number_ resnum chain resname atname typenum typenam covrad vdwrad surface volume refvol packeff goodbad 1 1 L ALA N 12 N3H1s 0.700 1.640 5.809 39.326 14.046 2.800 possible 2 1 L ALA CA 4 C4H1b 0.770 1.880 4.876 24.227 14.063 1.723 possible 3 1 L ALA C 1 C3H0s 0.770 1.610 2.456 8.829 8.900 0.992 [OK] 4 1 L ALA O 16 O1H0u 0.660 1.420 2.870 18.873 16.188 1.166 [OK] 5 1 L ALA CB 10 C4H3u 0.770 1.880 5.894 78.662 36.782 2.139 possible 6 2 L LEU N 12 N3H1s 0.700 1.640 2.592 13.322 13.655 0.976 [OK] 7 2 L LEU CA 3 C4H1s 0.770 1.880 2.745 13.038 13.122 0.994 [OK] 8 2 L LEU C 1 C3H0s 0.770 1.610 2.520 9.274 8.825 1.051 [OK] 9 2 L LEU O 16 O1H0u 0.660 1.420 2.552 16.279 16.208 1.004 [OK] 10 2 L LEU CB 8 C4H2s 0.770 1.880 2.949 22.361 22.951 0.974 [OK] 11 2 L LEU CG 4 C4H1b 0.770 1.880 2.696 14.804 14.764 1.003 [OK] 12 2 L LEU CD1 10 C4H3u 0.770 1.880 3.292 35.197 37.425 0.940 possible 13 2 L LEU CD2 10 C4H3u 0.770 1.880 3.408 38.995 37.143 1.050 possible 14 3 L LEU N 12 N3H1s 0.700 1.640 2.543 13.740 13.655 1.006 [OK] 15 3 L LEU CA 3 C4H1s 0.770 1.880 2.675 13.019 13.122 0.992 [OK] 16 3 L LEU C 1 C3H0s 0.770 1.610 2.597 9.182 8.825 1.040 [OK] 17 3 L LEU O 16 O1H0u 0.660 1.420 2.453 14.495 16.208 0.894 [OK] 18 3 L LEU CB 8 C4H2s 0.770 1.880 2.939 23.104 22.951 1.007 [OK] 19 3 L LEU CG 4 C4H1b 0.770 1.880 2.699 13.980 14.764 0.947 [OK] 20 3 L LEU CD1 10 C4H3u 0.770 1.880 3.126 37.805 37.425 1.010 possible 21 3 L LEU CD2 10 C4H3u 0.770 1.880 3.031 33.251 37.143 0.895 possible 22 4 L SER N 12 N3H1s 0.700 1.640 2.686 15.357 14.103 1.089 [OK] 23 4 L SER CA 3 C4H1s 0.770 1.880 2.818 15.116 13.476 1.122 [OK] 24 4 L SER C 1 C3H0s 0.770 1.610 2.450 8.762 8.923 0.982 [OK] 25 4 L SER O 16 O1H0u 0.660 1.420 2.488 18.962 16.179 1.172 [OK] 26 4 L SER CB 8 C4H2s 0.770 1.880 2.957 22.900 23.884 0.959 [OK] 27 4 L SER OG 17 O2H1u 0.660 1.460 3.420 27.947 18.732 1.492 possible 28 5 L PHE N 12 N3H1s 0.700 1.640 2.497 13.641 13.691 0.996 [OK] 29 5 L PHE CA 3 C4H1s 0.770 1.880 2.821 14.662 13.449 1.090 [OK] 30 5 L PHE C 1 C3H0s 0.770 1.610 2.438 8.964 8.753 1.024 [OK] 31 5 L PHE O 16 O1H0u 0.660 1.420 2.339 16.592 16.151 1.027 [OK] 32 5 L PHE CB 8 C4H2s 0.770 1.880 2.652 22.519 23.777 0.947 [OK] 33 5 L PHE CG 2 C3H0b 0.770 1.610 2.347 9.341 9.721 0.961 [OK] 34 5 L PHE CD1 5 C3H1s 0.770 1.760 2.778 21.062 20.405 1.032 [OK] 35 5 L PHE CD2 6 C3H1b 0.770 1.760 2.839 21.455 21.051 1.019 [OK] 36 5 L PHE CE1 6 C3H1b 0.770 1.760 2.804 21.332 21.580 0.989 [OK] 37 5 L PHE CE2 6 C3H1b 0.770 1.760 2.965 21.871 21.680 1.009 [OK] 38 5 L PHE CZ 6 C3H1b 0.770 1.760 3.061 23.196 21.666 1.071 possible 39 6 L GLU N 12 N3H1s 0.700 1.640 2.555 13.686 13.615 1.005 [OK] 40 6 L GLU CA 3 C4H1s 0.770 1.880 2.838 13.578 13.399 1.013 [OK] 41 6 L GLU C 1 C3H0s 0.770 1.610 2.440 8.823 8.675 1.017 [OK] 42 6 L GLU O 16 O1H0u 0.660 1.420 2.375 15.428 16.023 0.963 [OK] 43 6 L GLU CB 8 C4H2s 0.770 1.880 2.962 21.319 23.529 0.906 [OK] 44 6 L GLU CG 8 C4H2s 0.770 1.880 2.826 21.614 23.513 0.919 [OK] 45 6 L GLU CD 2 C3H0b 0.770 1.610 2.315 8.602 9.460 0.909 [OK] 46 6 L GLU OE1 16 O1H0u 0.660 1.420 2.316 15.295 15.999 0.956 [OK] 47 6 L GLU OE2 16 O1H0u 0.660 1.420 2.349 14.810 17.432 0.850 [OK] 48 7 L ARG N 12 N3H1s 0.700 1.640 2.466 13.453 13.650 0.986 [OK] 49 7 L ARG CA 3 C4H1s 0.770 1.880 3.272 14.208 13.422 1.059 possible 50 7 L ARG C 1 C3H0s 0.770 1.610 2.581 8.221 8.838 0.930 [OK] 51 7 L ARG O 16 O1H0u 0.660 1.420 2.799 18.405 16.084 1.144 [OK] 52 7 L ARG CB 8 C4H2s 0.770 1.880 3.006 22.432 23.088 0.972 possible 53 7 L ARG CG 8 C4H2s 0.770 1.880 3.382 30.655 23.640 1.297 possible 54 7 L ARG CD 8 C4H2s 0.770 1.880 6.415 50.371 23.300 2.162 possible 55 7 L ARG NE 13 N3H1b 0.700 1.640 5.870 26.266 15.569 1.687 possible 56 7 L ARG CZ 2 C3H0b 0.770 1.610 6.917 21.351 9.747 2.191 possible 57 7 L ARG NH1 15 N3H2u 0.700 1.640 6.238 36.843 22.782 1.617 possible 58 7 L ARG NH2 15 N3H2u 0.700 1.640 19.792 -1.000 23.810 -1.000 bad 59 8 L LYS N 12 N3H1s 0.700 1.640 2.593 13.671 13.675 1.000 [OK] 60 8 L LYS CA 3 C4H1s 0.770 1.880 2.631 12.743 13.324 0.956 [OK] 61 8 L LYS C 1 C3H0s 0.770 1.610 2.549 8.803 8.759 1.005 [OK] 62 8 L LYS O 16 O1H0u 0.660 1.420 2.379 16.122 16.049 1.005 [OK] 63 8 L LYS CB 8 C4H2s 0.770 1.880 2.909 22.310 22.904 0.974 [OK] 64 8 L LYS CG 8 C4H2s 0.770 1.880 2.769 21.998 23.131 0.951 [OK] 65 8 L LYS CD 8 C4H2s 0.770 1.880 3.117 24.933 23.837 1.046 possible 66 8 L LYS CE 9 C4H2b 0.770 1.880 3.134 25.512 23.934 1.066 possible 67 8 L LYS NZ 14 N4H3u 0.700 1.640 2.924 22.139 21.213 1.044 [OK] 68 9 L TYR N 12 N3H1s 0.700 1.640 2.515 12.232 13.691 0.893 [OK] 69 9 L TYR CA 3 C4H1s 0.770 1.880 2.797 12.848 13.330 0.964 [OK] 70 9 L TYR C 1 C3H0s 0.770 1.610 2.333 9.152 8.770 1.044 [OK] 71 9 L TYR O 16 O1H0u 0.660 1.420 2.399 16.083 16.124 0.997 [OK] 72 9 L TYR CB 8 C4H2s 0.770 1.880 2.826 22.308 23.678 0.942 [OK] 73 9 L TYR CG 2 C3H0b 0.770 1.610 2.668 9.955 9.732 1.023 [OK] 74 9 L TYR CD1 5 C3H1s 0.770 1.760 3.104 22.327 20.171 1.107 possible 75 9 L TYR CD2 5 C3H1s 0.770 1.760 2.776 17.934 20.728 0.865 [OK] 76 9 L TYR CE1 5 C3H1s 0.770 1.760 2.881 19.822 20.675 0.959 [OK] 77 9 L TYR CE2 5 C3H1s 0.770 1.760 2.843 19.931 20.810 0.958 [OK] 78 9 L TYR CZ 2 C3H0b 0.770 1.610 2.745 10.633 9.926 1.071 [OK] 79 9 L TYR OH 17 O2H1u 0.660 1.460 2.596 18.184 19.173 0.948 [OK] 80 10 L ARG N 12 N3H1s 0.700 1.640 2.640 14.678 13.650 1.075 [OK] 81 10 L ARG CA 3 C4H1s 0.770 1.880 2.661 13.895 13.422 1.035 [OK] 82 10 L ARG C 1 C3H0s 0.770 1.610 2.491 9.854 8.838 1.115 [OK] 83 10 L ARG O 16 O1H0u 0.660 1.420 2.600 17.529 16.084 1.090 [OK] 84 10 L ARG CB 8 C4H2s 0.770 1.880 3.312 26.995 23.088 1.169 possible 85 10 L ARG CG 8 C4H2s 0.770 1.880 3.393 26.231 23.640 1.110 possible 86 10 L ARG CD 8 C4H2s 0.770 1.880 2.559 20.849 23.300 0.895 [OK] 87 10 L ARG NE 13 N3H1b 0.700 1.640 3.001 16.632 15.569 1.068 possible 88 10 L ARG CZ 2 C3H0b 0.770 1.610 2.377 8.708 9.747 0.893 [OK] 89 10 L ARG NH1 15 N3H2u 0.700 1.640 2.622 24.171 22.782 1.061 [OK] 90 10 L ARG NH2 15 N3H2u 0.700 1.640 3.073 24.697 23.810 1.037 possible 91 11 L VAL N 12 N3H1s 0.700 1.640 2.377 12.446 13.676 0.910 [OK] 92 11 L VAL CA 3 C4H1s 0.770 1.880 2.538 12.020 13.123 0.916 [OK] 93 11 L VAL C 1 C3H0s 0.770 1.610 2.330 8.612 8.563 1.006 [OK] 94 11 L VAL O 16 O1H0u 0.660 1.420 2.583 17.737 16.181 1.096 [OK] 95 11 L VAL CB 4 C4H1b 0.770 1.880 2.740 14.223 14.598 0.974 [OK] 96 11 L VAL CG1 10 C4H3u 0.770 1.880 3.032 34.167 36.584 0.934 possible 97 11 L VAL CG2 10 C4H3u 0.770 1.880 3.019 35.841 36.332 0.986 possible 98 12 L PRO N 11 N3H0u 0.700 1.640 2.240 7.767 8.823 0.880 [OK] 99 12 L PRO CA 4 C4H1b 0.770 1.880 2.874 14.566 13.955 1.044 [OK] 100 12 L PRO C 1 C3H0s 0.770 1.610 3.660 10.048 8.812 1.140 possible 101 12 L PRO O 16 O1H0u 0.660 1.420 7.391 30.313 16.169 1.875 possible 102 12 L PRO CB 9 C4H2b 0.770 1.880 24.189 -1.000 25.563 -1.000 bad 103 12 L PRO CG 9 C4H2b 0.770 1.880 7.203 61.771 25.832 2.391 possible 104 12 L PRO CD 8 C4H2s 0.770 1.880 3.098 23.130 23.836 0.970 possible 105 13 L GLY N 12 N3H1s 0.700 1.640 4.490 20.445 14.854 1.376 possible 106 13 L GLY CA 8 C4H2s 0.770 1.880 21.685 -1.000 23.688 -1.000 bad 107 13 L GLY C 2 C3H0b 0.770 1.610 2.549 10.029 9.840 1.019 [OK] 108 13 L GLY O 16 O1H0u 0.660 1.420 3.013 19.871 16.391 1.212 possible 109 14 L GLY N 12 N3H1s 0.700 1.640 6.246 37.098 14.854 2.497 possible 110 14 L GLY CA 8 C4H2s 0.770 1.880 3.317 26.879 23.688 1.135 possible 111 14 L GLY C 2 C3H0b 0.770 1.610 3.132 11.266 9.840 1.145 possible 112 14 L GLY O 16 O1H0u 0.660 1.420 2.467 14.901 16.391 0.909 [OK] 113 15 L THR N 12 N3H1s 0.700 1.640 3.020 15.439 13.832 1.116 possible 114 15 L THR CA 3 C4H1s 0.770 1.880 2.940 13.165 13.099 1.005 [OK] 115 15 L THR C 1 C3H0s 0.770 1.610 2.830 8.795 8.738 1.007 [OK] 116 15 L THR O 16 O1H0u 0.660 1.420 7.564 64.503 16.020 4.026 possible 117 15 L THR CB 4 C4H1b 0.770 1.880 3.125 15.635 14.829 1.054 possible 118 15 L THR OG1 17 O2H1u 0.660 1.460 5.725 36.442 18.123 2.011 possible 119 15 L THR CG2 10 C4H3u 0.770 1.880 3.057 33.371 36.542 0.913 possible 120 16 L LEU N 12 N3H1s 0.700 1.640 2.397 13.261 13.655 0.971 [OK] 121 16 L LEU CA 3 C4H1s 0.770 1.880 3.819 15.051 13.122 1.147 possible 122 16 L LEU C 1 C3H0s 0.770 1.610 3.132 9.699 8.825 1.099 possible 123 16 L LEU O 16 O1H0u 0.660 1.420 28.666 -1.000 16.208 -1.000 bad 124 16 L LEU CB 8 C4H2s 0.770 1.880 4.870 27.304 22.951 1.190 possible 125 16 L LEU CG 4 C4H1b 0.770 1.880 2.787 14.717 14.764 0.997 [OK] 126 16 L LEU CD1 10 C4H3u 0.770 1.880 5.435 56.665 37.425 1.514 possible 127 16 L LEU CD2 10 C4H3u 0.770 1.880 38.205 -1.000 37.143 -1.000 bad 128 17 L VAL N 12 N3H1s 0.700 1.640 3.017 16.401 13.676 1.199 possible 129 17 L VAL CA 3 C4H1s 0.770 1.880 4.774 15.691 13.123 1.196 possible 130 17 L VAL C 1 C3H0s 0.770 1.610 3.044 9.496 8.563 1.109 possible 131 17 L VAL O 16 O1H0u 0.660 1.420 2.673 17.132 16.181 1.059 [OK] 132 17 L VAL CB 4 C4H1b 0.770 1.880 2.821 13.177 14.598 0.903 [OK] 133 17 L VAL CG1 10 C4H3u 0.770 1.880 28.273 -1.000 36.584 -1.000 bad 134 17 L VAL CG2 10 C4H3u 0.770 1.880 26.825 -1.000 36.332 -1.000 bad 135 18 L GLY N 12 N3H1s 0.700 1.640 8.697 -1.000 14.854 -1.000 bad 136 18 L GLY CA 8 C4H2s 0.770 1.880 22.670 -1.000 23.688 -1.000 bad 137 18 L GLY C 2 C3H0b 0.770 1.610 1.461 -1.000 9.840 -1.000 bad 138 18 L GLY O 16 O1H0u 0.660 1.420 5.773 22.498 16.391 1.373 possible 139 19 L GLY N 12 N3H1s 0.700 1.640 10.400 -1.000 14.854 -1.000 bad 140 19 L GLY CA 8 C4H2s 0.770 1.880 39.523 -1.000 23.688 -1.000 bad 141 19 L GLY C 2 C3H0b 0.770 1.610 4.766 12.806 9.840 1.301 possible 142 19 L GLY O 16 O1H0u 0.660 1.420 2.848 16.097 16.391 0.982 [OK] 143 20 L ASN N 12 N3H1s 0.700 1.640 6.653 27.764 13.695 2.027 possible 144 20 L ASN CA 3 C4H1s 0.770 1.880 3.646 14.076 13.167 1.069 possible 145 20 L ASN C 1 C3H0s 0.770 1.610 2.924 9.515 8.928 1.066 [OK] 146 20 L ASN O 16 O1H0u 0.660 1.420 4.530 31.822 16.199 1.964 possible 147 20 L ASN CB 8 C4H2s 0.770 1.880 22.352 -1.000 23.128 -1.000 bad 148 20 L ASN CG 2 C3H0b 0.770 1.610 2.093 -1.000 9.599 -1.000 bad 149 20 L ASN OD1 16 O1H0u 0.660 1.420 24.620 -1.000 16.664 -1.000 bad 150 20 L ASN ND2 15 N3H2u 0.700 1.640 58.799 -1.000 23.083 -1.000 bad 151 21 L LEU N 12 N3H1s 0.700 1.640 2.964 15.284 13.655 1.119 [OK] 152 21 L LEU CA 3 C4H1s 0.770 1.880 4.802 17.527 13.122 1.336 possible 153 21 L LEU C 1 C3H0s 0.770 1.610 2.586 8.292 8.825 0.940 [OK] 154 21 L LEU O 16 O1H0u 0.660 1.420 15.434 -1.000 16.208 -1.000 bad 155 21 L LEU CB 8 C4H2s 0.770 1.880 4.070 24.647 22.951 1.074 possible 156 21 L LEU CG 4 C4H1b 0.770 1.880 7.783 29.725 14.764 2.013 possible 157 21 L LEU CD1 10 C4H3u 0.770 1.880 45.078 -1.000 37.425 -1.000 bad 158 21 L LEU CD2 10 C4H3u 0.770 1.880 57.847 -1.000 37.143 -1.000 bad 159 22 L PHE N 12 N3H1s 0.700 1.640 2.358 12.046 13.691 0.880 [OK] 160 22 L PHE CA 3 C4H1s 0.770 1.880 2.802 13.093 13.449 0.973 [OK] 161 22 L PHE C 1 C3H0s 0.770 1.610 2.649 9.698 8.753 1.108 [OK] 162 22 L PHE O 16 O1H0u 0.660 1.420 2.383 16.271 16.151 1.007 [OK] 163 22 L PHE CB 8 C4H2s 0.770 1.880 2.882 21.108 23.777 0.888 [OK] 164 22 L PHE CG 2 C3H0b 0.770 1.610 2.538 9.906 9.721 1.019 [OK] 165 22 L PHE CD1 5 C3H1s 0.770 1.760 4.070 29.924 20.405 1.467 possible 166 22 L PHE CD2 6 C3H1b 0.770 1.760 2.960 20.766 21.051 0.986 [OK] 167 22 L PHE CE1 6 C3H1b 0.770 1.760 23.133 -1.000 21.580 -1.000 bad 168 22 L PHE CE2 6 C3H1b 0.770 1.760 5.882 36.520 21.680 1.685 possible 169 22 L PHE CZ 6 C3H1b 0.770 1.760 24.550 -1.000 21.666 -1.000 bad 170 23 L ASP N 12 N3H1s 0.700 1.640 2.881 15.240 13.895 1.097 [OK] 171 23 L ASP CA 3 C4H1s 0.770 1.880 2.737 13.617 13.377 1.018 [OK] 172 23 L ASP C 1 C3H0s 0.770 1.610 2.740 9.606 8.816 1.090 [OK] 173 23 L ASP O 16 O1H0u 0.660 1.420 3.669 22.880 16.091 1.422 possible 174 23 L ASP CB 8 C4H2s 0.770 1.880 3.550 23.416 23.481 0.997 possible 175 23 L ASP CG 2 C3H0b 0.770 1.610 3.000 9.674 9.422 1.027 possible 176 23 L ASP OD1 16 O1H0u 0.660 1.420 2.610 19.200 15.505 1.238 [OK] 177 23 L ASP OD2 16 O1H0u 0.660 1.420 3.541 25.449 16.324 1.559 possible 178 24 L PHE N 12 N3H1s 0.700 1.640 2.749 14.315 13.691 1.046 [OK] 179 24 L PHE CA 3 C4H1s 0.770 1.880 2.857 13.947 13.449 1.037 [OK] 180 24 L PHE C 1 C3H0s 0.770 1.610 2.587 9.126 8.753 1.043 [OK] 181 24 L PHE O 16 O1H0u 0.660 1.420 2.342 15.544 16.151 0.962 [OK] 182 24 L PHE CB 8 C4H2s 0.770 1.880 3.430 23.407 23.777 0.984 possible 183 24 L PHE CG 2 C3H0b 0.770 1.610 2.886 10.562 9.721 1.087 [OK] 184 24 L PHE CD1 5 C3H1s 0.770 1.760 4.581 29.090 20.405 1.426 possible 185 24 L PHE CD2 6 C3H1b 0.770 1.760 3.810 26.547 21.051 1.261 possible 186 24 L PHE CE1 6 C3H1b 0.770 1.760 14.095 -1.000 21.580 -1.000 bad 187 24 L PHE CE2 6 C3H1b 0.770 1.760 10.462 -1.000 21.680 -1.000 bad 188 24 L PHE CZ 6 C3H1b 0.770 1.760 22.338 -1.000 21.666 -1.000 bad 189 25 L TRP N 12 N3H1s 0.700 1.640 2.430 12.466 13.791 0.904 [OK] 190 25 L TRP CA 3 C4H1s 0.770 1.880 2.553 12.580 13.377 0.940 [OK] 191 25 L TRP C 1 C3H0s 0.770 1.610 2.632 9.403 8.724 1.078 [OK] 192 25 L TRP O 16 O1H0u 0.660 1.420 4.393 34.315 15.951 2.151 possible 193 25 L TRP CB 8 C4H2s 0.770 1.880 3.108 22.699 24.004 0.946 possible 194 25 L TRP CG 2 C3H0b 0.770 1.610 2.385 9.285 9.965 0.932 [OK] 195 25 L TRP CD1 5 C3H1s 0.770 1.760 2.718 20.115 20.874 0.964 [OK] 196 25 L TRP CD2 2 C3H0b 0.770 1.610 2.529 9.684 10.097 0.959 [OK] 197 25 L TRP NE1 13 N3H1b 0.700 1.640 2.670 16.196 16.969 0.954 [OK] 198 25 L TRP CE2 2 C3H0b 0.770 1.610 2.501 9.109 9.889 0.921 [OK] 199 25 L TRP CE3 6 C3H1b 0.770 1.760 2.736 19.373 20.448 0.947 [OK] 200 25 L TRP CZ2 6 C3H1b 0.770 1.760 2.932 19.742 21.012 0.940 [OK] 201 25 L TRP CZ3 6 C3H1b 0.770 1.760 2.922 22.067 21.516 1.026 [OK] 202 25 L TRP CH2 6 C3H1b 0.770 1.760 2.636 18.805 21.339 0.881 [OK] 203 26 L VAL N 12 N3H1s 0.700 1.640 2.808 14.220 13.676 1.040 [OK] 204 26 L VAL CA 3 C4H1s 0.770 1.880 5.205 17.393 13.123 1.325 possible 205 26 L VAL C 1 C3H0s 0.770 1.610 2.892 8.104 8.563 0.946 [OK] 206 26 L VAL O 16 O1H0u 0.660 1.420 4.234 20.477 16.181 1.265 possible 207 26 L VAL CB 4 C4H1b 0.770 1.880 7.036 25.576 14.598 1.752 possible 208 26 L VAL CG1 10 C4H3u 0.770 1.880 56.007 -1.000 36.584 -1.000 bad 209 26 L VAL CG2 10 C4H3u 0.770 1.880 33.885 -1.000 36.332 -1.000 bad 210 27 L GLY N 12 N3H1s 0.700 1.640 9.137 -1.000 14.854 -1.000 bad 211 27 L GLY CA 8 C4H2s 0.770 1.880 7.698 85.914 23.688 3.627 possible 212 27 L GLY C 2 C3H0b 0.770 1.610 2.596 9.399 9.840 0.955 [OK] 213 27 L GLY O 16 O1H0u 0.660 1.420 2.751 21.151 16.391 1.290 [OK] 214 28 L PRO N 11 N3H0u 0.700 1.640 2.753 8.852 8.823 1.003 [OK] 215 28 L PRO CA 4 C4H1b 0.770 1.880 2.715 12.754 13.955 0.914 [OK] 216 28 L PRO C 1 C3H0s 0.770 1.610 2.474 9.650 8.812 1.095 [OK] 217 28 L PRO O 16 O1H0u 0.660 1.420 2.399 17.926 16.169 1.109 [OK] 218 28 L PRO CB 9 C4H2b 0.770 1.880 3.017 25.259 25.563 0.988 possible 219 28 L PRO CG 9 C4H2b 0.770 1.880 6.247 47.349 25.832 1.833 possible 220 28 L PRO CD 8 C4H2s 0.770 1.880 6.293 72.123 23.836 3.026 possible 221 29 L PHE N 12 N3H1s 0.700 1.640 2.571 13.275 13.691 0.970 [OK] 222 29 L PHE CA 3 C4H1s 0.770 1.880 2.891 14.299 13.449 1.063 [OK] 223 29 L PHE C 1 C3H0s 0.770 1.610 2.666 8.514 8.753 0.973 [OK] 224 29 L PHE O 16 O1H0u 0.660 1.420 2.614 15.758 16.151 0.976 [OK] 225 29 L PHE CB 8 C4H2s 0.770 1.880 5.147 39.997 23.777 1.682 possible 226 29 L PHE CG 2 C3H0b 0.770 1.610 4.449 14.754 9.721 1.518 possible 227 29 L PHE CD1 5 C3H1s 0.770 1.760 4.923 31.556 20.405 1.546 possible 228 29 L PHE CD2 6 C3H1b 0.770 1.760 4.012 28.282 21.051 1.344 possible 229 29 L PHE CE1 6 C3H1b 0.770 1.760 23.202 -1.000 21.580 -1.000 bad 230 29 L PHE CE2 6 C3H1b 0.770 1.760 3.327 22.343 21.680 1.031 possible 231 29 L PHE CZ 6 C3H1b 0.770 1.760 7.143 50.610 21.666 2.336 possible 232 30 L TYR N 12 N3H1s 0.700 1.640 2.468 13.392 13.691 0.978 [OK] 233 30 L TYR CA 3 C4H1s 0.770 1.880 2.621 12.543 13.330 0.941 [OK] 234 30 L TYR C 1 C3H0s 0.770 1.610 2.660 8.789 8.770 1.002 [OK] 235 30 L TYR O 16 O1H0u 0.660 1.420 4.296 22.145 16.124 1.373 possible 236 30 L TYR CB 8 C4H2s 0.770 1.880 2.867 23.750 23.678 1.003 [OK] 237 30 L TYR CG 2 C3H0b 0.770 1.610 3.179 10.885 9.732 1.119 possible 238 30 L TYR CD1 5 C3H1s 0.770 1.760 3.319 22.012 20.171 1.091 possible 239 30 L TYR CD2 5 C3H1s 0.770 1.760 3.275 21.622 20.728 1.043 possible 240 30 L TYR CE1 5 C3H1s 0.770 1.760 3.250 21.056 20.675 1.018 possible 241 30 L TYR CE2 5 C3H1s 0.770 1.760 3.266 22.324 20.810 1.073 possible 242 30 L TYR CZ 2 C3H0b 0.770 1.610 3.121 11.802 9.926 1.189 possible 243 30 L TYR OH 17 O2H1u 0.660 1.460 2.953 23.201 19.173 1.210 [OK] 244 31 L VAL N 12 N3H1s 0.700 1.640 2.439 12.785 13.676 0.935 [OK] 245 31 L VAL CA 3 C4H1s 0.770 1.880 4.048 15.057 13.123 1.147 possible 246 31 L VAL C 1 C3H0s 0.770 1.610 2.239 8.404 8.563 0.981 [OK] 247 31 L VAL O 16 O1H0u 0.660 1.420 2.691 18.156 16.181 1.122 [OK] 248 31 L VAL CB 4 C4H1b 0.770 1.880 2.742 13.833 14.598 0.948 [OK] 249 31 L VAL CG1 10 C4H3u 0.770 1.880 4.998 53.355 36.584 1.458 possible 250 31 L VAL CG2 10 C4H3u 0.770 1.880 5.919 57.409 36.332 1.580 possible 251 32 L GLY N 12 N3H1s 0.700 1.640 2.554 13.874 14.854 0.934 [OK] 252 32 L GLY CA 8 C4H2s 0.770 1.880 2.862 22.447 23.688 0.948 [OK] 253 32 L GLY C 2 C3H0b 0.770 1.610 2.762 9.104 9.840 0.925 [OK] 254 32 L GLY O 16 O1H0u 0.660 1.420 2.342 14.917 16.391 0.910 [OK] 255 33 L PHE N 12 N3H1s 0.700 1.640 2.512 13.461 13.691 0.983 [OK] 256 33 L PHE CA 3 C4H1s 0.770 1.880 2.687 13.724 13.449 1.020 [OK] 257 33 L PHE C 1 C3H0s 0.770 1.610 2.201 7.699 8.753 0.880 [OK] 258 33 L PHE O 16 O1H0u 0.660 1.420 2.728 14.887 16.151 0.922 [OK] 259 33 L PHE CB 8 C4H2s 0.770 1.880 3.101 23.612 23.777 0.993 possible 260 33 L PHE CG 2 C3H0b 0.770 1.610 2.435 8.676 9.721 0.892 [OK] 261 33 L PHE CD1 5 C3H1s 0.770 1.760 3.982 23.900 20.405 1.171 possible 262 33 L PHE CD2 6 C3H1b 0.770 1.760 2.569 17.378 21.051 0.826 [OK] 263 33 L PHE CE1 6 C3H1b 0.770 1.760 26.594 -1.000 21.580 -1.000 bad 264 33 L PHE CE2 6 C3H1b 0.770 1.760 12.029 -1.000 21.680 -1.000 bad 265 33 L PHE CZ 6 C3H1b 0.770 1.760 29.264 -1.000 21.666 -1.000 bad 266 34 L PHE N 12 N3H1s 0.700 1.640 2.989 14.592 13.691 1.066 [OK] 267 34 L PHE CA 3 C4H1s 0.770 1.880 2.695 12.313 13.449 0.916 [OK] 268 34 L PHE C 1 C3H0s 0.770 1.610 2.303 8.967 8.753 1.024 [OK] 269 34 L PHE O 16 O1H0u 0.660 1.420 2.411 16.245 16.151 1.006 [OK] 270 34 L PHE CB 8 C4H2s 0.770 1.880 3.243 23.481 23.777 0.988 possible 271 34 L PHE CG 2 C3H0b 0.770 1.610 2.341 8.834 9.721 0.909 [OK] 272 34 L PHE CD1 5 C3H1s 0.770 1.760 3.270 22.857 20.405 1.120 possible 273 34 L PHE CD2 6 C3H1b 0.770 1.760 2.704 21.325 21.051 1.013 [OK] 274 34 L PHE CE1 6 C3H1b 0.770 1.760 12.935 -1.000 21.580 -1.000 bad 275 34 L PHE CE2 6 C3H1b 0.770 1.760 3.172 21.670 21.680 1.000 possible 276 34 L PHE CZ 6 C3H1b 0.770 1.760 10.110 -1.000 21.666 -1.000 bad 277 35 L GLY N 12 N3H1s 0.700 1.640 2.964 14.277 14.854 0.961 [OK] 278 35 L GLY CA 8 C4H2s 0.770 1.880 4.384 29.978 23.688 1.266 possible 279 35 L GLY C 2 C3H0b 0.770 1.610 3.571 11.553 9.840 1.174 possible 280 35 L GLY O 16 O1H0u 0.660 1.420 4.250 33.054 16.391 2.017 possible 281 36 L VAL N 12 N3H1s 0.700 1.640 3.277 13.934 13.676 1.019 possible 282 36 L VAL CA 3 C4H1s 0.770 1.880 4.084 17.151 13.123 1.307 possible 283 36 L VAL C 1 C3H0s 0.770 1.610 3.399 8.886 8.563 1.038 possible 284 36 L VAL O 16 O1H0u 0.660 1.420 4.582 24.537 16.181 1.516 possible 285 36 L VAL CB 4 C4H1b 0.770 1.880 12.823 -1.000 14.598 -1.000 bad 286 36 L VAL CG1 10 C4H3u 0.770 1.880 25.501 -1.000 36.584 -1.000 bad 287 36 L VAL CG2 10 C4H3u 0.770 1.880 13.503 -1.000 36.332 -1.000 bad 288 37 L ALA N 12 N3H1s 0.700 1.640 3.529 14.493 14.046 1.032 possible 289 37 L ALA CA 4 C4H1b 0.770 1.880 5.044 26.539 14.063 1.887 possible 290 37 L ALA C 1 C3H0s 0.770 1.610 2.433 8.646 8.900 0.971 [OK] 291 37 L ALA O 16 O1H0u 0.660 1.420 2.961 15.573 16.188 0.962 [OK] 292 37 L ALA CB 10 C4H3u 0.770 1.880 4.972 53.348 36.782 1.450 possible 293 38 L THR N 12 N3H1s 0.700 1.640 2.490 12.990 13.832 0.939 [OK] 294 38 L THR CA 3 C4H1s 0.770 1.880 2.818 14.319 13.099 1.093 [OK] 295 38 L THR C 1 C3H0s 0.770 1.610 3.024 8.332 8.738 0.954 possible 296 38 L THR O 16 O1H0u 0.660 1.420 3.080 15.880 16.020 0.991 possible 297 38 L THR CB 4 C4H1b 0.770 1.880 4.015 19.110 14.829 1.289 possible 298 38 L THR OG1 17 O2H1u 0.660 1.460 2.602 18.700 18.123 1.032 [OK] 299 38 L THR CG2 10 C4H3u 0.770 1.880 3.989 43.513 36.542 1.191 possible 300 39 L PHE N 12 N3H1s 0.700 1.640 3.658 16.615 13.691 1.214 possible 301 39 L PHE CA 3 C4H1s 0.770 1.880 3.892 20.007 13.449 1.488 possible 302 39 L PHE C 1 C3H0s 0.770 1.610 2.454 8.133 8.753 0.929 [OK] 303 39 L PHE O 16 O1H0u 0.660 1.420 3.458 17.910 16.151 1.109 possible 304 39 L PHE CB 8 C4H2s 0.770 1.880 4.379 35.164 23.777 1.479 possible 305 39 L PHE CG 2 C3H0b 0.770 1.610 5.213 15.796 9.721 1.625 possible 306 39 L PHE CD1 5 C3H1s 0.770 1.760 16.874 -1.000 20.405 -1.000 bad 307 39 L PHE CD2 6 C3H1b 0.770 1.760 6.566 72.578 21.051 3.448 possible 308 39 L PHE CE1 6 C3H1b 0.770 1.760 27.496 -1.000 21.580 -1.000 bad 309 39 L PHE CE2 6 C3H1b 0.770 1.760 34.839 -1.000 21.680 -1.000 bad 310 39 L PHE CZ 6 C3H1b 0.770 1.760 35.875 -1.000 21.666 -1.000 bad 311 40 L PHE N 12 N3H1s 0.700 1.640 3.835 15.574 13.691 1.138 possible 312 40 L PHE CA 3 C4H1s 0.770 1.880 4.108 19.202 13.449 1.428 possible 313 40 L PHE C 1 C3H0s 0.770 1.610 2.272 7.881 8.753 0.900 [OK] 314 40 L PHE O 16 O1H0u 0.660 1.420 3.044 17.171 16.151 1.063 possible 315 40 L PHE CB 8 C4H2s 0.770 1.880 5.604 49.959 23.777 2.101 possible 316 40 L PHE CG 2 C3H0b 0.770 1.610 7.743 20.803 9.721 2.140 possible 317 40 L PHE CD1 5 C3H1s 0.770 1.760 23.873 -1.000 20.405 -1.000 bad 318 40 L PHE CD2 6 C3H1b 0.770 1.760 9.328 -1.000 21.051 -1.000 bad 319 40 L PHE CE1 6 C3H1b 0.770 1.760 31.352 -1.000 21.580 -1.000 bad 320 40 L PHE CE2 6 C3H1b 0.770 1.760 18.767 -1.000 21.680 -1.000 bad 321 40 L PHE CZ 6 C3H1b 0.770 1.760 23.059 -1.000 21.666 -1.000 bad 322 41 L PHE N 12 N3H1s 0.700 1.640 2.595 13.433 13.691 0.981 [OK] 323 41 L PHE CA 3 C4H1s 0.770 1.880 3.041 15.395 13.449 1.145 possible 324 41 L PHE C 1 C3H0s 0.770 1.610 2.477 8.651 8.753 0.988 [OK] 325 41 L PHE O 16 O1H0u 0.660 1.420 2.452 16.312 16.151 1.010 [OK] 326 41 L PHE CB 8 C4H2s 0.770 1.880 2.682 20.652 23.777 0.869 [OK] 327 41 L PHE CG 2 C3H0b 0.770 1.610 2.525 9.896 9.721 1.018 [OK] 328 41 L PHE CD1 5 C3H1s 0.770 1.760 3.330 24.978 20.405 1.224 possible 329 41 L PHE CD2 6 C3H1b 0.770 1.760 3.073 19.877 21.051 0.944 possible 330 41 L PHE CE1 6 C3H1b 0.770 1.760 16.559 -1.000 21.580 -1.000 bad 331 41 L PHE CE2 6 C3H1b 0.770 1.760 5.537 49.221 21.680 2.270 possible 332 41 L PHE CZ 6 C3H1b 0.770 1.760 30.575 -1.000 21.666 -1.000 bad 333 42 L ALA N 12 N3H1s 0.700 1.640 2.437 13.226 14.046 0.942 [OK] 334 42 L ALA CA 4 C4H1b 0.770 1.880 2.681 13.024 14.063 0.926 [OK] 335 42 L ALA C 1 C3H0s 0.770 1.610 2.829 8.651 8.900 0.972 [OK] 336 42 L ALA O 16 O1H0u 0.660 1.420 2.317 14.422 16.188 0.891 [OK] 337 42 L ALA CB 10 C4H3u 0.770 1.880 4.940 52.626 36.782 1.431 possible 338 43 L ALA N 12 N3H1s 0.700 1.640 4.184 15.900 14.046 1.132 possible 339 43 L ALA CA 4 C4H1b 0.770 1.880 4.915 24.751 14.063 1.760 possible 340 43 L ALA C 1 C3H0s 0.770 1.610 2.430 8.357 8.900 0.939 [OK] 341 43 L ALA O 16 O1H0u 0.660 1.420 3.481 15.307 16.188 0.946 possible 342 43 L ALA CB 10 C4H3u 0.770 1.880 6.742 101.679 36.782 2.764 possible 343 44 L LEU N 12 N3H1s 0.700 1.640 3.764 16.611 13.655 1.217 possible 344 44 L LEU CA 3 C4H1s 0.770 1.880 3.759 14.810 13.122 1.129 possible 345 44 L LEU C 1 C3H0s 0.770 1.610 2.336 8.076 8.825 0.915 [OK] 346 44 L LEU O 16 O1H0u 0.660 1.420 2.639 14.565 16.208 0.899 [OK] 347 44 L LEU CB 8 C4H2s 0.770 1.880 3.905 26.975 22.951 1.175 possible 348 44 L LEU CG 4 C4H1b 0.770 1.880 2.967 13.893 14.764 0.941 [OK] 349 44 L LEU CD1 10 C4H3u 0.770 1.880 36.427 -1.000 37.425 -1.000 bad 350 44 L LEU CD2 10 C4H3u 0.770 1.880 22.713 -1.000 37.143 -1.000 bad 351 45 L GLY N 12 N3H1s 0.700 1.640 2.396 13.876 14.854 0.934 [OK] 352 45 L GLY CA 8 C4H2s 0.770 1.880 2.882 24.192 23.688 1.021 [OK] 353 45 L GLY C 2 C3H0b 0.770 1.610 2.489 9.690 9.840 0.985 [OK] 354 45 L GLY O 16 O1H0u 0.660 1.420 2.286 14.725 16.391 0.898 [OK] 355 46 L ILE N 12 N3H1s 0.700 1.640 2.581 12.908 13.633 0.947 [OK] 356 46 L ILE CA 3 C4H1s 0.770 1.880 3.360 14.348 13.007 1.103 possible 357 46 L ILE C 1 C3H0s 0.770 1.610 2.767 8.135 8.470 0.960 [OK] 358 46 L ILE O 16 O1H0u 0.660 1.420 3.748 18.440 16.144 1.142 possible 359 46 L ILE CB 4 C4H1b 0.770 1.880 3.324 14.753 14.227 1.037 possible 360 46 L ILE CG1 9 C4H2b 0.770 1.880 3.237 24.381 24.187 1.008 possible 361 46 L ILE CG2 10 C4H3u 0.770 1.880 45.212 -1.000 35.961 -1.000 bad 362 46 L ILE CD1 10 C4H3u 0.770 1.880 28.168 -1.000 38.377 -1.000 bad 363 47 L ILE N 12 N3H1s 0.700 1.640 2.990 13.252 13.633 0.972 [OK] 364 47 L ILE CA 3 C4H1s 0.770 1.880 4.076 17.915 13.007 1.377 possible 365 47 L ILE C 1 C3H0s 0.770 1.610 2.837 7.955 8.470 0.939 [OK] 366 47 L ILE O 16 O1H0u 0.660 1.420 3.948 18.400 16.144 1.140 possible 367 47 L ILE CB 4 C4H1b 0.770 1.880 3.041 14.441 14.227 1.015 possible 368 47 L ILE CG1 9 C4H2b 0.770 1.880 19.546 -1.000 24.187 -1.000 bad 369 47 L ILE CG2 10 C4H3u 0.770 1.880 43.091 -1.000 35.961 -1.000 bad 370 47 L ILE CD1 10 C4H3u 0.770 1.880 42.488 -1.000 38.377 -1.000 bad 371 48 L LEU N 12 N3H1s 0.700 1.640 2.907 13.402 13.655 0.981 [OK] 372 48 L LEU CA 3 C4H1s 0.770 1.880 3.319 14.389 13.122 1.097 possible 373 48 L LEU C 1 C3H0s 0.770 1.610 2.155 8.360 8.825 0.947 [OK] 374 48 L LEU O 16 O1H0u 0.660 1.420 2.543 16.737 16.208 1.033 [OK] 375 48 L LEU CB 8 C4H2s 0.770 1.880 3.102 21.451 22.951 0.935 possible 376 48 L LEU CG 4 C4H1b 0.770 1.880 3.249 14.950 14.764 1.013 possible 377 48 L LEU CD1 10 C4H3u 0.770 1.880 3.787 37.264 37.425 0.996 possible 378 48 L LEU CD2 10 C4H3u 0.770 1.880 26.766 -1.000 37.143 -1.000 bad 379 49 L ILE N 12 N3H1s 0.700 1.640 2.213 11.987 13.633 0.879 [OK] 380 49 L ILE CA 3 C4H1s 0.770 1.880 2.640 13.382 13.007 1.029 [OK] 381 49 L ILE C 1 C3H0s 0.770 1.610 2.726 7.964 8.470 0.940 [OK] 382 49 L ILE O 16 O1H0u 0.660 1.420 2.806 16.236 16.144 1.006 [OK] 383 49 L ILE CB 4 C4H1b 0.770 1.880 3.367 14.344 14.227 1.008 possible 384 49 L ILE CG1 9 C4H2b 0.770 1.880 3.332 22.421 24.187 0.927 possible 385 49 L ILE CG2 10 C4H3u 0.770 1.880 5.203 78.541 35.961 2.184 possible 386 49 L ILE CD1 10 C4H3u 0.770 1.880 4.081 44.720 38.377 1.165 possible 387 50 L ALA N 12 N3H1s 0.700 1.640 3.853 14.384 14.046 1.024 possible 388 50 L ALA CA 4 C4H1b 0.770 1.880 4.514 19.170 14.063 1.363 possible 389 50 L ALA C 1 C3H0s 0.770 1.610 3.637 9.240 8.900 1.038 possible 390 50 L ALA O 16 O1H0u 0.660 1.420 2.989 14.501 16.188 0.896 [OK] 391 50 L ALA CB 10 C4H3u 0.770 1.880 30.473 -1.000 36.782 -1.000 bad 392 51 L TRP N 12 N3H1s 0.700 1.640 4.163 15.556 13.791 1.128 possible 393 51 L TRP CA 3 C4H1s 0.770 1.880 3.893 14.397 13.377 1.076 possible 394 51 L TRP C 1 C3H0s 0.770 1.610 2.436 8.642 8.724 0.991 [OK] 395 51 L TRP O 16 O1H0u 0.660 1.420 2.504 15.354 15.951 0.963 [OK] 396 51 L TRP CB 8 C4H2s 0.770 1.880 4.045 32.065 24.004 1.336 possible 397 51 L TRP CG 2 C3H0b 0.770 1.610 4.945 14.713 9.965 1.477 possible 398 51 L TRP CD1 5 C3H1s 0.770 1.760 19.674 -1.000 20.874 -1.000 bad 399 51 L TRP CD2 2 C3H0b 0.770 1.610 5.766 17.024 10.097 1.686 possible 400 51 L TRP NE1 13 N3H1b 0.700 1.640 20.355 -1.000 16.969 -1.000 bad 401 51 L TRP CE2 2 C3H0b 0.770 1.610 7.677 20.956 9.889 2.119 possible 402 51 L TRP CE3 6 C3H1b 0.770 1.760 5.783 26.932 20.448 1.317 possible 403 51 L TRP CZ2 6 C3H1b 0.770 1.760 26.710 -1.000 21.012 -1.000 bad 404 51 L TRP CZ3 6 C3H1b 0.770 1.760 6.164 29.514 21.516 1.372 possible 405 51 L TRP CH2 6 C3H1b 0.770 1.760 22.866 -1.000 21.339 -1.000 bad 406 52 L SER N 12 N3H1s 0.700 1.640 2.509 12.769 14.103 0.905 [OK] 407 52 L SER CA 3 C4H1s 0.770 1.880 3.122 14.182 13.476 1.052 possible 408 52 L SER C 1 C3H0s 0.770 1.610 2.565 8.654 8.923 0.970 [OK] 409 52 L SER O 16 O1H0u 0.660 1.420 3.296 16.466 16.179 1.018 possible 410 52 L SER CB 8 C4H2s 0.770 1.880 2.964 23.419 23.884 0.981 [OK] 411 52 L SER OG 17 O2H1u 0.660 1.460 3.162 20.490 18.732 1.094 possible 412 53 L ALA N 12 N3H1s 0.700 1.640 2.761 13.812 14.046 0.983 [OK] 413 53 L ALA CA 4 C4H1b 0.770 1.880 2.992 16.504 14.063 1.174 [OK] 414 53 L ALA C 1 C3H0s 0.770 1.610 2.511 8.427 8.900 0.947 [OK] 415 53 L ALA O 16 O1H0u 0.660 1.420 2.315 14.166 16.188 0.875 [OK] 416 53 L ALA CB 10 C4H3u 0.770 1.880 3.241 33.083 36.782 0.899 possible 417 54 L VAL N 12 N3H1s 0.700 1.640 2.997 13.972 13.676 1.022 [OK] 418 54 L VAL CA 3 C4H1s 0.770 1.880 3.175 13.263 13.123 1.011 possible 419 54 L VAL C 1 C3H0s 0.770 1.610 2.724 7.847 8.563 0.916 [OK] 420 54 L VAL O 16 O1H0u 0.660 1.420 8.638 -1.000 16.181 -1.000 bad 421 54 L VAL CB 4 C4H1b 0.770 1.880 2.777 14.035 14.598 0.961 [OK] 422 54 L VAL CG1 10 C4H3u 0.770 1.880 39.820 -1.000 36.584 -1.000 bad 423 54 L VAL CG2 10 C4H3u 0.770 1.880 18.181 -1.000 36.332 -1.000 bad 424 55 L LEU N 12 N3H1s 0.700 1.640 2.731 13.192 13.655 0.966 [OK] 425 55 L LEU CA 3 C4H1s 0.770 1.880 4.943 17.763 13.122 1.354 possible 426 55 L LEU C 1 C3H0s 0.770 1.610 3.957 9.258 8.825 1.049 possible 427 55 L LEU O 16 O1H0u 0.660 1.420 29.706 -1.000 16.208 -1.000 bad 428 55 L LEU CB 8 C4H2s 0.770 1.880 4.182 34.536 22.951 1.505 possible 429 55 L LEU CG 4 C4H1b 0.770 1.880 2.932 14.519 14.764 0.983 [OK] 430 55 L LEU CD1 10 C4H3u 0.770 1.880 4.507 41.825 37.425 1.118 possible 431 55 L LEU CD2 10 C4H3u 0.770 1.880 39.341 -1.000 37.143 -1.000 bad 432 56 L GLN N 12 N3H1s 0.700 1.640 4.027 14.838 13.616 1.090 possible 433 56 L GLN CA 3 C4H1s 0.770 1.880 7.507 33.068 13.334 2.480 possible 434 56 L GLN C 1 C3H0s 0.770 1.610 3.260 9.971 8.787 1.135 possible 435 56 L GLN O 16 O1H0u 0.660 1.420 26.743 -1.000 15.993 -1.000 bad 436 56 L GLN CB 8 C4H2s 0.770 1.880 4.710 24.030 23.275 1.032 possible 437 56 L GLN CG 8 C4H2s 0.770 1.880 23.490 -1.000 23.465 -1.000 bad 438 56 L GLN CD 2 C3H0b 0.770 1.610 3.509 12.148 9.659 1.258 possible 439 56 L GLN OE1 16 O1H0u 0.660 1.420 2.675 17.125 17.091 1.002 [OK] 440 56 L GLN NE2 15 N3H2u 0.700 1.640 5.082 38.664 24.150 1.601 possible 441 57 L GLY N 12 N3H1s 0.700 1.640 3.190 13.861 14.854 0.933 possible 442 57 L GLY CA 8 C4H2s 0.770 1.880 26.814 -1.000 23.688 -1.000 bad 443 57 L GLY C 2 C3H0b 0.770 1.610 3.175 10.654 9.840 1.083 possible 444 57 L GLY O 16 O1H0u 0.660 1.420 33.940 -1.000 16.391 -1.000 bad 445 58 L THR N 12 N3H1s 0.700 1.640 3.212 13.464 13.832 0.973 possible 446 58 L THR CA 3 C4H1s 0.770 1.880 4.672 20.098 13.099 1.534 possible 447 58 L THR C 1 C3H0s 0.770 1.610 3.390 10.426 8.738 1.193 possible 448 58 L THR O 16 O1H0u 0.660 1.420 2.705 17.847 16.020 1.114 [OK] 449 58 L THR CB 4 C4H1b 0.770 1.880 3.983 20.357 14.829 1.373 possible 450 58 L THR OG1 17 O2H1u 0.660 1.460 7.551 45.687 18.123 2.521 possible 451 58 L THR CG2 10 C4H3u 0.770 1.880 3.446 38.774 36.542 1.061 possible 452 59 L TRP N 12 N3H1s 0.700 1.640 3.938 15.325 13.791 1.111 possible 453 59 L TRP CA 3 C4H1s 0.770 1.880 2.681 13.540 13.377 1.012 [OK] 454 59 L TRP C 1 C3H0s 0.770 1.610 2.314 8.828 8.724 1.012 [OK] 455 59 L TRP O 16 O1H0u 0.660 1.420 9.045 -1.000 15.951 -1.000 bad 456 59 L TRP CB 8 C4H2s 0.770 1.880 6.041 32.246 24.004 1.343 possible 457 59 L TRP CG 2 C3H0b 0.770 1.610 0.746 -1.000 9.965 -1.000 bad 458 59 L TRP CD1 5 C3H1s 0.770 1.760 32.946 -1.000 20.874 -1.000 bad 459 59 L TRP CD2 2 C3H0b 0.770 1.610 1.725 -1.000 10.097 -1.000 bad 460 59 L TRP NE1 13 N3H1b 0.700 1.640 25.722 -1.000 16.969 -1.000 bad 461 59 L TRP CE2 2 C3H0b 0.770 1.610 1.552 -1.000 9.889 -1.000 bad 462 59 L TRP CE3 6 C3H1b 0.770 1.760 10.033 -1.000 20.448 -1.000 bad 463 59 L TRP CZ2 6 C3H1b 0.770 1.760 22.653 -1.000 21.012 -1.000 bad 464 59 L TRP CZ3 6 C3H1b 0.770 1.760 8.944 -1.000 21.516 -1.000 bad 465 59 L TRP CH2 6 C3H1b 0.770 1.760 14.484 -1.000 21.339 -1.000 bad 466 60 L ASN N 12 N3H1s 0.700 1.640 2.493 14.073 13.695 1.028 [OK] 467 60 L ASN CA 3 C4H1s 0.770 1.880 3.252 12.906 13.167 0.980 possible 468 60 L ASN C 1 C3H0s 0.770 1.610 2.251 8.415 8.928 0.943 [OK] 469 60 L ASN O 16 O1H0u 0.660 1.420 2.307 13.955 16.199 0.861 [OK] 470 60 L ASN CB 8 C4H2s 0.770 1.880 4.925 30.163 23.128 1.304 possible 471 60 L ASN CG 2 C3H0b 0.770 1.610 2.964 9.322 9.599 0.971 [OK] 472 60 L ASN OD1 16 O1H0u 0.660 1.420 4.531 19.747 16.664 1.185 possible 473 60 L ASN ND2 15 N3H2u 0.700 1.640 46.521 -1.000 23.083 -1.000 bad 474 61 L PRO N 11 N3H0u 0.700 1.640 2.871 9.087 8.823 1.030 [OK] 475 61 L PRO CA 4 C4H1b 0.770 1.880 6.050 23.177 13.955 1.661 possible 476 61 L PRO C 1 C3H0s 0.770 1.610 2.510 8.544 8.812 0.970 [OK] 477 61 L PRO O 16 O1H0u 0.660 1.420 4.496 26.211 16.169 1.621 possible 478 61 L PRO CB 9 C4H2b 0.770 1.880 20.501 -1.000 25.563 -1.000 bad 479 61 L PRO CG 9 C4H2b 0.770 1.880 43.330 -1.000 25.832 -1.000 bad 480 61 L PRO CD 8 C4H2s 0.770 1.880 15.402 -1.000 23.836 -1.000 bad 481 62 L GLN N 12 N3H1s 0.700 1.640 2.622 12.608 13.616 0.926 [OK] 482 62 L GLN CA 3 C4H1s 0.770 1.880 2.767 14.691 13.334 1.102 [OK] 483 62 L GLN C 1 C3H0s 0.770 1.610 2.636 8.881 8.787 1.011 [OK] 484 62 L GLN O 16 O1H0u 0.660 1.420 3.299 22.903 15.993 1.432 possible 485 62 L GLN CB 8 C4H2s 0.770 1.880 6.659 42.416 23.275 1.822 possible 486 62 L GLN CG 8 C4H2s 0.770 1.880 24.620 -1.000 23.465 -1.000 bad 487 62 L GLN CD 2 C3H0b 0.770 1.610 2.144 -1.000 9.659 -1.000 bad 488 62 L GLN OE1 16 O1H0u 0.660 1.420 23.363 -1.000 17.091 -1.000 bad 489 62 L GLN NE2 15 N3H2u 0.700 1.640 25.813 -1.000 24.150 -1.000 bad 490 63 L LEU N 12 N3H1s 0.700 1.640 2.216 12.505 13.655 0.916 [OK] 491 63 L LEU CA 3 C4H1s 0.770 1.880 3.583 13.480 13.122 1.027 possible 492 63 L LEU C 1 C3H0s 0.770 1.610 2.537 9.715 8.825 1.101 [OK] 493 63 L LEU O 16 O1H0u 0.660 1.420 3.158 22.364 16.208 1.380 possible 494 63 L LEU CB 8 C4H2s 0.770 1.880 2.911 24.201 22.951 1.054 [OK] 495 63 L LEU CG 4 C4H1b 0.770 1.880 7.101 31.507 14.764 2.134 possible 496 63 L LEU CD1 10 C4H3u 0.770 1.880 45.665 -1.000 37.425 -1.000 bad 497 63 L LEU CD2 10 C4H3u 0.770 1.880 23.784 -1.000 37.143 -1.000 bad 498 64 L ILE N 12 N3H1s 0.700 1.640 2.517 14.288 13.633 1.048 [OK] 499 64 L ILE CA 3 C4H1s 0.770 1.880 2.905 13.481 13.007 1.036 [OK] 500 64 L ILE C 1 C3H0s 0.770 1.610 2.829 8.037 8.470 0.949 [OK] 501 64 L ILE O 16 O1H0u 0.660 1.420 4.088 22.281 16.144 1.380 possible 502 64 L ILE CB 4 C4H1b 0.770 1.880 4.785 21.935 14.227 1.542 possible 503 64 L ILE CG1 9 C4H2b 0.770 1.880 2.793 22.340 24.187 0.924 [OK] 504 64 L ILE CG2 10 C4H3u 0.770 1.880 4.125 45.214 35.961 1.257 possible 505 64 L ILE CD1 10 C4H3u 0.770 1.880 7.525 95.921 38.377 2.499 possible 506 65 L SER N 12 N3H1s 0.700 1.640 2.860 14.581 14.103 1.034 [OK] 507 65 L SER CA 3 C4H1s 0.770 1.880 2.841 12.847 13.476 0.953 [OK] 508 65 L SER C 1 C3H0s 0.770 1.610 2.674 9.586 8.923 1.074 [OK] 509 65 L SER O 16 O1H0u 0.660 1.420 3.616 21.507 16.179 1.329 possible 510 65 L SER CB 8 C4H2s 0.770 1.880 3.032 25.187 23.884 1.055 possible 511 65 L SER OG 17 O2H1u 0.660 1.460 2.460 18.626 18.732 0.994 [OK] 512 66 L VAL N 12 N3H1s 0.700 1.640 2.771 14.382 13.676 1.052 [OK] 513 66 L VAL CA 3 C4H1s 0.770 1.880 2.583 13.137 13.123 1.001 [OK] 514 66 L VAL C 1 C3H0s 0.770 1.610 2.571 8.903 8.563 1.040 [OK] 515 66 L VAL O 16 O1H0u 0.660 1.420 2.491 16.364 16.181 1.011 [OK] 516 66 L VAL CB 4 C4H1b 0.770 1.880 2.950 14.853 14.598 1.017 [OK] 517 66 L VAL CG1 10 C4H3u 0.770 1.880 2.887 32.449 36.584 0.887 [OK] 518 66 L VAL CG2 10 C4H3u 0.770 1.880 3.374 40.802 36.332 1.123 possible 519 67 L TYR N 12 N3H1s 0.700 1.640 2.989 16.945 13.691 1.238 [OK] 520 67 L TYR CA 3 C4H1s 0.770 1.880 2.513 11.562 13.330 0.867 [OK] 521 67 L TYR C 1 C3H0s 0.770 1.610 2.303 8.563 8.770 0.976 [OK] 522 67 L TYR O 16 O1H0u 0.660 1.420 3.081 17.224 16.124 1.068 possible 523 67 L TYR CB 8 C4H2s 0.770 1.880 6.496 56.869 23.678 2.402 possible 524 67 L TYR CG 2 C3H0b 0.770 1.610 6.776 19.624 9.732 2.016 possible 525 67 L TYR CD1 5 C3H1s 0.770 1.760 13.537 -1.000 20.171 -1.000 bad 526 67 L TYR CD2 5 C3H1s 0.770 1.760 7.098 66.576 20.728 3.212 possible 527 67 L TYR CE1 5 C3H1s 0.770 1.760 11.248 -1.000 20.675 -1.000 bad 528 67 L TYR CE2 5 C3H1s 0.770 1.760 14.830 -1.000 20.810 -1.000 bad 529 67 L TYR CZ 2 C3H0b 0.770 1.610 1.838 -1.000 9.926 -1.000 bad 530 67 L TYR OH 17 O2H1u 0.660 1.460 9.708 -1.000 19.173 -1.000 bad 531 68 L PRO N 11 N3H0u 0.700 1.640 2.463 8.055 8.823 0.913 [OK] 532 68 L PRO CA 4 C4H1b 0.770 1.880 2.544 12.378 13.955 0.887 [OK] 533 68 L PRO C 1 C3H0s 0.770 1.610 2.381 8.998 8.812 1.021 [OK] 534 68 L PRO O 16 O1H0u 0.660 1.420 4.208 33.618 16.169 2.079 possible 535 68 L PRO CB 9 C4H2b 0.770 1.880 2.887 24.652 25.563 0.964 [OK] 536 68 L PRO CG 9 C4H2b 0.770 1.880 4.759 40.262 25.832 1.559 possible 537 68 L PRO CD 8 C4H2s 0.770 1.880 3.117 24.226 23.836 1.016 possible 538 69 L PRO N 11 N3H0u 0.700 1.640 2.494 8.343 8.823 0.946 [OK] 539 69 L PRO CA 4 C4H1b 0.770 1.880 2.862 14.341 13.955 1.028 [OK] 540 69 L PRO C 1 C3H0s 0.770 1.610 2.593 8.595 8.812 0.975 [OK] 541 69 L PRO O 16 O1H0u 0.660 1.420 2.970 15.900 16.169 0.983 [OK] 542 69 L PRO CB 9 C4H2b 0.770 1.880 3.092 26.092 25.563 1.021 possible 543 69 L PRO CG 9 C4H2b 0.770 1.880 3.058 22.889 25.832 0.886 possible 544 69 L PRO CD 8 C4H2s 0.770 1.880 2.856 23.865 23.836 1.001 [OK] 545 70 L ALA N 12 N3H1s 0.700 1.640 4.088 21.989 14.046 1.565 possible 546 70 L ALA CA 4 C4H1b 0.770 1.880 6.170 32.215 14.063 2.291 possible 547 70 L ALA C 1 C3H0s 0.770 1.610 2.199 8.365 8.900 0.940 [OK] 548 70 L ALA O 16 O1H0u 0.660 1.420 2.273 14.699 16.188 0.908 [OK] 549 70 L ALA CB 10 C4H3u 0.770 1.880 39.463 -1.000 36.782 -1.000 bad 550 71 L LEU N 12 N3H1s 0.700 1.640 4.198 22.846 13.655 1.673 possible 551 71 L LEU CA 3 C4H1s 0.770 1.880 2.659 13.410 13.122 1.022 [OK] 552 71 L LEU C 1 C3H0s 0.770 1.610 4.029 9.380 8.825 1.063 possible 553 71 L LEU O 16 O1H0u 0.660 1.420 10.419 -1.000 16.208 -1.000 bad 554 71 L LEU CB 8 C4H2s 0.770 1.880 7.536 57.423 22.951 2.502 possible 555 71 L LEU CG 4 C4H1b 0.770 1.880 11.551 -1.000 14.764 -1.000 bad 556 71 L LEU CD1 10 C4H3u 0.770 1.880 50.600 -1.000 37.425 -1.000 bad 557 71 L LEU CD2 10 C4H3u 0.770 1.880 4.891 42.694 37.143 1.149 possible 558 72 L GLU N 12 N3H1s 0.700 1.640 4.495 16.093 13.615 1.182 possible 559 72 L GLU CA 3 C4H1s 0.770 1.880 12.905 -1.000 13.399 -1.000 bad 560 72 L GLU C 1 C3H0s 0.770 1.610 3.146 8.746 8.675 1.008 possible 561 72 L GLU O 16 O1H0u 0.660 1.420 30.331 -1.000 16.023 -1.000 bad 562 72 L GLU CB 8 C4H2s 0.770 1.880 21.674 -1.000 23.529 -1.000 bad 563 72 L GLU CG 8 C4H2s 0.770 1.880 39.275 -1.000 23.513 -1.000 bad 564 72 L GLU CD 2 C3H0b 0.770 1.610 3.481 -1.000 9.460 -1.000 bad 565 72 L GLU OE1 16 O1H0u 0.660 1.420 18.410 -1.000 15.999 -1.000 bad 566 72 L GLU OE2 16 O1H0u 0.660 1.420 23.582 -1.000 17.432 -1.000 bad 567 73 L TYR N 12 N3H1s 0.700 1.640 2.850 13.573 13.691 0.991 [OK] 568 73 L TYR CA 3 C4H1s 0.770 1.880 5.277 19.179 13.330 1.439 possible 569 73 L TYR C 1 C3H0s 0.770 1.610 3.292 9.836 8.770 1.122 possible 570 73 L TYR O 16 O1H0u 0.660 1.420 10.218 -1.000 16.124 -1.000 bad 571 73 L TYR CB 8 C4H2s 0.770 1.880 3.157 27.851 23.678 1.176 possible 572 73 L TYR CG 2 C3H0b 0.770 1.610 2.793 10.077 9.732 1.035 [OK] 573 73 L TYR CD1 5 C3H1s 0.770 1.760 10.946 -1.000 20.171 -1.000 bad 574 73 L TYR CD2 5 C3H1s 0.770 1.760 2.932 18.870 20.728 0.910 [OK] 575 73 L TYR CE1 5 C3H1s 0.770 1.760 18.685 -1.000 20.675 -1.000 bad 576 73 L TYR CE2 5 C3H1s 0.770 1.760 4.057 29.590 20.810 1.422 possible 577 73 L TYR CZ 2 C3H0b 0.770 1.610 4.361 13.629 9.926 1.373 possible 578 73 L TYR OH 17 O2H1u 0.660 1.460 15.090 -1.000 19.173 -1.000 bad 579 74 L GLY N 12 N3H1s 0.700 1.640 3.478 16.697 14.854 1.124 possible 580 74 L GLY CA 8 C4H2s 0.770 1.880 17.571 -1.000 23.688 -1.000 bad 581 74 L GLY C 2 C3H0b 0.770 1.610 2.134 8.341 9.840 0.848 [OK] 582 74 L GLY O 16 O1H0u 0.660 1.420 2.542 16.072 16.391 0.981 [OK] 583 75 L LEU N 12 N3H1s 0.700 1.640 6.013 -1.000 13.655 -1.000 bad 584 75 L LEU CA 3 C4H1s 0.770 1.880 2.497 12.180 13.122 0.928 [OK] 585 75 L LEU C 1 C3H0s 0.770 1.610 6.897 12.486 8.825 1.415 possible 586 75 L LEU O 16 O1H0u 0.660 1.420 22.475 -1.000 16.208 -1.000 bad 587 75 L LEU CB 8 C4H2s 0.770 1.880 15.407 -1.000 22.951 -1.000 bad 588 75 L LEU CG 4 C4H1b 0.770 1.880 3.500 13.591 14.764 0.921 possible 589 75 L LEU CD1 10 C4H3u 0.770 1.880 29.229 -1.000 37.425 -1.000 bad 590 75 L LEU CD2 10 C4H3u 0.770 1.880 3.419 33.328 37.143 0.897 possible 591 76 L GLY N 12 N3H1s 0.700 1.640 1.477 -1.000 14.854 -1.000 bad 592 76 L GLY CA 8 C4H2s 0.770 1.880 31.942 -1.000 23.688 -1.000 bad 593 76 L GLY C 2 C3H0b 0.770 1.610 4.235 13.367 9.840 1.358 possible 594 76 L GLY O 16 O1H0u 0.660 1.420 3.037 21.045 16.391 1.284 possible 595 77 L GLY N 12 N3H1s 0.700 1.640 16.717 -1.000 14.854 -1.000 bad 596 77 L GLY CA 8 C4H2s 0.770 1.880 33.019 -1.000 23.688 -1.000 bad 597 77 L GLY C 2 C3H0b 0.770 1.610 1.745 -1.000 9.840 -1.000 bad 598 77 L GLY O 16 O1H0u 0.660 1.420 12.652 -1.000 16.391 -1.000 bad 599 78 L ALA N 12 N3H1s 0.700 1.640 4.761 20.289 14.046 1.444 possible 600 78 L ALA CA 4 C4H1b 0.770 1.880 3.543 13.333 14.063 0.948 possible 601 78 L ALA C 1 C3H0s 0.770 1.610 6.810 13.138 8.900 1.476 possible 602 78 L ALA O 16 O1H0u 0.660 1.420 9.840 -1.000 16.188 -1.000 bad 603 78 L ALA CB 10 C4H3u 0.770 1.880 3.084 34.489 36.782 0.938 possible 604 79 L PRO N 11 N3H0u 0.700 1.640 7.339 14.863 8.823 1.685 possible 605 79 L PRO CA 4 C4H1b 0.770 1.880 10.745 -1.000 13.955 -1.000 bad 606 79 L PRO C 1 C3H0s 0.770 1.610 2.564 8.551 8.812 0.970 [OK] 607 79 L PRO O 16 O1H0u 0.660 1.420 2.422 14.426 16.169 0.892 [OK] 608 79 L PRO CB 9 C4H2b 0.770 1.880 21.743 -1.000 25.563 -1.000 bad 609 79 L PRO CG 9 C4H2b 0.770 1.880 38.034 -1.000 25.832 -1.000 bad 610 79 L PRO CD 8 C4H2s 0.770 1.880 7.709 48.782 23.836 2.047 possible 611 80 L LEU N 12 N3H1s 0.700 1.640 5.602 25.851 13.655 1.893 possible 612 80 L LEU CA 3 C4H1s 0.770 1.880 2.719 12.231 13.122 0.932 [OK] 613 80 L LEU C 1 C3H0s 0.770 1.610 2.583 8.447 8.825 0.957 [OK] 614 80 L LEU O 16 O1H0u 0.660 1.420 2.581 15.207 16.208 0.938 [OK] 615 80 L LEU CB 8 C4H2s 0.770 1.880 7.155 36.388 22.951 1.585 possible 616 80 L LEU CG 4 C4H1b 0.770 1.880 12.846 -1.000 14.764 -1.000 bad 617 80 L LEU CD1 10 C4H3u 0.770 1.880 40.401 -1.000 37.425 -1.000 bad 618 80 L LEU CD2 10 C4H3u 0.770 1.880 29.606 -1.000 37.143 -1.000 bad 619 81 L ALA N 12 N3H1s 0.700 1.640 5.591 25.015 14.046 1.781 possible 620 81 L ALA CA 4 C4H1b 0.770 1.880 3.595 16.186 14.063 1.151 possible 621 81 L ALA C 1 C3H0s 0.770 1.610 2.727 9.605 8.900 1.079 [OK] 622 81 L ALA O 16 O1H0u 0.660 1.420 6.525 70.695 16.188 4.367 possible 623 81 L ALA CB 10 C4H3u 0.770 1.880 37.494 -1.000 36.782 -1.000 bad 624 82 L LYS N 12 N3H1s 0.700 1.640 2.978 13.272 13.675 0.971 [OK] 625 82 L LYS CA 3 C4H1s 0.770 1.880 5.652 25.907 13.324 1.944 possible 626 82 L LYS C 1 C3H0s 0.770 1.610 4.270 13.223 8.759 1.510 possible 627 82 L LYS O 16 O1H0u 0.660 1.420 3.980 24.683 16.049 1.538 possible 628 82 L LYS CB 8 C4H2s 0.770 1.880 5.204 33.943 22.904 1.482 possible 629 82 L LYS CG 8 C4H2s 0.770 1.880 10.526 -1.000 23.131 -1.000 bad 630 82 L LYS CD 8 C4H2s 0.770 1.880 5.859 55.312 23.837 2.320 possible 631 82 L LYS CE 9 C4H2b 0.770 1.880 38.450 -1.000 23.934 -1.000 bad 632 82 L LYS NZ 14 N4H3u 0.700 1.640 55.531 -1.000 21.213 -1.000 bad 633 83 L GLY N 12 N3H1s 0.700 1.640 3.409 18.255 14.854 1.229 possible 634 83 L GLY CA 8 C4H2s 0.770 1.880 2.932 20.555 23.688 0.868 [OK] 635 83 L GLY C 2 C3H0b 0.770 1.610 2.245 9.198 9.840 0.935 [OK] 636 83 L GLY O 16 O1H0u 0.660 1.420 2.218 14.440 16.391 0.881 [OK] 637 84 L GLY N 12 N3H1s 0.700 1.640 2.295 13.240 14.854 0.891 [OK] 638 84 L GLY CA 8 C4H2s 0.770 1.880 3.876 26.741 23.688 1.129 possible 639 84 L GLY C 2 C3H0b 0.770 1.610 2.760 10.009 9.840 1.017 [OK] 640 84 L GLY O 16 O1H0u 0.660 1.420 3.110 16.120 16.391 0.983 possible 641 85 L LEU N 12 N3H1s 0.700 1.640 2.730 13.122 13.655 0.961 [OK] 642 85 L LEU CA 3 C4H1s 0.770 1.880 2.906 13.136 13.122 1.001 [OK] 643 85 L LEU C 1 C3H0s 0.770 1.610 2.290 8.338 8.825 0.945 [OK] 644 85 L LEU O 16 O1H0u 0.660 1.420 2.576 15.195 16.208 0.937 [OK] 645 85 L LEU CB 8 C4H2s 0.770 1.880 2.901 22.290 22.951 0.971 [OK] 646 85 L LEU CG 4 C4H1b 0.770 1.880 2.971 17.593 14.764 1.192 [OK] 647 85 L LEU CD1 10 C4H3u 0.770 1.880 3.625 40.619 37.425 1.085 possible 648 85 L LEU CD2 10 C4H3u 0.770 1.880 3.466 36.393 37.143 0.980 possible 649 86 L TRP N 12 N3H1s 0.700 1.640 2.233 12.752 13.791 0.925 [OK] 650 86 L TRP CA 3 C4H1s 0.770 1.880 2.895 14.183 13.377 1.060 [OK] 651 86 L TRP C 1 C3H0s 0.770 1.610 1.997 7.600 8.724 0.871 [OK] 652 86 L TRP O 16 O1H0u 0.660 1.420 2.415 14.009 15.951 0.878 [OK] 653 86 L TRP CB 8 C4H2s 0.770 1.880 2.605 20.572 24.004 0.857 [OK] 654 86 L TRP CG 2 C3H0b 0.770 1.610 2.400 9.320 9.965 0.935 [OK] 655 86 L TRP CD1 5 C3H1s 0.770 1.760 2.623 20.781 20.874 0.996 [OK] 656 86 L TRP CD2 2 C3H0b 0.770 1.610 2.287 9.388 10.097 0.930 [OK] 657 86 L TRP NE1 13 N3H1b 0.700 1.640 2.522 15.353 16.969 0.905 [OK] 658 86 L TRP CE2 2 C3H0b 0.770 1.610 2.581 9.710 9.889 0.982 [OK] 659 86 L TRP CE3 6 C3H1b 0.770 1.760 2.681 18.326 20.448 0.896 [OK] 660 86 L TRP CZ2 6 C3H1b 0.770 1.760 2.763 19.114 21.012 0.910 [OK] 661 86 L TRP CZ3 6 C3H1b 0.770 1.760 4.133 31.425 21.516 1.461 possible 662 86 L TRP CH2 6 C3H1b 0.770 1.760 3.099 23.490 21.339 1.101 possible 663 87 L GLN N 12 N3H1s 0.700 1.640 2.396 12.022 13.616 0.883 [OK] 664 87 L GLN CA 3 C4H1s 0.770 1.880 4.106 15.078 13.334 1.131 possible 665 87 L GLN C 1 C3H0s 0.770 1.610 3.073 8.802 8.787 1.002 possible 666 87 L GLN O 16 O1H0u 0.660 1.420 3.658 22.825 15.993 1.427 possible 667 87 L GLN CB 8 C4H2s 0.770 1.880 5.275 41.426 23.275 1.780 possible 668 87 L GLN CG 8 C4H2s 0.770 1.880 4.211 26.056 23.465 1.110 possible 669 87 L GLN CD 2 C3H0b 0.770 1.610 4.102 10.039 9.659 1.039 possible 670 87 L GLN OE1 16 O1H0u 0.660 1.420 6.308 46.914 17.091 2.745 possible 671 87 L GLN NE2 15 N3H2u 0.700 1.640 4.287 31.307 24.150 1.296 possible 672 88 L ILE N 12 N3H1s 0.700 1.640 2.433 12.262 13.633 0.899 [OK] 673 88 L ILE CA 3 C4H1s 0.770 1.880 3.188 13.893 13.007 1.068 possible 674 88 L ILE C 1 C3H0s 0.770 1.610 2.380 8.388 8.470 0.990 [OK] 675 88 L ILE O 16 O1H0u 0.660 1.420 2.795 14.592 16.144 0.904 [OK] 676 88 L ILE CB 4 C4H1b 0.770 1.880 3.073 15.808 14.227 1.111 possible 677 88 L ILE CG1 9 C4H2b 0.770 1.880 5.368 36.170 24.187 1.495 possible 678 88 L ILE CG2 10 C4H3u 0.770 1.880 23.285 -1.000 35.961 -1.000 bad 679 88 L ILE CD1 10 C4H3u 0.770 1.880 46.545 -1.000 38.377 -1.000 bad 680 89 L ILE N 12 N3H1s 0.700 1.640 2.517 12.527 13.633 0.919 [OK] 681 89 L ILE CA 3 C4H1s 0.770 1.880 2.740 14.123 13.007 1.086 [OK] 682 89 L ILE C 1 C3H0s 0.770 1.610 2.507 8.198 8.470 0.968 [OK] 683 89 L ILE O 16 O1H0u 0.660 1.420 2.535 15.472 16.144 0.958 [OK] 684 89 L ILE CB 4 C4H1b 0.770 1.880 2.878 14.503 14.227 1.019 [OK] 685 89 L ILE CG1 9 C4H2b 0.770 1.880 2.859 20.868 24.187 0.863 [OK] 686 89 L ILE CG2 10 C4H3u 0.770 1.880 2.999 37.269 35.961 1.036 [OK] 687 89 L ILE CD1 10 C4H3u 0.770 1.880 3.093 35.358 38.377 0.921 possible 688 90 L THR N 12 N3H1s 0.700 1.640 2.602 12.599 13.832 0.911 [OK] 689 90 L THR CA 3 C4H1s 0.770 1.880 2.905 14.151 13.099 1.080 [OK] 690 90 L THR C 1 C3H0s 0.770 1.610 2.939 8.361 8.738 0.957 [OK] 691 90 L THR O 16 O1H0u 0.660 1.420 2.811 15.175 16.020 0.947 [OK] 692 90 L THR CB 4 C4H1b 0.770 1.880 3.340 14.969 14.829 1.009 possible 693 90 L THR OG1 17 O2H1u 0.660 1.460 2.262 15.882 18.123 0.876 [OK] 694 90 L THR CG2 10 C4H3u 0.770 1.880 4.326 57.305 36.542 1.568 possible 695 91 L ILE N 12 N3H1s 0.700 1.640 2.833 13.193 13.633 0.968 [OK] 696 91 L ILE CA 3 C4H1s 0.770 1.880 3.455 15.020 13.007 1.155 possible 697 91 L ILE C 1 C3H0s 0.770 1.610 2.750 7.937 8.470 0.937 [OK] 698 91 L ILE O 16 O1H0u 0.660 1.420 4.199 22.234 16.144 1.377 possible 699 91 L ILE CB 4 C4H1b 0.770 1.880 3.545 15.385 14.227 1.081 possible 700 91 L ILE CG1 9 C4H2b 0.770 1.880 13.306 -1.000 24.187 -1.000 bad 701 91 L ILE CG2 10 C4H3u 0.770 1.880 41.805 -1.000 35.961 -1.000 bad 702 91 L ILE CD1 10 C4H3u 0.770 1.880 58.139 -1.000 38.377 -1.000 bad 703 92 L CYS N 12 N3H1s 0.700 1.640 3.005 13.108 13.981 0.938 possible 704 92 L CYS CA 3 C4H1s 0.770 1.880 3.196 13.999 13.656 1.025 possible 705 92 L CYS C 1 C3H0s 0.770 1.610 2.350 8.344 8.897 0.938 [OK] 706 92 L CYS O 16 O1H0u 0.660 1.420 2.356 15.300 16.543 0.925 [OK] 707 92 L CYS CB 9 C4H2b 0.770 1.880 2.882 22.215 23.536 0.944 [OK] 708 92 L CYS SG 20 S2H1u 1.040 1.770 3.772 42.930 34.603 1.241 possible 709 93 L ALA N 12 N3H1s 0.700 1.640 2.610 12.628 14.046 0.899 [OK] 710 93 L ALA CA 4 C4H1b 0.770 1.880 3.028 15.962 14.063 1.135 possible 711 93 L ALA C 1 C3H0s 0.770 1.610 2.384 8.448 8.900 0.949 [OK] 712 93 L ALA O 16 O1H0u 0.660 1.420 2.556 14.046 16.188 0.868 [OK] 713 93 L ALA CB 10 C4H3u 0.770 1.880 3.021 36.055 36.782 0.980 possible 714 94 L THR N 12 N3H1s 0.700 1.640 2.504 13.206 13.832 0.955 [OK] 715 94 L THR CA 3 C4H1s 0.770 1.880 3.176 16.226 13.099 1.239 possible 716 94 L THR C 1 C3H0s 0.770 1.610 3.214 8.461 8.738 0.968 possible 717 94 L THR O 16 O1H0u 0.660 1.420 3.230 16.429 16.020 1.026 possible 718 94 L THR CB 4 C4H1b 0.770 1.880 3.959 18.467 14.829 1.245 possible 719 94 L THR OG1 17 O2H1u 0.660 1.460 3.499 26.818 18.123 1.480 possible 720 94 L THR CG2 10 C4H3u 0.770 1.880 28.624 -1.000 36.542 -1.000 bad 721 95 L GLY N 12 N3H1s 0.700 1.640 4.516 16.985 14.854 1.143 possible 722 95 L GLY CA 8 C4H2s 0.770 1.880 6.797 50.652 23.688 2.138 possible 723 95 L GLY C 2 C3H0b 0.770 1.610 2.168 8.456 9.840 0.859 [OK] 724 95 L GLY O 16 O1H0u 0.660 1.420 3.580 17.152 16.391 1.046 possible 725 96 L ALA N 12 N3H1s 0.700 1.640 2.235 11.782 14.046 0.839 [OK] 726 96 L ALA CA 4 C4H1b 0.770 1.880 2.810 14.667 14.063 1.043 [OK] 727 96 L ALA C 1 C3H0s 0.770 1.610 2.460 8.755 8.900 0.984 [OK] 728 96 L ALA O 16 O1H0u 0.660 1.420 2.299 16.172 16.188 0.999 [OK] 729 96 L ALA CB 10 C4H3u 0.770 1.880 3.032 38.651 36.782 1.051 possible 730 97 L PHE N 12 N3H1s 0.700 1.640 2.422 12.332 13.691 0.901 [OK] 731 97 L PHE CA 3 C4H1s 0.770 1.880 2.662 13.622 13.449 1.013 [OK] 732 97 L PHE C 1 C3H0s 0.770 1.610 2.103 8.251 8.753 0.943 [OK] 733 97 L PHE O 16 O1H0u 0.660 1.420 2.241 14.006 16.151 0.867 [OK] 734 97 L PHE CB 8 C4H2s 0.770 1.880 2.981 23.458 23.777 0.987 [OK] 735 97 L PHE CG 2 C3H0b 0.770 1.610 2.585 10.370 9.721 1.067 [OK] 736 97 L PHE CD1 5 C3H1s 0.770 1.760 2.744 20.817 20.405 1.020 [OK] 737 97 L PHE CD2 6 C3H1b 0.770 1.760 3.046 22.878 21.051 1.087 possible 738 97 L PHE CE1 6 C3H1b 0.770 1.760 2.899 22.732 21.580 1.053 [OK] 739 97 L PHE CE2 6 C3H1b 0.770 1.760 2.707 20.581 21.680 0.949 [OK] 740 97 L PHE CZ 6 C3H1b 0.770 1.760 2.757 21.508 21.666 0.993 [OK] 741 98 L VAL N 12 N3H1s 0.700 1.640 2.558 13.037 13.676 0.953 [OK] 742 98 L VAL CA 3 C4H1s 0.770 1.880 3.724 15.503 13.123 1.181 possible 743 98 L VAL C 1 C3H0s 0.770 1.610 2.645 8.077 8.563 0.943 [OK] 744 98 L VAL O 16 O1H0u 0.660 1.420 2.896 15.249 16.181 0.942 [OK] 745 98 L VAL CB 4 C4H1b 0.770 1.880 4.380 18.136 14.598 1.242 possible 746 98 L VAL CG1 10 C4H3u 0.770 1.880 37.505 -1.000 36.584 -1.000 bad 747 98 L VAL CG2 10 C4H3u 0.770 1.880 22.308 -1.000 36.332 -1.000 bad 748 99 L SER N 12 N3H1s 0.700 1.640 3.148 14.676 14.103 1.041 possible 749 99 L SER CA 3 C4H1s 0.770 1.880 3.257 15.203 13.476 1.128 possible 750 99 L SER C 1 C3H0s 0.770 1.610 2.275 8.145 8.923 0.913 [OK] 751 99 L SER O 16 O1H0u 0.660 1.420 2.465 14.805 16.179 0.915 [OK] 752 99 L SER CB 8 C4H2s 0.770 1.880 2.706 21.484 23.884 0.900 [OK] 753 99 L SER OG 17 O2H1u 0.660 1.460 4.488 30.796 18.732 1.644 possible 754 100 L TRP N 12 N3H1s 0.700 1.640 2.312 12.424 13.791 0.901 [OK] 755 100 L TRP CA 3 C4H1s 0.770 1.880 2.916 14.994 13.377 1.121 [OK] 756 100 L TRP C 1 C3H0s 0.770 1.610 2.568 8.199 8.724 0.940 [OK] 757 100 L TRP O 16 O1H0u 0.660 1.420 2.412 13.384 15.951 0.839 [OK] 758 100 L TRP CB 8 C4H2s 0.770 1.880 2.601 21.027 24.004 0.876 [OK] 759 100 L TRP CG 2 C3H0b 0.770 1.610 2.159 8.893 9.965 0.892 [OK] 760 100 L TRP CD1 5 C3H1s 0.770 1.760 2.694 20.461 20.874 0.980 [OK] 761 100 L TRP CD2 2 C3H0b 0.770 1.610 2.411 9.501 10.097 0.941 [OK] 762 100 L TRP NE1 13 N3H1b 0.700 1.640 2.573 15.515 16.969 0.914 [OK] 763 100 L TRP CE2 2 C3H0b 0.770 1.610 2.409 9.635 9.889 0.974 [OK] 764 100 L TRP CE3 6 C3H1b 0.770 1.760 3.081 20.783 20.448 1.016 possible 765 100 L TRP CZ2 6 C3H1b 0.770 1.760 2.863 21.645 21.012 1.030 [OK] 766 100 L TRP CZ3 6 C3H1b 0.770 1.760 4.130 32.666 21.516 1.518 possible 767 100 L TRP CH2 6 C3H1b 0.770 1.760 3.228 23.592 21.339 1.106 possible 768 101 L ALA N 12 N3H1s 0.700 1.640 2.627 12.810 14.046 0.912 [OK] 769 101 L ALA CA 4 C4H1b 0.770 1.880 2.824 14.927 14.063 1.061 [OK] 770 101 L ALA C 1 C3H0s 0.770 1.610 2.984 8.617 8.900 0.968 [OK] 771 101 L ALA O 16 O1H0u 0.660 1.420 2.824 14.523 16.188 0.897 [OK] 772 101 L ALA CB 10 C4H3u 0.770 1.880 4.557 55.897 36.782 1.520 possible 773 102 L LEU N 12 N3H1s 0.700 1.640 2.356 11.875 13.655 0.870 [OK] 774 102 L LEU CA 3 C4H1s 0.770 1.880 2.865 13.148 13.122 1.002 [OK] 775 102 L LEU C 1 C3H0s 0.770 1.610 2.228 8.615 8.825 0.976 [OK] 776 102 L LEU O 16 O1H0u 0.660 1.420 2.425 16.486 16.208 1.017 [OK] 777 102 L LEU CB 8 C4H2s 0.770 1.880 2.696 21.628 22.951 0.942 [OK] 778 102 L LEU CG 4 C4H1b 0.770 1.880 6.148 24.757 14.764 1.677 possible 779 102 L LEU CD1 10 C4H3u 0.770 1.880 31.807 -1.000 37.425 -1.000 bad 780 102 L LEU CD2 10 C4H3u 0.770 1.880 25.728 -1.000 37.143 -1.000 bad 781 103 L ARG N 12 N3H1s 0.700 1.640 2.324 11.789 13.650 0.864 [OK] 782 103 L ARG CA 3 C4H1s 0.770 1.880 3.178 15.916 13.422 1.186 possible 783 103 L ARG C 1 C3H0s 0.770 1.610 2.410 8.139 8.838 0.921 [OK] 784 103 L ARG O 16 O1H0u 0.660 1.420 2.666 15.266 16.084 0.949 [OK] 785 103 L ARG CB 8 C4H2s 0.770 1.880 2.951 21.043 23.088 0.911 [OK] 786 103 L ARG CG 8 C4H2s 0.770 1.880 3.255 27.254 23.640 1.153 possible 787 103 L ARG CD 8 C4H2s 0.770 1.880 3.493 25.795 23.300 1.107 possible 788 103 L ARG NE 13 N3H1b 0.700 1.640 4.189 22.086 15.569 1.419 possible 789 103 L ARG CZ 2 C3H0b 0.770 1.610 3.890 12.529 9.747 1.285 possible 790 103 L ARG NH1 15 N3H2u 0.700 1.640 2.763 20.835 22.782 0.915 [OK] 791 103 L ARG NH2 15 N3H2u 0.700 1.640 4.494 29.884 23.810 1.255 possible 792 104 L GLU N 12 N3H1s 0.700 1.640 2.517 12.678 13.615 0.931 [OK] 793 104 L GLU CA 3 C4H1s 0.770 1.880 2.800 14.280 13.399 1.066 [OK] 794 104 L GLU C 1 C3H0s 0.770 1.610 2.354 8.406 8.675 0.969 [OK] 795 104 L GLU O 16 O1H0u 0.660 1.420 2.255 13.948 16.023 0.871 [OK] 796 104 L GLU CB 8 C4H2s 0.770 1.880 2.707 20.189 23.529 0.858 [OK] 797 104 L GLU CG 8 C4H2s 0.770 1.880 2.778 21.723 23.513 0.924 [OK] 798 104 L GLU CD 2 C3H0b 0.770 1.610 2.476 9.793 9.460 1.035 [OK] 799 104 L GLU OE1 16 O1H0u 0.660 1.420 2.380 18.902 15.999 1.181 [OK] 800 104 L GLU OE2 16 O1H0u 0.660 1.420 2.321 17.764 17.432 1.019 [OK] 801 105 L VAL N 12 N3H1s 0.700 1.640 2.386 12.664 13.676 0.926 [OK] 802 105 L VAL CA 3 C4H1s 0.770 1.880 2.789 13.848 13.123 1.055 [OK] 803 105 L VAL C 1 C3H0s 0.770 1.610 2.504 8.108 8.563 0.947 [OK] 804 105 L VAL O 16 O1H0u 0.660 1.420 2.092 13.453 16.181 0.831 [OK] 805 105 L VAL CB 4 C4H1b 0.770 1.880 3.240 14.481 14.598 0.992 possible 806 105 L VAL CG1 10 C4H3u 0.770 1.880 16.117 -1.000 36.584 -1.000 bad 807 105 L VAL CG2 10 C4H3u 0.770 1.880 15.039 -1.000 36.332 -1.000 bad 808 106 L GLU N 12 N3H1s 0.700 1.640 2.538 13.507 13.615 0.992 [OK] 809 106 L GLU CA 3 C4H1s 0.770 1.880 2.699 13.306 13.399 0.993 [OK] 810 106 L GLU C 1 C3H0s 0.770 1.610 2.699 8.694 8.675 1.002 [OK] 811 106 L GLU O 16 O1H0u 0.660 1.420 2.918 19.784 16.023 1.235 [OK] 812 106 L GLU CB 8 C4H2s 0.770 1.880 3.245 24.930 23.529 1.060 possible 813 106 L GLU CG 8 C4H2s 0.770 1.880 2.753 23.098 23.513 0.982 [OK] 814 106 L GLU CD 2 C3H0b 0.770 1.610 2.567 10.039 9.460 1.061 [OK] 815 106 L GLU OE1 16 O1H0u 0.660 1.420 2.670 20.712 15.999 1.295 [OK] 816 106 L GLU OE2 16 O1H0u 0.660 1.420 2.313 16.649 17.432 0.955 [OK] 817 107 L ILE N 12 N3H1s 0.700 1.640 2.750 12.626 13.633 0.926 [OK] 818 107 L ILE CA 3 C4H1s 0.770 1.880 3.501 16.972 13.007 1.305 possible 819 107 L ILE C 1 C3H0s 0.770 1.610 2.511 8.419 8.470 0.994 [OK] 820 107 L ILE O 16 O1H0u 0.660 1.420 2.494 16.033 16.144 0.993 [OK] 821 107 L ILE CB 4 C4H1b 0.770 1.880 2.707 13.567 14.227 0.954 [OK] 822 107 L ILE CG1 9 C4H2b 0.770 1.880 3.333 23.400 24.187 0.967 possible 823 107 L ILE CG2 10 C4H3u 0.770 1.880 2.762 31.723 35.961 0.882 [OK] 824 107 L ILE CD1 10 C4H3u 0.770 1.880 2.863 36.580 38.377 0.953 [OK] 825 108 L CYS N 12 N3H1s 0.700 1.640 2.596 12.841 13.981 0.918 [OK] 826 108 L CYS CA 3 C4H1s 0.770 1.880 2.910 14.136 13.656 1.035 [OK] 827 108 L CYS C 1 C3H0s 0.770 1.610 2.814 8.879 8.897 0.998 [OK] 828 108 L CYS O 16 O1H0u 0.660 1.420 3.097 17.440 16.543 1.054 possible 829 108 L CYS CB 9 C4H2b 0.770 1.880 2.801 21.936 23.536 0.932 [OK] 830 108 L CYS SG 20 S2H1u 1.040 1.770 2.758 34.375 34.603 0.993 [OK] 831 109 L ARG N 12 N3H1s 0.700 1.640 2.808 12.913 13.650 0.946 [OK] 832 109 L ARG CA 3 C4H1s 0.770 1.880 3.462 17.024 13.422 1.268 possible 833 109 L ARG C 1 C3H0s 0.770 1.610 2.423 8.462 8.838 0.957 [OK] 834 109 L ARG O 16 O1H0u 0.660 1.420 2.707 18.310 16.084 1.138 [OK] 835 109 L ARG CB 8 C4H2s 0.770 1.880 3.184 23.737 23.088 1.028 possible 836 109 L ARG CG 8 C4H2s 0.770 1.880 3.229 21.906 23.640 0.927 possible 837 109 L ARG CD 8 C4H2s 0.770 1.880 3.554 24.446 23.300 1.049 possible 838 109 L ARG NE 13 N3H1b 0.700 1.640 6.509 36.070 15.569 2.317 possible 839 109 L ARG CZ 2 C3H0b 0.770 1.610 3.019 10.921 9.747 1.120 possible 840 109 L ARG NH1 15 N3H2u 0.700 1.640 4.252 27.368 22.782 1.201 possible 841 109 L ARG NH2 15 N3H2u 0.700 1.640 45.991 -1.000 23.810 -1.000 bad 842 110 L LYS N 12 N3H1s 0.700 1.640 2.373 13.330 13.675 0.975 [OK] 843 110 L LYS CA 3 C4H1s 0.770 1.880 2.574 12.563 13.324 0.943 [OK] 844 110 L LYS C 1 C3H0s 0.770 1.610 2.625 8.649 8.759 0.987 [OK] 845 110 L LYS O 16 O1H0u 0.660 1.420 2.456 16.370 16.049 1.020 [OK] 846 110 L LYS CB 8 C4H2s 0.770 1.880 3.323 26.130 22.904 1.141 possible 847 110 L LYS CG 8 C4H2s 0.770 1.880 3.113 26.268 23.131 1.136 possible 848 110 L LYS CD 8 C4H2s 0.770 1.880 3.436 24.777 23.837 1.039 possible 849 110 L LYS CE 9 C4H2b 0.770 1.880 3.483 27.181 23.934 1.136 possible 850 110 L LYS NZ 14 N4H3u 0.700 1.640 2.815 22.998 21.213 1.084 [OK] 851 111 L LEU N 12 N3H1s 0.700 1.640 2.503 12.540 13.655 0.918 [OK] 852 111 L LEU CA 3 C4H1s 0.770 1.880 3.058 13.532 13.122 1.031 possible 853 111 L LEU C 1 C3H0s 0.770 1.610 2.539 9.292 8.825 1.053 [OK] 854 111 L LEU O 16 O1H0u 0.660 1.420 2.694 15.737 16.208 0.971 [OK] 855 111 L LEU CB 8 C4H2s 0.770 1.880 2.900 22.460 22.951 0.979 [OK] 856 111 L LEU CG 4 C4H1b 0.770 1.880 2.842 13.885 14.764 0.940 [OK] 857 111 L LEU CD1 10 C4H3u 0.770 1.880 2.939 34.888 37.425 0.932 [OK] 858 111 L LEU CD2 10 C4H3u 0.770 1.880 3.059 36.959 37.143 0.995 possible 859 112 L GLY N 12 N3H1s 0.700 1.640 2.484 13.962 14.854 0.940 [OK] 860 112 L GLY CA 8 C4H2s 0.770 1.880 3.234 26.668 23.688 1.126 possible 861 112 L GLY C 2 C3H0b 0.770 1.610 3.083 10.373 9.840 1.054 possible 862 112 L GLY O 16 O1H0u 0.660 1.420 2.467 16.539 16.391 1.009 [OK] 863 113 L ILE N 12 N3H1s 0.700 1.640 2.869 13.416 13.633 0.984 [OK] 864 113 L ILE CA 3 C4H1s 0.770 1.880 2.747 12.660 13.007 0.973 [OK] 865 113 L ILE C 1 C3H0s 0.770 1.610 2.163 8.243 8.470 0.973 [OK] 866 113 L ILE O 16 O1H0u 0.660 1.420 3.057 20.922 16.144 1.296 possible 867 113 L ILE CB 4 C4H1b 0.770 1.880 2.628 13.294 14.227 0.934 [OK] 868 113 L ILE CG1 9 C4H2b 0.770 1.880 2.821 22.490 24.187 0.930 [OK] 869 113 L ILE CG2 10 C4H3u 0.770 1.880 2.961 31.779 35.961 0.884 [OK] 870 113 L ILE CD1 10 C4H3u 0.770 1.880 3.229 46.550 38.377 1.213 possible 871 114 L GLY N 12 N3H1s 0.700 1.640 2.671 13.809 14.854 0.930 [OK] 872 114 L GLY CA 8 C4H2s 0.770 1.880 3.090 22.981 23.688 0.970 possible 873 114 L GLY C 2 C3H0b 0.770 1.610 2.436 9.573 9.840 0.973 [OK] 874 114 L GLY O 16 O1H0u 0.660 1.420 2.158 14.474 16.391 0.883 [OK] 875 115 L TYR N 12 N3H1s 0.700 1.640 2.558 13.199 13.691 0.964 [OK] 876 115 L TYR CA 3 C4H1s 0.770 1.880 2.646 13.564 13.330 1.018 [OK] 877 115 L TYR C 1 C3H0s 0.770 1.610 2.800 10.626 8.770 1.212 [OK] 878 115 L TYR O 16 O1H0u 0.660 1.420 3.714 19.962 16.124 1.238 possible 879 115 L TYR CB 8 C4H2s 0.770 1.880 6.915 54.357 23.678 2.296 possible 880 115 L TYR CG 2 C3H0b 0.770 1.610 5.406 14.011 9.732 1.440 possible 881 115 L TYR CD1 5 C3H1s 0.770 1.760 3.454 21.632 20.171 1.072 possible 882 115 L TYR CD2 5 C3H1s 0.770 1.760 13.132 -1.000 20.728 -1.000 bad 883 115 L TYR CE1 5 C3H1s 0.770 1.760 3.438 21.848 20.675 1.057 possible 884 115 L TYR CE2 5 C3H1s 0.770 1.760 13.816 -1.000 20.810 -1.000 bad 885 115 L TYR CZ 2 C3H0b 0.770 1.610 5.073 15.325 9.926 1.544 possible 886 115 L TYR OH 17 O2H1u 0.660 1.460 6.586 63.882 19.173 3.332 possible 887 116 L HIS N 12 N3H1s 0.700 1.640 2.733 12.654 13.715 0.923 [OK] 888 116 L HIS CA 3 C4H1s 0.770 1.880 3.565 17.852 13.467 1.326 possible 889 116 L HIS C 1 C3H0s 0.770 1.610 2.141 8.140 8.882 0.916 [OK] 890 116 L HIS O 16 O1H0u 0.660 1.420 2.946 18.114 16.082 1.126 [OK] 891 116 L HIS CB 8 C4H2s 0.770 1.880 3.467 23.206 23.653 0.981 possible 892 116 L HIS CG 2 C3H0b 0.770 1.610 3.054 10.894 9.952 1.095 possible 893 116 L HIS ND1 13 N3H1b 0.700 1.640 2.666 16.069 15.506 1.036 [OK] 894 116 L HIS CD2 5 C3H1s 0.770 1.760 3.728 27.664 21.085 1.312 possible 895 116 L HIS CE1 5 C3H1s 0.770 1.760 2.967 24.119 20.636 1.169 [OK] 896 116 L HIS NE2 13 N3H1b 0.700 1.640 2.959 16.693 15.337 1.088 [OK] 897 117 L ILE N 12 N3H1s 0.700 1.640 2.566 12.056 13.633 0.884 [OK] 898 117 L ILE CA 3 C4H1s 0.770 1.880 3.096 13.419 13.007 1.032 possible 899 117 L ILE C 1 C3H0s 0.770 1.610 2.307 8.035 8.470 0.949 [OK] 900 117 L ILE O 16 O1H0u 0.660 1.420 2.369 15.295 16.144 0.947 [OK] 901 117 L ILE CB 4 C4H1b 0.770 1.880 2.754 12.341 14.227 0.867 [OK] 902 117 L ILE CG1 9 C4H2b 0.770 1.880 2.986 22.508 24.187 0.931 [OK] 903 117 L ILE CG2 10 C4H3u 0.770 1.880 3.112 33.215 35.961 0.924 possible 904 117 L ILE CD1 10 C4H3u 0.770 1.880 3.228 36.790 38.377 0.959 possible 905 118 L PRO N 11 N3H0u 0.700 1.640 2.343 8.441 8.823 0.957 [OK] 906 118 L PRO CA 4 C4H1b 0.770 1.880 2.814 14.248 13.955 1.021 [OK] 907 118 L PRO C 1 C3H0s 0.770 1.610 4.483 10.144 8.812 1.151 possible 908 118 L PRO O 16 O1H0u 0.660 1.420 4.458 22.940 16.169 1.419 possible 909 118 L PRO CB 9 C4H2b 0.770 1.880 4.617 30.368 25.563 1.188 possible 910 118 L PRO CG 9 C4H2b 0.770 1.880 3.959 27.020 25.832 1.046 possible 911 118 L PRO CD 8 C4H2s 0.770 1.880 2.793 23.549 23.836 0.988 [OK] 912 119 L PHE N 12 N3H1s 0.700 1.640 4.500 18.761 13.691 1.370 possible 913 119 L PHE CA 3 C4H1s 0.770 1.880 5.763 24.751 13.449 1.840 possible 914 119 L PHE C 1 C3H0s 0.770 1.610 2.250 7.958 8.753 0.909 [OK] 915 119 L PHE O 16 O1H0u 0.660 1.420 3.040 18.508 16.151 1.146 possible 916 119 L PHE CB 8 C4H2s 0.770 1.880 4.994 33.049 23.777 1.390 possible 917 119 L PHE CG 2 C3H0b 0.770 1.610 3.363 12.390 9.721 1.275 possible 918 119 L PHE CD1 5 C3H1s 0.770 1.760 22.977 -1.000 20.405 -1.000 bad 919 119 L PHE CD2 6 C3H1b 0.770 1.760 3.740 35.502 21.051 1.686 possible 920 119 L PHE CE1 6 C3H1b 0.770 1.760 34.475 -1.000 21.580 -1.000 bad 921 119 L PHE CE2 6 C3H1b 0.770 1.760 5.214 49.389 21.680 2.278 possible 922 119 L PHE CZ 6 C3H1b 0.770 1.760 25.343 -1.000 21.666 -1.000 bad 923 120 L ALA N 12 N3H1s 0.700 1.640 2.872 13.149 14.046 0.936 [OK] 924 120 L ALA CA 4 C4H1b 0.770 1.880 3.011 15.407 14.063 1.096 possible 925 120 L ALA C 1 C3H0s 0.770 1.610 2.469 8.505 8.900 0.956 [OK] 926 120 L ALA O 16 O1H0u 0.660 1.420 2.514 16.874 16.188 1.042 [OK] 927 120 L ALA CB 10 C4H3u 0.770 1.880 3.330 37.115 36.782 1.009 possible 928 121 L PHE N 12 N3H1s 0.700 1.640 2.314 12.388 13.691 0.905 [OK] 929 121 L PHE CA 3 C4H1s 0.770 1.880 2.774 13.651 13.449 1.015 [OK] 930 121 L PHE C 1 C3H0s 0.770 1.610 2.437 8.342 8.753 0.953 [OK] 931 121 L PHE O 16 O1H0u 0.660 1.420 2.350 14.250 16.151 0.882 [OK] 932 121 L PHE CB 8 C4H2s 0.770 1.880 2.867 23.098 23.777 0.971 [OK] 933 121 L PHE CG 2 C3H0b 0.770 1.610 2.480 9.838 9.721 1.012 [OK] 934 121 L PHE CD1 5 C3H1s 0.770 1.760 2.816 18.038 20.405 0.884 [OK] 935 121 L PHE CD2 6 C3H1b 0.770 1.760 2.861 21.295 21.051 1.012 [OK] 936 121 L PHE CE1 6 C3H1b 0.770 1.760 3.051 21.266 21.580 0.985 possible 937 121 L PHE CE2 6 C3H1b 0.770 1.760 2.464 17.556 21.680 0.810 [OK] 938 121 L PHE CZ 6 C3H1b 0.770 1.760 2.746 20.547 21.666 0.948 [OK] 939 122 L ALA N 12 N3H1s 0.700 1.640 2.801 14.694 14.046 1.046 [OK] 940 122 L ALA CA 4 C4H1b 0.770 1.880 3.422 15.755 14.063 1.120 possible 941 122 L ALA C 1 C3H0s 0.770 1.610 2.931 8.839 8.900 0.993 [OK] 942 122 L ALA O 16 O1H0u 0.660 1.420 3.151 16.433 16.188 1.015 possible 943 122 L ALA CB 10 C4H3u 0.770 1.880 34.524 -1.000 36.782 -1.000 bad 944 123 L PHE N 12 N3H1s 0.700 1.640 2.873 13.645 13.691 0.997 [OK] 945 123 L PHE CA 3 C4H1s 0.770 1.880 3.452 16.017 13.449 1.191 possible 946 123 L PHE C 1 C3H0s 0.770 1.610 2.146 8.148 8.753 0.931 [OK] 947 123 L PHE O 16 O1H0u 0.660 1.420 3.387 18.450 16.151 1.142 possible 948 123 L PHE CB 8 C4H2s 0.770 1.880 2.982 22.288 23.777 0.937 [OK] 949 123 L PHE CG 2 C3H0b 0.770 1.610 2.994 10.431 9.721 1.073 [OK] 950 123 L PHE CD1 5 C3H1s 0.770 1.760 3.436 23.296 20.405 1.142 possible 951 123 L PHE CD2 6 C3H1b 0.770 1.760 3.877 29.558 21.051 1.404 possible 952 123 L PHE CE1 6 C3H1b 0.770 1.760 4.956 32.254 21.580 1.495 possible 953 123 L PHE CE2 6 C3H1b 0.770 1.760 5.636 43.108 21.680 1.988 possible 954 123 L PHE CZ 6 C3H1b 0.770 1.760 26.302 -1.000 21.666 -1.000 bad 955 124 L ALA N 12 N3H1s 0.700 1.640 2.452 12.170 14.046 0.866 [OK] 956 124 L ALA CA 4 C4H1b 0.770 1.880 3.017 15.394 14.063 1.095 possible 957 124 L ALA C 1 C3H0s 0.770 1.610 2.022 7.911 8.900 0.889 [OK] 958 124 L ALA O 16 O1H0u 0.660 1.420 2.245 14.235 16.188 0.879 [OK] 959 124 L ALA CB 10 C4H3u 0.770 1.880 3.228 37.246 36.782 1.013 possible 960 125 L ILE N 12 N3H1s 0.700 1.640 2.546 12.665 13.633 0.929 [OK] 961 125 L ILE CA 3 C4H1s 0.770 1.880 2.915 13.694 13.007 1.053 [OK] 962 125 L ILE C 1 C3H0s 0.770 1.610 2.489 7.840 8.470 0.926 [OK] 963 125 L ILE O 16 O1H0u 0.660 1.420 2.385 14.754 16.144 0.914 [OK] 964 125 L ILE CB 4 C4H1b 0.770 1.880 3.530 14.774 14.227 1.038 possible 965 125 L ILE CG1 9 C4H2b 0.770 1.880 2.780 22.610 24.187 0.935 [OK] 966 125 L ILE CG2 10 C4H3u 0.770 1.880 4.361 49.381 35.961 1.373 possible 967 125 L ILE CD1 10 C4H3u 0.770 1.880 4.285 43.446 38.377 1.132 possible 968 126 L LEU N 12 N3H1s 0.700 1.640 2.564 12.725 13.655 0.932 [OK] 969 126 L LEU CA 3 C4H1s 0.770 1.880 2.735 13.015 13.122 0.992 [OK] 970 126 L LEU C 1 C3H0s 0.770 1.610 2.969 9.155 8.825 1.037 [OK] 971 126 L LEU O 16 O1H0u 0.660 1.420 3.000 17.459 16.208 1.077 possible 972 126 L LEU CB 8 C4H2s 0.770 1.880 4.508 35.056 22.951 1.527 possible 973 126 L LEU CG 4 C4H1b 0.770 1.880 6.759 43.862 14.764 2.971 possible 974 126 L LEU CD1 10 C4H3u 0.770 1.880 27.156 -1.000 37.425 -1.000 bad 975 126 L LEU CD2 10 C4H3u 0.770 1.880 44.998 -1.000 37.143 -1.000 bad 976 127 L ALA N 12 N3H1s 0.700 1.640 3.242 14.362 14.046 1.022 possible 977 127 L ALA CA 4 C4H1b 0.770 1.880 3.097 15.431 14.063 1.097 possible 978 127 L ALA C 1 C3H0s 0.770 1.610 2.527 8.467 8.900 0.951 [OK] 979 127 L ALA O 16 O1H0u 0.660 1.420 2.502 16.975 16.188 1.049 [OK] 980 127 L ALA CB 10 C4H3u 0.770 1.880 3.227 37.323 36.782 1.015 possible 981 128 L TYR N 12 N3H1s 0.700 1.640 2.337 12.620 13.691 0.922 [OK] 982 128 L TYR CA 3 C4H1s 0.770 1.880 3.185 16.009 13.330 1.201 possible 983 128 L TYR C 1 C3H0s 0.770 1.610 2.418 7.962 8.770 0.908 [OK] 984 128 L TYR O 16 O1H0u 0.660 1.420 2.510 15.767 16.124 0.978 [OK] 985 128 L TYR CB 8 C4H2s 0.770 1.880 2.839 22.654 23.678 0.957 [OK] 986 128 L TYR CG 2 C3H0b 0.770 1.610 2.527 10.058 9.732 1.033 [OK] 987 128 L TYR CD1 5 C3H1s 0.770 1.760 2.997 21.147 20.171 1.048 [OK] 988 128 L TYR CD2 5 C3H1s 0.770 1.760 3.055 20.519 20.728 0.990 possible 989 128 L TYR CE1 5 C3H1s 0.770 1.760 2.876 21.812 20.675 1.055 [OK] 990 128 L TYR CE2 5 C3H1s 0.770 1.760 2.843 20.862 20.810 1.002 [OK] 991 128 L TYR CZ 2 C3H0b 0.770 1.610 2.520 10.144 9.926 1.022 [OK] 992 128 L TYR OH 17 O2H1u 0.660 1.460 2.540 19.418 19.173 1.013 [OK] 993 129 L LEU N 12 N3H1s 0.700 1.640 2.443 12.253 13.655 0.897 [OK] 994 129 L LEU CA 3 C4H1s 0.770 1.880 2.680 13.076 13.122 0.997 [OK] 995 129 L LEU C 1 C3H0s 0.770 1.610 2.320 8.546 8.825 0.968 [OK] 996 129 L LEU O 16 O1H0u 0.660 1.420 2.354 14.014 16.208 0.865 [OK] 997 129 L LEU CB 8 C4H2s 0.770 1.880 2.780 20.699 22.951 0.902 [OK] 998 129 L LEU CG 4 C4H1b 0.770 1.880 3.131 15.372 14.764 1.041 possible 999 129 L LEU CD1 10 C4H3u 0.770 1.880 3.653 37.888 37.425 1.012 possible 1000 129 L LEU CD2 10 C4H3u 0.770 1.880 15.809 -1.000 37.143 -1.000 bad 1001 130 L THR N 12 N3H1s 0.700 1.640 2.315 11.836 13.832 0.856 [OK] 1002 130 L THR CA 3 C4H1s 0.770 1.880 2.613 12.375 13.099 0.945 [OK] 1003 130 L THR C 1 C3H0s 0.770 1.610 2.708 8.178 8.738 0.936 [OK] 1004 130 L THR O 16 O1H0u 0.660 1.420 2.697 16.079 16.020 1.004 [OK] 1005 130 L THR CB 4 C4H1b 0.770 1.880 2.944 14.584 14.829 0.983 [OK] 1006 130 L THR OG1 17 O2H1u 0.660 1.460 4.908 32.393 18.123 1.787 possible 1007 130 L THR CG2 10 C4H3u 0.770 1.880 3.317 39.209 36.542 1.073 possible 1008 131 L LEU N 12 N3H1s 0.700 1.640 2.536 12.484 13.655 0.914 [OK] 1009 131 L LEU CA 3 C4H1s 0.770 1.880 3.055 14.402 13.122 1.098 possible 1010 131 L LEU C 1 C3H0s 0.770 1.610 2.408 9.036 8.825 1.024 [OK] 1011 131 L LEU O 16 O1H0u 0.660 1.420 2.491 17.601 16.208 1.086 [OK] 1012 131 L LEU CB 8 C4H2s 0.770 1.880 2.950 22.256 22.951 0.970 [OK] 1013 131 L LEU CG 4 C4H1b 0.770 1.880 2.840 14.360 14.764 0.973 [OK] 1014 131 L LEU CD1 10 C4H3u 0.770 1.880 3.140 38.376 37.425 1.025 possible 1015 131 L LEU CD2 10 C4H3u 0.770 1.880 3.134 35.725 37.143 0.962 possible 1016 132 L VAL N 12 N3H1s 0.700 1.640 2.477 12.927 13.676 0.945 [OK] 1017 132 L VAL CA 3 C4H1s 0.770 1.880 2.455 12.335 13.123 0.940 [OK] 1018 132 L VAL C 1 C3H0s 0.770 1.610 2.327 8.257 8.563 0.964 [OK] 1019 132 L VAL O 16 O1H0u 0.660 1.420 3.137 22.012 16.181 1.360 possible 1020 132 L VAL CB 4 C4H1b 0.770 1.880 2.752 13.307 14.598 0.912 [OK] 1021 132 L VAL CG1 10 C4H3u 0.770 1.880 3.697 38.235 36.584 1.045 possible 1022 132 L VAL CG2 10 C4H3u 0.770 1.880 3.008 34.249 36.332 0.943 possible 1023 133 L LEU N 12 N3H1s 0.700 1.640 2.383 13.483 13.655 0.987 [OK] 1024 133 L LEU CA 3 C4H1s 0.770 1.880 3.067 13.586 13.122 1.035 possible 1025 133 L LEU C 1 C3H0s 0.770 1.610 2.828 8.684 8.825 0.984 [OK] 1026 133 L LEU O 16 O1H0u 0.660 1.420 2.744 15.179 16.208 0.937 [OK] 1027 133 L LEU CB 8 C4H2s 0.770 1.880 3.740 26.217 22.951 1.142 possible 1028 133 L LEU CG 4 C4H1b 0.770 1.880 4.044 17.630 14.764 1.194 possible 1029 133 L LEU CD1 10 C4H3u 0.770 1.880 30.192 -1.000 37.425 -1.000 bad 1030 133 L LEU CD2 10 C4H3u 0.770 1.880 30.410 -1.000 37.143 -1.000 bad 1031 134 L PHE N 12 N3H1s 0.700 1.640 2.621 13.096 13.691 0.957 [OK] 1032 134 L PHE CA 3 C4H1s 0.770 1.880 3.829 16.428 13.449 1.222 possible 1033 134 L PHE C 1 C3H0s 0.770 1.610 2.439 8.656 8.753 0.989 [OK] 1034 134 L PHE O 16 O1H0u 0.660 1.420 3.713 20.473 16.151 1.268 possible 1035 134 L PHE CB 8 C4H2s 0.770 1.880 4.354 27.764 23.777 1.168 possible 1036 134 L PHE CG 2 C3H0b 0.770 1.610 5.127 13.800 9.721 1.420 possible 1037 134 L PHE CD1 5 C3H1s 0.770 1.760 18.063 -1.000 20.405 -1.000 bad 1038 134 L PHE CD2 6 C3H1b 0.770 1.760 5.371 30.475 21.051 1.448 possible 1039 134 L PHE CE1 6 C3H1b 0.770 1.760 23.378 -1.000 21.580 -1.000 bad 1040 134 L PHE CE2 6 C3H1b 0.770 1.760 7.530 41.983 21.680 1.936 possible 1041 134 L PHE CZ 6 C3H1b 0.770 1.760 18.966 -1.000 21.666 -1.000 bad 1042 135 L ARG N 12 N3H1s 0.700 1.640 2.520 13.974 13.650 1.024 [OK] 1043 135 L ARG CA 3 C4H1s 0.770 1.880 3.019 15.051 13.422 1.121 possible 1044 135 L ARG C 1 C3H0s 0.770 1.610 2.829 8.997 8.838 1.018 [OK] 1045 135 L ARG O 16 O1H0u 0.660 1.420 2.452 14.825 16.084 0.922 [OK] 1046 135 L ARG CB 8 C4H2s 0.770 1.880 3.134 24.633 23.088 1.067 possible 1047 135 L ARG CG 8 C4H2s 0.770 1.880 3.040 26.392 23.640 1.116 possible 1048 135 L ARG CD 8 C4H2s 0.770 1.880 3.127 23.223 23.300 0.997 possible 1049 135 L ARG NE 13 N3H1b 0.700 1.640 2.905 17.360 15.569 1.115 [OK] 1050 135 L ARG CZ 2 C3H0b 0.770 1.610 2.498 9.299 9.747 0.954 [OK] 1051 135 L ARG NH1 15 N3H2u 0.700 1.640 2.734 26.636 22.782 1.169 [OK] 1052 135 L ARG NH2 15 N3H2u 0.700 1.640 2.680 26.518 23.810 1.114 [OK] 1053 136 L PRO N 11 N3H0u 0.700 1.640 2.901 9.658 8.823 1.095 [OK] 1054 136 L PRO CA 4 C4H1b 0.770 1.880 2.873 14.659 13.955 1.050 [OK] 1055 136 L PRO C 1 C3H0s 0.770 1.610 2.438 8.585 8.812 0.974 [OK] 1056 136 L PRO O 16 O1H0u 0.660 1.420 2.353 14.544 16.169 0.899 [OK] 1057 136 L PRO CB 9 C4H2b 0.770 1.880 3.108 24.939 25.563 0.976 possible 1058 136 L PRO CG 9 C4H2b 0.770 1.880 3.119 25.365 25.832 0.982 possible 1059 136 L PRO CD 8 C4H2s 0.770 1.880 2.802 22.025 23.836 0.924 [OK] 1060 137 L VAL N 12 N3H1s 0.700 1.640 2.453 13.450 13.676 0.983 [OK] 1061 137 L VAL CA 3 C4H1s 0.770 1.880 2.443 11.552 13.123 0.880 [OK] 1062 137 L VAL C 1 C3H0s 0.770 1.610 2.835 7.981 8.563 0.932 [OK] 1063 137 L VAL O 16 O1H0u 0.660 1.420 8.162 -1.000 16.181 -1.000 bad 1064 137 L VAL CB 4 C4H1b 0.770 1.880 3.829 18.862 14.598 1.292 possible 1065 137 L VAL CG1 10 C4H3u 0.770 1.880 47.763 -1.000 36.584 -1.000 bad 1066 137 L VAL CG2 10 C4H3u 0.770 1.880 7.613 55.496 36.332 1.527 possible 1067 138 L MET N 12 N3H1s 0.700 1.640 3.066 14.637 13.564 1.079 possible 1068 138 L MET CA 3 C4H1s 0.770 1.880 7.930 -1.000 13.231 -1.000 bad 1069 138 L MET C 1 C3H0s 0.770 1.610 2.454 8.622 8.782 0.982 [OK] 1070 138 L MET O 16 O1H0u 0.660 1.420 27.364 -1.000 16.277 -1.000 bad 1071 138 L MET CB 8 C4H2s 0.770 1.880 3.305 22.082 23.645 0.934 possible 1072 138 L MET CG 9 C4H2b 0.770 1.880 25.985 -1.000 24.009 -1.000 bad 1073 138 L MET SD 19 S2H0u 1.040 1.770 8.294 -1.000 30.093 -1.000 bad 1074 138 L MET CE 10 C4H3u 0.770 1.880 45.028 -1.000 37.161 -1.000 bad 1075 139 L MET N 12 N3H1s 0.700 1.640 2.338 11.899 13.564 0.877 [OK] 1076 139 L MET CA 3 C4H1s 0.770 1.880 4.630 18.984 13.231 1.435 possible 1077 139 L MET C 1 C3H0s 0.770 1.610 4.156 11.372 8.782 1.295 possible 1078 139 L MET O 16 O1H0u 0.660 1.420 22.967 -1.000 16.277 -1.000 bad 1079 139 L MET CB 8 C4H2s 0.770 1.880 3.718 24.768 23.645 1.048 possible 1080 139 L MET CG 9 C4H2b 0.770 1.880 3.879 25.519 24.009 1.063 possible 1081 139 L MET SD 19 S2H0u 1.040 1.770 3.052 30.424 30.093 1.011 possible 1082 139 L MET CE 10 C4H3u 0.770 1.880 5.296 60.123 37.161 1.618 possible 1083 140 L GLY N 12 N3H1s 0.700 1.640 4.027 15.511 14.854 1.044 possible 1084 140 L GLY CA 8 C4H2s 0.770 1.880 25.149 -1.000 23.688 -1.000 bad 1085 140 L GLY C 2 C3H0b 0.770 1.610 3.506 10.730 9.840 1.090 possible 1086 140 L GLY O 16 O1H0u 0.660 1.420 11.295 -1.000 16.391 -1.000 bad 1087 141 L ALA N 12 N3H1s 0.700 1.640 2.673 15.115 14.046 1.076 [OK] 1088 141 L ALA CA 4 C4H1b 0.770 1.880 2.403 11.927 14.063 0.848 [OK] 1089 141 L ALA C 1 C3H0s 0.770 1.610 2.429 8.815 8.900 0.990 [OK] 1090 141 L ALA O 16 O1H0u 0.660 1.420 2.338 15.917 16.188 0.983 [OK] 1091 141 L ALA CB 10 C4H3u 0.770 1.880 5.679 47.101 36.782 1.281 possible 1092 142 L TRP N 12 N3H1s 0.700 1.640 2.482 13.139 13.791 0.953 [OK] 1093 142 L TRP CA 3 C4H1s 0.770 1.880 2.997 13.639 13.377 1.020 [OK] 1094 142 L TRP C 1 C3H0s 0.770 1.610 2.429 8.769 8.724 1.005 [OK] 1095 142 L TRP O 16 O1H0u 0.660 1.420 2.703 17.269 15.951 1.083 [OK] 1096 142 L TRP CB 8 C4H2s 0.770 1.880 2.984 24.412 24.004 1.017 [OK] 1097 142 L TRP CG 2 C3H0b 0.770 1.610 2.691 10.778 9.965 1.082 [OK] 1098 142 L TRP CD1 5 C3H1s 0.770 1.760 2.838 21.536 20.874 1.032 [OK] 1099 142 L TRP CD2 2 C3H0b 0.770 1.610 3.440 11.380 10.097 1.127 possible 1100 142 L TRP NE1 13 N3H1b 0.700 1.640 4.091 19.055 16.969 1.123 possible 1101 142 L TRP CE2 2 C3H0b 0.770 1.610 3.533 11.407 9.889 1.154 possible 1102 142 L TRP CE3 6 C3H1b 0.770 1.760 3.571 24.047 20.448 1.176 possible 1103 142 L TRP CZ2 6 C3H1b 0.770 1.760 23.098 -1.000 21.012 -1.000 bad 1104 142 L TRP CZ3 6 C3H1b 0.770 1.760 3.860 27.224 21.516 1.265 possible 1105 142 L TRP CH2 6 C3H1b 0.770 1.760 14.644 -1.000 21.339 -1.000 bad 1106 143 L GLY N 12 N3H1s 0.700 1.640 2.446 13.854 14.854 0.933 [OK] 1107 143 L GLY CA 8 C4H2s 0.770 1.880 3.802 27.869 23.688 1.177 possible 1108 143 L GLY C 2 C3H0b 0.770 1.610 2.616 9.636 9.840 0.979 [OK] 1109 143 L GLY O 16 O1H0u 0.660 1.420 7.252 71.546 16.391 4.365 possible 1110 144 L TYR N 12 N3H1s 0.700 1.640 2.561 14.337 13.691 1.047 [OK] 1111 144 L TYR CA 3 C4H1s 0.770 1.880 3.695 15.631 13.330 1.173 possible 1112 144 L TYR C 1 C3H0s 0.770 1.610 2.762 9.529 8.770 1.087 [OK] 1113 144 L TYR O 16 O1H0u 0.660 1.420 3.016 17.634 16.124 1.094 possible 1114 144 L TYR CB 8 C4H2s 0.770 1.880 3.156 27.231 23.678 1.150 possible 1115 144 L TYR CG 2 C3H0b 0.770 1.610 2.465 9.560 9.732 0.982 [OK] 1116 144 L TYR CD1 5 C3H1s 0.770 1.760 5.546 31.691 20.171 1.571 possible 1117 144 L TYR CD2 5 C3H1s 0.770 1.760 2.673 19.256 20.728 0.929 [OK] 1118 144 L TYR CE1 5 C3H1s 0.770 1.760 6.249 54.633 20.675 2.642 possible 1119 144 L TYR CE2 5 C3H1s 0.770 1.760 4.252 27.079 20.810 1.301 possible 1120 144 L TYR CZ 2 C3H0b 0.770 1.610 3.070 10.341 9.926 1.042 possible 1121 144 L TYR OH 17 O2H1u 0.660 1.460 34.691 -1.000 19.173 -1.000 bad 1122 145 L ALA N 12 N3H1s 0.700 1.640 2.536 13.732 14.046 0.978 [OK] 1123 145 L ALA CA 4 C4H1b 0.770 1.880 2.855 13.694 14.063 0.974 [OK] 1124 145 L ALA C 1 C3H0s 0.770 1.610 2.554 9.413 8.900 1.058 [OK] 1125 145 L ALA O 16 O1H0u 0.660 1.420 3.660 19.518 16.188 1.206 possible 1126 145 L ALA CB 10 C4H3u 0.770 1.880 3.164 33.092 36.782 0.900 possible 1127 146 L PHE N 12 N3H1s 0.700 1.640 2.803 16.193 13.691 1.183 [OK] 1128 146 L PHE CA 3 C4H1s 0.770 1.880 2.294 11.134 13.449 0.828 [OK] 1129 146 L PHE C 1 C3H0s 0.770 1.610 2.347 8.887 8.753 1.015 [OK] 1130 146 L PHE O 16 O1H0u 0.660 1.420 2.424 18.144 16.151 1.123 [OK] 1131 146 L PHE CB 8 C4H2s 0.770 1.880 3.074 23.290 23.777 0.980 possible 1132 146 L PHE CG 2 C3H0b 0.770 1.610 2.677 10.082 9.721 1.037 [OK] 1133 146 L PHE CD1 5 C3H1s 0.770 1.760 2.914 22.425 20.405 1.099 [OK] 1134 146 L PHE CD2 6 C3H1b 0.770 1.760 2.795 20.342 21.051 0.966 [OK] 1135 146 L PHE CE1 6 C3H1b 0.770 1.760 3.011 21.428 21.580 0.993 possible 1136 146 L PHE CE2 6 C3H1b 0.770 1.760 2.854 21.348 21.680 0.985 [OK] 1137 146 L PHE CZ 6 C3H1b 0.770 1.760 3.011 22.099 21.666 1.020 possible 1138 147 L PRO N 11 N3H0u 0.700 1.640 2.448 8.279 8.823 0.938 [OK] 1139 147 L PRO CA 4 C4H1b 0.770 1.880 2.583 12.965 13.955 0.929 [OK] 1140 147 L PRO C 1 C3H0s 0.770 1.610 2.485 8.943 8.812 1.015 [OK] 1141 147 L PRO O 16 O1H0u 0.660 1.420 2.316 16.911 16.169 1.046 [OK] 1142 147 L PRO CB 9 C4H2b 0.770 1.880 2.860 25.790 25.563 1.009 [OK] 1143 147 L PRO CG 9 C4H2b 0.770 1.880 3.843 28.236 25.832 1.093 possible 1144 147 L PRO CD 8 C4H2s 0.770 1.880 4.514 32.836 23.836 1.378 possible 1145 148 L TYR N 12 N3H1s 0.700 1.640 2.700 14.522 13.691 1.061 [OK] 1146 148 L TYR CA 3 C4H1s 0.770 1.880 2.609 12.712 13.330 0.954 [OK] 1147 148 L TYR C 1 C3H0s 0.770 1.610 2.990 10.074 8.770 1.149 [OK] 1148 148 L TYR O 16 O1H0u 0.660 1.420 4.069 25.775 16.124 1.599 possible 1149 148 L TYR CB 8 C4H2s 0.770 1.880 3.706 29.092 23.678 1.229 possible 1150 148 L TYR CG 2 C3H0b 0.770 1.610 2.535 9.948 9.732 1.022 [OK] 1151 148 L TYR CD1 5 C3H1s 0.770 1.760 2.667 18.717 20.171 0.928 [OK] 1152 148 L TYR CD2 5 C3H1s 0.770 1.760 2.954 24.124 20.728 1.164 [OK] 1153 148 L TYR CE1 5 C3H1s 0.770 1.760 2.841 21.762 20.675 1.053 [OK] 1154 148 L TYR CE2 5 C3H1s 0.770 1.760 2.876 22.052 20.810 1.060 [OK] 1155 148 L TYR CZ 2 C3H0b 0.770 1.610 2.446 9.337 9.926 0.941 [OK] 1156 148 L TYR OH 17 O2H1u 0.660 1.460 2.482 17.088 19.173 0.891 [OK] 1157 149 L GLY N 12 N3H1s 0.700 1.640 2.828 16.695 14.854 1.124 [OK] 1158 149 L GLY CA 8 C4H2s 0.770 1.880 4.690 27.702 23.688 1.169 possible 1159 149 L GLY C 2 C3H0b 0.770 1.610 2.620 9.297 9.840 0.945 [OK] 1160 149 L GLY O 16 O1H0u 0.660 1.420 2.300 14.695 16.391 0.897 [OK] 1161 150 L ILE N 12 N3H1s 0.700 1.640 3.447 14.363 13.633 1.054 possible 1162 150 L ILE CA 3 C4H1s 0.770 1.880 3.114 13.678 13.007 1.052 possible 1163 150 L ILE C 1 C3H0s 0.770 1.610 2.521 7.948 8.470 0.938 [OK] 1164 150 L ILE O 16 O1H0u 0.660 1.420 2.647 16.730 16.144 1.036 [OK] 1165 150 L ILE CB 4 C4H1b 0.770 1.880 2.777 14.344 14.227 1.008 [OK] 1166 150 L ILE CG1 9 C4H2b 0.770 1.880 4.790 37.016 24.187 1.530 possible 1167 150 L ILE CG2 10 C4H3u 0.770 1.880 5.883 51.972 35.961 1.445 possible 1168 150 L ILE CD1 10 C4H3u 0.770 1.880 6.891 89.698 38.377 2.337 possible 1169 151 L TRP N 12 N3H1s 0.700 1.640 2.555 12.488 13.791 0.905 [OK] 1170 151 L TRP CA 3 C4H1s 0.770 1.880 2.706 13.119 13.377 0.981 [OK] 1171 151 L TRP C 1 C3H0s 0.770 1.610 2.429 9.347 8.724 1.071 [OK] 1172 151 L TRP O 16 O1H0u 0.660 1.420 2.761 17.902 15.951 1.122 [OK] 1173 151 L TRP CB 8 C4H2s 0.770 1.880 4.502 37.633 24.004 1.568 possible 1174 151 L TRP CG 2 C3H0b 0.770 1.610 5.139 15.414 9.965 1.547 possible 1175 151 L TRP CD1 5 C3H1s 0.770 1.760 6.088 34.122 20.874 1.635 possible 1176 151 L TRP CD2 2 C3H0b 0.770 1.610 4.409 14.041 10.097 1.391 possible 1177 151 L TRP NE1 13 N3H1b 0.700 1.640 6.734 29.488 16.969 1.738 possible 1178 151 L TRP CE2 2 C3H0b 0.770 1.610 5.060 16.382 9.889 1.657 possible 1179 151 L TRP CE3 6 C3H1b 0.770 1.760 3.228 24.224 20.448 1.185 possible 1180 151 L TRP CZ2 6 C3H1b 0.770 1.760 6.427 81.730 21.012 3.890 possible 1181 151 L TRP CZ3 6 C3H1b 0.770 1.760 3.293 23.094 21.516 1.073 possible 1182 151 L TRP CH2 6 C3H1b 0.770 1.760 4.713 51.938 21.339 2.434 possible 1183 152 L THR N 12 N3H1s 0.700 1.640 2.707 13.102 13.832 0.947 [OK] 1184 152 L THR CA 3 C4H1s 0.770 1.880 2.652 13.017 13.099 0.994 [OK] 1185 152 L THR C 1 C3H0s 0.770 1.610 2.158 8.165 8.738 0.934 [OK] 1186 152 L THR O 16 O1H0u 0.660 1.420 2.879 15.590 16.020 0.973 [OK] 1187 152 L THR CB 4 C4H1b 0.770 1.880 2.703 14.501 14.829 0.978 [OK] 1188 152 L THR OG1 17 O2H1u 0.660 1.460 2.432 16.849 18.123 0.930 [OK] 1189 152 L THR CG2 10 C4H3u 0.770 1.880 3.920 44.119 36.542 1.207 possible 1190 153 L HIS N 12 N3H1s 0.700 1.640 2.532 14.391 13.715 1.049 [OK] 1191 153 L HIS CA 3 C4H1s 0.770 1.880 2.749 14.462 13.467 1.074 [OK] 1192 153 L HIS C 1 C3H0s 0.770 1.610 2.604 8.662 8.882 0.975 [OK] 1193 153 L HIS O 16 O1H0u 0.660 1.420 2.600 15.825 16.082 0.984 [OK] 1194 153 L HIS CB 8 C4H2s 0.770 1.880 3.114 24.312 23.653 1.028 possible 1195 153 L HIS CG 2 C3H0b 0.770 1.610 2.375 9.700 9.952 0.975 [OK] 1196 153 L HIS ND1 13 N3H1b 0.700 1.640 2.290 13.886 15.506 0.895 [OK] 1197 153 L HIS CD2 5 C3H1s 0.770 1.760 2.975 21.439 21.085 1.017 [OK] 1198 153 L HIS CE1 5 C3H1s 0.770 1.760 2.999 21.209 20.636 1.028 [OK] 1199 153 L HIS NE2 13 N3H1b 0.700 1.640 2.353 11.216 15.337 0.731 [OK] 1200 154 L LEU N 12 N3H1s 0.700 1.640 2.486 13.385 13.655 0.980 [OK] 1201 154 L LEU CA 3 C4H1s 0.770 1.880 3.031 13.735 13.122 1.047 possible 1202 154 L LEU C 1 C3H0s 0.770 1.610 2.514 8.697 8.825 0.986 [OK] 1203 154 L LEU O 16 O1H0u 0.660 1.420 2.417 15.467 16.208 0.954 [OK] 1204 154 L LEU CB 8 C4H2s 0.770 1.880 2.865 23.312 22.951 1.016 [OK] 1205 154 L LEU CG 4 C4H1b 0.770 1.880 2.807 14.977 14.764 1.014 [OK] 1206 154 L LEU CD1 10 C4H3u 0.770 1.880 3.387 38.348 37.425 1.025 possible 1207 154 L LEU CD2 10 C4H3u 0.770 1.880 3.037 32.130 37.143 0.865 possible 1208 155 L ASP N 12 N3H1s 0.700 1.640 2.555 13.847 13.895 0.997 [OK] 1209 155 L ASP CA 3 C4H1s 0.770 1.880 2.971 15.006 13.377 1.122 [OK] 1210 155 L ASP C 1 C3H0s 0.770 1.610 2.742 8.354 8.816 0.948 [OK] 1211 155 L ASP O 16 O1H0u 0.660 1.420 2.658 15.694 16.091 0.975 [OK] 1212 155 L ASP CB 8 C4H2s 0.770 1.880 4.106 30.717 23.481 1.308 possible 1213 155 L ASP CG 2 C3H0b 0.770 1.610 4.384 12.413 9.422 1.317 possible 1214 155 L ASP OD1 16 O1H0u 0.660 1.420 3.669 26.533 15.505 1.711 possible 1215 155 L ASP OD2 16 O1H0u 0.660 1.420 10.571 -1.000 16.324 -1.000 bad 1216 156 L TRP N 12 N3H1s 0.700 1.640 3.488 15.212 13.791 1.103 possible 1217 156 L TRP CA 3 C4H1s 0.770 1.880 4.388 20.589 13.377 1.539 possible 1218 156 L TRP C 1 C3H0s 0.770 1.610 2.056 7.774 8.724 0.891 [OK] 1219 156 L TRP O 16 O1H0u 0.660 1.420 2.954 15.273 15.951 0.957 [OK] 1220 156 L TRP CB 8 C4H2s 0.770 1.880 4.246 23.709 24.004 0.988 possible 1221 156 L TRP CG 2 C3H0b 0.770 1.610 2.248 8.943 9.965 0.897 [OK] 1222 156 L TRP CD1 5 C3H1s 0.770 1.760 5.605 53.068 20.874 2.542 possible 1223 156 L TRP CD2 2 C3H0b 0.770 1.610 2.336 9.162 10.097 0.907 [OK] 1224 156 L TRP NE1 13 N3H1b 0.700 1.640 4.006 21.141 16.969 1.246 possible 1225 156 L TRP CE2 2 C3H0b 0.770 1.610 2.486 9.458 9.889 0.956 [OK] 1226 156 L TRP CE3 6 C3H1b 0.770 1.760 2.985 20.314 20.448 0.993 [OK] 1227 156 L TRP CZ2 6 C3H1b 0.770 1.760 2.949 23.813 21.012 1.133 [OK] 1228 156 L TRP CZ3 6 C3H1b 0.770 1.760 2.798 23.803 21.516 1.106 [OK] 1229 156 L TRP CH2 6 C3H1b 0.770 1.760 2.941 23.668 21.339 1.109 [OK] 1230 157 L VAL N 12 N3H1s 0.700 1.640 2.137 11.779 13.676 0.861 [OK] 1231 157 L VAL CA 3 C4H1s 0.770 1.880 2.745 13.356 13.123 1.018 [OK] 1232 157 L VAL C 1 C3H0s 0.770 1.610 2.362 7.882 8.563 0.920 [OK] 1233 157 L VAL O 16 O1H0u 0.660 1.420 2.193 14.632 16.181 0.904 [OK] 1234 157 L VAL CB 4 C4H1b 0.770 1.880 3.022 14.781 14.598 1.013 possible 1235 157 L VAL CG1 10 C4H3u 0.770 1.880 3.157 32.555 36.584 0.890 possible 1236 157 L VAL CG2 10 C4H3u 0.770 1.880 2.997 36.994 36.332 1.018 [OK] 1237 158 L SER N 12 N3H1s 0.700 1.640 2.514 13.037 14.103 0.924 [OK] 1238 158 L SER CA 3 C4H1s 0.770 1.880 2.657 12.977 13.476 0.963 [OK] 1239 158 L SER C 1 C3H0s 0.770 1.610 3.268 9.432 8.923 1.057 possible 1240 158 L SER O 16 O1H0u 0.660 1.420 2.940 15.678 16.179 0.969 [OK] 1241 158 L SER CB 8 C4H2s 0.770 1.880 3.647 27.497 23.884 1.151 possible 1242 158 L SER OG 17 O2H1u 0.660 1.460 4.456 32.256 18.732 1.722 possible 1243 159 L ASN N 12 N3H1s 0.700 1.640 2.848 13.175 13.695 0.962 [OK] 1244 159 L ASN CA 3 C4H1s 0.770 1.880 4.944 19.406 13.167 1.474 possible 1245 159 L ASN C 1 C3H0s 0.770 1.610 3.465 9.023 8.928 1.011 possible 1246 159 L ASN O 16 O1H0u 0.660 1.420 5.376 21.713 16.199 1.340 possible 1247 159 L ASN CB 8 C4H2s 0.770 1.880 23.664 -1.000 23.128 -1.000 bad 1248 159 L ASN CG 2 C3H0b 0.770 1.610 2.353 -1.000 9.599 -1.000 bad 1249 159 L ASN OD1 16 O1H0u 0.660 1.420 28.141 -1.000 16.664 -1.000 bad 1250 159 L ASN ND2 15 N3H2u 0.700 1.640 36.626 -1.000 23.083 -1.000 bad 1251 160 L THR N 12 N3H1s 0.700 1.640 3.958 15.051 13.832 1.088 possible 1252 160 L THR CA 3 C4H1s 0.770 1.880 3.827 17.533 13.099 1.339 possible 1253 160 L THR C 1 C3H0s 0.770 1.610 2.776 8.242 8.738 0.943 [OK] 1254 160 L THR O 16 O1H0u 0.660 1.420 2.664 17.162 16.020 1.071 [OK] 1255 160 L THR CB 4 C4H1b 0.770 1.880 2.766 13.920 14.829 0.939 [OK] 1256 160 L THR OG1 17 O2H1u 0.660 1.460 4.088 24.204 18.123 1.336 possible 1257 160 L THR CG2 10 C4H3u 0.770 1.880 3.080 40.017 36.542 1.095 possible 1258 161 L GLY N 12 N3H1s 0.700 1.640 2.760 13.067 14.854 0.880 [OK] 1259 161 L GLY CA 8 C4H2s 0.770 1.880 3.038 24.159 23.688 1.020 possible 1260 161 L GLY C 2 C3H0b 0.770 1.610 2.201 8.285 9.840 0.842 [OK] 1261 161 L GLY O 16 O1H0u 0.660 1.420 2.527 16.999 16.391 1.037 [OK] 1262 162 L TYR N 12 N3H1s 0.700 1.640 2.505 12.992 13.691 0.949 [OK] 1263 162 L TYR CA 3 C4H1s 0.770 1.880 2.567 11.479 13.330 0.861 [OK] 1264 162 L TYR C 1 C3H0s 0.770 1.610 4.798 9.877 8.770 1.126 possible 1265 162 L TYR O 16 O1H0u 0.660 1.420 13.950 -1.000 16.124 -1.000 bad 1266 162 L TYR CB 8 C4H2s 0.770 1.880 20.522 -1.000 23.678 -1.000 bad 1267 162 L TYR CG 2 C3H0b 0.770 1.610 7.976 22.040 9.732 2.265 possible 1268 162 L TYR CD1 5 C3H1s 0.770 1.760 11.777 -1.000 20.171 -1.000 bad 1269 162 L TYR CD2 5 C3H1s 0.770 1.760 11.324 -1.000 20.728 -1.000 bad 1270 162 L TYR CE1 5 C3H1s 0.770 1.760 5.163 36.973 20.675 1.788 possible 1271 162 L TYR CE2 5 C3H1s 0.770 1.760 5.104 32.150 20.810 1.545 possible 1272 162 L TYR CZ 2 C3H0b 0.770 1.610 3.999 12.169 9.926 1.226 possible 1273 162 L TYR OH 17 O2H1u 0.660 1.460 2.613 18.165 19.173 0.947 [OK] 1274 163 L THR N 12 N3H1s 0.700 1.640 4.854 15.312 13.832 1.107 possible 1275 163 L THR CA 3 C4H1s 0.770 1.880 10.387 -1.000 13.099 -1.000 bad 1276 163 L THR C 1 C3H0s 0.770 1.610 2.392 8.514 8.738 0.974 [OK] 1277 163 L THR O 16 O1H0u 0.660 1.420 11.507 -1.000 16.020 -1.000 bad 1278 163 L THR CB 4 C4H1b 0.770 1.880 3.009 14.016 14.829 0.945 possible 1279 163 L THR OG1 17 O2H1u 0.660 1.460 18.494 -1.000 18.123 -1.000 bad 1280 163 L THR CG2 10 C4H3u 0.770 1.880 40.990 -1.000 36.542 -1.000 bad 1281 164 L TYR N 12 N3H1s 0.700 1.640 2.219 11.545 13.691 0.843 [OK] 1282 164 L TYR CA 3 C4H1s 0.770 1.880 2.907 13.932 13.330 1.045 [OK] 1283 164 L TYR C 1 C3H0s 0.770 1.610 2.689 9.899 8.770 1.129 [OK] 1284 164 L TYR O 16 O1H0u 0.660 1.420 2.507 16.328 16.124 1.013 [OK] 1285 164 L TYR CB 8 C4H2s 0.770 1.880 2.926 22.655 23.678 0.957 [OK] 1286 164 L TYR CG 2 C3H0b 0.770 1.610 2.442 10.113 9.732 1.039 [OK] 1287 164 L TYR CD1 5 C3H1s 0.770 1.760 2.918 18.058 20.171 0.895 [OK] 1288 164 L TYR CD2 5 C3H1s 0.770 1.760 3.040 23.348 20.728 1.126 possible 1289 164 L TYR CE1 5 C3H1s 0.770 1.760 2.939 21.781 20.675 1.053 [OK] 1290 164 L TYR CE2 5 C3H1s 0.770 1.760 3.782 26.139 20.810 1.256 possible 1291 164 L TYR CZ 2 C3H0b 0.770 1.610 2.923 9.968 9.926 1.004 [OK] 1292 164 L TYR OH 17 O2H1u 0.660 1.460 5.200 33.596 19.173 1.752 possible 1293 165 L GLY N 12 N3H1s 0.700 1.640 2.722 13.626 14.854 0.917 [OK] 1294 165 L GLY CA 8 C4H2s 0.770 1.880 6.347 41.512 23.688 1.752 possible 1295 165 L GLY C 2 C3H0b 0.770 1.610 4.856 12.940 9.840 1.315 possible 1296 165 L GLY O 16 O1H0u 0.660 1.420 2.625 15.542 16.391 0.948 [OK] 1297 166 L ASN N 12 N3H1s 0.700 1.640 4.796 18.770 13.695 1.371 possible 1298 166 L ASN CA 3 C4H1s 0.770 1.880 3.364 15.806 13.167 1.200 possible 1299 166 L ASN C 1 C3H0s 0.770 1.610 2.684 8.487 8.928 0.951 [OK] 1300 166 L ASN O 16 O1H0u 0.660 1.420 2.591 16.083 16.199 0.993 [OK] 1301 166 L ASN CB 8 C4H2s 0.770 1.880 3.903 26.710 23.128 1.155 possible 1302 166 L ASN CG 2 C3H0b 0.770 1.610 2.602 10.220 9.599 1.065 [OK] 1303 166 L ASN OD1 16 O1H0u 0.660 1.420 2.720 16.478 16.664 0.989 [OK] 1304 166 L ASN ND2 15 N3H2u 0.700 1.640 2.734 23.528 23.083 1.019 [OK] 1305 167 L PHE N 12 N3H1s 0.700 1.640 2.798 14.440 13.691 1.055 [OK] 1306 167 L PHE CA 3 C4H1s 0.770 1.880 3.065 15.632 13.449 1.162 possible 1307 167 L PHE C 1 C3H0s 0.770 1.610 2.573 9.077 8.753 1.037 [OK] 1308 167 L PHE O 16 O1H0u 0.660 1.420 2.394 16.759 16.151 1.038 [OK] 1309 167 L PHE CB 8 C4H2s 0.770 1.880 2.820 20.597 23.777 0.866 [OK] 1310 167 L PHE CG 2 C3H0b 0.770 1.610 2.565 9.879 9.721 1.016 [OK] 1311 167 L PHE CD1 5 C3H1s 0.770 1.760 2.843 20.795 20.405 1.019 [OK] 1312 167 L PHE CD2 6 C3H1b 0.770 1.760 2.659 18.695 21.051 0.888 [OK] 1313 167 L PHE CE1 6 C3H1b 0.770 1.760 2.917 21.650 21.580 1.003 [OK] 1314 167 L PHE CE2 6 C3H1b 0.770 1.760 2.819 21.992 21.680 1.014 [OK] 1315 167 L PHE CZ 6 C3H1b 0.770 1.760 2.916 21.461 21.666 0.991 [OK] 1316 168 L HIS N 12 N3H1s 0.700 1.640 2.598 13.377 13.715 0.975 [OK] 1317 168 L HIS CA 3 C4H1s 0.770 1.880 2.562 12.651 13.467 0.939 [OK] 1318 168 L HIS C 1 C3H0s 0.770 1.610 2.576 8.338 8.882 0.939 [OK] 1319 168 L HIS O 16 O1H0u 0.660 1.420 2.511 16.373 16.082 1.018 [OK] 1320 168 L HIS CB 8 C4H2s 0.770 1.880 2.883 23.797 23.653 1.006 [OK] 1321 168 L HIS CG 2 C3H0b 0.770 1.610 2.589 9.855 9.952 0.990 [OK] 1322 168 L HIS ND1 13 N3H1b 0.700 1.640 2.658 15.572 15.506 1.004 [OK] 1323 168 L HIS CD2 5 C3H1s 0.770 1.760 2.675 19.292 21.085 0.915 [OK] 1324 168 L HIS CE1 5 C3H1s 0.770 1.760 2.944 21.128 20.636 1.024 [OK] 1325 168 L HIS NE2 13 N3H1b 0.700 1.640 2.413 13.580 15.337 0.885 [OK] 1326 169 L TYR N 12 N3H1s 0.700 1.640 2.582 13.210 13.691 0.965 [OK] 1327 169 L TYR CA 3 C4H1s 0.770 1.880 2.762 12.766 13.330 0.958 [OK] 1328 169 L TYR C 1 C3H0s 0.770 1.610 2.393 8.932 8.770 1.018 [OK] 1329 169 L TYR O 16 O1H0u 0.660 1.420 2.459 16.741 16.124 1.038 [OK] 1330 169 L TYR CB 8 C4H2s 0.770 1.880 2.592 20.403 23.678 0.862 [OK] 1331 169 L TYR CG 2 C3H0b 0.770 1.610 2.558 9.484 9.732 0.975 [OK] 1332 169 L TYR CD1 5 C3H1s 0.770 1.760 3.010 20.827 20.171 1.033 possible 1333 169 L TYR CD2 5 C3H1s 0.770 1.760 2.708 21.329 20.728 1.029 [OK] 1334 169 L TYR CE1 5 C3H1s 0.770 1.760 3.120 20.910 20.675 1.011 possible 1335 169 L TYR CE2 5 C3H1s 0.770 1.760 2.857 23.369 20.810 1.123 [OK] 1336 169 L TYR CZ 2 C3H0b 0.770 1.610 2.555 11.024 9.926 1.111 [OK] 1337 169 L TYR OH 17 O2H1u 0.660 1.460 2.448 18.489 19.173 0.964 [OK] 1338 170 L ASN N 12 N3H1s 0.700 1.640 2.574 13.920 13.695 1.016 [OK] 1339 170 L ASN CA 3 C4H1s 0.770 1.880 2.507 12.010 13.167 0.912 [OK] 1340 170 L ASN C 1 C3H0s 0.770 1.610 2.422 8.284 8.928 0.928 [OK] 1341 170 L ASN O 16 O1H0u 0.660 1.420 2.470 14.825 16.199 0.915 [OK] 1342 170 L ASN CB 8 C4H2s 0.770 1.880 2.699 21.813 23.128 0.943 [OK] 1343 170 L ASN CG 2 C3H0b 0.770 1.610 2.355 9.330 9.599 0.972 [OK] 1344 170 L ASN OD1 16 O1H0u 0.660 1.420 2.504 16.084 16.664 0.965 [OK] 1345 170 L ASN ND2 15 N3H2u 0.700 1.640 2.543 21.782 23.083 0.944 [OK] 1346 171 L PRO N 11 N3H0u 0.700 1.640 2.498 8.560 8.823 0.970 [OK] 1347 171 L PRO CA 4 C4H1b 0.770 1.880 3.548 15.606 13.955 1.118 possible 1348 171 L PRO C 1 C3H0s 0.770 1.610 3.067 9.254 8.812 1.050 possible 1349 171 L PRO O 16 O1H0u 0.660 1.420 3.758 19.114 16.169 1.182 possible 1350 171 L PRO CB 9 C4H2b 0.770 1.880 5.302 48.289 25.563 1.889 possible 1351 171 L PRO CG 9 C4H2b 0.770 1.880 5.757 49.427 25.832 1.913 possible 1352 171 L PRO CD 8 C4H2s 0.770 1.880 2.934 23.770 23.836 0.997 [OK] 1353 172 L ALA N 12 N3H1s 0.700 1.640 4.198 16.680 14.046 1.188 possible 1354 172 L ALA CA 4 C4H1b 0.770 1.880 3.643 15.164 14.063 1.078 possible 1355 172 L ALA C 1 C3H0s 0.770 1.610 2.257 8.651 8.900 0.972 [OK] 1356 172 L ALA O 16 O1H0u 0.660 1.420 2.515 15.928 16.188 0.984 [OK] 1357 172 L ALA CB 10 C4H3u 0.770 1.880 5.071 47.136 36.782 1.281 possible 1358 173 L HIS N 12 N3H1s 0.700 1.640 2.321 12.048 13.715 0.878 [OK] 1359 173 L HIS CA 3 C4H1s 0.770 1.880 3.120 15.681 13.467 1.164 possible 1360 173 L HIS C 1 C3H0s 0.770 1.610 2.296 8.594 8.882 0.968 [OK] 1361 173 L HIS O 16 O1H0u 0.660 1.420 2.421 14.700 16.082 0.914 [OK] 1362 173 L HIS CB 8 C4H2s 0.770 1.880 2.929 21.655 23.653 0.916 [OK] 1363 173 L HIS CG 2 C3H0b 0.770 1.610 2.600 10.877 9.952 1.093 [OK] 1364 173 L HIS ND1 13 N3H1b 0.700 1.640 2.687 15.321 15.506 0.988 [OK] 1365 173 L HIS CD2 5 C3H1s 0.770 1.760 3.015 22.757 21.085 1.079 possible 1366 173 L HIS CE1 5 C3H1s 0.770 1.760 2.711 19.340 20.636 0.937 [OK] 1367 173 L HIS NE2 13 N3H1b 0.700 1.640 2.474 11.075 15.337 0.722 [OK] 1368 174 L MET N 12 N3H1s 0.700 1.640 2.447 13.258 13.564 0.977 [OK] 1369 174 L MET CA 3 C4H1s 0.770 1.880 2.467 13.062 13.231 0.987 [OK] 1370 174 L MET C 1 C3H0s 0.770 1.610 3.643 9.135 8.782 1.040 possible 1371 174 L MET O 16 O1H0u 0.660 1.420 3.124 16.487 16.277 1.013 possible 1372 174 L MET CB 8 C4H2s 0.770 1.880 4.800 29.141 23.645 1.232 possible 1373 174 L MET CG 9 C4H2b 0.770 1.880 2.951 23.444 24.009 0.976 [OK] 1374 174 L MET SD 19 S2H0u 1.040 1.770 5.213 45.237 30.093 1.503 possible 1375 174 L MET CE 10 C4H3u 0.770 1.880 2.956 34.743 37.161 0.935 [OK] 1376 175 L ILE N 12 N3H1s 0.700 1.640 3.796 13.892 13.633 1.019 possible 1377 175 L ILE CA 3 C4H1s 0.770 1.880 3.958 17.514 13.007 1.346 possible 1378 175 L ILE C 1 C3H0s 0.770 1.610 2.519 8.385 8.470 0.990 [OK] 1379 175 L ILE O 16 O1H0u 0.660 1.420 2.909 15.182 16.144 0.940 [OK] 1380 175 L ILE CB 4 C4H1b 0.770 1.880 2.517 13.278 14.227 0.933 [OK] 1381 175 L ILE CG1 9 C4H2b 0.770 1.880 17.547 -1.000 24.187 -1.000 bad 1382 175 L ILE CG2 10 C4H3u 0.770 1.880 13.410 -1.000 35.961 -1.000 bad 1383 175 L ILE CD1 10 C4H3u 0.770 1.880 38.199 -1.000 38.377 -1.000 bad 1384 176 L ALA N 12 N3H1s 0.700 1.640 2.555 12.744 14.046 0.907 [OK] 1385 176 L ALA CA 4 C4H1b 0.770 1.880 2.916 15.102 14.063 1.074 [OK] 1386 176 L ALA C 1 C3H0s 0.770 1.610 2.280 8.341 8.900 0.937 [OK] 1387 176 L ALA O 16 O1H0u 0.660 1.420 2.343 14.567 16.188 0.900 [OK] 1388 176 L ALA CB 10 C4H3u 0.770 1.880 3.149 33.077 36.782 0.899 possible 1389 177 L ILE N 12 N3H1s 0.700 1.640 2.332 12.447 13.633 0.913 [OK] 1390 177 L ILE CA 3 C4H1s 0.770 1.880 3.196 15.039 13.007 1.156 possible 1391 177 L ILE C 1 C3H0s 0.770 1.610 2.724 7.948 8.470 0.938 [OK] 1392 177 L ILE O 16 O1H0u 0.660 1.420 2.649 14.634 16.144 0.906 [OK] 1393 177 L ILE CB 4 C4H1b 0.770 1.880 2.652 13.496 14.227 0.949 [OK] 1394 177 L ILE CG1 9 C4H2b 0.770 1.880 3.001 20.439 24.187 0.845 possible 1395 177 L ILE CG2 10 C4H3u 0.770 1.880 3.136 32.296 35.961 0.898 possible 1396 177 L ILE CD1 10 C4H3u 0.770 1.880 2.688 28.274 38.377 0.737 [OK] 1397 178 L SER N 12 N3H1s 0.700 1.640 2.874 13.720 14.103 0.973 [OK] 1398 178 L SER CA 3 C4H1s 0.770 1.880 3.061 13.850 13.476 1.028 possible 1399 178 L SER C 1 C3H0s 0.770 1.610 3.640 9.601 8.923 1.076 possible 1400 178 L SER O 16 O1H0u 0.660 1.420 2.978 14.734 16.179 0.911 [OK] 1401 178 L SER CB 8 C4H2s 0.770 1.880 21.981 -1.000 23.884 -1.000 bad 1402 178 L SER OG 17 O2H1u 0.660 1.460 6.813 -1.000 18.732 -1.000 bad 1403 179 L PHE N 12 N3H1s 0.700 1.640 3.363 14.515 13.691 1.060 possible 1404 179 L PHE CA 3 C4H1s 0.770 1.880 3.415 14.502 13.449 1.078 possible 1405 179 L PHE C 1 C3H0s 0.770 1.610 2.388 8.469 8.753 0.968 [OK] 1406 179 L PHE O 16 O1H0u 0.660 1.420 2.568 16.704 16.151 1.034 [OK] 1407 179 L PHE CB 8 C4H2s 0.770 1.880 2.676 20.728 23.777 0.872 [OK] 1408 179 L PHE CG 2 C3H0b 0.770 1.610 3.211 10.281 9.721 1.058 possible 1409 179 L PHE CD1 5 C3H1s 0.770 1.760 4.070 23.487 20.405 1.151 possible 1410 179 L PHE CD2 6 C3H1b 0.770 1.760 3.354 22.039 21.051 1.047 possible 1411 179 L PHE CE1 6 C3H1b 0.770 1.760 18.614 -1.000 21.580 -1.000 bad 1412 179 L PHE CE2 6 C3H1b 0.770 1.760 4.337 27.468 21.680 1.267 possible 1413 179 L PHE CZ 6 C3H1b 0.770 1.760 28.186 -1.000 21.666 -1.000 bad 1414 180 L PHE N 12 N3H1s 0.700 1.640 2.402 12.760 13.691 0.932 [OK] 1415 180 L PHE CA 3 C4H1s 0.770 1.880 3.133 14.137 13.449 1.051 possible 1416 180 L PHE C 1 C3H0s 0.770 1.610 2.356 8.400 8.753 0.960 [OK] 1417 180 L PHE O 16 O1H0u 0.660 1.420 2.316 14.466 16.151 0.896 [OK] 1418 180 L PHE CB 8 C4H2s 0.770 1.880 3.207 25.301 23.777 1.064 possible 1419 180 L PHE CG 2 C3H0b 0.770 1.610 3.056 10.817 9.721 1.113 possible 1420 180 L PHE CD1 5 C3H1s 0.770 1.760 3.097 22.974 20.405 1.126 possible 1421 180 L PHE CD2 6 C3H1b 0.770 1.760 3.276 21.746 21.051 1.033 possible 1422 180 L PHE CE1 6 C3H1b 0.770 1.760 3.125 24.438 21.580 1.132 possible 1423 180 L PHE CE2 6 C3H1b 0.770 1.760 3.067 18.880 21.680 0.871 possible 1424 180 L PHE CZ 6 C3H1b 0.770 1.760 3.228 23.888 21.666 1.103 possible 1425 181 L PHE N 12 N3H1s 0.700 1.640 2.366 12.206 13.691 0.892 [OK] 1426 181 L PHE CA 3 C4H1s 0.770 1.880 3.033 14.770 13.449 1.098 possible 1427 181 L PHE C 1 C3H0s 0.770 1.610 2.797 9.153 8.753 1.046 [OK] 1428 181 L PHE O 16 O1H0u 0.660 1.420 2.637 15.203 16.151 0.941 [OK] 1429 181 L PHE CB 8 C4H2s 0.770 1.880 2.805 22.037 23.777 0.927 [OK] 1430 181 L PHE CG 2 C3H0b 0.770 1.610 2.618 10.743 9.721 1.105 [OK] 1431 181 L PHE CD1 5 C3H1s 0.770 1.760 2.976 20.653 20.405 1.012 [OK] 1432 181 L PHE CD2 6 C3H1b 0.770 1.760 2.985 20.344 21.051 0.966 [OK] 1433 181 L PHE CE1 6 C3H1b 0.770 1.760 3.025 21.160 21.580 0.981 possible 1434 181 L PHE CE2 6 C3H1b 0.770 1.760 2.937 22.533 21.680 1.039 [OK] 1435 181 L PHE CZ 6 C3H1b 0.770 1.760 2.738 21.358 21.666 0.986 [OK] 1436 182 L THR N 12 N3H1s 0.700 1.640 2.695 13.096 13.832 0.947 [OK] 1437 182 L THR CA 3 C4H1s 0.770 1.880 2.965 14.353 13.099 1.096 [OK] 1438 182 L THR C 1 C3H0s 0.770 1.610 2.209 8.025 8.738 0.918 [OK] 1439 182 L THR O 16 O1H0u 0.660 1.420 2.646 15.489 16.020 0.967 [OK] 1440 182 L THR CB 4 C4H1b 0.770 1.880 3.424 15.989 14.829 1.078 possible 1441 182 L THR OG1 17 O2H1u 0.660 1.460 4.857 30.229 18.123 1.668 possible 1442 182 L THR CG2 10 C4H3u 0.770 1.880 5.959 55.949 36.542 1.531 possible 1443 183 L ASN N 12 N3H1s 0.700 1.640 2.477 12.785 13.695 0.934 [OK] 1444 183 L ASN CA 3 C4H1s 0.770 1.880 2.961 13.418 13.167 1.019 [OK] 1445 183 L ASN C 1 C3H0s 0.770 1.610 2.222 7.713 8.928 0.864 [OK] 1446 183 L ASN O 16 O1H0u 0.660 1.420 2.525 15.525 16.199 0.958 [OK] 1447 183 L ASN CB 8 C4H2s 0.770 1.880 3.189 23.059 23.128 0.997 possible 1448 183 L ASN CG 2 C3H0b 0.770 1.610 2.697 9.550 9.599 0.995 [OK] 1449 183 L ASN OD1 16 O1H0u 0.660 1.420 2.522 17.930 16.664 1.076 [OK] 1450 183 L ASN ND2 15 N3H2u 0.700 1.640 2.569 21.885 23.083 0.948 [OK] 1451 184 L ALA N 12 N3H1s 0.700 1.640 2.315 12.678 14.046 0.903 [OK] 1452 184 L ALA CA 4 C4H1b 0.770 1.880 2.818 14.780 14.063 1.051 [OK] 1453 184 L ALA C 1 C3H0s 0.770 1.610 2.502 8.370 8.900 0.940 [OK] 1454 184 L ALA O 16 O1H0u 0.660 1.420 2.458 15.293 16.188 0.945 [OK] 1455 184 L ALA CB 10 C4H3u 0.770 1.880 3.088 40.169 36.782 1.092 possible 1456 185 L LEU N 12 N3H1s 0.700 1.640 2.138 11.959 13.655 0.876 [OK] 1457 185 L LEU CA 3 C4H1s 0.770 1.880 2.630 13.028 13.122 0.993 [OK] 1458 185 L LEU C 1 C3H0s 0.770 1.610 2.327 7.907 8.825 0.896 [OK] 1459 185 L LEU O 16 O1H0u 0.660 1.420 2.267 14.897 16.208 0.919 [OK] 1460 185 L LEU CB 8 C4H2s 0.770 1.880 3.069 20.442 22.951 0.891 possible 1461 185 L LEU CG 4 C4H1b 0.770 1.880 3.243 17.221 14.764 1.166 possible 1462 185 L LEU CD1 10 C4H3u 0.770 1.880 3.213 31.332 37.425 0.837 possible 1463 185 L LEU CD2 10 C4H3u 0.770 1.880 3.246 37.773 37.143 1.017 possible 1464 186 L ALA N 12 N3H1s 0.700 1.640 2.950 13.178 14.046 0.938 [OK] 1465 186 L ALA CA 4 C4H1b 0.770 1.880 2.828 14.534 14.063 1.033 [OK] 1466 186 L ALA C 1 C3H0s 0.770 1.610 2.239 8.079 8.900 0.908 [OK] 1467 186 L ALA O 16 O1H0u 0.660 1.420 2.370 16.060 16.188 0.992 [OK] 1468 186 L ALA CB 10 C4H3u 0.770 1.880 3.205 40.202 36.782 1.093 possible 1469 187 L LEU N 12 N3H1s 0.700 1.640 2.296 12.143 13.655 0.889 [OK] 1470 187 L LEU CA 3 C4H1s 0.770 1.880 2.897 13.022 13.122 0.992 [OK] 1471 187 L LEU C 1 C3H0s 0.770 1.610 2.532 8.298 8.825 0.940 [OK] 1472 187 L LEU O 16 O1H0u 0.660 1.420 2.690 17.992 16.208 1.110 [OK] 1473 187 L LEU CB 8 C4H2s 0.770 1.880 2.854 22.075 22.951 0.962 [OK] 1474 187 L LEU CG 4 C4H1b 0.770 1.880 2.610 13.710 14.764 0.929 [OK] 1475 187 L LEU CD1 10 C4H3u 0.770 1.880 3.310 40.850 37.425 1.092 possible 1476 187 L LEU CD2 10 C4H3u 0.770 1.880 2.843 34.546 37.143 0.930 [OK] 1477 188 L ALA N 12 N3H1s 0.700 1.640 2.583 12.088 14.046 0.861 [OK] 1478 188 L ALA CA 4 C4H1b 0.770 1.880 2.891 15.558 14.063 1.106 [OK] 1479 188 L ALA C 1 C3H0s 0.770 1.610 2.730 8.772 8.900 0.986 [OK] 1480 188 L ALA O 16 O1H0u 0.660 1.420 2.590 16.239 16.188 1.003 [OK] 1481 188 L ALA CB 10 C4H3u 0.770 1.880 3.014 35.871 36.782 0.975 possible 1482 189 L LEU N 12 N3H1s 0.700 1.640 2.650 12.980 13.655 0.951 [OK] 1483 189 L LEU CA 3 C4H1s 0.770 1.880 3.052 13.968 13.122 1.064 possible 1484 189 L LEU C 1 C3H0s 0.770 1.610 2.139 8.233 8.825 0.933 [OK] 1485 189 L LEU O 16 O1H0u 0.660 1.420 2.167 13.563 16.208 0.837 [OK] 1486 189 L LEU CB 8 C4H2s 0.770 1.880 2.612 19.248 22.951 0.839 [OK] 1487 189 L LEU CG 4 C4H1b 0.770 1.880 2.617 13.956 14.764 0.945 [OK] 1488 189 L LEU CD1 10 C4H3u 0.770 1.880 3.130 34.969 37.425 0.934 possible 1489 189 L LEU CD2 10 C4H3u 0.770 1.880 2.928 32.718 37.143 0.881 [OK] 1490 190 L HIS N 12 N3H1s 0.700 1.640 2.614 12.895 13.715 0.940 [OK] 1491 190 L HIS CA 3 C4H1s 0.770 1.880 2.632 13.668 13.467 1.015 [OK] 1492 190 L HIS C 1 C3H0s 0.770 1.610 2.382 8.230 8.882 0.927 [OK] 1493 190 L HIS O 16 O1H0u 0.660 1.420 2.526 16.016 16.082 0.996 [OK] 1494 190 L HIS CB 8 C4H2s 0.770 1.880 3.125 24.836 23.653 1.050 possible 1495 190 L HIS CG 2 C3H0b 0.770 1.610 2.531 9.553 9.952 0.960 [OK] 1496 190 L HIS ND1 13 N3H1b 0.700 1.640 2.615 14.784 15.506 0.953 [OK] 1497 190 L HIS CD2 5 C3H1s 0.770 1.760 3.071 26.955 21.085 1.278 possible 1498 190 L HIS CE1 5 C3H1s 0.770 1.760 2.760 18.824 20.636 0.912 [OK] 1499 190 L HIS NE2 13 N3H1b 0.700 1.640 2.769 10.630 15.337 0.693 [OK] 1500 191 L GLY N 12 N3H1s 0.700 1.640 2.908 15.118 14.854 1.018 [OK] 1501 191 L GLY CA 8 C4H2s 0.770 1.880 3.015 24.902 23.688 1.051 possible 1502 191 L GLY C 2 C3H0b 0.770 1.610 2.431 9.293 9.840 0.944 [OK] 1503 191 L GLY O 16 O1H0u 0.660 1.420 2.334 15.937 16.391 0.972 [OK] 1504 192 L ALA N 12 N3H1s 0.700 1.640 2.402 12.668 14.046 0.902 [OK] 1505 192 L ALA CA 4 C4H1b 0.770 1.880 2.859 13.507 14.063 0.960 [OK] 1506 192 L ALA C 1 C3H0s 0.770 1.610 2.488 8.750 8.900 0.983 [OK] 1507 192 L ALA O 16 O1H0u 0.660 1.420 2.449 15.108 16.188 0.933 [OK] 1508 192 L ALA CB 10 C4H3u 0.770 1.880 3.130 33.844 36.782 0.920 possible 1509 193 L LEU N 12 N3H1s 0.700 1.640 2.488 12.882 13.655 0.943 [OK] 1510 193 L LEU CA 3 C4H1s 0.770 1.880 2.706 13.451 13.122 1.025 [OK] 1511 193 L LEU C 1 C3H0s 0.770 1.610 2.243 8.249 8.825 0.935 [OK] 1512 193 L LEU O 16 O1H0u 0.660 1.420 2.294 15.146 16.208 0.934 [OK] 1513 193 L LEU CB 8 C4H2s 0.770 1.880 2.949 22.712 22.951 0.990 [OK] 1514 193 L LEU CG 4 C4H1b 0.770 1.880 2.854 13.910 14.764 0.942 [OK] 1515 193 L LEU CD1 10 C4H3u 0.770 1.880 2.820 34.351 37.425 0.918 [OK] 1516 193 L LEU CD2 10 C4H3u 0.770 1.880 3.138 34.856 37.143 0.938 possible 1517 194 L VAL N 12 N3H1s 0.700 1.640 2.693 13.505 13.676 0.987 [OK] 1518 194 L VAL CA 3 C4H1s 0.770 1.880 2.764 12.890 13.123 0.982 [OK] 1519 194 L VAL C 1 C3H0s 0.770 1.610 2.668 8.170 8.563 0.954 [OK] 1520 194 L VAL O 16 O1H0u 0.660 1.420 2.761 15.754 16.181 0.974 [OK] 1521 194 L VAL CB 4 C4H1b 0.770 1.880 2.711 14.639 14.598 1.003 [OK] 1522 194 L VAL CG1 10 C4H3u 0.770 1.880 3.216 39.342 36.584 1.075 possible 1523 194 L VAL CG2 10 C4H3u 0.770 1.880 2.958 33.888 36.332 0.933 [OK] 1524 195 L LEU N 12 N3H1s 0.700 1.640 2.505 13.480 13.655 0.987 [OK] 1525 195 L LEU CA 3 C4H1s 0.770 1.880 2.901 13.120 13.122 1.000 [OK] 1526 195 L LEU C 1 C3H0s 0.770 1.610 2.144 8.448 8.825 0.957 [OK] 1527 195 L LEU O 16 O1H0u 0.660 1.420 2.283 14.676 16.208 0.905 [OK] 1528 195 L LEU CB 8 C4H2s 0.770 1.880 2.815 19.239 22.951 0.838 [OK] 1529 195 L LEU CG 4 C4H1b 0.770 1.880 2.908 15.875 14.764 1.075 [OK] 1530 195 L LEU CD1 10 C4H3u 0.770 1.880 3.216 37.691 37.425 1.007 possible 1531 195 L LEU CD2 10 C4H3u 0.770 1.880 3.177 37.579 37.143 1.012 possible 1532 196 L SER N 12 N3H1s 0.700 1.640 2.214 12.213 14.103 0.866 [OK] 1533 196 L SER CA 3 C4H1s 0.770 1.880 2.609 12.808 13.476 0.950 [OK] 1534 196 L SER C 1 C3H0s 0.770 1.610 2.256 8.710 8.923 0.976 [OK] 1535 196 L SER O 16 O1H0u 0.660 1.420 2.460 16.844 16.179 1.041 [OK] 1536 196 L SER CB 8 C4H2s 0.770 1.880 2.858 21.721 23.884 0.909 [OK] 1537 196 L SER OG 17 O2H1u 0.660 1.460 2.360 16.756 18.732 0.895 [OK] 1538 197 L ALA N 12 N3H1s 0.700 1.640 2.416 12.843 14.046 0.914 [OK] 1539 197 L ALA CA 4 C4H1b 0.770 1.880 2.789 13.660 14.063 0.971 [OK] 1540 197 L ALA C 1 C3H0s 0.770 1.610 2.620 9.116 8.900 1.024 [OK] 1541 197 L ALA O 16 O1H0u 0.660 1.420 2.518 16.958 16.188 1.048 [OK] 1542 197 L ALA CB 10 C4H3u 0.770 1.880 2.915 34.668 36.782 0.943 [OK] 1543 198 L ALA N 12 N3H1s 0.700 1.640 2.618 12.821 14.046 0.913 [OK] 1544 198 L ALA CA 4 C4H1b 0.770 1.880 2.911 13.524 14.063 0.962 [OK] 1545 198 L ALA C 1 C3H0s 0.770 1.610 2.396 8.326 8.900 0.935 [OK] 1546 198 L ALA O 16 O1H0u 0.660 1.420 2.443 17.579 16.188 1.086 [OK] 1547 198 L ALA CB 10 C4H3u 0.770 1.880 3.216 39.332 36.782 1.069 possible 1548 199 L ASN N 12 N3H1s 0.700 1.640 2.304 12.472 13.695 0.911 [OK] 1549 199 L ASN CA 3 C4H1s 0.770 1.880 2.784 12.688 13.167 0.964 [OK] 1550 199 L ASN C 1 C3H0s 0.770 1.610 2.645 9.032 8.928 1.012 [OK] 1551 199 L ASN O 16 O1H0u 0.660 1.420 4.775 23.346 16.199 1.441 possible 1552 199 L ASN CB 8 C4H2s 0.770 1.880 7.249 51.887 23.128 2.243 possible 1553 199 L ASN CG 2 C3H0b 0.770 1.610 3.742 10.603 9.599 1.105 possible 1554 199 L ASN OD1 16 O1H0u 0.660 1.420 5.630 34.429 16.664 2.066 possible 1555 199 L ASN ND2 15 N3H2u 0.700 1.640 2.795 24.097 23.083 1.044 [OK] 1556 200 L PRO N 11 N3H0u 0.700 1.640 2.469 8.471 8.823 0.960 [OK] 1557 200 L PRO CA 4 C4H1b 0.770 1.880 2.566 12.947 13.955 0.928 [OK] 1558 200 L PRO C 1 C3H0s 0.770 1.610 2.738 9.302 8.812 1.056 [OK] 1559 200 L PRO O 16 O1H0u 0.660 1.420 5.810 35.318 16.169 2.184 possible 1560 200 L PRO CB 9 C4H2b 0.770 1.880 2.985 25.219 25.563 0.987 [OK] 1561 200 L PRO CG 9 C4H2b 0.770 1.880 3.019 25.981 25.832 1.006 possible 1562 200 L PRO CD 8 C4H2s 0.770 1.880 2.814 21.980 23.836 0.922 [OK] 1563 201 L GLU N 12 N3H1s 0.700 1.640 2.829 15.030 13.615 1.104 [OK] 1564 201 L GLU CA 3 C4H1s 0.770 1.880 5.895 28.639 13.399 2.137 possible 1565 201 L GLU C 1 C3H0s 0.770 1.610 2.355 8.238 8.675 0.950 [OK] 1566 201 L GLU O 16 O1H0u 0.660 1.420 2.740 16.974 16.023 1.059 [OK] 1567 201 L GLU CB 8 C4H2s 0.770 1.880 6.624 33.111 23.529 1.407 possible 1568 201 L GLU CG 8 C4H2s 0.770 1.880 6.692 35.376 23.513 1.505 possible 1569 201 L GLU CD 2 C3H0b 0.770 1.610 6.572 18.452 9.460 1.951 possible 1570 201 L GLU OE1 16 O1H0u 0.660 1.420 7.696 47.328 15.999 2.958 possible 1571 201 L GLU OE2 16 O1H0u 0.660 1.420 5.213 33.154 17.432 1.902 possible 1572 202 L LYS N 12 N3H1s 0.700 1.640 7.156 45.916 13.675 3.358 possible 1573 202 L LYS CA 3 C4H1s 0.770 1.880 4.168 20.278 13.324 1.522 possible 1574 202 L LYS C 1 C3H0s 0.770 1.610 2.889 8.051 8.759 0.919 [OK] 1575 202 L LYS O 16 O1H0u 0.660 1.420 10.506 -1.000 16.049 -1.000 bad 1576 202 L LYS CB 8 C4H2s 0.770 1.880 21.451 -1.000 22.904 -1.000 bad 1577 202 L LYS CG 8 C4H2s 0.770 1.880 21.719 -1.000 23.131 -1.000 bad 1578 202 L LYS CD 8 C4H2s 0.770 1.880 28.686 -1.000 23.837 -1.000 bad 1579 202 L LYS CE 9 C4H2b 0.770 1.880 42.406 -1.000 23.934 -1.000 bad 1580 202 L LYS NZ 14 N4H3u 0.700 1.640 54.935 -1.000 21.213 -1.000 bad 1581 203 L GLY N 12 N3H1s 0.700 1.640 5.595 36.215 14.854 2.438 possible 1582 203 L GLY CA 8 C4H2s 0.770 1.880 30.866 -1.000 23.688 -1.000 bad 1583 203 L GLY C 2 C3H0b 0.770 1.610 4.365 13.121 9.840 1.333 possible 1584 203 L GLY O 16 O1H0u 0.660 1.420 18.976 -1.000 16.391 -1.000 bad 1585 204 L LYS N 12 N3H1s 0.700 1.640 2.985 14.648 13.675 1.071 [OK] 1586 204 L LYS CA 3 C4H1s 0.770 1.880 3.206 13.165 13.324 0.988 possible 1587 204 L LYS C 1 C3H0s 0.770 1.610 2.532 9.114 8.759 1.040 [OK] 1588 204 L LYS O 16 O1H0u 0.660 1.420 3.058 19.564 16.049 1.219 possible 1589 204 L LYS CB 8 C4H2s 0.770 1.880 2.806 22.913 22.904 1.000 [OK] 1590 204 L LYS CG 8 C4H2s 0.770 1.880 6.105 36.273 23.131 1.568 possible 1591 204 L LYS CD 8 C4H2s 0.770 1.880 3.228 23.656 23.837 0.992 possible 1592 204 L LYS CE 9 C4H2b 0.770 1.880 17.915 -1.000 23.934 -1.000 bad 1593 204 L LYS NZ 14 N4H3u 0.700 1.640 12.300 -1.000 21.213 -1.000 bad 1594 205 L GLU N 12 N3H1s 0.700 1.640 3.096 15.578 13.615 1.144 possible 1595 205 L GLU CA 3 C4H1s 0.770 1.880 2.536 12.069 13.399 0.901 [OK] 1596 205 L GLU C 1 C3H0s 0.770 1.610 2.344 8.530 8.675 0.983 [OK] 1597 205 L GLU O 16 O1H0u 0.660 1.420 2.297 14.362 16.023 0.896 [OK] 1598 205 L GLU CB 8 C4H2s 0.770 1.880 2.897 23.872 23.529 1.015 [OK] 1599 205 L GLU CG 8 C4H2s 0.770 1.880 5.357 32.079 23.513 1.364 possible 1600 205 L GLU CD 2 C3H0b 0.770 1.610 4.441 12.475 9.460 1.319 possible 1601 205 L GLU OE1 16 O1H0u 0.660 1.420 16.107 -1.000 15.999 -1.000 bad 1602 205 L GLU OE2 16 O1H0u 0.660 1.420 25.565 -1.000 17.432 -1.000 bad 1603 206 L MET N 12 N3H1s 0.700 1.640 2.389 13.676 13.564 1.008 [OK] 1604 206 L MET CA 3 C4H1s 0.770 1.880 2.974 14.256 13.231 1.077 [OK] 1605 206 L MET C 1 C3H0s 0.770 1.610 2.271 8.102 8.782 0.923 [OK] 1606 206 L MET O 16 O1H0u 0.660 1.420 2.532 17.140 16.277 1.053 [OK] 1607 206 L MET CB 8 C4H2s 0.770 1.880 3.128 26.546 23.645 1.123 possible 1608 206 L MET CG 9 C4H2b 0.770 1.880 2.929 24.702 24.009 1.029 [OK] 1609 206 L MET SD 19 S2H0u 1.040 1.770 3.208 30.790 30.093 1.023 possible 1610 206 L MET CE 10 C4H3u 0.770 1.880 3.005 37.307 37.161 1.004 possible 1611 207 L ARG N 12 N3H1s 0.700 1.640 2.426 13.623 13.650 0.998 [OK] 1612 207 L ARG CA 3 C4H1s 0.770 1.880 2.681 12.644 13.422 0.942 [OK] 1613 207 L ARG C 1 C3H0s 0.770 1.610 2.523 9.479 8.838 1.072 [OK] 1614 207 L ARG O 16 O1H0u 0.660 1.420 2.416 17.416 16.084 1.083 [OK] 1615 207 L ARG CB 8 C4H2s 0.770 1.880 2.930 22.058 23.088 0.955 [OK] 1616 207 L ARG CG 8 C4H2s 0.770 1.880 3.076 23.346 23.640 0.988 possible 1617 207 L ARG CD 8 C4H2s 0.770 1.880 2.763 20.643 23.300 0.886 [OK] 1618 207 L ARG NE 13 N3H1b 0.700 1.640 2.564 17.439 15.569 1.120 [OK] 1619 207 L ARG CZ 2 C3H0b 0.770 1.610 2.708 10.998 9.747 1.128 [OK] 1620 207 L ARG NH1 15 N3H2u 0.700 1.640 3.020 24.228 22.782 1.063 possible 1621 207 L ARG NH2 15 N3H2u 0.700 1.640 3.724 29.250 23.810 1.228 possible 1622 208 L THR N 12 N3H1s 0.700 1.640 2.568 13.228 13.832 0.956 [OK] 1623 208 L THR CA 3 C4H1s 0.770 1.880 2.763 12.709 13.099 0.970 [OK] 1624 208 L THR C 1 C3H0s 0.770 1.610 2.225 8.447 8.738 0.967 [OK] 1625 208 L THR O 16 O1H0u 0.660 1.420 2.439 15.563 16.020 0.971 [OK] 1626 208 L THR CB 4 C4H1b 0.770 1.880 2.974 15.431 14.829 1.041 [OK] 1627 208 L THR OG1 17 O2H1u 0.660 1.460 2.486 16.674 18.123 0.920 [OK] 1628 208 L THR CG2 10 C4H3u 0.770 1.880 3.105 39.866 36.542 1.091 possible 1629 209 L PRO N 11 N3H0u 0.700 1.640 2.440 8.324 8.823 0.943 [OK] 1630 209 L PRO CA 4 C4H1b 0.770 1.880 3.029 13.739 13.955 0.985 possible 1631 209 L PRO C 1 C3H0s 0.770 1.610 3.244 9.186 8.812 1.042 possible 1632 209 L PRO O 16 O1H0u 0.660 1.420 2.645 15.074 16.169 0.932 [OK] 1633 209 L PRO CB 9 C4H2b 0.770 1.880 3.665 37.775 25.563 1.478 possible 1634 209 L PRO CG 9 C4H2b 0.770 1.880 3.669 28.481 25.832 1.103 possible 1635 209 L PRO CD 8 C4H2s 0.770 1.880 2.913 22.315 23.836 0.936 [OK] 1636 210 L ASP N 12 N3H1s 0.700 1.640 3.230 15.124 13.895 1.088 possible 1637 210 L ASP CA 3 C4H1s 0.770 1.880 2.956 14.991 13.377 1.121 [OK] 1638 210 L ASP C 1 C3H0s 0.770 1.610 2.130 8.005 8.816 0.908 [OK] 1639 210 L ASP O 16 O1H0u 0.660 1.420 2.262 14.665 16.091 0.911 [OK] 1640 210 L ASP CB 8 C4H2s 0.770 1.880 2.884 22.176 23.481 0.944 [OK] 1641 210 L ASP CG 2 C3H0b 0.770 1.610 2.434 9.155 9.422 0.972 [OK] 1642 210 L ASP OD1 16 O1H0u 0.660 1.420 2.961 17.936 15.505 1.157 [OK] 1643 210 L ASP OD2 16 O1H0u 0.660 1.420 3.270 28.532 16.324 1.748 possible 1644 211 L HIS N 12 N3H1s 0.700 1.640 2.305 12.399 13.715 0.904 [OK] 1645 211 L HIS CA 3 C4H1s 0.770 1.880 2.856 15.006 13.467 1.114 [OK] 1646 211 L HIS C 1 C3H0s 0.770 1.610 2.164 8.287 8.882 0.933 [OK] 1647 211 L HIS O 16 O1H0u 0.660 1.420 2.441 15.575 16.082 0.968 [OK] 1648 211 L HIS CB 8 C4H2s 0.770 1.880 2.885 23.864 23.653 1.009 [OK] 1649 211 L HIS CG 2 C3H0b 0.770 1.610 2.410 9.127 9.952 0.917 [OK] 1650 211 L HIS ND1 13 N3H1b 0.700 1.640 2.725 20.885 15.506 1.347 [OK] 1651 211 L HIS CD2 5 C3H1s 0.770 1.760 2.595 16.665 21.085 0.790 [OK] 1652 211 L HIS CE1 5 C3H1s 0.770 1.760 3.268 22.654 20.636 1.098 possible 1653 211 L HIS NE2 13 N3H1b 0.700 1.640 3.282 16.897 15.337 1.102 possible 1654 212 L GLU N 12 N3H1s 0.700 1.640 2.663 13.068 13.615 0.960 [OK] 1655 212 L GLU CA 3 C4H1s 0.770 1.880 2.574 13.028 13.399 0.972 [OK] 1656 212 L GLU C 1 C3H0s 0.770 1.610 2.880 9.209 8.675 1.062 [OK] 1657 212 L GLU O 16 O1H0u 0.660 1.420 2.657 17.118 16.023 1.068 [OK] 1658 212 L GLU CB 8 C4H2s 0.770 1.880 2.843 21.836 23.529 0.928 [OK] 1659 212 L GLU CG 8 C4H2s 0.770 1.880 2.875 23.405 23.513 0.995 [OK] 1660 212 L GLU CD 2 C3H0b 0.770 1.610 2.520 8.997 9.460 0.951 [OK] 1661 212 L GLU OE1 16 O1H0u 0.660 1.420 2.552 17.394 15.999 1.087 [OK] 1662 212 L GLU OE2 16 O1H0u 0.660 1.420 2.449 18.870 17.432 1.082 [OK] 1663 213 L ASP N 12 N3H1s 0.700 1.640 2.888 12.838 13.895 0.924 [OK] 1664 213 L ASP CA 3 C4H1s 0.770 1.880 3.009 13.734 13.377 1.027 possible 1665 213 L ASP C 1 C3H0s 0.770 1.610 2.569 8.541 8.816 0.969 [OK] 1666 213 L ASP O 16 O1H0u 0.660 1.420 2.281 14.697 16.091 0.913 [OK] 1667 213 L ASP CB 8 C4H2s 0.770 1.880 2.871 23.703 23.481 1.009 [OK] 1668 213 L ASP CG 2 C3H0b 0.770 1.610 2.794 9.995 9.422 1.061 [OK] 1669 213 L ASP OD1 16 O1H0u 0.660 1.420 2.805 20.973 15.505 1.353 [OK] 1670 213 L ASP OD2 16 O1H0u 0.660 1.420 2.996 25.904 16.324 1.587 [OK] 1671 214 L THR N 12 N3H1s 0.700 1.640 2.653 13.329 13.832 0.964 [OK] 1672 214 L THR CA 3 C4H1s 0.770 1.880 2.649 13.856 13.099 1.058 [OK] 1673 214 L THR C 1 C3H0s 0.770 1.610 2.219 8.306 8.738 0.951 [OK] 1674 214 L THR O 16 O1H0u 0.660 1.420 2.399 14.863 16.020 0.928 [OK] 1675 214 L THR CB 4 C4H1b 0.770 1.880 2.856 15.528 14.829 1.047 [OK] 1676 214 L THR OG1 17 O2H1u 0.660 1.460 2.418 16.947 18.123 0.935 [OK] 1677 214 L THR CG2 10 C4H3u 0.770 1.880 2.819 33.523 36.542 0.917 [OK] 1678 215 L PHE N 12 N3H1s 0.700 1.640 2.342 12.496 13.691 0.913 [OK] 1679 215 L PHE CA 3 C4H1s 0.770 1.880 3.021 14.140 13.449 1.051 possible 1680 215 L PHE C 1 C3H0s 0.770 1.610 2.195 7.738 8.753 0.884 [OK] 1681 215 L PHE O 16 O1H0u 0.660 1.420 2.503 16.543 16.151 1.024 [OK] 1682 215 L PHE CB 8 C4H2s 0.770 1.880 2.624 22.272 23.777 0.937 [OK] 1683 215 L PHE CG 2 C3H0b 0.770 1.610 2.667 10.292 9.721 1.059 [OK] 1684 215 L PHE CD1 5 C3H1s 0.770 1.760 2.962 22.573 20.405 1.106 [OK] 1685 215 L PHE CD2 6 C3H1b 0.770 1.760 2.692 18.685 21.051 0.888 [OK] 1686 215 L PHE CE1 6 C3H1b 0.770 1.760 2.858 21.235 21.580 0.984 [OK] 1687 215 L PHE CE2 6 C3H1b 0.770 1.760 2.813 21.553 21.680 0.994 [OK] 1688 215 L PHE CZ 6 C3H1b 0.770 1.760 2.784 22.328 21.666 1.031 [OK] 1689 216 L PHE N 12 N3H1s 0.700 1.640 2.557 13.129 13.691 0.959 [OK] 1690 216 L PHE CA 3 C4H1s 0.770 1.880 2.869 13.613 13.449 1.012 [OK] 1691 216 L PHE C 1 C3H0s 0.770 1.610 2.183 8.376 8.753 0.957 [OK] 1692 216 L PHE O 16 O1H0u 0.660 1.420 2.578 15.299 16.151 0.947 [OK] 1693 216 L PHE CB 8 C4H2s 0.770 1.880 2.953 24.144 23.777 1.015 [OK] 1694 216 L PHE CG 2 C3H0b 0.770 1.610 2.645 9.138 9.721 0.940 [OK] 1695 216 L PHE CD1 5 C3H1s 0.770 1.760 2.708 20.454 20.405 1.002 [OK] 1696 216 L PHE CD2 6 C3H1b 0.770 1.760 2.906 21.389 21.051 1.016 [OK] 1697 216 L PHE CE1 6 C3H1b 0.770 1.760 3.000 22.136 21.580 1.026 possible 1698 216 L PHE CE2 6 C3H1b 0.770 1.760 2.971 24.769 21.680 1.142 [OK] 1699 216 L PHE CZ 6 C3H1b 0.770 1.760 3.009 21.022 21.666 0.970 possible 1700 217 L ARG N 12 N3H1s 0.700 1.640 2.386 13.279 13.650 0.973 [OK] 1701 217 L ARG CA 3 C4H1s 0.770 1.880 2.559 13.327 13.422 0.993 [OK] 1702 217 L ARG C 1 C3H0s 0.770 1.610 2.146 8.286 8.838 0.938 [OK] 1703 217 L ARG O 16 O1H0u 0.660 1.420 2.205 13.973 16.084 0.869 [OK] 1704 217 L ARG CB 8 C4H2s 0.770 1.880 2.715 20.662 23.088 0.895 [OK] 1705 217 L ARG CG 8 C4H2s 0.770 1.880 2.798 24.202 23.640 1.024 [OK] 1706 217 L ARG CD 8 C4H2s 0.770 1.880 2.662 20.206 23.300 0.867 [OK] 1707 217 L ARG NE 13 N3H1b 0.700 1.640 2.657 16.434 15.569 1.056 [OK] 1708 217 L ARG CZ 2 C3H0b 0.770 1.610 2.476 9.868 9.747 1.012 [OK] 1709 217 L ARG NH1 15 N3H2u 0.700 1.640 3.169 28.902 22.782 1.269 possible 1710 217 L ARG NH2 15 N3H2u 0.700 1.640 3.036 28.598 23.810 1.201 possible 1711 218 L ASP N 12 N3H1s 0.700 1.640 2.355 12.483 13.895 0.898 [OK] 1712 218 L ASP CA 3 C4H1s 0.770 1.880 2.655 12.805 13.377 0.957 [OK] 1713 218 L ASP C 1 C3H0s 0.770 1.610 2.282 8.366 8.816 0.949 [OK] 1714 218 L ASP O 16 O1H0u 0.660 1.420 2.418 14.970 16.091 0.930 [OK] 1715 218 L ASP CB 8 C4H2s 0.770 1.880 2.991 23.214 23.481 0.989 [OK] 1716 218 L ASP CG 2 C3H0b 0.770 1.610 2.481 9.435 9.422 1.001 [OK] 1717 218 L ASP OD1 16 O1H0u 0.660 1.420 2.410 16.310 15.505 1.052 [OK] 1718 218 L ASP OD2 16 O1H0u 0.660 1.420 2.491 17.833 16.324 1.092 [OK] 1719 219 L LEU N 12 N3H1s 0.700 1.640 2.519 13.355 13.655 0.978 [OK] 1720 219 L LEU CA 3 C4H1s 0.770 1.880 2.788 13.455 13.122 1.025 [OK] 1721 219 L LEU C 1 C3H0s 0.770 1.610 2.378 8.715 8.825 0.987 [OK] 1722 219 L LEU O 16 O1H0u 0.660 1.420 2.845 16.307 16.208 1.006 [OK] 1723 219 L LEU CB 8 C4H2s 0.770 1.880 3.040 24.304 22.951 1.059 possible 1724 219 L LEU CG 4 C4H1b 0.770 1.880 3.097 16.580 14.764 1.123 possible 1725 219 L LEU CD1 10 C4H3u 0.770 1.880 3.002 34.653 37.425 0.926 possible 1726 219 L LEU CD2 10 C4H3u 0.770 1.880 3.120 43.013 37.143 1.158 possible 1727 220 L VAL N 12 N3H1s 0.700 1.640 2.736 13.022 13.676 0.952 [OK] 1728 220 L VAL CA 3 C4H1s 0.770 1.880 3.520 13.579 13.123 1.035 possible 1729 220 L VAL C 1 C3H0s 0.770 1.610 2.451 8.367 8.563 0.977 [OK] 1730 220 L VAL O 16 O1H0u 0.660 1.420 4.376 22.644 16.181 1.399 possible 1731 220 L VAL CB 4 C4H1b 0.770 1.880 3.051 17.538 14.598 1.201 possible 1732 220 L VAL CG1 10 C4H3u 0.770 1.880 3.241 38.043 36.584 1.040 possible 1733 220 L VAL CG2 10 C4H3u 0.770 1.880 5.297 56.860 36.332 1.565 possible 1734 221 L GLY N 12 N3H1s 0.700 1.640 2.329 12.732 14.854 0.857 [OK] 1735 221 L GLY CA 8 C4H2s 0.770 1.880 2.775 22.963 23.688 0.969 [OK] 1736 221 L GLY C 2 C3H0b 0.770 1.610 2.511 10.222 9.840 1.039 [OK] 1737 221 L GLY O 16 O1H0u 0.660 1.420 2.475 17.240 16.391 1.052 [OK] 1738 222 L TYR N 12 N3H1s 0.700 1.640 2.419 14.149 13.691 1.033 [OK] 1739 222 L TYR CA 3 C4H1s 0.770 1.880 2.667 13.155 13.330 0.987 [OK] 1740 222 L TYR C 1 C3H0s 0.770 1.610 2.601 9.363 8.770 1.068 [OK] 1741 222 L TYR O 16 O1H0u 0.660 1.420 2.706 17.614 16.124 1.092 [OK] 1742 222 L TYR CB 8 C4H2s 0.770 1.880 3.152 24.495 23.678 1.034 possible 1743 222 L TYR CG 2 C3H0b 0.770 1.610 2.605 9.565 9.732 0.983 [OK] 1744 222 L TYR CD1 5 C3H1s 0.770 1.760 2.732 18.594 20.171 0.922 [OK] 1745 222 L TYR CD2 5 C3H1s 0.770 1.760 3.465 23.343 20.728 1.126 possible 1746 222 L TYR CE1 5 C3H1s 0.770 1.760 2.845 19.693 20.675 0.952 [OK] 1747 222 L TYR CE2 5 C3H1s 0.770 1.760 4.498 30.837 20.810 1.482 possible 1748 222 L TYR CZ 2 C3H0b 0.770 1.610 2.603 10.049 9.926 1.012 [OK] 1749 222 L TYR OH 17 O2H1u 0.660 1.460 3.268 23.018 19.173 1.201 possible 1750 223 L SER N 12 N3H1s 0.700 1.640 2.410 13.186 14.103 0.935 [OK] 1751 223 L SER CA 3 C4H1s 0.770 1.880 2.744 13.892 13.476 1.031 [OK] 1752 223 L SER C 1 C3H0s 0.770 1.610 2.192 8.200 8.923 0.919 [OK] 1753 223 L SER O 16 O1H0u 0.660 1.420 2.210 13.860 16.179 0.857 [OK] 1754 223 L SER CB 8 C4H2s 0.770 1.880 2.692 23.691 23.884 0.992 [OK] 1755 223 L SER OG 17 O2H1u 0.660 1.460 2.785 22.515 18.732 1.202 [OK] 1756 224 L ILE N 12 N3H1s 0.700 1.640 2.340 13.349 13.633 0.979 [OK] 1757 224 L ILE CA 3 C4H1s 0.770 1.880 2.511 12.344 13.007 0.949 [OK] 1758 224 L ILE C 1 C3H0s 0.770 1.610 2.280 8.570 8.470 1.012 [OK] 1759 224 L ILE O 16 O1H0u 0.660 1.420 2.225 14.848 16.144 0.920 [OK] 1760 224 L ILE CB 4 C4H1b 0.770 1.880 2.968 13.958 14.227 0.981 [OK] 1761 224 L ILE CG1 9 C4H2b 0.770 1.880 3.605 23.716 24.187 0.981 possible 1762 224 L ILE CG2 10 C4H3u 0.770 1.880 2.840 30.880 35.961 0.859 [OK] 1763 224 L ILE CD1 10 C4H3u 0.770 1.880 4.958 56.017 38.377 1.460 possible 1764 225 L GLY N 12 N3H1s 0.700 1.640 2.589 15.706 14.854 1.057 [OK] 1765 225 L GLY CA 8 C4H2s 0.770 1.880 2.849 24.109 23.688 1.018 [OK] 1766 225 L GLY C 2 C3H0b 0.770 1.610 2.224 9.571 9.840 0.973 [OK] 1767 225 L GLY O 16 O1H0u 0.660 1.420 2.126 14.338 16.391 0.875 [OK] 1768 226 L THR N 12 N3H1s 0.700 1.640 2.471 13.462 13.832 0.973 [OK] 1769 226 L THR CA 3 C4H1s 0.770 1.880 2.895 14.078 13.099 1.075 [OK] 1770 226 L THR C 1 C3H0s 0.770 1.610 2.152 8.597 8.738 0.984 [OK] 1771 226 L THR O 16 O1H0u 0.660 1.420 2.665 15.826 16.020 0.988 [OK] 1772 226 L THR CB 4 C4H1b 0.770 1.880 2.780 13.872 14.829 0.935 [OK] 1773 226 L THR OG1 17 O2H1u 0.660 1.460 3.025 25.551 18.123 1.410 possible 1774 226 L THR CG2 10 C4H3u 0.770 1.880 3.181 38.774 36.542 1.061 possible 1775 227 L LEU N 12 N3H1s 0.700 1.640 2.710 14.356 13.655 1.051 [OK] 1776 227 L LEU CA 3 C4H1s 0.770 1.880 3.249 13.682 13.122 1.043 possible 1777 227 L LEU C 1 C3H0s 0.770 1.610 2.399 8.497 8.825 0.963 [OK] 1778 227 L LEU O 16 O1H0u 0.660 1.420 2.790 16.752 16.208 1.034 [OK] 1779 227 L LEU CB 8 C4H2s 0.770 1.880 3.121 24.268 22.951 1.057 possible 1780 227 L LEU CG 4 C4H1b 0.770 1.880 3.218 14.793 14.764 1.002 possible 1781 227 L LEU CD1 10 C4H3u 0.770 1.880 3.249 36.552 37.425 0.977 possible 1782 227 L LEU CD2 10 C4H3u 0.770 1.880 3.257 42.275 37.143 1.138 possible 1783 228 L GLY N 12 N3H1s 0.700 1.640 2.977 15.218 14.854 1.024 [OK] 1784 228 L GLY CA 8 C4H2s 0.770 1.880 2.869 25.218 23.688 1.065 [OK] 1785 228 L GLY C 2 C3H0b 0.770 1.610 2.228 8.673 9.840 0.881 [OK] 1786 228 L GLY O 16 O1H0u 0.660 1.420 2.502 14.490 16.391 0.884 [OK] 1787 229 L ILE N 12 N3H1s 0.700 1.640 2.287 12.944 13.633 0.949 [OK] 1788 229 L ILE CA 3 C4H1s 0.770 1.880 2.720 12.830 13.007 0.986 [OK] 1789 229 L ILE C 1 C3H0s 0.770 1.610 2.822 8.315 8.470 0.982 [OK] 1790 229 L ILE O 16 O1H0u 0.660 1.420 2.551 15.588 16.144 0.966 [OK] 1791 229 L ILE CB 4 C4H1b 0.770 1.880 2.766 14.601 14.227 1.026 [OK] 1792 229 L ILE CG1 9 C4H2b 0.770 1.880 3.089 22.418 24.187 0.927 possible 1793 229 L ILE CG2 10 C4H3u 0.770 1.880 2.977 31.111 35.961 0.865 [OK] 1794 229 L ILE CD1 10 C4H3u 0.770 1.880 3.205 37.712 38.377 0.983 possible 1795 230 L HIS N 12 N3H1s 0.700 1.640 2.738 12.868 13.715 0.938 [OK] 1796 230 L HIS CA 3 C4H1s 0.770 1.880 2.953 14.857 13.467 1.103 [OK] 1797 230 L HIS C 1 C3H0s 0.770 1.610 2.477 8.849 8.882 0.996 [OK] 1798 230 L HIS O 16 O1H0u 0.660 1.420 2.480 17.813 16.082 1.108 [OK] 1799 230 L HIS CB 8 C4H2s 0.770 1.880 3.249 26.492 23.653 1.120 possible 1800 230 L HIS CG 2 C3H0b 0.770 1.610 2.450 8.875 9.952 0.892 [OK] 1801 230 L HIS ND1 13 N3H1b 0.700 1.640 2.935 15.055 15.506 0.971 [OK] 1802 230 L HIS CD2 5 C3H1s 0.770 1.760 2.930 23.273 21.085 1.104 [OK] 1803 230 L HIS CE1 5 C3H1s 0.770 1.760 2.737 21.066 20.636 1.021 [OK] 1804 230 L HIS NE2 13 N3H1b 0.700 1.640 2.544 10.979 15.337 0.716 [OK] 1805 231 L ARG N 12 N3H1s 0.700 1.640 2.415 13.313 13.650 0.975 [OK] 1806 231 L ARG CA 3 C4H1s 0.770 1.880 3.261 14.698 13.422 1.095 possible 1807 231 L ARG C 1 C3H0s 0.770 1.610 2.330 8.140 8.838 0.921 [OK] 1808 231 L ARG O 16 O1H0u 0.660 1.420 2.775 17.511 16.084 1.089 [OK] 1809 231 L ARG CB 8 C4H2s 0.770 1.880 2.894 22.334 23.088 0.967 [OK] 1810 231 L ARG CG 8 C4H2s 0.770 1.880 3.290 24.830 23.640 1.050 possible 1811 231 L ARG CD 8 C4H2s 0.770 1.880 2.676 20.973 23.300 0.900 [OK] 1812 231 L ARG NE 13 N3H1b 0.700 1.640 2.811 16.639 15.569 1.069 [OK] 1813 231 L ARG CZ 2 C3H0b 0.770 1.610 2.631 9.337 9.747 0.958 [OK] 1814 231 L ARG NH1 15 N3H2u 0.700 1.640 2.952 25.250 22.782 1.108 [OK] 1815 231 L ARG NH2 15 N3H2u 0.700 1.640 2.884 22.510 23.810 0.945 [OK] 1816 232 L LEU N 12 N3H1s 0.700 1.640 2.280 11.959 13.655 0.876 [OK] 1817 232 L LEU CA 3 C4H1s 0.770 1.880 2.889 13.165 13.122 1.003 [OK] 1818 232 L LEU C 1 C3H0s 0.770 1.610 2.527 8.213 8.825 0.931 [OK] 1819 232 L LEU O 16 O1H0u 0.660 1.420 2.704 14.419 16.208 0.890 [OK] 1820 232 L LEU CB 8 C4H2s 0.770 1.880 2.955 20.799 22.951 0.906 [OK] 1821 232 L LEU CG 4 C4H1b 0.770 1.880 3.156 14.973 14.764 1.014 possible 1822 232 L LEU CD1 10 C4H3u 0.770 1.880 6.978 101.494 37.425 2.712 possible 1823 232 L LEU CD2 10 C4H3u 0.770 1.880 3.904 43.337 37.143 1.167 possible 1824 233 L GLY N 12 N3H1s 0.700 1.640 2.888 15.200 14.854 1.023 [OK] 1825 233 L GLY CA 8 C4H2s 0.770 1.880 2.988 24.394 23.688 1.030 [OK] 1826 233 L GLY C 2 C3H0b 0.770 1.610 2.489 9.481 9.840 0.963 [OK] 1827 233 L GLY O 16 O1H0u 0.660 1.420 2.407 16.274 16.391 0.993 [OK] 1828 234 L LEU N 12 N3H1s 0.700 1.640 2.680 15.199 13.655 1.113 [OK] 1829 234 L LEU CA 3 C4H1s 0.770 1.880 2.916 14.214 13.122 1.083 [OK] 1830 234 L LEU C 1 C3H0s 0.770 1.610 2.566 8.247 8.825 0.935 [OK] 1831 234 L LEU O 16 O1H0u 0.660 1.420 2.394 14.811 16.208 0.914 [OK] 1832 234 L LEU CB 8 C4H2s 0.770 1.880 3.123 24.206 22.951 1.055 possible 1833 234 L LEU CG 4 C4H1b 0.770 1.880 3.295 15.791 14.764 1.070 possible 1834 234 L LEU CD1 10 C4H3u 0.770 1.880 3.367 33.829 37.425 0.904 possible 1835 234 L LEU CD2 10 C4H3u 0.770 1.880 3.844 49.981 37.143 1.346 possible 1836 235 L LEU N 12 N3H1s 0.700 1.640 2.381 12.458 13.655 0.912 [OK] 1837 235 L LEU CA 3 C4H1s 0.770 1.880 3.256 13.798 13.122 1.052 possible 1838 235 L LEU C 1 C3H0s 0.770 1.610 3.328 9.324 8.825 1.057 possible 1839 235 L LEU O 16 O1H0u 0.660 1.420 3.144 17.650 16.208 1.089 possible 1840 235 L LEU CB 8 C4H2s 0.770 1.880 4.526 30.832 22.951 1.343 possible 1841 235 L LEU CG 4 C4H1b 0.770 1.880 3.449 17.069 14.764 1.156 possible 1842 235 L LEU CD1 10 C4H3u 0.770 1.880 44.319 -1.000 37.425 -1.000 bad 1843 235 L LEU CD2 10 C4H3u 0.770 1.880 5.834 65.310 37.143 1.758 possible 1844 236 L LEU N 12 N3H1s 0.700 1.640 3.005 13.408 13.655 0.982 possible 1845 236 L LEU CA 3 C4H1s 0.770 1.880 3.161 13.557 13.122 1.033 possible 1846 236 L LEU C 1 C3H0s 0.770 1.610 2.421 8.548 8.825 0.969 [OK] 1847 236 L LEU O 16 O1H0u 0.660 1.420 2.550 16.333 16.208 1.008 [OK] 1848 236 L LEU CB 8 C4H2s 0.770 1.880 2.872 22.311 22.951 0.972 [OK] 1849 236 L LEU CG 4 C4H1b 0.770 1.880 3.104 13.380 14.764 0.906 possible 1850 236 L LEU CD1 10 C4H3u 0.770 1.880 3.265 37.519 37.425 1.003 possible 1851 236 L LEU CD2 10 C4H3u 0.770 1.880 6.113 59.552 37.143 1.603 possible 1852 237 L SER N 12 N3H1s 0.700 1.640 2.345 13.061 14.103 0.926 [OK] 1853 237 L SER CA 3 C4H1s 0.770 1.880 3.162 15.954 13.476 1.184 possible 1854 237 L SER C 1 C3H0s 0.770 1.610 2.560 8.983 8.923 1.007 [OK] 1855 237 L SER O 16 O1H0u 0.660 1.420 2.539 17.524 16.179 1.083 [OK] 1856 237 L SER CB 8 C4H2s 0.770 1.880 2.891 23.227 23.884 0.972 [OK] 1857 237 L SER OG 17 O2H1u 0.660 1.460 2.390 17.958 18.732 0.959 [OK] 1858 238 L LEU N 12 N3H1s 0.700 1.640 2.495 12.811 13.655 0.938 [OK] 1859 238 L LEU CA 3 C4H1s 0.770 1.880 2.892 14.252 13.122 1.086 [OK] 1860 238 L LEU C 1 C3H0s 0.770 1.610 3.368 9.084 8.825 1.029 possible 1861 238 L LEU O 16 O1H0u 0.660 1.420 3.063 16.966 16.208 1.047 possible 1862 238 L LEU CB 8 C4H2s 0.770 1.880 4.337 29.029 22.951 1.265 possible 1863 238 L LEU CG 4 C4H1b 0.770 1.880 2.685 14.413 14.764 0.976 [OK] 1864 238 L LEU CD1 10 C4H3u 0.770 1.880 3.007 34.677 37.425 0.927 possible 1865 238 L LEU CD2 10 C4H3u 0.770 1.880 4.535 53.699 37.143 1.446 possible 1866 239 L SER N 12 N3H1s 0.700 1.640 3.571 14.738 14.103 1.045 possible 1867 239 L SER CA 3 C4H1s 0.770 1.880 3.858 17.422 13.476 1.293 possible 1868 239 L SER C 1 C3H0s 0.770 1.610 2.231 8.519 8.923 0.955 [OK] 1869 239 L SER O 16 O1H0u 0.660 1.420 2.472 15.545 16.179 0.961 [OK] 1870 239 L SER CB 8 C4H2s 0.770 1.880 3.254 23.778 23.884 0.996 possible 1871 239 L SER OG 17 O2H1u 0.660 1.460 6.280 67.763 18.732 3.617 possible 1872 240 L ALA N 12 N3H1s 0.700 1.640 2.275 12.274 14.046 0.874 [OK] 1873 240 L ALA CA 4 C4H1b 0.770 1.880 2.799 14.289 14.063 1.016 [OK] 1874 240 L ALA C 1 C3H0s 0.770 1.610 2.422 8.510 8.900 0.956 [OK] 1875 240 L ALA O 16 O1H0u 0.660 1.420 2.355 14.950 16.188 0.924 [OK] 1876 240 L ALA CB 10 C4H3u 0.770 1.880 3.178 34.012 36.782 0.925 possible 1877 241 L VAL N 12 N3H1s 0.700 1.640 2.428 12.976 13.676 0.949 [OK] 1878 241 L VAL CA 3 C4H1s 0.770 1.880 2.898 13.930 13.123 1.062 [OK] 1879 241 L VAL C 1 C3H0s 0.770 1.610 2.783 8.115 8.563 0.948 [OK] 1880 241 L VAL O 16 O1H0u 0.660 1.420 3.096 16.516 16.181 1.021 possible 1881 241 L VAL CB 4 C4H1b 0.770 1.880 2.892 15.698 14.598 1.075 [OK] 1882 241 L VAL CG1 10 C4H3u 0.770 1.880 3.589 36.820 36.584 1.006 possible 1883 241 L VAL CG2 10 C4H3u 0.770 1.880 3.074 37.403 36.332 1.029 possible 1884 242 L PHE N 12 N3H1s 0.700 1.640 3.061 14.658 13.691 1.071 possible 1885 242 L PHE CA 3 C4H1s 0.770 1.880 3.994 20.198 13.449 1.502 possible 1886 242 L PHE C 1 C3H0s 0.770 1.610 2.115 7.541 8.753 0.861 [OK] 1887 242 L PHE O 16 O1H0u 0.660 1.420 3.247 17.364 16.151 1.075 possible 1888 242 L PHE CB 8 C4H2s 0.770 1.880 4.587 29.493 23.777 1.240 possible 1889 242 L PHE CG 2 C3H0b 0.770 1.610 6.237 17.447 9.721 1.795 possible 1890 242 L PHE CD1 5 C3H1s 0.770 1.760 6.874 53.170 20.405 2.606 possible 1891 242 L PHE CD2 6 C3H1b 0.770 1.760 6.535 29.988 21.051 1.425 possible 1892 242 L PHE CE1 6 C3H1b 0.770 1.760 35.679 -1.000 21.580 -1.000 bad 1893 242 L PHE CE2 6 C3H1b 0.770 1.760 11.845 -1.000 21.680 -1.000 bad 1894 242 L PHE CZ 6 C3H1b 0.770 1.760 25.746 -1.000 21.666 -1.000 bad 1895 243 L PHE N 12 N3H1s 0.700 1.640 2.256 12.470 13.691 0.911 [OK] 1896 243 L PHE CA 3 C4H1s 0.770 1.880 2.782 13.115 13.449 0.975 [OK] 1897 243 L PHE C 1 C3H0s 0.770 1.610 2.210 8.305 8.753 0.949 [OK] 1898 243 L PHE O 16 O1H0u 0.660 1.420 2.450 16.024 16.151 0.992 [OK] 1899 243 L PHE CB 8 C4H2s 0.770 1.880 2.856 22.125 23.777 0.931 [OK] 1900 243 L PHE CG 2 C3H0b 0.770 1.610 2.568 9.490 9.721 0.976 [OK] 1901 243 L PHE CD1 5 C3H1s 0.770 1.760 2.873 20.698 20.405 1.014 [OK] 1902 243 L PHE CD2 6 C3H1b 0.770 1.760 2.971 19.365 21.051 0.920 [OK] 1903 243 L PHE CE1 6 C3H1b 0.770 1.760 8.195 -1.000 21.580 -1.000 bad 1904 243 L PHE CE2 6 C3H1b 0.770 1.760 12.486 -1.000 21.680 -1.000 bad 1905 243 L PHE CZ 6 C3H1b 0.770 1.760 26.386 -1.000 21.666 -1.000 bad 1906 244 L SER N 12 N3H1s 0.700 1.640 2.232 12.024 14.103 0.853 [OK] 1907 244 L SER CA 3 C4H1s 0.770 1.880 3.097 15.179 13.476 1.126 possible 1908 244 L SER C 1 C3H0s 0.770 1.610 2.046 7.861 8.923 0.881 [OK] 1909 244 L SER O 16 O1H0u 0.660 1.420 2.203 13.574 16.179 0.839 [OK] 1910 244 L SER CB 8 C4H2s 0.770 1.880 2.975 22.304 23.884 0.934 [OK] 1911 244 L SER OG 17 O2H1u 0.660 1.460 2.483 17.876 18.732 0.954 [OK] 1912 245 L ALA N 12 N3H1s 0.700 1.640 2.743 13.321 14.046 0.948 [OK] 1913 245 L ALA CA 4 C4H1b 0.770 1.880 2.980 15.158 14.063 1.078 [OK] 1914 245 L ALA C 1 C3H0s 0.770 1.610 3.712 9.426 8.900 1.059 possible 1915 245 L ALA O 16 O1H0u 0.660 1.420 3.192 16.211 16.188 1.001 possible 1916 245 L ALA CB 10 C4H3u 0.770 1.880 5.077 64.581 36.782 1.756 possible 1917 246 L LEU N 12 N3H1s 0.700 1.640 4.194 15.438 13.655 1.131 possible 1918 246 L LEU CA 3 C4H1s 0.770 1.880 4.314 14.741 13.122 1.123 possible 1919 246 L LEU C 1 C3H0s 0.770 1.610 2.499 8.180 8.825 0.927 [OK] 1920 246 L LEU O 16 O1H0u 0.660 1.420 2.372 14.539 16.208 0.897 [OK] 1921 246 L LEU CB 8 C4H2s 0.770 1.880 3.588 23.364 22.951 1.018 possible 1922 246 L LEU CG 4 C4H1b 0.770 1.880 3.702 17.244 14.764 1.168 possible 1923 246 L LEU CD1 10 C4H3u 0.770 1.880 33.811 -1.000 37.425 -1.000 bad 1924 246 L LEU CD2 10 C4H3u 0.770 1.880 26.120 -1.000 37.143 -1.000 bad 1925 247 L CYS N 12 N3H1s 0.700 1.640 2.328 12.292 13.981 0.879 [OK] 1926 247 L CYS CA 3 C4H1s 0.770 1.880 2.680 13.231 13.656 0.969 [OK] 1927 247 L CYS C 1 C3H0s 0.770 1.610 2.497 8.361 8.897 0.940 [OK] 1928 247 L CYS O 16 O1H0u 0.660 1.420 2.353 15.018 16.543 0.908 [OK] 1929 247 L CYS CB 9 C4H2b 0.770 1.880 2.755 19.573 23.536 0.832 [OK] 1930 247 L CYS SG 20 S2H1u 1.040 1.770 2.999 36.497 34.603 1.055 [OK] 1931 248 L MET N 12 N3H1s 0.700 1.640 2.307 12.597 13.564 0.929 [OK] 1932 248 L MET CA 3 C4H1s 0.770 1.880 2.644 12.013 13.231 0.908 [OK] 1933 248 L MET C 1 C3H0s 0.770 1.610 2.656 8.510 8.782 0.969 [OK] 1934 248 L MET O 16 O1H0u 0.660 1.420 2.527 14.665 16.277 0.901 [OK] 1935 248 L MET CB 8 C4H2s 0.770 1.880 3.134 25.468 23.645 1.077 possible 1936 248 L MET CG 9 C4H2b 0.770 1.880 2.480 18.817 24.009 0.784 [OK] 1937 248 L MET SD 19 S2H0u 1.040 1.770 2.825 28.071 30.093 0.933 [OK] 1938 248 L MET CE 10 C4H3u 0.770 1.880 3.051 39.065 37.161 1.051 possible 1939 249 L ILE N 12 N3H1s 0.700 1.640 2.682 13.532 13.633 0.993 [OK] 1940 249 L ILE CA 3 C4H1s 0.770 1.880 2.745 13.605 13.007 1.046 [OK] 1941 249 L ILE C 1 C3H0s 0.770 1.610 2.610 8.670 8.470 1.024 [OK] 1942 249 L ILE O 16 O1H0u 0.660 1.420 3.561 21.767 16.144 1.348 possible 1943 249 L ILE CB 4 C4H1b 0.770 1.880 3.378 13.154 14.227 0.925 possible 1944 249 L ILE CG1 9 C4H2b 0.770 1.880 3.620 26.426 24.187 1.093 possible 1945 249 L ILE CG2 10 C4H3u 0.770 1.880 7.069 71.367 35.961 1.985 possible 1946 249 L ILE CD1 10 C4H3u 0.770 1.880 28.405 -1.000 38.377 -1.000 bad 1947 250 L ILE N 12 N3H1s 0.700 1.640 2.218 12.031 13.633 0.883 [OK] 1948 250 L ILE CA 3 C4H1s 0.770 1.880 3.357 13.074 13.007 1.005 possible 1949 250 L ILE C 1 C3H0s 0.770 1.610 2.592 9.094 8.470 1.074 [OK] 1950 250 L ILE O 16 O1H0u 0.660 1.420 2.577 16.095 16.144 0.997 [OK] 1951 250 L ILE CB 4 C4H1b 0.770 1.880 3.382 14.717 14.227 1.034 possible 1952 250 L ILE CG1 9 C4H2b 0.770 1.880 2.928 20.757 24.187 0.858 [OK] 1953 250 L ILE CG2 10 C4H3u 0.770 1.880 6.221 68.721 35.961 1.911 possible 1954 250 L ILE CD1 10 C4H3u 0.770 1.880 6.309 74.754 38.377 1.948 possible 1955 251 L THR N 12 N3H1s 0.700 1.640 2.645 12.803 13.832 0.926 [OK] 1956 251 L THR CA 3 C4H1s 0.770 1.880 3.102 14.856 13.099 1.134 possible 1957 251 L THR C 1 C3H0s 0.770 1.610 2.419 8.407 8.738 0.962 [OK] 1958 251 L THR O 16 O1H0u 0.660 1.420 2.541 17.525 16.020 1.094 [OK] 1959 251 L THR CB 4 C4H1b 0.770 1.880 2.815 14.910 14.829 1.005 [OK] 1960 251 L THR OG1 17 O2H1u 0.660 1.460 2.662 16.438 18.123 0.907 [OK] 1961 251 L THR CG2 10 C4H3u 0.770 1.880 3.123 36.224 36.542 0.991 possible 1962 252 L GLY N 12 N3H1s 0.700 1.640 2.617 14.085 14.854 0.948 [OK] 1963 252 L GLY CA 8 C4H2s 0.770 1.880 4.157 27.041 23.688 1.142 possible 1964 252 L GLY C 2 C3H0b 0.770 1.610 2.592 10.515 9.840 1.069 [OK] 1965 252 L GLY O 16 O1H0u 0.660 1.420 5.029 40.236 16.391 2.455 possible 1966 253 L THR N 12 N3H1s 0.700 1.640 2.592 13.829 13.832 1.000 [OK] 1967 253 L THR CA 3 C4H1s 0.770 1.880 4.126 17.806 13.099 1.359 possible 1968 253 L THR C 1 C3H0s 0.770 1.610 2.597 9.297 8.738 1.064 [OK] 1969 253 L THR O 16 O1H0u 0.660 1.420 17.064 -1.000 16.020 -1.000 bad 1970 253 L THR CB 4 C4H1b 0.770 1.880 4.149 19.261 14.829 1.299 possible 1971 253 L THR OG1 17 O2H1u 0.660 1.460 3.280 18.623 18.123 1.028 possible 1972 253 L THR CG2 10 C4H3u 0.770 1.880 3.204 38.869 36.542 1.064 possible 1973 254 L ILE N 12 N3H1s 0.700 1.640 2.548 12.324 13.633 0.904 [OK] 1974 254 L ILE CA 3 C4H1s 0.770 1.880 5.357 17.858 13.007 1.373 possible 1975 254 L ILE C 1 C3H0s 0.770 1.610 2.598 9.093 8.470 1.074 [OK] 1976 254 L ILE O 16 O1H0u 0.660 1.420 21.017 -1.000 16.144 -1.000 bad 1977 254 L ILE CB 4 C4H1b 0.770 1.880 7.484 -1.000 14.227 -1.000 bad 1978 254 L ILE CG1 9 C4H2b 0.770 1.880 3.859 26.289 24.187 1.087 possible 1979 254 L ILE CG2 10 C4H3u 0.770 1.880 41.724 -1.000 35.961 -1.000 bad 1980 254 L ILE CD1 10 C4H3u 0.770 1.880 47.157 -1.000 38.377 -1.000 bad 1981 255 L TRP N 12 N3H1s 0.700 1.640 2.608 14.529 13.791 1.054 [OK] 1982 255 L TRP CA 3 C4H1s 0.770 1.880 3.650 14.957 13.377 1.118 possible 1983 255 L TRP C 1 C3H0s 0.770 1.610 2.367 8.240 8.724 0.945 [OK] 1984 255 L TRP O 16 O1H0u 0.660 1.420 2.599 17.913 15.951 1.123 [OK] 1985 255 L TRP CB 8 C4H2s 0.770 1.880 4.244 30.934 24.004 1.289 possible 1986 255 L TRP CG 2 C3H0b 0.770 1.610 2.512 8.785 9.965 0.882 [OK] 1987 255 L TRP CD1 5 C3H1s 0.770 1.760 2.944 21.301 20.874 1.020 [OK] 1988 255 L TRP CD2 2 C3H0b 0.770 1.610 3.332 11.455 10.097 1.134 possible 1989 255 L TRP NE1 13 N3H1b 0.700 1.640 2.456 14.441 16.969 0.851 [OK] 1990 255 L TRP CE2 2 C3H0b 0.770 1.610 3.056 10.696 9.889 1.082 possible 1991 255 L TRP CE3 6 C3H1b 0.770 1.760 6.177 52.039 20.448 2.545 possible 1992 255 L TRP CZ2 6 C3H1b 0.770 1.760 3.159 21.205 21.012 1.009 possible 1993 255 L TRP CZ3 6 C3H1b 0.770 1.760 23.023 -1.000 21.516 -1.000 bad 1994 255 L TRP CH2 6 C3H1b 0.770 1.760 7.470 43.088 21.339 2.019 possible 1995 256 L PHE N 12 N3H1s 0.700 1.640 3.734 18.020 13.691 1.316 possible 1996 256 L PHE CA 3 C4H1s 0.770 1.880 3.728 15.498 13.449 1.152 possible 1997 256 L PHE C 1 C3H0s 0.770 1.610 2.503 9.402 8.753 1.074 [OK] 1998 256 L PHE O 16 O1H0u 0.660 1.420 16.543 -1.000 16.151 -1.000 bad 1999 256 L PHE CB 8 C4H2s 0.770 1.880 20.923 -1.000 23.777 -1.000 bad 2000 256 L PHE CG 2 C3H0b 0.770 1.610 0.536 -1.000 9.721 -1.000 bad 2001 256 L PHE CD1 5 C3H1s 0.770 1.760 16.269 -1.000 20.405 -1.000 bad 2002 256 L PHE CD2 6 C3H1b 0.770 1.760 19.645 -1.000 21.051 -1.000 bad 2003 256 L PHE CE1 6 C3H1b 0.770 1.760 16.511 -1.000 21.580 -1.000 bad 2004 256 L PHE CE2 6 C3H1b 0.770 1.760 24.338 -1.000 21.680 -1.000 bad 2005 256 L PHE CZ 6 C3H1b 0.770 1.760 19.451 -1.000 21.666 -1.000 bad 2006 257 L ASP N 12 N3H1s 0.700 1.640 3.164 15.474 13.895 1.114 possible 2007 257 L ASP CA 3 C4H1s 0.770 1.880 4.670 18.856 13.377 1.410 possible 2008 257 L ASP C 1 C3H0s 0.770 1.610 3.332 11.548 8.816 1.310 possible 2009 257 L ASP O 16 O1H0u 0.660 1.420 2.729 15.182 16.091 0.944 [OK] 2010 257 L ASP CB 8 C4H2s 0.770 1.880 4.243 32.238 23.481 1.373 possible 2011 257 L ASP CG 2 C3H0b 0.770 1.610 5.266 14.454 9.422 1.534 possible 2012 257 L ASP OD1 16 O1H0u 0.660 1.420 33.851 -1.000 15.505 -1.000 bad 2013 257 L ASP OD2 16 O1H0u 0.660 1.420 42.524 -1.000 16.324 -1.000 bad 2014 258 L GLN N 12 N3H1s 0.700 1.640 3.546 17.264 13.616 1.268 possible 2015 258 L GLN CA 3 C4H1s 0.770 1.880 2.525 12.565 13.334 0.942 [OK] 2016 258 L GLN C 1 C3H0s 0.770 1.610 2.296 8.425 8.787 0.959 [OK] 2017 258 L GLN O 16 O1H0u 0.660 1.420 2.400 15.068 15.993 0.942 [OK] 2018 258 L GLN CB 8 C4H2s 0.770 1.880 3.469 24.575 23.275 1.056 possible 2019 258 L GLN CG 8 C4H2s 0.770 1.880 27.089 -1.000 23.465 -1.000 bad 2020 258 L GLN CD 2 C3H0b 0.770 1.610 2.248 -1.000 9.659 -1.000 bad 2021 258 L GLN OE1 16 O1H0u 0.660 1.420 23.459 -1.000 17.091 -1.000 bad 2022 258 L GLN NE2 15 N3H2u 0.700 1.640 20.981 -1.000 24.150 -1.000 bad 2023 259 L TRP N 12 N3H1s 0.700 1.640 2.426 13.493 13.791 0.978 [OK] 2024 259 L TRP CA 3 C4H1s 0.770 1.880 2.624 12.666 13.377 0.947 [OK] 2025 259 L TRP C 1 C3H0s 0.770 1.610 2.170 7.949 8.724 0.911 [OK] 2026 259 L TRP O 16 O1H0u 0.660 1.420 2.549 16.585 15.951 1.040 [OK] 2027 259 L TRP CB 8 C4H2s 0.770 1.880 2.951 23.933 24.004 0.997 [OK] 2028 259 L TRP CG 2 C3H0b 0.770 1.610 2.483 9.241 9.965 0.927 [OK] 2029 259 L TRP CD1 5 C3H1s 0.770 1.760 2.882 20.954 20.874 1.004 [OK] 2030 259 L TRP CD2 2 C3H0b 0.770 1.610 2.290 8.876 10.097 0.879 [OK] 2031 259 L TRP NE1 13 N3H1b 0.700 1.640 2.801 17.078 16.969 1.006 [OK] 2032 259 L TRP CE2 2 C3H0b 0.770 1.610 2.449 8.694 9.889 0.879 [OK] 2033 259 L TRP CE3 6 C3H1b 0.770 1.760 2.862 20.398 20.448 0.998 [OK] 2034 259 L TRP CZ2 6 C3H1b 0.770 1.760 2.842 19.361 21.012 0.921 [OK] 2035 259 L TRP CZ3 6 C3H1b 0.770 1.760 3.749 25.207 21.516 1.172 possible 2036 259 L TRP CH2 6 C3H1b 0.770 1.760 4.107 27.627 21.339 1.295 possible 2037 260 L VAL N 12 N3H1s 0.700 1.640 2.261 11.805 13.676 0.863 [OK] 2038 260 L VAL CA 3 C4H1s 0.770 1.880 2.574 12.476 13.123 0.951 [OK] 2039 260 L VAL C 1 C3H0s 0.770 1.610 2.878 8.467 8.563 0.989 [OK] 2040 260 L VAL O 16 O1H0u 0.660 1.420 3.460 24.512 16.181 1.515 possible 2041 260 L VAL CB 4 C4H1b 0.770 1.880 2.735 14.551 14.598 0.997 [OK] 2042 260 L VAL CG1 10 C4H3u 0.770 1.880 14.044 -1.000 36.584 -1.000 bad 2043 260 L VAL CG2 10 C4H3u 0.770 1.880 4.549 45.231 36.332 1.245 possible 2044 261 L ASP N 12 N3H1s 0.700 1.640 2.542 12.313 13.895 0.886 [OK] 2045 261 L ASP CA 3 C4H1s 0.770 1.880 3.338 15.010 13.377 1.122 possible 2046 261 L ASP C 1 C3H0s 0.770 1.610 2.663 8.939 8.816 1.014 [OK] 2047 261 L ASP O 16 O1H0u 0.660 1.420 7.043 45.002 16.091 2.797 possible 2048 261 L ASP CB 8 C4H2s 0.770 1.880 15.755 -1.000 23.481 -1.000 bad 2049 261 L ASP CG 2 C3H0b 0.770 1.610 7.813 19.552 9.422 2.075 possible 2050 261 L ASP OD1 16 O1H0u 0.660 1.420 27.713 -1.000 15.505 -1.000 bad 2051 261 L ASP OD2 16 O1H0u 0.660 1.420 18.924 -1.000 16.324 -1.000 bad 2052 262 L TRP N 12 N3H1s 0.700 1.640 2.359 13.190 13.791 0.956 [OK] 2053 262 L TRP CA 3 C4H1s 0.770 1.880 3.894 15.494 13.377 1.158 possible 2054 262 L TRP C 1 C3H0s 0.770 1.610 2.182 7.778 8.724 0.892 [OK] 2055 262 L TRP O 16 O1H0u 0.660 1.420 4.496 22.822 15.951 1.431 possible 2056 262 L TRP CB 8 C4H2s 0.770 1.880 3.068 22.843 24.004 0.952 possible 2057 262 L TRP CG 2 C3H0b 0.770 1.610 2.494 9.910 9.965 0.994 [OK] 2058 262 L TRP CD1 5 C3H1s 0.770 1.760 5.082 31.626 20.874 1.515 possible 2059 262 L TRP CD2 2 C3H0b 0.770 1.610 2.511 10.229 10.097 1.013 [OK] 2060 262 L TRP NE1 13 N3H1b 0.700 1.640 23.812 -1.000 16.969 -1.000 bad 2061 262 L TRP CE2 2 C3H0b 0.770 1.610 3.205 10.677 9.889 1.080 possible 2062 262 L TRP CE3 6 C3H1b 0.770 1.760 2.824 19.720 20.448 0.964 [OK] 2063 262 L TRP CZ2 6 C3H1b 0.770 1.760 22.594 -1.000 21.012 -1.000 bad 2064 262 L TRP CZ3 6 C3H1b 0.770 1.760 3.567 23.373 21.516 1.086 possible 2065 262 L TRP CH2 6 C3H1b 0.770 1.760 16.525 -1.000 21.339 -1.000 bad 2066 263 L TRP N 12 N3H1s 0.700 1.640 2.376 12.932 13.791 0.938 [OK] 2067 263 L TRP CA 3 C4H1s 0.770 1.880 3.181 15.008 13.377 1.122 possible 2068 263 L TRP C 1 C3H0s 0.770 1.610 2.714 9.385 8.724 1.076 [OK] 2069 263 L TRP O 16 O1H0u 0.660 1.420 3.139 21.654 15.951 1.358 possible 2070 263 L TRP CB 8 C4H2s 0.770 1.880 3.364 29.894 24.004 1.245 possible 2071 263 L TRP CG 2 C3H0b 0.770 1.610 2.710 9.032 9.965 0.906 [OK] 2072 263 L TRP CD1 5 C3H1s 0.770 1.760 2.976 20.672 20.874 0.990 [OK] 2073 263 L TRP CD2 2 C3H0b 0.770 1.610 2.317 8.879 10.097 0.879 [OK] 2074 263 L TRP NE1 13 N3H1b 0.700 1.640 2.687 16.574 16.969 0.977 [OK] 2075 263 L TRP CE2 2 C3H0b 0.770 1.610 2.356 9.490 9.889 0.960 [OK] 2076 263 L TRP CE3 6 C3H1b 0.770 1.760 3.503 31.367 20.448 1.534 possible 2077 263 L TRP CZ2 6 C3H1b 0.770 1.760 2.741 19.321 21.012 0.920 [OK] 2078 263 L TRP CZ3 6 C3H1b 0.770 1.760 6.866 43.198 21.516 2.008 possible 2079 263 L TRP CH2 6 C3H1b 0.770 1.760 6.567 55.156 21.339 2.585 possible 2080 264 L GLN N 12 N3H1s 0.700 1.640 2.917 14.503 13.616 1.065 [OK] 2081 264 L GLN CA 3 C4H1s 0.770 1.880 2.789 12.831 13.334 0.962 [OK] 2082 264 L GLN C 1 C3H0s 0.770 1.610 3.812 9.748 8.787 1.109 possible 2083 264 L GLN O 16 O1H0u 0.660 1.420 3.023 14.712 15.993 0.920 possible 2084 264 L GLN CB 8 C4H2s 0.770 1.880 7.749 60.217 23.275 2.587 possible 2085 264 L GLN CG 8 C4H2s 0.770 1.880 6.842 65.465 23.465 2.790 possible 2086 264 L GLN CD 2 C3H0b 0.770 1.610 7.865 20.334 9.659 2.105 possible 2087 264 L GLN OE1 16 O1H0u 0.660 1.420 4.962 -1.000 17.091 -1.000 bad 2088 264 L GLN NE2 15 N3H2u 0.700 1.640 7.769 59.118 24.150 2.448 possible 2089 265 L TRP N 12 N3H1s 0.700 1.640 6.361 22.264 13.791 1.614 possible 2090 265 L TRP CA 3 C4H1s 0.770 1.880 7.512 36.478 13.377 2.727 possible 2091 265 L TRP C 1 C3H0s 0.770 1.610 2.088 7.843 8.724 0.899 [OK] 2092 265 L TRP O 16 O1H0u 0.660 1.420 5.810 24.497 15.951 1.536 possible 2093 265 L TRP CB 8 C4H2s 0.770 1.880 29.885 -1.000 24.004 -1.000 bad 2094 265 L TRP CG 2 C3H0b 0.770 1.610 1.374 -1.000 9.965 -1.000 bad 2095 265 L TRP CD1 5 C3H1s 0.770 1.760 4.573 26.090 20.874 1.250 possible 2096 265 L TRP CD2 2 C3H0b 0.770 1.610 2.096 -1.000 10.097 -1.000 bad 2097 265 L TRP NE1 13 N3H1b 0.700 1.640 4.466 21.136 16.969 1.246 possible 2098 265 L TRP CE2 2 C3H0b 0.770 1.610 7.236 17.171 9.889 1.736 possible 2099 265 L TRP CE3 6 C3H1b 0.770 1.760 10.914 -1.000 20.448 -1.000 bad 2100 265 L TRP CZ2 6 C3H1b 0.770 1.760 23.754 -1.000 21.012 -1.000 bad 2101 265 L TRP CZ3 6 C3H1b 0.770 1.760 18.659 -1.000 21.516 -1.000 bad 2102 265 L TRP CH2 6 C3H1b 0.770 1.760 23.435 -1.000 21.339 -1.000 bad 2103 266 L TRP N 12 N3H1s 0.700 1.640 2.629 12.848 13.791 0.932 [OK] 2104 266 L TRP CA 3 C4H1s 0.770 1.880 2.670 13.977 13.377 1.045 [OK] 2105 266 L TRP C 1 C3H0s 0.770 1.610 2.272 8.095 8.724 0.928 [OK] 2106 266 L TRP O 16 O1H0u 0.660 1.420 2.286 15.825 15.951 0.992 [OK] 2107 266 L TRP CB 8 C4H2s 0.770 1.880 3.913 32.652 24.004 1.360 possible 2108 266 L TRP CG 2 C3H0b 0.770 1.610 3.367 10.298 9.965 1.033 possible 2109 266 L TRP CD1 5 C3H1s 0.770 1.760 3.484 22.574 20.874 1.081 possible 2110 266 L TRP CD2 2 C3H0b 0.770 1.610 3.630 12.268 10.097 1.215 possible 2111 266 L TRP NE1 13 N3H1b 0.700 1.640 2.761 15.028 16.969 0.886 [OK] 2112 266 L TRP CE2 2 C3H0b 0.770 1.610 3.050 10.102 9.889 1.021 possible 2113 266 L TRP CE3 6 C3H1b 0.770 1.760 5.035 29.754 20.448 1.455 possible 2114 266 L TRP CZ2 6 C3H1b 0.770 1.760 4.633 37.138 21.012 1.767 possible 2115 266 L TRP CZ3 6 C3H1b 0.770 1.760 27.373 -1.000 21.516 -1.000 bad 2116 266 L TRP CH2 6 C3H1b 0.770 1.760 29.360 -1.000 21.339 -1.000 bad 2117 267 L VAL N 12 N3H1s 0.700 1.640 2.496 13.149 13.676 0.961 [OK] 2118 267 L VAL CA 3 C4H1s 0.770 1.880 2.768 13.939 13.123 1.062 [OK] 2119 267 L VAL C 1 C3H0s 0.770 1.610 2.589 8.296 8.563 0.969 [OK] 2120 267 L VAL O 16 O1H0u 0.660 1.420 2.615 17.149 16.181 1.060 [OK] 2121 267 L VAL CB 4 C4H1b 0.770 1.880 2.724 14.400 14.598 0.986 [OK] 2122 267 L VAL CG1 10 C4H3u 0.770 1.880 3.276 34.419 36.584 0.941 possible 2123 267 L VAL CG2 10 C4H3u 0.770 1.880 3.245 36.770 36.332 1.012 possible 2124 268 L LYS N 12 N3H1s 0.700 1.640 2.404 12.800 13.675 0.936 [OK] 2125 268 L LYS CA 3 C4H1s 0.770 1.880 3.065 13.508 13.324 1.014 possible 2126 268 L LYS C 1 C3H0s 0.770 1.610 3.100 9.865 8.759 1.126 possible 2127 268 L LYS O 16 O1H0u 0.660 1.420 7.568 33.898 16.049 2.112 possible 2128 268 L LYS CB 8 C4H2s 0.770 1.880 15.593 -1.000 22.904 -1.000 bad 2129 268 L LYS CG 8 C4H2s 0.770 1.880 15.596 -1.000 23.131 -1.000 bad 2130 268 L LYS CD 8 C4H2s 0.770 1.880 14.891 -1.000 23.837 -1.000 bad 2131 268 L LYS CE 9 C4H2b 0.770 1.880 22.034 -1.000 23.934 -1.000 bad 2132 268 L LYS NZ 14 N4H3u 0.700 1.640 35.198 -1.000 21.213 -1.000 bad 2133 269 L LEU N 12 N3H1s 0.700 1.640 2.616 14.040 13.655 1.028 [OK] 2134 269 L LEU CA 3 C4H1s 0.770 1.880 3.270 12.130 13.122 0.924 possible 2135 269 L LEU C 1 C3H0s 0.770 1.610 2.383 8.880 8.825 1.006 [OK] 2136 269 L LEU O 16 O1H0u 0.660 1.420 2.467 14.177 16.208 0.875 [OK] 2137 269 L LEU CB 8 C4H2s 0.770 1.880 2.865 20.286 22.951 0.884 [OK] 2138 269 L LEU CG 4 C4H1b 0.770 1.880 4.110 16.821 14.764 1.139 possible 2139 269 L LEU CD1 10 C4H3u 0.770 1.880 24.066 -1.000 37.425 -1.000 bad 2140 269 L LEU CD2 10 C4H3u 0.770 1.880 5.618 51.648 37.143 1.391 possible 2141 270 L PRO N 11 N3H0u 0.700 1.640 2.325 8.751 8.823 0.992 [OK] 2142 270 L PRO CA 4 C4H1b 0.770 1.880 4.187 16.739 13.955 1.199 possible 2143 270 L PRO C 1 C3H0s 0.770 1.610 4.482 9.858 8.812 1.119 possible 2144 270 L PRO O 16 O1H0u 0.660 1.420 17.657 -1.000 16.169 -1.000 bad 2145 270 L PRO CB 9 C4H2b 0.770 1.880 32.014 -1.000 25.563 -1.000 bad 2146 270 L PRO CG 9 C4H2b 0.770 1.880 36.398 -1.000 25.832 -1.000 bad 2147 270 L PRO CD 8 C4H2s 0.770 1.880 12.735 -1.000 23.836 -1.000 bad 2148 271 L TRP N 12 N3H1s 0.700 1.640 4.363 16.279 13.791 1.180 possible 2149 271 L TRP CA 3 C4H1s 0.770 1.880 11.299 -1.000 13.377 -1.000 bad 2150 271 L TRP C 1 C3H0s 0.770 1.610 2.885 9.279 8.724 1.064 [OK] 2151 271 L TRP O 16 O1H0u 0.660 1.420 16.541 -1.000 15.951 -1.000 bad 2152 271 L TRP CB 8 C4H2s 0.770 1.880 30.297 -1.000 24.004 -1.000 bad 2153 271 L TRP CG 2 C3H0b 0.770 1.610 0.650 -1.000 9.965 -1.000 bad 2154 271 L TRP CD1 5 C3H1s 0.770 1.760 14.634 -1.000 20.874 -1.000 bad 2155 271 L TRP CD2 2 C3H0b 0.770 1.610 1.651 -1.000 10.097 -1.000 bad 2156 271 L TRP NE1 13 N3H1b 0.700 1.640 8.003 -1.000 16.969 -1.000 bad 2157 271 L TRP CE2 2 C3H0b 0.770 1.610 1.580 -1.000 9.889 -1.000 bad 2158 271 L TRP CE3 6 C3H1b 0.770 1.760 14.167 -1.000 20.448 -1.000 bad 2159 271 L TRP CZ2 6 C3H1b 0.770 1.760 17.084 -1.000 21.012 -1.000 bad 2160 271 L TRP CZ3 6 C3H1b 0.770 1.760 23.680 -1.000 21.516 -1.000 bad 2161 271 L TRP CH2 6 C3H1b 0.770 1.760 22.097 -1.000 21.339 -1.000 bad 2162 272 L TRP N 12 N3H1s 0.700 1.640 2.596 13.330 13.791 0.967 [OK] 2163 272 L TRP CA 3 C4H1s 0.770 1.880 2.767 12.534 13.377 0.937 [OK] 2164 272 L TRP C 1 C3H0s 0.770 1.610 3.008 9.764 8.724 1.119 possible 2165 272 L TRP O 16 O1H0u 0.660 1.420 2.436 14.772 15.951 0.926 [OK] 2166 272 L TRP CB 8 C4H2s 0.770 1.880 3.076 24.795 24.004 1.033 possible 2167 272 L TRP CG 2 C3H0b 0.770 1.610 2.564 9.405 9.965 0.944 [OK] 2168 272 L TRP CD1 5 C3H1s 0.770 1.760 2.792 17.447 20.874 0.836 [OK] 2169 272 L TRP CD2 2 C3H0b 0.770 1.610 2.409 9.369 10.097 0.928 [OK] 2170 272 L TRP NE1 13 N3H1b 0.700 1.640 2.720 14.433 16.969 0.851 [OK] 2171 272 L TRP CE2 2 C3H0b 0.770 1.610 2.525 9.846 9.889 0.996 [OK] 2172 272 L TRP CE3 6 C3H1b 0.770 1.760 4.278 21.780 20.448 1.065 possible 2173 272 L TRP CZ2 6 C3H1b 0.770 1.760 2.995 21.496 21.012 1.023 [OK] 2174 272 L TRP CZ3 6 C3H1b 0.770 1.760 5.540 33.149 21.516 1.541 possible 2175 272 L TRP CH2 6 C3H1b 0.770 1.760 6.356 38.665 21.339 1.812 possible 2176 273 L ALA N 12 N3H1s 0.700 1.640 2.869 13.666 14.046 0.973 [OK] 2177 273 L ALA CA 4 C4H1b 0.770 1.880 2.951 14.244 14.063 1.013 [OK] 2178 273 L ALA C 1 C3H0s 0.770 1.610 2.452 8.446 8.900 0.949 [OK] 2179 273 L ALA O 16 O1H0u 0.660 1.420 4.461 32.079 16.188 1.982 possible 2180 273 L ALA CB 10 C4H3u 0.770 1.880 3.793 41.117 36.782 1.118 possible 2181 274 L ASN N 12 N3H1s 0.700 1.640 3.814 18.376 13.695 1.342 possible 2182 274 L ASN CA 3 C4H1s 0.770 1.880 4.755 17.374 13.167 1.320 possible 2183 274 L ASN C 1 C3H0s 0.770 1.610 4.156 13.087 8.928 1.466 possible 2184 274 L ASN O 16 O1H0u 0.660 1.420 18.256 -1.000 16.199 -1.000 bad 2185 274 L ASN CB 8 C4H2s 0.770 1.880 31.381 -1.000 23.128 -1.000 bad 2186 274 L ASN CG 2 C3H0b 0.770 1.610 2.368 -1.000 9.599 -1.000 bad 2187 274 L ASN OD1 16 O1H0u 0.660 1.420 22.205 -1.000 16.664 -1.000 bad 2188 274 L ASN ND2 15 N3H2u 0.700 1.640 50.622 -1.000 23.083 -1.000 bad 2189 275 L ILE N 12 N3H1s 0.700 1.640 3.250 15.128 13.633 1.110 possible 2190 275 L ILE CA 3 C4H1s 0.770 1.880 5.197 16.342 13.007 1.256 possible 2191 275 L ILE C 1 C3H0s 0.770 1.610 2.904 8.375 8.470 0.989 [OK] 2192 275 L ILE O 16 O1H0u 0.660 1.420 3.045 19.601 16.144 1.214 possible 2193 275 L ILE CB 4 C4H1b 0.770 1.880 2.699 12.866 14.227 0.904 [OK] 2194 275 L ILE CG1 9 C4H2b 0.770 1.880 14.956 -1.000 24.187 -1.000 bad 2195 275 L ILE CG2 10 C4H3u 0.770 1.880 5.382 52.502 35.961 1.460 possible 2196 275 L ILE CD1 10 C4H3u 0.770 1.880 3.973 38.604 38.377 1.006 possible 2197 276 L PRO N 11 N3H0u 0.700 1.640 3.174 9.243 8.823 1.048 possible 2198 276 L PRO CA 4 C4H1b 0.770 1.880 3.791 14.792 13.955 1.060 possible 2199 276 L PRO C 1 C3H0s 0.770 1.610 3.685 10.024 8.812 1.138 possible 2200 276 L PRO O 16 O1H0u 0.660 1.420 4.892 28.550 16.169 1.766 possible 2201 276 L PRO CB 9 C4H2b 0.770 1.880 22.925 -1.000 25.563 -1.000 bad 2202 276 L PRO CG 9 C4H2b 0.770 1.880 38.421 -1.000 25.832 -1.000 bad 2203 276 L PRO CD 8 C4H2s 0.770 1.880 20.079 -1.000 23.836 -1.000 bad 2204 277 L GLY N 12 N3H1s 0.700 1.640 3.505 15.430 14.854 1.039 possible 2205 277 L GLY CA 8 C4H2s 0.770 1.880 7.317 57.445 23.688 2.425 possible 2206 277 L GLY C 2 C3H0b 0.770 1.610 2.884 10.647 9.840 1.082 [OK] 2207 277 L GLY O 16 O1H0u 0.660 1.420 2.505 15.855 16.391 0.967 [OK] 2208 278 L GLY N 12 N3H1s 0.700 1.640 5.408 24.809 14.854 1.670 possible 2209 278 L GLY CA 8 C4H2s 0.770 1.880 2.810 21.253 23.688 0.897 [OK] 2210 278 L GLY C 2 C3H0b 0.770 1.610 2.855 9.936 9.840 1.010 [OK] 2211 278 L GLY O 16 O1H0u 0.660 1.420 22.377 -1.000 16.391 -1.000 bad 2212 279 L ILE N 12 N3H1s 0.700 1.640 2.504 12.912 13.633 0.947 [OK] 2213 279 L ILE CA 3 C4H1s 0.770 1.880 4.454 14.701 13.007 1.130 possible 2214 279 L ILE C 1 C3H0s 0.770 1.610 2.704 9.381 8.470 1.108 [OK] 2215 279 L ILE O 16 O1H0u 0.660 1.420 24.295 -1.000 16.144 -1.000 bad 2216 279 L ILE CB 4 C4H1b 0.770 1.880 2.722 14.398 14.227 1.012 [OK] 2217 279 L ILE CG1 9 C4H2b 0.770 1.880 2.784 21.138 24.187 0.874 [OK] 2218 279 L ILE CG2 10 C4H3u 0.770 1.880 29.908 -1.000 35.961 -1.000 bad 2219 279 L ILE CD1 10 C4H3u 0.770 1.880 23.882 -1.000 38.377 -1.000 bad 2220 280 L ASN N 12 N3H1s 0.700 1.640 2.428 14.192 13.695 1.036 [OK] 2221 280 L ASN CA 3 C4H1s 0.770 1.880 7.640 24.517 13.167 1.862 possible 2222 280 L ASN C 1 C3H0s 0.770 1.610 7.838 20.352 8.928 2.280 possible 2223 280 L ASN O 16 O1H0u 0.660 1.420 5.685 31.952 16.199 1.972 possible 2224 280 L ASN CB 8 C4H2s 0.770 1.880 4.285 24.094 23.128 1.042 possible 2225 280 L ASN CG 2 C3H0b 0.770 1.610 2.441 9.699 9.599 1.010 [OK] 2226 280 L ASN OD1 16 O1H0u 0.660 1.420 17.643 -1.000 16.664 -1.000 bad 2227 280 L ASN ND2 15 N3H2u 0.700 1.640 2.610 23.403 23.083 1.014 [OK] 2228 281 L GLY N 12 N3H1s 0.700 1.640 3.907 -1.000 14.854 -1.000 bad 2229 281 L GLY CA 8 C4H2s 0.770 1.880 7.882 55.459 23.688 2.341 possible 2230 281 L GLY C 2 C3H0b 0.770 1.610 3.550 -1.000 9.840 -1.000 bad 2231 281 L GLY O 16 O1H0u 0.660 1.420 20.081 -1.000 16.391 -1.000 bad 2232 281 L GLY OXT 16 O1H0u 0.660 1.420 17.882 -1.000 1.420 -1.000 bad 2234 1 M ALA N 12 N3H1s 0.700 1.640 29.572 -1.000 14.046 -1.000 bad 2235 1 M ALA CA 4 C4H1b 0.770 1.880 5.028 47.362 14.063 3.368 possible 2236 1 M ALA C 1 C3H0s 0.770 1.610 3.849 12.229 8.900 1.374 possible 2237 1 M ALA O 16 O1H0u 0.660 1.420 3.355 29.557 16.188 1.826 possible 2238 1 M ALA CB 10 C4H3u 0.770 1.880 62.427 -1.000 36.782 -1.000 bad 2239 2 M GLU N 12 N3H1s 0.700 1.640 4.340 23.734 13.615 1.743 possible 2240 2 M GLU CA 3 C4H1s 0.770 1.880 3.193 16.939 13.399 1.264 possible 2241 2 M GLU C 1 C3H0s 0.770 1.610 2.828 10.013 8.675 1.154 [OK] 2242 2 M GLU O 16 O1H0u 0.660 1.420 4.545 36.841 16.023 2.299 possible 2243 2 M GLU CB 8 C4H2s 0.770 1.880 4.978 28.686 23.529 1.219 possible 2244 2 M GLU CG 8 C4H2s 0.770 1.880 7.040 70.385 23.513 2.993 possible 2245 2 M GLU CD 2 C3H0b 0.770 1.610 3.865 12.493 9.460 1.321 possible 2246 2 M GLU OE1 16 O1H0u 0.660 1.420 4.157 23.497 15.999 1.469 possible 2247 2 M GLU OE2 16 O1H0u 0.660 1.420 4.069 30.795 17.432 1.767 possible 2248 3 M TYR N 12 N3H1s 0.700 1.640 3.102 16.420 13.691 1.199 possible 2249 3 M TYR CA 3 C4H1s 0.770 1.880 3.263 14.238 13.330 1.068 possible 2250 3 M TYR C 1 C3H0s 0.770 1.610 2.438 8.700 8.770 0.992 [OK] 2251 3 M TYR O 16 O1H0u 0.660 1.420 2.352 17.306 16.124 1.073 [OK] 2252 3 M TYR CB 8 C4H2s 0.770 1.880 3.398 30.015 23.678 1.268 possible 2253 3 M TYR CG 2 C3H0b 0.770 1.610 2.578 9.777 9.732 1.005 [OK] 2254 3 M TYR CD1 5 C3H1s 0.770 1.760 3.851 26.178 20.171 1.298 possible 2255 3 M TYR CD2 5 C3H1s 0.770 1.760 2.794 21.350 20.728 1.030 [OK] 2256 3 M TYR CE1 5 C3H1s 0.770 1.760 3.938 23.943 20.675 1.158 possible 2257 3 M TYR CE2 5 C3H1s 0.770 1.760 2.551 16.586 20.810 0.797 [OK] 2258 3 M TYR CZ 2 C3H0b 0.770 1.610 2.251 8.743 9.926 0.881 [OK] 2259 3 M TYR OH 17 O2H1u 0.660 1.460 2.768 19.593 19.173 1.022 [OK] 2260 4 M GLN N 12 N3H1s 0.700 1.640 2.601 13.131 13.616 0.964 [OK] 2261 4 M GLN CA 3 C4H1s 0.770 1.880 2.605 12.753 13.334 0.956 [OK] 2262 4 M GLN C 1 C3H0s 0.770 1.610 2.587 9.652 8.787 1.098 [OK] 2263 4 M GLN O 16 O1H0u 0.660 1.420 2.688 17.523 15.993 1.096 [OK] 2264 4 M GLN CB 8 C4H2s 0.770 1.880 4.475 30.466 23.275 1.309 possible 2265 4 M GLN CG 8 C4H2s 0.770 1.880 7.984 97.014 23.465 4.134 possible 2266 4 M GLN CD 2 C3H0b 0.770 1.610 5.754 16.393 9.659 1.697 possible 2267 4 M GLN OE1 16 O1H0u 0.660 1.420 5.148 27.845 17.091 1.629 possible 2268 4 M GLN NE2 15 N3H2u 0.700 1.640 6.552 73.893 24.150 3.060 possible 2269 5 M ASN N 12 N3H1s 0.700 1.640 2.578 14.275 13.695 1.042 [OK] 2270 5 M ASN CA 3 C4H1s 0.770 1.880 2.648 12.176 13.167 0.925 [OK] 2271 5 M ASN C 1 C3H0s 0.770 1.610 2.546 9.485 8.928 1.062 [OK] 2272 5 M ASN O 16 O1H0u 0.660 1.420 2.390 16.247 16.199 1.003 [OK] 2273 5 M ASN CB 8 C4H2s 0.770 1.880 3.108 26.341 23.128 1.139 possible 2274 5 M ASN CG 2 C3H0b 0.770 1.610 2.456 9.821 9.599 1.023 [OK] 2275 5 M ASN OD1 16 O1H0u 0.660 1.420 2.689 17.092 16.664 1.026 [OK] 2276 5 M ASN ND2 15 N3H2u 0.700 1.640 2.638 22.621 23.083 0.980 [OK] 2277 6 M ILE N 12 N3H1s 0.700 1.640 2.486 12.609 13.633 0.925 [OK] 2278 6 M ILE CA 3 C4H1s 0.770 1.880 2.616 12.284 13.007 0.944 [OK] 2279 6 M ILE C 1 C3H0s 0.770 1.610 2.192 8.638 8.470 1.020 [OK] 2280 6 M ILE O 16 O1H0u 0.660 1.420 2.316 16.542 16.144 1.025 [OK] 2281 6 M ILE CB 4 C4H1b 0.770 1.880 4.412 18.186 14.227 1.278 possible 2282 6 M ILE CG1 9 C4H2b 0.770 1.880 6.393 55.002 24.187 2.274 possible 2283 6 M ILE CG2 10 C4H3u 0.770 1.880 5.697 52.384 35.961 1.457 possible 2284 6 M ILE CD1 10 C4H3u 0.770 1.880 4.173 52.292 38.377 1.363 possible 2285 7 M PHE N 12 N3H1s 0.700 1.640 2.541 14.036 13.691 1.025 [OK] 2286 7 M PHE CA 3 C4H1s 0.770 1.880 2.571 12.643 13.449 0.940 [OK] 2287 7 M PHE C 1 C3H0s 0.770 1.610 2.393 8.881 8.753 1.015 [OK] 2288 7 M PHE O 16 O1H0u 0.660 1.420 3.525 21.458 16.151 1.329 possible 2289 7 M PHE CB 8 C4H2s 0.770 1.880 4.381 32.862 23.777 1.382 possible 2290 7 M PHE CG 2 C3H0b 0.770 1.610 2.346 9.569 9.721 0.984 [OK] 2291 7 M PHE CD1 5 C3H1s 0.770 1.760 2.725 20.771 20.405 1.018 [OK] 2292 7 M PHE CD2 6 C3H1b 0.770 1.760 13.587 -1.000 21.051 -1.000 bad 2293 7 M PHE CE1 6 C3H1b 0.770 1.760 3.777 25.959 21.580 1.203 possible 2294 7 M PHE CE2 6 C3H1b 0.770 1.760 26.974 -1.000 21.680 -1.000 bad 2295 7 M PHE CZ 6 C3H1b 0.770 1.760 20.739 -1.000 21.666 -1.000 bad 2296 8 M SER N 12 N3H1s 0.700 1.640 2.659 14.216 14.103 1.008 [OK] 2297 8 M SER CA 3 C4H1s 0.770 1.880 3.017 13.946 13.476 1.035 possible 2298 8 M SER C 1 C3H0s 0.770 1.610 2.692 9.101 8.923 1.020 [OK] 2299 8 M SER O 16 O1H0u 0.660 1.420 2.696 17.380 16.179 1.074 [OK] 2300 8 M SER CB 8 C4H2s 0.770 1.880 3.149 28.466 23.884 1.192 possible 2301 8 M SER OG 17 O2H1u 0.660 1.460 2.813 21.366 18.732 1.141 [OK] 2302 9 M GLN N 12 N3H1s 0.700 1.640 2.500 12.972 13.616 0.953 [OK] 2303 9 M GLN CA 3 C4H1s 0.770 1.880 2.777 11.513 13.334 0.863 [OK] 2304 9 M GLN C 1 C3H0s 0.770 1.610 2.616 8.795 8.787 1.001 [OK] 2305 9 M GLN O 16 O1H0u 0.660 1.420 2.484 17.572 15.993 1.099 [OK] 2306 9 M GLN CB 8 C4H2s 0.770 1.880 2.969 24.394 23.275 1.048 [OK] 2307 9 M GLN CG 8 C4H2s 0.770 1.880 3.477 23.030 23.465 0.981 possible 2308 9 M GLN CD 2 C3H0b 0.770 1.610 2.590 9.325 9.659 0.965 [OK] 2309 9 M GLN OE1 16 O1H0u 0.660 1.420 2.419 18.951 17.091 1.109 [OK] 2310 9 M GLN NE2 15 N3H2u 0.700 1.640 3.321 27.388 24.150 1.134 possible 2311 10 M VAL N 12 N3H1s 0.700 1.640 2.704 13.420 13.676 0.981 [OK] 2312 10 M VAL CA 3 C4H1s 0.770 1.880 2.829 13.376 13.123 1.019 [OK] 2313 10 M VAL C 1 C3H0s 0.770 1.610 2.693 9.574 8.563 1.118 [OK] 2314 10 M VAL O 16 O1H0u 0.660 1.420 2.593 17.618 16.181 1.089 [OK] 2315 10 M VAL CB 4 C4H1b 0.770 1.880 2.975 16.662 14.598 1.141 [OK] 2316 10 M VAL CG1 10 C4H3u 0.770 1.880 3.082 38.151 36.584 1.043 possible 2317 10 M VAL CG2 10 C4H3u 0.770 1.880 2.936 34.868 36.332 0.960 [OK] 2318 11 M GLN N 12 N3H1s 0.700 1.640 2.591 13.709 13.616 1.007 [OK] 2319 11 M GLN CA 3 C4H1s 0.770 1.880 2.827 12.083 13.334 0.906 [OK] 2320 11 M GLN C 1 C3H0s 0.770 1.610 2.752 9.286 8.787 1.057 [OK] 2321 11 M GLN O 16 O1H0u 0.660 1.420 2.457 15.901 15.993 0.994 [OK] 2322 11 M GLN CB 8 C4H2s 0.770 1.880 3.248 22.884 23.275 0.983 possible 2323 11 M GLN CG 8 C4H2s 0.770 1.880 3.106 27.806 23.465 1.185 possible 2324 11 M GLN CD 2 C3H0b 0.770 1.610 2.389 9.013 9.659 0.933 [OK] 2325 11 M GLN OE1 16 O1H0u 0.660 1.420 3.221 26.902 17.091 1.574 possible 2326 11 M GLN NE2 15 N3H2u 0.700 1.640 2.423 20.189 24.150 0.836 [OK] 2327 12 M VAL N 12 N3H1s 0.700 1.640 2.778 13.360 13.676 0.977 [OK] 2328 12 M VAL CA 3 C4H1s 0.770 1.880 2.507 12.383 13.123 0.944 [OK] 2329 12 M VAL C 1 C3H0s 0.770 1.610 2.592 8.296 8.563 0.969 [OK] 2330 12 M VAL O 16 O1H0u 0.660 1.420 2.987 20.907 16.181 1.292 [OK] 2331 12 M VAL CB 4 C4H1b 0.770 1.880 3.073 15.894 14.598 1.089 possible 2332 12 M VAL CG1 10 C4H3u 0.770 1.880 3.051 32.741 36.584 0.895 possible 2333 12 M VAL CG2 10 C4H3u 0.770 1.880 3.018 40.646 36.332 1.119 possible 2334 13 M ARG N 12 N3H1s 0.700 1.640 2.787 14.566 13.650 1.067 [OK] 2335 13 M ARG CA 3 C4H1s 0.770 1.880 3.005 13.151 13.422 0.980 possible 2336 13 M ARG C 1 C3H0s 0.770 1.610 2.596 8.774 8.838 0.993 [OK] 2337 13 M ARG O 16 O1H0u 0.660 1.420 2.522 14.648 16.084 0.911 [OK] 2338 13 M ARG CB 8 C4H2s 0.770 1.880 3.446 24.486 23.088 1.061 possible 2339 13 M ARG CG 8 C4H2s 0.770 1.880 3.332 26.475 23.640 1.120 possible 2340 13 M ARG CD 8 C4H2s 0.770 1.880 3.869 29.777 23.300 1.278 possible 2341 13 M ARG NE 13 N3H1b 0.700 1.640 4.537 25.783 15.569 1.656 possible 2342 13 M ARG CZ 2 C3H0b 0.770 1.610 3.499 10.621 9.747 1.090 possible 2343 13 M ARG NH1 15 N3H2u 0.700 1.640 18.962 -1.000 22.782 -1.000 bad 2344 13 M ARG NH2 15 N3H2u 0.700 1.640 40.413 -1.000 23.810 -1.000 bad 2345 14 M GLY N 12 N3H1s 0.700 1.640 2.758 13.137 14.854 0.884 [OK] 2346 14 M GLY CA 8 C4H2s 0.770 1.880 3.082 21.688 23.688 0.916 possible 2347 14 M GLY C 2 C3H0b 0.770 1.610 4.411 12.601 9.840 1.281 possible 2348 14 M GLY O 16 O1H0u 0.660 1.420 5.097 32.344 16.391 1.973 possible 2349 15 M PRO N 11 N3H0u 0.700 1.640 4.804 11.892 8.823 1.348 possible 2350 15 M PRO CA 4 C4H1b 0.770 1.880 11.525 -1.000 13.955 -1.000 bad 2351 15 M PRO C 1 C3H0s 0.770 1.610 2.496 8.539 8.812 0.969 [OK] 2352 15 M PRO O 16 O1H0u 0.660 1.420 2.723 16.458 16.169 1.018 [OK] 2353 15 M PRO CB 9 C4H2b 0.770 1.880 29.417 -1.000 25.563 -1.000 bad 2354 15 M PRO CG 9 C4H2b 0.770 1.880 28.136 -1.000 25.832 -1.000 bad 2355 15 M PRO CD 8 C4H2s 0.770 1.880 4.166 26.328 23.836 1.105 possible 2356 16 M ALA N 12 N3H1s 0.700 1.640 7.265 -1.000 14.046 -1.000 bad 2357 16 M ALA CA 4 C4H1b 0.770 1.880 2.812 13.974 14.063 0.994 [OK] 2358 16 M ALA C 1 C3H0s 0.770 1.610 2.698 8.938 8.900 1.004 [OK] 2359 16 M ALA O 16 O1H0u 0.660 1.420 4.988 39.495 16.188 2.440 possible 2360 16 M ALA CB 10 C4H3u 0.770 1.880 18.715 -1.000 36.782 -1.000 bad 2361 17 M ASP N 12 N3H1s 0.700 1.640 2.696 15.505 13.895 1.116 [OK] 2362 17 M ASP CA 3 C4H1s 0.770 1.880 3.432 14.493 13.377 1.083 possible 2363 17 M ASP C 1 C3H0s 0.770 1.610 2.698 9.253 8.816 1.050 [OK] 2364 17 M ASP O 16 O1H0u 0.660 1.420 2.456 18.392 16.091 1.143 [OK] 2365 17 M ASP CB 8 C4H2s 0.770 1.880 3.176 26.863 23.481 1.144 possible 2366 17 M ASP CG 2 C3H0b 0.770 1.610 2.914 10.341 9.422 1.098 [OK] 2367 17 M ASP OD1 16 O1H0u 0.660 1.420 3.069 23.130 15.505 1.492 possible 2368 17 M ASP OD2 16 O1H0u 0.660 1.420 4.042 36.552 16.324 2.239 possible 2369 18 M LEU N 12 N3H1s 0.700 1.640 2.718 13.230 13.655 0.969 [OK] 2370 18 M LEU CA 3 C4H1s 0.770 1.880 2.804 13.730 13.122 1.046 [OK] 2371 18 M LEU C 1 C3H0s 0.770 1.610 2.901 9.905 8.825 1.122 [OK] 2372 18 M LEU O 16 O1H0u 0.660 1.420 2.695 15.823 16.208 0.976 [OK] 2373 18 M LEU CB 8 C4H2s 0.770 1.880 4.954 30.988 22.951 1.350 possible 2374 18 M LEU CG 4 C4H1b 0.770 1.880 4.092 19.571 14.764 1.326 possible 2375 18 M LEU CD1 10 C4H3u 0.770 1.880 60.714 -1.000 37.425 -1.000 bad 2376 18 M LEU CD2 10 C4H3u 0.770 1.880 19.154 -1.000 37.143 -1.000 bad 2377 19 M GLY N 12 N3H1s 0.700 1.640 2.726 15.280 14.854 1.029 [OK] 2378 19 M GLY CA 8 C4H2s 0.770 1.880 2.760 20.194 23.688 0.852 [OK] 2379 19 M GLY C 2 C3H0b 0.770 1.610 3.087 11.085 9.840 1.127 possible 2380 19 M GLY O 16 O1H0u 0.660 1.420 4.599 35.630 16.391 2.174 possible 2381 20 M MET N 12 N3H1s 0.700 1.640 2.830 13.286 13.564 0.980 [OK] 2382 20 M MET CA 3 C4H1s 0.770 1.880 2.884 13.855 13.231 1.047 [OK] 2383 20 M MET C 1 C3H0s 0.770 1.610 2.777 9.768 8.782 1.112 [OK] 2384 20 M MET O 16 O1H0u 0.660 1.420 2.562 17.151 16.277 1.054 [OK] 2385 20 M MET CB 8 C4H2s 0.770 1.880 3.020 26.047 23.645 1.102 possible 2386 20 M MET CG 9 C4H2b 0.770 1.880 2.925 23.473 24.009 0.978 [OK] 2387 20 M MET SD 19 S2H0u 1.040 1.770 3.287 29.876 30.093 0.993 possible 2388 20 M MET CE 10 C4H3u 0.770 1.880 5.976 56.438 37.161 1.519 possible 2389 21 M THR N 12 N3H1s 0.700 1.640 4.073 21.120 13.832 1.527 possible 2390 21 M THR CA 3 C4H1s 0.770 1.880 2.867 13.518 13.099 1.032 [OK] 2391 21 M THR C 1 C3H0s 0.770 1.610 2.556 8.921 8.738 1.021 [OK] 2392 21 M THR O 16 O1H0u 0.660 1.420 2.468 16.185 16.020 1.010 [OK] 2393 21 M THR CB 4 C4H1b 0.770 1.880 13.076 -1.000 14.829 -1.000 bad 2394 21 M THR OG1 17 O2H1u 0.660 1.460 21.976 -1.000 18.123 -1.000 bad 2395 21 M THR CG2 10 C4H3u 0.770 1.880 17.662 -1.000 36.542 -1.000 bad 2396 22 M GLU N 12 N3H1s 0.700 1.640 6.995 35.068 13.615 2.576 possible 2397 22 M GLU CA 3 C4H1s 0.770 1.880 5.319 20.411 13.399 1.523 possible 2398 22 M GLU C 1 C3H0s 0.770 1.610 3.756 10.956 8.675 1.263 possible 2399 22 M GLU O 16 O1H0u 0.660 1.420 12.400 -1.000 16.023 -1.000 bad 2400 22 M GLU CB 8 C4H2s 0.770 1.880 2.887 21.910 23.529 0.931 [OK] 2401 22 M GLU CG 8 C4H2s 0.770 1.880 3.290 24.012 23.513 1.021 possible 2402 22 M GLU CD 2 C3H0b 0.770 1.610 2.915 9.179 9.460 0.970 [OK] 2403 22 M GLU OE1 16 O1H0u 0.660 1.420 4.971 31.945 15.999 1.997 possible 2404 22 M GLU OE2 16 O1H0u 0.660 1.420 26.256 -1.000 17.432 -1.000 bad 2405 23 M ASP N 12 N3H1s 0.700 1.640 2.715 13.029 13.895 0.938 [OK] 2406 23 M ASP CA 3 C4H1s 0.770 1.880 4.562 16.645 13.377 1.244 possible 2407 23 M ASP C 1 C3H0s 0.770 1.610 2.770 9.728 8.816 1.103 [OK] 2408 23 M ASP O 16 O1H0u 0.660 1.420 18.799 -1.000 16.091 -1.000 bad 2409 23 M ASP CB 8 C4H2s 0.770 1.880 18.884 -1.000 23.481 -1.000 bad 2410 23 M ASP CG 2 C3H0b 0.770 1.610 3.573 -1.000 9.422 -1.000 bad 2411 23 M ASP OD1 16 O1H0u 0.660 1.420 37.885 -1.000 15.505 -1.000 bad 2412 23 M ASP OD2 16 O1H0u 0.660 1.420 6.557 52.984 16.324 3.246 possible 2413 24 M VAL N 12 N3H1s 0.700 1.640 2.379 13.057 13.676 0.955 [OK] 2414 24 M VAL CA 3 C4H1s 0.770 1.880 2.493 12.355 13.123 0.942 [OK] 2415 24 M VAL C 1 C3H0s 0.770 1.610 2.732 8.182 8.563 0.956 [OK] 2416 24 M VAL O 16 O1H0u 0.660 1.420 3.509 16.625 16.181 1.027 possible 2417 24 M VAL CB 4 C4H1b 0.770 1.880 2.921 14.838 14.598 1.016 [OK] 2418 24 M VAL CG1 10 C4H3u 0.770 1.880 2.987 34.048 36.584 0.931 [OK] 2419 24 M VAL CG2 10 C4H3u 0.770 1.880 2.862 33.364 36.332 0.918 [OK] 2420 25 M ASN N 12 N3H1s 0.700 1.640 3.220 15.403 13.695 1.125 possible 2421 25 M ASN CA 3 C4H1s 0.770 1.880 5.380 20.082 13.167 1.525 possible 2422 25 M ASN C 1 C3H0s 0.770 1.610 2.285 7.754 8.928 0.869 [OK] 2423 25 M ASN O 16 O1H0u 0.660 1.420 2.511 16.490 16.199 1.018 [OK] 2424 25 M ASN CB 8 C4H2s 0.770 1.880 17.315 -1.000 23.128 -1.000 bad 2425 25 M ASN CG 2 C3H0b 0.770 1.610 2.186 -1.000 9.599 -1.000 bad 2426 25 M ASN OD1 16 O1H0u 0.660 1.420 7.566 -1.000 16.664 -1.000 bad 2427 25 M ASN ND2 15 N3H2u 0.700 1.640 34.777 -1.000 23.083 -1.000 bad 2428 26 M LEU N 12 N3H1s 0.700 1.640 2.746 13.168 13.655 0.964 [OK] 2429 26 M LEU CA 3 C4H1s 0.770 1.880 2.946 14.307 13.122 1.090 [OK] 2430 26 M LEU C 1 C3H0s 0.770 1.610 4.129 9.304 8.825 1.054 possible 2431 26 M LEU O 16 O1H0u 0.660 1.420 9.463 -1.000 16.208 -1.000 bad 2432 26 M LEU CB 8 C4H2s 0.770 1.880 14.487 -1.000 22.951 -1.000 bad 2433 26 M LEU CG 4 C4H1b 0.770 1.880 6.156 30.296 14.764 2.052 possible 2434 26 M LEU CD1 10 C4H3u 0.770 1.880 3.417 38.819 37.425 1.037 possible 2435 26 M LEU CD2 10 C4H3u 0.770 1.880 41.688 -1.000 37.143 -1.000 bad 2436 27 M ALA N 12 N3H1s 0.700 1.640 5.702 23.221 14.046 1.653 possible 2437 27 M ALA CA 4 C4H1b 0.770 1.880 13.733 -1.000 14.063 -1.000 bad 2438 27 M ALA C 1 C3H0s 0.770 1.610 2.942 8.763 8.900 0.985 [OK] 2439 27 M ALA O 16 O1H0u 0.660 1.420 28.857 -1.000 16.188 -1.000 bad 2440 27 M ALA CB 10 C4H3u 0.770 1.880 48.372 -1.000 36.782 -1.000 bad 2441 28 M ASN N 12 N3H1s 0.700 1.640 2.562 13.447 13.695 0.982 [OK] 2442 28 M ASN CA 3 C4H1s 0.770 1.880 4.537 17.957 13.167 1.364 possible 2443 28 M ASN C 1 C3H0s 0.770 1.610 3.944 11.914 8.928 1.334 possible 2444 28 M ASN O 16 O1H0u 0.660 1.420 4.212 23.126 16.199 1.428 possible 2445 28 M ASN CB 8 C4H2s 0.770 1.880 2.764 21.297 23.128 0.921 [OK] 2446 28 M ASN CG 2 C3H0b 0.770 1.610 2.434 9.918 9.599 1.033 [OK] 2447 28 M ASN OD1 16 O1H0u 0.660 1.420 27.612 -1.000 16.664 -1.000 bad 2448 28 M ASN ND2 15 N3H2u 0.700 1.640 6.586 58.408 23.083 2.530 possible 2449 29 M ARG N 12 N3H1s 0.700 1.640 2.767 14.861 13.650 1.089 [OK] 2450 29 M ARG CA 3 C4H1s 0.770 1.880 2.709 12.908 13.422 0.962 [OK] 2451 29 M ARG C 1 C3H0s 0.770 1.610 3.683 10.036 8.838 1.136 possible 2452 29 M ARG O 16 O1H0u 0.660 1.420 18.208 -1.000 16.084 -1.000 bad 2453 29 M ARG CB 8 C4H2s 0.770 1.880 4.312 30.825 23.088 1.335 possible 2454 29 M ARG CG 8 C4H2s 0.770 1.880 3.452 27.064 23.640 1.145 possible 2455 29 M ARG CD 8 C4H2s 0.770 1.880 2.941 23.514 23.300 1.009 [OK] 2456 29 M ARG NE 13 N3H1b 0.700 1.640 2.839 18.114 15.569 1.163 [OK] 2457 29 M ARG CZ 2 C3H0b 0.770 1.610 2.516 10.283 9.747 1.055 [OK] 2458 29 M ARG NH1 15 N3H2u 0.700 1.640 2.665 22.517 22.782 0.988 [OK] 2459 29 M ARG NH2 15 N3H2u 0.700 1.640 3.253 25.519 23.810 1.072 possible 2460 30 M SER N 12 N3H1s 0.700 1.640 3.788 16.576 14.103 1.175 possible 2461 30 M SER CA 3 C4H1s 0.770 1.880 4.308 21.099 13.476 1.566 possible 2462 30 M SER C 1 C3H0s 0.770 1.610 4.396 11.390 8.923 1.276 possible 2463 30 M SER O 16 O1H0u 0.660 1.420 6.259 35.455 16.179 2.191 possible 2464 30 M SER CB 8 C4H2s 0.770 1.880 3.527 28.024 23.884 1.173 possible 2465 30 M SER OG 17 O2H1u 0.660 1.460 2.288 16.429 18.732 0.877 [OK] 2466 31 M GLY N 12 N3H1s 0.700 1.640 7.979 30.972 14.854 2.085 possible 2467 31 M GLY CA 8 C4H2s 0.770 1.880 29.811 -1.000 23.688 -1.000 bad 2468 31 M GLY C 2 C3H0b 0.770 1.610 2.841 10.626 9.840 1.080 [OK] 2469 31 M GLY O 16 O1H0u 0.660 1.420 2.195 14.720 16.391 0.898 [OK] 2470 32 M VAL N 12 N3H1s 0.700 1.640 4.208 -1.000 13.676 -1.000 bad 2471 32 M VAL CA 3 C4H1s 0.770 1.880 2.680 13.621 13.123 1.038 [OK] 2472 32 M VAL C 1 C3H0s 0.770 1.610 2.411 8.265 8.563 0.965 [OK] 2473 32 M VAL O 16 O1H0u 0.660 1.420 20.075 -1.000 16.181 -1.000 bad 2474 32 M VAL CB 4 C4H1b 0.770 1.880 10.464 -1.000 14.598 -1.000 bad 2475 32 M VAL CG1 10 C4H3u 0.770 1.880 5.333 38.096 36.584 1.041 possible 2476 32 M VAL CG2 10 C4H3u 0.770 1.880 6.067 -1.000 36.332 -1.000 bad 2477 33 M GLY N 12 N3H1s 0.700 1.640 2.501 13.632 14.854 0.918 [OK] 2478 33 M GLY CA 8 C4H2s 0.770 1.880 4.184 29.359 23.688 1.239 possible 2479 33 M GLY C 2 C3H0b 0.770 1.610 5.028 12.907 9.840 1.312 possible 2480 33 M GLY O 16 O1H0u 0.660 1.420 7.087 -1.000 16.391 -1.000 bad 2481 34 M PRO N 11 N3H0u 0.700 1.640 6.956 14.230 8.823 1.613 possible 2482 34 M PRO CA 4 C4H1b 0.770 1.880 10.596 -1.000 13.955 -1.000 bad 2483 34 M PRO C 1 C3H0s 0.770 1.610 2.893 9.680 8.812 1.098 [OK] 2484 34 M PRO O 16 O1H0u 0.660 1.420 2.521 17.419 16.169 1.077 [OK] 2485 34 M PRO CB 9 C4H2b 0.770 1.880 31.754 -1.000 25.563 -1.000 bad 2486 34 M PRO CG 9 C4H2b 0.770 1.880 27.662 -1.000 25.832 -1.000 bad 2487 34 M PRO CD 8 C4H2s 0.770 1.880 25.960 -1.000 23.836 -1.000 bad 2488 35 M PHE N 12 N3H1s 0.700 1.640 4.447 21.007 13.691 1.534 possible 2489 35 M PHE CA 3 C4H1s 0.770 1.880 2.572 12.965 13.449 0.964 [OK] 2490 35 M PHE C 1 C3H0s 0.770 1.610 3.152 10.611 8.753 1.212 possible 2491 35 M PHE O 16 O1H0u 0.660 1.420 19.990 -1.000 16.151 -1.000 bad 2492 35 M PHE CB 8 C4H2s 0.770 1.880 3.785 27.490 23.777 1.156 possible 2493 35 M PHE CG 2 C3H0b 0.770 1.610 2.408 9.612 9.721 0.989 [OK] 2494 35 M PHE CD1 5 C3H1s 0.770 1.760 4.769 27.832 20.405 1.364 possible 2495 35 M PHE CD2 6 C3H1b 0.770 1.760 3.037 21.501 21.051 1.021 possible 2496 35 M PHE CE1 6 C3H1b 0.770 1.760 6.059 38.964 21.580 1.806 possible 2497 35 M PHE CE2 6 C3H1b 0.770 1.760 2.961 24.225 21.680 1.117 [OK] 2498 35 M PHE CZ 6 C3H1b 0.770 1.760 3.523 22.758 21.666 1.050 possible 2499 36 M SER N 12 N3H1s 0.700 1.640 2.940 15.971 14.103 1.132 [OK] 2500 36 M SER CA 3 C4H1s 0.770 1.880 5.194 18.259 13.476 1.355 possible 2501 36 M SER C 1 C3H0s 0.770 1.610 3.063 9.297 8.923 1.042 possible 2502 36 M SER O 16 O1H0u 0.660 1.420 2.493 15.249 16.179 0.943 [OK] 2503 36 M SER CB 8 C4H2s 0.770 1.880 4.961 38.112 23.884 1.596 possible 2504 36 M SER OG 17 O2H1u 0.660 1.460 14.105 -1.000 18.732 -1.000 bad 2505 37 M THR N 12 N3H1s 0.700 1.640 7.986 32.874 13.832 2.377 possible 2506 37 M THR CA 3 C4H1s 0.770 1.880 3.295 15.088 13.099 1.152 possible 2507 37 M THR C 1 C3H0s 0.770 1.610 3.228 9.126 8.738 1.044 possible 2508 37 M THR O 16 O1H0u 0.660 1.420 2.662 14.129 16.020 0.882 [OK] 2509 37 M THR CB 4 C4H1b 0.770 1.880 15.130 -1.000 14.829 -1.000 bad 2510 37 M THR OG1 17 O2H1u 0.660 1.460 18.201 -1.000 18.123 -1.000 bad 2511 37 M THR CG2 10 C4H3u 0.770 1.880 21.062 -1.000 36.542 -1.000 bad 2512 38 M LEU N 12 N3H1s 0.700 1.640 5.420 23.675 13.655 1.734 possible 2513 38 M LEU CA 3 C4H1s 0.770 1.880 4.070 14.924 13.122 1.137 possible 2514 38 M LEU C 1 C3H0s 0.770 1.610 2.742 8.345 8.825 0.946 [OK] 2515 38 M LEU O 16 O1H0u 0.660 1.420 2.386 16.467 16.208 1.016 [OK] 2516 38 M LEU CB 8 C4H2s 0.770 1.880 10.199 -1.000 22.951 -1.000 bad 2517 38 M LEU CG 4 C4H1b 0.770 1.880 3.303 16.561 14.764 1.122 possible 2518 38 M LEU CD1 10 C4H3u 0.770 1.880 35.766 -1.000 37.425 -1.000 bad 2519 38 M LEU CD2 10 C4H3u 0.770 1.880 59.684 -1.000 37.143 -1.000 bad 2520 39 M LEU N 12 N3H1s 0.700 1.640 2.851 14.609 13.655 1.070 [OK] 2521 39 M LEU CA 3 C4H1s 0.770 1.880 3.286 15.152 13.122 1.155 possible 2522 39 M LEU C 1 C3H0s 0.770 1.610 2.381 8.322 8.825 0.943 [OK] 2523 39 M LEU O 16 O1H0u 0.660 1.420 3.194 18.604 16.208 1.148 possible 2524 39 M LEU CB 8 C4H2s 0.770 1.880 3.335 23.537 22.951 1.026 possible 2525 39 M LEU CG 4 C4H1b 0.770 1.880 5.770 19.723 14.764 1.336 possible 2526 39 M LEU CD1 10 C4H3u 0.770 1.880 6.344 52.502 37.425 1.403 possible 2527 39 M LEU CD2 10 C4H3u 0.770 1.880 41.906 -1.000 37.143 -1.000 bad 2528 40 M GLY N 12 N3H1s 0.700 1.640 2.390 13.725 14.854 0.924 [OK] 2529 40 M GLY CA 8 C4H2s 0.770 1.880 2.745 22.641 23.688 0.956 [OK] 2530 40 M GLY C 2 C3H0b 0.770 1.610 2.153 8.626 9.840 0.877 [OK] 2531 40 M GLY O 16 O1H0u 0.660 1.420 2.725 17.701 16.391 1.080 [OK] 2532 41 M TRP N 12 N3H1s 0.700 1.640 2.243 12.515 13.791 0.908 [OK] 2533 41 M TRP CA 3 C4H1s 0.770 1.880 2.784 13.173 13.377 0.985 [OK] 2534 41 M TRP C 1 C3H0s 0.770 1.610 2.600 9.119 8.724 1.045 [OK] 2535 41 M TRP O 16 O1H0u 0.660 1.420 2.441 16.466 15.951 1.032 [OK] 2536 41 M TRP CB 8 C4H2s 0.770 1.880 2.842 23.297 24.004 0.971 [OK] 2537 41 M TRP CG 2 C3H0b 0.770 1.610 2.306 8.735 9.965 0.877 [OK] 2538 41 M TRP CD1 5 C3H1s 0.770 1.760 3.616 21.868 20.874 1.048 possible 2539 41 M TRP CD2 2 C3H0b 0.770 1.610 2.365 9.224 10.097 0.914 [OK] 2540 41 M TRP NE1 13 N3H1b 0.700 1.640 13.451 -1.000 16.969 -1.000 bad 2541 41 M TRP CE2 2 C3H0b 0.770 1.610 3.118 9.983 9.889 1.009 possible 2542 41 M TRP CE3 6 C3H1b 0.770 1.760 2.772 21.305 20.448 1.042 [OK] 2543 41 M TRP CZ2 6 C3H1b 0.770 1.760 15.371 -1.000 21.012 -1.000 bad 2544 41 M TRP CZ3 6 C3H1b 0.770 1.760 2.877 21.028 21.516 0.977 [OK] 2545 41 M TRP CH2 6 C3H1b 0.770 1.760 4.758 25.040 21.339 1.173 possible 2546 42 M PHE N 12 N3H1s 0.700 1.640 2.620 13.680 13.691 0.999 [OK] 2547 42 M PHE CA 3 C4H1s 0.770 1.880 2.758 13.371 13.449 0.994 [OK] 2548 42 M PHE C 1 C3H0s 0.770 1.610 2.488 8.913 8.753 1.018 [OK] 2549 42 M PHE O 16 O1H0u 0.660 1.420 2.637 18.695 16.151 1.158 [OK] 2550 42 M PHE CB 8 C4H2s 0.770 1.880 3.648 27.184 23.777 1.143 possible 2551 42 M PHE CG 2 C3H0b 0.770 1.610 2.930 10.241 9.721 1.054 [OK] 2552 42 M PHE CD1 5 C3H1s 0.770 1.760 3.404 21.533 20.405 1.055 possible 2553 42 M PHE CD2 6 C3H1b 0.770 1.760 4.501 33.519 21.051 1.592 possible 2554 42 M PHE CE1 6 C3H1b 0.770 1.760 3.732 27.022 21.580 1.252 possible 2555 42 M PHE CE2 6 C3H1b 0.770 1.760 4.475 27.653 21.680 1.276 possible 2556 42 M PHE CZ 6 C3H1b 0.770 1.760 4.276 23.908 21.666 1.103 possible 2557 43 M GLY N 12 N3H1s 0.700 1.640 3.449 15.993 14.854 1.077 possible 2558 43 M GLY CA 8 C4H2s 0.770 1.880 3.079 24.310 23.688 1.026 possible 2559 43 M GLY C 2 C3H0b 0.770 1.610 2.619 10.190 9.840 1.036 [OK] 2560 43 M GLY O 16 O1H0u 0.660 1.420 2.223 15.876 16.391 0.969 [OK] 2561 44 M ASN N 12 N3H1s 0.700 1.640 2.496 14.672 13.695 1.071 [OK] 2562 44 M ASN CA 3 C4H1s 0.770 1.880 2.555 12.751 13.167 0.968 [OK] 2563 44 M ASN C 1 C3H0s 0.770 1.610 2.522 8.525 8.928 0.955 [OK] 2564 44 M ASN O 16 O1H0u 0.660 1.420 2.455 16.779 16.199 1.036 [OK] 2565 44 M ASN CB 8 C4H2s 0.770 1.880 2.947 21.437 23.128 0.927 [OK] 2566 44 M ASN CG 2 C3H0b 0.770 1.610 3.120 11.228 9.599 1.170 possible 2567 44 M ASN OD1 16 O1H0u 0.660 1.420 2.932 22.135 16.664 1.328 [OK] 2568 44 M ASN ND2 15 N3H2u 0.700 1.640 3.169 31.473 23.083 1.363 possible 2569 45 M ALA N 12 N3H1s 0.700 1.640 2.420 13.298 14.046 0.947 [OK] 2570 45 M ALA CA 4 C4H1b 0.770 1.880 2.698 13.779 14.063 0.980 [OK] 2571 45 M ALA C 1 C3H0s 0.770 1.610 2.552 9.476 8.900 1.065 [OK] 2572 45 M ALA O 16 O1H0u 0.660 1.420 2.429 17.656 16.188 1.091 [OK] 2573 45 M ALA CB 10 C4H3u 0.770 1.880 3.866 45.446 36.782 1.236 possible 2574 46 M GLN N 12 N3H1s 0.700 1.640 2.496 14.091 13.616 1.035 [OK] 2575 46 M GLN CA 3 C4H1s 0.770 1.880 2.745 13.329 13.334 1.000 [OK] 2576 46 M GLN C 1 C3H0s 0.770 1.610 2.187 8.197 8.787 0.933 [OK] 2577 46 M GLN O 16 O1H0u 0.660 1.420 2.439 14.244 15.993 0.891 [OK] 2578 46 M GLN CB 8 C4H2s 0.770 1.880 2.877 22.146 23.275 0.952 [OK] 2579 46 M GLN CG 8 C4H2s 0.770 1.880 3.012 22.797 23.465 0.972 possible 2580 46 M GLN CD 2 C3H0b 0.770 1.610 2.425 10.063 9.659 1.042 [OK] 2581 46 M GLN OE1 16 O1H0u 0.660 1.420 2.374 17.300 17.091 1.012 [OK] 2582 46 M GLN NE2 15 N3H2u 0.700 1.640 2.668 24.787 24.150 1.026 [OK] 2583 47 M LEU N 12 N3H1s 0.700 1.640 2.773 14.165 13.655 1.037 [OK] 2584 47 M LEU CA 3 C4H1s 0.770 1.880 2.895 13.868 13.122 1.057 [OK] 2585 47 M LEU C 1 C3H0s 0.770 1.610 2.604 9.129 8.825 1.034 [OK] 2586 47 M LEU O 16 O1H0u 0.660 1.420 2.573 15.960 16.208 0.985 [OK] 2587 47 M LEU CB 8 C4H2s 0.770 1.880 3.222 22.936 22.951 0.999 possible 2588 47 M LEU CG 4 C4H1b 0.770 1.880 3.432 18.187 14.764 1.232 possible 2589 47 M LEU CD1 10 C4H3u 0.770 1.880 3.759 37.430 37.425 1.000 possible 2590 47 M LEU CD2 10 C4H3u 0.770 1.880 25.781 -1.000 37.143 -1.000 bad 2591 48 M GLY N 12 N3H1s 0.700 1.640 2.470 14.647 14.854 0.986 [OK] 2592 48 M GLY CA 8 C4H2s 0.770 1.880 2.775 23.013 23.688 0.971 [OK] 2593 48 M GLY C 2 C3H0b 0.770 1.610 2.489 10.094 9.840 1.026 [OK] 2594 48 M GLY O 16 O1H0u 0.660 1.420 2.438 15.242 16.391 0.930 [OK] 2595 49 M PRO N 11 N3H0u 0.700 1.640 2.358 8.620 8.823 0.977 [OK] 2596 49 M PRO CA 4 C4H1b 0.770 1.880 2.616 13.052 13.955 0.935 [OK] 2597 49 M PRO C 1 C3H0s 0.770 1.610 2.533 9.419 8.812 1.069 [OK] 2598 49 M PRO O 16 O1H0u 0.660 1.420 2.340 14.832 16.169 0.917 [OK] 2599 49 M PRO CB 9 C4H2b 0.770 1.880 3.073 23.428 25.563 0.916 possible 2600 49 M PRO CG 9 C4H2b 0.770 1.880 3.444 28.743 25.832 1.113 possible 2601 49 M PRO CD 8 C4H2s 0.770 1.880 2.956 27.606 23.836 1.158 [OK] 2602 50 M ILE N 12 N3H1s 0.700 1.640 2.497 13.742 13.633 1.008 [OK] 2603 50 M ILE CA 3 C4H1s 0.770 1.880 2.600 12.720 13.007 0.978 [OK] 2604 50 M ILE C 1 C3H0s 0.770 1.610 2.614 9.735 8.470 1.149 [OK] 2605 50 M ILE O 16 O1H0u 0.660 1.420 2.630 16.390 16.144 1.015 [OK] 2606 50 M ILE CB 4 C4H1b 0.770 1.880 2.775 13.734 14.227 0.965 [OK] 2607 50 M ILE CG1 9 C4H2b 0.770 1.880 2.745 22.288 24.187 0.921 [OK] 2608 50 M ILE CG2 10 C4H3u 0.770 1.880 4.307 36.082 35.961 1.003 possible 2609 50 M ILE CD1 10 C4H3u 0.770 1.880 5.139 62.194 38.377 1.621 possible 2610 51 M TYR N 12 N3H1s 0.700 1.640 2.640 13.666 13.691 0.998 [OK] 2611 51 M TYR CA 3 C4H1s 0.770 1.880 2.688 13.797 13.330 1.035 [OK] 2612 51 M TYR C 1 C3H0s 0.770 1.610 2.300 8.298 8.770 0.946 [OK] 2613 51 M TYR O 16 O1H0u 0.660 1.420 2.379 14.602 16.124 0.906 [OK] 2614 51 M TYR CB 8 C4H2s 0.770 1.880 2.870 22.264 23.678 0.940 [OK] 2615 51 M TYR CG 2 C3H0b 0.770 1.610 2.454 9.417 9.732 0.968 [OK] 2616 51 M TYR CD1 5 C3H1s 0.770 1.760 2.663 18.415 20.171 0.913 [OK] 2617 51 M TYR CD2 5 C3H1s 0.770 1.760 2.901 22.624 20.728 1.091 [OK] 2618 51 M TYR CE1 5 C3H1s 0.770 1.760 3.186 21.406 20.675 1.035 possible 2619 51 M TYR CE2 5 C3H1s 0.770 1.760 2.652 17.021 20.810 0.818 [OK] 2620 51 M TYR CZ 2 C3H0b 0.770 1.610 2.136 8.834 9.926 0.890 [OK] 2621 51 M TYR OH 17 O2H1u 0.660 1.460 6.532 40.307 19.173 2.102 possible 2622 52 M LEU N 12 N3H1s 0.700 1.640 2.743 13.839 13.655 1.013 [OK] 2623 52 M LEU CA 3 C4H1s 0.770 1.880 2.991 14.416 13.122 1.099 [OK] 2624 52 M LEU C 1 C3H0s 0.770 1.610 2.673 9.493 8.825 1.076 [OK] 2625 52 M LEU O 16 O1H0u 0.660 1.420 7.857 61.014 16.208 3.764 possible 2626 52 M LEU CB 8 C4H2s 0.770 1.880 5.067 34.214 22.951 1.491 possible 2627 52 M LEU CG 4 C4H1b 0.770 1.880 2.996 14.202 14.764 0.962 [OK] 2628 52 M LEU CD1 10 C4H3u 0.770 1.880 7.831 127.655 37.425 3.411 possible 2629 52 M LEU CD2 10 C4H3u 0.770 1.880 4.621 64.802 37.143 1.745 possible 2630 53 M GLY N 12 N3H1s 0.700 1.640 2.425 14.292 14.854 0.962 [OK] 2631 53 M GLY CA 8 C4H2s 0.770 1.880 3.844 30.461 23.688 1.286 possible 2632 53 M GLY C 2 C3H0b 0.770 1.610 3.414 11.484 9.840 1.167 possible 2633 53 M GLY O 16 O1H0u 0.660 1.420 2.421 14.289 16.391 0.872 [OK] 2634 54 M SER N 12 N3H1s 0.700 1.640 4.328 28.204 14.103 2.000 possible 2635 54 M SER CA 3 C4H1s 0.770 1.880 4.082 19.543 13.476 1.450 possible 2636 54 M SER C 1 C3H0s 0.770 1.610 3.779 9.563 8.923 1.072 possible 2637 54 M SER O 16 O1H0u 0.660 1.420 5.284 26.871 16.179 1.661 possible 2638 54 M SER CB 8 C4H2s 0.770 1.880 41.930 -1.000 23.884 -1.000 bad 2639 54 M SER OG 17 O2H1u 0.660 1.460 40.295 -1.000 18.732 -1.000 bad 2640 55 M LEU N 12 N3H1s 0.700 1.640 4.052 20.175 13.655 1.478 possible 2641 55 M LEU CA 3 C4H1s 0.770 1.880 3.767 14.473 13.122 1.103 possible 2642 55 M LEU C 1 C3H0s 0.770 1.610 2.688 8.878 8.825 1.006 [OK] 2643 55 M LEU O 16 O1H0u 0.660 1.420 2.721 16.940 16.208 1.045 [OK] 2644 55 M LEU CB 8 C4H2s 0.770 1.880 4.546 24.919 22.951 1.086 possible 2645 55 M LEU CG 4 C4H1b 0.770 1.880 3.000 15.132 14.764 1.025 possible 2646 55 M LEU CD1 10 C4H3u 0.770 1.880 29.155 -1.000 37.425 -1.000 bad 2647 55 M LEU CD2 10 C4H3u 0.770 1.880 7.691 55.783 37.143 1.502 possible 2648 56 M GLY N 12 N3H1s 0.700 1.640 2.567 13.812 14.854 0.930 [OK] 2649 56 M GLY CA 8 C4H2s 0.770 1.880 3.542 27.502 23.688 1.161 possible 2650 56 M GLY C 2 C3H0b 0.770 1.610 2.823 10.370 9.840 1.054 [OK] 2651 56 M GLY O 16 O1H0u 0.660 1.420 3.089 21.203 16.391 1.294 possible 2652 57 M VAL N 12 N3H1s 0.700 1.640 2.868 13.946 13.676 1.020 [OK] 2653 57 M VAL CA 3 C4H1s 0.770 1.880 4.051 18.389 13.123 1.401 possible 2654 57 M VAL C 1 C3H0s 0.770 1.610 2.722 8.055 8.563 0.941 [OK] 2655 57 M VAL O 16 O1H0u 0.660 1.420 4.335 20.728 16.181 1.281 possible 2656 57 M VAL CB 4 C4H1b 0.770 1.880 3.808 15.878 14.598 1.088 possible 2657 57 M VAL CG1 10 C4H3u 0.770 1.880 52.613 -1.000 36.584 -1.000 bad 2658 57 M VAL CG2 10 C4H3u 0.770 1.880 30.247 -1.000 36.332 -1.000 bad 2659 58 M LEU N 12 N3H1s 0.700 1.640 3.764 15.138 13.655 1.109 possible 2660 58 M LEU CA 3 C4H1s 0.770 1.880 4.392 18.459 13.122 1.407 possible 2661 58 M LEU C 1 C3H0s 0.770 1.610 2.759 8.263 8.825 0.936 [OK] 2662 58 M LEU O 16 O1H0u 0.660 1.420 2.628 15.670 16.208 0.967 [OK] 2663 58 M LEU CB 8 C4H2s 0.770 1.880 5.851 34.064 22.951 1.484 possible 2664 58 M LEU CG 4 C4H1b 0.770 1.880 2.996 14.734 14.764 0.998 [OK] 2665 58 M LEU CD1 10 C4H3u 0.770 1.880 29.584 -1.000 37.425 -1.000 bad 2666 58 M LEU CD2 10 C4H3u 0.770 1.880 40.669 -1.000 37.143 -1.000 bad 2667 59 M SER N 12 N3H1s 0.700 1.640 2.696 13.360 14.103 0.947 [OK] 2668 59 M SER CA 3 C4H1s 0.770 1.880 3.043 14.537 13.476 1.079 possible 2669 59 M SER C 1 C3H0s 0.770 1.610 2.234 8.065 8.923 0.904 [OK] 2670 59 M SER O 16 O1H0u 0.660 1.420 2.264 16.014 16.179 0.990 [OK] 2671 59 M SER CB 8 C4H2s 0.770 1.880 3.211 24.918 23.884 1.043 possible 2672 59 M SER OG 17 O2H1u 0.660 1.460 2.461 17.711 18.732 0.945 [OK] 2673 60 M LEU N 12 N3H1s 0.700 1.640 2.890 14.378 13.655 1.053 [OK] 2674 60 M LEU CA 3 C4H1s 0.770 1.880 2.631 12.647 13.122 0.964 [OK] 2675 60 M LEU C 1 C3H0s 0.770 1.610 3.090 8.830 8.825 1.001 possible 2676 60 M LEU O 16 O1H0u 0.660 1.420 2.484 15.467 16.208 0.954 [OK] 2677 60 M LEU CB 8 C4H2s 0.770 1.880 5.274 32.116 22.951 1.399 possible 2678 60 M LEU CG 4 C4H1b 0.770 1.880 5.041 23.722 14.764 1.607 possible 2679 60 M LEU CD1 10 C4H3u 0.770 1.880 43.510 -1.000 37.425 -1.000 bad 2680 60 M LEU CD2 10 C4H3u 0.770 1.880 19.754 -1.000 37.143 -1.000 bad 2681 61 M PHE N 12 N3H1s 0.700 1.640 4.674 16.275 13.691 1.189 possible 2682 61 M PHE CA 3 C4H1s 0.770 1.880 5.011 18.032 13.449 1.341 possible 2683 61 M PHE C 1 C3H0s 0.770 1.610 2.427 8.020 8.753 0.916 [OK] 2684 61 M PHE O 16 O1H0u 0.660 1.420 2.927 15.264 16.151 0.945 [OK] 2685 61 M PHE CB 8 C4H2s 0.770 1.880 5.066 36.171 23.777 1.521 possible 2686 61 M PHE CG 2 C3H0b 0.770 1.610 5.637 15.641 9.721 1.609 possible 2687 61 M PHE CD1 5 C3H1s 0.770 1.760 19.773 -1.000 20.405 -1.000 bad 2688 61 M PHE CD2 6 C3H1b 0.770 1.760 7.313 49.756 21.051 2.364 possible 2689 61 M PHE CE1 6 C3H1b 0.770 1.760 26.929 -1.000 21.580 -1.000 bad 2690 61 M PHE CE2 6 C3H1b 0.770 1.760 24.097 -1.000 21.680 -1.000 bad 2691 61 M PHE CZ 6 C3H1b 0.770 1.760 21.629 -1.000 21.666 -1.000 bad 2692 62 M SER N 12 N3H1s 0.700 1.640 2.574 13.370 14.103 0.948 [OK] 2693 62 M SER CA 3 C4H1s 0.770 1.880 3.098 14.742 13.476 1.094 possible 2694 62 M SER C 1 C3H0s 0.770 1.610 2.388 8.449 8.923 0.947 [OK] 2695 62 M SER O 16 O1H0u 0.660 1.420 2.544 14.255 16.179 0.881 [OK] 2696 62 M SER CB 8 C4H2s 0.770 1.880 3.003 23.845 23.884 0.998 possible 2697 62 M SER OG 17 O2H1u 0.660 1.460 4.159 30.081 18.732 1.606 possible 2698 63 M GLY N 12 N3H1s 0.700 1.640 2.414 13.091 14.854 0.881 [OK] 2699 63 M GLY CA 8 C4H2s 0.770 1.880 3.428 26.113 23.688 1.102 possible 2700 63 M GLY C 2 C3H0b 0.770 1.610 2.829 9.141 9.840 0.929 [OK] 2701 63 M GLY O 16 O1H0u 0.660 1.420 3.360 19.563 16.391 1.194 possible 2702 64 M LEU N 12 N3H1s 0.700 1.640 2.830 13.363 13.655 0.979 [OK] 2703 64 M LEU CA 3 C4H1s 0.770 1.880 3.259 14.647 13.122 1.116 possible 2704 64 M LEU C 1 C3H0s 0.770 1.610 3.353 8.982 8.825 1.018 possible 2705 64 M LEU O 16 O1H0u 0.660 1.420 4.603 22.441 16.208 1.385 possible 2706 64 M LEU CB 8 C4H2s 0.770 1.880 5.590 42.492 22.951 1.851 possible 2707 64 M LEU CG 4 C4H1b 0.770 1.880 2.883 13.365 14.764 0.905 [OK] 2708 64 M LEU CD1 10 C4H3u 0.770 1.880 48.575 -1.000 37.425 -1.000 bad 2709 64 M LEU CD2 10 C4H3u 0.770 1.880 38.265 -1.000 37.143 -1.000 bad 2710 65 M MET N 12 N3H1s 0.700 1.640 2.932 13.111 13.564 0.967 [OK] 2711 65 M MET CA 3 C4H1s 0.770 1.880 2.961 12.994 13.231 0.982 [OK] 2712 65 M MET C 1 C3H0s 0.770 1.610 2.184 8.212 8.782 0.935 [OK] 2713 65 M MET O 16 O1H0u 0.660 1.420 2.619 15.287 16.277 0.939 [OK] 2714 65 M MET CB 8 C4H2s 0.770 1.880 2.874 20.086 23.645 0.849 [OK] 2715 65 M MET CG 9 C4H2b 0.770 1.880 3.176 24.516 24.009 1.021 possible 2716 65 M MET SD 19 S2H0u 1.040 1.770 7.842 86.320 30.093 2.868 possible 2717 65 M MET CE 10 C4H3u 0.770 1.880 36.157 -1.000 37.161 -1.000 bad 2718 66 M TRP N 12 N3H1s 0.700 1.640 2.242 11.912 13.791 0.864 [OK] 2719 66 M TRP CA 3 C4H1s 0.770 1.880 2.883 15.180 13.377 1.135 [OK] 2720 66 M TRP C 1 C3H0s 0.770 1.610 2.544 8.217 8.724 0.942 [OK] 2721 66 M TRP O 16 O1H0u 0.660 1.420 2.343 16.459 15.951 1.032 [OK] 2722 66 M TRP CB 8 C4H2s 0.770 1.880 3.342 23.068 24.004 0.961 possible 2723 66 M TRP CG 2 C3H0b 0.770 1.610 2.931 9.707 9.965 0.974 [OK] 2724 66 M TRP CD1 5 C3H1s 0.770 1.760 2.608 18.537 20.874 0.888 [OK] 2725 66 M TRP CD2 2 C3H0b 0.770 1.610 3.057 11.431 10.097 1.132 possible 2726 66 M TRP NE1 13 N3H1b 0.700 1.640 2.597 16.357 16.969 0.964 [OK] 2727 66 M TRP CE2 2 C3H0b 0.770 1.610 2.490 9.087 9.889 0.919 [OK] 2728 66 M TRP CE3 6 C3H1b 0.770 1.760 3.859 33.141 20.448 1.621 possible 2729 66 M TRP CZ2 6 C3H1b 0.770 1.760 3.082 24.092 21.012 1.147 possible 2730 66 M TRP CZ3 6 C3H1b 0.770 1.760 4.843 43.073 21.516 2.002 possible 2731 66 M TRP CH2 6 C3H1b 0.770 1.760 4.105 31.659 21.339 1.484 possible 2732 67 M PHE N 12 N3H1s 0.700 1.640 2.625 13.156 13.691 0.961 [OK] 2733 67 M PHE CA 3 C4H1s 0.770 1.880 3.466 17.908 13.449 1.332 possible 2734 67 M PHE C 1 C3H0s 0.770 1.610 2.371 8.281 8.753 0.946 [OK] 2735 67 M PHE O 16 O1H0u 0.660 1.420 3.253 20.005 16.151 1.239 possible 2736 67 M PHE CB 8 C4H2s 0.770 1.880 3.946 31.069 23.777 1.307 possible 2737 67 M PHE CG 2 C3H0b 0.770 1.610 3.914 13.404 9.721 1.379 possible 2738 67 M PHE CD1 5 C3H1s 0.770 1.760 4.820 53.393 20.405 2.617 possible 2739 67 M PHE CD2 6 C3H1b 0.770 1.760 6.283 47.798 21.051 2.271 possible 2740 67 M PHE CE1 6 C3H1b 0.770 1.760 21.731 -1.000 21.580 -1.000 bad 2741 67 M PHE CE2 6 C3H1b 0.770 1.760 32.738 -1.000 21.680 -1.000 bad 2742 67 M PHE CZ 6 C3H1b 0.770 1.760 28.762 -1.000 21.666 -1.000 bad 2743 68 M PHE N 12 N3H1s 0.700 1.640 3.119 13.146 13.691 0.960 possible 2744 68 M PHE CA 3 C4H1s 0.770 1.880 4.167 19.369 13.449 1.440 possible 2745 68 M PHE C 1 C3H0s 0.770 1.610 2.334 8.169 8.753 0.933 [OK] 2746 68 M PHE O 16 O1H0u 0.660 1.420 3.013 16.468 16.151 1.020 possible 2747 68 M PHE CB 8 C4H2s 0.770 1.880 5.199 37.519 23.777 1.578 possible 2748 68 M PHE CG 2 C3H0b 0.770 1.610 4.507 13.748 9.721 1.414 possible 2749 68 M PHE CD1 5 C3H1s 0.770 1.760 23.136 -1.000 20.405 -1.000 bad 2750 68 M PHE CD2 6 C3H1b 0.770 1.760 4.502 31.805 21.051 1.511 possible 2751 68 M PHE CE1 6 C3H1b 0.770 1.760 27.611 -1.000 21.580 -1.000 bad 2752 68 M PHE CE2 6 C3H1b 0.770 1.760 24.088 -1.000 21.680 -1.000 bad 2753 68 M PHE CZ 6 C3H1b 0.770 1.760 18.433 -1.000 21.666 -1.000 bad 2754 69 M THR N 12 N3H1s 0.700 1.640 2.551 13.087 13.832 0.946 [OK] 2755 69 M THR CA 3 C4H1s 0.770 1.880 4.067 16.746 13.099 1.278 possible 2756 69 M THR C 1 C3H0s 0.770 1.610 2.438 8.375 8.738 0.958 [OK] 2757 69 M THR O 16 O1H0u 0.660 1.420 2.486 18.104 16.020 1.130 [OK] 2758 69 M THR CB 4 C4H1b 0.770 1.880 2.783 14.925 14.829 1.006 [OK] 2759 69 M THR OG1 17 O2H1u 0.660 1.460 4.224 28.330 18.123 1.563 possible 2760 69 M THR CG2 10 C4H3u 0.770 1.880 4.430 40.493 36.542 1.108 possible 2761 70 M ILE N 12 N3H1s 0.700 1.640 2.537 13.677 13.633 1.003 [OK] 2762 70 M ILE CA 3 C4H1s 0.770 1.880 2.975 14.508 13.007 1.115 [OK] 2763 70 M ILE C 1 C3H0s 0.770 1.610 2.781 8.159 8.470 0.963 [OK] 2764 70 M ILE O 16 O1H0u 0.660 1.420 2.595 15.503 16.144 0.960 [OK] 2765 70 M ILE CB 4 C4H1b 0.770 1.880 3.043 15.018 14.227 1.056 possible 2766 70 M ILE CG1 9 C4H2b 0.770 1.880 2.733 23.380 24.187 0.967 [OK] 2767 70 M ILE CG2 10 C4H3u 0.770 1.880 3.034 35.115 35.961 0.976 possible 2768 70 M ILE CD1 10 C4H3u 0.770 1.880 3.575 40.275 38.377 1.049 possible 2769 71 M GLY N 12 N3H1s 0.700 1.640 2.767 14.218 14.854 0.957 [OK] 2770 71 M GLY CA 8 C4H2s 0.770 1.880 4.813 48.322 23.688 2.040 possible 2771 71 M GLY C 2 C3H0b 0.770 1.610 4.028 11.792 9.840 1.198 possible 2772 71 M GLY O 16 O1H0u 0.660 1.420 2.690 15.506 16.391 0.946 [OK] 2773 72 M ILE N 12 N3H1s 0.700 1.640 3.808 16.619 13.633 1.219 possible 2774 72 M ILE CA 3 C4H1s 0.770 1.880 4.048 16.854 13.007 1.296 possible 2775 72 M ILE C 1 C3H0s 0.770 1.610 3.144 8.556 8.470 1.010 possible 2776 72 M ILE O 16 O1H0u 0.660 1.420 3.427 17.113 16.144 1.060 possible 2777 72 M ILE CB 4 C4H1b 0.770 1.880 3.426 15.305 14.227 1.076 possible 2778 72 M ILE CG1 9 C4H2b 0.770 1.880 5.210 40.647 24.187 1.681 possible 2779 72 M ILE CG2 10 C4H3u 0.770 1.880 5.054 59.213 35.961 1.647 possible 2780 72 M ILE CD1 10 C4H3u 0.770 1.880 43.523 -1.000 38.377 -1.000 bad 2781 73 M TRP N 12 N3H1s 0.700 1.640 3.059 13.438 13.791 0.974 possible 2782 73 M TRP CA 3 C4H1s 0.770 1.880 3.946 17.047 13.377 1.274 possible 2783 73 M TRP C 1 C3H0s 0.770 1.610 2.381 7.951 8.724 0.911 [OK] 2784 73 M TRP O 16 O1H0u 0.660 1.420 2.355 14.109 15.951 0.885 [OK] 2785 73 M TRP CB 8 C4H2s 0.770 1.880 2.989 25.954 24.004 1.081 [OK] 2786 73 M TRP CG 2 C3H0b 0.770 1.610 2.457 9.195 9.965 0.923 [OK] 2787 73 M TRP CD1 5 C3H1s 0.770 1.760 2.943 20.592 20.874 0.987 [OK] 2788 73 M TRP CD2 2 C3H0b 0.770 1.610 2.516 10.637 10.097 1.054 [OK] 2789 73 M TRP NE1 13 N3H1b 0.700 1.640 2.356 13.105 16.969 0.772 [OK] 2790 73 M TRP CE2 2 C3H0b 0.770 1.610 2.499 9.217 9.889 0.932 [OK] 2791 73 M TRP CE3 6 C3H1b 0.770 1.760 4.186 25.456 20.448 1.245 possible 2792 73 M TRP CZ2 6 C3H1b 0.770 1.760 6.562 34.904 21.012 1.661 possible 2793 73 M TRP CZ3 6 C3H1b 0.770 1.760 3.283 20.750 21.516 0.964 possible 2794 73 M TRP CH2 6 C3H1b 0.770 1.760 7.976 58.444 21.339 2.739 possible 2795 74 M PHE N 12 N3H1s 0.700 1.640 2.429 12.323 13.691 0.900 [OK] 2796 74 M PHE CA 3 C4H1s 0.770 1.880 2.801 14.389 13.449 1.070 [OK] 2797 74 M PHE C 1 C3H0s 0.770 1.610 2.425 8.323 8.753 0.951 [OK] 2798 74 M PHE O 16 O1H0u 0.660 1.420 2.274 15.311 16.151 0.948 [OK] 2799 74 M PHE CB 8 C4H2s 0.770 1.880 3.276 23.187 23.777 0.975 possible 2800 74 M PHE CG 2 C3H0b 0.770 1.610 2.710 10.195 9.721 1.049 [OK] 2801 74 M PHE CD1 5 C3H1s 0.770 1.760 2.896 18.966 20.405 0.929 [OK] 2802 74 M PHE CD2 6 C3H1b 0.770 1.760 3.215 23.235 21.051 1.104 possible 2803 74 M PHE CE1 6 C3H1b 0.770 1.760 2.901 20.337 21.580 0.942 [OK] 2804 74 M PHE CE2 6 C3H1b 0.770 1.760 3.332 24.215 21.680 1.117 possible 2805 74 M PHE CZ 6 C3H1b 0.770 1.760 2.846 20.827 21.666 0.961 [OK] 2806 75 M TRP N 12 N3H1s 0.700 1.640 2.308 12.649 13.791 0.917 [OK] 2807 75 M TRP CA 3 C4H1s 0.770 1.880 2.691 13.320 13.377 0.996 [OK] 2808 75 M TRP C 1 C3H0s 0.770 1.610 2.188 8.134 8.724 0.932 [OK] 2809 75 M TRP O 16 O1H0u 0.660 1.420 2.370 15.137 15.951 0.949 [OK] 2810 75 M TRP CB 8 C4H2s 0.770 1.880 3.558 22.301 24.004 0.929 possible 2811 75 M TRP CG 2 C3H0b 0.770 1.610 5.376 13.614 9.965 1.366 possible 2812 75 M TRP CD1 5 C3H1s 0.770 1.760 6.245 43.056 20.874 2.063 possible 2813 75 M TRP CD2 2 C3H0b 0.770 1.610 6.130 15.784 10.097 1.563 possible 2814 75 M TRP NE1 13 N3H1b 0.700 1.640 18.339 -1.000 16.969 -1.000 bad 2815 75 M TRP CE2 2 C3H0b 0.770 1.610 1.658 -1.000 9.889 -1.000 bad 2816 75 M TRP CE3 6 C3H1b 0.770 1.760 6.348 29.660 20.448 1.451 possible 2817 75 M TRP CZ2 6 C3H1b 0.770 1.760 23.643 -1.000 21.012 -1.000 bad 2818 75 M TRP CZ3 6 C3H1b 0.770 1.760 4.116 -1.000 21.516 -1.000 bad 2819 75 M TRP CH2 6 C3H1b 0.770 1.760 13.057 -1.000 21.339 -1.000 bad 2820 76 M TYR N 12 N3H1s 0.700 1.640 2.235 12.434 13.691 0.908 [OK] 2821 76 M TYR CA 3 C4H1s 0.770 1.880 2.772 13.595 13.330 1.020 [OK] 2822 76 M TYR C 1 C3H0s 0.770 1.610 2.273 7.649 8.770 0.872 [OK] 2823 76 M TYR O 16 O1H0u 0.660 1.420 5.034 30.012 16.124 1.861 possible 2824 76 M TYR CB 8 C4H2s 0.770 1.880 5.356 32.850 23.678 1.387 possible 2825 76 M TYR CG 2 C3H0b 0.770 1.610 4.989 14.157 9.732 1.455 possible 2826 76 M TYR CD1 5 C3H1s 0.770 1.760 5.935 37.287 20.171 1.849 possible 2827 76 M TYR CD2 5 C3H1s 0.770 1.760 3.509 23.105 20.728 1.115 possible 2828 76 M TYR CE1 5 C3H1s 0.770 1.760 27.982 -1.000 20.675 -1.000 bad 2829 76 M TYR CE2 5 C3H1s 0.770 1.760 6.824 52.541 20.810 2.525 possible 2830 76 M TYR CZ 2 C3H0b 0.770 1.610 4.556 14.892 9.926 1.500 possible 2831 76 M TYR OH 17 O2H1u 0.660 1.460 29.130 -1.000 19.173 -1.000 bad 2832 77 M GLN N 12 N3H1s 0.700 1.640 2.395 12.080 13.616 0.887 [OK] 2833 77 M GLN CA 3 C4H1s 0.770 1.880 5.826 24.805 13.334 1.860 possible 2834 77 M GLN C 1 C3H0s 0.770 1.610 2.417 8.227 8.787 0.936 [OK] 2835 77 M GLN O 16 O1H0u 0.660 1.420 5.607 40.101 15.993 2.507 possible 2836 77 M GLN CB 8 C4H2s 0.770 1.880 4.572 25.744 23.275 1.106 possible 2837 77 M GLN CG 8 C4H2s 0.770 1.880 4.887 29.062 23.465 1.239 possible 2838 77 M GLN CD 2 C3H0b 0.770 1.610 2.614 8.896 9.659 0.921 [OK] 2839 77 M GLN OE1 16 O1H0u 0.660 1.420 2.684 17.360 17.091 1.016 [OK] 2840 77 M GLN NE2 15 N3H2u 0.700 1.640 22.289 -1.000 24.150 -1.000 bad 2841 78 M ALA N 12 N3H1s 0.700 1.640 2.231 11.826 14.046 0.842 [OK] 2842 78 M ALA CA 4 C4H1b 0.770 1.880 2.652 13.578 14.063 0.966 [OK] 2843 78 M ALA C 1 C3H0s 0.770 1.610 2.693 10.181 8.900 1.144 [OK] 2844 78 M ALA O 16 O1H0u 0.660 1.420 2.484 16.657 16.188 1.029 [OK] 2845 78 M ALA CB 10 C4H3u 0.770 1.880 2.942 34.045 36.782 0.926 [OK] 2846 79 M GLY N 12 N3H1s 0.700 1.640 4.060 17.020 14.854 1.146 possible 2847 79 M GLY CA 8 C4H2s 0.770 1.880 20.928 -1.000 23.688 -1.000 bad 2848 79 M GLY C 2 C3H0b 0.770 1.610 2.782 8.796 9.840 0.894 [OK] 2849 79 M GLY O 16 O1H0u 0.660 1.420 19.629 -1.000 16.391 -1.000 bad 2850 80 M TRP N 12 N3H1s 0.700 1.640 2.645 12.863 13.791 0.933 [OK] 2851 80 M TRP CA 3 C4H1s 0.770 1.880 2.908 14.325 13.377 1.071 [OK] 2852 80 M TRP C 1 C3H0s 0.770 1.610 3.215 9.929 8.724 1.138 possible 2853 80 M TRP O 16 O1H0u 0.660 1.420 14.435 -1.000 15.951 -1.000 bad 2854 80 M TRP CB 8 C4H2s 0.770 1.880 23.315 -1.000 24.004 -1.000 bad 2855 80 M TRP CG 2 C3H0b 0.770 1.610 1.017 -1.000 9.965 -1.000 bad 2856 80 M TRP CD1 5 C3H1s 0.770 1.760 23.273 -1.000 20.874 -1.000 bad 2857 80 M TRP CD2 2 C3H0b 0.770 1.610 1.847 -1.000 10.097 -1.000 bad 2858 80 M TRP NE1 13 N3H1b 0.700 1.640 16.055 -1.000 16.969 -1.000 bad 2859 80 M TRP CE2 2 C3H0b 0.770 1.610 1.544 -1.000 9.889 -1.000 bad 2860 80 M TRP CE3 6 C3H1b 0.770 1.760 14.017 -1.000 20.448 -1.000 bad 2861 80 M TRP CZ2 6 C3H1b 0.770 1.760 17.929 -1.000 21.012 -1.000 bad 2862 80 M TRP CZ3 6 C3H1b 0.770 1.760 13.039 -1.000 21.516 -1.000 bad 2863 80 M TRP CH2 6 C3H1b 0.770 1.760 12.440 -1.000 21.339 -1.000 bad 2864 81 M ASN N 12 N3H1s 0.700 1.640 3.075 14.418 13.695 1.053 possible 2865 81 M ASN CA 3 C4H1s 0.770 1.880 5.874 18.811 13.167 1.429 possible 2866 81 M ASN C 1 C3H0s 0.770 1.610 2.434 8.517 8.928 0.954 [OK] 2867 81 M ASN O 16 O1H0u 0.660 1.420 2.436 14.956 16.199 0.923 [OK] 2868 81 M ASN CB 8 C4H2s 0.770 1.880 6.230 35.939 23.128 1.554 possible 2869 81 M ASN CG 2 C3H0b 0.770 1.610 4.915 13.272 9.599 1.383 possible 2870 81 M ASN OD1 16 O1H0u 0.660 1.420 4.019 23.632 16.664 1.418 possible 2871 81 M ASN ND2 15 N3H2u 0.700 1.640 13.384 -1.000 23.083 -1.000 bad 2872 82 M PRO N 11 N3H0u 0.700 1.640 2.445 8.331 8.823 0.944 [OK] 2873 82 M PRO CA 4 C4H1b 0.770 1.880 3.462 14.069 13.955 1.008 possible 2874 82 M PRO C 1 C3H0s 0.770 1.610 3.295 9.301 8.812 1.055 possible 2875 82 M PRO O 16 O1H0u 0.660 1.420 3.221 17.364 16.169 1.074 possible 2876 82 M PRO CB 9 C4H2b 0.770 1.880 29.344 -1.000 25.563 -1.000 bad 2877 82 M PRO CG 9 C4H2b 0.770 1.880 33.704 -1.000 25.832 -1.000 bad 2878 82 M PRO CD 8 C4H2s 0.770 1.880 19.629 -1.000 23.836 -1.000 bad 2879 83 M ALA N 12 N3H1s 0.700 1.640 4.533 19.351 14.046 1.378 possible 2880 83 M ALA CA 4 C4H1b 0.770 1.880 4.710 18.606 14.063 1.323 possible 2881 83 M ALA C 1 C3H0s 0.770 1.610 2.688 8.854 8.900 0.995 [OK] 2882 83 M ALA O 16 O1H0u 0.660 1.420 2.487 15.198 16.188 0.939 [OK] 2883 83 M ALA CB 10 C4H3u 0.770 1.880 7.060 65.113 36.782 1.770 possible 2884 84 M VAL N 12 N3H1s 0.700 1.640 2.800 13.344 13.676 0.976 [OK] 2885 84 M VAL CA 3 C4H1s 0.770 1.880 2.962 13.399 13.123 1.021 [OK] 2886 84 M VAL C 1 C3H0s 0.770 1.610 2.346 8.397 8.563 0.981 [OK] 2887 84 M VAL O 16 O1H0u 0.660 1.420 2.331 15.459 16.181 0.955 [OK] 2888 84 M VAL CB 4 C4H1b 0.770 1.880 2.639 13.936 14.598 0.955 [OK] 2889 84 M VAL CG1 10 C4H3u 0.770 1.880 2.911 35.038 36.584 0.958 [OK] 2890 84 M VAL CG2 10 C4H3u 0.770 1.880 3.022 35.560 36.332 0.979 possible 2891 85 M PHE N 12 N3H1s 0.700 1.640 2.282 12.546 13.691 0.916 [OK] 2892 85 M PHE CA 3 C4H1s 0.770 1.880 2.478 12.573 13.449 0.935 [OK] 2893 85 M PHE C 1 C3H0s 0.770 1.610 2.281 8.003 8.753 0.914 [OK] 2894 85 M PHE O 16 O1H0u 0.660 1.420 2.656 17.087 16.151 1.058 [OK] 2895 85 M PHE CB 8 C4H2s 0.770 1.880 3.040 22.741 23.777 0.956 possible 2896 85 M PHE CG 2 C3H0b 0.770 1.610 2.513 9.605 9.721 0.988 [OK] 2897 85 M PHE CD1 5 C3H1s 0.770 1.760 2.710 20.597 20.405 1.009 [OK] 2898 85 M PHE CD2 6 C3H1b 0.770 1.760 4.160 26.396 21.051 1.254 possible 2899 85 M PHE CE1 6 C3H1b 0.770 1.760 2.942 21.279 21.580 0.986 [OK] 2900 85 M PHE CE2 6 C3H1b 0.770 1.760 17.169 -1.000 21.680 -1.000 bad 2901 85 M PHE CZ 6 C3H1b 0.770 1.760 4.776 39.277 21.666 1.813 possible 2902 86 M LEU N 12 N3H1s 0.700 1.640 2.437 12.775 13.655 0.936 [OK] 2903 86 M LEU CA 3 C4H1s 0.770 1.880 3.187 14.031 13.122 1.069 possible 2904 86 M LEU C 1 C3H0s 0.770 1.610 2.298 8.799 8.825 0.997 [OK] 2905 86 M LEU O 16 O1H0u 0.660 1.420 3.348 22.602 16.208 1.394 possible 2906 86 M LEU CB 8 C4H2s 0.770 1.880 3.518 23.375 22.951 1.018 possible 2907 86 M LEU CG 4 C4H1b 0.770 1.880 4.272 16.873 14.764 1.143 possible 2908 86 M LEU CD1 10 C4H3u 0.770 1.880 45.396 -1.000 37.425 -1.000 bad 2909 86 M LEU CD2 10 C4H3u 0.770 1.880 40.010 -1.000 37.143 -1.000 bad 2910 87 M ARG N 12 N3H1s 0.700 1.640 2.318 13.904 13.650 1.019 [OK] 2911 87 M ARG CA 3 C4H1s 0.770 1.880 2.720 12.564 13.422 0.936 [OK] 2912 87 M ARG C 1 C3H0s 0.770 1.610 2.368 8.481 8.838 0.960 [OK] 2913 87 M ARG O 16 O1H0u 0.660 1.420 2.549 17.458 16.084 1.085 [OK] 2914 87 M ARG CB 8 C4H2s 0.770 1.880 2.809 21.325 23.088 0.924 [OK] 2915 87 M ARG CG 8 C4H2s 0.770 1.880 2.854 21.879 23.640 0.926 [OK] 2916 87 M ARG CD 8 C4H2s 0.770 1.880 2.879 23.897 23.300 1.026 [OK] 2917 87 M ARG NE 13 N3H1b 0.700 1.640 2.700 15.566 15.569 1.000 [OK] 2918 87 M ARG CZ 2 C3H0b 0.770 1.610 2.988 11.243 9.747 1.153 [OK] 2919 87 M ARG NH1 15 N3H2u 0.700 1.640 2.885 22.890 22.782 1.005 [OK] 2920 87 M ARG NH2 15 N3H2u 0.700 1.640 2.826 21.938 23.810 0.921 [OK] 2921 88 M ASP N 12 N3H1s 0.700 1.640 2.433 12.730 13.895 0.916 [OK] 2922 88 M ASP CA 3 C4H1s 0.770 1.880 2.621 12.379 13.377 0.925 [OK] 2923 88 M ASP C 1 C3H0s 0.770 1.610 2.440 8.954 8.816 1.016 [OK] 2924 88 M ASP O 16 O1H0u 0.660 1.420 2.211 13.320 16.091 0.828 [OK] 2925 88 M ASP CB 8 C4H2s 0.770 1.880 2.659 21.856 23.481 0.931 [OK] 2926 88 M ASP CG 2 C3H0b 0.770 1.610 2.478 9.724 9.422 1.032 [OK] 2927 88 M ASP OD1 16 O1H0u 0.660 1.420 2.344 15.581 15.505 1.005 [OK] 2928 88 M ASP OD2 16 O1H0u 0.660 1.420 2.314 16.749 16.324 1.026 [OK] 2929 89 M LEU N 12 N3H1s 0.700 1.640 2.502 13.623 13.655 0.998 [OK] 2930 89 M LEU CA 3 C4H1s 0.770 1.880 2.638 12.269 13.122 0.935 [OK] 2931 89 M LEU C 1 C3H0s 0.770 1.610 2.390 7.735 8.825 0.876 [OK] 2932 89 M LEU O 16 O1H0u 0.660 1.420 2.966 17.717 16.208 1.093 [OK] 2933 89 M LEU CB 8 C4H2s 0.770 1.880 3.756 27.637 22.951 1.204 possible 2934 89 M LEU CG 4 C4H1b 0.770 1.880 3.699 18.418 14.764 1.247 possible 2935 89 M LEU CD1 10 C4H3u 0.770 1.880 4.154 45.159 37.425 1.207 possible 2936 89 M LEU CD2 10 C4H3u 0.770 1.880 43.075 -1.000 37.143 -1.000 bad 2937 90 M PHE N 12 N3H1s 0.700 1.640 2.441 11.837 13.691 0.865 [OK] 2938 90 M PHE CA 3 C4H1s 0.770 1.880 2.740 12.446 13.449 0.925 [OK] 2939 90 M PHE C 1 C3H0s 0.770 1.610 2.379 8.905 8.753 1.017 [OK] 2940 90 M PHE O 16 O1H0u 0.660 1.420 2.218 14.467 16.151 0.896 [OK] 2941 90 M PHE CB 8 C4H2s 0.770 1.880 3.282 23.242 23.777 0.978 possible 2942 90 M PHE CG 2 C3H0b 0.770 1.610 2.503 10.421 9.721 1.072 [OK] 2943 90 M PHE CD1 5 C3H1s 0.770 1.760 3.208 20.344 20.405 0.997 possible 2944 90 M PHE CD2 6 C3H1b 0.770 1.760 3.398 23.635 21.051 1.123 possible 2945 90 M PHE CE1 6 C3H1b 0.770 1.760 14.555 -1.000 21.580 -1.000 bad 2946 90 M PHE CE2 6 C3H1b 0.770 1.760 6.639 48.227 21.680 2.225 possible 2947 90 M PHE CZ 6 C3H1b 0.770 1.760 33.184 -1.000 21.666 -1.000 bad 2948 91 M PHE N 12 N3H1s 0.700 1.640 2.341 11.864 13.691 0.867 [OK] 2949 91 M PHE CA 3 C4H1s 0.770 1.880 2.815 14.529 13.449 1.080 [OK] 2950 91 M PHE C 1 C3H0s 0.770 1.610 2.311 8.549 8.753 0.977 [OK] 2951 91 M PHE O 16 O1H0u 0.660 1.420 4.946 28.715 16.151 1.778 possible 2952 91 M PHE CB 8 C4H2s 0.770 1.880 3.216 21.548 23.777 0.906 possible 2953 91 M PHE CG 2 C3H0b 0.770 1.610 2.398 9.701 9.721 0.998 [OK] 2954 91 M PHE CD1 5 C3H1s 0.770 1.760 2.740 18.974 20.405 0.930 [OK] 2955 91 M PHE CD2 6 C3H1b 0.770 1.760 3.873 29.657 21.051 1.409 possible 2956 91 M PHE CE1 6 C3H1b 0.770 1.760 3.509 26.782 21.580 1.241 possible 2957 91 M PHE CE2 6 C3H1b 0.770 1.760 3.463 25.243 21.680 1.164 possible 2958 91 M PHE CZ 6 C3H1b 0.770 1.760 3.305 23.459 21.666 1.083 possible 2959 92 M PHE N 12 N3H1s 0.700 1.640 2.459 14.378 13.691 1.050 [OK] 2960 92 M PHE CA 3 C4H1s 0.770 1.880 2.909 13.200 13.449 0.982 [OK] 2961 92 M PHE C 1 C3H0s 0.770 1.610 2.520 8.691 8.753 0.993 [OK] 2962 92 M PHE O 16 O1H0u 0.660 1.420 2.264 15.124 16.151 0.936 [OK] 2963 92 M PHE CB 8 C4H2s 0.770 1.880 2.630 20.043 23.777 0.843 [OK] 2964 92 M PHE CG 2 C3H0b 0.770 1.610 2.479 9.846 9.721 1.013 [OK] 2965 92 M PHE CD1 5 C3H1s 0.770 1.760 2.724 18.228 20.405 0.893 [OK] 2966 92 M PHE CD2 6 C3H1b 0.770 1.760 2.682 19.245 21.051 0.914 [OK] 2967 92 M PHE CE1 6 C3H1b 0.770 1.760 2.842 20.704 21.580 0.959 [OK] 2968 92 M PHE CE2 6 C3H1b 0.770 1.760 2.692 20.058 21.680 0.925 [OK] 2969 92 M PHE CZ 6 C3H1b 0.770 1.760 2.694 18.867 21.666 0.871 [OK] 2970 93 M SER N 12 N3H1s 0.700 1.640 3.303 16.472 14.103 1.168 possible 2971 93 M SER CA 3 C4H1s 0.770 1.880 2.522 12.746 13.476 0.946 [OK] 2972 93 M SER C 1 C3H0s 0.770 1.610 2.483 9.298 8.923 1.042 [OK] 2973 93 M SER O 16 O1H0u 0.660 1.420 3.412 18.271 16.179 1.129 possible 2974 93 M SER CB 8 C4H2s 0.770 1.880 5.477 46.285 23.884 1.938 possible 2975 93 M SER OG 17 O2H1u 0.660 1.460 2.665 18.408 18.732 0.983 [OK] 2976 94 M LEU N 12 N3H1s 0.700 1.640 2.475 14.241 13.655 1.043 [OK] 2977 94 M LEU CA 3 C4H1s 0.770 1.880 2.454 11.714 13.122 0.893 [OK] 2978 94 M LEU C 1 C3H0s 0.770 1.610 2.411 9.051 8.825 1.026 [OK] 2979 94 M LEU O 16 O1H0u 0.660 1.420 2.318 15.394 16.208 0.950 [OK] 2980 94 M LEU CB 8 C4H2s 0.770 1.880 3.060 23.734 22.951 1.034 possible 2981 94 M LEU CG 4 C4H1b 0.770 1.880 3.082 15.659 14.764 1.061 possible 2982 94 M LEU CD1 10 C4H3u 0.770 1.880 3.009 35.385 37.425 0.945 possible 2983 94 M LEU CD2 10 C4H3u 0.770 1.880 2.755 30.003 37.143 0.808 [OK] 2984 95 M GLU N 12 N3H1s 0.700 1.640 2.483 13.579 13.615 0.997 [OK] 2985 95 M GLU CA 3 C4H1s 0.770 1.880 2.561 11.904 13.399 0.888 [OK] 2986 95 M GLU C 1 C3H0s 0.770 1.610 2.310 8.639 8.675 0.996 [OK] 2987 95 M GLU O 16 O1H0u 0.660 1.420 2.271 14.882 16.023 0.929 [OK] 2988 95 M GLU CB 8 C4H2s 0.770 1.880 5.198 37.312 23.529 1.586 possible 2989 95 M GLU CG 8 C4H2s 0.770 1.880 21.888 -1.000 23.513 -1.000 bad 2990 95 M GLU CD 2 C3H0b 0.770 1.610 3.211 -1.000 9.460 -1.000 bad 2991 95 M GLU OE1 16 O1H0u 0.660 1.420 14.012 -1.000 15.999 -1.000 bad 2992 95 M GLU OE2 16 O1H0u 0.660 1.420 14.536 -1.000 17.432 -1.000 bad 2993 96 M PRO N 11 N3H0u 0.700 1.640 2.513 8.198 8.823 0.929 [OK] 2994 96 M PRO CA 4 C4H1b 0.770 1.880 2.526 12.339 13.955 0.884 [OK] 2995 96 M PRO C 1 C3H0s 0.770 1.610 2.372 8.786 8.812 0.997 [OK] 2996 96 M PRO O 16 O1H0u 0.660 1.420 4.539 24.655 16.169 1.525 possible 2997 96 M PRO CB 9 C4H2b 0.770 1.880 3.698 25.509 25.563 0.998 possible 2998 96 M PRO CG 9 C4H2b 0.770 1.880 3.120 26.659 25.832 1.032 possible 2999 96 M PRO CD 8 C4H2s 0.770 1.880 4.405 27.847 23.836 1.168 possible 3000 97 M PRO N 11 N3H0u 0.700 1.640 2.482 7.927 8.823 0.898 [OK] 3001 97 M PRO CA 4 C4H1b 0.770 1.880 2.783 14.001 13.955 1.003 [OK] 3002 97 M PRO C 1 C3H0s 0.770 1.610 2.685 8.601 8.812 0.976 [OK] 3003 97 M PRO O 16 O1H0u 0.660 1.420 3.909 18.815 16.169 1.164 possible 3004 97 M PRO CB 9 C4H2b 0.770 1.880 3.128 26.406 25.563 1.033 possible 3005 97 M PRO CG 9 C4H2b 0.770 1.880 3.040 25.221 25.832 0.976 possible 3006 97 M PRO CD 8 C4H2s 0.770 1.880 2.719 22.807 23.836 0.957 [OK] 3007 98 M ALA N 12 N3H1s 0.700 1.640 3.036 13.903 14.046 0.990 possible 3008 98 M ALA CA 4 C4H1b 0.770 1.880 6.151 26.672 14.063 1.897 possible 3009 98 M ALA C 1 C3H0s 0.770 1.610 2.303 8.905 8.900 1.001 [OK] 3010 98 M ALA O 16 O1H0u 0.660 1.420 2.116 14.086 16.188 0.870 [OK] 3011 98 M ALA CB 10 C4H3u 0.770 1.880 25.558 -1.000 36.782 -1.000 bad 3012 99 M PRO N 11 N3H0u 0.700 1.640 2.641 8.409 8.823 0.953 [OK] 3013 99 M PRO CA 4 C4H1b 0.770 1.880 2.924 13.671 13.955 0.980 [OK] 3014 99 M PRO C 1 C3H0s 0.770 1.610 4.688 9.674 8.812 1.098 possible 3015 99 M PRO O 16 O1H0u 0.660 1.420 9.039 -1.000 16.169 -1.000 bad 3016 99 M PRO CB 9 C4H2b 0.770 1.880 31.989 -1.000 25.563 -1.000 bad 3017 99 M PRO CG 9 C4H2b 0.770 1.880 21.287 -1.000 25.832 -1.000 bad 3018 99 M PRO CD 8 C4H2s 0.770 1.880 22.435 -1.000 23.836 -1.000 bad 3019 100 M GLU N 12 N3H1s 0.700 1.640 5.850 25.026 13.615 1.838 possible 3020 100 M GLU CA 3 C4H1s 0.770 1.880 14.349 -1.000 13.399 -1.000 bad 3021 100 M GLU C 1 C3H0s 0.770 1.610 2.915 8.784 8.675 1.013 [OK] 3022 100 M GLU O 16 O1H0u 0.660 1.420 32.155 -1.000 16.023 -1.000 bad 3023 100 M GLU CB 8 C4H2s 0.770 1.880 29.760 -1.000 23.529 -1.000 bad 3024 100 M GLU CG 8 C4H2s 0.770 1.880 4.672 25.579 23.513 1.088 possible 3025 100 M GLU CD 2 C3H0b 0.770 1.610 5.980 11.913 9.460 1.259 possible 3026 100 M GLU OE1 16 O1H0u 0.660 1.420 34.314 -1.000 15.999 -1.000 bad 3027 100 M GLU OE2 16 O1H0u 0.660 1.420 34.056 -1.000 17.432 -1.000 bad 3028 101 M TYR N 12 N3H1s 0.700 1.640 2.672 12.406 13.691 0.906 [OK] 3029 101 M TYR CA 3 C4H1s 0.770 1.880 4.107 16.565 13.330 1.243 possible 3030 101 M TYR C 1 C3H0s 0.770 1.610 3.437 10.079 8.770 1.149 possible 3031 101 M TYR O 16 O1H0u 0.660 1.420 5.430 -1.000 16.124 -1.000 bad 3032 101 M TYR CB 8 C4H2s 0.770 1.880 3.175 27.766 23.678 1.173 possible 3033 101 M TYR CG 2 C3H0b 0.770 1.610 2.551 9.913 9.732 1.019 [OK] 3034 101 M TYR CD1 5 C3H1s 0.770 1.760 6.459 39.108 20.171 1.939 possible 3035 101 M TYR CD2 5 C3H1s 0.770 1.760 2.722 18.139 20.728 0.875 [OK] 3036 101 M TYR CE1 5 C3H1s 0.770 1.760 13.582 -1.000 20.675 -1.000 bad 3037 101 M TYR CE2 5 C3H1s 0.770 1.760 3.727 23.347 20.810 1.122 possible 3038 101 M TYR CZ 2 C3H0b 0.770 1.610 2.776 10.886 9.926 1.097 [OK] 3039 101 M TYR OH 17 O2H1u 0.660 1.460 21.857 -1.000 19.173 -1.000 bad 3040 102 M GLY N 12 N3H1s 0.700 1.640 3.647 16.700 14.854 1.124 possible 3041 102 M GLY CA 8 C4H2s 0.770 1.880 20.137 -1.000 23.688 -1.000 bad 3042 102 M GLY C 2 C3H0b 0.770 1.610 2.190 8.455 9.840 0.859 [OK] 3043 102 M GLY O 16 O1H0u 0.660 1.420 2.670 15.794 16.391 0.964 [OK] 3044 103 M LEU N 12 N3H1s 0.700 1.640 5.586 -1.000 13.655 -1.000 bad 3045 103 M LEU CA 3 C4H1s 0.770 1.880 2.507 11.645 13.122 0.887 [OK] 3046 103 M LEU C 1 C3H0s 0.770 1.610 5.199 11.355 8.825 1.287 possible 3047 103 M LEU O 16 O1H0u 0.660 1.420 5.682 -1.000 16.208 -1.000 bad 3048 103 M LEU CB 8 C4H2s 0.770 1.880 15.555 -1.000 22.951 -1.000 bad 3049 103 M LEU CG 4 C4H1b 0.770 1.880 3.823 14.025 14.764 0.950 possible 3050 103 M LEU CD1 10 C4H3u 0.770 1.880 32.598 -1.000 37.425 -1.000 bad 3051 103 M LEU CD2 10 C4H3u 0.770 1.880 3.210 34.665 37.143 0.933 possible 3052 104 M SER N 12 N3H1s 0.700 1.640 5.740 21.107 14.103 1.497 possible 3053 104 M SER CA 3 C4H1s 0.770 1.880 8.015 -1.000 13.476 -1.000 bad 3054 104 M SER C 1 C3H0s 0.770 1.610 2.525 8.967 8.923 1.005 [OK] 3055 104 M SER O 16 O1H0u 0.660 1.420 2.644 22.967 16.179 1.420 [OK] 3056 104 M SER CB 8 C4H2s 0.770 1.880 32.875 -1.000 23.884 -1.000 bad 3057 104 M SER OG 17 O2H1u 0.660 1.460 5.636 -1.000 18.732 -1.000 bad 3058 105 M PHE N 12 N3H1s 0.700 1.640 7.212 27.225 13.691 1.989 possible 3059 105 M PHE CA 3 C4H1s 0.770 1.880 2.767 12.787 13.449 0.951 [OK] 3060 105 M PHE C 1 C3H0s 0.770 1.610 5.486 13.190 8.753 1.507 possible 3061 105 M PHE O 16 O1H0u 0.660 1.420 21.282 -1.000 16.151 -1.000 bad 3062 105 M PHE CB 8 C4H2s 0.770 1.880 25.867 -1.000 23.777 -1.000 bad 3063 105 M PHE CG 2 C3H0b 0.770 1.610 0.570 -1.000 9.721 -1.000 bad 3064 105 M PHE CD1 5 C3H1s 0.770 1.760 6.174 40.778 20.405 1.998 possible 3065 105 M PHE CD2 6 C3H1b 0.770 1.760 21.380 -1.000 21.051 -1.000 bad 3066 105 M PHE CE1 6 C3H1b 0.770 1.760 5.550 49.023 21.580 2.272 possible 3067 105 M PHE CE2 6 C3H1b 0.770 1.760 30.197 -1.000 21.680 -1.000 bad 3068 105 M PHE CZ 6 C3H1b 0.770 1.760 23.652 -1.000 21.666 -1.000 bad 3069 106 M ALA N 12 N3H1s 0.700 1.640 4.867 17.349 14.046 1.235 possible 3070 106 M ALA CA 4 C4H1b 0.770 1.880 11.714 -1.000 14.063 -1.000 bad 3071 106 M ALA C 1 C3H0s 0.770 1.610 4.144 11.619 8.900 1.305 possible 3072 106 M ALA O 16 O1H0u 0.660 1.420 19.969 -1.000 16.188 -1.000 bad 3073 106 M ALA CB 10 C4H3u 0.770 1.880 49.001 -1.000 36.782 -1.000 bad 3074 107 M ALA N 12 N3H1s 0.700 1.640 2.885 17.439 14.046 1.242 [OK] 3075 107 M ALA CA 4 C4H1b 0.770 1.880 2.550 12.155 14.063 0.864 [OK] 3076 107 M ALA C 1 C3H0s 0.770 1.610 2.851 8.586 8.900 0.965 [OK] 3077 107 M ALA O 16 O1H0u 0.660 1.420 6.741 46.647 16.188 2.882 possible 3078 107 M ALA CB 10 C4H3u 0.770 1.880 3.097 38.247 36.782 1.040 possible 3079 108 M PRO N 11 N3H0u 0.700 1.640 3.406 9.952 8.823 1.128 possible 3080 108 M PRO CA 4 C4H1b 0.770 1.880 10.076 -1.000 13.955 -1.000 bad 3081 108 M PRO C 1 C3H0s 0.770 1.610 2.324 8.625 8.812 0.979 [OK] 3082 108 M PRO O 16 O1H0u 0.660 1.420 2.120 13.839 16.169 0.856 [OK] 3083 108 M PRO CB 9 C4H2b 0.770 1.880 10.894 -1.000 25.563 -1.000 bad 3084 108 M PRO CG 9 C4H2b 0.770 1.880 28.516 -1.000 25.832 -1.000 bad 3085 108 M PRO CD 8 C4H2s 0.770 1.880 3.925 25.686 23.836 1.078 possible 3086 109 M LEU N 12 N3H1s 0.700 1.640 5.585 27.397 13.655 2.006 possible 3087 109 M LEU CA 3 C4H1s 0.770 1.880 3.157 12.870 13.122 0.981 possible 3088 109 M LEU C 1 C3H0s 0.770 1.610 2.718 8.394 8.825 0.951 [OK] 3089 109 M LEU O 16 O1H0u 0.660 1.420 2.342 16.011 16.208 0.988 [OK] 3090 109 M LEU CB 8 C4H2s 0.770 1.880 4.324 29.943 22.951 1.305 possible 3091 109 M LEU CG 4 C4H1b 0.770 1.880 7.431 50.750 14.764 3.437 possible 3092 109 M LEU CD1 10 C4H3u 0.770 1.880 65.989 -1.000 37.425 -1.000 bad 3093 109 M LEU CD2 10 C4H3u 0.770 1.880 5.888 58.704 37.143 1.580 possible 3094 110 M LYS N 12 N3H1s 0.700 1.640 2.840 13.520 13.675 0.989 [OK] 3095 110 M LYS CA 3 C4H1s 0.770 1.880 2.734 13.775 13.324 1.034 [OK] 3096 110 M LYS C 1 C3H0s 0.770 1.610 2.408 9.245 8.759 1.055 [OK] 3097 110 M LYS O 16 O1H0u 0.660 1.420 5.205 29.124 16.049 1.815 possible 3098 110 M LYS CB 8 C4H2s 0.770 1.880 5.161 36.366 22.904 1.588 possible 3099 110 M LYS CG 8 C4H2s 0.770 1.880 5.571 40.754 23.131 1.762 possible 3100 110 M LYS CD 8 C4H2s 0.770 1.880 15.285 -1.000 23.837 -1.000 bad 3101 110 M LYS CE 9 C4H2b 0.770 1.880 33.186 -1.000 23.934 -1.000 bad 3102 110 M LYS NZ 14 N4H3u 0.700 1.640 32.232 -1.000 21.213 -1.000 bad 3103 111 M GLU N 12 N3H1s 0.700 1.640 2.916 13.431 13.615 0.987 [OK] 3104 111 M GLU CA 3 C4H1s 0.770 1.880 3.271 13.549 13.399 1.011 possible 3105 111 M GLU C 1 C3H0s 0.770 1.610 2.189 8.762 8.675 1.010 [OK] 3106 111 M GLU O 16 O1H0u 0.660 1.420 2.489 16.864 16.023 1.052 [OK] 3107 111 M GLU CB 8 C4H2s 0.770 1.880 3.367 26.110 23.529 1.110 possible 3108 111 M GLU CG 8 C4H2s 0.770 1.880 6.802 58.322 23.513 2.480 possible 3109 111 M GLU CD 2 C3H0b 0.770 1.610 4.110 14.815 9.460 1.566 possible 3110 111 M GLU OE1 16 O1H0u 0.660 1.420 22.105 -1.000 15.999 -1.000 bad 3111 111 M GLU OE2 16 O1H0u 0.660 1.420 45.624 -1.000 17.432 -1.000 bad 3112 112 M GLY N 12 N3H1s 0.700 1.640 2.395 13.612 14.854 0.916 [OK] 3113 112 M GLY CA 8 C4H2s 0.770 1.880 2.564 20.251 23.688 0.855 [OK] 3114 112 M GLY C 2 C3H0b 0.770 1.610 2.402 9.044 9.840 0.919 [OK] 3115 112 M GLY O 16 O1H0u 0.660 1.420 2.198 14.200 16.391 0.866 [OK] 3116 113 M GLY N 12 N3H1s 0.700 1.640 2.407 14.372 14.854 0.968 [OK] 3117 113 M GLY CA 8 C4H2s 0.770 1.880 4.777 35.959 23.688 1.518 possible 3118 113 M GLY C 2 C3H0b 0.770 1.610 2.851 9.398 9.840 0.955 [OK] 3119 113 M GLY O 16 O1H0u 0.660 1.420 4.131 19.497 16.391 1.189 possible 3120 114 M LEU N 12 N3H1s 0.700 1.640 2.375 12.944 13.655 0.948 [OK] 3121 114 M LEU CA 3 C4H1s 0.770 1.880 2.699 13.101 13.122 0.998 [OK] 3122 114 M LEU C 1 C3H0s 0.770 1.610 2.310 8.261 8.825 0.936 [OK] 3123 114 M LEU O 16 O1H0u 0.660 1.420 2.312 14.707 16.208 0.907 [OK] 3124 114 M LEU CB 8 C4H2s 0.770 1.880 2.684 19.749 22.951 0.860 [OK] 3125 114 M LEU CG 4 C4H1b 0.770 1.880 3.021 18.310 14.764 1.240 possible 3126 114 M LEU CD1 10 C4H3u 0.770 1.880 6.267 77.292 37.425 2.065 possible 3127 114 M LEU CD2 10 C4H3u 0.770 1.880 5.864 64.053 37.143 1.725 possible 3128 115 M TRP N 12 N3H1s 0.700 1.640 2.040 11.468 13.791 0.832 [OK] 3129 115 M TRP CA 3 C4H1s 0.770 1.880 2.656 13.507 13.377 1.010 [OK] 3130 115 M TRP C 1 C3H0s 0.770 1.610 1.995 7.781 8.724 0.892 [OK] 3131 115 M TRP O 16 O1H0u 0.660 1.420 2.221 14.272 15.951 0.895 [OK] 3132 115 M TRP CB 8 C4H2s 0.770 1.880 2.635 20.481 24.004 0.853 [OK] 3133 115 M TRP CG 2 C3H0b 0.770 1.610 2.382 8.979 9.965 0.901 [OK] 3134 115 M TRP CD1 5 C3H1s 0.770 1.760 2.506 19.219 20.874 0.921 [OK] 3135 115 M TRP CD2 2 C3H0b 0.770 1.610 2.398 9.364 10.097 0.927 [OK] 3136 115 M TRP NE1 13 N3H1b 0.700 1.640 2.707 16.055 16.969 0.946 [OK] 3137 115 M TRP CE2 2 C3H0b 0.770 1.610 2.470 9.651 9.889 0.976 [OK] 3138 115 M TRP CE3 6 C3H1b 0.770 1.760 2.566 18.524 20.448 0.906 [OK] 3139 115 M TRP CZ2 6 C3H1b 0.770 1.760 2.763 19.335 21.012 0.920 [OK] 3140 115 M TRP CZ3 6 C3H1b 0.770 1.760 3.439 24.076 21.516 1.119 possible 3141 115 M TRP CH2 6 C3H1b 0.770 1.760 3.237 23.330 21.339 1.093 possible 3142 116 M LEU N 12 N3H1s 0.700 1.640 2.361 12.239 13.655 0.896 [OK] 3143 116 M LEU CA 3 C4H1s 0.770 1.880 3.011 13.795 13.122 1.051 possible 3144 116 M LEU C 1 C3H0s 0.770 1.610 4.116 9.521 8.825 1.079 possible 3145 116 M LEU O 16 O1H0u 0.660 1.420 4.069 26.250 16.208 1.620 possible 3146 116 M LEU CB 8 C4H2s 0.770 1.880 4.533 33.966 22.951 1.480 possible 3147 116 M LEU CG 4 C4H1b 0.770 1.880 2.618 13.827 14.764 0.937 [OK] 3148 116 M LEU CD1 10 C4H3u 0.770 1.880 4.448 44.030 37.425 1.176 possible 3149 116 M LEU CD2 10 C4H3u 0.770 1.880 4.226 42.827 37.143 1.153 possible 3150 117 M ILE N 12 N3H1s 0.700 1.640 3.500 13.825 13.633 1.014 possible 3151 117 M ILE CA 3 C4H1s 0.770 1.880 4.144 17.059 13.007 1.312 possible 3152 117 M ILE C 1 C3H0s 0.770 1.610 2.474 7.926 8.470 0.936 [OK] 3153 117 M ILE O 16 O1H0u 0.660 1.420 2.778 15.663 16.144 0.970 [OK] 3154 117 M ILE CB 4 C4H1b 0.770 1.880 2.739 14.000 14.227 0.984 [OK] 3155 117 M ILE CG1 9 C4H2b 0.770 1.880 22.426 -1.000 24.187 -1.000 bad 3156 117 M ILE CG2 10 C4H3u 0.770 1.880 5.497 60.549 35.961 1.684 possible 3157 117 M ILE CD1 10 C4H3u 0.770 1.880 34.572 -1.000 38.377 -1.000 bad 3158 118 M ALA N 12 N3H1s 0.700 1.640 2.574 12.851 14.046 0.915 [OK] 3159 118 M ALA CA 4 C4H1b 0.770 1.880 2.884 15.879 14.063 1.129 [OK] 3160 118 M ALA C 1 C3H0s 0.770 1.610 2.508 8.684 8.900 0.976 [OK] 3161 118 M ALA O 16 O1H0u 0.660 1.420 2.407 14.462 16.188 0.893 [OK] 3162 118 M ALA CB 10 C4H3u 0.770 1.880 2.824 34.958 36.782 0.950 [OK] 3163 119 M SER N 12 N3H1s 0.700 1.640 2.327 12.660 14.103 0.898 [OK] 3164 119 M SER CA 3 C4H1s 0.770 1.880 2.750 13.916 13.476 1.033 [OK] 3165 119 M SER C 1 C3H0s 0.770 1.610 2.919 9.043 8.923 1.013 [OK] 3166 119 M SER O 16 O1H0u 0.660 1.420 2.745 16.043 16.179 0.992 [OK] 3167 119 M SER CB 8 C4H2s 0.770 1.880 4.346 33.835 23.884 1.417 possible 3168 119 M SER OG 17 O2H1u 0.660 1.460 2.528 17.894 18.732 0.955 [OK] 3169 120 M PHE N 12 N3H1s 0.700 1.640 4.222 16.550 13.691 1.209 possible 3170 120 M PHE CA 3 C4H1s 0.770 1.880 4.808 21.969 13.449 1.634 possible 3171 120 M PHE C 1 C3H0s 0.770 1.610 2.239 7.777 8.753 0.888 [OK] 3172 120 M PHE O 16 O1H0u 0.660 1.420 2.632 15.679 16.151 0.971 [OK] 3173 120 M PHE CB 8 C4H2s 0.770 1.880 5.243 41.590 23.777 1.749 possible 3174 120 M PHE CG 2 C3H0b 0.770 1.610 5.770 16.494 9.721 1.697 possible 3175 120 M PHE CD1 5 C3H1s 0.770 1.760 6.886 83.300 20.405 4.082 possible 3176 120 M PHE CD2 6 C3H1b 0.770 1.760 6.048 36.466 21.051 1.732 possible 3177 120 M PHE CE1 6 C3H1b 0.770 1.760 27.827 -1.000 21.580 -1.000 bad 3178 120 M PHE CE2 6 C3H1b 0.770 1.760 20.119 -1.000 21.680 -1.000 bad 3179 120 M PHE CZ 6 C3H1b 0.770 1.760 26.554 -1.000 21.666 -1.000 bad 3180 121 M PHE N 12 N3H1s 0.700 1.640 2.485 12.662 13.691 0.925 [OK] 3181 121 M PHE CA 3 C4H1s 0.770 1.880 3.061 13.972 13.449 1.039 possible 3182 121 M PHE C 1 C3H0s 0.770 1.610 2.402 8.560 8.753 0.978 [OK] 3183 121 M PHE O 16 O1H0u 0.660 1.420 2.548 15.654 16.151 0.969 [OK] 3184 121 M PHE CB 8 C4H2s 0.770 1.880 2.696 20.707 23.777 0.871 [OK] 3185 121 M PHE CG 2 C3H0b 0.770 1.610 2.638 9.936 9.721 1.022 [OK] 3186 121 M PHE CD1 5 C3H1s 0.770 1.760 3.449 22.892 20.405 1.122 possible 3187 121 M PHE CD2 6 C3H1b 0.770 1.760 2.890 20.056 21.051 0.953 [OK] 3188 121 M PHE CE1 6 C3H1b 0.770 1.760 7.414 50.180 21.580 2.325 possible 3189 121 M PHE CE2 6 C3H1b 0.770 1.760 4.517 26.673 21.680 1.230 possible 3190 121 M PHE CZ 6 C3H1b 0.770 1.760 16.988 -1.000 21.666 -1.000 bad 3191 122 M MET N 12 N3H1s 0.700 1.640 2.428 12.924 13.564 0.953 [OK] 3192 122 M MET CA 3 C4H1s 0.770 1.880 3.464 16.067 13.231 1.214 possible 3193 122 M MET C 1 C3H0s 0.770 1.610 2.408 8.440 8.782 0.961 [OK] 3194 122 M MET O 16 O1H0u 0.660 1.420 2.718 14.834 16.277 0.911 [OK] 3195 122 M MET CB 8 C4H2s 0.770 1.880 2.853 20.667 23.645 0.874 [OK] 3196 122 M MET CG 9 C4H2b 0.770 1.880 3.493 28.038 24.009 1.168 possible 3197 122 M MET SD 19 S2H0u 1.040 1.770 3.101 33.047 30.093 1.098 possible 3198 122 M MET CE 10 C4H3u 0.770 1.880 3.040 33.083 37.161 0.890 possible 3199 123 M PHE N 12 N3H1s 0.700 1.640 2.620 13.298 13.691 0.971 [OK] 3200 123 M PHE CA 3 C4H1s 0.770 1.880 2.603 13.357 13.449 0.993 [OK] 3201 123 M PHE C 1 C3H0s 0.770 1.610 2.297 7.909 8.753 0.904 [OK] 3202 123 M PHE O 16 O1H0u 0.660 1.420 2.641 15.473 16.151 0.958 [OK] 3203 123 M PHE CB 8 C4H2s 0.770 1.880 3.945 25.103 23.777 1.056 possible 3204 123 M PHE CG 2 C3H0b 0.770 1.610 4.866 14.168 9.721 1.457 possible 3205 123 M PHE CD1 5 C3H1s 0.770 1.760 4.933 23.309 20.405 1.142 possible 3206 123 M PHE CD2 6 C3H1b 0.770 1.760 5.553 35.707 21.051 1.696 possible 3207 123 M PHE CE1 6 C3H1b 0.770 1.760 5.094 33.218 21.580 1.539 possible 3208 123 M PHE CE2 6 C3H1b 0.770 1.760 27.646 -1.000 21.680 -1.000 bad 3209 123 M PHE CZ 6 C3H1b 0.770 1.760 26.620 -1.000 21.666 -1.000 bad 3210 124 M VAL N 12 N3H1s 0.700 1.640 2.482 12.786 13.676 0.935 [OK] 3211 124 M VAL CA 3 C4H1s 0.770 1.880 4.786 19.478 13.123 1.484 possible 3212 124 M VAL C 1 C3H0s 0.770 1.610 2.762 7.955 8.563 0.929 [OK] 3213 124 M VAL O 16 O1H0u 0.660 1.420 3.774 16.480 16.181 1.018 possible 3214 124 M VAL CB 4 C4H1b 0.770 1.880 3.327 15.811 14.598 1.083 possible 3215 124 M VAL CG1 10 C4H3u 0.770 1.880 6.083 60.154 36.584 1.644 possible 3216 124 M VAL CG2 10 C4H3u 0.770 1.880 16.606 -1.000 36.332 -1.000 bad 3217 125 M ALA N 12 N3H1s 0.700 1.640 2.769 13.271 14.046 0.945 [OK] 3218 125 M ALA CA 4 C4H1b 0.770 1.880 3.049 14.780 14.063 1.051 possible 3219 125 M ALA C 1 C3H0s 0.770 1.610 2.336 8.313 8.900 0.934 [OK] 3220 125 M ALA O 16 O1H0u 0.660 1.420 2.160 14.637 16.188 0.904 [OK] 3221 125 M ALA CB 10 C4H3u 0.770 1.880 3.524 38.106 36.782 1.036 possible 3222 126 M VAL N 12 N3H1s 0.700 1.640 2.674 13.298 13.676 0.972 [OK] 3223 126 M VAL CA 3 C4H1s 0.770 1.880 2.657 13.194 13.123 1.005 [OK] 3224 126 M VAL C 1 C3H0s 0.770 1.610 2.658 8.034 8.563 0.938 [OK] 3225 126 M VAL O 16 O1H0u 0.660 1.420 2.545 16.036 16.181 0.991 [OK] 3226 126 M VAL CB 4 C4H1b 0.770 1.880 2.693 14.160 14.598 0.970 [OK] 3227 126 M VAL CG1 10 C4H3u 0.770 1.880 3.065 35.300 36.584 0.965 possible 3228 126 M VAL CG2 10 C4H3u 0.770 1.880 3.159 38.246 36.332 1.053 possible 3229 127 M TRP N 12 N3H1s 0.700 1.640 2.710 13.651 13.791 0.990 [OK] 3230 127 M TRP CA 3 C4H1s 0.770 1.880 2.961 13.106 13.377 0.980 [OK] 3231 127 M TRP C 1 C3H0s 0.770 1.610 4.779 10.318 8.724 1.183 possible 3232 127 M TRP O 16 O1H0u 0.660 1.420 6.784 34.997 15.951 2.194 possible 3233 127 M TRP CB 8 C4H2s 0.770 1.880 18.285 -1.000 24.004 -1.000 bad 3234 127 M TRP CG 2 C3H0b 0.770 1.610 5.761 14.200 9.965 1.425 possible 3235 127 M TRP CD1 5 C3H1s 0.770 1.760 3.030 20.017 20.874 0.959 possible 3236 127 M TRP CD2 2 C3H0b 0.770 1.610 5.906 18.124 10.097 1.795 possible 3237 127 M TRP NE1 13 N3H1b 0.700 1.640 3.046 16.730 16.969 0.986 possible 3238 127 M TRP CE2 2 C3H0b 0.770 1.610 5.329 14.592 9.889 1.476 possible 3239 127 M TRP CE3 6 C3H1b 0.770 1.760 9.882 -1.000 20.448 -1.000 bad 3240 127 M TRP CZ2 6 C3H1b 0.770 1.760 6.771 34.470 21.012 1.640 possible 3241 127 M TRP CZ3 6 C3H1b 0.770 1.760 10.626 -1.000 21.516 -1.000 bad 3242 127 M TRP CH2 6 C3H1b 0.770 1.760 16.475 -1.000 21.339 -1.000 bad 3243 128 M SER N 12 N3H1s 0.700 1.640 4.828 16.725 14.103 1.186 possible 3244 128 M SER CA 3 C4H1s 0.770 1.880 4.571 17.859 13.476 1.325 possible 3245 128 M SER C 1 C3H0s 0.770 1.610 2.616 8.631 8.923 0.967 [OK] 3246 128 M SER O 16 O1H0u 0.660 1.420 2.724 16.527 16.179 1.022 [OK] 3247 128 M SER CB 8 C4H2s 0.770 1.880 2.834 21.938 23.884 0.919 [OK] 3248 128 M SER OG 17 O2H1u 0.660 1.460 5.332 31.838 18.732 1.700 possible 3249 129 M TRP N 12 N3H1s 0.700 1.640 2.599 12.611 13.791 0.914 [OK] 3250 129 M TRP CA 3 C4H1s 0.770 1.880 3.026 13.926 13.377 1.041 possible 3251 129 M TRP C 1 C3H0s 0.770 1.610 2.096 8.194 8.724 0.939 [OK] 3252 129 M TRP O 16 O1H0u 0.660 1.420 2.457 14.714 15.951 0.922 [OK] 3253 129 M TRP CB 8 C4H2s 0.770 1.880 2.683 21.298 24.004 0.887 [OK] 3254 129 M TRP CG 2 C3H0b 0.770 1.610 2.643 9.069 9.965 0.910 [OK] 3255 129 M TRP CD1 5 C3H1s 0.770 1.760 2.721 18.997 20.874 0.910 [OK] 3256 129 M TRP CD2 2 C3H0b 0.770 1.610 3.032 10.764 10.097 1.066 possible 3257 129 M TRP NE1 13 N3H1b 0.700 1.640 3.245 16.456 16.969 0.970 possible 3258 129 M TRP CE2 2 C3H0b 0.770 1.610 3.039 10.973 9.889 1.110 possible 3259 129 M TRP CE3 6 C3H1b 0.770 1.760 3.162 19.439 20.448 0.951 possible 3260 129 M TRP CZ2 6 C3H1b 0.770 1.760 3.687 27.468 21.012 1.307 possible 3261 129 M TRP CZ3 6 C3H1b 0.770 1.760 3.711 32.833 21.516 1.526 possible 3262 129 M TRP CH2 6 C3H1b 0.770 1.760 5.056 40.981 21.339 1.920 possible 3263 130 M TRP N 12 N3H1s 0.700 1.640 2.307 12.454 13.791 0.903 [OK] 3264 130 M TRP CA 3 C4H1s 0.770 1.880 2.510 12.647 13.377 0.945 [OK] 3265 130 M TRP C 1 C3H0s 0.770 1.610 2.068 7.710 8.724 0.884 [OK] 3266 130 M TRP O 16 O1H0u 0.660 1.420 2.425 15.585 15.951 0.977 [OK] 3267 130 M TRP CB 8 C4H2s 0.770 1.880 2.867 22.735 24.004 0.947 [OK] 3268 130 M TRP CG 2 C3H0b 0.770 1.610 2.561 9.769 9.965 0.980 [OK] 3269 130 M TRP CD1 5 C3H1s 0.770 1.760 2.691 20.161 20.874 0.966 [OK] 3270 130 M TRP CD2 2 C3H0b 0.770 1.610 2.842 10.568 10.097 1.047 [OK] 3271 130 M TRP NE1 13 N3H1b 0.700 1.640 2.557 15.402 16.969 0.908 [OK] 3272 130 M TRP CE2 2 C3H0b 0.770 1.610 2.914 11.379 9.889 1.151 [OK] 3273 130 M TRP CE3 6 C3H1b 0.770 1.760 5.558 31.699 20.448 1.550 possible 3274 130 M TRP CZ2 6 C3H1b 0.770 1.760 3.413 24.310 21.012 1.157 possible 3275 130 M TRP CZ3 6 C3H1b 0.770 1.760 26.637 -1.000 21.516 -1.000 bad 3276 130 M TRP CH2 6 C3H1b 0.770 1.760 21.391 -1.000 21.339 -1.000 bad 3277 131 M GLY N 12 N3H1s 0.700 1.640 2.898 13.764 14.854 0.927 [OK] 3278 131 M GLY CA 8 C4H2s 0.770 1.880 7.152 60.270 23.688 2.544 possible 3279 131 M GLY C 2 C3H0b 0.770 1.610 2.609 8.760 9.840 0.890 [OK] 3280 131 M GLY O 16 O1H0u 0.660 1.420 3.399 15.989 16.391 0.975 possible 3281 132 M ARG N 12 N3H1s 0.700 1.640 2.370 12.040 13.650 0.882 [OK] 3282 132 M ARG CA 3 C4H1s 0.770 1.880 2.693 14.583 13.422 1.086 [OK] 3283 132 M ARG C 1 C3H0s 0.770 1.610 2.240 8.299 8.838 0.939 [OK] 3284 132 M ARG O 16 O1H0u 0.660 1.420 2.476 15.744 16.084 0.979 [OK] 3285 132 M ARG CB 8 C4H2s 0.770 1.880 3.185 23.077 23.088 1.000 possible 3286 132 M ARG CG 8 C4H2s 0.770 1.880 2.832 23.825 23.640 1.008 [OK] 3287 132 M ARG CD 8 C4H2s 0.770 1.880 3.286 25.261 23.300 1.084 possible 3288 132 M ARG NE 13 N3H1b 0.700 1.640 2.567 15.244 15.569 0.979 [OK] 3289 132 M ARG CZ 2 C3H0b 0.770 1.610 3.259 11.890 9.747 1.220 possible 3290 132 M ARG NH1 15 N3H2u 0.700 1.640 3.242 23.271 22.782 1.021 possible 3291 132 M ARG NH2 15 N3H2u 0.700 1.640 3.368 22.923 23.810 0.963 possible 3292 133 M THR N 12 N3H1s 0.700 1.640 2.475 12.710 13.832 0.919 [OK] 3293 133 M THR CA 3 C4H1s 0.770 1.880 2.989 15.058 13.099 1.150 [OK] 3294 133 M THR C 1 C3H0s 0.770 1.610 2.383 8.571 8.738 0.981 [OK] 3295 133 M THR O 16 O1H0u 0.660 1.420 2.329 16.939 16.020 1.057 [OK] 3296 133 M THR CB 4 C4H1b 0.770 1.880 2.911 16.186 14.829 1.092 [OK] 3297 133 M THR OG1 17 O2H1u 0.660 1.460 2.547 18.628 18.123 1.028 [OK] 3298 133 M THR CG2 10 C4H3u 0.770 1.880 2.862 34.553 36.542 0.946 [OK] 3299 134 M TYR N 12 N3H1s 0.700 1.640 2.471 12.773 13.691 0.933 [OK] 3300 134 M TYR CA 3 C4H1s 0.770 1.880 2.897 14.557 13.330 1.092 [OK] 3301 134 M TYR C 1 C3H0s 0.770 1.610 2.192 8.130 8.770 0.927 [OK] 3302 134 M TYR O 16 O1H0u 0.660 1.420 2.395 15.548 16.124 0.964 [OK] 3303 134 M TYR CB 8 C4H2s 0.770 1.880 3.762 27.301 23.678 1.153 possible 3304 134 M TYR CG 2 C3H0b 0.770 1.610 3.667 12.587 9.732 1.293 possible 3305 134 M TYR CD1 5 C3H1s 0.770 1.760 3.830 24.026 20.171 1.191 possible 3306 134 M TYR CD2 5 C3H1s 0.770 1.760 6.153 33.566 20.728 1.619 possible 3307 134 M TYR CE1 5 C3H1s 0.770 1.760 5.316 31.068 20.675 1.503 possible 3308 134 M TYR CE2 5 C3H1s 0.770 1.760 9.839 -1.000 20.810 -1.000 bad 3309 134 M TYR CZ 2 C3H0b 0.770 1.610 6.708 18.353 9.926 1.849 possible 3310 134 M TYR OH 17 O2H1u 0.660 1.460 36.511 -1.000 19.173 -1.000 bad 3311 135 M LEU N 12 N3H1s 0.700 1.640 2.310 12.328 13.655 0.903 [OK] 3312 135 M LEU CA 3 C4H1s 0.770 1.880 2.679 12.726 13.122 0.970 [OK] 3313 135 M LEU C 1 C3H0s 0.770 1.610 2.143 8.283 8.825 0.939 [OK] 3314 135 M LEU O 16 O1H0u 0.660 1.420 2.233 14.152 16.208 0.873 [OK] 3315 135 M LEU CB 8 C4H2s 0.770 1.880 3.328 23.719 22.951 1.033 possible 3316 135 M LEU CG 4 C4H1b 0.770 1.880 4.472 16.761 14.764 1.135 possible 3317 135 M LEU CD1 10 C4H3u 0.770 1.880 21.982 -1.000 37.425 -1.000 bad 3318 135 M LEU CD2 10 C4H3u 0.770 1.880 23.974 -1.000 37.143 -1.000 bad 3319 136 M ARG N 12 N3H1s 0.700 1.640 2.569 13.604 13.650 0.997 [OK] 3320 136 M ARG CA 3 C4H1s 0.770 1.880 2.445 11.396 13.422 0.849 [OK] 3321 136 M ARG C 1 C3H0s 0.770 1.610 2.249 8.372 8.838 0.947 [OK] 3322 136 M ARG O 16 O1H0u 0.660 1.420 2.487 16.212 16.084 1.008 [OK] 3323 136 M ARG CB 8 C4H2s 0.770 1.880 2.977 26.184 23.088 1.134 [OK] 3324 136 M ARG CG 8 C4H2s 0.770 1.880 2.875 26.302 23.640 1.113 [OK] 3325 136 M ARG CD 8 C4H2s 0.770 1.880 2.908 25.110 23.300 1.078 [OK] 3326 136 M ARG NE 13 N3H1b 0.700 1.640 2.570 13.502 15.569 0.867 [OK] 3327 136 M ARG CZ 2 C3H0b 0.770 1.610 2.259 8.591 9.747 0.881 [OK] 3328 136 M ARG NH1 15 N3H2u 0.700 1.640 3.889 30.648 22.782 1.345 possible 3329 136 M ARG NH2 15 N3H2u 0.700 1.640 2.627 19.921 23.810 0.837 [OK] 3330 137 M ALA N 12 N3H1s 0.700 1.640 2.399 13.300 14.046 0.947 [OK] 3331 137 M ALA CA 4 C4H1b 0.770 1.880 2.944 15.240 14.063 1.084 [OK] 3332 137 M ALA C 1 C3H0s 0.770 1.610 2.465 8.860 8.900 0.995 [OK] 3333 137 M ALA O 16 O1H0u 0.660 1.420 2.585 15.009 16.188 0.927 [OK] 3334 137 M ALA CB 10 C4H3u 0.770 1.880 3.124 36.856 36.782 1.002 possible 3335 138 M GLN N 12 N3H1s 0.700 1.640 2.537 12.909 13.616 0.948 [OK] 3336 138 M GLN CA 3 C4H1s 0.770 1.880 2.974 14.414 13.334 1.081 [OK] 3337 138 M GLN C 1 C3H0s 0.770 1.610 3.013 8.216 8.787 0.935 possible 3338 138 M GLN O 16 O1H0u 0.660 1.420 3.516 19.396 15.993 1.213 possible 3339 138 M GLN CB 8 C4H2s 0.770 1.880 2.699 22.304 23.275 0.958 [OK] 3340 138 M GLN CG 8 C4H2s 0.770 1.880 4.523 36.131 23.465 1.540 possible 3341 138 M GLN CD 2 C3H0b 0.770 1.610 5.571 15.282 9.659 1.582 possible 3342 138 M GLN OE1 16 O1H0u 0.660 1.420 14.623 -1.000 17.091 -1.000 bad 3343 138 M GLN NE2 15 N3H2u 0.700 1.640 36.548 -1.000 24.150 -1.000 bad 3344 139 M ALA N 12 N3H1s 0.700 1.640 3.151 14.299 14.046 1.018 possible 3345 139 M ALA CA 4 C4H1b 0.770 1.880 4.227 20.501 14.063 1.458 possible 3346 139 M ALA C 1 C3H0s 0.770 1.610 2.476 8.770 8.900 0.985 [OK] 3347 139 M ALA O 16 O1H0u 0.660 1.420 2.487 17.076 16.188 1.055 [OK] 3348 139 M ALA CB 10 C4H3u 0.770 1.880 3.608 35.597 36.782 0.968 possible 3349 140 M LEU N 12 N3H1s 0.700 1.640 2.443 12.352 13.655 0.905 [OK] 3350 140 M LEU CA 3 C4H1s 0.770 1.880 2.639 12.145 13.122 0.926 [OK] 3351 140 M LEU C 1 C3H0s 0.770 1.610 2.480 9.341 8.825 1.059 [OK] 3352 140 M LEU O 16 O1H0u 0.660 1.420 2.454 17.859 16.208 1.102 [OK] 3353 140 M LEU CB 8 C4H2s 0.770 1.880 2.879 22.112 22.951 0.963 [OK] 3354 140 M LEU CG 4 C4H1b 0.770 1.880 2.749 14.047 14.764 0.951 [OK] 3355 140 M LEU CD1 10 C4H3u 0.770 1.880 2.978 36.205 37.425 0.967 [OK] 3356 140 M LEU CD2 10 C4H3u 0.770 1.880 2.995 39.875 37.143 1.074 [OK] 3357 141 M GLY N 12 N3H1s 0.700 1.640 2.542 13.171 14.854 0.887 [OK] 3358 141 M GLY CA 8 C4H2s 0.770 1.880 2.873 23.731 23.688 1.002 [OK] 3359 141 M GLY C 2 C3H0b 0.770 1.610 2.713 10.289 9.840 1.046 [OK] 3360 141 M GLY O 16 O1H0u 0.660 1.420 2.348 16.366 16.391 0.998 [OK] 3361 142 M MET N 12 N3H1s 0.700 1.640 2.736 12.936 13.564 0.954 [OK] 3362 142 M MET CA 3 C4H1s 0.770 1.880 2.949 13.638 13.231 1.031 [OK] 3363 142 M MET C 1 C3H0s 0.770 1.610 2.331 8.999 8.782 1.025 [OK] 3364 142 M MET O 16 O1H0u 0.660 1.420 2.478 17.340 16.277 1.065 [OK] 3365 142 M MET CB 8 C4H2s 0.770 1.880 3.127 24.695 23.645 1.044 possible 3366 142 M MET CG 9 C4H2b 0.770 1.880 2.970 23.812 24.009 0.992 [OK] 3367 142 M MET SD 19 S2H0u 1.040 1.770 3.028 30.616 30.093 1.017 possible 3368 142 M MET CE 10 C4H3u 0.770 1.880 2.902 37.102 37.161 0.998 [OK] 3369 143 M GLY N 12 N3H1s 0.700 1.640 2.408 13.759 14.854 0.926 [OK] 3370 143 M GLY CA 8 C4H2s 0.770 1.880 5.998 40.968 23.688 1.729 possible 3371 143 M GLY C 2 C3H0b 0.770 1.610 2.261 9.060 9.840 0.921 [OK] 3372 143 M GLY O 16 O1H0u 0.660 1.420 2.487 14.656 16.391 0.894 [OK] 3373 144 M LYS N 12 N3H1s 0.700 1.640 5.965 30.433 13.675 2.225 possible 3374 144 M LYS CA 3 C4H1s 0.770 1.880 2.580 12.761 13.324 0.958 [OK] 3375 144 M LYS C 1 C3H0s 0.770 1.610 3.233 11.152 8.759 1.273 possible 3376 144 M LYS O 16 O1H0u 0.660 1.420 2.809 17.058 16.049 1.063 [OK] 3377 144 M LYS CB 8 C4H2s 0.770 1.880 5.092 35.701 22.904 1.559 possible 3378 144 M LYS CG 8 C4H2s 0.770 1.880 7.692 58.386 23.131 2.524 possible 3379 144 M LYS CD 8 C4H2s 0.770 1.880 2.909 23.698 23.837 0.994 [OK] 3380 144 M LYS CE 9 C4H2b 0.770 1.880 3.526 26.386 23.934 1.102 possible 3381 144 M LYS NZ 14 N4H3u 0.700 1.640 6.416 45.218 21.213 2.132 possible 3382 145 M HIS N 12 N3H1s 0.700 1.640 3.113 13.440 13.715 0.980 possible 3383 145 M HIS CA 3 C4H1s 0.770 1.880 2.597 12.599 13.467 0.936 [OK] 3384 145 M HIS C 1 C3H0s 0.770 1.610 2.197 8.127 8.882 0.915 [OK] 3385 145 M HIS O 16 O1H0u 0.660 1.420 2.368 16.494 16.082 1.026 [OK] 3386 145 M HIS CB 8 C4H2s 0.770 1.880 2.820 22.159 23.653 0.937 [OK] 3387 145 M HIS CG 2 C3H0b 0.770 1.610 2.647 9.778 9.952 0.983 [OK] 3388 145 M HIS ND1 13 N3H1b 0.700 1.640 3.236 16.684 15.506 1.076 possible 3389 145 M HIS CD2 5 C3H1s 0.770 1.760 2.868 18.724 21.085 0.888 [OK] 3390 145 M HIS CE1 5 C3H1s 0.770 1.760 5.978 41.994 20.636 2.035 possible 3391 145 M HIS NE2 13 N3H1b 0.700 1.640 5.067 28.155 15.337 1.836 possible 3392 146 M THR N 12 N3H1s 0.700 1.640 2.673 12.774 13.832 0.924 [OK] 3393 146 M THR CA 3 C4H1s 0.770 1.880 3.130 13.708 13.099 1.047 possible 3394 146 M THR C 1 C3H0s 0.770 1.610 2.456 8.211 8.738 0.940 [OK] 3395 146 M THR O 16 O1H0u 0.660 1.420 2.528 15.796 16.020 0.986 [OK] 3396 146 M THR CB 4 C4H1b 0.770 1.880 2.785 13.974 14.829 0.942 [OK] 3397 146 M THR OG1 17 O2H1u 0.660 1.460 2.480 17.332 18.123 0.956 [OK] 3398 146 M THR CG2 10 C4H3u 0.770 1.880 3.125 38.647 36.542 1.058 possible 3399 147 M ALA N 12 N3H1s 0.700 1.640 2.427 13.416 14.046 0.955 [OK] 3400 147 M ALA CA 4 C4H1b 0.770 1.880 2.787 14.161 14.063 1.007 [OK] 3401 147 M ALA C 1 C3H0s 0.770 1.610 2.358 8.256 8.900 0.928 [OK] 3402 147 M ALA O 16 O1H0u 0.660 1.420 2.352 14.810 16.188 0.915 [OK] 3403 147 M ALA CB 10 C4H3u 0.770 1.880 2.922 36.576 36.782 0.994 [OK] 3404 148 M TRP N 12 N3H1s 0.700 1.640 2.264 12.562 13.791 0.911 [OK] 3405 148 M TRP CA 3 C4H1s 0.770 1.880 3.227 14.072 13.377 1.052 possible 3406 148 M TRP C 1 C3H0s 0.770 1.610 2.181 8.148 8.724 0.934 [OK] 3407 148 M TRP O 16 O1H0u 0.660 1.420 2.704 15.745 15.951 0.987 [OK] 3408 148 M TRP CB 8 C4H2s 0.770 1.880 3.187 22.767 24.004 0.948 possible 3409 148 M TRP CG 2 C3H0b 0.770 1.610 3.704 13.100 9.965 1.315 possible 3410 148 M TRP CD1 5 C3H1s 0.770 1.760 5.218 30.378 20.874 1.455 possible 3411 148 M TRP CD2 2 C3H0b 0.770 1.610 3.550 12.440 10.097 1.232 possible 3412 148 M TRP NE1 13 N3H1b 0.700 1.640 22.290 -1.000 16.969 -1.000 bad 3413 148 M TRP CE2 2 C3H0b 0.770 1.610 5.218 15.391 9.889 1.556 possible 3414 148 M TRP CE3 6 C3H1b 0.770 1.760 3.107 20.556 20.448 1.005 possible 3415 148 M TRP CZ2 6 C3H1b 0.770 1.760 31.621 -1.000 21.012 -1.000 bad 3416 148 M TRP CZ3 6 C3H1b 0.770 1.760 4.041 26.300 21.516 1.222 possible 3417 148 M TRP CH2 6 C3H1b 0.770 1.760 22.874 -1.000 21.339 -1.000 bad 3418 149 M ALA N 12 N3H1s 0.700 1.640 2.580 13.909 14.046 0.990 [OK] 3419 149 M ALA CA 4 C4H1b 0.770 1.880 2.889 14.335 14.063 1.019 [OK] 3420 149 M ALA C 1 C3H0s 0.770 1.610 2.245 7.969 8.900 0.895 [OK] 3421 149 M ALA O 16 O1H0u 0.660 1.420 2.478 18.680 16.188 1.154 [OK] 3422 149 M ALA CB 10 C4H3u 0.770 1.880 3.057 36.797 36.782 1.000 possible 3423 150 M PHE N 12 N3H1s 0.700 1.640 2.311 11.986 13.691 0.875 [OK] 3424 150 M PHE CA 3 C4H1s 0.770 1.880 2.720 12.883 13.449 0.958 [OK] 3425 150 M PHE C 1 C3H0s 0.770 1.610 2.329 8.412 8.753 0.961 [OK] 3426 150 M PHE O 16 O1H0u 0.660 1.420 2.329 13.352 16.151 0.827 [OK] 3427 150 M PHE CB 8 C4H2s 0.770 1.880 2.909 22.835 23.777 0.960 [OK] 3428 150 M PHE CG 2 C3H0b 0.770 1.610 2.354 9.261 9.721 0.953 [OK] 3429 150 M PHE CD1 5 C3H1s 0.770 1.760 2.686 16.799 20.405 0.823 [OK] 3430 150 M PHE CD2 6 C3H1b 0.770 1.760 2.621 18.529 21.051 0.880 [OK] 3431 150 M PHE CE1 6 C3H1b 0.770 1.760 3.080 21.452 21.580 0.994 possible 3432 150 M PHE CE2 6 C3H1b 0.770 1.760 2.637 18.749 21.680 0.865 [OK] 3433 150 M PHE CZ 6 C3H1b 0.770 1.760 2.933 21.353 21.666 0.986 [OK] 3434 151 M LEU N 12 N3H1s 0.700 1.640 2.352 13.340 13.655 0.977 [OK] 3435 151 M LEU CA 3 C4H1s 0.770 1.880 2.618 12.617 13.122 0.962 [OK] 3436 151 M LEU C 1 C3H0s 0.770 1.610 2.204 8.139 8.825 0.922 [OK] 3437 151 M LEU O 16 O1H0u 0.660 1.420 3.268 17.541 16.208 1.082 possible 3438 151 M LEU CB 8 C4H2s 0.770 1.880 2.904 20.899 22.951 0.911 [OK] 3439 151 M LEU CG 4 C4H1b 0.770 1.880 2.793 14.598 14.764 0.989 [OK] 3440 151 M LEU CD1 10 C4H3u 0.770 1.880 29.766 -1.000 37.425 -1.000 bad 3441 151 M LEU CD2 10 C4H3u 0.770 1.880 7.507 75.002 37.143 2.019 possible 3442 152 M SER N 12 N3H1s 0.700 1.640 2.407 13.463 14.103 0.955 [OK] 3443 152 M SER CA 3 C4H1s 0.770 1.880 2.978 14.130 13.476 1.049 [OK] 3444 152 M SER C 1 C3H0s 0.770 1.610 2.148 8.147 8.923 0.913 [OK] 3445 152 M SER O 16 O1H0u 0.660 1.420 2.549 16.514 16.179 1.021 [OK] 3446 152 M SER CB 8 C4H2s 0.770 1.880 2.890 24.046 23.884 1.007 [OK] 3447 152 M SER OG 17 O2H1u 0.660 1.460 2.569 18.572 18.732 0.991 [OK] 3448 153 M ALA N 12 N3H1s 0.700 1.640 2.634 14.477 14.046 1.031 [OK] 3449 153 M ALA CA 4 C4H1b 0.770 1.880 2.762 14.140 14.063 1.005 [OK] 3450 153 M ALA C 1 C3H0s 0.770 1.610 2.395 8.390 8.900 0.943 [OK] 3451 153 M ALA O 16 O1H0u 0.660 1.420 2.248 16.023 16.188 0.990 [OK] 3452 153 M ALA CB 10 C4H3u 0.770 1.880 3.251 36.500 36.782 0.992 possible 3453 154 M ILE N 12 N3H1s 0.700 1.640 2.657 12.877 13.633 0.945 [OK] 3454 154 M ILE CA 3 C4H1s 0.770 1.880 2.637 13.448 13.007 1.034 [OK] 3455 154 M ILE C 1 C3H0s 0.770 1.610 2.828 8.186 8.470 0.967 [OK] 3456 154 M ILE O 16 O1H0u 0.660 1.420 2.666 13.391 16.144 0.829 [OK] 3457 154 M ILE CB 4 C4H1b 0.770 1.880 2.901 13.776 14.227 0.968 [OK] 3458 154 M ILE CG1 9 C4H2b 0.770 1.880 2.847 20.886 24.187 0.864 [OK] 3459 154 M ILE CG2 10 C4H3u 0.770 1.880 3.953 35.026 35.961 0.974 possible 3460 154 M ILE CD1 10 C4H3u 0.770 1.880 3.034 36.025 38.377 0.939 possible 3461 155 M TRP N 12 N3H1s 0.700 1.640 3.636 15.028 13.791 1.090 possible 3462 155 M TRP CA 3 C4H1s 0.770 1.880 4.341 19.630 13.377 1.467 possible 3463 155 M TRP C 1 C3H0s 0.770 1.610 2.446 8.163 8.724 0.936 [OK] 3464 155 M TRP O 16 O1H0u 0.660 1.420 2.424 15.174 15.951 0.951 [OK] 3465 155 M TRP CB 8 C4H2s 0.770 1.880 3.372 22.137 24.004 0.922 possible 3466 155 M TRP CG 2 C3H0b 0.770 1.610 2.550 9.468 9.965 0.950 [OK] 3467 155 M TRP CD1 5 C3H1s 0.770 1.760 2.854 20.792 20.874 0.996 [OK] 3468 155 M TRP CD2 2 C3H0b 0.770 1.610 2.448 9.548 10.097 0.946 [OK] 3469 155 M TRP NE1 13 N3H1b 0.700 1.640 3.215 16.637 16.969 0.980 possible 3470 155 M TRP CE2 2 C3H0b 0.770 1.610 3.283 11.135 9.889 1.126 possible 3471 155 M TRP CE3 6 C3H1b 0.770 1.760 5.854 36.739 20.448 1.797 possible 3472 155 M TRP CZ2 6 C3H1b 0.770 1.760 5.190 31.975 21.012 1.522 possible 3473 155 M TRP CZ3 6 C3H1b 0.770 1.760 14.773 -1.000 21.516 -1.000 bad 3474 155 M TRP CH2 6 C3H1b 0.770 1.760 13.314 -1.000 21.339 -1.000 bad 3475 156 M LEU N 12 N3H1s 0.700 1.640 2.564 15.497 13.655 1.135 [OK] 3476 156 M LEU CA 3 C4H1s 0.770 1.880 2.719 13.661 13.122 1.041 [OK] 3477 156 M LEU C 1 C3H0s 0.770 1.610 2.714 8.372 8.825 0.949 [OK] 3478 156 M LEU O 16 O1H0u 0.660 1.420 2.503 14.703 16.208 0.907 [OK] 3479 156 M LEU CB 8 C4H2s 0.770 1.880 2.991 22.375 22.951 0.975 [OK] 3480 156 M LEU CG 4 C4H1b 0.770 1.880 2.936 15.729 14.764 1.065 [OK] 3481 156 M LEU CD1 10 C4H3u 0.770 1.880 3.124 35.831 37.425 0.957 possible 3482 156 M LEU CD2 10 C4H3u 0.770 1.880 3.006 35.923 37.143 0.967 possible 3483 157 M TRP N 12 N3H1s 0.700 1.640 2.760 14.539 13.791 1.054 [OK] 3484 157 M TRP CA 3 C4H1s 0.770 1.880 2.780 14.800 13.377 1.106 [OK] 3485 157 M TRP C 1 C3H0s 0.770 1.610 2.430 8.144 8.724 0.933 [OK] 3486 157 M TRP O 16 O1H0u 0.660 1.420 2.641 18.265 15.951 1.145 [OK] 3487 157 M TRP CB 8 C4H2s 0.770 1.880 2.655 21.683 24.004 0.903 [OK] 3488 157 M TRP CG 2 C3H0b 0.770 1.610 2.690 9.108 9.965 0.914 [OK] 3489 157 M TRP CD1 5 C3H1s 0.770 1.760 2.914 19.843 20.874 0.951 [OK] 3490 157 M TRP CD2 2 C3H0b 0.770 1.610 2.645 10.572 10.097 1.047 [OK] 3491 157 M TRP NE1 13 N3H1b 0.700 1.640 2.966 18.378 16.969 1.083 [OK] 3492 157 M TRP CE2 2 C3H0b 0.770 1.610 2.672 10.929 9.889 1.105 [OK] 3493 157 M TRP CE3 6 C3H1b 0.770 1.760 2.701 18.911 20.448 0.925 [OK] 3494 157 M TRP CZ2 6 C3H1b 0.770 1.760 2.772 19.320 21.012 0.919 [OK] 3495 157 M TRP CZ3 6 C3H1b 0.770 1.760 2.814 19.092 21.516 0.887 [OK] 3496 157 M TRP CH2 6 C3H1b 0.770 1.760 2.652 20.203 21.339 0.947 [OK] 3497 158 M MET N 12 N3H1s 0.700 1.640 2.469 12.177 13.564 0.898 [OK] 3498 158 M MET CA 3 C4H1s 0.770 1.880 2.835 13.922 13.231 1.052 [OK] 3499 158 M MET C 1 C3H0s 0.770 1.610 2.108 8.173 8.782 0.931 [OK] 3500 158 M MET O 16 O1H0u 0.660 1.420 2.349 14.355 16.277 0.882 [OK] 3501 158 M MET CB 8 C4H2s 0.770 1.880 3.774 24.869 23.645 1.052 possible 3502 158 M MET CG 9 C4H2b 0.770 1.880 4.614 28.892 24.009 1.203 possible 3503 158 M MET SD 19 S2H0u 1.040 1.770 2.806 27.760 30.093 0.922 [OK] 3504 158 M MET CE 10 C4H3u 0.770 1.880 28.212 -1.000 37.161 -1.000 bad 3505 159 M VAL N 12 N3H1s 0.700 1.640 2.560 12.937 13.676 0.946 [OK] 3506 159 M VAL CA 3 C4H1s 0.770 1.880 2.779 12.871 13.123 0.981 [OK] 3507 159 M VAL C 1 C3H0s 0.770 1.610 2.512 7.936 8.563 0.927 [OK] 3508 159 M VAL O 16 O1H0u 0.660 1.420 2.509 15.729 16.181 0.972 [OK] 3509 159 M VAL CB 4 C4H1b 0.770 1.880 2.872 14.937 14.598 1.023 [OK] 3510 159 M VAL CG1 10 C4H3u 0.770 1.880 2.963 33.197 36.584 0.907 [OK] 3511 159 M VAL CG2 10 C4H3u 0.770 1.880 2.993 34.721 36.332 0.956 [OK] 3512 160 M LEU N 12 N3H1s 0.700 1.640 2.703 13.963 13.655 1.023 [OK] 3513 160 M LEU CA 3 C4H1s 0.770 1.880 3.079 15.872 13.122 1.210 possible 3514 160 M LEU C 1 C3H0s 0.770 1.610 2.447 8.779 8.825 0.995 [OK] 3515 160 M LEU O 16 O1H0u 0.660 1.420 2.483 18.326 16.208 1.131 [OK] 3516 160 M LEU CB 8 C4H2s 0.770 1.880 2.722 20.587 22.951 0.897 [OK] 3517 160 M LEU CG 4 C4H1b 0.770 1.880 2.963 14.964 14.764 1.014 [OK] 3518 160 M LEU CD1 10 C4H3u 0.770 1.880 3.047 37.797 37.425 1.010 possible 3519 160 M LEU CD2 10 C4H3u 0.770 1.880 3.238 37.094 37.143 0.999 possible 3520 161 M GLY N 12 N3H1s 0.700 1.640 2.541 14.555 14.854 0.980 [OK] 3521 161 M GLY CA 8 C4H2s 0.770 1.880 3.207 24.145 23.688 1.019 possible 3522 161 M GLY C 2 C3H0b 0.770 1.610 2.283 9.283 9.840 0.943 [OK] 3523 161 M GLY O 16 O1H0u 0.660 1.420 2.845 20.311 16.391 1.239 [OK] 3524 162 M PHE N 12 N3H1s 0.700 1.640 2.501 13.349 13.691 0.975 [OK] 3525 162 M PHE CA 3 C4H1s 0.770 1.880 2.978 14.681 13.449 1.092 [OK] 3526 162 M PHE C 1 C3H0s 0.770 1.610 2.905 9.262 8.753 1.058 [OK] 3527 162 M PHE O 16 O1H0u 0.660 1.420 2.422 15.103 16.151 0.935 [OK] 3528 162 M PHE CB 8 C4H2s 0.770 1.880 4.213 32.978 23.777 1.387 possible 3529 162 M PHE CG 2 C3H0b 0.770 1.610 2.997 10.690 9.721 1.100 [OK] 3530 162 M PHE CD1 5 C3H1s 0.770 1.760 5.600 43.236 20.405 2.119 possible 3531 162 M PHE CD2 6 C3H1b 0.770 1.760 2.876 21.528 21.051 1.023 [OK] 3532 162 M PHE CE1 6 C3H1b 0.770 1.760 5.383 43.320 21.580 2.007 possible 3533 162 M PHE CE2 6 C3H1b 0.770 1.760 3.038 21.780 21.680 1.005 possible 3534 162 M PHE CZ 6 C3H1b 0.770 1.760 2.771 21.287 21.666 0.982 [OK] 3535 163 M ILE N 12 N3H1s 0.700 1.640 3.189 13.846 13.633 1.016 possible 3536 163 M ILE CA 3 C4H1s 0.770 1.880 4.163 17.595 13.007 1.353 possible 3537 163 M ILE C 1 C3H0s 0.770 1.610 2.333 8.022 8.470 0.947 [OK] 3538 163 M ILE O 16 O1H0u 0.660 1.420 3.130 16.417 16.144 1.017 possible 3539 163 M ILE CB 4 C4H1b 0.770 1.880 2.754 13.486 14.227 0.948 [OK] 3540 163 M ILE CG1 9 C4H2b 0.770 1.880 10.395 -1.000 24.187 -1.000 bad 3541 163 M ILE CG2 10 C4H3u 0.770 1.880 18.985 -1.000 35.961 -1.000 bad 3542 163 M ILE CD1 10 C4H3u 0.770 1.880 18.737 -1.000 38.377 -1.000 bad 3543 164 M ARG N 12 N3H1s 0.700 1.640 2.547 13.534 13.650 0.991 [OK] 3544 164 M ARG CA 3 C4H1s 0.770 1.880 2.891 14.544 13.422 1.084 [OK] 3545 164 M ARG C 1 C3H0s 0.770 1.610 2.570 8.490 8.838 0.961 [OK] 3546 164 M ARG O 16 O1H0u 0.660 1.420 2.413 14.203 16.084 0.883 [OK] 3547 164 M ARG CB 8 C4H2s 0.770 1.880 2.930 22.334 23.088 0.967 [OK] 3548 164 M ARG CG 8 C4H2s 0.770 1.880 2.897 25.867 23.640 1.094 [OK] 3549 164 M ARG CD 8 C4H2s 0.770 1.880 3.081 23.572 23.300 1.012 possible 3550 164 M ARG NE 13 N3H1b 0.700 1.640 2.639 15.343 15.569 0.985 [OK] 3551 164 M ARG CZ 2 C3H0b 0.770 1.610 2.437 9.253 9.747 0.949 [OK] 3552 164 M ARG NH1 15 N3H2u 0.700 1.640 3.528 25.737 22.782 1.130 possible 3553 164 M ARG NH2 15 N3H2u 0.700 1.640 3.814 29.467 23.810 1.238 possible 3554 165 M PRO N 11 N3H0u 0.700 1.640 2.604 8.930 8.823 1.012 [OK] 3555 165 M PRO CA 4 C4H1b 0.770 1.880 2.807 13.329 13.955 0.955 [OK] 3556 165 M PRO C 1 C3H0s 0.770 1.610 2.470 8.598 8.812 0.976 [OK] 3557 165 M PRO O 16 O1H0u 0.660 1.420 2.310 14.496 16.169 0.897 [OK] 3558 165 M PRO CB 9 C4H2b 0.770 1.880 2.876 26.853 25.563 1.050 [OK] 3559 165 M PRO CG 9 C4H2b 0.770 1.880 2.783 22.511 25.832 0.871 [OK] 3560 165 M PRO CD 8 C4H2s 0.770 1.880 2.527 20.698 23.836 0.868 [OK] 3561 166 M ILE N 12 N3H1s 0.700 1.640 2.628 13.426 13.633 0.985 [OK] 3562 166 M ILE CA 3 C4H1s 0.770 1.880 2.515 12.009 13.007 0.923 [OK] 3563 166 M ILE C 1 C3H0s 0.770 1.610 2.598 7.592 8.470 0.896 [OK] 3564 166 M ILE O 16 O1H0u 0.660 1.420 7.566 -1.000 16.144 -1.000 bad 3565 166 M ILE CB 4 C4H1b 0.770 1.880 3.229 14.126 14.227 0.993 possible 3566 166 M ILE CG1 9 C4H2b 0.770 1.880 4.346 27.369 24.187 1.132 possible 3567 166 M ILE CG2 10 C4H3u 0.770 1.880 38.132 -1.000 35.961 -1.000 bad 3568 166 M ILE CD1 10 C4H3u 0.770 1.880 39.065 -1.000 38.377 -1.000 bad 3569 167 M LEU N 12 N3H1s 0.700 1.640 2.654 13.265 13.655 0.971 [OK] 3570 167 M LEU CA 3 C4H1s 0.770 1.880 4.500 16.632 13.122 1.267 possible 3571 167 M LEU C 1 C3H0s 0.770 1.610 2.652 8.646 8.825 0.980 [OK] 3572 167 M LEU O 16 O1H0u 0.660 1.420 29.776 -1.000 16.208 -1.000 bad 3573 167 M LEU CB 8 C4H2s 0.770 1.880 4.326 25.535 22.951 1.113 possible 3574 167 M LEU CG 4 C4H1b 0.770 1.880 3.764 16.806 14.764 1.138 possible 3575 167 M LEU CD1 10 C4H3u 0.770 1.880 18.791 -1.000 37.425 -1.000 bad 3576 167 M LEU CD2 10 C4H3u 0.770 1.880 55.813 -1.000 37.143 -1.000 bad 3577 168 M MET N 12 N3H1s 0.700 1.640 2.593 11.784 13.564 0.869 [OK] 3578 168 M MET CA 3 C4H1s 0.770 1.880 3.829 14.559 13.231 1.100 possible 3579 168 M MET C 1 C3H0s 0.770 1.610 3.966 11.116 8.782 1.266 possible 3580 168 M MET O 16 O1H0u 0.660 1.420 20.145 -1.000 16.277 -1.000 bad 3581 168 M MET CB 8 C4H2s 0.770 1.880 3.464 23.324 23.645 0.986 possible 3582 168 M MET CG 9 C4H2b 0.770 1.880 3.084 23.064 24.009 0.961 possible 3583 168 M MET SD 19 S2H0u 1.040 1.770 3.554 33.719 30.093 1.121 possible 3584 168 M MET CE 10 C4H3u 0.770 1.880 40.327 -1.000 37.161 -1.000 bad 3585 169 M GLY N 12 N3H1s 0.700 1.640 3.878 15.026 14.854 1.012 possible 3586 169 M GLY CA 8 C4H2s 0.770 1.880 25.847 -1.000 23.688 -1.000 bad 3587 169 M GLY C 2 C3H0b 0.770 1.610 3.139 9.958 9.840 1.012 possible 3588 169 M GLY O 16 O1H0u 0.660 1.420 9.753 -1.000 16.391 -1.000 bad 3589 170 M SER N 12 N3H1s 0.700 1.640 2.558 14.110 14.103 1.001 [OK] 3590 170 M SER CA 3 C4H1s 0.770 1.880 2.414 11.895 13.476 0.883 [OK] 3591 170 M SER C 1 C3H0s 0.770 1.610 2.448 8.558 8.923 0.959 [OK] 3592 170 M SER O 16 O1H0u 0.660 1.420 2.363 16.148 16.179 0.998 [OK] 3593 170 M SER CB 8 C4H2s 0.770 1.880 5.788 50.675 23.884 2.122 possible 3594 170 M SER OG 17 O2H1u 0.660 1.460 3.486 20.445 18.732 1.091 possible 3595 171 M TRP N 12 N3H1s 0.700 1.640 2.526 12.765 13.791 0.926 [OK] 3596 171 M TRP CA 3 C4H1s 0.770 1.880 2.788 13.502 13.377 1.009 [OK] 3597 171 M TRP C 1 C3H0s 0.770 1.610 2.437 8.653 8.724 0.992 [OK] 3598 171 M TRP O 16 O1H0u 0.660 1.420 2.409 16.274 15.951 1.020 [OK] 3599 171 M TRP CB 8 C4H2s 0.770 1.880 2.746 22.729 24.004 0.947 [OK] 3600 171 M TRP CG 2 C3H0b 0.770 1.610 2.496 9.820 9.965 0.985 [OK] 3601 171 M TRP CD1 5 C3H1s 0.770 1.760 2.933 22.266 20.874 1.067 [OK] 3602 171 M TRP CD2 2 C3H0b 0.770 1.610 2.580 9.978 10.097 0.988 [OK] 3603 171 M TRP NE1 13 N3H1b 0.700 1.640 2.554 16.197 16.969 0.955 [OK] 3604 171 M TRP CE2 2 C3H0b 0.770 1.610 2.583 9.343 9.889 0.945 [OK] 3605 171 M TRP CE3 6 C3H1b 0.770 1.760 2.923 23.085 20.448 1.129 [OK] 3606 171 M TRP CZ2 6 C3H1b 0.770 1.760 4.607 32.034 21.012 1.525 possible 3607 171 M TRP CZ3 6 C3H1b 0.770 1.760 3.475 29.295 21.516 1.362 possible 3608 171 M TRP CH2 6 C3H1b 0.770 1.760 5.315 44.482 21.339 2.085 possible 3609 172 M SER N 12 N3H1s 0.700 1.640 2.385 12.988 14.103 0.921 [OK] 3610 172 M SER CA 3 C4H1s 0.770 1.880 3.800 15.140 13.476 1.123 possible 3611 172 M SER C 1 C3H0s 0.770 1.610 2.440 8.777 8.923 0.984 [OK] 3612 172 M SER O 16 O1H0u 0.660 1.420 4.275 33.852 16.179 2.092 possible 3613 172 M SER CB 8 C4H2s 0.770 1.880 5.424 36.205 23.884 1.516 possible 3614 172 M SER OG 17 O2H1u 0.660 1.460 3.794 20.304 18.732 1.084 possible 3615 173 M GLU N 12 N3H1s 0.700 1.640 2.448 13.631 13.615 1.001 [OK] 3616 173 M GLU CA 3 C4H1s 0.770 1.880 4.114 16.665 13.399 1.244 possible 3617 173 M GLU C 1 C3H0s 0.770 1.610 2.647 9.144 8.675 1.054 [OK] 3618 173 M GLU O 16 O1H0u 0.660 1.420 3.590 21.043 16.023 1.313 possible 3619 173 M GLU CB 8 C4H2s 0.770 1.880 2.849 21.906 23.529 0.931 [OK] 3620 173 M GLU CG 8 C4H2s 0.770 1.880 3.851 27.090 23.513 1.152 possible 3621 173 M GLU CD 2 C3H0b 0.770 1.610 3.925 12.207 9.460 1.290 possible 3622 173 M GLU OE1 16 O1H0u 0.660 1.420 4.090 34.028 15.999 2.127 possible 3623 173 M GLU OE2 16 O1H0u 0.660 1.420 7.380 70.584 17.432 4.049 possible 3624 174 M ALA N 12 N3H1s 0.700 1.640 2.525 13.677 14.046 0.974 [OK] 3625 174 M ALA CA 4 C4H1b 0.770 1.880 2.856 13.554 14.063 0.964 [OK] 3626 174 M ALA C 1 C3H0s 0.770 1.610 2.615 9.907 8.900 1.113 [OK] 3627 174 M ALA O 16 O1H0u 0.660 1.420 2.405 15.869 16.188 0.980 [OK] 3628 174 M ALA CB 10 C4H3u 0.770 1.880 2.852 33.117 36.782 0.900 [OK] 3629 175 M VAL N 12 N3H1s 0.700 1.640 2.580 13.085 13.676 0.957 [OK] 3630 175 M VAL CA 3 C4H1s 0.770 1.880 2.446 11.931 13.123 0.909 [OK] 3631 175 M VAL C 1 C3H0s 0.770 1.610 2.509 9.133 8.563 1.067 [OK] 3632 175 M VAL O 16 O1H0u 0.660 1.420 2.471 18.130 16.181 1.120 [OK] 3633 175 M VAL CB 4 C4H1b 0.770 1.880 2.780 13.438 14.598 0.921 [OK] 3634 175 M VAL CG1 10 C4H3u 0.770 1.880 2.992 35.104 36.584 0.960 [OK] 3635 175 M VAL CG2 10 C4H3u 0.770 1.880 2.854 33.923 36.332 0.934 [OK] 3636 176 M PRO N 11 N3H0u 0.700 1.640 2.444 8.446 8.823 0.957 [OK] 3637 176 M PRO CA 4 C4H1b 0.770 1.880 2.582 13.507 13.955 0.968 [OK] 3638 176 M PRO C 1 C3H0s 0.770 1.610 2.632 9.877 8.812 1.121 [OK] 3639 176 M PRO O 16 O1H0u 0.660 1.420 2.576 18.993 16.169 1.175 [OK] 3640 176 M PRO CB 9 C4H2b 0.770 1.880 2.776 23.101 25.563 0.904 [OK] 3641 176 M PRO CG 9 C4H2b 0.770 1.880 4.335 31.965 25.832 1.237 possible 3642 176 M PRO CD 8 C4H2s 0.770 1.880 3.465 24.070 23.836 1.010 possible 3643 177 M TYR N 12 N3H1s 0.700 1.640 2.573 14.585 13.691 1.065 [OK] 3644 177 M TYR CA 3 C4H1s 0.770 1.880 2.588 13.332 13.330 1.000 [OK] 3645 177 M TYR C 1 C3H0s 0.770 1.610 2.620 9.595 8.770 1.094 [OK] 3646 177 M TYR O 16 O1H0u 0.660 1.420 2.443 16.753 16.124 1.039 [OK] 3647 177 M TYR CB 8 C4H2s 0.770 1.880 2.866 23.122 23.678 0.977 [OK] 3648 177 M TYR CG 2 C3H0b 0.770 1.610 2.767 9.305 9.732 0.956 [OK] 3649 177 M TYR CD1 5 C3H1s 0.770 1.760 3.003 21.571 20.171 1.069 possible 3650 177 M TYR CD2 5 C3H1s 0.770 1.760 2.868 20.131 20.728 0.971 [OK] 3651 177 M TYR CE1 5 C3H1s 0.770 1.760 2.946 20.170 20.675 0.976 [OK] 3652 177 M TYR CE2 5 C3H1s 0.770 1.760 2.854 19.926 20.810 0.958 [OK] 3653 177 M TYR CZ 2 C3H0b 0.770 1.610 2.746 11.659 9.926 1.175 [OK] 3654 177 M TYR OH 17 O2H1u 0.660 1.460 2.484 19.360 19.173 1.010 [OK] 3655 178 M GLY N 12 N3H1s 0.700 1.640 2.692 16.368 14.854 1.102 [OK] 3656 178 M GLY CA 8 C4H2s 0.770 1.880 2.855 23.413 23.688 0.988 [OK] 3657 178 M GLY C 2 C3H0b 0.770 1.610 2.491 10.117 9.840 1.028 [OK] 3658 178 M GLY O 16 O1H0u 0.660 1.420 2.503 15.775 16.391 0.962 [OK] 3659 179 M ILE N 12 N3H1s 0.700 1.640 2.632 13.659 13.633 1.002 [OK] 3660 179 M ILE CA 3 C4H1s 0.770 1.880 3.033 13.828 13.007 1.063 possible 3661 179 M ILE C 1 C3H0s 0.770 1.610 2.515 8.423 8.470 0.994 [OK] 3662 179 M ILE O 16 O1H0u 0.660 1.420 2.433 15.453 16.144 0.957 [OK] 3663 179 M ILE CB 4 C4H1b 0.770 1.880 2.591 13.116 14.227 0.922 [OK] 3664 179 M ILE CG1 9 C4H2b 0.770 1.880 3.973 32.734 24.187 1.353 possible 3665 179 M ILE CG2 10 C4H3u 0.770 1.880 4.653 44.089 35.961 1.226 possible 3666 179 M ILE CD1 10 C4H3u 0.770 1.880 6.984 74.040 38.377 1.929 possible 3667 180 M PHE N 12 N3H1s 0.700 1.640 2.376 12.718 13.691 0.929 [OK] 3668 180 M PHE CA 3 C4H1s 0.770 1.880 2.856 12.599 13.449 0.937 [OK] 3669 180 M PHE C 1 C3H0s 0.770 1.610 2.437 8.697 8.753 0.994 [OK] 3670 180 M PHE O 16 O1H0u 0.660 1.420 2.488 15.115 16.151 0.936 [OK] 3671 180 M PHE CB 8 C4H2s 0.770 1.880 2.700 20.836 23.777 0.876 [OK] 3672 180 M PHE CG 2 C3H0b 0.770 1.610 2.383 9.431 9.721 0.970 [OK] 3673 180 M PHE CD1 5 C3H1s 0.770 1.760 2.763 19.395 20.405 0.950 [OK] 3674 180 M PHE CD2 6 C3H1b 0.770 1.760 2.969 21.886 21.051 1.040 [OK] 3675 180 M PHE CE1 6 C3H1b 0.770 1.760 3.344 24.355 21.580 1.129 possible 3676 180 M PHE CE2 6 C3H1b 0.770 1.760 3.244 23.253 21.680 1.073 possible 3677 180 M PHE CZ 6 C3H1b 0.770 1.760 3.286 20.123 21.666 0.929 possible 3678 181 M SER N 12 N3H1s 0.700 1.640 2.358 13.031 14.103 0.924 [OK] 3679 181 M SER CA 3 C4H1s 0.770 1.880 3.224 14.693 13.476 1.090 possible 3680 181 M SER C 1 C3H0s 0.770 1.610 2.147 7.973 8.923 0.894 [OK] 3681 181 M SER O 16 O1H0u 0.660 1.420 4.354 19.328 16.179 1.195 possible 3682 181 M SER CB 8 C4H2s 0.770 1.880 4.725 40.314 23.884 1.688 possible 3683 181 M SER OG 17 O2H1u 0.660 1.460 2.581 17.610 18.732 0.940 [OK] 3684 182 M HIS N 12 N3H1s 0.700 1.640 2.739 14.436 13.715 1.053 [OK] 3685 182 M HIS CA 3 C4H1s 0.770 1.880 2.615 14.348 13.467 1.065 [OK] 3686 182 M HIS C 1 C3H0s 0.770 1.610 2.731 8.559 8.882 0.964 [OK] 3687 182 M HIS O 16 O1H0u 0.660 1.420 2.583 17.333 16.082 1.078 [OK] 3688 182 M HIS CB 8 C4H2s 0.770 1.880 2.835 23.496 23.653 0.993 [OK] 3689 182 M HIS CG 2 C3H0b 0.770 1.610 2.619 9.703 9.952 0.975 [OK] 3690 182 M HIS ND1 13 N3H1b 0.700 1.640 2.719 15.727 15.506 1.014 [OK] 3691 182 M HIS CD2 5 C3H1s 0.770 1.760 2.901 21.096 21.085 1.001 [OK] 3692 182 M HIS CE1 5 C3H1s 0.770 1.760 2.967 24.176 20.636 1.172 [OK] 3693 182 M HIS NE2 13 N3H1b 0.700 1.640 2.750 11.627 15.337 0.758 [OK] 3694 183 M LEU N 12 N3H1s 0.700 1.640 2.778 12.883 13.655 0.943 [OK] 3695 183 M LEU CA 3 C4H1s 0.770 1.880 3.060 14.999 13.122 1.143 possible 3696 183 M LEU C 1 C3H0s 0.770 1.610 2.652 8.815 8.825 0.999 [OK] 3697 183 M LEU O 16 O1H0u 0.660 1.420 2.267 15.056 16.208 0.929 [OK] 3698 183 M LEU CB 8 C4H2s 0.770 1.880 2.946 22.808 22.951 0.994 [OK] 3699 183 M LEU CG 4 C4H1b 0.770 1.880 2.702 13.838 14.764 0.937 [OK] 3700 183 M LEU CD1 10 C4H3u 0.770 1.880 3.040 38.877 37.425 1.039 possible 3701 183 M LEU CD2 10 C4H3u 0.770 1.880 3.051 34.957 37.143 0.941 possible 3702 184 M ASP N 12 N3H1s 0.700 1.640 2.723 13.112 13.895 0.944 [OK] 3703 184 M ASP CA 3 C4H1s 0.770 1.880 2.629 13.796 13.377 1.031 [OK] 3704 184 M ASP C 1 C3H0s 0.770 1.610 3.908 9.263 8.816 1.051 possible 3705 184 M ASP O 16 O1H0u 0.660 1.420 3.521 15.658 16.091 0.973 possible 3706 184 M ASP CB 8 C4H2s 0.770 1.880 7.696 63.238 23.481 2.693 possible 3707 184 M ASP CG 2 C3H0b 0.770 1.610 4.563 12.809 9.422 1.359 possible 3708 184 M ASP OD1 16 O1H0u 0.660 1.420 3.269 18.198 15.505 1.174 possible 3709 184 M ASP OD2 16 O1H0u 0.660 1.420 12.810 -1.000 16.324 -1.000 bad 3710 185 M TRP N 12 N3H1s 0.700 1.640 5.115 17.103 13.791 1.240 possible 3711 185 M TRP CA 3 C4H1s 0.770 1.880 5.981 22.889 13.377 1.711 possible 3712 185 M TRP C 1 C3H0s 0.770 1.610 2.020 7.686 8.724 0.881 [OK] 3713 185 M TRP O 16 O1H0u 0.660 1.420 2.174 13.224 15.951 0.829 [OK] 3714 185 M TRP CB 8 C4H2s 0.770 1.880 5.125 26.842 24.004 1.118 possible 3715 185 M TRP CG 2 C3H0b 0.770 1.610 2.261 9.326 9.965 0.936 [OK] 3716 185 M TRP CD1 5 C3H1s 0.770 1.760 5.386 33.878 20.874 1.623 possible 3717 185 M TRP CD2 2 C3H0b 0.770 1.610 2.325 9.552 10.097 0.946 [OK] 3718 185 M TRP NE1 13 N3H1b 0.700 1.640 3.805 23.477 16.969 1.384 possible 3719 185 M TRP CE2 2 C3H0b 0.770 1.610 2.681 9.697 9.889 0.981 [OK] 3720 185 M TRP CE3 6 C3H1b 0.770 1.760 2.864 19.466 20.448 0.952 [OK] 3721 185 M TRP CZ2 6 C3H1b 0.770 1.760 3.645 24.729 21.012 1.177 possible 3722 185 M TRP CZ3 6 C3H1b 0.770 1.760 3.065 23.200 21.516 1.078 possible 3723 185 M TRP CH2 6 C3H1b 0.770 1.760 3.073 23.083 21.339 1.082 possible 3724 186 M THR N 12 N3H1s 0.700 1.640 2.312 12.309 13.832 0.890 [OK] 3725 186 M THR CA 3 C4H1s 0.770 1.880 2.687 13.041 13.099 0.996 [OK] 3726 186 M THR C 1 C3H0s 0.770 1.610 2.309 8.089 8.738 0.926 [OK] 3727 186 M THR O 16 O1H0u 0.660 1.420 2.402 15.627 16.020 0.975 [OK] 3728 186 M THR CB 4 C4H1b 0.770 1.880 3.060 13.960 14.829 0.941 possible 3729 186 M THR OG1 17 O2H1u 0.660 1.460 2.639 19.309 18.123 1.065 [OK] 3730 186 M THR CG2 10 C4H3u 0.770 1.880 2.837 31.954 36.542 0.874 [OK] 3731 187 M ASN N 12 N3H1s 0.700 1.640 2.347 13.426 13.695 0.980 [OK] 3732 187 M ASN CA 3 C4H1s 0.770 1.880 2.593 12.296 13.167 0.934 [OK] 3733 187 M ASN C 1 C3H0s 0.770 1.610 2.215 8.029 8.928 0.899 [OK] 3734 187 M ASN O 16 O1H0u 0.660 1.420 2.482 15.976 16.199 0.986 [OK] 3735 187 M ASN CB 8 C4H2s 0.770 1.880 2.858 22.206 23.128 0.960 [OK] 3736 187 M ASN CG 2 C3H0b 0.770 1.610 2.366 9.119 9.599 0.950 [OK] 3737 187 M ASN OD1 16 O1H0u 0.660 1.420 2.630 19.793 16.664 1.188 [OK] 3738 187 M ASN ND2 15 N3H2u 0.700 1.640 6.353 50.084 23.083 2.170 possible 3739 188 M ASN N 12 N3H1s 0.700 1.640 2.568 12.759 13.695 0.932 [OK] 3740 188 M ASN CA 3 C4H1s 0.770 1.880 3.137 14.165 13.167 1.076 possible 3741 188 M ASN C 1 C3H0s 0.770 1.610 2.435 8.034 8.928 0.900 [OK] 3742 188 M ASN O 16 O1H0u 0.660 1.420 2.639 14.446 16.199 0.892 [OK] 3743 188 M ASN CB 8 C4H2s 0.770 1.880 4.857 31.343 23.128 1.355 possible 3744 188 M ASN CG 2 C3H0b 0.770 1.610 7.043 17.037 9.599 1.775 possible 3745 188 M ASN OD1 16 O1H0u 0.660 1.420 32.122 -1.000 16.664 -1.000 bad 3746 188 M ASN ND2 15 N3H2u 0.700 1.640 7.867 106.256 23.083 4.603 possible 3747 189 M PHE N 12 N3H1s 0.700 1.640 2.513 12.120 13.691 0.885 [OK] 3748 189 M PHE CA 3 C4H1s 0.770 1.880 3.501 16.556 13.449 1.231 possible 3749 189 M PHE C 1 C3H0s 0.770 1.610 2.297 8.075 8.753 0.923 [OK] 3750 189 M PHE O 16 O1H0u 0.660 1.420 2.302 14.516 16.151 0.899 [OK] 3751 189 M PHE CB 8 C4H2s 0.770 1.880 2.643 21.360 23.777 0.898 [OK] 3752 189 M PHE CG 2 C3H0b 0.770 1.610 2.869 10.031 9.721 1.032 [OK] 3753 189 M PHE CD1 5 C3H1s 0.770 1.760 3.102 19.476 20.405 0.954 possible 3754 189 M PHE CD2 6 C3H1b 0.770 1.760 3.898 26.084 21.051 1.239 possible 3755 189 M PHE CE1 6 C3H1b 0.770 1.760 3.129 20.765 21.580 0.962 possible 3756 189 M PHE CE2 6 C3H1b 0.770 1.760 3.113 21.484 21.680 0.991 possible 3757 189 M PHE CZ 6 C3H1b 0.770 1.760 3.109 20.281 21.666 0.936 possible 3758 190 M SER N 12 N3H1s 0.700 1.640 2.641 14.403 14.103 1.021 [OK] 3759 190 M SER CA 3 C4H1s 0.770 1.880 2.755 14.944 13.476 1.109 [OK] 3760 190 M SER C 1 C3H0s 0.770 1.610 2.439 8.819 8.923 0.988 [OK] 3761 190 M SER O 16 O1H0u 0.660 1.420 2.592 15.788 16.179 0.976 [OK] 3762 190 M SER CB 8 C4H2s 0.770 1.880 2.859 23.454 23.884 0.982 [OK] 3763 190 M SER OG 17 O2H1u 0.660 1.460 2.388 17.401 18.732 0.929 [OK] 3764 191 M LEU N 12 N3H1s 0.700 1.640 2.495 13.398 13.655 0.981 [OK] 3765 191 M LEU CA 3 C4H1s 0.770 1.880 3.268 13.669 13.122 1.042 possible 3766 191 M LEU C 1 C3H0s 0.770 1.610 4.940 10.734 8.825 1.216 possible 3767 191 M LEU O 16 O1H0u 0.660 1.420 12.313 -1.000 16.208 -1.000 bad 3768 191 M LEU CB 8 C4H2s 0.770 1.880 7.581 -1.000 22.951 -1.000 bad 3769 191 M LEU CG 4 C4H1b 0.770 1.880 15.171 -1.000 14.764 -1.000 bad 3770 191 M LEU CD1 10 C4H3u 0.770 1.880 11.605 -1.000 37.425 -1.000 bad 3771 191 M LEU CD2 10 C4H3u 0.770 1.880 28.576 -1.000 37.143 -1.000 bad 3772 192 M VAL N 12 N3H1s 0.700 1.640 3.916 14.071 13.676 1.029 possible 3773 192 M VAL CA 3 C4H1s 0.770 1.880 8.323 -1.000 13.123 -1.000 bad 3774 192 M VAL C 1 C3H0s 0.770 1.610 2.425 8.551 8.563 0.999 [OK] 3775 192 M VAL O 16 O1H0u 0.660 1.420 10.197 -1.000 16.181 -1.000 bad 3776 192 M VAL CB 4 C4H1b 0.770 1.880 3.647 16.022 14.598 1.098 possible 3777 192 M VAL CG1 10 C4H3u 0.770 1.880 24.375 -1.000 36.584 -1.000 bad 3778 192 M VAL CG2 10 C4H3u 0.770 1.880 29.813 -1.000 36.332 -1.000 bad 3779 193 M HIS N 12 N3H1s 0.700 1.640 2.210 12.001 13.715 0.875 [OK] 3780 193 M HIS CA 3 C4H1s 0.770 1.880 2.518 11.991 13.467 0.890 [OK] 3781 193 M HIS C 1 C3H0s 0.770 1.610 2.766 10.045 8.882 1.131 [OK] 3782 193 M HIS O 16 O1H0u 0.660 1.420 2.699 16.764 16.082 1.042 [OK] 3783 193 M HIS CB 8 C4H2s 0.770 1.880 3.219 26.776 23.653 1.132 possible 3784 193 M HIS CG 2 C3H0b 0.770 1.610 2.567 10.099 9.952 1.015 [OK] 3785 193 M HIS ND1 13 N3H1b 0.700 1.640 2.626 14.473 15.506 0.933 [OK] 3786 193 M HIS CD2 5 C3H1s 0.770 1.760 2.971 22.878 21.085 1.085 [OK] 3787 193 M HIS CE1 5 C3H1s 0.770 1.760 4.204 25.195 20.636 1.221 possible 3788 193 M HIS NE2 13 N3H1b 0.700 1.640 2.579 14.704 15.337 0.959 [OK] 3789 194 M GLY N 12 N3H1s 0.700 1.640 3.677 17.773 14.854 1.197 possible 3790 194 M GLY CA 8 C4H2s 0.770 1.880 4.456 32.244 23.688 1.361 possible 3791 194 M GLY C 2 C3H0b 0.770 1.610 3.741 10.931 9.840 1.111 possible 3792 194 M GLY O 16 O1H0u 0.660 1.420 3.624 20.098 16.391 1.226 possible 3793 195 M ASN N 12 N3H1s 0.700 1.640 2.777 14.057 13.695 1.026 [OK] 3794 195 M ASN CA 3 C4H1s 0.770 1.880 2.638 12.734 13.167 0.967 [OK] 3795 195 M ASN C 1 C3H0s 0.770 1.610 2.802 9.355 8.928 1.048 [OK] 3796 195 M ASN O 16 O1H0u 0.660 1.420 2.472 16.158 16.199 0.997 [OK] 3797 195 M ASN CB 8 C4H2s 0.770 1.880 3.189 22.764 23.128 0.984 possible 3798 195 M ASN CG 2 C3H0b 0.770 1.610 2.778 10.322 9.599 1.075 [OK] 3799 195 M ASN OD1 16 O1H0u 0.660 1.420 3.229 22.092 16.664 1.326 possible 3800 195 M ASN ND2 15 N3H2u 0.700 1.640 2.550 20.679 23.083 0.896 [OK] 3801 196 M LEU N 12 N3H1s 0.700 1.640 2.847 14.700 13.655 1.077 [OK] 3802 196 M LEU CA 3 C4H1s 0.770 1.880 2.841 13.473 13.122 1.027 [OK] 3803 196 M LEU C 1 C3H0s 0.770 1.610 2.679 8.978 8.825 1.017 [OK] 3804 196 M LEU O 16 O1H0u 0.660 1.420 2.362 15.083 16.208 0.931 [OK] 3805 196 M LEU CB 8 C4H2s 0.770 1.880 2.930 23.748 22.951 1.035 [OK] 3806 196 M LEU CG 4 C4H1b 0.770 1.880 3.083 15.650 14.764 1.060 possible 3807 196 M LEU CD1 10 C4H3u 0.770 1.880 3.100 39.656 37.425 1.060 possible 3808 196 M LEU CD2 10 C4H3u 0.770 1.880 3.231 34.543 37.143 0.930 possible 3809 197 M PHE N 12 N3H1s 0.700 1.640 2.705 14.954 13.691 1.092 [OK] 3810 197 M PHE CA 3 C4H1s 0.770 1.880 2.528 11.398 13.449 0.848 [OK] 3811 197 M PHE C 1 C3H0s 0.770 1.610 2.673 9.082 8.753 1.038 [OK] 3812 197 M PHE O 16 O1H0u 0.660 1.420 3.183 23.509 16.151 1.456 possible 3813 197 M PHE CB 8 C4H2s 0.770 1.880 2.864 24.477 23.777 1.029 [OK] 3814 197 M PHE CG 2 C3H0b 0.770 1.610 2.580 10.438 9.721 1.074 [OK] 3815 197 M PHE CD1 5 C3H1s 0.770 1.760 2.816 21.445 20.405 1.051 [OK] 3816 197 M PHE CD2 6 C3H1b 0.770 1.760 2.699 20.821 21.051 0.989 [OK] 3817 197 M PHE CE1 6 C3H1b 0.770 1.760 2.694 18.830 21.580 0.873 [OK] 3818 197 M PHE CE2 6 C3H1b 0.770 1.760 2.763 21.819 21.680 1.006 [OK] 3819 197 M PHE CZ 6 C3H1b 0.770 1.760 2.897 19.424 21.666 0.897 [OK] 3820 198 M TYR N 12 N3H1s 0.700 1.640 2.680 13.317 13.691 0.973 [OK] 3821 198 M TYR CA 3 C4H1s 0.770 1.880 3.278 14.796 13.330 1.110 possible 3822 198 M TYR C 1 C3H0s 0.770 1.610 3.187 10.221 8.770 1.165 possible 3823 198 M TYR O 16 O1H0u 0.660 1.420 3.807 30.112 16.124 1.868 possible 3824 198 M TYR CB 8 C4H2s 0.770 1.880 3.469 24.230 23.678 1.023 possible 3825 198 M TYR CG 2 C3H0b 0.770 1.610 2.821 10.091 9.732 1.037 [OK] 3826 198 M TYR CD1 5 C3H1s 0.770 1.760 5.000 38.151 20.171 1.891 possible 3827 198 M TYR CD2 5 C3H1s 0.770 1.760 2.732 19.590 20.728 0.945 [OK] 3828 198 M TYR CE1 5 C3H1s 0.770 1.760 5.012 47.085 20.675 2.277 possible 3829 198 M TYR CE2 5 C3H1s 0.770 1.760 3.029 23.063 20.810 1.108 possible 3830 198 M TYR CZ 2 C3H0b 0.770 1.610 2.504 9.777 9.926 0.985 [OK] 3831 198 M TYR OH 17 O2H1u 0.660 1.460 4.558 38.570 19.173 2.012 possible 3832 199 M ASN N 12 N3H1s 0.700 1.640 2.565 14.069 13.695 1.027 [OK] 3833 199 M ASN CA 3 C4H1s 0.770 1.880 2.444 11.956 13.167 0.908 [OK] 3834 199 M ASN C 1 C3H0s 0.770 1.610 3.157 8.509 8.928 0.953 possible 3835 199 M ASN O 16 O1H0u 0.660 1.420 3.240 19.471 16.199 1.202 possible 3836 199 M ASN CB 8 C4H2s 0.770 1.880 2.770 21.736 23.128 0.940 [OK] 3837 199 M ASN CG 2 C3H0b 0.770 1.610 2.565 9.691 9.599 1.010 [OK] 3838 199 M ASN OD1 16 O1H0u 0.660 1.420 2.580 17.068 16.664 1.024 [OK] 3839 199 M ASN ND2 15 N3H2u 0.700 1.640 2.912 27.914 23.083 1.209 [OK] 3840 200 M PRO N 11 N3H0u 0.700 1.640 3.189 9.052 8.823 1.026 possible 3841 200 M PRO CA 4 C4H1b 0.770 1.880 5.132 28.120 13.955 2.015 possible 3842 200 M PRO C 1 C3H0s 0.770 1.610 2.412 8.848 8.812 1.004 [OK] 3843 200 M PRO O 16 O1H0u 0.660 1.420 4.461 26.795 16.169 1.657 possible 3844 200 M PRO CB 9 C4H2b 0.770 1.880 6.167 65.756 25.563 2.572 possible 3845 200 M PRO CG 9 C4H2b 0.770 1.880 3.290 30.485 25.832 1.180 possible 3846 200 M PRO CD 8 C4H2s 0.770 1.880 3.457 22.245 23.836 0.933 possible 3847 201 M PHE N 12 N3H1s 0.700 1.640 2.440 12.877 13.691 0.941 [OK] 3848 201 M PHE CA 3 C4H1s 0.770 1.880 2.695 13.042 13.449 0.970 [OK] 3849 201 M PHE C 1 C3H0s 0.770 1.610 2.753 9.162 8.753 1.047 [OK] 3850 201 M PHE O 16 O1H0u 0.660 1.420 2.543 16.247 16.151 1.006 [OK] 3851 201 M PHE CB 8 C4H2s 0.770 1.880 2.995 20.961 23.777 0.882 [OK] 3852 201 M PHE CG 2 C3H0b 0.770 1.610 2.386 9.853 9.721 1.014 [OK] 3853 201 M PHE CD1 5 C3H1s 0.770 1.760 2.754 20.958 20.405 1.027 [OK] 3854 201 M PHE CD2 6 C3H1b 0.770 1.760 3.156 23.457 21.051 1.114 possible 3855 201 M PHE CE1 6 C3H1b 0.770 1.760 3.302 23.546 21.580 1.091 possible 3856 201 M PHE CE2 6 C3H1b 0.770 1.760 3.151 22.204 21.680 1.024 possible 3857 201 M PHE CZ 6 C3H1b 0.770 1.760 3.426 20.547 21.666 0.948 possible 3858 202 M HIS N 12 N3H1s 0.700 1.640 2.836 14.917 13.715 1.088 [OK] 3859 202 M HIS CA 3 C4H1s 0.770 1.880 2.783 13.203 13.467 0.980 [OK] 3860 202 M HIS C 1 C3H0s 0.770 1.610 2.345 8.385 8.882 0.944 [OK] 3861 202 M HIS O 16 O1H0u 0.660 1.420 2.567 15.050 16.082 0.936 [OK] 3862 202 M HIS CB 8 C4H2s 0.770 1.880 3.172 23.886 23.653 1.010 possible 3863 202 M HIS CG 2 C3H0b 0.770 1.610 2.473 9.927 9.952 0.997 [OK] 3864 202 M HIS ND1 13 N3H1b 0.700 1.640 2.554 16.384 15.506 1.057 [OK] 3865 202 M HIS CD2 5 C3H1s 0.770 1.760 2.878 19.282 21.085 0.914 [OK] 3866 202 M HIS CE1 5 C3H1s 0.770 1.760 2.849 19.319 20.636 0.936 [OK] 3867 202 M HIS NE2 13 N3H1b 0.700 1.640 2.533 11.695 15.337 0.763 [OK] 3868 203 M GLY N 12 N3H1s 0.700 1.640 2.775 14.613 14.854 0.984 [OK] 3869 203 M GLY CA 8 C4H2s 0.770 1.880 3.881 31.727 23.688 1.339 possible 3870 203 M GLY C 2 C3H0b 0.770 1.610 3.741 11.831 9.840 1.202 possible 3871 203 M GLY O 16 O1H0u 0.660 1.420 3.612 19.563 16.391 1.194 possible 3872 204 M LEU N 12 N3H1s 0.700 1.640 4.122 16.044 13.655 1.175 possible 3873 204 M LEU CA 3 C4H1s 0.770 1.880 3.530 14.011 13.122 1.068 possible 3874 204 M LEU C 1 C3H0s 0.770 1.610 2.373 8.437 8.825 0.956 [OK] 3875 204 M LEU O 16 O1H0u 0.660 1.420 2.602 13.387 16.208 0.826 [OK] 3876 204 M LEU CB 8 C4H2s 0.770 1.880 2.719 20.581 22.951 0.897 [OK] 3877 204 M LEU CG 4 C4H1b 0.770 1.880 4.671 19.423 14.764 1.316 possible 3878 204 M LEU CD1 10 C4H3u 0.770 1.880 3.117 34.191 37.425 0.914 possible 3879 204 M LEU CD2 10 C4H3u 0.770 1.880 4.760 59.755 37.143 1.609 possible 3880 205 M SER N 12 N3H1s 0.700 1.640 2.332 12.925 14.103 0.916 [OK] 3881 205 M SER CA 3 C4H1s 0.770 1.880 2.736 14.097 13.476 1.046 [OK] 3882 205 M SER C 1 C3H0s 0.770 1.610 2.126 7.663 8.923 0.859 [OK] 3883 205 M SER O 16 O1H0u 0.660 1.420 2.216 14.732 16.179 0.911 [OK] 3884 205 M SER CB 8 C4H2s 0.770 1.880 3.022 21.973 23.884 0.920 possible 3885 205 M SER OG 17 O2H1u 0.660 1.460 2.716 19.308 18.732 1.031 [OK] 3886 206 M ILE N 12 N3H1s 0.700 1.640 2.402 11.964 13.633 0.878 [OK] 3887 206 M ILE CA 3 C4H1s 0.770 1.880 3.105 13.774 13.007 1.059 possible 3888 206 M ILE C 1 C3H0s 0.770 1.610 2.606 7.659 8.470 0.904 [OK] 3889 206 M ILE O 16 O1H0u 0.660 1.420 2.647 14.971 16.144 0.927 [OK] 3890 206 M ILE CB 4 C4H1b 0.770 1.880 2.709 13.125 14.227 0.923 [OK] 3891 206 M ILE CG1 9 C4H2b 0.770 1.880 2.934 19.745 24.187 0.816 [OK] 3892 206 M ILE CG2 10 C4H3u 0.770 1.880 3.123 30.996 35.961 0.862 possible 3893 206 M ILE CD1 10 C4H3u 0.770 1.880 2.720 29.972 38.377 0.781 [OK] 3894 207 M ALA N 12 N3H1s 0.700 1.640 2.761 12.942 14.046 0.921 [OK] 3895 207 M ALA CA 4 C4H1b 0.770 1.880 2.938 14.823 14.063 1.054 [OK] 3896 207 M ALA C 1 C3H0s 0.770 1.610 3.037 8.780 8.900 0.986 possible 3897 207 M ALA O 16 O1H0u 0.660 1.420 3.089 18.451 16.188 1.140 possible 3898 207 M ALA CB 10 C4H3u 0.770 1.880 4.811 63.151 36.782 1.717 possible 3899 208 M PHE N 12 N3H1s 0.700 1.640 2.577 12.095 13.691 0.883 [OK] 3900 208 M PHE CA 3 C4H1s 0.770 1.880 2.831 12.898 13.449 0.959 [OK] 3901 208 M PHE C 1 C3H0s 0.770 1.610 2.090 8.165 8.753 0.933 [OK] 3902 208 M PHE O 16 O1H0u 0.660 1.420 2.310 14.434 16.151 0.894 [OK] 3903 208 M PHE CB 8 C4H2s 0.770 1.880 2.682 22.085 23.777 0.929 [OK] 3904 208 M PHE CG 2 C3H0b 0.770 1.610 2.670 9.756 9.721 1.004 [OK] 3905 208 M PHE CD1 5 C3H1s 0.770 1.760 3.409 24.230 20.405 1.187 possible 3906 208 M PHE CD2 6 C3H1b 0.770 1.760 2.794 19.690 21.051 0.935 [OK] 3907 208 M PHE CE1 6 C3H1b 0.770 1.760 4.232 28.164 21.580 1.305 possible 3908 208 M PHE CE2 6 C3H1b 0.770 1.760 2.964 20.805 21.680 0.960 [OK] 3909 208 M PHE CZ 6 C3H1b 0.770 1.760 4.273 26.771 21.666 1.236 possible 3910 209 M LEU N 12 N3H1s 0.700 1.640 2.318 12.055 13.655 0.883 [OK] 3911 209 M LEU CA 3 C4H1s 0.770 1.880 2.881 13.530 13.122 1.031 [OK] 3912 209 M LEU C 1 C3H0s 0.770 1.610 2.706 8.507 8.825 0.964 [OK] 3913 209 M LEU O 16 O1H0u 0.660 1.420 2.525 17.187 16.208 1.060 [OK] 3914 209 M LEU CB 8 C4H2s 0.770 1.880 3.132 22.670 22.951 0.988 possible 3915 209 M LEU CG 4 C4H1b 0.770 1.880 3.054 15.938 14.764 1.080 possible 3916 209 M LEU CD1 10 C4H3u 0.770 1.880 3.010 39.830 37.425 1.064 possible 3917 209 M LEU CD2 10 C4H3u 0.770 1.880 3.405 43.974 37.143 1.184 possible 3918 210 M TYR N 12 N3H1s 0.700 1.640 2.596 12.591 13.691 0.920 [OK] 3919 210 M TYR CA 3 C4H1s 0.770 1.880 2.961 15.200 13.330 1.140 [OK] 3920 210 M TYR C 1 C3H0s 0.770 1.610 2.475 8.551 8.770 0.975 [OK] 3921 210 M TYR O 16 O1H0u 0.660 1.420 2.597 16.343 16.124 1.014 [OK] 3922 210 M TYR CB 8 C4H2s 0.770 1.880 3.007 22.636 23.678 0.956 possible 3923 210 M TYR CG 2 C3H0b 0.770 1.610 2.753 10.278 9.732 1.056 [OK] 3924 210 M TYR CD1 5 C3H1s 0.770 1.760 3.266 26.285 20.171 1.303 possible 3925 210 M TYR CD2 5 C3H1s 0.770 1.760 2.833 20.454 20.728 0.987 [OK] 3926 210 M TYR CE1 5 C3H1s 0.770 1.760 3.270 23.484 20.675 1.136 possible 3927 210 M TYR CE2 5 C3H1s 0.770 1.760 2.981 21.233 20.810 1.020 [OK] 3928 210 M TYR CZ 2 C3H0b 0.770 1.610 2.978 9.992 9.926 1.007 [OK] 3929 210 M TYR OH 17 O2H1u 0.660 1.460 2.466 18.421 19.173 0.961 [OK] 3930 211 M GLY N 12 N3H1s 0.700 1.640 2.434 12.587 14.854 0.847 [OK] 3931 211 M GLY CA 8 C4H2s 0.770 1.880 2.910 24.425 23.688 1.031 [OK] 3932 211 M GLY C 2 C3H0b 0.770 1.610 2.072 8.272 9.840 0.841 [OK] 3933 211 M GLY O 16 O1H0u 0.660 1.420 2.655 15.303 16.391 0.934 [OK] 3934 212 M SER N 12 N3H1s 0.700 1.640 2.149 11.949 14.103 0.847 [OK] 3935 212 M SER CA 3 C4H1s 0.770 1.880 2.649 12.429 13.476 0.922 [OK] 3936 212 M SER C 1 C3H0s 0.770 1.610 2.117 7.896 8.923 0.885 [OK] 3937 212 M SER O 16 O1H0u 0.660 1.420 2.364 15.427 16.179 0.954 [OK] 3938 212 M SER CB 8 C4H2s 0.770 1.880 2.808 23.268 23.884 0.974 [OK] 3939 212 M SER OG 17 O2H1u 0.660 1.460 2.454 19.512 18.732 1.042 [OK] 3940 213 M ALA N 12 N3H1s 0.700 1.640 2.281 12.913 14.046 0.919 [OK] 3941 213 M ALA CA 4 C4H1b 0.770 1.880 2.682 12.345 14.063 0.878 [OK] 3942 213 M ALA C 1 C3H0s 0.770 1.610 2.205 8.483 8.900 0.953 [OK] 3943 213 M ALA O 16 O1H0u 0.660 1.420 2.401 15.154 16.188 0.936 [OK] 3944 213 M ALA CB 10 C4H3u 0.770 1.880 3.178 37.360 36.782 1.016 possible 3945 214 M LEU N 12 N3H1s 0.700 1.640 2.198 12.120 13.655 0.888 [OK] 3946 214 M LEU CA 3 C4H1s 0.770 1.880 2.462 12.586 13.122 0.959 [OK] 3947 214 M LEU C 1 C3H0s 0.770 1.610 2.274 8.061 8.825 0.913 [OK] 3948 214 M LEU O 16 O1H0u 0.660 1.420 2.165 14.519 16.208 0.896 [OK] 3949 214 M LEU CB 8 C4H2s 0.770 1.880 3.104 22.936 22.951 0.999 possible 3950 214 M LEU CG 4 C4H1b 0.770 1.880 3.026 14.270 14.764 0.967 possible 3951 214 M LEU CD1 10 C4H3u 0.770 1.880 3.093 31.198 37.425 0.834 possible 3952 214 M LEU CD2 10 C4H3u 0.770 1.880 3.111 35.951 37.143 0.968 possible 3953 215 M LEU N 12 N3H1s 0.700 1.640 2.803 13.167 13.655 0.964 [OK] 3954 215 M LEU CA 3 C4H1s 0.770 1.880 2.852 13.073 13.122 0.996 [OK] 3955 215 M LEU C 1 C3H0s 0.770 1.610 2.551 8.567 8.825 0.971 [OK] 3956 215 M LEU O 16 O1H0u 0.660 1.420 2.702 15.241 16.208 0.940 [OK] 3957 215 M LEU CB 8 C4H2s 0.770 1.880 3.110 24.356 22.951 1.061 possible 3958 215 M LEU CG 4 C4H1b 0.770 1.880 3.393 18.577 14.764 1.258 possible 3959 215 M LEU CD1 10 C4H3u 0.770 1.880 2.975 36.276 37.425 0.969 [OK] 3960 215 M LEU CD2 10 C4H3u 0.770 1.880 3.290 37.449 37.143 1.008 possible 3961 216 M PHE N 12 N3H1s 0.700 1.640 2.498 14.342 13.691 1.048 [OK] 3962 216 M PHE CA 3 C4H1s 0.770 1.880 2.947 12.604 13.449 0.937 [OK] 3963 216 M PHE C 1 C3H0s 0.770 1.610 2.537 8.795 8.753 1.005 [OK] 3964 216 M PHE O 16 O1H0u 0.660 1.420 2.457 16.705 16.151 1.034 [OK] 3965 216 M PHE CB 8 C4H2s 0.770 1.880 2.817 24.349 23.777 1.024 [OK] 3966 216 M PHE CG 2 C3H0b 0.770 1.610 2.431 9.548 9.721 0.982 [OK] 3967 216 M PHE CD1 5 C3H1s 0.770 1.760 2.905 20.600 20.405 1.010 [OK] 3968 216 M PHE CD2 6 C3H1b 0.770 1.760 2.836 20.748 21.051 0.986 [OK] 3969 216 M PHE CE1 6 C3H1b 0.770 1.760 3.015 26.401 21.580 1.223 possible 3970 216 M PHE CE2 6 C3H1b 0.770 1.760 3.068 20.283 21.680 0.936 possible 3971 216 M PHE CZ 6 C3H1b 0.770 1.760 2.884 22.008 21.666 1.016 [OK] 3972 217 M ALA N 12 N3H1s 0.700 1.640 2.484 13.885 14.046 0.989 [OK] 3973 217 M ALA CA 4 C4H1b 0.770 1.880 2.655 14.091 14.063 1.002 [OK] 3974 217 M ALA C 1 C3H0s 0.770 1.610 2.404 8.444 8.900 0.949 [OK] 3975 217 M ALA O 16 O1H0u 0.660 1.420 2.666 16.617 16.188 1.026 [OK] 3976 217 M ALA CB 10 C4H3u 0.770 1.880 3.021 33.700 36.782 0.916 possible 3977 218 M MET N 12 N3H1s 0.700 1.640 2.391 12.728 13.564 0.938 [OK] 3978 218 M MET CA 3 C4H1s 0.770 1.880 3.112 15.993 13.231 1.209 possible 3979 218 M MET C 1 C3H0s 0.770 1.610 2.322 8.268 8.782 0.941 [OK] 3980 218 M MET O 16 O1H0u 0.660 1.420 2.385 15.407 16.277 0.947 [OK] 3981 218 M MET CB 8 C4H2s 0.770 1.880 2.636 20.592 23.645 0.871 [OK] 3982 218 M MET CG 9 C4H2b 0.770 1.880 2.815 22.634 24.009 0.943 [OK] 3983 218 M MET SD 19 S2H0u 1.040 1.770 2.731 27.470 30.093 0.913 [OK] 3984 218 M MET CE 10 C4H3u 0.770 1.880 2.803 33.262 37.161 0.895 [OK] 3985 219 M HIS N 12 N3H1s 0.700 1.640 2.432 12.587 13.715 0.918 [OK] 3986 219 M HIS CA 3 C4H1s 0.770 1.880 2.449 11.912 13.467 0.885 [OK] 3987 219 M HIS C 1 C3H0s 0.770 1.610 2.440 8.508 8.882 0.958 [OK] 3988 219 M HIS O 16 O1H0u 0.660 1.420 2.393 14.812 16.082 0.921 [OK] 3989 219 M HIS CB 8 C4H2s 0.770 1.880 3.393 29.368 23.653 1.242 possible 3990 219 M HIS CG 2 C3H0b 0.770 1.610 3.079 10.690 9.952 1.074 possible 3991 219 M HIS ND1 13 N3H1b 0.700 1.640 2.469 14.121 15.506 0.911 [OK] 3992 219 M HIS CD2 5 C3H1s 0.770 1.760 3.153 28.594 21.085 1.356 possible 3993 219 M HIS CE1 5 C3H1s 0.770 1.760 2.837 17.638 20.636 0.855 [OK] 3994 219 M HIS NE2 13 N3H1b 0.700 1.640 2.988 12.044 15.337 0.785 [OK] 3995 220 M GLY N 12 N3H1s 0.700 1.640 2.669 14.954 14.854 1.007 [OK] 3996 220 M GLY CA 8 C4H2s 0.770 1.880 2.925 27.177 23.688 1.147 [OK] 3997 220 M GLY C 2 C3H0b 0.770 1.610 2.649 9.712 9.840 0.987 [OK] 3998 220 M GLY O 16 O1H0u 0.660 1.420 2.482 16.509 16.391 1.007 [OK] 3999 221 M ALA N 12 N3H1s 0.700 1.640 2.586 13.761 14.046 0.980 [OK] 4000 221 M ALA CA 4 C4H1b 0.770 1.880 2.823 14.342 14.063 1.020 [OK] 4001 221 M ALA C 1 C3H0s 0.770 1.610 2.230 8.192 8.900 0.920 [OK] 4002 221 M ALA O 16 O1H0u 0.660 1.420 2.336 14.870 16.188 0.919 [OK] 4003 221 M ALA CB 10 C4H3u 0.770 1.880 3.112 33.048 36.782 0.898 possible 4004 222 M THR N 12 N3H1s 0.700 1.640 2.233 12.284 13.832 0.888 [OK] 4005 222 M THR CA 3 C4H1s 0.770 1.880 3.189 13.834 13.099 1.056 possible 4006 222 M THR C 1 C3H0s 0.770 1.610 2.562 8.104 8.738 0.927 [OK] 4007 222 M THR O 16 O1H0u 0.660 1.420 2.743 14.409 16.020 0.899 [OK] 4008 222 M THR CB 4 C4H1b 0.770 1.880 2.789 13.637 14.829 0.920 [OK] 4009 222 M THR OG1 17 O2H1u 0.660 1.460 2.420 16.067 18.123 0.887 [OK] 4010 222 M THR CG2 10 C4H3u 0.770 1.880 3.229 39.823 36.542 1.090 possible 4011 223 M ILE N 12 N3H1s 0.700 1.640 2.504 12.647 13.633 0.928 [OK] 4012 223 M ILE CA 3 C4H1s 0.770 1.880 2.802 11.800 13.007 0.907 [OK] 4013 223 M ILE C 1 C3H0s 0.770 1.610 2.658 7.860 8.470 0.928 [OK] 4014 223 M ILE O 16 O1H0u 0.660 1.420 2.643 15.441 16.144 0.956 [OK] 4015 223 M ILE CB 4 C4H1b 0.770 1.880 2.709 14.120 14.227 0.992 [OK] 4016 223 M ILE CG1 9 C4H2b 0.770 1.880 2.880 20.794 24.187 0.860 [OK] 4017 223 M ILE CG2 10 C4H3u 0.770 1.880 3.249 36.164 35.961 1.006 possible 4018 223 M ILE CD1 10 C4H3u 0.770 1.880 3.060 38.990 38.377 1.016 possible 4019 224 M LEU N 12 N3H1s 0.700 1.640 2.565 13.326 13.655 0.976 [OK] 4020 224 M LEU CA 3 C4H1s 0.770 1.880 2.957 12.932 13.122 0.985 [OK] 4021 224 M LEU C 1 C3H0s 0.770 1.610 2.191 8.320 8.825 0.943 [OK] 4022 224 M LEU O 16 O1H0u 0.660 1.420 2.604 17.333 16.208 1.069 [OK] 4023 224 M LEU CB 8 C4H2s 0.770 1.880 2.959 23.206 22.951 1.011 [OK] 4024 224 M LEU CG 4 C4H1b 0.770 1.880 2.855 14.333 14.764 0.971 [OK] 4025 224 M LEU CD1 10 C4H3u 0.770 1.880 3.335 37.534 37.425 1.003 possible 4026 224 M LEU CD2 10 C4H3u 0.770 1.880 3.229 39.794 37.143 1.071 possible 4027 225 M ALA N 12 N3H1s 0.700 1.640 2.341 12.163 14.046 0.866 [OK] 4028 225 M ALA CA 4 C4H1b 0.770 1.880 2.975 13.928 14.063 0.990 [OK] 4029 225 M ALA C 1 C3H0s 0.770 1.610 2.364 8.656 8.900 0.973 [OK] 4030 225 M ALA O 16 O1H0u 0.660 1.420 2.404 16.392 16.188 1.013 [OK] 4031 225 M ALA CB 10 C4H3u 0.770 1.880 3.198 34.804 36.782 0.946 possible 4032 226 M VAL N 12 N3H1s 0.700 1.640 2.285 11.344 13.676 0.829 [OK] 4033 226 M VAL CA 3 C4H1s 0.770 1.880 2.633 12.956 13.123 0.987 [OK] 4034 226 M VAL C 1 C3H0s 0.770 1.610 2.390 8.988 8.563 1.050 [OK] 4035 226 M VAL O 16 O1H0u 0.660 1.420 2.113 13.836 16.181 0.855 [OK] 4036 226 M VAL CB 4 C4H1b 0.770 1.880 2.595 13.423 14.598 0.920 [OK] 4037 226 M VAL CG1 10 C4H3u 0.770 1.880 3.220 38.680 36.584 1.057 possible 4038 226 M VAL CG2 10 C4H3u 0.770 1.880 3.060 36.618 36.332 1.008 possible 4039 227 M SER N 12 N3H1s 0.700 1.640 2.384 12.354 14.103 0.876 [OK] 4040 227 M SER CA 3 C4H1s 0.770 1.880 2.920 14.448 13.476 1.072 [OK] 4041 227 M SER C 1 C3H0s 0.770 1.610 2.276 8.078 8.923 0.905 [OK] 4042 227 M SER O 16 O1H0u 0.660 1.420 2.269 13.743 16.179 0.849 [OK] 4043 227 M SER CB 8 C4H2s 0.770 1.880 3.203 27.132 23.884 1.136 possible 4044 227 M SER OG 17 O2H1u 0.660 1.460 2.483 19.337 18.732 1.032 [OK] 4045 228 M ARG N 12 N3H1s 0.700 1.640 2.364 12.708 13.650 0.931 [OK] 4046 228 M ARG CA 3 C4H1s 0.770 1.880 2.836 12.622 13.422 0.940 [OK] 4047 228 M ARG C 1 C3H0s 0.770 1.610 2.256 8.661 8.838 0.980 [OK] 4048 228 M ARG O 16 O1H0u 0.660 1.420 2.367 15.783 16.084 0.981 [OK] 4049 228 M ARG CB 8 C4H2s 0.770 1.880 2.965 22.799 23.088 0.987 [OK] 4050 228 M ARG CG 8 C4H2s 0.770 1.880 2.736 21.165 23.640 0.895 [OK] 4051 228 M ARG CD 8 C4H2s 0.770 1.880 2.835 22.858 23.300 0.981 [OK] 4052 228 M ARG NE 13 N3H1b 0.700 1.640 2.733 15.339 15.569 0.985 [OK] 4053 228 M ARG CZ 2 C3H0b 0.770 1.610 2.455 8.783 9.747 0.901 [OK] 4054 228 M ARG NH1 15 N3H2u 0.700 1.640 2.833 21.035 22.782 0.923 [OK] 4055 228 M ARG NH2 15 N3H2u 0.700 1.640 2.944 29.263 23.810 1.229 [OK] 4056 229 M PHE N 12 N3H1s 0.700 1.640 2.324 11.594 13.691 0.847 [OK] 4057 229 M PHE CA 3 C4H1s 0.770 1.880 3.291 14.100 13.449 1.048 possible 4058 229 M PHE C 1 C3H0s 0.770 1.610 2.853 10.885 8.753 1.244 [OK] 4059 229 M PHE O 16 O1H0u 0.660 1.420 2.905 18.040 16.151 1.117 [OK] 4060 229 M PHE CB 8 C4H2s 0.770 1.880 3.300 21.617 23.777 0.909 possible 4061 229 M PHE CG 2 C3H0b 0.770 1.610 2.414 9.081 9.721 0.934 [OK] 4062 229 M PHE CD1 5 C3H1s 0.770 1.760 2.795 19.099 20.405 0.936 [OK] 4063 229 M PHE CD2 6 C3H1b 0.770 1.760 2.771 19.416 21.051 0.922 [OK] 4064 229 M PHE CE1 6 C3H1b 0.770 1.760 2.664 20.023 21.580 0.928 [OK] 4065 229 M PHE CE2 6 C3H1b 0.770 1.760 2.686 18.813 21.680 0.868 [OK] 4066 229 M PHE CZ 6 C3H1b 0.770 1.760 2.609 17.109 21.666 0.790 [OK] 4067 230 M GLY N 12 N3H1s 0.700 1.640 2.577 13.486 14.854 0.908 [OK] 4068 230 M GLY CA 8 C4H2s 0.770 1.880 2.924 24.515 23.688 1.035 [OK] 4069 230 M GLY C 2 C3H0b 0.770 1.610 2.650 9.777 9.840 0.994 [OK] 4070 230 M GLY O 16 O1H0u 0.660 1.420 2.548 16.428 16.391 1.002 [OK] 4071 231 M GLY N 12 N3H1s 0.700 1.640 2.419 14.145 14.854 0.952 [OK] 4072 231 M GLY CA 8 C4H2s 0.770 1.880 2.915 25.211 23.688 1.064 [OK] 4073 231 M GLY C 2 C3H0b 0.770 1.610 2.616 9.633 9.840 0.979 [OK] 4074 231 M GLY O 16 O1H0u 0.660 1.420 2.495 18.966 16.391 1.157 [OK] 4075 232 M GLU N 12 N3H1s 0.700 1.640 2.720 14.565 13.615 1.070 [OK] 4076 232 M GLU CA 3 C4H1s 0.770 1.880 2.799 13.974 13.399 1.043 [OK] 4077 232 M GLU C 1 C3H0s 0.770 1.610 2.496 8.369 8.675 0.965 [OK] 4078 232 M GLU O 16 O1H0u 0.660 1.420 2.605 16.850 16.023 1.052 [OK] 4079 232 M GLU CB 8 C4H2s 0.770 1.880 3.245 26.134 23.529 1.111 possible 4080 232 M GLU CG 8 C4H2s 0.770 1.880 3.134 24.759 23.513 1.053 possible 4081 232 M GLU CD 2 C3H0b 0.770 1.610 2.592 9.799 9.460 1.036 [OK] 4082 232 M GLU OE1 16 O1H0u 0.660 1.420 2.728 17.763 15.999 1.110 [OK] 4083 232 M GLU OE2 16 O1H0u 0.660 1.420 2.736 16.071 17.432 0.922 [OK] 4084 233 M ARG N 12 N3H1s 0.700 1.640 2.639 13.104 13.650 0.960 [OK] 4085 233 M ARG CA 3 C4H1s 0.770 1.880 3.152 13.295 13.422 0.991 possible 4086 233 M ARG C 1 C3H0s 0.770 1.610 2.554 9.370 8.838 1.060 [OK] 4087 233 M ARG O 16 O1H0u 0.660 1.420 2.429 16.439 16.084 1.022 [OK] 4088 233 M ARG CB 8 C4H2s 0.770 1.880 2.807 24.033 23.088 1.041 [OK] 4089 233 M ARG CG 8 C4H2s 0.770 1.880 3.603 33.341 23.640 1.410 possible 4090 233 M ARG CD 8 C4H2s 0.770 1.880 2.967 23.351 23.300 1.002 [OK] 4091 233 M ARG NE 13 N3H1b 0.700 1.640 2.787 16.236 15.569 1.043 [OK] 4092 233 M ARG CZ 2 C3H0b 0.770 1.610 2.766 10.800 9.747 1.108 [OK] 4093 233 M ARG NH1 15 N3H2u 0.700 1.640 2.578 20.604 22.782 0.904 [OK] 4094 233 M ARG NH2 15 N3H2u 0.700 1.640 2.812 24.240 23.810 1.018 [OK] 4095 234 M GLU N 12 N3H1s 0.700 1.640 2.444 12.966 13.615 0.952 [OK] 4096 234 M GLU CA 3 C4H1s 0.770 1.880 2.776 13.539 13.399 1.010 [OK] 4097 234 M GLU C 1 C3H0s 0.770 1.610 2.488 8.611 8.675 0.993 [OK] 4098 234 M GLU O 16 O1H0u 0.660 1.420 2.346 12.903 16.023 0.805 [OK] 4099 234 M GLU CB 8 C4H2s 0.770 1.880 3.011 26.077 23.529 1.108 possible 4100 234 M GLU CG 8 C4H2s 0.770 1.880 2.757 22.508 23.513 0.957 [OK] 4101 234 M GLU CD 2 C3H0b 0.770 1.610 2.547 8.978 9.460 0.949 [OK] 4102 234 M GLU OE1 16 O1H0u 0.660 1.420 2.327 12.596 15.999 0.787 [OK] 4103 234 M GLU OE2 16 O1H0u 0.660 1.420 2.472 14.299 17.432 0.820 [OK] 4104 235 M LEU N 12 N3H1s 0.700 1.640 2.605 14.676 13.655 1.075 [OK] 4105 235 M LEU CA 3 C4H1s 0.770 1.880 2.626 12.637 13.122 0.963 [OK] 4106 235 M LEU C 1 C3H0s 0.770 1.610 2.510 8.718 8.825 0.988 [OK] 4107 235 M LEU O 16 O1H0u 0.660 1.420 2.616 15.062 16.208 0.929 [OK] 4108 235 M LEU CB 8 C4H2s 0.770 1.880 2.868 22.577 22.951 0.984 [OK] 4109 235 M LEU CG 4 C4H1b 0.770 1.880 2.856 15.571 14.764 1.055 [OK] 4110 235 M LEU CD1 10 C4H3u 0.770 1.880 2.814 31.410 37.425 0.839 [OK] 4111 235 M LEU CD2 10 C4H3u 0.770 1.880 2.995 32.836 37.143 0.884 [OK] 4112 236 M GLU N 12 N3H1s 0.700 1.640 2.492 13.071 13.615 0.960 [OK] 4113 236 M GLU CA 3 C4H1s 0.770 1.880 2.894 12.558 13.399 0.937 [OK] 4114 236 M GLU C 1 C3H0s 0.770 1.610 2.248 8.040 8.675 0.927 [OK] 4115 236 M GLU O 16 O1H0u 0.660 1.420 2.437 14.663 16.023 0.915 [OK] 4116 236 M GLU CB 8 C4H2s 0.770 1.880 2.759 22.432 23.529 0.953 [OK] 4117 236 M GLU CG 8 C4H2s 0.770 1.880 2.760 20.465 23.513 0.870 [OK] 4118 236 M GLU CD 2 C3H0b 0.770 1.610 2.434 8.849 9.460 0.935 [OK] 4119 236 M GLU OE1 16 O1H0u 0.660 1.420 2.746 24.298 15.999 1.519 [OK] 4120 236 M GLU OE2 16 O1H0u 0.660 1.420 2.802 21.552 17.432 1.236 [OK] 4121 237 M GLN N 12 N3H1s 0.700 1.640 2.474 12.745 13.616 0.936 [OK] 4122 237 M GLN CA 3 C4H1s 0.770 1.880 2.770 13.755 13.334 1.032 [OK] 4123 237 M GLN C 1 C3H0s 0.770 1.610 2.301 8.704 8.787 0.991 [OK] 4124 237 M GLN O 16 O1H0u 0.660 1.420 2.397 16.529 15.993 1.033 [OK] 4125 237 M GLN CB 8 C4H2s 0.770 1.880 2.822 20.861 23.275 0.896 [OK] 4126 237 M GLN CG 8 C4H2s 0.770 1.880 2.862 25.717 23.465 1.096 [OK] 4127 237 M GLN CD 2 C3H0b 0.770 1.610 2.579 10.345 9.659 1.071 [OK] 4128 237 M GLN OE1 16 O1H0u 0.660 1.420 2.454 16.906 17.091 0.989 [OK] 4129 237 M GLN NE2 15 N3H2u 0.700 1.640 2.454 22.888 24.150 0.948 [OK] 4130 238 M ILE N 12 N3H1s 0.700 1.640 2.310 11.952 13.633 0.877 [OK] 4131 238 M ILE CA 3 C4H1s 0.770 1.880 2.549 13.439 13.007 1.033 [OK] 4132 238 M ILE C 1 C3H0s 0.770 1.610 2.730 8.114 8.470 0.958 [OK] 4133 238 M ILE O 16 O1H0u 0.660 1.420 2.546 16.070 16.144 0.995 [OK] 4134 238 M ILE CB 4 C4H1b 0.770 1.880 2.609 12.877 14.227 0.905 [OK] 4135 238 M ILE CG1 9 C4H2b 0.770 1.880 2.706 19.676 24.187 0.814 [OK] 4136 238 M ILE CG2 10 C4H3u 0.770 1.880 3.069 35.041 35.961 0.974 possible 4137 238 M ILE CD1 10 C4H3u 0.770 1.880 3.216 38.486 38.377 1.003 possible 4138 239 M ALA N 12 N3H1s 0.700 1.640 2.833 13.154 14.046 0.937 [OK] 4139 239 M ALA CA 4 C4H1b 0.770 1.880 3.080 17.419 14.063 1.239 possible 4140 239 M ALA C 1 C3H0s 0.770 1.610 2.417 8.493 8.900 0.954 [OK] 4141 239 M ALA O 16 O1H0u 0.660 1.420 3.094 18.350 16.188 1.134 possible 4142 239 M ALA CB 10 C4H3u 0.770 1.880 3.387 38.089 36.782 1.036 possible 4143 240 M ASP N 12 N3H1s 0.700 1.640 2.443 12.438 13.895 0.895 [OK] 4144 240 M ASP CA 3 C4H1s 0.770 1.880 3.651 15.714 13.377 1.175 possible 4145 240 M ASP C 1 C3H0s 0.770 1.610 2.406 8.845 8.816 1.003 [OK] 4146 240 M ASP O 16 O1H0u 0.660 1.420 2.404 14.605 16.091 0.908 [OK] 4147 240 M ASP CB 8 C4H2s 0.770 1.880 2.872 22.798 23.481 0.971 [OK] 4148 240 M ASP CG 2 C3H0b 0.770 1.610 2.707 10.007 9.422 1.062 [OK] 4149 240 M ASP OD1 16 O1H0u 0.660 1.420 3.389 20.540 15.505 1.325 possible 4150 240 M ASP OD2 16 O1H0u 0.660 1.420 2.683 19.103 16.324 1.170 [OK] 4151 241 M ARG N 12 N3H1s 0.700 1.640 2.676 13.270 13.650 0.972 [OK] 4152 241 M ARG CA 3 C4H1s 0.770 1.880 2.826 13.193 13.422 0.983 [OK] 4153 241 M ARG C 1 C3H0s 0.770 1.610 2.678 8.309 8.838 0.940 [OK] 4154 241 M ARG O 16 O1H0u 0.660 1.420 2.590 17.546 16.084 1.091 [OK] 4155 241 M ARG CB 8 C4H2s 0.770 1.880 3.192 23.474 23.088 1.017 possible 4156 241 M ARG CG 8 C4H2s 0.770 1.880 3.017 24.253 23.640 1.026 possible 4157 241 M ARG CD 8 C4H2s 0.770 1.880 2.751 23.866 23.300 1.024 [OK] 4158 241 M ARG NE 13 N3H1b 0.700 1.640 2.784 15.007 15.569 0.964 [OK] 4159 241 M ARG CZ 2 C3H0b 0.770 1.610 2.829 10.798 9.747 1.108 [OK] 4160 241 M ARG NH1 15 N3H2u 0.700 1.640 4.197 39.405 22.782 1.730 possible 4161 241 M ARG NH2 15 N3H2u 0.700 1.640 2.862 24.049 23.810 1.010 [OK] 4162 242 M GLY N 12 N3H1s 0.700 1.640 2.519 15.524 14.854 1.045 [OK] 4163 242 M GLY CA 8 C4H2s 0.770 1.880 2.666 21.798 23.688 0.920 [OK] 4164 242 M GLY C 2 C3H0b 0.770 1.610 2.667 9.724 9.840 0.988 [OK] 4165 242 M GLY O 16 O1H0u 0.660 1.420 2.605 15.407 16.391 0.940 [OK] 4166 243 M THR N 12 N3H1s 0.700 1.640 2.205 12.915 13.832 0.934 [OK] 4167 243 M THR CA 3 C4H1s 0.770 1.880 2.613 13.143 13.099 1.003 [OK] 4168 243 M THR C 1 C3H0s 0.770 1.610 2.514 8.277 8.738 0.947 [OK] 4169 243 M THR O 16 O1H0u 0.660 1.420 2.471 14.756 16.020 0.921 [OK] 4170 243 M THR CB 4 C4H1b 0.770 1.880 2.652 13.682 14.829 0.923 [OK] 4171 243 M THR OG1 17 O2H1u 0.660 1.460 2.627 18.869 18.123 1.041 [OK] 4172 243 M THR CG2 10 C4H3u 0.770 1.880 3.172 38.749 36.542 1.060 possible 4173 244 M ALA N 12 N3H1s 0.700 1.640 2.439 13.452 14.046 0.958 [OK] 4174 244 M ALA CA 4 C4H1b 0.770 1.880 2.894 14.544 14.063 1.034 [OK] 4175 244 M ALA C 1 C3H0s 0.770 1.610 2.650 8.586 8.900 0.965 [OK] 4176 244 M ALA O 16 O1H0u 0.660 1.420 2.538 16.150 16.188 0.998 [OK] 4177 244 M ALA CB 10 C4H3u 0.770 1.880 2.887 32.518 36.782 0.884 [OK] 4178 245 M ALA N 12 N3H1s 0.700 1.640 2.503 13.922 14.046 0.991 [OK] 4179 245 M ALA CA 4 C4H1b 0.770 1.880 3.124 15.045 14.063 1.070 possible 4180 245 M ALA C 1 C3H0s 0.770 1.610 2.377 8.513 8.900 0.957 [OK] 4181 245 M ALA O 16 O1H0u 0.660 1.420 2.665 16.837 16.188 1.040 [OK] 4182 245 M ALA CB 10 C4H3u 0.770 1.880 3.155 37.217 36.782 1.012 possible 4183 246 M GLU N 12 N3H1s 0.700 1.640 2.515 13.459 13.615 0.989 [OK] 4184 246 M GLU CA 3 C4H1s 0.770 1.880 2.746 13.499 13.399 1.007 [OK] 4185 246 M GLU C 1 C3H0s 0.770 1.610 2.731 8.929 8.675 1.029 [OK] 4186 246 M GLU O 16 O1H0u 0.660 1.420 2.454 15.583 16.023 0.973 [OK] 4187 246 M GLU CB 8 C4H2s 0.770 1.880 2.775 21.619 23.529 0.919 [OK] 4188 246 M GLU CG 8 C4H2s 0.770 1.880 2.787 21.984 23.513 0.935 [OK] 4189 246 M GLU CD 2 C3H0b 0.770 1.610 2.507 8.452 9.460 0.893 [OK] 4190 246 M GLU OE1 16 O1H0u 0.660 1.420 2.233 14.488 15.999 0.906 [OK] 4191 246 M GLU OE2 16 O1H0u 0.660 1.420 2.546 15.335 17.432 0.880 [OK] 4192 247 M ARG N 12 N3H1s 0.700 1.640 2.815 13.334 13.650 0.977 [OK] 4193 247 M ARG CA 3 C4H1s 0.770 1.880 3.030 15.175 13.422 1.131 possible 4194 247 M ARG C 1 C3H0s 0.770 1.610 2.617 8.945 8.838 1.012 [OK] 4195 247 M ARG O 16 O1H0u 0.660 1.420 2.540 17.617 16.084 1.095 [OK] 4196 247 M ARG CB 8 C4H2s 0.770 1.880 2.918 24.482 23.088 1.060 [OK] 4197 247 M ARG CG 8 C4H2s 0.770 1.880 3.095 22.735 23.640 0.962 possible 4198 247 M ARG CD 8 C4H2s 0.770 1.880 3.072 21.830 23.300 0.937 possible 4199 247 M ARG NE 13 N3H1b 0.700 1.640 2.845 15.340 15.569 0.985 [OK] 4200 247 M ARG CZ 2 C3H0b 0.770 1.610 2.814 10.245 9.747 1.051 [OK] 4201 247 M ARG NH1 15 N3H2u 0.700 1.640 2.942 21.336 22.782 0.937 [OK] 4202 247 M ARG NH2 15 N3H2u 0.700 1.640 2.554 23.371 23.810 0.982 [OK] 4203 248 M ALA N 12 N3H1s 0.700 1.640 2.714 13.528 14.046 0.963 [OK] 4204 248 M ALA CA 4 C4H1b 0.770 1.880 3.229 17.030 14.063 1.211 possible 4205 248 M ALA C 1 C3H0s 0.770 1.610 2.297 8.484 8.900 0.953 [OK] 4206 248 M ALA O 16 O1H0u 0.660 1.420 2.588 17.522 16.188 1.082 [OK] 4207 248 M ALA CB 10 C4H3u 0.770 1.880 3.065 36.639 36.782 0.996 possible 4208 249 M ALA N 12 N3H1s 0.700 1.640 2.335 12.784 14.046 0.910 [OK] 4209 249 M ALA CA 4 C4H1b 0.770 1.880 2.763 13.742 14.063 0.977 [OK] 4210 249 M ALA C 1 C3H0s 0.770 1.610 2.598 8.867 8.900 0.996 [OK] 4211 249 M ALA O 16 O1H0u 0.660 1.420 2.447 15.563 16.188 0.961 [OK] 4212 249 M ALA CB 10 C4H3u 0.770 1.880 2.852 36.055 36.782 0.980 [OK] 4213 250 M LEU N 12 N3H1s 0.700 1.640 2.575 13.061 13.655 0.957 [OK] 4214 250 M LEU CA 3 C4H1s 0.770 1.880 2.763 12.005 13.122 0.915 [OK] 4215 250 M LEU C 1 C3H0s 0.770 1.610 2.298 8.526 8.825 0.966 [OK] 4216 250 M LEU O 16 O1H0u 0.660 1.420 2.339 15.467 16.208 0.954 [OK] 4217 250 M LEU CB 8 C4H2s 0.770 1.880 2.765 23.260 22.951 1.013 [OK] 4218 250 M LEU CG 4 C4H1b 0.770 1.880 2.849 14.685 14.764 0.995 [OK] 4219 250 M LEU CD1 10 C4H3u 0.770 1.880 3.020 36.965 37.425 0.988 possible 4220 250 M LEU CD2 10 C4H3u 0.770 1.880 2.981 33.442 37.143 0.900 [OK] 4221 251 M PHE N 12 N3H1s 0.700 1.640 2.284 12.713 13.691 0.929 [OK] 4222 251 M PHE CA 3 C4H1s 0.770 1.880 2.551 12.729 13.449 0.947 [OK] 4223 251 M PHE C 1 C3H0s 0.770 1.610 2.195 7.611 8.753 0.870 [OK] 4224 251 M PHE O 16 O1H0u 0.660 1.420 2.233 14.279 16.151 0.884 [OK] 4225 251 M PHE CB 8 C4H2s 0.770 1.880 3.229 26.152 23.777 1.100 possible 4226 251 M PHE CG 2 C3H0b 0.770 1.610 2.667 10.214 9.721 1.051 [OK] 4227 251 M PHE CD1 5 C3H1s 0.770 1.760 2.853 20.502 20.405 1.005 [OK] 4228 251 M PHE CD2 6 C3H1b 0.770 1.760 2.860 17.962 21.051 0.853 [OK] 4229 251 M PHE CE1 6 C3H1b 0.770 1.760 2.837 20.141 21.580 0.933 [OK] 4230 251 M PHE CE2 6 C3H1b 0.770 1.760 2.597 19.193 21.680 0.885 [OK] 4231 251 M PHE CZ 6 C3H1b 0.770 1.760 2.758 19.269 21.666 0.889 [OK] 4232 252 M TRP N 12 N3H1s 0.700 1.640 2.301 12.891 13.791 0.935 [OK] 4233 252 M TRP CA 3 C4H1s 0.770 1.880 2.598 12.432 13.377 0.929 [OK] 4234 252 M TRP C 1 C3H0s 0.770 1.610 2.229 8.234 8.724 0.944 [OK] 4235 252 M TRP O 16 O1H0u 0.660 1.420 2.245 14.526 15.951 0.911 [OK] 4236 252 M TRP CB 8 C4H2s 0.770 1.880 2.814 24.166 24.004 1.007 [OK] 4237 252 M TRP CG 2 C3H0b 0.770 1.610 2.150 8.386 9.965 0.842 [OK] 4238 252 M TRP CD1 5 C3H1s 0.770 1.760 2.874 18.002 20.874 0.862 [OK] 4239 252 M TRP CD2 2 C3H0b 0.770 1.610 2.339 9.386 10.097 0.930 [OK] 4240 252 M TRP NE1 13 N3H1b 0.700 1.640 2.820 15.417 16.969 0.909 [OK] 4241 252 M TRP CE2 2 C3H0b 0.770 1.610 2.295 9.478 9.889 0.958 [OK] 4242 252 M TRP CE3 6 C3H1b 0.770 1.760 2.734 19.804 20.448 0.968 [OK] 4243 252 M TRP CZ2 6 C3H1b 0.770 1.760 2.653 19.531 21.012 0.929 [OK] 4244 252 M TRP CZ3 6 C3H1b 0.770 1.760 2.790 20.110 21.516 0.935 [OK] 4245 252 M TRP CH2 6 C3H1b 0.770 1.760 2.659 18.033 21.339 0.845 [OK] 4246 253 M ARG N 12 N3H1s 0.700 1.640 2.276 13.459 13.650 0.986 [OK] 4247 253 M ARG CA 3 C4H1s 0.770 1.880 2.639 13.909 13.422 1.036 [OK] 4248 253 M ARG C 1 C3H0s 0.770 1.610 2.297 7.662 8.838 0.867 [OK] 4249 253 M ARG O 16 O1H0u 0.660 1.420 2.455 16.481 16.084 1.025 [OK] 4250 253 M ARG CB 8 C4H2s 0.770 1.880 2.954 23.605 23.088 1.022 [OK] 4251 253 M ARG CG 8 C4H2s 0.770 1.880 2.800 23.037 23.640 0.975 [OK] 4252 253 M ARG CD 8 C4H2s 0.770 1.880 2.749 22.192 23.300 0.952 [OK] 4253 253 M ARG NE 13 N3H1b 0.700 1.640 2.602 14.925 15.569 0.959 [OK] 4254 253 M ARG CZ 2 C3H0b 0.770 1.610 2.829 10.475 9.747 1.075 [OK] 4255 253 M ARG NH1 15 N3H2u 0.700 1.640 4.311 33.923 22.782 1.489 possible 4256 253 M ARG NH2 15 N3H2u 0.700 1.640 4.857 35.692 23.810 1.499 possible 4257 254 M TRP N 12 N3H1s 0.700 1.640 2.328 11.973 13.791 0.868 [OK] 4258 254 M TRP CA 3 C4H1s 0.770 1.880 2.608 12.177 13.377 0.910 [OK] 4259 254 M TRP C 1 C3H0s 0.770 1.610 2.424 8.412 8.724 0.964 [OK] 4260 254 M TRP O 16 O1H0u 0.660 1.420 2.441 15.592 15.951 0.977 [OK] 4261 254 M TRP CB 8 C4H2s 0.770 1.880 2.751 22.084 24.004 0.920 [OK] 4262 254 M TRP CG 2 C3H0b 0.770 1.610 2.514 9.556 9.965 0.959 [OK] 4263 254 M TRP CD1 5 C3H1s 0.770 1.760 2.737 19.351 20.874 0.927 [OK] 4264 254 M TRP CD2 2 C3H0b 0.770 1.610 2.491 10.190 10.097 1.009 [OK] 4265 254 M TRP NE1 13 N3H1b 0.700 1.640 2.615 16.565 16.969 0.976 [OK] 4266 254 M TRP CE2 2 C3H0b 0.770 1.610 2.459 9.631 9.889 0.974 [OK] 4267 254 M TRP CE3 6 C3H1b 0.770 1.760 3.356 25.217 20.448 1.233 possible 4268 254 M TRP CZ2 6 C3H1b 0.770 1.760 2.823 21.399 21.012 1.018 [OK] 4269 254 M TRP CZ3 6 C3H1b 0.770 1.760 2.879 20.648 21.516 0.960 [OK] 4270 254 M TRP CH2 6 C3H1b 0.770 1.760 2.818 20.958 21.339 0.982 [OK] 4271 255 M THR N 12 N3H1s 0.700 1.640 2.363 12.176 13.832 0.880 [OK] 4272 255 M THR CA 3 C4H1s 0.770 1.880 2.698 12.648 13.099 0.966 [OK] 4273 255 M THR C 1 C3H0s 0.770 1.610 2.635 8.676 8.738 0.993 [OK] 4274 255 M THR O 16 O1H0u 0.660 1.420 2.793 16.904 16.020 1.055 [OK] 4275 255 M THR CB 4 C4H1b 0.770 1.880 2.668 13.867 14.829 0.935 [OK] 4276 255 M THR OG1 17 O2H1u 0.660 1.460 2.461 19.317 18.123 1.066 [OK] 4277 255 M THR CG2 10 C4H3u 0.770 1.880 2.911 36.096 36.542 0.988 [OK] 4278 256 M MET N 12 N3H1s 0.700 1.640 2.442 12.289 13.564 0.906 [OK] 4279 256 M MET CA 3 C4H1s 0.770 1.880 2.930 14.069 13.231 1.063 [OK] 4280 256 M MET C 1 C3H0s 0.770 1.610 2.387 8.814 8.782 1.004 [OK] 4281 256 M MET O 16 O1H0u 0.660 1.420 4.287 28.143 16.277 1.729 possible 4282 256 M MET CB 8 C4H2s 0.770 1.880 3.011 25.166 23.645 1.064 possible 4283 256 M MET CG 9 C4H2b 0.770 1.880 2.936 22.455 24.009 0.935 [OK] 4284 256 M MET SD 19 S2H0u 1.040 1.770 2.819 27.526 30.093 0.915 [OK] 4285 256 M MET CE 10 C4H3u 0.770 1.880 2.814 33.517 37.161 0.902 [OK] 4286 257 M GLY N 12 N3H1s 0.700 1.640 2.712 14.769 14.854 0.994 [OK] 4287 257 M GLY CA 8 C4H2s 0.770 1.880 4.167 25.049 23.688 1.057 possible 4288 257 M GLY C 2 C3H0b 0.770 1.610 4.120 12.241 9.840 1.244 possible 4289 257 M GLY O 16 O1H0u 0.660 1.420 6.263 55.492 16.391 3.386 possible 4290 258 M PHE N 12 N3H1s 0.700 1.640 2.519 13.726 13.691 1.003 [OK] 4291 258 M PHE CA 3 C4H1s 0.770 1.880 3.354 16.547 13.449 1.230 possible 4292 258 M PHE C 1 C3H0s 0.770 1.610 2.544 9.240 8.753 1.056 [OK] 4293 258 M PHE O 16 O1H0u 0.660 1.420 2.396 16.888 16.151 1.046 [OK] 4294 258 M PHE CB 8 C4H2s 0.770 1.880 4.250 30.756 23.777 1.294 possible 4295 258 M PHE CG 2 C3H0b 0.770 1.610 2.474 9.592 9.721 0.987 [OK] 4296 258 M PHE CD1 5 C3H1s 0.770 1.760 3.929 23.624 20.405 1.158 possible 4297 258 M PHE CD2 6 C3H1b 0.770 1.760 2.737 20.639 21.051 0.980 [OK] 4298 258 M PHE CE1 6 C3H1b 0.770 1.760 3.937 24.422 21.580 1.132 possible 4299 258 M PHE CE2 6 C3H1b 0.770 1.760 2.741 20.861 21.680 0.962 [OK] 4300 258 M PHE CZ 6 C3H1b 0.770 1.760 2.737 20.781 21.666 0.959 [OK] 4301 259 M ASN N 12 N3H1s 0.700 1.640 2.525 13.521 13.695 0.987 [OK] 4302 259 M ASN CA 3 C4H1s 0.770 1.880 2.812 13.258 13.167 1.007 [OK] 4303 259 M ASN C 1 C3H0s 0.770 1.610 2.350 8.361 8.928 0.937 [OK] 4304 259 M ASN O 16 O1H0u 0.660 1.420 2.588 18.693 16.199 1.154 [OK] 4305 259 M ASN CB 8 C4H2s 0.770 1.880 2.693 21.613 23.128 0.934 [OK] 4306 259 M ASN CG 2 C3H0b 0.770 1.610 2.611 9.547 9.599 0.995 [OK] 4307 259 M ASN OD1 16 O1H0u 0.660 1.420 2.575 19.253 16.664 1.155 [OK] 4308 259 M ASN ND2 15 N3H2u 0.700 1.640 2.738 23.951 23.083 1.038 [OK] 4309 260 M ALA N 12 N3H1s 0.700 1.640 2.463 12.089 14.046 0.861 [OK] 4310 260 M ALA CA 4 C4H1b 0.770 1.880 2.725 12.943 14.063 0.920 [OK] 4311 260 M ALA C 1 C3H0s 0.770 1.610 2.678 9.801 8.900 1.101 [OK] 4312 260 M ALA O 16 O1H0u 0.660 1.420 2.446 14.781 16.188 0.913 [OK] 4313 260 M ALA CB 10 C4H3u 0.770 1.880 2.713 32.365 36.782 0.880 [OK] 4314 261 M THR N 12 N3H1s 0.700 1.640 2.380 11.888 13.832 0.859 [OK] 4315 261 M THR CA 3 C4H1s 0.770 1.880 2.887 13.679 13.099 1.044 [OK] 4316 261 M THR C 1 C3H0s 0.770 1.610 2.383 8.589 8.738 0.983 [OK] 4317 261 M THR O 16 O1H0u 0.660 1.420 2.294 14.306 16.020 0.893 [OK] 4318 261 M THR CB 4 C4H1b 0.770 1.880 3.011 14.217 14.829 0.959 possible 4319 261 M THR OG1 17 O2H1u 0.660 1.460 2.450 16.362 18.123 0.903 [OK] 4320 261 M THR CG2 10 C4H3u 0.770 1.880 3.027 33.656 36.542 0.921 possible 4321 262 M MET N 12 N3H1s 0.700 1.640 2.931 13.579 13.564 1.001 [OK] 4322 262 M MET CA 3 C4H1s 0.770 1.880 3.063 14.750 13.231 1.115 possible 4323 262 M MET C 1 C3H0s 0.770 1.610 2.169 8.199 8.782 0.934 [OK] 4324 262 M MET O 16 O1H0u 0.660 1.420 2.495 16.991 16.277 1.044 [OK] 4325 262 M MET CB 8 C4H2s 0.770 1.880 3.155 24.694 23.645 1.044 possible 4326 262 M MET CG 9 C4H2b 0.770 1.880 2.870 21.790 24.009 0.908 [OK] 4327 262 M MET SD 19 S2H0u 1.040 1.770 2.979 29.389 30.093 0.977 [OK] 4328 262 M MET CE 10 C4H3u 0.770 1.880 3.155 42.595 37.161 1.146 possible 4329 263 M GLU N 12 N3H1s 0.700 1.640 2.452 12.204 13.615 0.896 [OK] 4330 263 M GLU CA 3 C4H1s 0.770 1.880 3.178 12.939 13.399 0.966 possible 4331 263 M GLU C 1 C3H0s 0.770 1.610 2.383 8.618 8.675 0.993 [OK] 4332 263 M GLU O 16 O1H0u 0.660 1.420 2.728 17.615 16.023 1.099 [OK] 4333 263 M GLU CB 8 C4H2s 0.770 1.880 2.648 21.041 23.529 0.894 [OK] 4334 263 M GLU CG 8 C4H2s 0.770 1.880 3.206 25.409 23.513 1.081 possible 4335 263 M GLU CD 2 C3H0b 0.770 1.610 2.634 9.988 9.460 1.056 [OK] 4336 263 M GLU OE1 16 O1H0u 0.660 1.420 2.511 16.538 15.999 1.034 [OK] 4337 263 M GLU OE2 16 O1H0u 0.660 1.420 2.459 17.012 17.432 0.976 [OK] 4338 264 M GLY N 12 N3H1s 0.700 1.640 2.302 13.261 14.854 0.893 [OK] 4339 264 M GLY CA 8 C4H2s 0.770 1.880 3.089 25.054 23.688 1.058 possible 4340 264 M GLY C 2 C3H0b 0.770 1.610 2.391 8.763 9.840 0.891 [OK] 4341 264 M GLY O 16 O1H0u 0.660 1.420 2.665 15.935 16.391 0.972 [OK] 4342 265 M ILE N 12 N3H1s 0.700 1.640 2.457 13.378 13.633 0.981 [OK] 4343 265 M ILE CA 3 C4H1s 0.770 1.880 2.558 12.384 13.007 0.952 [OK] 4344 265 M ILE C 1 C3H0s 0.770 1.610 2.866 8.478 8.470 1.001 [OK] 4345 265 M ILE O 16 O1H0u 0.660 1.420 2.912 17.277 16.144 1.070 [OK] 4346 265 M ILE CB 4 C4H1b 0.770 1.880 2.714 13.791 14.227 0.969 [OK] 4347 265 M ILE CG1 9 C4H2b 0.770 1.880 3.393 24.835 24.187 1.027 possible 4348 265 M ILE CG2 10 C4H3u 0.770 1.880 3.095 31.516 35.961 0.876 possible 4349 265 M ILE CD1 10 C4H3u 0.770 1.880 3.236 33.196 38.377 0.865 possible 4350 266 M HIS N 12 N3H1s 0.700 1.640 2.550 12.574 13.715 0.917 [OK] 4351 266 M HIS CA 3 C4H1s 0.770 1.880 3.008 13.592 13.467 1.009 possible 4352 266 M HIS C 1 C3H0s 0.770 1.610 2.151 8.705 8.882 0.980 [OK] 4353 266 M HIS O 16 O1H0u 0.660 1.420 2.243 14.632 16.082 0.910 [OK] 4354 266 M HIS CB 8 C4H2s 0.770 1.880 2.947 23.609 23.653 0.998 [OK] 4355 266 M HIS CG 2 C3H0b 0.770 1.610 2.521 9.171 9.952 0.922 [OK] 4356 266 M HIS ND1 13 N3H1b 0.700 1.640 2.950 16.268 15.506 1.049 [OK] 4357 266 M HIS CD2 5 C3H1s 0.770 1.760 3.175 23.556 21.085 1.117 possible 4358 266 M HIS CE1 5 C3H1s 0.770 1.760 2.851 20.554 20.636 0.996 [OK] 4359 266 M HIS NE2 13 N3H1b 0.700 1.640 2.531 11.131 15.337 0.726 [OK] 4360 267 M ARG N 12 N3H1s 0.700 1.640 2.347 12.672 13.650 0.928 [OK] 4361 267 M ARG CA 3 C4H1s 0.770 1.880 2.963 13.306 13.422 0.991 [OK] 4362 267 M ARG C 1 C3H0s 0.770 1.610 2.211 8.440 8.838 0.955 [OK] 4363 267 M ARG O 16 O1H0u 0.660 1.420 2.298 14.443 16.084 0.898 [OK] 4364 267 M ARG CB 8 C4H2s 0.770 1.880 3.265 23.797 23.088 1.031 possible 4365 267 M ARG CG 8 C4H2s 0.770 1.880 2.866 22.384 23.640 0.947 [OK] 4366 267 M ARG CD 8 C4H2s 0.770 1.880 3.252 24.827 23.300 1.066 possible 4367 267 M ARG NE 13 N3H1b 0.700 1.640 2.683 16.955 15.569 1.089 [OK] 4368 267 M ARG CZ 2 C3H0b 0.770 1.610 3.008 10.752 9.747 1.103 possible 4369 267 M ARG NH1 15 N3H2u 0.700 1.640 5.255 38.723 22.782 1.700 possible 4370 267 M ARG NH2 15 N3H2u 0.700 1.640 5.239 34.135 23.810 1.434 possible 4371 268 M TRP N 12 N3H1s 0.700 1.640 2.773 14.459 13.791 1.048 [OK] 4372 268 M TRP CA 3 C4H1s 0.770 1.880 2.850 14.991 13.377 1.121 [OK] 4373 268 M TRP C 1 C3H0s 0.770 1.610 2.191 7.942 8.724 0.910 [OK] 4374 268 M TRP O 16 O1H0u 0.660 1.420 2.748 17.638 15.951 1.106 [OK] 4375 268 M TRP CB 8 C4H2s 0.770 1.880 3.068 23.715 24.004 0.988 possible 4376 268 M TRP CG 2 C3H0b 0.770 1.610 2.536 9.737 9.965 0.977 [OK] 4377 268 M TRP CD1 5 C3H1s 0.770 1.760 2.884 20.829 20.874 0.998 [OK] 4378 268 M TRP CD2 2 C3H0b 0.770 1.610 2.512 9.602 10.097 0.951 [OK] 4379 268 M TRP NE1 13 N3H1b 0.700 1.640 2.562 15.260 16.969 0.899 [OK] 4380 268 M TRP CE2 2 C3H0b 0.770 1.610 2.448 9.493 9.889 0.960 [OK] 4381 268 M TRP CE3 6 C3H1b 0.770 1.760 3.156 21.477 20.448 1.050 possible 4382 268 M TRP CZ2 6 C3H1b 0.770 1.760 2.872 24.029 21.012 1.144 [OK] 4383 268 M TRP CZ3 6 C3H1b 0.770 1.760 2.806 22.846 21.516 1.062 [OK] 4384 268 M TRP CH2 6 C3H1b 0.770 1.760 2.990 25.999 21.339 1.218 [OK] 4385 269 M ALA N 12 N3H1s 0.700 1.640 2.663 13.312 14.046 0.948 [OK] 4386 269 M ALA CA 4 C4H1b 0.770 1.880 2.634 13.654 14.063 0.971 [OK] 4387 269 M ALA C 1 C3H0s 0.770 1.610 2.480 8.886 8.900 0.998 [OK] 4388 269 M ALA O 16 O1H0u 0.660 1.420 2.324 15.757 16.188 0.973 [OK] 4389 269 M ALA CB 10 C4H3u 0.770 1.880 3.393 43.745 36.782 1.189 possible 4390 270 M ILE N 12 N3H1s 0.700 1.640 2.573 13.740 13.633 1.008 [OK] 4391 270 M ILE CA 3 C4H1s 0.770 1.880 2.809 14.516 13.007 1.116 [OK] 4392 270 M ILE C 1 C3H0s 0.770 1.610 2.826 8.395 8.470 0.991 [OK] 4393 270 M ILE O 16 O1H0u 0.660 1.420 2.705 15.496 16.144 0.960 [OK] 4394 270 M ILE CB 4 C4H1b 0.770 1.880 2.695 14.349 14.227 1.009 [OK] 4395 270 M ILE CG1 9 C4H2b 0.770 1.880 3.006 25.011 24.187 1.034 possible 4396 270 M ILE CG2 10 C4H3u 0.770 1.880 3.133 33.727 35.961 0.938 possible 4397 270 M ILE CD1 10 C4H3u 0.770 1.880 3.054 36.652 38.377 0.955 possible 4398 271 M TRP N 12 N3H1s 0.700 1.640 2.844 12.788 13.791 0.927 [OK] 4399 271 M TRP CA 3 C4H1s 0.770 1.880 3.133 13.431 13.377 1.004 possible 4400 271 M TRP C 1 C3H0s 0.770 1.610 2.326 8.637 8.724 0.990 [OK] 4401 271 M TRP O 16 O1H0u 0.660 1.420 2.308 14.161 15.951 0.888 [OK] 4402 271 M TRP CB 8 C4H2s 0.770 1.880 2.865 23.855 24.004 0.994 [OK] 4403 271 M TRP CG 2 C3H0b 0.770 1.610 2.812 9.911 9.965 0.995 [OK] 4404 271 M TRP CD1 5 C3H1s 0.770 1.760 2.724 20.839 20.874 0.998 [OK] 4405 271 M TRP CD2 2 C3H0b 0.770 1.610 2.885 10.593 10.097 1.049 [OK] 4406 271 M TRP NE1 13 N3H1b 0.700 1.640 3.079 18.393 16.969 1.084 possible 4407 271 M TRP CE2 2 C3H0b 0.770 1.610 2.623 9.537 9.889 0.964 [OK] 4408 271 M TRP CE3 6 C3H1b 0.770 1.760 2.854 21.151 20.448 1.034 [OK] 4409 271 M TRP CZ2 6 C3H1b 0.770 1.760 12.602 -1.000 21.012 -1.000 bad 4410 271 M TRP CZ3 6 C3H1b 0.770 1.760 3.495 25.039 21.516 1.164 possible 4411 271 M TRP CH2 6 C3H1b 0.770 1.760 7.857 57.650 21.339 2.702 possible 4412 272 M MET N 12 N3H1s 0.700 1.640 2.463 13.545 13.564 0.999 [OK] 4413 272 M MET CA 3 C4H1s 0.770 1.880 2.906 15.330 13.231 1.159 [OK] 4414 272 M MET C 1 C3H0s 0.770 1.610 2.208 7.827 8.782 0.891 [OK] 4415 272 M MET O 16 O1H0u 0.660 1.420 2.356 17.561 16.277 1.079 [OK] 4416 272 M MET CB 8 C4H2s 0.770 1.880 3.124 22.470 23.645 0.950 possible 4417 272 M MET CG 9 C4H2b 0.770 1.880 2.649 22.202 24.009 0.925 [OK] 4418 272 M MET SD 19 S2H0u 1.040 1.770 3.184 29.885 30.093 0.993 possible 4419 272 M MET CE 10 C4H3u 0.770 1.880 3.294 40.518 37.161 1.090 possible 4420 273 M ALA N 12 N3H1s 0.700 1.640 2.366 13.680 14.046 0.974 [OK] 4421 273 M ALA CA 4 C4H1b 0.770 1.880 2.731 13.862 14.063 0.986 [OK] 4422 273 M ALA C 1 C3H0s 0.770 1.610 2.344 8.268 8.900 0.929 [OK] 4423 273 M ALA O 16 O1H0u 0.660 1.420 2.655 16.154 16.188 0.998 [OK] 4424 273 M ALA CB 10 C4H3u 0.770 1.880 2.889 33.817 36.782 0.919 [OK] 4425 274 M VAL N 12 N3H1s 0.700 1.640 2.550 13.243 13.676 0.968 [OK] 4426 274 M VAL CA 3 C4H1s 0.770 1.880 2.634 12.492 13.123 0.952 [OK] 4427 274 M VAL C 1 C3H0s 0.770 1.610 2.384 7.845 8.563 0.916 [OK] 4428 274 M VAL O 16 O1H0u 0.660 1.420 2.252 13.903 16.181 0.859 [OK] 4429 274 M VAL CB 4 C4H1b 0.770 1.880 3.155 14.451 14.598 0.990 possible 4430 274 M VAL CG1 10 C4H3u 0.770 1.880 3.095 36.357 36.584 0.994 possible 4431 274 M VAL CG2 10 C4H3u 0.770 1.880 3.022 36.148 36.332 0.995 possible 4432 275 M LEU N 12 N3H1s 0.700 1.640 2.537 13.010 13.655 0.953 [OK] 4433 275 M LEU CA 3 C4H1s 0.770 1.880 2.661 12.227 13.122 0.932 [OK] 4434 275 M LEU C 1 C3H0s 0.770 1.610 2.213 8.599 8.825 0.974 [OK] 4435 275 M LEU O 16 O1H0u 0.660 1.420 2.413 14.445 16.208 0.891 [OK] 4436 275 M LEU CB 8 C4H2s 0.770 1.880 2.737 21.118 22.951 0.920 [OK] 4437 275 M LEU CG 4 C4H1b 0.770 1.880 2.719 13.167 14.764 0.892 [OK] 4438 275 M LEU CD1 10 C4H3u 0.770 1.880 3.064 35.442 37.425 0.947 possible 4439 275 M LEU CD2 10 C4H3u 0.770 1.880 3.265 40.336 37.143 1.086 possible 4440 276 M VAL N 12 N3H1s 0.700 1.640 2.327 13.288 13.676 0.972 [OK] 4441 276 M VAL CA 3 C4H1s 0.770 1.880 2.748 14.199 13.123 1.082 [OK] 4442 276 M VAL C 1 C3H0s 0.770 1.610 2.562 7.678 8.563 0.897 [OK] 4443 276 M VAL O 16 O1H0u 0.660 1.420 2.676 15.872 16.181 0.981 [OK] 4444 276 M VAL CB 4 C4H1b 0.770 1.880 3.088 15.719 14.598 1.077 possible 4445 276 M VAL CG1 10 C4H3u 0.770 1.880 2.983 37.043 36.584 1.013 [OK] 4446 276 M VAL CG2 10 C4H3u 0.770 1.880 2.926 33.108 36.332 0.911 [OK] 4447 277 M THR N 12 N3H1s 0.700 1.640 2.564 12.696 13.832 0.918 [OK] 4448 277 M THR CA 3 C4H1s 0.770 1.880 3.077 14.221 13.099 1.086 possible 4449 277 M THR C 1 C3H0s 0.770 1.610 2.629 9.148 8.738 1.047 [OK] 4450 277 M THR O 16 O1H0u 0.660 1.420 2.426 16.142 16.020 1.008 [OK] 4451 277 M THR CB 4 C4H1b 0.770 1.880 2.719 14.028 14.829 0.946 [OK] 4452 277 M THR OG1 17 O2H1u 0.660 1.460 2.394 16.890 18.123 0.932 [OK] 4453 277 M THR CG2 10 C4H3u 0.770 1.880 2.980 36.137 36.542 0.989 [OK] 4454 278 M LEU N 12 N3H1s 0.700 1.640 2.733 13.066 13.655 0.957 [OK] 4455 278 M LEU CA 3 C4H1s 0.770 1.880 2.973 13.012 13.122 0.992 [OK] 4456 278 M LEU C 1 C3H0s 0.770 1.610 3.073 9.066 8.825 1.027 possible 4457 278 M LEU O 16 O1H0u 0.660 1.420 2.553 16.362 16.208 1.010 [OK] 4458 278 M LEU CB 8 C4H2s 0.770 1.880 3.035 21.242 22.951 0.926 possible 4459 278 M LEU CG 4 C4H1b 0.770 1.880 4.888 24.592 14.764 1.666 possible 4460 278 M LEU CD1 10 C4H3u 0.770 1.880 6.921 64.598 37.425 1.726 possible 4461 278 M LEU CD2 10 C4H3u 0.770 1.880 5.604 63.217 37.143 1.702 possible 4462 279 M THR N 12 N3H1s 0.700 1.640 3.156 13.686 13.832 0.989 possible 4463 279 M THR CA 3 C4H1s 0.770 1.880 3.194 15.230 13.099 1.163 possible 4464 279 M THR C 1 C3H0s 0.770 1.610 2.448 8.688 8.738 0.994 [OK] 4465 279 M THR O 16 O1H0u 0.660 1.420 2.538 15.936 16.020 0.995 [OK] 4466 279 M THR CB 4 C4H1b 0.770 1.880 2.710 14.968 14.829 1.009 [OK] 4467 279 M THR OG1 17 O2H1u 0.660 1.460 2.365 15.949 18.123 0.880 [OK] 4468 279 M THR CG2 10 C4H3u 0.770 1.880 3.358 36.742 36.542 1.005 possible 4469 280 M GLY N 12 N3H1s 0.700 1.640 2.504 13.290 14.854 0.895 [OK] 4470 280 M GLY CA 8 C4H2s 0.770 1.880 2.986 22.953 23.688 0.969 [OK] 4471 280 M GLY C 2 C3H0b 0.770 1.610 2.272 8.825 9.840 0.897 [OK] 4472 280 M GLY O 16 O1H0u 0.660 1.420 2.530 15.587 16.391 0.951 [OK] 4473 281 M GLY N 12 N3H1s 0.700 1.640 2.438 13.365 14.854 0.900 [OK] 4474 281 M GLY CA 8 C4H2s 0.770 1.880 2.853 24.069 23.688 1.016 [OK] 4475 281 M GLY C 2 C3H0b 0.770 1.610 2.314 8.837 9.840 0.898 [OK] 4476 281 M GLY O 16 O1H0u 0.660 1.420 2.345 15.162 16.391 0.925 [OK] 4477 282 M ILE N 12 N3H1s 0.700 1.640 2.245 12.896 13.633 0.946 [OK] 4478 282 M ILE CA 3 C4H1s 0.770 1.880 3.233 15.506 13.007 1.192 possible 4479 282 M ILE C 1 C3H0s 0.770 1.610 2.441 8.055 8.470 0.951 [OK] 4480 282 M ILE O 16 O1H0u 0.660 1.420 2.878 15.470 16.144 0.958 [OK] 4481 282 M ILE CB 4 C4H1b 0.770 1.880 2.690 14.075 14.227 0.989 [OK] 4482 282 M ILE CG1 9 C4H2b 0.770 1.880 7.269 42.880 24.187 1.773 possible 4483 282 M ILE CG2 10 C4H3u 0.770 1.880 5.858 53.035 35.961 1.475 possible 4484 282 M ILE CD1 10 C4H3u 0.770 1.880 29.813 -1.000 38.377 -1.000 bad 4485 283 M GLY N 12 N3H1s 0.700 1.640 2.460 13.289 14.854 0.895 [OK] 4486 283 M GLY CA 8 C4H2s 0.770 1.880 3.116 26.891 23.688 1.135 possible 4487 283 M GLY C 2 C3H0b 0.770 1.610 2.856 9.881 9.840 1.004 [OK] 4488 283 M GLY O 16 O1H0u 0.660 1.420 2.594 16.804 16.391 1.025 [OK] 4489 284 M ILE N 12 N3H1s 0.700 1.640 2.672 13.109 13.633 0.962 [OK] 4490 284 M ILE CA 3 C4H1s 0.770 1.880 2.705 12.426 13.007 0.955 [OK] 4491 284 M ILE C 1 C3H0s 0.770 1.610 2.456 8.167 8.470 0.964 [OK] 4492 284 M ILE O 16 O1H0u 0.660 1.420 2.388 15.269 16.144 0.946 [OK] 4493 284 M ILE CB 4 C4H1b 0.770 1.880 2.951 15.317 14.227 1.077 [OK] 4494 284 M ILE CG1 9 C4H2b 0.770 1.880 2.755 21.547 24.187 0.891 [OK] 4495 284 M ILE CG2 10 C4H3u 0.770 1.880 3.262 37.014 35.961 1.029 possible 4496 284 M ILE CD1 10 C4H3u 0.770 1.880 3.260 37.875 38.377 0.987 possible 4497 285 M LEU N 12 N3H1s 0.700 1.640 2.482 12.161 13.655 0.891 [OK] 4498 285 M LEU CA 3 C4H1s 0.770 1.880 2.664 13.775 13.122 1.050 [OK] 4499 285 M LEU C 1 C3H0s 0.770 1.610 2.738 8.431 8.825 0.955 [OK] 4500 285 M LEU O 16 O1H0u 0.660 1.420 3.417 19.861 16.208 1.225 possible 4501 285 M LEU CB 8 C4H2s 0.770 1.880 3.263 21.991 22.951 0.958 possible 4502 285 M LEU CG 4 C4H1b 0.770 1.880 4.748 22.154 14.764 1.501 possible 4503 285 M LEU CD1 10 C4H3u 0.770 1.880 3.296 35.882 37.425 0.959 possible 4504 285 M LEU CD2 10 C4H3u 0.770 1.880 31.856 -1.000 37.143 -1.000 bad 4505 286 M LEU N 12 N3H1s 0.700 1.640 2.731 13.378 13.655 0.980 [OK] 4506 286 M LEU CA 3 C4H1s 0.770 1.880 3.010 13.265 13.122 1.011 possible 4507 286 M LEU C 1 C3H0s 0.770 1.610 2.423 9.019 8.825 1.022 [OK] 4508 286 M LEU O 16 O1H0u 0.660 1.420 2.337 15.202 16.208 0.938 [OK] 4509 286 M LEU CB 8 C4H2s 0.770 1.880 2.976 23.877 22.951 1.040 [OK] 4510 286 M LEU CG 4 C4H1b 0.770 1.880 3.421 15.180 14.764 1.028 possible 4511 286 M LEU CD1 10 C4H3u 0.770 1.880 3.208 36.910 37.425 0.986 possible 4512 286 M LEU CD2 10 C4H3u 0.770 1.880 4.866 62.336 37.143 1.678 possible 4513 287 M SER N 12 N3H1s 0.700 1.640 2.370 13.475 14.103 0.956 [OK] 4514 287 M SER CA 3 C4H1s 0.770 1.880 2.959 14.493 13.476 1.075 [OK] 4515 287 M SER C 1 C3H0s 0.770 1.610 2.310 8.382 8.923 0.939 [OK] 4516 287 M SER O 16 O1H0u 0.660 1.420 2.392 18.374 16.179 1.136 [OK] 4517 287 M SER CB 8 C4H2s 0.770 1.880 2.924 23.065 23.884 0.966 [OK] 4518 287 M SER OG 17 O2H1u 0.660 1.460 2.612 20.038 18.732 1.070 [OK] 4519 288 M GLY N 12 N3H1s 0.700 1.640 2.482 13.684 14.854 0.921 [OK] 4520 288 M GLY CA 8 C4H2s 0.770 1.880 3.072 27.037 23.688 1.141 possible 4521 288 M GLY C 2 C3H0b 0.770 1.610 2.883 10.506 9.840 1.068 [OK] 4522 288 M GLY O 16 O1H0u 0.660 1.420 6.831 39.849 16.391 2.431 possible 4523 289 M THR N 12 N3H1s 0.700 1.640 2.553 13.431 13.832 0.971 [OK] 4524 289 M THR CA 3 C4H1s 0.770 1.880 4.471 19.432 13.099 1.483 possible 4525 289 M THR C 1 C3H0s 0.770 1.610 3.209 10.078 8.738 1.153 possible 4526 289 M THR O 16 O1H0u 0.660 1.420 35.023 -1.000 16.020 -1.000 bad 4527 289 M THR CB 4 C4H1b 0.770 1.880 5.458 34.880 14.829 2.352 possible 4528 289 M THR OG1 17 O2H1u 0.660 1.460 3.922 21.422 18.123 1.182 possible 4529 289 M THR CG2 10 C4H3u 0.770 1.880 3.819 43.382 36.542 1.187 possible 4530 290 M VAL N 12 N3H1s 0.700 1.640 2.846 12.234 13.676 0.895 [OK] 4531 290 M VAL CA 3 C4H1s 0.770 1.880 5.960 18.730 13.123 1.427 possible 4532 290 M VAL C 1 C3H0s 0.770 1.610 3.323 10.114 8.563 1.181 possible 4533 290 M VAL O 16 O1H0u 0.660 1.420 14.456 -1.000 16.181 -1.000 bad 4534 290 M VAL CB 4 C4H1b 0.770 1.880 2.827 14.321 14.598 0.981 [OK] 4535 290 M VAL CG1 10 C4H3u 0.770 1.880 7.160 52.604 36.584 1.438 possible 4536 290 M VAL CG2 10 C4H3u 0.770 1.880 7.244 91.738 36.332 2.525 possible 4537 291 M VAL N 12 N3H1s 0.700 1.640 2.991 13.914 13.676 1.017 [OK] 4538 291 M VAL CA 3 C4H1s 0.770 1.880 3.139 12.600 13.123 0.960 possible 4539 291 M VAL C 1 C3H0s 0.770 1.610 3.042 9.369 8.563 1.094 possible 4540 291 M VAL O 16 O1H0u 0.660 1.420 2.625 18.982 16.181 1.173 [OK] 4541 291 M VAL CB 4 C4H1b 0.770 1.880 2.750 14.312 14.598 0.980 [OK] 4542 291 M VAL CG1 10 C4H3u 0.770 1.880 3.364 31.707 36.584 0.867 possible 4543 291 M VAL CG2 10 C4H3u 0.770 1.880 3.709 35.849 36.332 0.987 possible 4544 292 M ASP N 12 N3H1s 0.700 1.640 2.957 13.567 13.895 0.976 [OK] 4545 292 M ASP CA 3 C4H1s 0.770 1.880 3.015 14.980 13.377 1.120 possible 4546 292 M ASP C 1 C3H0s 0.770 1.610 2.839 10.138 8.816 1.150 [OK] 4547 292 M ASP O 16 O1H0u 0.660 1.420 3.917 22.077 16.091 1.372 possible 4548 292 M ASP CB 8 C4H2s 0.770 1.880 18.364 -1.000 23.481 -1.000 bad 4549 292 M ASP CG 2 C3H0b 0.770 1.610 3.670 -1.000 9.422 -1.000 bad 4550 292 M ASP OD1 16 O1H0u 0.660 1.420 22.607 -1.000 15.505 -1.000 bad 4551 292 M ASP OD2 16 O1H0u 0.660 1.420 33.451 -1.000 16.324 -1.000 bad 4552 293 M ASN N 12 N3H1s 0.700 1.640 2.851 13.921 13.695 1.017 [OK] 4553 293 M ASN CA 3 C4H1s 0.770 1.880 2.782 12.737 13.167 0.967 [OK] 4554 293 M ASN C 1 C3H0s 0.770 1.610 2.348 7.985 8.928 0.894 [OK] 4555 293 M ASN O 16 O1H0u 0.660 1.420 2.275 14.299 16.199 0.883 [OK] 4556 293 M ASN CB 8 C4H2s 0.770 1.880 6.891 49.348 23.128 2.134 possible 4557 293 M ASN CG 2 C3H0b 0.770 1.610 2.744 8.920 9.599 0.929 [OK] 4558 293 M ASN OD1 16 O1H0u 0.660 1.420 2.869 14.891 16.664 0.894 [OK] 4559 293 M ASN ND2 15 N3H2u 0.700 1.640 36.117 -1.000 23.083 -1.000 bad 4560 294 M TRP N 12 N3H1s 0.700 1.640 2.714 13.853 13.791 1.005 [OK] 4561 294 M TRP CA 3 C4H1s 0.770 1.880 2.497 12.636 13.377 0.945 [OK] 4562 294 M TRP C 1 C3H0s 0.770 1.610 2.242 8.411 8.724 0.964 [OK] 4563 294 M TRP O 16 O1H0u 0.660 1.420 2.698 17.633 15.951 1.105 [OK] 4564 294 M TRP CB 8 C4H2s 0.770 1.880 2.927 25.566 24.004 1.065 [OK] 4565 294 M TRP CG 2 C3H0b 0.770 1.610 2.551 9.319 9.965 0.935 [OK] 4566 294 M TRP CD1 5 C3H1s 0.770 1.760 3.101 22.519 20.874 1.079 possible 4567 294 M TRP CD2 2 C3H0b 0.770 1.610 2.152 8.859 10.097 0.877 [OK] 4568 294 M TRP NE1 13 N3H1b 0.700 1.640 2.912 18.000 16.969 1.061 [OK] 4569 294 M TRP CE2 2 C3H0b 0.770 1.610 2.467 8.966 9.889 0.907 [OK] 4570 294 M TRP CE3 6 C3H1b 0.770 1.760 2.830 19.783 20.448 0.967 [OK] 4571 294 M TRP CZ2 6 C3H1b 0.770 1.760 2.853 20.748 21.012 0.987 [OK] 4572 294 M TRP CZ3 6 C3H1b 0.770 1.760 3.128 21.670 21.516 1.007 possible 4573 294 M TRP CH2 6 C3H1b 0.770 1.760 3.189 22.927 21.339 1.074 possible 4574 295 M TYR N 12 N3H1s 0.700 1.640 2.474 13.206 13.691 0.965 [OK] 4575 295 M TYR CA 3 C4H1s 0.770 1.880 3.101 14.417 13.330 1.082 possible 4576 295 M TYR C 1 C3H0s 0.770 1.610 2.336 7.892 8.770 0.900 [OK] 4577 295 M TYR O 16 O1H0u 0.660 1.420 3.258 18.659 16.124 1.157 possible 4578 295 M TYR CB 8 C4H2s 0.770 1.880 4.684 29.889 23.678 1.262 possible 4579 295 M TYR CG 2 C3H0b 0.770 1.610 3.944 13.343 9.732 1.371 possible 4580 295 M TYR CD1 5 C3H1s 0.770 1.760 3.983 26.274 20.171 1.303 possible 4581 295 M TYR CD2 5 C3H1s 0.770 1.760 7.738 54.726 20.728 2.640 possible 4582 295 M TYR CE1 5 C3H1s 0.770 1.760 4.942 44.092 20.675 2.133 possible 4583 295 M TYR CE2 5 C3H1s 0.770 1.760 28.092 -1.000 20.810 -1.000 bad 4584 295 M TYR CZ 2 C3H0b 0.770 1.610 5.711 16.295 9.926 1.642 possible 4585 295 M TYR OH 17 O2H1u 0.660 1.460 39.825 -1.000 19.173 -1.000 bad 4586 296 M VAL N 12 N3H1s 0.700 1.640 2.441 12.515 13.676 0.915 [OK] 4587 296 M VAL CA 3 C4H1s 0.770 1.880 3.749 16.156 13.123 1.231 possible 4588 296 M VAL C 1 C3H0s 0.770 1.610 2.607 7.844 8.563 0.916 [OK] 4589 296 M VAL O 16 O1H0u 0.660 1.420 3.020 16.013 16.181 0.990 possible 4590 296 M VAL CB 4 C4H1b 0.770 1.880 3.217 14.306 14.598 0.980 possible 4591 296 M VAL CG1 10 C4H3u 0.770 1.880 35.225 -1.000 36.584 -1.000 bad 4592 296 M VAL CG2 10 C4H3u 0.770 1.880 31.577 -1.000 36.332 -1.000 bad 4593 297 M TRP N 12 N3H1s 0.700 1.640 3.170 14.603 13.791 1.059 possible 4594 297 M TRP CA 3 C4H1s 0.770 1.880 4.094 19.238 13.377 1.438 possible 4595 297 M TRP C 1 C3H0s 0.770 1.610 2.064 7.551 8.724 0.866 [OK] 4596 297 M TRP O 16 O1H0u 0.660 1.420 2.921 19.159 15.951 1.201 [OK] 4597 297 M TRP CB 8 C4H2s 0.770 1.880 3.617 23.113 24.004 0.963 possible 4598 297 M TRP CG 2 C3H0b 0.770 1.610 2.419 9.512 9.965 0.954 [OK] 4599 297 M TRP CD1 5 C3H1s 0.770 1.760 4.284 34.531 20.874 1.654 possible 4600 297 M TRP CD2 2 C3H0b 0.770 1.610 2.395 9.603 10.097 0.951 [OK] 4601 297 M TRP NE1 13 N3H1b 0.700 1.640 3.579 18.541 16.969 1.093 possible 4602 297 M TRP CE2 2 C3H0b 0.770 1.610 2.639 10.329 9.889 1.045 [OK] 4603 297 M TRP CE3 6 C3H1b 0.770 1.760 3.055 21.749 20.448 1.064 possible 4604 297 M TRP CZ2 6 C3H1b 0.770 1.760 3.038 20.566 21.012 0.979 possible 4605 297 M TRP CZ3 6 C3H1b 0.770 1.760 5.104 40.420 21.516 1.879 possible 4606 297 M TRP CH2 6 C3H1b 0.770 1.760 4.386 27.785 21.339 1.302 possible 4607 298 M GLY N 12 N3H1s 0.700 1.640 2.548 12.407 14.854 0.835 [OK] 4608 298 M GLY CA 8 C4H2s 0.770 1.880 4.742 46.966 23.688 1.983 possible 4609 298 M GLY C 2 C3H0b 0.770 1.610 3.748 11.967 9.840 1.216 possible 4610 298 M GLY O 16 O1H0u 0.660 1.420 6.021 67.561 16.391 4.122 possible 4611 299 M GLN N 12 N3H1s 0.700 1.640 2.866 12.672 13.616 0.931 [OK] 4612 299 M GLN CA 3 C4H1s 0.770 1.880 4.188 15.565 13.334 1.167 possible 4613 299 M GLN C 1 C3H0s 0.770 1.610 2.571 8.703 8.787 0.990 [OK] 4614 299 M GLN O 16 O1H0u 0.660 1.420 25.347 -1.000 15.993 -1.000 bad 4615 299 M GLN CB 8 C4H2s 0.770 1.880 11.372 -1.000 23.275 -1.000 bad 4616 299 M GLN CG 8 C4H2s 0.770 1.880 8.998 -1.000 23.465 -1.000 bad 4617 299 M GLN CD 2 C3H0b 0.770 1.610 3.511 10.829 9.659 1.121 possible 4618 299 M GLN OE1 16 O1H0u 0.660 1.420 37.250 -1.000 17.091 -1.000 bad 4619 299 M GLN NE2 15 N3H2u 0.700 1.640 32.925 -1.000 24.150 -1.000 bad 4620 300 M ASN N 12 N3H1s 0.700 1.640 2.329 12.715 13.695 0.928 [OK] 4621 300 M ASN CA 3 C4H1s 0.770 1.880 10.349 -1.000 13.167 -1.000 bad 4622 300 M ASN C 1 C3H0s 0.770 1.610 2.023 -1.000 8.928 -1.000 bad 4623 300 M ASN O 16 O1H0u 0.660 1.420 14.854 -1.000 16.199 -1.000 bad 4624 300 M ASN CB 8 C4H2s 0.770 1.880 28.409 -1.000 23.128 -1.000 bad 4625 300 M ASN CG 2 C3H0b 0.770 1.610 2.431 -1.000 9.599 -1.000 bad 4626 300 M ASN OD1 16 O1H0u 0.660 1.420 20.357 -1.000 16.664 -1.000 bad 4627 300 M ASN ND2 15 N3H2u 0.700 1.640 34.700 -1.000 23.083 -1.000 bad 4628 301 M HIS N 12 N3H1s 0.700 1.640 4.235 -1.000 13.715 -1.000 bad 4629 301 M HIS CA 3 C4H1s 0.770 1.880 6.483 22.325 13.467 1.658 possible 4630 301 M HIS C 1 C3H0s 0.770 1.610 5.033 -1.000 8.882 -1.000 bad 4631 301 M HIS O 16 O1H0u 0.660 1.420 30.954 -1.000 16.082 -1.000 bad 4632 301 M HIS CB 8 C4H2s 0.770 1.880 6.340 36.186 23.653 1.530 possible 4633 301 M HIS CG 2 C3H0b 0.770 1.610 3.178 10.179 9.952 1.023 possible 4634 301 M HIS ND1 13 N3H1b 0.700 1.640 7.989 74.470 15.506 4.803 possible 4635 301 M HIS CD2 5 C3H1s 0.770 1.760 3.735 25.954 21.085 1.231 possible 4636 301 M HIS CE1 5 C3H1s 0.770 1.760 27.702 -1.000 20.636 -1.000 bad 4637 301 M HIS NE2 13 N3H1b 0.700 1.640 3.929 -1.000 15.337 -1.000 bad 4638 301 M HIS OXT 16 O1H0u 0.660 1.420 39.555 -1.000 1.420 -1.000 bad 4640 11 H ASP N 12 N3H1s 0.700 1.640 43.459 -1.000 13.895 -1.000 bad 4641 11 H ASP CA 3 C4H1s 0.770 1.880 15.622 -1.000 13.377 -1.000 bad 4642 11 H ASP C 1 C3H0s 0.770 1.610 4.170 11.634 8.816 1.320 possible 4643 11 H ASP O 16 O1H0u 0.660 1.420 3.868 21.192 16.091 1.317 possible 4644 11 H ASP CB 8 C4H2s 0.770 1.880 21.010 -1.000 23.481 -1.000 bad 4645 11 H ASP CG 2 C3H0b 0.770 1.610 3.514 10.680 9.422 1.134 possible 4646 11 H ASP OD1 16 O1H0u 0.660 1.420 2.302 16.070 15.505 1.036 [OK] 4647 11 H ASP OD2 16 O1H0u 0.660 1.420 29.228 -1.000 16.324 -1.000 bad 4648 12 H LEU N 12 N3H1s 0.700 1.640 7.049 33.063 13.655 2.421 possible 4649 12 H LEU CA 3 C4H1s 0.770 1.880 3.732 15.025 13.122 1.145 possible 4650 12 H LEU C 1 C3H0s 0.770 1.610 2.497 8.569 8.825 0.971 [OK] 4651 12 H LEU O 16 O1H0u 0.660 1.420 2.755 16.318 16.208 1.007 [OK] 4652 12 H LEU CB 8 C4H2s 0.770 1.880 5.101 25.297 22.951 1.102 possible 4653 12 H LEU CG 4 C4H1b 0.770 1.880 7.789 -1.000 14.764 -1.000 bad 4654 12 H LEU CD1 10 C4H3u 0.770 1.880 33.344 -1.000 37.425 -1.000 bad 4655 12 H LEU CD2 10 C4H3u 0.770 1.880 55.072 -1.000 37.143 -1.000 bad 4656 13 H ALA N 12 N3H1s 0.700 1.640 2.469 14.264 14.046 1.016 [OK] 4657 13 H ALA CA 4 C4H1b 0.770 1.880 2.795 13.982 14.063 0.994 [OK] 4658 13 H ALA C 1 C3H0s 0.770 1.610 2.300 8.433 8.900 0.948 [OK] 4659 13 H ALA O 16 O1H0u 0.660 1.420 2.814 18.692 16.188 1.155 [OK] 4660 13 H ALA CB 10 C4H3u 0.770 1.880 3.313 35.941 36.782 0.977 possible 4661 14 H SER N 12 N3H1s 0.700 1.640 2.199 12.756 14.103 0.904 [OK] 4662 14 H SER CA 3 C4H1s 0.770 1.880 2.925 14.702 13.476 1.091 [OK] 4663 14 H SER C 1 C3H0s 0.770 1.610 4.549 9.737 8.923 1.091 possible 4664 14 H SER O 16 O1H0u 0.660 1.420 4.929 27.432 16.179 1.696 possible 4665 14 H SER CB 8 C4H2s 0.770 1.880 18.741 -1.000 23.884 -1.000 bad 4666 14 H SER OG 17 O2H1u 0.660 1.460 5.315 29.598 18.732 1.580 possible 4667 15 H LEU N 12 N3H1s 0.700 1.640 5.237 17.810 13.655 1.304 possible 4668 15 H LEU CA 3 C4H1s 0.770 1.880 6.171 23.182 13.122 1.767 possible 4669 15 H LEU C 1 C3H0s 0.770 1.610 2.860 8.311 8.825 0.942 [OK] 4670 15 H LEU O 16 O1H0u 0.660 1.420 2.614 14.713 16.208 0.908 [OK] 4671 15 H LEU CB 8 C4H2s 0.770 1.880 5.419 36.446 22.951 1.588 possible 4672 15 H LEU CG 4 C4H1b 0.770 1.880 4.595 21.408 14.764 1.450 possible 4673 15 H LEU CD1 10 C4H3u 0.770 1.880 42.133 -1.000 37.425 -1.000 bad 4674 15 H LEU CD2 10 C4H3u 0.770 1.880 50.191 -1.000 37.143 -1.000 bad 4675 16 H ALA N 12 N3H1s 0.700 1.640 3.525 15.156 14.046 1.079 possible 4676 16 H ALA CA 4 C4H1b 0.770 1.880 6.588 30.826 14.063 2.192 possible 4677 16 H ALA C 1 C3H0s 0.770 1.610 2.421 8.113 8.900 0.912 [OK] 4678 16 H ALA O 16 O1H0u 0.660 1.420 3.957 20.893 16.188 1.291 possible 4679 16 H ALA CB 10 C4H3u 0.770 1.880 6.822 62.663 36.782 1.704 possible 4680 17 H ILE N 12 N3H1s 0.700 1.640 2.357 12.993 13.633 0.953 [OK] 4681 17 H ILE CA 3 C4H1s 0.770 1.880 2.511 11.906 13.007 0.915 [OK] 4682 17 H ILE C 1 C3H0s 0.770 1.610 3.081 8.614 8.470 1.017 possible 4683 17 H ILE O 16 O1H0u 0.660 1.420 2.631 14.232 16.144 0.882 [OK] 4684 17 H ILE CB 4 C4H1b 0.770 1.880 3.000 15.009 14.227 1.055 [OK] 4685 17 H ILE CG1 9 C4H2b 0.770 1.880 5.672 36.125 24.187 1.494 possible 4686 17 H ILE CG2 10 C4H3u 0.770 1.880 5.176 57.579 35.961 1.601 possible 4687 17 H ILE CD1 10 C4H3u 0.770 1.880 3.682 38.108 38.377 0.993 possible 4688 18 H TYR N 12 N3H1s 0.700 1.640 3.330 14.222 13.691 1.039 possible 4689 18 H TYR CA 3 C4H1s 0.770 1.880 5.092 22.128 13.330 1.660 possible 4690 18 H TYR C 1 C3H0s 0.770 1.610 2.504 8.075 8.770 0.921 [OK] 4691 18 H TYR O 16 O1H0u 0.660 1.420 2.948 17.312 16.124 1.074 [OK] 4692 18 H TYR CB 8 C4H2s 0.770 1.880 5.550 41.292 23.678 1.744 possible 4693 18 H TYR CG 2 C3H0b 0.770 1.610 7.567 20.344 9.732 2.090 possible 4694 18 H TYR CD1 5 C3H1s 0.770 1.760 22.340 -1.000 20.171 -1.000 bad 4695 18 H TYR CD2 5 C3H1s 0.770 1.760 8.815 -1.000 20.728 -1.000 bad 4696 18 H TYR CE1 5 C3H1s 0.770 1.760 26.215 -1.000 20.675 -1.000 bad 4697 18 H TYR CE2 5 C3H1s 0.770 1.760 29.835 -1.000 20.810 -1.000 bad 4698 18 H TYR CZ 2 C3H0b 0.770 1.610 1.983 -1.000 9.926 -1.000 bad 4699 18 H TYR OH 17 O2H1u 0.660 1.460 41.961 -1.000 19.173 -1.000 bad 4700 19 H SER N 12 N3H1s 0.700 1.640 2.534 12.574 14.103 0.892 [OK] 4701 19 H SER CA 3 C4H1s 0.770 1.880 4.409 19.367 13.476 1.437 possible 4702 19 H SER C 1 C3H0s 0.770 1.610 4.123 9.620 8.923 1.078 possible 4703 19 H SER O 16 O1H0u 0.660 1.420 5.587 26.023 16.179 1.608 possible 4704 19 H SER CB 8 C4H2s 0.770 1.880 32.083 -1.000 23.884 -1.000 bad 4705 19 H SER OG 17 O2H1u 0.660 1.460 14.652 -1.000 18.732 -1.000 bad 4706 20 H PHE N 12 N3H1s 0.700 1.640 4.513 16.271 13.691 1.188 possible 4707 20 H PHE CA 3 C4H1s 0.770 1.880 5.054 19.918 13.449 1.481 possible 4708 20 H PHE C 1 C3H0s 0.770 1.610 2.119 7.503 8.753 0.857 [OK] 4709 20 H PHE O 16 O1H0u 0.660 1.420 2.442 14.598 16.151 0.904 [OK] 4710 20 H PHE CB 8 C4H2s 0.770 1.880 3.973 26.597 23.777 1.119 possible 4711 20 H PHE CG 2 C3H0b 0.770 1.610 2.611 9.921 9.721 1.021 [OK] 4712 20 H PHE CD1 5 C3H1s 0.770 1.760 4.673 36.583 20.405 1.793 possible 4713 20 H PHE CD2 6 C3H1b 0.770 1.760 2.760 21.404 21.051 1.017 [OK] 4714 20 H PHE CE1 6 C3H1b 0.770 1.760 3.663 26.993 21.580 1.251 possible 4715 20 H PHE CE2 6 C3H1b 0.770 1.760 2.770 20.199 21.680 0.932 [OK] 4716 20 H PHE CZ 6 C3H1b 0.770 1.760 3.010 22.496 21.666 1.038 possible 4717 21 H TRP N 12 N3H1s 0.700 1.640 2.447 13.218 13.791 0.958 [OK] 4718 21 H TRP CA 3 C4H1s 0.770 1.880 2.792 13.612 13.377 1.018 [OK] 4719 21 H TRP C 1 C3H0s 0.770 1.610 3.302 9.187 8.724 1.053 possible 4720 21 H TRP O 16 O1H0u 0.660 1.420 4.988 28.174 15.951 1.766 possible 4721 21 H TRP CB 8 C4H2s 0.770 1.880 19.495 -1.000 24.004 -1.000 bad 4722 21 H TRP CG 2 C3H0b 0.770 1.610 0.949 -1.000 9.965 -1.000 bad 4723 21 H TRP CD1 5 C3H1s 0.770 1.760 11.323 -1.000 20.874 -1.000 bad 4724 21 H TRP CD2 2 C3H0b 0.770 1.610 1.575 -1.000 10.097 -1.000 bad 4725 21 H TRP NE1 13 N3H1b 0.700 1.640 9.581 -1.000 16.969 -1.000 bad 4726 21 H TRP CE2 2 C3H0b 0.770 1.610 1.593 -1.000 9.889 -1.000 bad 4727 21 H TRP CE3 6 C3H1b 0.770 1.760 15.192 -1.000 20.448 -1.000 bad 4728 21 H TRP CZ2 6 C3H1b 0.770 1.760 21.653 -1.000 21.012 -1.000 bad 4729 21 H TRP CZ3 6 C3H1b 0.770 1.760 21.501 -1.000 21.516 -1.000 bad 4730 21 H TRP CH2 6 C3H1b 0.770 1.760 23.880 -1.000 21.339 -1.000 bad 4731 22 H ILE N 12 N3H1s 0.700 1.640 2.723 13.184 13.633 0.967 [OK] 4732 22 H ILE CA 3 C4H1s 0.770 1.880 3.643 15.605 13.007 1.200 possible 4733 22 H ILE C 1 C3H0s 0.770 1.610 2.969 8.149 8.470 0.962 [OK] 4734 22 H ILE O 16 O1H0u 0.660 1.420 4.484 25.858 16.144 1.602 possible 4735 22 H ILE CB 4 C4H1b 0.770 1.880 4.348 17.707 14.227 1.245 possible 4736 22 H ILE CG1 9 C4H2b 0.770 1.880 5.539 35.517 24.187 1.468 possible 4737 22 H ILE CG2 10 C4H3u 0.770 1.880 52.252 -1.000 35.961 -1.000 bad 4738 22 H ILE CD1 10 C4H3u 0.770 1.880 36.731 -1.000 38.377 -1.000 bad 4739 23 H PHE N 12 N3H1s 0.700 1.640 4.404 16.067 13.691 1.174 possible 4740 23 H PHE CA 3 C4H1s 0.770 1.880 6.651 33.557 13.449 2.495 possible 4741 23 H PHE C 1 C3H0s 0.770 1.610 2.250 7.720 8.753 0.882 [OK] 4742 23 H PHE O 16 O1H0u 0.660 1.420 3.892 19.257 16.151 1.192 possible 4743 23 H PHE CB 8 C4H2s 0.770 1.880 7.207 56.226 23.777 2.365 possible 4744 23 H PHE CG 2 C3H0b 0.770 1.610 6.270 18.531 9.721 1.906 possible 4745 23 H PHE CD1 5 C3H1s 0.770 1.760 23.281 -1.000 20.405 -1.000 bad 4746 23 H PHE CD2 6 C3H1b 0.770 1.760 4.799 29.070 21.051 1.381 possible 4747 23 H PHE CE1 6 C3H1b 0.770 1.760 27.205 -1.000 21.580 -1.000 bad 4748 23 H PHE CE2 6 C3H1b 0.770 1.760 4.574 28.959 21.680 1.336 possible 4749 23 H PHE CZ 6 C3H1b 0.770 1.760 4.565 30.381 21.666 1.402 possible 4750 24 H LEU N 12 N3H1s 0.700 1.640 2.608 12.653 13.655 0.927 [OK] 4751 24 H LEU CA 3 C4H1s 0.770 1.880 2.924 14.298 13.122 1.090 [OK] 4752 24 H LEU C 1 C3H0s 0.770 1.610 2.811 8.398 8.825 0.952 [OK] 4753 24 H LEU O 16 O1H0u 0.660 1.420 2.479 14.576 16.208 0.899 [OK] 4754 24 H LEU CB 8 C4H2s 0.770 1.880 3.416 23.640 22.951 1.030 possible 4755 24 H LEU CG 4 C4H1b 0.770 1.880 4.055 16.166 14.764 1.095 possible 4756 24 H LEU CD1 10 C4H3u 0.770 1.880 3.139 41.887 37.425 1.119 possible 4757 24 H LEU CD2 10 C4H3u 0.770 1.880 4.541 54.629 37.143 1.471 possible 4758 25 H ALA N 12 N3H1s 0.700 1.640 3.929 16.079 14.046 1.145 possible 4759 25 H ALA CA 4 C4H1b 0.770 1.880 5.303 27.385 14.063 1.947 possible 4760 25 H ALA C 1 C3H0s 0.770 1.610 4.468 9.446 8.900 1.061 possible 4761 25 H ALA O 16 O1H0u 0.660 1.420 4.990 36.401 16.188 2.249 possible 4762 25 H ALA CB 10 C4H3u 0.770 1.880 49.607 -1.000 36.782 -1.000 bad 4763 26 H GLY N 12 N3H1s 0.700 1.640 5.000 17.608 14.854 1.185 possible 4764 26 H GLY CA 8 C4H2s 0.770 1.880 33.234 -1.000 23.688 -1.000 bad 4765 26 H GLY C 2 C3H0b 0.770 1.610 7.149 18.170 9.840 1.847 possible 4766 26 H GLY O 16 O1H0u 0.660 1.420 7.993 34.547 16.391 2.108 possible 4767 27 H LEU N 12 N3H1s 0.700 1.640 4.741 17.482 13.655 1.280 possible 4768 27 H LEU CA 3 C4H1s 0.770 1.880 4.981 18.351 13.122 1.398 possible 4769 27 H LEU C 1 C3H0s 0.770 1.610 2.558 8.096 8.825 0.917 [OK] 4770 27 H LEU O 16 O1H0u 0.660 1.420 2.219 13.530 16.208 0.835 [OK] 4771 27 H LEU CB 8 C4H2s 0.770 1.880 3.351 25.080 22.951 1.093 possible 4772 27 H LEU CG 4 C4H1b 0.770 1.880 2.986 14.535 14.764 0.984 [OK] 4773 27 H LEU CD1 10 C4H3u 0.770 1.880 5.289 49.101 37.425 1.312 possible 4774 27 H LEU CD2 10 C4H3u 0.770 1.880 2.996 36.377 37.143 0.979 [OK] 4775 28 H ILE N 12 N3H1s 0.700 1.640 2.716 13.025 13.633 0.955 [OK] 4776 28 H ILE CA 3 C4H1s 0.770 1.880 2.851 14.508 13.007 1.115 [OK] 4777 28 H ILE C 1 C3H0s 0.770 1.610 2.755 8.455 8.470 0.998 [OK] 4778 28 H ILE O 16 O1H0u 0.660 1.420 2.641 17.560 16.144 1.088 [OK] 4779 28 H ILE CB 4 C4H1b 0.770 1.880 3.748 16.577 14.227 1.165 possible 4780 28 H ILE CG1 9 C4H2b 0.770 1.880 2.994 26.775 24.187 1.107 [OK] 4781 28 H ILE CG2 10 C4H3u 0.770 1.880 7.078 70.163 35.961 1.951 possible 4782 28 H ILE CD1 10 C4H3u 0.770 1.880 18.074 -1.000 38.377 -1.000 bad 4783 29 H TYR N 12 N3H1s 0.700 1.640 3.683 15.996 13.691 1.168 possible 4784 29 H TYR CA 3 C4H1s 0.770 1.880 3.334 14.609 13.330 1.096 possible 4785 29 H TYR C 1 C3H0s 0.770 1.610 2.399 8.010 8.770 0.913 [OK] 4786 29 H TYR O 16 O1H0u 0.660 1.420 2.394 15.497 16.124 0.961 [OK] 4787 29 H TYR CB 8 C4H2s 0.770 1.880 5.199 35.333 23.678 1.492 possible 4788 29 H TYR CG 2 C3H0b 0.770 1.610 6.793 17.079 9.732 1.755 possible 4789 29 H TYR CD1 5 C3H1s 0.770 1.760 13.252 -1.000 20.171 -1.000 bad 4790 29 H TYR CD2 5 C3H1s 0.770 1.760 14.886 -1.000 20.728 -1.000 bad 4791 29 H TYR CE1 5 C3H1s 0.770 1.760 14.885 -1.000 20.675 -1.000 bad 4792 29 H TYR CE2 5 C3H1s 0.770 1.760 27.090 -1.000 20.810 -1.000 bad 4793 29 H TYR CZ 2 C3H0b 0.770 1.610 1.716 -1.000 9.926 -1.000 bad 4794 29 H TYR OH 17 O2H1u 0.660 1.460 22.895 -1.000 19.173 -1.000 bad 4795 30 H TYR N 12 N3H1s 0.700 1.640 3.259 14.295 13.691 1.044 possible 4796 30 H TYR CA 3 C4H1s 0.770 1.880 4.668 19.812 13.330 1.486 possible 4797 30 H TYR C 1 C3H0s 0.770 1.610 2.459 7.907 8.770 0.902 [OK] 4798 30 H TYR O 16 O1H0u 0.660 1.420 2.690 14.494 16.124 0.899 [OK] 4799 30 H TYR CB 8 C4H2s 0.770 1.880 14.648 -1.000 23.678 -1.000 bad 4800 30 H TYR CG 2 C3H0b 0.770 1.610 0.607 -1.000 9.732 -1.000 bad 4801 30 H TYR CD1 5 C3H1s 0.770 1.760 19.100 -1.000 20.171 -1.000 bad 4802 30 H TYR CD2 5 C3H1s 0.770 1.760 6.224 27.095 20.728 1.307 possible 4803 30 H TYR CE1 5 C3H1s 0.770 1.760 18.200 -1.000 20.675 -1.000 bad 4804 30 H TYR CE2 5 C3H1s 0.770 1.760 6.159 30.546 20.810 1.468 possible 4805 30 H TYR CZ 2 C3H0b 0.770 1.610 6.858 19.804 9.926 1.995 possible 4806 30 H TYR OH 17 O2H1u 0.660 1.460 7.802 63.752 19.173 3.325 possible 4807 31 H LEU N 12 N3H1s 0.700 1.640 2.398 12.127 13.655 0.888 [OK] 4808 31 H LEU CA 3 C4H1s 0.770 1.880 2.993 13.666 13.122 1.041 [OK] 4809 31 H LEU C 1 C3H0s 0.770 1.610 2.483 8.514 8.825 0.965 [OK] 4810 31 H LEU O 16 O1H0u 0.660 1.420 2.743 15.259 16.208 0.941 [OK] 4811 31 H LEU CB 8 C4H2s 0.770 1.880 2.937 23.764 22.951 1.035 [OK] 4812 31 H LEU CG 4 C4H1b 0.770 1.880 2.579 13.142 14.764 0.890 [OK] 4813 31 H LEU CD1 10 C4H3u 0.770 1.880 2.986 36.736 37.425 0.982 [OK] 4814 31 H LEU CD2 10 C4H3u 0.770 1.880 3.261 37.457 37.143 1.008 possible 4815 32 H GLN N 12 N3H1s 0.700 1.640 2.698 13.970 13.616 1.026 [OK] 4816 32 H GLN CA 3 C4H1s 0.770 1.880 2.809 13.778 13.334 1.033 [OK] 4817 32 H GLN C 1 C3H0s 0.770 1.610 2.495 8.345 8.787 0.950 [OK] 4818 32 H GLN O 16 O1H0u 0.660 1.420 2.444 14.902 15.993 0.932 [OK] 4819 32 H GLN CB 8 C4H2s 0.770 1.880 3.133 28.191 23.275 1.211 possible 4820 32 H GLN CG 8 C4H2s 0.770 1.880 3.085 24.279 23.465 1.035 possible 4821 32 H GLN CD 2 C3H0b 0.770 1.610 2.327 9.114 9.659 0.944 [OK] 4822 32 H GLN OE1 16 O1H0u 0.660 1.420 2.594 18.029 17.091 1.055 [OK] 4823 32 H GLN NE2 15 N3H2u 0.700 1.640 3.990 34.572 24.150 1.432 possible 4824 33 H THR N 12 N3H1s 0.700 1.640 2.529 13.372 13.832 0.967 [OK] 4825 33 H THR CA 3 C4H1s 0.770 1.880 2.824 14.080 13.099 1.075 [OK] 4826 33 H THR C 1 C3H0s 0.770 1.610 2.474 8.549 8.738 0.978 [OK] 4827 33 H THR O 16 O1H0u 0.660 1.420 2.434 14.538 16.020 0.907 [OK] 4828 33 H THR CB 4 C4H1b 0.770 1.880 4.116 17.507 14.829 1.181 possible 4829 33 H THR OG1 17 O2H1u 0.660 1.460 5.514 36.300 18.123 2.003 possible 4830 33 H THR CG2 10 C4H3u 0.770 1.880 4.342 39.616 36.542 1.084 possible 4831 34 H GLU N 12 N3H1s 0.700 1.640 2.876 13.364 13.615 0.982 [OK] 4832 34 H GLU CA 3 C4H1s 0.770 1.880 2.798 14.401 13.399 1.075 [OK] 4833 34 H GLU C 1 C3H0s 0.770 1.610 2.648 8.914 8.675 1.028 [OK] 4834 34 H GLU O 16 O1H0u 0.660 1.420 2.423 17.586 16.023 1.098 [OK] 4835 34 H GLU CB 8 C4H2s 0.770 1.880 3.240 23.641 23.529 1.005 possible 4836 34 H GLU CG 8 C4H2s 0.770 1.880 3.112 23.121 23.513 0.983 possible 4837 34 H GLU CD 2 C3H0b 0.770 1.610 2.855 10.089 9.460 1.066 [OK] 4838 34 H GLU OE1 16 O1H0u 0.660 1.420 4.903 38.802 15.999 2.425 possible 4839 34 H GLU OE2 16 O1H0u 0.660 1.420 2.599 18.098 17.432 1.038 [OK] 4840 35 H ASN N 12 N3H1s 0.700 1.640 2.501 12.294 13.695 0.898 [OK] 4841 35 H ASN CA 3 C4H1s 0.770 1.880 2.699 13.209 13.167 1.003 [OK] 4842 35 H ASN C 1 C3H0s 0.770 1.610 2.600 9.831 8.928 1.101 [OK] 4843 35 H ASN O 16 O1H0u 0.660 1.420 2.612 20.474 16.199 1.264 [OK] 4844 35 H ASN CB 8 C4H2s 0.770 1.880 2.917 23.116 23.128 0.999 [OK] 4845 35 H ASN CG 2 C3H0b 0.770 1.610 2.569 9.120 9.599 0.950 [OK] 4846 35 H ASN OD1 16 O1H0u 0.660 1.420 2.266 13.516 16.664 0.811 [OK] 4847 35 H ASN ND2 15 N3H2u 0.700 1.640 2.962 25.276 23.083 1.095 [OK] 4848 36 H MET N 12 N3H1s 0.700 1.640 2.280 11.794 13.564 0.870 [OK] 4849 36 H MET CA 3 C4H1s 0.770 1.880 2.650 12.934 13.231 0.978 [OK] 4850 36 H MET C 1 C3H0s 0.770 1.610 2.528 9.841 8.782 1.121 [OK] 4851 36 H MET O 16 O1H0u 0.660 1.420 2.281 16.462 16.277 1.011 [OK] 4852 36 H MET CB 8 C4H2s 0.770 1.880 2.775 21.271 23.645 0.900 [OK] 4853 36 H MET CG 9 C4H2b 0.770 1.880 3.118 23.843 24.009 0.993 possible 4854 36 H MET SD 19 S2H0u 1.040 1.770 3.902 34.859 30.093 1.158 possible 4855 36 H MET CE 10 C4H3u 0.770 1.880 3.927 43.410 37.161 1.168 possible 4856 37 H ARG N 12 N3H1s 0.700 1.640 2.592 14.800 13.650 1.084 [OK] 4857 37 H ARG CA 3 C4H1s 0.770 1.880 2.654 13.092 13.422 0.975 [OK] 4858 37 H ARG C 1 C3H0s 0.770 1.610 2.502 8.847 8.838 1.001 [OK] 4859 37 H ARG O 16 O1H0u 0.660 1.420 2.734 16.325 16.084 1.015 [OK] 4860 37 H ARG CB 8 C4H2s 0.770 1.880 3.143 24.560 23.088 1.064 possible 4861 37 H ARG CG 8 C4H2s 0.770 1.880 2.628 20.899 23.640 0.884 [OK] 4862 37 H ARG CD 8 C4H2s 0.770 1.880 2.943 23.175 23.300 0.995 [OK] 4863 37 H ARG NE 13 N3H1b 0.700 1.640 2.605 15.684 15.569 1.007 [OK] 4864 37 H ARG CZ 2 C3H0b 0.770 1.610 2.379 8.900 9.747 0.913 [OK] 4865 37 H ARG NH1 15 N3H2u 0.700 1.640 2.535 19.397 22.782 0.851 [OK] 4866 37 H ARG NH2 15 N3H2u 0.700 1.640 4.841 48.780 23.810 2.049 possible 4867 38 H GLU N 12 N3H1s 0.700 1.640 2.530 13.130 13.615 0.964 [OK] 4868 38 H GLU CA 3 C4H1s 0.770 1.880 2.735 13.482 13.399 1.006 [OK] 4869 38 H GLU C 1 C3H0s 0.770 1.610 2.692 8.607 8.675 0.992 [OK] 4870 38 H GLU O 16 O1H0u 0.660 1.420 2.614 16.978 16.023 1.060 [OK] 4871 38 H GLU CB 8 C4H2s 0.770 1.880 2.940 25.358 23.529 1.078 [OK] 4872 38 H GLU CG 8 C4H2s 0.770 1.880 3.167 26.162 23.513 1.113 possible 4873 38 H GLU CD 2 C3H0b 0.770 1.610 2.676 9.948 9.460 1.052 [OK] 4874 38 H GLU OE1 16 O1H0u 0.660 1.420 3.948 27.519 15.999 1.720 possible 4875 38 H GLU OE2 16 O1H0u 0.660 1.420 2.781 17.758 17.432 1.019 [OK] 4876 39 H GLY N 12 N3H1s 0.700 1.640 2.738 15.054 14.854 1.013 [OK] 4877 39 H GLY CA 8 C4H2s 0.770 1.880 3.109 23.731 23.688 1.002 possible 4878 39 H GLY C 2 C3H0b 0.770 1.610 2.489 9.209 9.840 0.936 [OK] 4879 39 H GLY O 16 O1H0u 0.660 1.420 2.292 15.731 16.391 0.960 [OK] 4880 40 H TYR N 12 N3H1s 0.700 1.640 2.762 13.288 13.691 0.971 [OK] 4881 40 H TYR CA 3 C4H1s 0.770 1.880 2.651 12.541 13.330 0.941 [OK] 4882 40 H TYR C 1 C3H0s 0.770 1.610 2.714 9.888 8.770 1.127 [OK] 4883 40 H TYR O 16 O1H0u 0.660 1.420 3.240 18.132 16.124 1.125 possible 4884 40 H TYR CB 8 C4H2s 0.770 1.880 3.734 23.634 23.678 0.998 possible 4885 40 H TYR CG 2 C3H0b 0.770 1.610 2.500 9.901 9.732 1.017 [OK] 4886 40 H TYR CD1 5 C3H1s 0.770 1.760 2.603 17.871 20.171 0.886 [OK] 4887 40 H TYR CD2 5 C3H1s 0.770 1.760 3.600 25.599 20.728 1.235 possible 4888 40 H TYR CE1 5 C3H1s 0.770 1.760 2.969 21.270 20.675 1.029 [OK] 4889 40 H TYR CE2 5 C3H1s 0.770 1.760 4.212 31.406 20.810 1.509 possible 4890 40 H TYR CZ 2 C3H0b 0.770 1.610 2.646 9.927 9.926 1.000 [OK] 4891 40 H TYR OH 17 O2H1u 0.660 1.460 4.435 32.574 19.173 1.699 possible 4892 41 H PRO N 11 N3H0u 0.700 1.640 2.756 9.309 8.823 1.055 [OK] 4893 41 H PRO CA 4 C4H1b 0.770 1.880 3.439 15.098 13.955 1.082 possible 4894 41 H PRO C 1 C3H0s 0.770 1.610 2.601 8.653 8.812 0.982 [OK] 4895 41 H PRO O 16 O1H0u 0.660 1.420 3.297 22.713 16.169 1.405 possible 4896 41 H PRO CB 9 C4H2b 0.770 1.880 4.872 43.082 25.563 1.685 possible 4897 41 H PRO CG 9 C4H2b 0.770 1.880 30.628 -1.000 25.832 -1.000 bad 4898 41 H PRO CD 8 C4H2s 0.770 1.880 5.861 72.112 23.836 3.025 possible 4899 42 H LEU N 12 N3H1s 0.700 1.640 2.539 13.574 13.655 0.994 [OK] 4900 42 H LEU CA 3 C4H1s 0.770 1.880 2.748 13.040 13.122 0.994 [OK] 4901 42 H LEU C 1 C3H0s 0.770 1.610 2.373 8.625 8.825 0.977 [OK] 4902 42 H LEU O 16 O1H0u 0.660 1.420 2.959 16.594 16.208 1.024 [OK] 4903 42 H LEU CB 8 C4H2s 0.770 1.880 2.901 23.827 22.951 1.038 [OK] 4904 42 H LEU CG 4 C4H1b 0.770 1.880 3.040 14.290 14.764 0.968 possible 4905 42 H LEU CD1 10 C4H3u 0.770 1.880 5.231 67.532 37.425 1.804 possible 4906 42 H LEU CD2 10 C4H3u 0.770 1.880 2.863 34.485 37.143 0.928 [OK] 4907 43 H GLU N 12 N3H1s 0.700 1.640 2.714 14.204 13.615 1.043 [OK] 4908 43 H GLU CA 3 C4H1s 0.770 1.880 2.547 12.296 13.399 0.918 [OK] 4909 43 H GLU C 1 C3H0s 0.770 1.610 2.414 8.709 8.675 1.004 [OK] 4910 43 H GLU O 16 O1H0u 0.660 1.420 2.827 19.518 16.023 1.218 [OK] 4911 43 H GLU CB 8 C4H2s 0.770 1.880 3.080 23.495 23.529 0.999 possible 4912 43 H GLU CG 8 C4H2s 0.770 1.880 3.992 32.633 23.513 1.388 possible 4913 43 H GLU CD 2 C3H0b 0.770 1.610 2.886 10.308 9.460 1.090 [OK] 4914 43 H GLU OE1 16 O1H0u 0.660 1.420 3.699 22.667 15.999 1.417 possible 4915 43 H GLU OE2 16 O1H0u 0.660 1.420 6.051 63.240 17.432 3.628 possible 4916 44 H ASN N 12 N3H1s 0.700 1.640 2.435 12.818 13.695 0.936 [OK] 4917 44 H ASN CA 3 C4H1s 0.770 1.880 3.492 18.300 13.167 1.390 possible 4918 44 H ASN C 1 C3H0s 0.770 1.610 2.705 9.491 8.928 1.063 [OK] 4919 44 H ASN O 16 O1H0u 0.660 1.420 2.431 14.957 16.199 0.923 [OK] 4920 44 H ASN CB 8 C4H2s 0.770 1.880 4.694 29.252 23.128 1.265 possible 4921 44 H ASN CG 2 C3H0b 0.770 1.610 6.677 16.774 9.599 1.747 possible 4922 44 H ASN OD1 16 O1H0u 0.660 1.420 19.115 -1.000 16.664 -1.000 bad 4923 44 H ASN ND2 15 N3H2u 0.700 1.640 15.308 -1.000 23.083 -1.000 bad 4924 45 H GLU N 12 N3H1s 0.700 1.640 3.058 17.831 13.615 1.310 possible 4925 45 H GLU CA 3 C4H1s 0.770 1.880 2.959 14.009 13.399 1.046 [OK] 4926 45 H GLU C 1 C3H0s 0.770 1.610 2.753 10.909 8.675 1.258 [OK] 4927 45 H GLU O 16 O1H0u 0.660 1.420 3.796 25.682 16.023 1.603 possible 4928 45 H GLU CB 8 C4H2s 0.770 1.880 2.980 21.437 23.529 0.911 [OK] 4929 45 H GLU CG 8 C4H2s 0.770 1.880 3.351 24.614 23.513 1.047 possible 4930 45 H GLU CD 2 C3H0b 0.770 1.610 2.428 8.866 9.460 0.937 [OK] 4931 45 H GLU OE1 16 O1H0u 0.660 1.420 2.453 17.116 15.999 1.070 [OK] 4932 45 H GLU OE2 16 O1H0u 0.660 1.420 2.699 17.022 17.432 0.976 [OK] 4933 46 H ASP N 12 N3H1s 0.700 1.640 2.658 12.461 13.895 0.897 [OK] 4934 46 H ASP CA 3 C4H1s 0.770 1.880 5.668 26.974 13.377 2.016 possible 4935 46 H ASP C 1 C3H0s 0.770 1.610 4.319 13.704 8.816 1.555 possible 4936 46 H ASP O 16 O1H0u 0.660 1.420 21.074 -1.000 16.091 -1.000 bad 4937 46 H ASP CB 8 C4H2s 0.770 1.880 28.223 -1.000 23.481 -1.000 bad 4938 46 H ASP CG 2 C3H0b 0.770 1.610 6.945 17.699 9.422 1.878 possible 4939 46 H ASP OD1 16 O1H0u 0.660 1.420 12.216 -1.000 15.505 -1.000 bad 4940 46 H ASP OD2 16 O1H0u 0.660 1.420 17.555 -1.000 16.324 -1.000 bad 4941 47 H GLY N 12 N3H1s 0.700 1.640 3.939 17.702 14.854 1.192 possible 4942 47 H GLY CA 8 C4H2s 0.770 1.880 20.941 -1.000 23.688 -1.000 bad 4943 47 H GLY C 2 C3H0b 0.770 1.610 4.926 13.437 9.840 1.366 possible 4944 47 H GLY O 16 O1H0u 0.660 1.420 15.417 -1.000 16.391 -1.000 bad 4945 48 H THR N 12 N3H1s 0.700 1.640 3.530 15.613 13.832 1.129 possible 4946 48 H THR CA 3 C4H1s 0.770 1.880 4.726 15.593 13.099 1.190 possible 4947 48 H THR C 1 C3H0s 0.770 1.610 2.512 8.934 8.738 1.022 [OK] 4948 48 H THR O 16 O1H0u 0.660 1.420 2.246 13.766 16.020 0.859 [OK] 4949 48 H THR CB 4 C4H1b 0.770 1.880 7.101 28.841 14.829 1.945 possible 4950 48 H THR OG1 17 O2H1u 0.660 1.460 3.194 -1.000 18.123 -1.000 bad 4951 48 H THR CG2 10 C4H3u 0.770 1.880 55.940 -1.000 36.542 -1.000 bad 4952 49 H PRO N 11 N3H0u 0.700 1.640 2.986 9.638 8.823 1.092 [OK] 4953 49 H PRO CA 4 C4H1b 0.770 1.880 3.481 16.254 13.955 1.165 possible 4954 49 H PRO C 1 C3H0s 0.770 1.610 2.592 8.499 8.812 0.964 [OK] 4955 49 H PRO O 16 O1H0u 0.660 1.420 12.471 -1.000 16.169 -1.000 bad 4956 49 H PRO CB 9 C4H2b 0.770 1.880 22.211 -1.000 25.563 -1.000 bad 4957 49 H PRO CG 9 C4H2b 0.770 1.880 41.461 -1.000 25.832 -1.000 bad 4958 49 H PRO CD 8 C4H2s 0.770 1.880 25.690 -1.000 23.836 -1.000 bad 4959 50 H ALA N 12 N3H1s 0.700 1.640 2.417 13.505 14.046 0.962 [OK] 4960 50 H ALA CA 4 C4H1b 0.770 1.880 2.706 12.518 14.063 0.890 [OK] 4961 50 H ALA C 1 C3H0s 0.770 1.610 2.853 8.500 8.900 0.955 [OK] 4962 50 H ALA O 16 O1H0u 0.660 1.420 5.888 31.225 16.188 1.929 possible 4963 50 H ALA CB 10 C4H3u 0.770 1.880 4.776 48.395 36.782 1.316 possible 4964 51 H ALA N 12 N3H1s 0.700 1.640 4.658 27.332 14.046 1.946 possible 4965 51 H ALA CA 4 C4H1b 0.770 1.880 12.191 -1.000 14.063 -1.000 bad 4966 51 H ALA C 1 C3H0s 0.770 1.610 4.063 9.371 8.900 1.053 possible 4967 51 H ALA O 16 O1H0u 0.660 1.420 23.218 -1.000 16.188 -1.000 bad 4968 51 H ALA CB 10 C4H3u 0.770 1.880 68.464 -1.000 36.782 -1.000 bad 4969 52 H ASN N 12 N3H1s 0.700 1.640 5.207 23.773 13.695 1.736 possible 4970 52 H ASN CA 3 C4H1s 0.770 1.880 5.687 19.630 13.167 1.491 possible 4971 52 H ASN C 1 C3H0s 0.770 1.610 2.437 8.840 8.928 0.990 [OK] 4972 52 H ASN O 16 O1H0u 0.660 1.420 3.402 25.730 16.199 1.588 possible 4973 52 H ASN CB 8 C4H2s 0.770 1.880 29.368 -1.000 23.128 -1.000 bad 4974 52 H ASN CG 2 C3H0b 0.770 1.610 2.147 -1.000 9.599 -1.000 bad 4975 52 H ASN OD1 16 O1H0u 0.660 1.420 14.544 -1.000 16.664 -1.000 bad 4976 52 H ASN ND2 15 N3H2u 0.700 1.640 57.676 -1.000 23.083 -1.000 bad 4977 53 H GLN N 12 N3H1s 0.700 1.640 4.761 22.049 13.616 1.619 possible 4978 53 H GLN CA 3 C4H1s 0.770 1.880 2.808 13.655 13.334 1.024 [OK] 4979 53 H GLN C 1 C3H0s 0.770 1.610 3.026 10.480 8.787 1.193 possible 4980 53 H GLN O 16 O1H0u 0.660 1.420 3.797 33.269 15.993 2.080 possible 4981 53 H GLN CB 8 C4H2s 0.770 1.880 18.270 -1.000 23.275 -1.000 bad 4982 53 H GLN CG 8 C4H2s 0.770 1.880 24.770 -1.000 23.465 -1.000 bad 4983 53 H GLN CD 2 C3H0b 0.770 1.610 3.845 11.312 9.659 1.171 possible 4984 53 H GLN OE1 16 O1H0u 0.660 1.420 3.470 26.070 17.091 1.525 possible 4985 53 H GLN NE2 15 N3H2u 0.700 1.640 3.843 26.575 24.150 1.100 possible 4986 54 H GLY N 12 N3H1s 0.700 1.640 3.880 19.990 14.854 1.346 possible 4987 54 H GLY CA 8 C4H2s 0.770 1.880 6.266 59.045 23.688 2.493 possible 4988 54 H GLY C 2 C3H0b 0.770 1.610 5.413 15.887 9.840 1.615 possible 4989 54 H GLY O 16 O1H0u 0.660 1.420 19.275 -1.000 16.391 -1.000 bad 4990 55 H PRO N 11 N3H0u 0.700 1.640 4.830 10.754 8.823 1.219 possible 4991 55 H PRO CA 4 C4H1b 0.770 1.880 11.835 -1.000 13.955 -1.000 bad 4992 55 H PRO C 1 C3H0s 0.770 1.610 3.841 11.602 8.812 1.317 possible 4993 55 H PRO O 16 O1H0u 0.660 1.420 18.391 -1.000 16.169 -1.000 bad 4994 55 H PRO CB 9 C4H2b 0.770 1.880 38.022 -1.000 25.563 -1.000 bad 4995 55 H PRO CG 9 C4H2b 0.770 1.880 21.806 -1.000 25.832 -1.000 bad 4996 55 H PRO CD 8 C4H2s 0.770 1.880 24.166 -1.000 23.836 -1.000 bad 4997 56 H PHE N 12 N3H1s 0.700 1.640 3.525 16.212 13.691 1.184 possible 4998 56 H PHE CA 3 C4H1s 0.770 1.880 2.701 12.232 13.449 0.910 [OK] 4999 56 H PHE C 1 C3H0s 0.770 1.610 3.792 10.058 8.753 1.149 possible 5000 56 H PHE O 16 O1H0u 0.660 1.420 3.868 28.569 16.151 1.769 possible 5001 56 H PHE CB 8 C4H2s 0.770 1.880 3.943 24.318 23.777 1.023 possible 5002 56 H PHE CG 2 C3H0b 0.770 1.610 2.607 10.074 9.721 1.036 [OK] 5003 56 H PHE CD1 5 C3H1s 0.770 1.760 3.259 22.013 20.405 1.079 possible 5004 56 H PHE CD2 6 C3H1b 0.770 1.760 4.498 30.881 21.051 1.467 possible 5005 56 H PHE CE1 6 C3H1b 0.770 1.760 7.211 42.090 21.580 1.950 possible 5006 56 H PHE CE2 6 C3H1b 0.770 1.760 3.550 22.442 21.680 1.035 possible 5007 56 H PHE CZ 6 C3H1b 0.770 1.760 13.460 -1.000 21.666 -1.000 bad 5008 57 H PRO N 11 N3H0u 0.700 1.640 4.556 11.272 8.823 1.278 possible 5009 57 H PRO CA 4 C4H1b 0.770 1.880 4.981 16.754 13.955 1.201 possible 5010 57 H PRO C 1 C3H0s 0.770 1.610 2.632 9.143 8.812 1.038 [OK] 5011 57 H PRO O 16 O1H0u 0.660 1.420 3.039 17.808 16.169 1.101 possible 5012 57 H PRO CB 9 C4H2b 0.770 1.880 31.296 -1.000 25.563 -1.000 bad 5013 57 H PRO CG 9 C4H2b 0.770 1.880 19.480 -1.000 25.832 -1.000 bad 5014 57 H PRO CD 8 C4H2s 0.770 1.880 6.740 35.146 23.836 1.474 possible 5015 58 H LEU N 12 N3H1s 0.700 1.640 3.504 15.014 13.655 1.100 possible 5016 58 H LEU CA 3 C4H1s 0.770 1.880 2.637 11.745 13.122 0.895 [OK] 5017 58 H LEU C 1 C3H0s 0.770 1.610 2.754 8.505 8.825 0.964 [OK] 5018 58 H LEU O 16 O1H0u 0.660 1.420 17.992 -1.000 16.208 -1.000 bad 5019 58 H LEU CB 8 C4H2s 0.770 1.880 7.879 45.195 22.951 1.969 possible 5020 58 H LEU CG 4 C4H1b 0.770 1.880 3.912 18.854 14.764 1.277 possible 5021 58 H LEU CD1 10 C4H3u 0.770 1.880 29.259 -1.000 37.425 -1.000 bad 5022 58 H LEU CD2 10 C4H3u 0.770 1.880 3.702 35.842 37.143 0.965 possible 5023 59 H PRO N 11 N3H0u 0.700 1.640 3.100 9.240 8.823 1.047 possible 5024 59 H PRO CA 4 C4H1b 0.770 1.880 6.007 31.070 13.955 2.226 possible 5025 59 H PRO C 1 C3H0s 0.770 1.610 3.081 9.267 8.812 1.052 possible 5026 59 H PRO O 16 O1H0u 0.660 1.420 5.573 29.674 16.169 1.835 possible 5027 59 H PRO CB 9 C4H2b 0.770 1.880 5.713 42.460 25.563 1.661 possible 5028 59 H PRO CG 9 C4H2b 0.770 1.880 2.768 23.318 25.832 0.903 [OK] 5029 59 H PRO CD 8 C4H2s 0.770 1.880 2.827 24.280 23.836 1.019 [OK] 5030 60 H LYS N 12 N3H1s 0.700 1.640 6.903 42.963 13.675 3.142 possible 5031 60 H LYS CA 3 C4H1s 0.770 1.880 6.881 -1.000 13.324 -1.000 bad 5032 60 H LYS C 1 C3H0s 0.770 1.610 2.234 8.420 8.759 0.961 [OK] 5033 60 H LYS O 16 O1H0u 0.660 1.420 3.228 17.875 16.049 1.114 possible 5034 60 H LYS CB 8 C4H2s 0.770 1.880 23.337 -1.000 22.904 -1.000 bad 5035 60 H LYS CG 8 C4H2s 0.770 1.880 15.685 -1.000 23.131 -1.000 bad 5036 60 H LYS CD 8 C4H2s 0.770 1.880 27.441 -1.000 23.837 -1.000 bad 5037 60 H LYS CE 9 C4H2b 0.770 1.880 36.140 -1.000 23.934 -1.000 bad 5038 60 H LYS NZ 14 N4H3u 0.700 1.640 55.160 -1.000 21.213 -1.000 bad 5039 61 H PRO N 11 N3H0u 0.700 1.640 2.735 9.083 8.823 1.029 [OK] 5040 61 H PRO CA 4 C4H1b 0.770 1.880 2.434 12.191 13.955 0.874 [OK] 5041 61 H PRO C 1 C3H0s 0.770 1.610 3.146 9.663 8.812 1.097 possible 5042 61 H PRO O 16 O1H0u 0.660 1.420 19.677 -1.000 16.169 -1.000 bad 5043 61 H PRO CB 9 C4H2b 0.770 1.880 9.448 -1.000 25.563 -1.000 bad 5044 61 H PRO CG 9 C4H2b 0.770 1.880 31.170 -1.000 25.832 -1.000 bad 5045 61 H PRO CD 8 C4H2s 0.770 1.880 24.990 -1.000 23.836 -1.000 bad 5046 62 H LYS N 12 N3H1s 0.700 1.640 2.785 13.010 13.675 0.951 [OK] 5047 62 H LYS CA 3 C4H1s 0.770 1.880 6.240 24.663 13.324 1.851 possible 5048 62 H LYS C 1 C3H0s 0.770 1.610 3.083 9.743 8.759 1.112 possible 5049 62 H LYS O 16 O1H0u 0.660 1.420 2.536 16.546 16.049 1.031 [OK] 5050 62 H LYS CB 8 C4H2s 0.770 1.880 6.098 48.602 22.904 2.122 possible 5051 62 H LYS CG 8 C4H2s 0.770 1.880 3.130 22.389 23.131 0.968 possible 5052 62 H LYS CD 8 C4H2s 0.770 1.880 2.989 24.338 23.837 1.021 [OK] 5053 62 H LYS CE 9 C4H2b 0.770 1.880 4.490 28.472 23.934 1.190 possible 5054 62 H LYS NZ 14 N4H3u 0.700 1.640 3.002 21.978 21.213 1.036 possible 5055 63 H THR N 12 N3H1s 0.700 1.640 4.778 -1.000 13.832 -1.000 bad 5056 63 H THR CA 3 C4H1s 0.770 1.880 2.802 11.739 13.099 0.896 [OK] 5057 63 H THR C 1 C3H0s 0.770 1.610 2.783 9.224 8.738 1.056 [OK] 5058 63 H THR O 16 O1H0u 0.660 1.420 6.202 42.258 16.020 2.638 possible 5059 63 H THR CB 4 C4H1b 0.770 1.880 14.033 -1.000 14.829 -1.000 bad 5060 63 H THR OG1 17 O2H1u 0.660 1.460 14.419 -1.000 18.123 -1.000 bad 5061 63 H THR CG2 10 C4H3u 0.770 1.880 15.973 -1.000 36.542 -1.000 bad 5062 64 H PHE N 12 N3H1s 0.700 1.640 2.787 13.559 13.691 0.990 [OK] 5063 64 H PHE CA 3 C4H1s 0.770 1.880 2.664 13.923 13.449 1.035 [OK] 5064 64 H PHE C 1 C3H0s 0.770 1.610 2.579 9.287 8.753 1.061 [OK] 5065 64 H PHE O 16 O1H0u 0.660 1.420 2.359 15.062 16.151 0.933 [OK] 5066 64 H PHE CB 8 C4H2s 0.770 1.880 2.997 23.626 23.777 0.994 [OK] 5067 64 H PHE CG 2 C3H0b 0.770 1.610 2.813 10.792 9.721 1.110 [OK] 5068 64 H PHE CD1 5 C3H1s 0.770 1.760 2.841 21.374 20.405 1.048 [OK] 5069 64 H PHE CD2 6 C3H1b 0.770 1.760 2.938 22.839 21.051 1.085 [OK] 5070 64 H PHE CE1 6 C3H1b 0.770 1.760 2.802 24.248 21.580 1.124 [OK] 5071 64 H PHE CE2 6 C3H1b 0.770 1.760 2.824 22.010 21.680 1.015 [OK] 5072 64 H PHE CZ 6 C3H1b 0.770 1.760 2.749 18.955 21.666 0.875 [OK] 5073 65 H ILE N 12 N3H1s 0.700 1.640 2.630 14.040 13.633 1.030 [OK] 5074 65 H ILE CA 3 C4H1s 0.770 1.880 2.699 12.851 13.007 0.988 [OK] 5075 65 H ILE C 1 C3H0s 0.770 1.610 2.457 8.488 8.470 1.002 [OK] 5076 65 H ILE O 16 O1H0u 0.660 1.420 2.314 14.860 16.144 0.920 [OK] 5077 65 H ILE CB 4 C4H1b 0.770 1.880 2.657 12.994 14.227 0.913 [OK] 5078 65 H ILE CG1 9 C4H2b 0.770 1.880 5.278 41.437 24.187 1.713 possible 5079 65 H ILE CG2 10 C4H3u 0.770 1.880 22.589 -1.000 35.961 -1.000 bad 5080 65 H ILE CD1 10 C4H3u 0.770 1.880 29.535 -1.000 38.377 -1.000 bad 5081 66 H LEU N 12 N3H1s 0.700 1.640 2.491 13.313 13.655 0.975 [OK] 5082 66 H LEU CA 3 C4H1s 0.770 1.880 2.764 11.807 13.122 0.900 [OK] 5083 66 H LEU C 1 C3H0s 0.770 1.610 2.472 9.264 8.825 1.050 [OK] 5084 66 H LEU O 16 O1H0u 0.660 1.420 4.410 28.011 16.208 1.728 possible 5085 66 H LEU CB 8 C4H2s 0.770 1.880 3.023 22.065 22.951 0.961 possible 5086 66 H LEU CG 4 C4H1b 0.770 1.880 2.599 14.300 14.764 0.969 [OK] 5087 66 H LEU CD1 10 C4H3u 0.770 1.880 2.826 35.593 37.425 0.951 [OK] 5088 66 H LEU CD2 10 C4H3u 0.770 1.880 3.501 37.214 37.143 1.002 possible 5089 67 H PRO N 11 N3H0u 0.700 1.640 2.712 8.868 8.823 1.005 [OK] 5090 67 H PRO CA 4 C4H1b 0.770 1.880 2.637 13.295 13.955 0.953 [OK] 5091 67 H PRO C 1 C3H0s 0.770 1.610 2.613 9.142 8.812 1.037 [OK] 5092 67 H PRO O 16 O1H0u 0.660 1.420 3.394 19.936 16.169 1.233 possible 5093 67 H PRO CB 9 C4H2b 0.770 1.880 3.536 32.603 25.563 1.275 possible 5094 67 H PRO CG 9 C4H2b 0.770 1.880 3.309 25.761 25.832 0.997 possible 5095 67 H PRO CD 8 C4H2s 0.770 1.880 3.875 39.678 23.836 1.665 possible 5096 68 H HIS N 12 N3H1s 0.700 1.640 4.773 26.283 13.715 1.916 possible 5097 68 H HIS CA 3 C4H1s 0.770 1.880 5.667 21.188 13.467 1.573 possible 5098 68 H HIS C 1 C3H0s 0.770 1.610 2.444 8.528 8.882 0.960 [OK] 5099 68 H HIS O 16 O1H0u 0.660 1.420 5.235 41.609 16.082 2.587 possible 5100 68 H HIS CB 8 C4H2s 0.770 1.880 3.848 27.197 23.653 1.150 possible 5101 68 H HIS CG 2 C3H0b 0.770 1.610 3.270 10.827 9.952 1.088 possible 5102 68 H HIS ND1 13 N3H1b 0.700 1.640 7.542 33.621 15.506 2.168 possible 5103 68 H HIS CD2 5 C3H1s 0.770 1.760 3.227 21.442 21.085 1.017 possible 5104 68 H HIS CE1 5 C3H1s 0.770 1.760 32.579 -1.000 20.636 -1.000 bad 5105 68 H HIS NE2 13 N3H1b 0.700 1.640 5.126 36.355 15.337 2.370 possible 5106 69 H GLY N 12 N3H1s 0.700 1.640 7.661 43.677 14.854 2.940 possible 5107 69 H GLY CA 8 C4H2s 0.770 1.880 34.963 -1.000 23.688 -1.000 bad 5108 69 H GLY C 2 C3H0b 0.770 1.610 3.786 10.518 9.840 1.069 possible 5109 69 H GLY O 16 O1H0u 0.660 1.420 31.272 -1.000 16.391 -1.000 bad 5110 70 H ARG N 12 N3H1s 0.700 1.640 3.021 14.405 13.650 1.055 possible 5111 70 H ARG CA 3 C4H1s 0.770 1.880 3.205 14.866 13.422 1.108 possible 5112 70 H ARG C 1 C3H0s 0.770 1.610 4.310 11.981 8.838 1.356 possible 5113 70 H ARG O 16 O1H0u 0.660 1.420 3.959 20.147 16.084 1.253 possible 5114 70 H ARG CB 8 C4H2s 0.770 1.880 3.070 24.421 23.088 1.058 possible 5115 70 H ARG CG 8 C4H2s 0.770 1.880 3.740 29.296 23.640 1.239 possible 5116 70 H ARG CD 8 C4H2s 0.770 1.880 3.349 27.376 23.300 1.175 possible 5117 70 H ARG NE 13 N3H1b 0.700 1.640 4.311 24.788 15.569 1.592 possible 5118 70 H ARG CZ 2 C3H0b 0.770 1.610 2.776 10.083 9.747 1.034 [OK] 5119 70 H ARG NH1 15 N3H2u 0.700 1.640 3.135 31.147 22.782 1.367 possible 5120 70 H ARG NH2 15 N3H2u 0.700 1.640 5.089 33.303 23.810 1.399 possible 5121 71 H GLY N 12 N3H1s 0.700 1.640 4.707 28.945 14.854 1.949 possible 5122 71 H GLY CA 8 C4H2s 0.770 1.880 37.688 -1.000 23.688 -1.000 bad 5123 71 H GLY C 2 C3H0b 0.770 1.610 3.745 11.019 9.840 1.120 possible 5124 71 H GLY O 16 O1H0u 0.660 1.420 5.137 24.554 16.391 1.498 possible 5125 72 H THR N 12 N3H1s 0.700 1.640 5.030 20.180 13.832 1.459 possible 5126 72 H THR CA 3 C4H1s 0.770 1.880 2.451 12.255 13.099 0.936 [OK] 5127 72 H THR C 1 C3H0s 0.770 1.610 3.071 9.921 8.738 1.135 possible 5128 72 H THR O 16 O1H0u 0.660 1.420 13.522 -1.000 16.020 -1.000 bad 5129 72 H THR CB 4 C4H1b 0.770 1.880 2.950 13.987 14.829 0.943 [OK] 5130 72 H THR OG1 17 O2H1u 0.660 1.460 31.378 -1.000 18.123 -1.000 bad 5131 72 H THR CG2 10 C4H3u 0.770 1.880 27.445 -1.000 36.542 -1.000 bad 5132 73 H LEU N 12 N3H1s 0.700 1.640 2.770 14.440 13.655 1.057 [OK] 5133 73 H LEU CA 3 C4H1s 0.770 1.880 3.638 13.990 13.122 1.066 possible 5134 73 H LEU C 1 C3H0s 0.770 1.610 2.631 9.243 8.825 1.047 [OK] 5135 73 H LEU O 16 O1H0u 0.660 1.420 2.510 15.781 16.208 0.974 [OK] 5136 73 H LEU CB 8 C4H2s 0.770 1.880 2.997 24.238 22.951 1.056 [OK] 5137 73 H LEU CG 4 C4H1b 0.770 1.880 2.876 14.733 14.764 0.998 [OK] 5138 73 H LEU CD1 10 C4H3u 0.770 1.880 3.013 36.092 37.425 0.964 possible 5139 73 H LEU CD2 10 C4H3u 0.770 1.880 6.716 97.196 37.143 2.617 possible 5140 74 H THR N 12 N3H1s 0.700 1.640 5.852 25.729 13.832 1.860 possible 5141 74 H THR CA 3 C4H1s 0.770 1.880 2.516 12.096 13.099 0.923 [OK] 5142 74 H THR C 1 C3H0s 0.770 1.610 2.490 8.979 8.738 1.028 [OK] 5143 74 H THR O 16 O1H0u 0.660 1.420 5.634 40.205 16.020 2.510 possible 5144 74 H THR CB 4 C4H1b 0.770 1.880 7.448 47.619 14.829 3.211 possible 5145 74 H THR OG1 17 O2H1u 0.660 1.460 12.585 -1.000 18.123 -1.000 bad 5146 74 H THR CG2 10 C4H3u 0.770 1.880 27.366 -1.000 36.542 -1.000 bad 5147 75 H VAL N 12 N3H1s 0.700 1.640 2.728 14.542 13.676 1.063 [OK] 5148 75 H VAL CA 3 C4H1s 0.770 1.880 2.780 11.820 13.123 0.901 [OK] 5149 75 H VAL C 1 C3H0s 0.770 1.610 2.501 9.197 8.563 1.074 [OK] 5150 75 H VAL O 16 O1H0u 0.660 1.420 2.279 13.616 16.181 0.841 [OK] 5151 75 H VAL CB 4 C4H1b 0.770 1.880 3.044 13.636 14.598 0.934 possible 5152 75 H VAL CG1 10 C4H3u 0.770 1.880 4.564 48.016 36.584 1.312 possible 5153 75 H VAL CG2 10 C4H3u 0.770 1.880 3.077 34.896 36.332 0.960 possible 5154 76 H PRO N 11 N3H0u 0.700 1.640 2.350 8.698 8.823 0.986 [OK] 5155 76 H PRO CA 4 C4H1b 0.770 1.880 2.691 14.303 13.955 1.025 [OK] 5156 76 H PRO C 1 C3H0s 0.770 1.610 4.162 10.140 8.812 1.151 possible 5157 76 H PRO O 16 O1H0u 0.660 1.420 5.713 41.084 16.169 2.541 possible 5158 76 H PRO CB 9 C4H2b 0.770 1.880 4.700 33.415 25.563 1.307 possible 5159 76 H PRO CG 9 C4H2b 0.770 1.880 3.578 26.257 25.832 1.016 possible 5160 76 H PRO CD 8 C4H2s 0.770 1.880 3.759 25.300 23.836 1.061 possible 5161 77 H GLY N 12 N3H1s 0.700 1.640 4.282 18.238 14.854 1.228 possible 5162 77 H GLY CA 8 C4H2s 0.770 1.880 6.184 48.991 23.688 2.068 possible 5163 77 H GLY C 2 C3H0b 0.770 1.610 4.992 15.705 9.840 1.596 possible 5164 77 H GLY O 16 O1H0u 0.660 1.420 4.178 28.438 16.391 1.735 possible 5165 78 H PRO N 11 N3H0u 0.700 1.640 4.703 11.545 8.823 1.308 possible 5166 78 H PRO CA 4 C4H1b 0.770 1.880 6.399 31.141 13.955 2.232 possible 5167 78 H PRO C 1 C3H0s 0.770 1.610 2.723 9.074 8.812 1.030 [OK] 5168 78 H PRO O 16 O1H0u 0.660 1.420 7.524 60.269 16.169 3.727 possible 5169 78 H PRO CB 9 C4H2b 0.770 1.880 33.575 -1.000 25.563 -1.000 bad 5170 78 H PRO CG 9 C4H2b 0.770 1.880 44.564 -1.000 25.832 -1.000 bad 5171 78 H PRO CD 8 C4H2s 0.770 1.880 32.488 -1.000 23.836 -1.000 bad 5172 79 H GLU N 12 N3H1s 0.700 1.640 6.821 40.981 13.615 3.010 possible 5173 79 H GLU CA 3 C4H1s 0.770 1.880 3.490 15.983 13.399 1.193 possible 5174 79 H GLU C 1 C3H0s 0.770 1.610 2.698 8.317 8.675 0.959 [OK] 5175 79 H GLU O 16 O1H0u 0.660 1.420 19.413 -1.000 16.023 -1.000 bad 5176 79 H GLU CB 8 C4H2s 0.770 1.880 6.816 54.210 23.529 2.304 possible 5177 79 H GLU CG 8 C4H2s 0.770 1.880 3.615 27.532 23.513 1.171 possible 5178 79 H GLU CD 2 C3H0b 0.770 1.610 2.461 9.138 9.460 0.966 [OK] 5179 79 H GLU OE1 16 O1H0u 0.660 1.420 3.067 19.370 15.999 1.211 possible 5180 79 H GLU OE2 16 O1H0u 0.660 1.420 2.529 18.208 17.432 1.044 [OK] 5181 80 H SER N 12 N3H1s 0.700 1.640 3.595 17.829 14.103 1.264 possible 5182 80 H SER CA 3 C4H1s 0.770 1.880 9.540 -1.000 13.476 -1.000 bad 5183 80 H SER C 1 C3H0s 0.770 1.610 2.842 9.903 8.923 1.110 [OK] 5184 80 H SER O 16 O1H0u 0.660 1.420 4.669 29.735 16.179 1.838 possible 5185 80 H SER CB 8 C4H2s 0.770 1.880 23.741 -1.000 23.884 -1.000 bad 5186 80 H SER OG 17 O2H1u 0.660 1.460 3.984 35.529 18.732 1.897 possible 5187 81 H GLU N 12 N3H1s 0.700 1.640 2.399 13.895 13.615 1.021 [OK] 5188 81 H GLU CA 3 C4H1s 0.770 1.880 3.036 13.853 13.399 1.034 possible 5189 81 H GLU C 1 C3H0s 0.770 1.610 2.963 8.789 8.675 1.013 [OK] 5190 81 H GLU O 16 O1H0u 0.660 1.420 12.964 -1.000 16.023 -1.000 bad 5191 81 H GLU CB 8 C4H2s 0.770 1.880 2.996 21.548 23.529 0.916 [OK] 5192 81 H GLU CG 8 C4H2s 0.770 1.880 3.233 26.071 23.513 1.109 possible 5193 81 H GLU CD 2 C3H0b 0.770 1.610 2.866 10.227 9.460 1.081 [OK] 5194 81 H GLU OE1 16 O1H0u 0.660 1.420 2.685 17.782 15.999 1.111 [OK] 5195 81 H GLU OE2 16 O1H0u 0.660 1.420 4.228 28.571 17.432 1.639 possible 5196 82 H ASP N 12 N3H1s 0.700 1.640 2.973 12.420 13.895 0.894 [OK] 5197 82 H ASP CA 3 C4H1s 0.770 1.880 10.513 -1.000 13.377 -1.000 bad 5198 82 H ASP C 1 C3H0s 0.770 1.610 3.582 10.421 8.816 1.182 possible 5199 82 H ASP O 16 O1H0u 0.660 1.420 24.117 -1.000 16.091 -1.000 bad 5200 82 H ASP CB 8 C4H2s 0.770 1.880 33.269 -1.000 23.481 -1.000 bad 5201 82 H ASP CG 2 C3H0b 0.770 1.610 3.474 -1.000 9.422 -1.000 bad 5202 82 H ASP OD1 16 O1H0u 0.660 1.420 15.335 -1.000 15.505 -1.000 bad 5203 82 H ASP OD2 16 O1H0u 0.660 1.420 30.372 -1.000 16.324 -1.000 bad 5204 83 H ARG N 12 N3H1s 0.700 1.640 3.129 13.691 13.650 1.003 possible 5205 83 H ARG CA 3 C4H1s 0.770 1.880 4.666 19.068 13.422 1.421 possible 5206 83 H ARG C 1 C3H0s 0.770 1.610 2.639 8.589 8.838 0.972 [OK] 5207 83 H ARG O 16 O1H0u 0.660 1.420 7.193 38.463 16.084 2.391 possible 5208 83 H ARG CB 8 C4H2s 0.770 1.880 5.509 40.170 23.088 1.740 possible 5209 83 H ARG CG 8 C4H2s 0.770 1.880 2.827 22.514 23.640 0.952 [OK] 5210 83 H ARG CD 8 C4H2s 0.770 1.880 3.061 25.735 23.300 1.105 possible 5211 83 H ARG NE 13 N3H1b 0.700 1.640 4.388 20.570 15.569 1.321 possible 5212 83 H ARG CZ 2 C3H0b 0.770 1.610 2.495 9.524 9.747 0.977 [OK] 5213 83 H ARG NH1 15 N3H2u 0.700 1.640 2.881 24.841 22.782 1.090 [OK] 5214 83 H ARG NH2 15 N3H2u 0.700 1.640 4.460 28.791 23.810 1.209 possible 5215 84 H PRO N 11 N3H0u 0.700 1.640 3.342 9.855 8.823 1.117 possible 5216 84 H PRO CA 4 C4H1b 0.770 1.880 9.498 -1.000 13.955 -1.000 bad 5217 84 H PRO C 1 C3H0s 0.770 1.610 2.896 9.121 8.812 1.035 [OK] 5218 84 H PRO O 16 O1H0u 0.660 1.420 5.008 27.854 16.169 1.723 possible 5219 84 H PRO CB 9 C4H2b 0.770 1.880 34.320 -1.000 25.563 -1.000 bad 5220 84 H PRO CG 9 C4H2b 0.770 1.880 44.133 -1.000 25.832 -1.000 bad 5221 84 H PRO CD 8 C4H2s 0.770 1.880 26.459 -1.000 23.836 -1.000 bad 5222 85 H ILE N 12 N3H1s 0.700 1.640 7.486 37.809 13.633 2.773 possible 5223 85 H ILE CA 3 C4H1s 0.770 1.880 2.699 12.096 13.007 0.930 [OK] 5224 85 H ILE C 1 C3H0s 0.770 1.610 3.205 8.987 8.470 1.061 possible 5225 85 H ILE O 16 O1H0u 0.660 1.420 13.458 -1.000 16.144 -1.000 bad 5226 85 H ILE CB 4 C4H1b 0.770 1.880 5.663 20.419 14.227 1.435 possible 5227 85 H ILE CG1 9 C4H2b 0.770 1.880 6.203 41.778 24.187 1.727 possible 5228 85 H ILE CG2 10 C4H3u 0.770 1.880 2.981 31.856 35.961 0.886 [OK] 5229 85 H ILE CD1 10 C4H3u 0.770 1.880 3.103 38.841 38.377 1.012 possible 5230 86 H ALA N 12 N3H1s 0.700 1.640 3.217 15.973 14.046 1.137 possible 5231 86 H ALA CA 4 C4H1b 0.770 1.880 6.497 30.037 14.063 2.136 possible 5232 86 H ALA C 1 C3H0s 0.770 1.610 2.804 9.800 8.900 1.101 [OK] 5233 86 H ALA O 16 O1H0u 0.660 1.420 2.295 14.205 16.188 0.878 [OK] 5234 86 H ALA CB 10 C4H3u 0.770 1.880 7.918 71.954 36.782 1.956 possible 5235 87 H LEU N 12 N3H1s 0.700 1.640 4.073 17.422 13.655 1.276 possible 5236 87 H LEU CA 3 C4H1s 0.770 1.880 2.456 11.791 13.122 0.899 [OK] 5237 87 H LEU C 1 C3H0s 0.770 1.610 2.753 9.249 8.825 1.048 [OK] 5238 87 H LEU O 16 O1H0u 0.660 1.420 8.461 -1.000 16.208 -1.000 bad 5239 87 H LEU CB 8 C4H2s 0.770 1.880 2.782 20.270 22.951 0.883 [OK] 5240 87 H LEU CG 4 C4H1b 0.770 1.880 2.673 14.259 14.764 0.966 [OK] 5241 87 H LEU CD1 10 C4H3u 0.770 1.880 2.938 35.469 37.425 0.948 [OK] 5242 87 H LEU CD2 10 C4H3u 0.770 1.880 2.729 28.781 37.143 0.775 [OK] 5243 88 H ALA N 12 N3H1s 0.700 1.640 2.762 12.588 14.046 0.896 [OK] 5244 88 H ALA CA 4 C4H1b 0.770 1.880 7.694 -1.000 14.063 -1.000 bad 5245 88 H ALA C 1 C3H0s 0.770 1.610 2.479 9.044 8.900 1.016 [OK] 5246 88 H ALA O 16 O1H0u 0.660 1.420 2.772 15.792 16.188 0.976 [OK] 5247 88 H ALA CB 10 C4H3u 0.770 1.880 37.442 -1.000 36.782 -1.000 bad 5248 89 H ARG N 12 N3H1s 0.700 1.640 5.702 -1.000 13.650 -1.000 bad 5249 89 H ARG CA 3 C4H1s 0.770 1.880 2.619 13.590 13.422 1.013 [OK] 5250 89 H ARG C 1 C3H0s 0.770 1.610 3.121 9.110 8.838 1.031 possible 5251 89 H ARG O 16 O1H0u 0.660 1.420 19.633 -1.000 16.084 -1.000 bad 5252 89 H ARG CB 8 C4H2s 0.770 1.880 20.917 -1.000 23.088 -1.000 bad 5253 89 H ARG CG 8 C4H2s 0.770 1.880 4.269 24.244 23.640 1.026 possible 5254 89 H ARG CD 8 C4H2s 0.770 1.880 26.626 -1.000 23.300 -1.000 bad 5255 89 H ARG NE 13 N3H1b 0.700 1.640 4.849 19.480 15.569 1.251 possible 5256 89 H ARG CZ 2 C3H0b 0.770 1.610 5.021 16.017 9.747 1.643 possible 5257 89 H ARG NH1 15 N3H2u 0.700 1.640 6.063 54.618 22.782 2.397 possible 5258 89 H ARG NH2 15 N3H2u 0.700 1.640 5.514 30.979 23.810 1.301 possible 5259 90 H THR N 12 N3H1s 0.700 1.640 2.330 12.710 13.832 0.919 [OK] 5260 90 H THR CA 3 C4H1s 0.770 1.880 5.026 17.189 13.099 1.312 possible 5261 90 H THR C 1 C3H0s 0.770 1.610 4.339 11.750 8.738 1.345 possible 5262 90 H THR O 16 O1H0u 0.660 1.420 26.274 -1.000 16.020 -1.000 bad 5263 90 H THR CB 4 C4H1b 0.770 1.880 2.971 15.844 14.829 1.068 [OK] 5264 90 H THR OG1 17 O2H1u 0.660 1.460 4.193 24.813 18.123 1.369 possible 5265 90 H THR CG2 10 C4H3u 0.770 1.880 51.563 -1.000 36.542 -1.000 bad 5266 91 H ALA N 12 N3H1s 0.700 1.640 4.305 17.445 14.046 1.242 possible 5267 91 H ALA CA 4 C4H1b 0.770 1.880 6.100 24.527 14.063 1.744 possible 5268 91 H ALA C 1 C3H0s 0.770 1.610 4.592 12.597 8.900 1.415 possible 5269 91 H ALA O 16 O1H0u 0.660 1.420 3.203 16.920 16.188 1.045 possible 5270 91 H ALA CB 10 C4H3u 0.770 1.880 23.702 -1.000 36.782 -1.000 bad 5271 92 H VAL N 12 N3H1s 0.700 1.640 5.141 24.735 13.676 1.809 possible 5272 92 H VAL CA 3 C4H1s 0.770 1.880 4.125 17.499 13.123 1.333 possible 5273 92 H VAL C 1 C3H0s 0.770 1.610 3.670 9.171 8.563 1.071 possible 5274 92 H VAL O 16 O1H0u 0.660 1.420 10.639 -1.000 16.181 -1.000 bad 5275 92 H VAL CB 4 C4H1b 0.770 1.880 9.848 -1.000 14.598 -1.000 bad 5276 92 H VAL CG1 10 C4H3u 0.770 1.880 59.043 -1.000 36.584 -1.000 bad 5277 92 H VAL CG2 10 C4H3u 0.770 1.880 61.700 -1.000 36.332 -1.000 bad 5278 93 H SER N 12 N3H1s 0.700 1.640 4.543 22.254 14.103 1.578 possible 5279 93 H SER CA 3 C4H1s 0.770 1.880 9.963 -1.000 13.476 -1.000 bad 5280 93 H SER C 1 C3H0s 0.770 1.610 2.239 8.324 8.923 0.933 [OK] 5281 93 H SER O 16 O1H0u 0.660 1.420 2.251 15.589 16.179 0.964 [OK] 5282 93 H SER CB 8 C4H2s 0.770 1.880 28.490 -1.000 23.884 -1.000 bad 5283 93 H SER OG 17 O2H1u 0.660 1.460 28.780 -1.000 18.732 -1.000 bad 5284 94 H GLU N 12 N3H1s 0.700 1.640 4.674 20.929 13.615 1.537 possible 5285 94 H GLU CA 3 C4H1s 0.770 1.880 2.528 13.218 13.399 0.986 [OK] 5286 94 H GLU C 1 C3H0s 0.770 1.610 3.703 9.570 8.675 1.103 possible 5287 94 H GLU O 16 O1H0u 0.660 1.420 5.568 45.172 16.023 2.819 possible 5288 94 H GLU CB 8 C4H2s 0.770 1.880 18.046 -1.000 23.529 -1.000 bad 5289 94 H GLU CG 8 C4H2s 0.770 1.880 33.880 -1.000 23.513 -1.000 bad 5290 94 H GLU CD 2 C3H0b 0.770 1.610 6.518 15.826 9.460 1.673 possible 5291 94 H GLU OE1 16 O1H0u 0.660 1.420 5.582 42.368 15.999 2.648 possible 5292 94 H GLU OE2 16 O1H0u 0.660 1.420 6.604 33.601 17.432 1.928 possible 5293 95 H GLY N 12 N3H1s 0.700 1.640 3.355 14.808 14.854 0.997 possible 5294 95 H GLY CA 8 C4H2s 0.770 1.880 3.923 30.554 23.688 1.290 possible 5295 95 H GLY C 2 C3H0b 0.770 1.610 3.074 10.031 9.840 1.019 possible 5296 95 H GLY O 16 O1H0u 0.660 1.420 3.028 16.480 16.391 1.005 possible 5297 96 H PHE N 12 N3H1s 0.700 1.640 2.297 12.046 13.691 0.880 [OK] 5298 96 H PHE CA 3 C4H1s 0.770 1.880 2.676 12.368 13.449 0.920 [OK] 5299 96 H PHE C 1 C3H0s 0.770 1.610 2.411 9.274 8.753 1.059 [OK] 5300 96 H PHE O 16 O1H0u 0.660 1.420 2.401 16.460 16.151 1.019 [OK] 5301 96 H PHE CB 8 C4H2s 0.770 1.880 3.503 27.323 23.777 1.149 possible 5302 96 H PHE CG 2 C3H0b 0.770 1.610 2.827 10.067 9.721 1.036 [OK] 5303 96 H PHE CD1 5 C3H1s 0.770 1.760 5.917 47.650 20.405 2.335 possible 5304 96 H PHE CD2 6 C3H1b 0.770 1.760 2.805 19.077 21.051 0.906 [OK] 5305 96 H PHE CE1 6 C3H1b 0.770 1.760 18.917 -1.000 21.580 -1.000 bad 5306 96 H PHE CE2 6 C3H1b 0.770 1.760 5.484 37.111 21.680 1.712 possible 5307 96 H PHE CZ 6 C3H1b 0.770 1.760 30.572 -1.000 21.666 -1.000 bad 5308 97 H PRO N 11 N3H0u 0.700 1.640 2.577 8.274 8.823 0.938 [OK] 5309 97 H PRO CA 4 C4H1b 0.770 1.880 2.740 13.417 13.955 0.961 [OK] 5310 97 H PRO C 1 C3H0s 0.770 1.610 2.700 9.031 8.812 1.025 [OK] 5311 97 H PRO O 16 O1H0u 0.660 1.420 2.458 15.040 16.169 0.930 [OK] 5312 97 H PRO CB 9 C4H2b 0.770 1.880 3.689 25.054 25.563 0.980 possible 5313 97 H PRO CG 9 C4H2b 0.770 1.880 4.182 34.041 25.832 1.318 possible 5314 97 H PRO CD 8 C4H2s 0.770 1.880 4.439 36.531 23.836 1.533 possible 5315 98 H HIS N 12 N3H1s 0.700 1.640 2.608 12.837 13.715 0.936 [OK] 5316 98 H HIS CA 3 C4H1s 0.770 1.880 2.593 12.757 13.467 0.947 [OK] 5317 98 H HIS C 1 C3H0s 0.770 1.610 2.544 9.055 8.882 1.019 [OK] 5318 98 H HIS O 16 O1H0u 0.660 1.420 2.319 15.629 16.082 0.972 [OK] 5319 98 H HIS CB 8 C4H2s 0.770 1.880 3.054 24.114 23.653 1.019 possible 5320 98 H HIS CG 2 C3H0b 0.770 1.610 2.909 11.488 9.952 1.154 [OK] 5321 98 H HIS ND1 13 N3H1b 0.700 1.640 2.901 17.424 15.506 1.124 [OK] 5322 98 H HIS CD2 5 C3H1s 0.770 1.760 3.226 23.147 21.085 1.098 possible 5323 98 H HIS CE1 5 C3H1s 0.770 1.760 3.641 25.303 20.636 1.226 possible 5324 98 H HIS NE2 13 N3H1b 0.700 1.640 3.106 20.349 15.337 1.327 possible 5325 99 H ALA N 12 N3H1s 0.700 1.640 2.709 14.574 14.046 1.038 [OK] 5326 99 H ALA CA 4 C4H1b 0.770 1.880 2.707 12.318 14.063 0.876 [OK] 5327 99 H ALA C 1 C3H0s 0.770 1.610 2.388 8.622 8.900 0.969 [OK] 5328 99 H ALA O 16 O1H0u 0.660 1.420 2.811 15.406 16.188 0.952 [OK] 5329 99 H ALA CB 10 C4H3u 0.770 1.880 32.717 -1.000 36.782 -1.000 bad 5330 100 H PRO N 11 N3H0u 0.700 1.640 2.708 8.200 8.823 0.929 [OK] 5331 100 H PRO CA 4 C4H1b 0.770 1.880 2.635 12.410 13.955 0.889 [OK] 5332 100 H PRO C 1 C3H0s 0.770 1.610 2.507 8.851 8.812 1.004 [OK] 5333 100 H PRO O 16 O1H0u 0.660 1.420 20.498 -1.000 16.169 -1.000 bad 5334 100 H PRO CB 9 C4H2b 0.770 1.880 6.391 33.639 25.563 1.316 possible 5335 100 H PRO CG 9 C4H2b 0.770 1.880 5.091 30.473 25.832 1.180 possible 5336 100 H PRO CD 8 C4H2s 0.770 1.880 8.871 -1.000 23.836 -1.000 bad 5337 101 H THR N 12 N3H1s 0.700 1.640 2.481 12.400 13.832 0.896 [OK] 5338 101 H THR CA 3 C4H1s 0.770 1.880 5.671 21.349 13.099 1.630 possible 5339 101 H THR C 1 C3H0s 0.770 1.610 3.667 10.337 8.738 1.183 possible 5340 101 H THR O 16 O1H0u 0.660 1.420 34.532 -1.000 16.020 -1.000 bad 5341 101 H THR CB 4 C4H1b 0.770 1.880 16.144 -1.000 14.829 -1.000 bad 5342 101 H THR OG1 17 O2H1u 0.660 1.460 8.289 -1.000 18.123 -1.000 bad 5343 101 H THR CG2 10 C4H3u 0.770 1.880 25.828 -1.000 36.542 -1.000 bad 5344 102 H GLY N 12 N3H1s 0.700 1.640 3.823 15.286 14.854 1.029 possible 5345 102 H GLY CA 8 C4H2s 0.770 1.880 28.675 -1.000 23.688 -1.000 bad 5346 102 H GLY C 2 C3H0b 0.770 1.610 1.715 -1.000 9.840 -1.000 bad 5347 102 H GLY O 16 O1H0u 0.660 1.420 11.427 -1.000 16.391 -1.000 bad 5348 103 H ASP N 12 N3H1s 0.700 1.640 6.500 -1.000 13.895 -1.000 bad 5349 103 H ASP CA 3 C4H1s 0.770 1.880 6.398 22.755 13.377 1.701 possible 5350 103 H ASP C 1 C3H0s 0.770 1.610 2.326 8.587 8.816 0.974 [OK] 5351 103 H ASP O 16 O1H0u 0.660 1.420 2.527 14.825 16.091 0.921 [OK] 5352 103 H ASP CB 8 C4H2s 0.770 1.880 14.948 -1.000 23.481 -1.000 bad 5353 103 H ASP CG 2 C3H0b 0.770 1.610 4.589 12.247 9.422 1.300 possible 5354 103 H ASP OD1 16 O1H0u 0.660 1.420 5.213 30.354 15.505 1.958 possible 5355 103 H ASP OD2 16 O1H0u 0.660 1.420 25.687 -1.000 16.324 -1.000 bad 5356 104 H PRO N 11 N3H0u 0.700 1.640 2.402 8.706 8.823 0.987 [OK] 5357 104 H PRO CA 4 C4H1b 0.770 1.880 2.711 14.445 13.955 1.035 [OK] 5358 104 H PRO C 1 C3H0s 0.770 1.610 2.472 9.106 8.812 1.033 [OK] 5359 104 H PRO O 16 O1H0u 0.660 1.420 2.313 16.707 16.169 1.033 [OK] 5360 104 H PRO CB 9 C4H2b 0.770 1.880 2.837 23.052 25.563 0.902 [OK] 5361 104 H PRO CG 9 C4H2b 0.770 1.880 6.993 48.355 25.832 1.872 possible 5362 104 H PRO CD 8 C4H2s 0.770 1.880 14.191 -1.000 23.836 -1.000 bad 5363 105 H MET N 12 N3H1s 0.700 1.640 2.574 14.398 13.564 1.061 [OK] 5364 105 H MET CA 3 C4H1s 0.770 1.880 2.947 13.845 13.231 1.046 [OK] 5365 105 H MET C 1 C3H0s 0.770 1.610 2.499 8.757 8.782 0.997 [OK] 5366 105 H MET O 16 O1H0u 0.660 1.420 3.233 21.401 16.277 1.315 possible 5367 105 H MET CB 8 C4H2s 0.770 1.880 3.448 25.849 23.645 1.093 possible 5368 105 H MET CG 9 C4H2b 0.770 1.880 4.592 37.469 24.009 1.561 possible 5369 105 H MET SD 19 S2H0u 1.040 1.770 2.852 29.075 30.093 0.966 [OK] 5370 105 H MET CE 10 C4H3u 0.770 1.880 3.213 37.296 37.161 1.004 possible 5371 106 H LYS N 12 N3H1s 0.700 1.640 2.665 14.086 13.675 1.030 [OK] 5372 106 H LYS CA 3 C4H1s 0.770 1.880 4.770 21.081 13.324 1.582 possible 5373 106 H LYS C 1 C3H0s 0.770 1.610 2.959 9.123 8.759 1.042 [OK] 5374 106 H LYS O 16 O1H0u 0.660 1.420 25.400 -1.000 16.049 -1.000 bad 5375 106 H LYS CB 8 C4H2s 0.770 1.880 11.859 -1.000 22.904 -1.000 bad 5376 106 H LYS CG 8 C4H2s 0.770 1.880 10.637 -1.000 23.131 -1.000 bad 5377 106 H LYS CD 8 C4H2s 0.770 1.880 20.696 -1.000 23.837 -1.000 bad 5378 106 H LYS CE 9 C4H2b 0.770 1.880 21.154 -1.000 23.934 -1.000 bad 5379 106 H LYS NZ 14 N4H3u 0.700 1.640 50.633 -1.000 21.213 -1.000 bad 5380 107 H ASP N 12 N3H1s 0.700 1.640 2.368 12.757 13.895 0.918 [OK] 5381 107 H ASP CA 3 C4H1s 0.770 1.880 5.979 20.623 13.377 1.542 possible 5382 107 H ASP C 1 C3H0s 0.770 1.610 2.809 9.881 8.816 1.121 [OK] 5383 107 H ASP O 16 O1H0u 0.660 1.420 5.394 29.159 16.091 1.812 possible 5384 107 H ASP CB 8 C4H2s 0.770 1.880 3.780 25.788 23.481 1.098 possible 5385 107 H ASP CG 2 C3H0b 0.770 1.610 3.666 10.866 9.422 1.153 possible 5386 107 H ASP OD1 16 O1H0u 0.660 1.420 27.979 -1.000 15.505 -1.000 bad 5387 107 H ASP OD2 16 O1H0u 0.660 1.420 6.514 28.962 16.324 1.774 possible 5388 108 H GLY N 12 N3H1s 0.700 1.640 2.921 15.635 14.854 1.053 [OK] 5389 108 H GLY CA 8 C4H2s 0.770 1.880 3.057 23.307 23.688 0.984 possible 5390 108 H GLY C 2 C3H0b 0.770 1.610 2.242 8.996 9.840 0.914 [OK] 5391 108 H GLY O 16 O1H0u 0.660 1.420 2.472 17.096 16.391 1.043 [OK] 5392 109 H VAL N 12 N3H1s 0.700 1.640 2.403 13.711 13.676 1.003 [OK] 5393 109 H VAL CA 3 C4H1s 0.770 1.880 2.645 12.156 13.123 0.926 [OK] 5394 109 H VAL C 1 C3H0s 0.770 1.610 2.800 8.896 8.563 1.039 [OK] 5395 109 H VAL O 16 O1H0u 0.660 1.420 2.558 17.690 16.181 1.093 [OK] 5396 109 H VAL CB 4 C4H1b 0.770 1.880 2.647 14.492 14.598 0.993 [OK] 5397 109 H VAL CG1 10 C4H3u 0.770 1.880 2.958 37.026 36.584 1.012 [OK] 5398 109 H VAL CG2 10 C4H3u 0.770 1.880 3.087 37.240 36.332 1.025 possible 5399 110 H GLY N 12 N3H1s 0.700 1.640 2.735 13.315 14.854 0.896 [OK] 5400 110 H GLY CA 8 C4H2s 0.770 1.880 2.847 20.612 23.688 0.870 [OK] 5401 110 H GLY C 2 C3H0b 0.770 1.610 2.226 8.286 9.840 0.842 [OK] 5402 110 H GLY O 16 O1H0u 0.660 1.420 2.716 15.714 16.391 0.959 [OK] 5403 111 H PRO N 11 N3H0u 0.700 1.640 2.329 7.951 8.823 0.901 [OK] 5404 111 H PRO CA 4 C4H1b 0.770 1.880 3.212 15.225 13.955 1.091 possible 5405 111 H PRO C 1 C3H0s 0.770 1.610 2.300 8.638 8.812 0.980 [OK] 5406 111 H PRO O 16 O1H0u 0.660 1.420 2.459 14.832 16.169 0.917 [OK] 5407 111 H PRO CB 9 C4H2b 0.770 1.880 2.934 24.029 25.563 0.940 [OK] 5408 111 H PRO CG 9 C4H2b 0.770 1.880 2.949 23.300 25.832 0.902 [OK] 5409 111 H PRO CD 8 C4H2s 0.770 1.880 2.765 22.465 23.836 0.942 [OK] 5410 112 H ALA N 12 N3H1s 0.700 1.640 2.444 12.968 14.046 0.923 [OK] 5411 112 H ALA CA 4 C4H1b 0.770 1.880 2.495 12.335 14.063 0.877 [OK] 5412 112 H ALA C 1 C3H0s 0.770 1.610 2.332 9.508 8.900 1.068 [OK] 5413 112 H ALA O 16 O1H0u 0.660 1.420 2.635 17.351 16.188 1.072 [OK] 5414 112 H ALA CB 10 C4H3u 0.770 1.880 2.951 37.655 36.782 1.024 [OK] 5415 113 H SER N 12 N3H1s 0.700 1.640 2.296 12.744 14.103 0.904 [OK] 5416 113 H SER CA 3 C4H1s 0.770 1.880 2.539 11.928 13.476 0.885 [OK] 5417 113 H SER C 1 C3H0s 0.770 1.610 2.644 9.246 8.923 1.036 [OK] 5418 113 H SER O 16 O1H0u 0.660 1.420 2.571 17.252 16.179 1.066 [OK] 5419 113 H SER CB 8 C4H2s 0.770 1.880 2.982 23.770 23.884 0.995 [OK] 5420 113 H SER OG 17 O2H1u 0.660 1.460 2.361 17.812 18.732 0.951 [OK] 5421 114 H TRP N 12 N3H1s 0.700 1.640 2.906 15.223 13.791 1.104 [OK] 5422 114 H TRP CA 3 C4H1s 0.770 1.880 2.863 14.661 13.377 1.096 [OK] 5423 114 H TRP C 1 C3H0s 0.770 1.610 2.895 9.234 8.724 1.058 [OK] 5424 114 H TRP O 16 O1H0u 0.660 1.420 2.538 16.613 15.951 1.042 [OK] 5425 114 H TRP CB 8 C4H2s 0.770 1.880 3.123 24.076 24.004 1.003 possible 5426 114 H TRP CG 2 C3H0b 0.770 1.610 2.283 9.149 9.965 0.918 [OK] 5427 114 H TRP CD1 5 C3H1s 0.770 1.760 3.170 23.287 20.874 1.116 possible 5428 114 H TRP CD2 2 C3H0b 0.770 1.610 2.279 9.312 10.097 0.922 [OK] 5429 114 H TRP NE1 13 N3H1b 0.700 1.640 4.222 30.641 16.969 1.806 possible 5430 114 H TRP CE2 2 C3H0b 0.770 1.610 2.715 9.439 9.889 0.955 [OK] 5431 114 H TRP CE3 6 C3H1b 0.770 1.760 2.972 19.927 20.448 0.975 [OK] 5432 114 H TRP CZ2 6 C3H1b 0.770 1.760 7.776 70.443 21.012 3.353 possible 5433 114 H TRP CZ3 6 C3H1b 0.770 1.760 3.975 21.981 21.516 1.022 possible 5434 114 H TRP CH2 6 C3H1b 0.770 1.760 6.642 53.901 21.339 2.526 possible 5435 115 H VAL N 12 N3H1s 0.700 1.640 2.361 12.251 13.676 0.896 [OK] 5436 115 H VAL CA 3 C4H1s 0.770 1.880 2.788 12.139 13.123 0.925 [OK] 5437 115 H VAL C 1 C3H0s 0.770 1.610 2.446 8.010 8.563 0.935 [OK] 5438 115 H VAL O 16 O1H0u 0.660 1.420 2.590 17.054 16.181 1.054 [OK] 5439 115 H VAL CB 4 C4H1b 0.770 1.880 2.547 13.561 14.598 0.929 [OK] 5440 115 H VAL CG1 10 C4H3u 0.770 1.880 3.221 37.608 36.584 1.028 possible 5441 115 H VAL CG2 10 C4H3u 0.770 1.880 3.037 31.762 36.332 0.874 possible 5442 116 H ALA N 12 N3H1s 0.700 1.640 2.814 14.462 14.046 1.030 [OK] 5443 116 H ALA CA 4 C4H1b 0.770 1.880 2.757 12.612 14.063 0.897 [OK] 5444 116 H ALA C 1 C3H0s 0.770 1.610 2.542 9.438 8.900 1.060 [OK] 5445 116 H ALA O 16 O1H0u 0.660 1.420 2.708 19.399 16.188 1.198 [OK] 5446 116 H ALA CB 10 C4H3u 0.770 1.880 4.217 54.663 36.782 1.486 possible 5447 117 H ARG N 12 N3H1s 0.700 1.640 2.642 13.428 13.650 0.984 [OK] 5448 117 H ARG CA 3 C4H1s 0.770 1.880 2.969 15.285 13.422 1.139 [OK] 5449 117 H ARG C 1 C3H0s 0.770 1.610 2.474 9.219 8.838 1.043 [OK] 5450 117 H ARG O 16 O1H0u 0.660 1.420 2.252 14.246 16.084 0.886 [OK] 5451 117 H ARG CB 8 C4H2s 0.770 1.880 2.859 22.498 23.088 0.974 [OK] 5452 117 H ARG CG 8 C4H2s 0.770 1.880 2.920 24.705 23.640 1.045 [OK] 5453 117 H ARG CD 8 C4H2s 0.770 1.880 2.726 20.651 23.300 0.886 [OK] 5454 117 H ARG NE 13 N3H1b 0.700 1.640 2.539 15.778 15.569 1.013 [OK] 5455 117 H ARG CZ 2 C3H0b 0.770 1.610 2.448 9.700 9.747 0.995 [OK] 5456 117 H ARG NH1 15 N3H2u 0.700 1.640 2.546 20.977 22.782 0.921 [OK] 5457 117 H ARG NH2 15 N3H2u 0.700 1.640 2.630 22.677 23.810 0.952 [OK] 5458 118 H ARG N 12 N3H1s 0.700 1.640 2.600 14.624 13.650 1.071 [OK] 5459 118 H ARG CA 3 C4H1s 0.770 1.880 3.579 15.485 13.422 1.154 possible 5460 118 H ARG C 1 C3H0s 0.770 1.610 2.301 8.026 8.838 0.908 [OK] 5461 118 H ARG O 16 O1H0u 0.660 1.420 2.572 16.266 16.084 1.011 [OK] 5462 118 H ARG CB 8 C4H2s 0.770 1.880 3.522 26.400 23.088 1.143 possible 5463 118 H ARG CG 8 C4H2s 0.770 1.880 4.238 34.710 23.640 1.468 possible 5464 118 H ARG CD 8 C4H2s 0.770 1.880 3.275 25.839 23.300 1.109 possible 5465 118 H ARG NE 13 N3H1b 0.700 1.640 3.459 18.650 15.569 1.198 possible 5466 118 H ARG CZ 2 C3H0b 0.770 1.610 4.610 13.653 9.747 1.401 possible 5467 118 H ARG NH1 15 N3H2u 0.700 1.640 26.542 -1.000 22.782 -1.000 bad 5468 118 H ARG NH2 15 N3H2u 0.700 1.640 16.008 -1.000 23.810 -1.000 bad 5469 119 H ASP N 12 N3H1s 0.700 1.640 3.077 15.119 13.895 1.088 possible 5470 119 H ASP CA 3 C4H1s 0.770 1.880 2.554 12.355 13.377 0.924 [OK] 5471 119 H ASP C 1 C3H0s 0.770 1.610 3.294 9.556 8.816 1.084 possible 5472 119 H ASP O 16 O1H0u 0.660 1.420 5.835 40.734 16.091 2.531 possible 5473 119 H ASP CB 8 C4H2s 0.770 1.880 5.348 34.285 23.481 1.460 possible 5474 119 H ASP CG 2 C3H0b 0.770 1.610 2.615 8.922 9.422 0.947 [OK] 5475 119 H ASP OD1 16 O1H0u 0.660 1.420 2.521 18.107 15.505 1.168 [OK] 5476 119 H ASP OD2 16 O1H0u 0.660 1.420 25.341 -1.000 16.324 -1.000 bad 5477 120 H LEU N 12 N3H1s 0.700 1.640 2.599 12.734 13.655 0.933 [OK] 5478 120 H LEU CA 3 C4H1s 0.770 1.880 3.274 12.503 13.122 0.953 possible 5479 120 H LEU C 1 C3H0s 0.770 1.610 2.261 8.650 8.825 0.980 [OK] 5480 120 H LEU O 16 O1H0u 0.660 1.420 2.682 17.213 16.208 1.062 [OK] 5481 120 H LEU CB 8 C4H2s 0.770 1.880 2.977 20.601 22.951 0.898 [OK] 5482 120 H LEU CG 4 C4H1b 0.770 1.880 6.535 28.024 14.764 1.898 possible 5483 120 H LEU CD1 10 C4H3u 0.770 1.880 28.294 -1.000 37.425 -1.000 bad 5484 120 H LEU CD2 10 C4H3u 0.770 1.880 48.439 -1.000 37.143 -1.000 bad 5485 121 H PRO N 11 N3H0u 0.700 1.640 2.264 8.062 8.823 0.914 [OK] 5486 121 H PRO CA 4 C4H1b 0.770 1.880 2.650 12.874 13.955 0.923 [OK] 5487 121 H PRO C 1 C3H0s 0.770 1.610 2.581 9.093 8.812 1.032 [OK] 5488 121 H PRO O 16 O1H0u 0.660 1.420 2.496 15.439 16.169 0.955 [OK] 5489 121 H PRO CB 9 C4H2b 0.770 1.880 2.783 24.892 25.563 0.974 [OK] 5490 121 H PRO CG 9 C4H2b 0.770 1.880 3.088 26.501 25.832 1.026 possible 5491 121 H PRO CD 8 C4H2s 0.770 1.880 4.043 34.675 23.836 1.455 possible 5492 122 H GLU N 12 N3H1s 0.700 1.640 2.608 13.800 13.615 1.014 [OK] 5493 122 H GLU CA 3 C4H1s 0.770 1.880 3.031 14.693 13.399 1.097 possible 5494 122 H GLU C 1 C3H0s 0.770 1.610 2.440 8.247 8.675 0.951 [OK] 5495 122 H GLU O 16 O1H0u 0.660 1.420 2.355 14.620 16.023 0.912 [OK] 5496 122 H GLU CB 8 C4H2s 0.770 1.880 3.036 23.439 23.529 0.996 possible 5497 122 H GLU CG 8 C4H2s 0.770 1.880 2.822 23.563 23.513 1.002 [OK] 5498 122 H GLU CD 2 C3H0b 0.770 1.610 2.326 8.326 9.460 0.880 [OK] 5499 122 H GLU OE1 16 O1H0u 0.660 1.420 2.335 15.730 15.999 0.983 [OK] 5500 122 H GLU OE2 16 O1H0u 0.660 1.420 2.587 18.309 17.432 1.050 [OK] 5501 123 H LEU N 12 N3H1s 0.700 1.640 2.557 13.469 13.655 0.986 [OK] 5502 123 H LEU CA 3 C4H1s 0.770 1.880 2.446 11.731 13.122 0.894 [OK] 5503 123 H LEU C 1 C3H0s 0.770 1.610 2.385 9.008 8.825 1.021 [OK] 5504 123 H LEU O 16 O1H0u 0.660 1.420 2.332 16.614 16.208 1.025 [OK] 5505 123 H LEU CB 8 C4H2s 0.770 1.880 3.612 25.401 22.951 1.107 possible 5506 123 H LEU CG 4 C4H1b 0.770 1.880 2.973 13.975 14.764 0.947 [OK] 5507 123 H LEU CD1 10 C4H3u 0.770 1.880 3.248 36.636 37.425 0.979 possible 5508 123 H LEU CD2 10 C4H3u 0.770 1.880 5.221 58.456 37.143 1.574 possible 5509 124 H ASP N 12 N3H1s 0.700 1.640 2.418 13.979 13.895 1.006 [OK] 5510 124 H ASP CA 3 C4H1s 0.770 1.880 2.798 14.228 13.377 1.064 [OK] 5511 124 H ASP C 1 C3H0s 0.770 1.610 2.598 9.403 8.816 1.067 [OK] 5512 124 H ASP O 16 O1H0u 0.660 1.420 2.279 14.691 16.091 0.913 [OK] 5513 124 H ASP CB 8 C4H2s 0.770 1.880 2.837 22.641 23.481 0.964 [OK] 5514 124 H ASP CG 2 C3H0b 0.770 1.610 2.686 10.586 9.422 1.124 [OK] 5515 124 H ASP OD1 16 O1H0u 0.660 1.420 2.393 14.207 15.505 0.916 [OK] 5516 124 H ASP OD2 16 O1H0u 0.660 1.420 4.028 32.305 16.324 1.979 possible 5517 125 H GLY N 12 N3H1s 0.700 1.640 2.728 15.682 14.854 1.056 [OK] 5518 125 H GLY CA 8 C4H2s 0.770 1.880 2.806 22.014 23.688 0.929 [OK] 5519 125 H GLY C 2 C3H0b 0.770 1.610 2.271 8.952 9.840 0.910 [OK] 5520 125 H GLY O 16 O1H0u 0.660 1.420 5.635 37.026 16.391 2.259 possible 5521 126 H HIS N 12 N3H1s 0.700 1.640 2.748 13.784 13.715 1.005 [OK] 5522 126 H HIS CA 3 C4H1s 0.770 1.880 5.336 19.701 13.467 1.463 possible 5523 126 H HIS C 1 C3H0s 0.770 1.610 3.517 10.787 8.882 1.214 possible 5524 126 H HIS O 16 O1H0u 0.660 1.420 12.994 -1.000 16.082 -1.000 bad 5525 126 H HIS CB 8 C4H2s 0.770 1.880 5.120 34.448 23.653 1.456 possible 5526 126 H HIS CG 2 C3H0b 0.770 1.610 5.116 14.716 9.952 1.479 possible 5527 126 H HIS ND1 13 N3H1b 0.700 1.640 18.135 -1.000 15.506 -1.000 bad 5528 126 H HIS CD2 5 C3H1s 0.770 1.760 5.743 59.001 21.085 2.798 possible 5529 126 H HIS CE1 5 C3H1s 0.770 1.760 16.741 -1.000 20.636 -1.000 bad 5530 126 H HIS NE2 13 N3H1b 0.700 1.640 6.568 41.528 15.337 2.708 possible 5531 127 H GLY N 12 N3H1s 0.700 1.640 2.519 14.403 14.854 0.970 [OK] 5532 127 H GLY CA 8 C4H2s 0.770 1.880 3.722 26.603 23.688 1.123 possible 5533 127 H GLY C 2 C3H0b 0.770 1.610 2.401 8.868 9.840 0.901 [OK] 5534 127 H GLY O 16 O1H0u 0.660 1.420 5.923 46.212 16.391 2.819 possible 5535 128 H HIS N 12 N3H1s 0.700 1.640 2.422 12.618 13.715 0.920 [OK] 5536 128 H HIS CA 3 C4H1s 0.770 1.880 2.842 13.130 13.467 0.975 [OK] 5537 128 H HIS C 1 C3H0s 0.770 1.610 2.498 9.159 8.882 1.031 [OK] 5538 128 H HIS O 16 O1H0u 0.660 1.420 2.365 14.477 16.082 0.900 [OK] 5539 128 H HIS CB 8 C4H2s 0.770 1.880 2.945 24.975 23.653 1.056 [OK] 5540 128 H HIS CG 2 C3H0b 0.770 1.610 2.550 9.980 9.952 1.003 [OK] 5541 128 H HIS ND1 13 N3H1b 0.700 1.640 5.073 32.563 15.506 2.100 possible 5542 128 H HIS CD2 5 C3H1s 0.770 1.760 6.815 38.007 21.085 1.803 possible 5543 128 H HIS CE1 5 C3H1s 0.770 1.760 33.838 -1.000 20.636 -1.000 bad 5544 128 H HIS NE2 13 N3H1b 0.700 1.640 21.917 -1.000 15.337 -1.000 bad 5545 129 H ASN N 12 N3H1s 0.700 1.640 2.723 15.349 13.695 1.121 [OK] 5546 129 H ASN CA 3 C4H1s 0.770 1.880 2.773 13.965 13.167 1.061 [OK] 5547 129 H ASN C 1 C3H0s 0.770 1.610 2.471 8.355 8.928 0.936 [OK] 5548 129 H ASN O 16 O1H0u 0.660 1.420 2.496 20.100 16.199 1.241 [OK] 5549 129 H ASN CB 8 C4H2s 0.770 1.880 2.958 25.303 23.128 1.094 [OK] 5550 129 H ASN CG 2 C3H0b 0.770 1.610 2.902 10.491 9.599 1.093 [OK] 5551 129 H ASN OD1 16 O1H0u 0.660 1.420 3.322 19.233 16.664 1.154 possible 5552 129 H ASN ND2 15 N3H2u 0.700 1.640 3.471 22.286 23.083 0.965 possible 5553 130 H LYS N 12 N3H1s 0.700 1.640 2.427 13.416 13.675 0.981 [OK] 5554 130 H LYS CA 3 C4H1s 0.770 1.880 2.811 14.789 13.324 1.110 [OK] 5555 130 H LYS C 1 C3H0s 0.770 1.610 2.657 9.095 8.759 1.038 [OK] 5556 130 H LYS O 16 O1H0u 0.660 1.420 2.546 17.684 16.049 1.102 [OK] 5557 130 H LYS CB 8 C4H2s 0.770 1.880 3.029 22.245 22.904 0.971 possible 5558 130 H LYS CG 8 C4H2s 0.770 1.880 2.878 23.756 23.131 1.027 [OK] 5559 130 H LYS CD 8 C4H2s 0.770 1.880 3.048 26.277 23.837 1.102 possible 5560 130 H LYS CE 9 C4H2b 0.770 1.880 3.194 25.595 23.934 1.069 possible 5561 130 H LYS NZ 14 N4H3u 0.700 1.640 3.366 29.201 21.213 1.377 possible 5562 131 H ILE N 12 N3H1s 0.700 1.640 2.545 12.931 13.633 0.949 [OK] 5563 131 H ILE CA 3 C4H1s 0.770 1.880 2.467 11.726 13.007 0.902 [OK] 5564 131 H ILE C 1 C3H0s 0.770 1.610 2.792 9.381 8.470 1.108 [OK] 5565 131 H ILE O 16 O1H0u 0.660 1.420 2.528 17.691 16.144 1.096 [OK] 5566 131 H ILE CB 4 C4H1b 0.770 1.880 2.811 14.481 14.227 1.018 [OK] 5567 131 H ILE CG1 9 C4H2b 0.770 1.880 3.041 26.161 24.187 1.082 possible 5568 131 H ILE CG2 10 C4H3u 0.770 1.880 2.983 37.337 35.961 1.038 [OK] 5569 131 H ILE CD1 10 C4H3u 0.770 1.880 3.031 36.246 38.377 0.944 possible 5570 132 H LYS N 12 N3H1s 0.700 1.640 2.616 13.551 13.675 0.991 [OK] 5571 132 H LYS CA 3 C4H1s 0.770 1.880 2.879 13.622 13.324 1.022 [OK] 5572 132 H LYS C 1 C3H0s 0.770 1.610 2.434 9.235 8.759 1.054 [OK] 5573 132 H LYS O 16 O1H0u 0.660 1.420 2.430 17.050 16.049 1.062 [OK] 5574 132 H LYS CB 8 C4H2s 0.770 1.880 3.127 22.055 22.904 0.963 possible 5575 132 H LYS CG 8 C4H2s 0.770 1.880 3.476 27.692 23.131 1.197 possible 5576 132 H LYS CD 8 C4H2s 0.770 1.880 5.466 37.110 23.837 1.557 possible 5577 132 H LYS CE 9 C4H2b 0.770 1.880 4.354 31.715 23.934 1.325 possible 5578 132 H LYS NZ 14 N4H3u 0.700 1.640 5.803 69.336 21.213 3.269 possible 5579 133 H PRO N 11 N3H0u 0.700 1.640 2.313 8.357 8.823 0.947 [OK] 5580 133 H PRO CA 4 C4H1b 0.770 1.880 2.865 13.961 13.955 1.000 [OK] 5581 133 H PRO C 1 C3H0s 0.770 1.610 2.602 8.622 8.812 0.978 [OK] 5582 133 H PRO O 16 O1H0u 0.660 1.420 2.473 14.959 16.169 0.925 [OK] 5583 133 H PRO CB 9 C4H2b 0.770 1.880 3.248 26.998 25.563 1.056 possible 5584 133 H PRO CG 9 C4H2b 0.770 1.880 3.706 33.651 25.832 1.303 possible 5585 133 H PRO CD 8 C4H2s 0.770 1.880 3.177 22.525 23.836 0.945 possible 5586 134 H MET N 12 N3H1s 0.700 1.640 2.713 14.689 13.564 1.083 [OK] 5587 134 H MET CA 3 C4H1s 0.770 1.880 2.929 13.784 13.231 1.042 [OK] 5588 134 H MET C 1 C3H0s 0.770 1.610 2.591 8.567 8.782 0.976 [OK] 5589 134 H MET O 16 O1H0u 0.660 1.420 2.381 14.533 16.277 0.893 [OK] 5590 134 H MET CB 8 C4H2s 0.770 1.880 3.006 22.468 23.645 0.950 possible 5591 134 H MET CG 9 C4H2b 0.770 1.880 2.881 22.578 24.009 0.940 [OK] 5592 134 H MET SD 19 S2H0u 1.040 1.770 2.849 30.084 30.093 1.000 [OK] 5593 134 H MET CE 10 C4H3u 0.770 1.880 3.978 42.572 37.161 1.146 possible 5594 135 H LYS N 12 N3H1s 0.700 1.640 3.438 16.199 13.675 1.185 possible 5595 135 H LYS CA 3 C4H1s 0.770 1.880 5.974 24.736 13.324 1.857 possible 5596 135 H LYS C 1 C3H0s 0.770 1.610 3.430 8.310 8.759 0.949 possible 5597 135 H LYS O 16 O1H0u 0.660 1.420 13.318 -1.000 16.049 -1.000 bad 5598 135 H LYS CB 8 C4H2s 0.770 1.880 5.706 38.120 22.904 1.664 possible 5599 135 H LYS CG 8 C4H2s 0.770 1.880 14.085 -1.000 23.131 -1.000 bad 5600 135 H LYS CD 8 C4H2s 0.770 1.880 20.954 -1.000 23.837 -1.000 bad 5601 135 H LYS CE 9 C4H2b 0.770 1.880 12.444 -1.000 23.934 -1.000 bad 5602 135 H LYS NZ 14 N4H3u 0.700 1.640 54.401 -1.000 21.213 -1.000 bad 5603 136 H ALA N 12 N3H1s 0.700 1.640 3.233 13.409 14.046 0.955 possible 5604 136 H ALA CA 4 C4H1b 0.770 1.880 10.076 -1.000 14.063 -1.000 bad 5605 136 H ALA C 1 C3H0s 0.770 1.610 2.886 9.932 8.900 1.116 [OK] 5606 136 H ALA O 16 O1H0u 0.660 1.420 16.991 -1.000 16.188 -1.000 bad 5607 136 H ALA CB 10 C4H3u 0.770 1.880 24.555 -1.000 36.782 -1.000 bad 5608 137 H ALA N 12 N3H1s 0.700 1.640 2.567 13.709 14.046 0.976 [OK] 5609 137 H ALA CA 4 C4H1b 0.770 1.880 4.178 18.906 14.063 1.344 possible 5610 137 H ALA C 1 C3H0s 0.770 1.610 3.108 9.813 8.900 1.103 possible 5611 137 H ALA O 16 O1H0u 0.660 1.420 2.350 14.340 16.188 0.886 [OK] 5612 137 H ALA CB 10 C4H3u 0.770 1.880 3.230 37.942 36.782 1.032 possible 5613 138 H ALA N 12 N3H1s 0.700 1.640 4.512 25.849 14.046 1.840 possible 5614 138 H ALA CA 4 C4H1b 0.770 1.880 3.894 16.661 14.063 1.185 possible 5615 138 H ALA C 1 C3H0s 0.770 1.610 4.367 9.551 8.900 1.073 possible 5616 138 H ALA O 16 O1H0u 0.660 1.420 5.056 33.885 16.188 2.093 possible 5617 138 H ALA CB 10 C4H3u 0.770 1.880 64.799 -1.000 36.782 -1.000 bad 5618 139 H GLY N 12 N3H1s 0.700 1.640 8.642 -1.000 14.854 -1.000 bad 5619 139 H GLY CA 8 C4H2s 0.770 1.880 32.747 -1.000 23.688 -1.000 bad 5620 139 H GLY C 2 C3H0b 0.770 1.610 4.001 11.502 9.840 1.169 possible 5621 139 H GLY O 16 O1H0u 0.660 1.420 7.341 47.107 16.391 2.874 possible 5622 140 H PHE N 12 N3H1s 0.700 1.640 2.536 13.530 13.691 0.988 [OK] 5623 140 H PHE CA 3 C4H1s 0.770 1.880 2.398 11.355 13.449 0.844 [OK] 5624 140 H PHE C 1 C3H0s 0.770 1.610 2.401 8.522 8.753 0.974 [OK] 5625 140 H PHE O 16 O1H0u 0.660 1.420 4.556 22.906 16.151 1.418 possible 5626 140 H PHE CB 8 C4H2s 0.770 1.880 2.954 23.666 23.777 0.995 [OK] 5627 140 H PHE CG 2 C3H0b 0.770 1.610 2.577 9.798 9.721 1.008 [OK] 5628 140 H PHE CD1 5 C3H1s 0.770 1.760 3.401 20.519 20.405 1.006 possible 5629 140 H PHE CD2 6 C3H1b 0.770 1.760 2.900 19.048 21.051 0.905 [OK] 5630 140 H PHE CE1 6 C3H1b 0.770 1.760 4.545 27.105 21.580 1.256 possible 5631 140 H PHE CE2 6 C3H1b 0.770 1.760 2.695 19.874 21.680 0.917 [OK] 5632 140 H PHE CZ 6 C3H1b 0.770 1.760 2.616 19.743 21.666 0.911 [OK] 5633 141 H HIS N 12 N3H1s 0.700 1.640 2.722 13.719 13.715 1.000 [OK] 5634 141 H HIS CA 3 C4H1s 0.770 1.880 2.424 12.474 13.467 0.926 [OK] 5635 141 H HIS C 1 C3H0s 0.770 1.610 2.358 8.864 8.882 0.998 [OK] 5636 141 H HIS O 16 O1H0u 0.660 1.420 2.526 15.814 16.082 0.983 [OK] 5637 141 H HIS CB 8 C4H2s 0.770 1.880 14.848 -1.000 23.653 -1.000 bad 5638 141 H HIS CG 2 C3H0b 0.770 1.610 0.788 -1.000 9.952 -1.000 bad 5639 141 H HIS ND1 13 N3H1b 0.700 1.640 4.127 -1.000 15.506 -1.000 bad 5640 141 H HIS CD2 5 C3H1s 0.770 1.760 14.098 -1.000 21.085 -1.000 bad 5641 141 H HIS CE1 5 C3H1s 0.770 1.760 18.129 -1.000 20.636 -1.000 bad 5642 141 H HIS NE2 13 N3H1b 0.700 1.640 3.612 -1.000 15.337 -1.000 bad 5643 142 H VAL N 12 N3H1s 0.700 1.640 2.389 13.202 13.676 0.965 [OK] 5644 142 H VAL CA 3 C4H1s 0.770 1.880 2.499 12.132 13.123 0.924 [OK] 5645 142 H VAL C 1 C3H0s 0.770 1.610 2.519 8.364 8.563 0.977 [OK] 5646 142 H VAL O 16 O1H0u 0.660 1.420 5.231 31.888 16.181 1.971 possible 5647 142 H VAL CB 4 C4H1b 0.770 1.880 2.659 13.901 14.598 0.952 [OK] 5648 142 H VAL CG1 10 C4H3u 0.770 1.880 2.864 35.865 36.584 0.980 [OK] 5649 142 H VAL CG2 10 C4H3u 0.770 1.880 2.887 34.146 36.332 0.940 [OK] 5650 143 H SER N 12 N3H1s 0.700 1.640 2.449 13.316 14.103 0.944 [OK] 5651 143 H SER CA 3 C4H1s 0.770 1.880 3.429 15.628 13.476 1.160 possible 5652 143 H SER C 1 C3H0s 0.770 1.610 3.044 10.565 8.923 1.184 possible 5653 143 H SER O 16 O1H0u 0.660 1.420 10.357 -1.000 16.179 -1.000 bad 5654 143 H SER CB 8 C4H2s 0.770 1.880 3.722 29.593 23.884 1.239 possible 5655 143 H SER OG 17 O2H1u 0.660 1.460 3.366 25.406 18.732 1.356 possible 5656 144 H ALA N 12 N3H1s 0.700 1.640 2.656 14.969 14.046 1.066 [OK] 5657 144 H ALA CA 4 C4H1b 0.770 1.880 5.155 18.673 14.063 1.328 possible 5658 144 H ALA C 1 C3H0s 0.770 1.610 2.443 9.083 8.900 1.021 [OK] 5659 144 H ALA O 16 O1H0u 0.660 1.420 2.390 16.716 16.188 1.033 [OK] 5660 144 H ALA CB 10 C4H3u 0.770 1.880 7.365 49.759 36.782 1.353 possible 5661 145 H GLY N 12 N3H1s 0.700 1.640 7.249 -1.000 14.854 -1.000 bad 5662 145 H GLY CA 8 C4H2s 0.770 1.880 9.139 -1.000 23.688 -1.000 bad 5663 145 H GLY C 2 C3H0b 0.770 1.610 1.722 -1.000 9.840 -1.000 bad 5664 145 H GLY O 16 O1H0u 0.660 1.420 7.455 25.051 16.391 1.528 possible 5665 146 H LYS N 12 N3H1s 0.700 1.640 2.238 -1.000 13.675 -1.000 bad 5666 146 H LYS CA 3 C4H1s 0.770 1.880 5.371 15.557 13.324 1.168 possible 5667 146 H LYS C 1 C3H0s 0.770 1.610 2.470 8.273 8.759 0.945 [OK] 5668 146 H LYS O 16 O1H0u 0.660 1.420 2.512 16.113 16.049 1.004 [OK] 5669 146 H LYS CB 8 C4H2s 0.770 1.880 7.071 46.306 22.904 2.022 possible 5670 146 H LYS CG 8 C4H2s 0.770 1.880 3.332 25.140 23.131 1.087 possible 5671 146 H LYS CD 8 C4H2s 0.770 1.880 17.381 -1.000 23.837 -1.000 bad 5672 146 H LYS CE 9 C4H2b 0.770 1.880 27.851 -1.000 23.934 -1.000 bad 5673 146 H LYS NZ 14 N4H3u 0.700 1.640 6.846 -1.000 21.213 -1.000 bad 5674 147 H ASN N 12 N3H1s 0.700 1.640 2.776 14.160 13.695 1.034 [OK] 5675 147 H ASN CA 3 C4H1s 0.770 1.880 2.616 12.965 13.167 0.985 [OK] 5676 147 H ASN C 1 C3H0s 0.770 1.610 2.479 8.355 8.928 0.936 [OK] 5677 147 H ASN O 16 O1H0u 0.660 1.420 4.565 26.689 16.199 1.648 possible 5678 147 H ASN CB 8 C4H2s 0.770 1.880 6.081 38.177 23.128 1.651 possible 5679 147 H ASN CG 2 C3H0b 0.770 1.610 4.403 12.748 9.599 1.328 possible 5680 147 H ASN OD1 16 O1H0u 0.660 1.420 2.985 17.920 16.664 1.075 [OK] 5681 147 H ASN ND2 15 N3H2u 0.700 1.640 7.761 66.813 23.083 2.894 possible 5682 148 H PRO N 11 N3H0u 0.700 1.640 2.523 8.290 8.823 0.940 [OK] 5683 148 H PRO CA 4 C4H1b 0.770 1.880 2.741 13.114 13.955 0.940 [OK] 5684 148 H PRO C 1 C3H0s 0.770 1.610 2.719 9.644 8.812 1.094 [OK] 5685 148 H PRO O 16 O1H0u 0.660 1.420 2.512 14.496 16.169 0.897 [OK] 5686 148 H PRO CB 9 C4H2b 0.770 1.880 2.674 24.013 25.563 0.939 [OK] 5687 148 H PRO CG 9 C4H2b 0.770 1.880 3.011 27.339 25.832 1.058 possible 5688 148 H PRO CD 8 C4H2s 0.770 1.880 2.952 23.506 23.836 0.986 [OK] 5689 149 H ILE N 12 N3H1s 0.700 1.640 2.561 13.987 13.633 1.026 [OK] 5690 149 H ILE CA 3 C4H1s 0.770 1.880 2.646 12.246 13.007 0.941 [OK] 5691 149 H ILE C 1 C3H0s 0.770 1.610 2.984 8.220 8.470 0.970 [OK] 5692 149 H ILE O 16 O1H0u 0.660 1.420 20.409 -1.000 16.144 -1.000 bad 5693 149 H ILE CB 4 C4H1b 0.770 1.880 4.458 18.884 14.227 1.327 possible 5694 149 H ILE CG1 9 C4H2b 0.770 1.880 2.795 21.851 24.187 0.903 [OK] 5695 149 H ILE CG2 10 C4H3u 0.770 1.880 30.262 -1.000 35.961 -1.000 bad 5696 149 H ILE CD1 10 C4H3u 0.770 1.880 5.550 58.265 38.377 1.518 possible 5697 150 H GLY N 12 N3H1s 0.700 1.640 3.548 14.950 14.854 1.006 possible 5698 150 H GLY CA 8 C4H2s 0.770 1.880 32.116 -1.000 23.688 -1.000 bad 5699 150 H GLY C 2 C3H0b 0.770 1.610 5.171 14.184 9.840 1.441 possible 5700 150 H GLY O 16 O1H0u 0.660 1.420 20.654 -1.000 16.391 -1.000 bad 5701 151 H LEU N 12 N3H1s 0.700 1.640 3.164 15.086 13.655 1.105 possible 5702 151 H LEU CA 3 C4H1s 0.770 1.880 3.188 11.884 13.122 0.906 possible 5703 151 H LEU C 1 C3H0s 0.770 1.610 2.569 8.663 8.825 0.982 [OK] 5704 151 H LEU O 16 O1H0u 0.660 1.420 2.374 16.101 16.208 0.993 [OK] 5705 151 H LEU CB 8 C4H2s 0.770 1.880 2.829 21.890 22.951 0.954 [OK] 5706 151 H LEU CG 4 C4H1b 0.770 1.880 3.517 16.750 14.764 1.135 possible 5707 151 H LEU CD1 10 C4H3u 0.770 1.880 2.741 33.866 37.425 0.905 [OK] 5708 151 H LEU CD2 10 C4H3u 0.770 1.880 19.343 -1.000 37.143 -1.000 bad 5709 152 H PRO N 11 N3H0u 0.700 1.640 3.515 9.777 8.823 1.108 possible 5710 152 H PRO CA 4 C4H1b 0.770 1.880 3.219 13.799 13.955 0.989 possible 5711 152 H PRO C 1 C3H0s 0.770 1.610 3.091 9.724 8.812 1.104 possible 5712 152 H PRO O 16 O1H0u 0.660 1.420 2.885 16.869 16.169 1.043 [OK] 5713 152 H PRO CB 9 C4H2b 0.770 1.880 11.816 -1.000 25.563 -1.000 bad 5714 152 H PRO CG 9 C4H2b 0.770 1.880 18.422 -1.000 25.832 -1.000 bad 5715 152 H PRO CD 8 C4H2s 0.770 1.880 16.412 -1.000 23.836 -1.000 bad 5716 153 H VAL N 12 N3H1s 0.700 1.640 2.724 13.221 13.676 0.967 [OK] 5717 153 H VAL CA 3 C4H1s 0.770 1.880 2.450 11.793 13.123 0.899 [OK] 5718 153 H VAL C 1 C3H0s 0.770 1.610 3.036 9.443 8.563 1.103 possible 5719 153 H VAL O 16 O1H0u 0.660 1.420 2.556 16.130 16.181 0.997 [OK] 5720 153 H VAL CB 4 C4H1b 0.770 1.880 2.944 14.824 14.598 1.015 [OK] 5721 153 H VAL CG1 10 C4H3u 0.770 1.880 3.446 39.570 36.584 1.082 possible 5722 153 H VAL CG2 10 C4H3u 0.770 1.880 3.263 33.085 36.332 0.911 possible 5723 154 H ARG N 12 N3H1s 0.700 1.640 3.094 14.900 13.650 1.092 possible 5724 154 H ARG CA 3 C4H1s 0.770 1.880 2.680 13.145 13.422 0.979 [OK] 5725 154 H ARG C 1 C3H0s 0.770 1.610 2.684 9.450 8.838 1.069 [OK] 5726 154 H ARG O 16 O1H0u 0.660 1.420 2.420 16.753 16.084 1.042 [OK] 5727 154 H ARG CB 8 C4H2s 0.770 1.880 3.493 25.462 23.088 1.103 possible 5728 154 H ARG CG 8 C4H2s 0.770 1.880 3.088 22.942 23.640 0.970 possible 5729 154 H ARG CD 8 C4H2s 0.770 1.880 4.686 34.459 23.300 1.479 possible 5730 154 H ARG NE 13 N3H1b 0.700 1.640 2.552 12.958 15.569 0.832 [OK] 5731 154 H ARG CZ 2 C3H0b 0.770 1.610 2.358 8.361 9.747 0.858 [OK] 5732 154 H ARG NH1 15 N3H2u 0.700 1.640 5.772 56.327 22.782 2.472 possible 5733 154 H ARG NH2 15 N3H2u 0.700 1.640 4.793 44.839 23.810 1.883 possible 5734 155 H GLY N 12 N3H1s 0.700 1.640 2.686 16.450 14.854 1.107 [OK] 5735 155 H GLY CA 8 C4H2s 0.770 1.880 2.754 24.257 23.688 1.024 [OK] 5736 155 H GLY C 2 C3H0b 0.770 1.610 2.424 10.159 9.840 1.032 [OK] 5737 155 H GLY O 16 O1H0u 0.660 1.420 2.339 15.531 16.391 0.948 [OK] 5738 156 H CYS N 12 N3H1s 0.700 1.640 2.412 13.403 13.981 0.959 [OK] 5739 156 H CYS CA 3 C4H1s 0.770 1.880 2.768 14.740 13.656 1.079 [OK] 5740 156 H CYS C 1 C3H0s 0.770 1.610 2.516 8.813 8.897 0.991 [OK] 5741 156 H CYS O 16 O1H0u 0.660 1.420 2.383 15.968 16.543 0.965 [OK] 5742 156 H CYS CB 9 C4H2b 0.770 1.880 2.699 21.461 23.536 0.912 [OK] 5743 156 H CYS SG 20 S2H1u 1.040 1.770 2.799 36.058 34.603 1.042 [OK] 5744 157 H ASP N 12 N3H1s 0.700 1.640 2.608 13.618 13.895 0.980 [OK] 5745 157 H ASP CA 3 C4H1s 0.770 1.880 2.585 13.721 13.377 1.026 [OK] 5746 157 H ASP C 1 C3H0s 0.770 1.610 2.367 9.253 8.816 1.050 [OK] 5747 157 H ASP O 16 O1H0u 0.660 1.420 3.749 24.018 16.091 1.493 possible 5748 157 H ASP CB 8 C4H2s 0.770 1.880 3.719 25.969 23.481 1.106 possible 5749 157 H ASP CG 2 C3H0b 0.770 1.610 2.408 8.835 9.422 0.938 [OK] 5750 157 H ASP OD1 16 O1H0u 0.660 1.420 2.318 15.815 15.505 1.020 [OK] 5751 157 H ASP OD2 16 O1H0u 0.660 1.420 5.963 40.716 16.324 2.494 possible 5752 158 H LEU N 12 N3H1s 0.700 1.640 2.432 12.335 13.655 0.903 [OK] 5753 158 H LEU CA 3 C4H1s 0.770 1.880 2.610 11.963 13.122 0.912 [OK] 5754 158 H LEU C 1 C3H0s 0.770 1.610 2.814 9.263 8.825 1.050 [OK] 5755 158 H LEU O 16 O1H0u 0.660 1.420 19.259 -1.000 16.208 -1.000 bad 5756 158 H LEU CB 8 C4H2s 0.770 1.880 6.168 39.190 22.951 1.708 possible 5757 158 H LEU CG 4 C4H1b 0.770 1.880 2.970 14.695 14.764 0.995 [OK] 5758 158 H LEU CD1 10 C4H3u 0.770 1.880 7.883 78.455 37.425 2.096 possible 5759 158 H LEU CD2 10 C4H3u 0.770 1.880 3.155 38.561 37.143 1.038 possible 5760 159 H GLU N 12 N3H1s 0.700 1.640 2.454 13.498 13.615 0.991 [OK] 5761 159 H GLU CA 3 C4H1s 0.770 1.880 3.008 13.655 13.399 1.019 possible 5762 159 H GLU C 1 C3H0s 0.770 1.610 2.723 9.325 8.675 1.075 [OK] 5763 159 H GLU O 16 O1H0u 0.660 1.420 2.379 16.581 16.023 1.035 [OK] 5764 159 H GLU CB 8 C4H2s 0.770 1.880 4.687 28.244 23.529 1.200 possible 5765 159 H GLU CG 8 C4H2s 0.770 1.880 4.385 32.448 23.513 1.380 possible 5766 159 H GLU CD 2 C3H0b 0.770 1.610 3.778 12.966 9.460 1.371 possible 5767 159 H GLU OE1 16 O1H0u 0.660 1.420 23.593 -1.000 15.999 -1.000 bad 5768 159 H GLU OE2 16 O1H0u 0.660 1.420 44.652 -1.000 17.432 -1.000 bad 5769 160 H ILE N 12 N3H1s 0.700 1.640 3.164 16.012 13.633 1.174 possible 5770 160 H ILE CA 3 C4H1s 0.770 1.880 2.535 12.179 13.007 0.936 [OK] 5771 160 H ILE C 1 C3H0s 0.770 1.610 2.461 8.524 8.470 1.006 [OK] 5772 160 H ILE O 16 O1H0u 0.660 1.420 5.575 41.445 16.144 2.567 possible 5773 160 H ILE CB 4 C4H1b 0.770 1.880 5.225 21.837 14.227 1.535 possible 5774 160 H ILE CG1 9 C4H2b 0.770 1.880 4.010 35.968 24.187 1.487 possible 5775 160 H ILE CG2 10 C4H3u 0.770 1.880 6.350 60.074 35.961 1.671 possible 5776 160 H ILE CD1 10 C4H3u 0.770 1.880 54.453 -1.000 38.377 -1.000 bad 5777 161 H ALA N 12 N3H1s 0.700 1.640 2.489 12.972 14.046 0.924 [OK] 5778 161 H ALA CA 4 C4H1b 0.770 1.880 3.491 16.454 14.063 1.170 possible 5779 161 H ALA C 1 C3H0s 0.770 1.610 2.710 9.959 8.900 1.119 [OK] 5780 161 H ALA O 16 O1H0u 0.660 1.420 2.553 18.730 16.188 1.157 [OK] 5781 161 H ALA CB 10 C4H3u 0.770 1.880 3.182 36.735 36.782 0.999 possible 5782 162 H GLY N 12 N3H1s 0.700 1.640 2.741 16.288 14.854 1.097 [OK] 5783 162 H GLY CA 8 C4H2s 0.770 1.880 3.508 25.594 23.688 1.080 possible 5784 162 H GLY C 2 C3H0b 0.770 1.610 3.517 11.969 9.840 1.216 possible 5785 162 H GLY O 16 O1H0u 0.660 1.420 4.094 20.298 16.391 1.238 possible 5786 163 H LYS N 12 N3H1s 0.700 1.640 2.928 14.071 13.675 1.029 [OK] 5787 163 H LYS CA 3 C4H1s 0.770 1.880 2.468 12.573 13.324 0.944 [OK] 5788 163 H LYS C 1 C3H0s 0.770 1.610 2.472 9.091 8.759 1.038 [OK] 5789 163 H LYS O 16 O1H0u 0.660 1.420 2.266 14.444 16.049 0.900 [OK] 5790 163 H LYS CB 8 C4H2s 0.770 1.880 4.666 38.857 22.904 1.697 possible 5791 163 H LYS CG 8 C4H2s 0.770 1.880 3.868 28.429 23.131 1.229 possible 5792 163 H LYS CD 8 C4H2s 0.770 1.880 7.931 97.191 23.837 4.077 possible 5793 163 H LYS CE 9 C4H2b 0.770 1.880 4.668 42.495 23.934 1.776 possible 5794 163 H LYS NZ 14 N4H3u 0.700 1.640 53.144 -1.000 21.213 -1.000 bad 5795 164 H VAL N 12 N3H1s 0.700 1.640 2.611 14.017 13.676 1.025 [OK] 5796 164 H VAL CA 3 C4H1s 0.770 1.880 2.652 12.691 13.123 0.967 [OK] 5797 164 H VAL C 1 C3H0s 0.770 1.610 2.437 8.360 8.563 0.976 [OK] 5798 164 H VAL O 16 O1H0u 0.660 1.420 4.875 24.648 16.181 1.523 possible 5799 164 H VAL CB 4 C4H1b 0.770 1.880 2.555 12.931 14.598 0.886 [OK] 5800 164 H VAL CG1 10 C4H3u 0.770 1.880 2.796 34.039 36.584 0.930 [OK] 5801 164 H VAL CG2 10 C4H3u 0.770 1.880 3.041 33.837 36.332 0.931 possible 5802 165 H VAL N 12 N3H1s 0.700 1.640 2.415 11.936 13.676 0.873 [OK] 5803 165 H VAL CA 3 C4H1s 0.770 1.880 5.388 18.524 13.123 1.412 possible 5804 165 H VAL C 1 C3H0s 0.770 1.610 2.376 8.912 8.563 1.041 [OK] 5805 165 H VAL O 16 O1H0u 0.660 1.420 4.283 27.344 16.181 1.690 possible 5806 165 H VAL CB 4 C4H1b 0.770 1.880 3.932 16.673 14.598 1.142 possible 5807 165 H VAL CG1 10 C4H3u 0.770 1.880 6.402 63.267 36.584 1.729 possible 5808 165 H VAL CG2 10 C4H3u 0.770 1.880 3.372 35.729 36.332 0.983 possible 5809 166 H ASP N 12 N3H1s 0.700 1.640 2.461 14.443 13.895 1.039 [OK] 5810 166 H ASP CA 3 C4H1s 0.770 1.880 2.924 13.143 13.377 0.983 [OK] 5811 166 H ASP C 1 C3H0s 0.770 1.610 2.399 9.650 8.816 1.095 [OK] 5812 166 H ASP O 16 O1H0u 0.660 1.420 2.346 15.531 16.091 0.965 [OK] 5813 166 H ASP CB 8 C4H2s 0.770 1.880 2.964 24.803 23.481 1.056 [OK] 5814 166 H ASP CG 2 C3H0b 0.770 1.610 3.305 11.288 9.422 1.198 possible 5815 166 H ASP OD1 16 O1H0u 0.660 1.420 4.401 26.155 15.505 1.687 possible 5816 166 H ASP OD2 16 O1H0u 0.660 1.420 2.639 16.447 16.324 1.008 [OK] 5817 167 H ILE N 12 N3H1s 0.700 1.640 2.579 13.028 13.633 0.956 [OK] 5818 167 H ILE CA 3 C4H1s 0.770 1.880 2.687 13.385 13.007 1.029 [OK] 5819 167 H ILE C 1 C3H0s 0.770 1.610 2.515 8.433 8.470 0.996 [OK] 5820 167 H ILE O 16 O1H0u 0.660 1.420 2.422 15.713 16.144 0.973 [OK] 5821 167 H ILE CB 4 C4H1b 0.770 1.880 2.802 15.003 14.227 1.055 [OK] 5822 167 H ILE CG1 9 C4H2b 0.770 1.880 3.070 21.905 24.187 0.906 possible 5823 167 H ILE CG2 10 C4H3u 0.770 1.880 3.082 35.281 35.961 0.981 possible 5824 167 H ILE CD1 10 C4H3u 0.770 1.880 2.997 37.206 38.377 0.969 [OK] 5825 168 H TRP N 12 N3H1s 0.700 1.640 2.581 12.580 13.791 0.912 [OK] 5826 168 H TRP CA 3 C4H1s 0.770 1.880 2.543 12.447 13.377 0.930 [OK] 5827 168 H TRP C 1 C3H0s 0.770 1.610 2.480 8.831 8.724 1.012 [OK] 5828 168 H TRP O 16 O1H0u 0.660 1.420 2.437 16.787 15.951 1.052 [OK] 5829 168 H TRP CB 8 C4H2s 0.770 1.880 2.881 24.416 24.004 1.017 [OK] 5830 168 H TRP CG 2 C3H0b 0.770 1.610 2.594 10.010 9.965 1.005 [OK] 5831 168 H TRP CD1 5 C3H1s 0.770 1.760 2.802 22.008 20.874 1.054 [OK] 5832 168 H TRP CD2 2 C3H0b 0.770 1.610 2.638 9.794 10.097 0.970 [OK] 5833 168 H TRP NE1 13 N3H1b 0.700 1.640 2.590 15.144 16.969 0.892 [OK] 5834 168 H TRP CE2 2 C3H0b 0.770 1.610 2.258 8.901 9.889 0.900 [OK] 5835 168 H TRP CE3 6 C3H1b 0.770 1.760 2.904 22.177 20.448 1.085 [OK] 5836 168 H TRP CZ2 6 C3H1b 0.770 1.760 3.068 22.654 21.012 1.078 possible 5837 168 H TRP CZ3 6 C3H1b 0.770 1.760 2.871 21.543 21.516 1.001 [OK] 5838 168 H TRP CH2 6 C3H1b 0.770 1.760 2.632 18.954 21.339 0.888 [OK] 5839 169 H VAL N 12 N3H1s 0.700 1.640 2.501 13.645 13.676 0.998 [OK] 5840 169 H VAL CA 3 C4H1s 0.770 1.880 2.646 12.682 13.123 0.966 [OK] 5841 169 H VAL C 1 C3H0s 0.770 1.610 2.612 9.374 8.563 1.095 [OK] 5842 169 H VAL O 16 O1H0u 0.660 1.420 2.265 14.534 16.181 0.898 [OK] 5843 169 H VAL CB 4 C4H1b 0.770 1.880 2.925 16.966 14.598 1.162 [OK] 5844 169 H VAL CG1 10 C4H3u 0.770 1.880 2.817 31.705 36.584 0.867 [OK] 5845 169 H VAL CG2 10 C4H3u 0.770 1.880 2.940 35.769 36.332 0.985 [OK] 5846 170 H ASP N 12 N3H1s 0.700 1.640 2.613 13.755 13.895 0.990 [OK] 5847 170 H ASP CA 3 C4H1s 0.770 1.880 2.780 14.367 13.377 1.074 [OK] 5848 170 H ASP C 1 C3H0s 0.770 1.610 2.237 8.240 8.816 0.935 [OK] 5849 170 H ASP O 16 O1H0u 0.660 1.420 2.300 14.740 16.091 0.916 [OK] 5850 170 H ASP CB 8 C4H2s 0.770 1.880 2.715 21.434 23.481 0.913 [OK] 5851 170 H ASP CG 2 C3H0b 0.770 1.610 2.610 9.807 9.422 1.041 [OK] 5852 170 H ASP OD1 16 O1H0u 0.660 1.420 2.282 15.034 15.505 0.970 [OK] 5853 170 H ASP OD2 16 O1H0u 0.660 1.420 2.787 19.470 16.324 1.193 [OK] 5854 171 H ILE N 12 N3H1s 0.700 1.640 2.390 12.350 13.633 0.906 [OK] 5855 171 H ILE CA 3 C4H1s 0.770 1.880 2.626 12.687 13.007 0.975 [OK] 5856 171 H ILE C 1 C3H0s 0.770 1.610 2.444 7.966 8.470 0.940 [OK] 5857 171 H ILE O 16 O1H0u 0.660 1.420 2.209 13.986 16.144 0.866 [OK] 5858 171 H ILE CB 4 C4H1b 0.770 1.880 2.911 14.057 14.227 0.988 [OK] 5859 171 H ILE CG1 9 C4H2b 0.770 1.880 4.407 31.723 24.187 1.312 possible 5860 171 H ILE CG2 10 C4H3u 0.770 1.880 4.866 57.679 35.961 1.604 possible 5861 171 H ILE CD1 10 C4H3u 0.770 1.880 3.122 36.085 38.377 0.940 possible 5862 172 H PRO N 11 N3H0u 0.700 1.640 2.831 8.706 8.823 0.987 [OK] 5863 172 H PRO CA 4 C4H1b 0.770 1.880 3.282 15.855 13.955 1.136 possible 5864 172 H PRO C 1 C3H0s 0.770 1.610 3.141 9.473 8.812 1.075 possible 5865 172 H PRO O 16 O1H0u 0.660 1.420 2.872 27.024 16.169 1.671 [OK] 5866 172 H PRO CB 9 C4H2b 0.770 1.880 3.577 30.627 25.563 1.198 possible 5867 172 H PRO CG 9 C4H2b 0.770 1.880 3.709 28.096 25.832 1.088 possible 5868 172 H PRO CD 8 C4H2s 0.770 1.880 2.805 23.130 23.836 0.970 [OK] 5869 173 H GLU N 12 N3H1s 0.700 1.640 2.835 14.206 13.615 1.043 [OK] 5870 173 H GLU CA 3 C4H1s 0.770 1.880 3.092 16.726 13.399 1.248 possible 5871 173 H GLU C 1 C3H0s 0.770 1.610 3.105 10.469 8.675 1.207 possible 5872 173 H GLU O 16 O1H0u 0.660 1.420 2.903 18.325 16.023 1.144 [OK] 5873 173 H GLU CB 8 C4H2s 0.770 1.880 3.226 24.020 23.529 1.021 possible 5874 173 H GLU CG 8 C4H2s 0.770 1.880 3.624 34.813 23.513 1.481 possible 5875 173 H GLU CD 2 C3H0b 0.770 1.610 3.011 10.534 9.460 1.114 possible 5876 173 H GLU OE1 16 O1H0u 0.660 1.420 2.855 23.932 15.999 1.496 [OK] 5877 173 H GLU OE2 16 O1H0u 0.660 1.420 3.036 24.453 17.432 1.403 possible 5878 174 H GLN N 12 N3H1s 0.700 1.640 2.476 12.536 13.616 0.921 [OK] 5879 174 H GLN CA 3 C4H1s 0.770 1.880 2.612 13.910 13.334 1.043 [OK] 5880 174 H GLN C 1 C3H0s 0.770 1.610 2.329 8.476 8.787 0.965 [OK] 5881 174 H GLN O 16 O1H0u 0.660 1.420 2.351 15.751 15.993 0.985 [OK] 5882 174 H GLN CB 8 C4H2s 0.770 1.880 3.062 24.981 23.275 1.073 possible 5883 174 H GLN CG 8 C4H2s 0.770 1.880 2.976 22.178 23.465 0.945 [OK] 5884 174 H GLN CD 2 C3H0b 0.770 1.610 2.470 9.601 9.659 0.994 [OK] 5885 174 H GLN OE1 16 O1H0u 0.660 1.420 2.637 19.238 17.091 1.126 [OK] 5886 174 H GLN NE2 15 N3H2u 0.700 1.640 2.595 25.792 24.150 1.068 [OK] 5887 175 H MET N 12 N3H1s 0.700 1.640 2.450 14.765 13.564 1.089 [OK] 5888 175 H MET CA 3 C4H1s 0.770 1.880 2.563 12.497 13.231 0.944 [OK] 5889 175 H MET C 1 C3H0s 0.770 1.610 2.483 8.642 8.782 0.984 [OK] 5890 175 H MET O 16 O1H0u 0.660 1.420 2.301 15.707 16.277 0.965 [OK] 5891 175 H MET CB 8 C4H2s 0.770 1.880 3.435 31.266 23.645 1.322 possible 5892 175 H MET CG 9 C4H2b 0.770 1.880 2.844 22.767 24.009 0.948 [OK] 5893 175 H MET SD 19 S2H0u 1.040 1.770 3.174 35.094 30.093 1.166 possible 5894 175 H MET CE 10 C4H3u 0.770 1.880 3.089 34.152 37.161 0.919 possible 5895 176 H ALA N 12 N3H1s 0.700 1.640 2.587 14.402 14.046 1.025 [OK] 5896 176 H ALA CA 4 C4H1b 0.770 1.880 2.799 15.017 14.063 1.068 [OK] 5897 176 H ALA C 1 C3H0s 0.770 1.610 2.533 8.648 8.900 0.972 [OK] 5898 176 H ALA O 16 O1H0u 0.660 1.420 2.716 16.121 16.188 0.996 [OK] 5899 176 H ALA CB 10 C4H3u 0.770 1.880 3.082 36.839 36.782 1.002 possible 5900 177 H ARG N 12 N3H1s 0.700 1.640 2.708 13.985 13.650 1.025 [OK] 5901 177 H ARG CA 3 C4H1s 0.770 1.880 3.136 13.321 13.422 0.992 possible 5902 177 H ARG C 1 C3H0s 0.770 1.610 2.058 7.957 8.838 0.900 [OK] 5903 177 H ARG O 16 O1H0u 0.660 1.420 2.651 15.621 16.084 0.971 [OK] 5904 177 H ARG CB 8 C4H2s 0.770 1.880 2.894 24.376 23.088 1.056 [OK] 5905 177 H ARG CG 8 C4H2s 0.770 1.880 2.870 22.191 23.640 0.939 [OK] 5906 177 H ARG CD 8 C4H2s 0.770 1.880 3.028 22.706 23.300 0.975 possible 5907 177 H ARG NE 13 N3H1b 0.700 1.640 2.811 14.564 15.569 0.935 [OK] 5908 177 H ARG CZ 2 C3H0b 0.770 1.610 2.235 8.390 9.747 0.861 [OK] 5909 177 H ARG NH1 15 N3H2u 0.700 1.640 2.714 21.651 22.782 0.950 [OK] 5910 177 H ARG NH2 15 N3H2u 0.700 1.640 3.082 28.830 23.810 1.211 possible 5911 178 H PHE N 12 N3H1s 0.700 1.640 2.573 13.929 13.691 1.017 [OK] 5912 178 H PHE CA 3 C4H1s 0.770 1.880 2.630 12.504 13.449 0.930 [OK] 5913 178 H PHE C 1 C3H0s 0.770 1.610 2.673 9.305 8.753 1.063 [OK] 5914 178 H PHE O 16 O1H0u 0.660 1.420 2.481 16.988 16.151 1.052 [OK] 5915 178 H PHE CB 8 C4H2s 0.770 1.880 2.941 23.519 23.777 0.989 [OK] 5916 178 H PHE CG 2 C3H0b 0.770 1.610 2.458 9.599 9.721 0.987 [OK] 5917 178 H PHE CD1 5 C3H1s 0.770 1.760 2.681 19.381 20.405 0.950 [OK] 5918 178 H PHE CD2 6 C3H1b 0.770 1.760 2.892 21.910 21.051 1.041 [OK] 5919 178 H PHE CE1 6 C3H1b 0.770 1.760 2.958 25.064 21.580 1.161 [OK] 5920 178 H PHE CE2 6 C3H1b 0.770 1.760 2.783 23.827 21.680 1.099 [OK] 5921 178 H PHE CZ 6 C3H1b 0.770 1.760 2.961 24.606 21.666 1.136 [OK] 5922 179 H LEU N 12 N3H1s 0.700 1.640 2.712 14.109 13.655 1.033 [OK] 5923 179 H LEU CA 3 C4H1s 0.770 1.880 2.588 12.437 13.122 0.948 [OK] 5924 179 H LEU C 1 C3H0s 0.770 1.610 2.643 9.455 8.825 1.071 [OK] 5925 179 H LEU O 16 O1H0u 0.660 1.420 2.292 16.197 16.208 0.999 [OK] 5926 179 H LEU CB 8 C4H2s 0.770 1.880 3.312 25.375 22.951 1.106 possible 5927 179 H LEU CG 4 C4H1b 0.770 1.880 3.155 15.056 14.764 1.020 possible 5928 179 H LEU CD1 10 C4H3u 0.770 1.880 3.419 37.642 37.425 1.006 possible 5929 179 H LEU CD2 10 C4H3u 0.770 1.880 3.082 34.205 37.143 0.921 possible 5930 180 H GLU N 12 N3H1s 0.700 1.640 2.658 15.109 13.615 1.110 [OK] 5931 180 H GLU CA 3 C4H1s 0.770 1.880 2.484 12.325 13.399 0.920 [OK] 5932 180 H GLU C 1 C3H0s 0.770 1.610 2.425 8.537 8.675 0.984 [OK] 5933 180 H GLU O 16 O1H0u 0.660 1.420 2.345 14.868 16.023 0.928 [OK] 5934 180 H GLU CB 8 C4H2s 0.770 1.880 2.643 20.947 23.529 0.890 [OK] 5935 180 H GLU CG 8 C4H2s 0.770 1.880 2.813 22.396 23.513 0.953 [OK] 5936 180 H GLU CD 2 C3H0b 0.770 1.610 2.756 10.317 9.460 1.091 [OK] 5937 180 H GLU OE1 16 O1H0u 0.660 1.420 2.743 19.152 15.999 1.197 [OK] 5938 180 H GLU OE2 16 O1H0u 0.660 1.420 4.051 26.018 17.432 1.493 possible 5939 181 H VAL N 12 N3H1s 0.700 1.640 2.459 13.316 13.676 0.974 [OK] 5940 181 H VAL CA 3 C4H1s 0.770 1.880 2.498 12.166 13.123 0.927 [OK] 5941 181 H VAL C 1 C3H0s 0.770 1.610 2.435 8.911 8.563 1.041 [OK] 5942 181 H VAL O 16 O1H0u 0.660 1.420 2.628 16.408 16.181 1.014 [OK] 5943 181 H VAL CB 4 C4H1b 0.770 1.880 3.241 16.108 14.598 1.103 possible 5944 181 H VAL CG1 10 C4H3u 0.770 1.880 3.221 38.747 36.584 1.059 possible 5945 181 H VAL CG2 10 C4H3u 0.770 1.880 3.446 39.183 36.332 1.078 possible 5946 182 H GLU N 12 N3H1s 0.700 1.640 2.430 13.444 13.615 0.987 [OK] 5947 182 H GLU CA 3 C4H1s 0.770 1.880 2.380 11.699 13.399 0.873 [OK] 5948 182 H GLU C 1 C3H0s 0.770 1.610 2.630 9.093 8.675 1.048 [OK] 5949 182 H GLU O 16 O1H0u 0.660 1.420 3.314 20.332 16.023 1.269 possible 5950 182 H GLU CB 8 C4H2s 0.770 1.880 3.130 21.731 23.529 0.924 possible 5951 182 H GLU CG 8 C4H2s 0.770 1.880 3.487 25.096 23.513 1.067 possible 5952 182 H GLU CD 2 C3H0b 0.770 1.610 3.145 10.079 9.460 1.065 possible 5953 182 H GLU OE1 16 O1H0u 0.660 1.420 15.050 -1.000 15.999 -1.000 bad 5954 182 H GLU OE2 16 O1H0u 0.660 1.420 21.647 -1.000 17.432 -1.000 bad 5955 183 H LEU N 12 N3H1s 0.700 1.640 2.416 12.741 13.655 0.933 [OK] 5956 183 H LEU CA 3 C4H1s 0.770 1.880 2.795 13.407 13.122 1.022 [OK] 5957 183 H LEU C 1 C3H0s 0.770 1.610 3.195 10.972 8.825 1.243 possible 5958 183 H LEU O 16 O1H0u 0.660 1.420 4.209 27.602 16.208 1.703 possible 5959 183 H LEU CB 8 C4H2s 0.770 1.880 2.734 21.311 22.951 0.929 [OK] 5960 183 H LEU CG 4 C4H1b 0.770 1.880 2.824 15.514 14.764 1.051 [OK] 5961 183 H LEU CD1 10 C4H3u 0.770 1.880 3.339 35.820 37.425 0.957 possible 5962 183 H LEU CD2 10 C4H3u 0.770 1.880 3.241 41.526 37.143 1.118 possible 5963 184 H LYS N 12 N3H1s 0.700 1.640 2.776 14.300 13.675 1.046 [OK] 5964 184 H LYS CA 3 C4H1s 0.770 1.880 4.638 18.867 13.324 1.416 possible 5965 184 H LYS C 1 C3H0s 0.770 1.610 3.929 9.200 8.759 1.050 possible 5966 184 H LYS O 16 O1H0u 0.660 1.420 30.386 -1.000 16.049 -1.000 bad 5967 184 H LYS CB 8 C4H2s 0.770 1.880 18.006 -1.000 22.904 -1.000 bad 5968 184 H LYS CG 8 C4H2s 0.770 1.880 30.334 -1.000 23.131 -1.000 bad 5969 184 H LYS CD 8 C4H2s 0.770 1.880 6.581 41.487 23.837 1.740 possible 5970 184 H LYS CE 9 C4H2b 0.770 1.880 19.747 -1.000 23.934 -1.000 bad 5971 184 H LYS NZ 14 N4H3u 0.700 1.640 34.141 -1.000 21.213 -1.000 bad 5972 185 H ASP N 12 N3H1s 0.700 1.640 4.182 13.982 13.895 1.006 possible 5973 185 H ASP CA 3 C4H1s 0.770 1.880 10.794 -1.000 13.377 -1.000 bad 5974 185 H ASP C 1 C3H0s 0.770 1.610 4.997 12.878 8.816 1.461 possible 5975 185 H ASP O 16 O1H0u 0.660 1.420 27.337 -1.000 16.091 -1.000 bad 5976 185 H ASP CB 8 C4H2s 0.770 1.880 30.687 -1.000 23.481 -1.000 bad 5977 185 H ASP CG 2 C3H0b 0.770 1.610 3.505 10.626 9.422 1.128 possible 5978 185 H ASP OD1 16 O1H0u 0.660 1.420 2.557 16.378 15.505 1.056 [OK] 5979 185 H ASP OD2 16 O1H0u 0.660 1.420 25.326 -1.000 16.324 -1.000 bad 5980 186 H GLY N 12 N3H1s 0.700 1.640 4.500 18.117 14.854 1.220 possible 5981 186 H GLY CA 8 C4H2s 0.770 1.880 24.513 -1.000 23.688 -1.000 bad 5982 186 H GLY C 2 C3H0b 0.770 1.610 5.089 13.275 9.840 1.349 possible 5983 186 H GLY O 16 O1H0u 0.660 1.420 18.050 -1.000 16.391 -1.000 bad 5984 187 H SER N 12 N3H1s 0.700 1.640 5.634 18.738 14.103 1.329 possible 5985 187 H SER CA 3 C4H1s 0.770 1.880 9.664 -1.000 13.476 -1.000 bad 5986 187 H SER C 1 C3H0s 0.770 1.610 2.578 9.329 8.923 1.045 [OK] 5987 187 H SER O 16 O1H0u 0.660 1.420 2.343 15.826 16.179 0.978 [OK] 5988 187 H SER CB 8 C4H2s 0.770 1.880 27.054 -1.000 23.884 -1.000 bad 5989 187 H SER OG 17 O2H1u 0.660 1.460 4.168 21.947 18.732 1.172 possible 5990 188 H THR N 12 N3H1s 0.700 1.640 4.553 20.969 13.832 1.516 possible 5991 188 H THR CA 3 C4H1s 0.770 1.880 2.593 11.614 13.099 0.887 [OK] 5992 188 H THR C 1 C3H0s 0.770 1.610 2.497 9.323 8.738 1.067 [OK] 5993 188 H THR O 16 O1H0u 0.660 1.420 4.575 22.527 16.020 1.406 possible 5994 188 H THR CB 4 C4H1b 0.770 1.880 2.675 13.383 14.829 0.902 [OK] 5995 188 H THR OG1 17 O2H1u 0.660 1.460 4.948 41.934 18.123 2.314 possible 5996 188 H THR CG2 10 C4H3u 0.770 1.880 4.460 40.213 36.542 1.100 possible 5997 189 H ARG N 12 N3H1s 0.700 1.640 2.567 13.919 13.650 1.020 [OK] 5998 189 H ARG CA 3 C4H1s 0.770 1.880 2.628 12.644 13.422 0.942 [OK] 5999 189 H ARG C 1 C3H0s 0.770 1.610 2.486 9.535 8.838 1.079 [OK] 6000 189 H ARG O 16 O1H0u 0.660 1.420 2.402 16.743 16.084 1.041 [OK] 6001 189 H ARG CB 8 C4H2s 0.770 1.880 3.241 25.756 23.088 1.116 possible 6002 189 H ARG CG 8 C4H2s 0.770 1.880 3.086 22.436 23.640 0.949 possible 6003 189 H ARG CD 8 C4H2s 0.770 1.880 2.645 21.602 23.300 0.927 [OK] 6004 189 H ARG NE 13 N3H1b 0.700 1.640 2.299 14.817 15.569 0.952 [OK] 6005 189 H ARG CZ 2 C3H0b 0.770 1.610 2.264 8.500 9.747 0.872 [OK] 6006 189 H ARG NH1 15 N3H2u 0.700 1.640 3.317 23.814 22.782 1.045 possible 6007 189 H ARG NH2 15 N3H2u 0.700 1.640 5.118 36.414 23.810 1.529 possible 6008 190 H LEU N 12 N3H1s 0.700 1.640 2.568 14.322 13.655 1.049 [OK] 6009 190 H LEU CA 3 C4H1s 0.770 1.880 2.596 12.150 13.122 0.926 [OK] 6010 190 H LEU C 1 C3H0s 0.770 1.610 2.365 8.934 8.825 1.012 [OK] 6011 190 H LEU O 16 O1H0u 0.660 1.420 2.426 19.087 16.208 1.178 [OK] 6012 190 H LEU CB 8 C4H2s 0.770 1.880 2.876 22.149 22.951 0.965 [OK] 6013 190 H LEU CG 4 C4H1b 0.770 1.880 2.950 16.618 14.764 1.126 [OK] 6014 190 H LEU CD1 10 C4H3u 0.770 1.880 3.116 39.711 37.425 1.061 possible 6015 190 H LEU CD2 10 C4H3u 0.770 1.880 3.005 34.074 37.143 0.917 possible 6016 191 H LEU N 12 N3H1s 0.700 1.640 2.484 13.451 13.655 0.985 [OK] 6017 191 H LEU CA 3 C4H1s 0.770 1.880 2.757 11.686 13.122 0.891 [OK] 6018 191 H LEU C 1 C3H0s 0.770 1.610 2.545 9.124 8.825 1.034 [OK] 6019 191 H LEU O 16 O1H0u 0.660 1.420 2.549 16.150 16.208 0.996 [OK] 6020 191 H LEU CB 8 C4H2s 0.770 1.880 3.344 25.194 22.951 1.098 possible 6021 191 H LEU CG 4 C4H1b 0.770 1.880 3.423 17.793 14.764 1.205 possible 6022 191 H LEU CD1 10 C4H3u 0.770 1.880 3.210 38.241 37.425 1.022 possible 6023 191 H LEU CD2 10 C4H3u 0.770 1.880 3.241 35.836 37.143 0.965 possible 6024 192 H PRO N 11 N3H0u 0.700 1.640 2.859 8.878 8.823 1.006 [OK] 6025 192 H PRO CA 4 C4H1b 0.770 1.880 2.979 14.022 13.955 1.005 [OK] 6026 192 H PRO C 1 C3H0s 0.770 1.610 2.580 8.522 8.812 0.967 [OK] 6027 192 H PRO O 16 O1H0u 0.660 1.420 2.718 16.189 16.169 1.001 [OK] 6028 192 H PRO CB 9 C4H2b 0.770 1.880 2.862 25.713 25.563 1.006 [OK] 6029 192 H PRO CG 9 C4H2b 0.770 1.880 2.759 25.352 25.832 0.981 [OK] 6030 192 H PRO CD 8 C4H2s 0.770 1.880 3.177 25.469 23.836 1.069 possible 6031 193 H MET N 12 N3H1s 0.700 1.640 2.642 13.868 13.564 1.022 [OK] 6032 193 H MET CA 3 C4H1s 0.770 1.880 3.119 13.706 13.231 1.036 possible 6033 193 H MET C 1 C3H0s 0.770 1.610 2.342 8.128 8.782 0.926 [OK] 6034 193 H MET O 16 O1H0u 0.660 1.420 2.392 17.233 16.277 1.059 [OK] 6035 193 H MET CB 8 C4H2s 0.770 1.880 3.071 24.983 23.645 1.057 possible 6036 193 H MET CG 9 C4H2b 0.770 1.880 2.920 22.505 24.009 0.937 [OK] 6037 193 H MET SD 19 S2H0u 1.040 1.770 2.965 28.780 30.093 0.956 [OK] 6038 193 H MET CE 10 C4H3u 0.770 1.880 2.991 37.555 37.161 1.011 [OK] 6039 194 H GLN N 12 N3H1s 0.700 1.640 2.534 13.186 13.616 0.968 [OK] 6040 194 H GLN CA 3 C4H1s 0.770 1.880 2.596 12.493 13.334 0.937 [OK] 6041 194 H GLN C 1 C3H0s 0.770 1.610 2.594 9.864 8.787 1.123 [OK] 6042 194 H GLN O 16 O1H0u 0.660 1.420 2.551 19.025 15.993 1.190 [OK] 6043 194 H GLN CB 8 C4H2s 0.770 1.880 2.713 22.909 23.275 0.984 [OK] 6044 194 H GLN CG 8 C4H2s 0.770 1.880 2.836 22.268 23.465 0.949 [OK] 6045 194 H GLN CD 2 C3H0b 0.770 1.610 2.244 8.479 9.659 0.878 [OK] 6046 194 H GLN OE1 16 O1H0u 0.660 1.420 2.586 19.508 17.091 1.141 [OK] 6047 194 H GLN NE2 15 N3H2u 0.700 1.640 2.595 21.060 24.150 0.872 [OK] 6048 195 H MET N 12 N3H1s 0.700 1.640 2.575 12.329 13.564 0.909 [OK] 6049 195 H MET CA 3 C4H1s 0.770 1.880 2.840 13.591 13.231 1.027 [OK] 6050 195 H MET C 1 C3H0s 0.770 1.610 3.035 11.083 8.782 1.262 possible 6051 195 H MET O 16 O1H0u 0.660 1.420 2.714 19.021 16.277 1.169 [OK] 6052 195 H MET CB 8 C4H2s 0.770 1.880 3.182 25.998 23.645 1.100 possible 6053 195 H MET CG 9 C4H2b 0.770 1.880 2.836 23.729 24.009 0.988 [OK] 6054 195 H MET SD 19 S2H0u 1.040 1.770 2.992 30.560 30.093 1.016 [OK] 6055 195 H MET CE 10 C4H3u 0.770 1.880 3.118 38.365 37.161 1.032 possible 6056 196 H VAL N 12 N3H1s 0.700 1.640 2.873 14.064 13.676 1.028 [OK] 6057 196 H VAL CA 3 C4H1s 0.770 1.880 2.687 13.537 13.123 1.032 [OK] 6058 196 H VAL C 1 C3H0s 0.770 1.610 2.908 9.789 8.563 1.143 [OK] 6059 196 H VAL O 16 O1H0u 0.660 1.420 2.923 19.731 16.181 1.219 [OK] 6060 196 H VAL CB 4 C4H1b 0.770 1.880 2.770 13.928 14.598 0.954 [OK] 6061 196 H VAL CG1 10 C4H3u 0.770 1.880 3.446 41.088 36.584 1.123 possible 6062 196 H VAL CG2 10 C4H3u 0.770 1.880 3.129 35.617 36.332 0.980 possible 6063 197 H LYS N 12 N3H1s 0.700 1.640 2.539 14.036 13.675 1.026 [OK] 6064 197 H LYS CA 3 C4H1s 0.770 1.880 2.690 12.060 13.324 0.905 [OK] 6065 197 H LYS C 1 C3H0s 0.770 1.610 2.545 8.881 8.759 1.014 [OK] 6066 197 H LYS O 16 O1H0u 0.660 1.420 2.408 15.405 16.049 0.960 [OK] 6067 197 H LYS CB 8 C4H2s 0.770 1.880 3.446 29.620 22.904 1.293 possible 6068 197 H LYS CG 8 C4H2s 0.770 1.880 4.271 34.983 23.131 1.512 possible 6069 197 H LYS CD 8 C4H2s 0.770 1.880 3.296 31.039 23.837 1.302 possible 6070 197 H LYS CE 9 C4H2b 0.770 1.880 31.285 -1.000 23.934 -1.000 bad 6071 197 H LYS NZ 14 N4H3u 0.700 1.640 19.673 -1.000 21.213 -1.000 bad 6072 198 H VAL N 12 N3H1s 0.700 1.640 2.668 13.723 13.676 1.003 [OK] 6073 198 H VAL CA 3 C4H1s 0.770 1.880 2.718 13.181 13.123 1.004 [OK] 6074 198 H VAL C 1 C3H0s 0.770 1.610 2.683 8.559 8.563 1.000 [OK] 6075 198 H VAL O 16 O1H0u 0.660 1.420 4.316 31.381 16.181 1.939 possible 6076 198 H VAL CB 4 C4H1b 0.770 1.880 2.974 14.931 14.598 1.023 [OK] 6077 198 H VAL CG1 10 C4H3u 0.770 1.880 3.156 35.092 36.584 0.959 possible 6078 198 H VAL CG2 10 C4H3u 0.770 1.880 3.011 42.434 36.332 1.168 possible 6079 199 H GLN N 12 N3H1s 0.700 1.640 2.392 12.458 13.616 0.915 [OK] 6080 199 H GLN CA 3 C4H1s 0.770 1.880 5.286 23.685 13.334 1.776 possible 6081 199 H GLN C 1 C3H0s 0.770 1.610 4.203 12.674 8.787 1.442 possible 6082 199 H GLN O 16 O1H0u 0.660 1.420 2.855 17.859 15.993 1.117 [OK] 6083 199 H GLN CB 8 C4H2s 0.770 1.880 5.591 30.454 23.275 1.308 possible 6084 199 H GLN CG 8 C4H2s 0.770 1.880 5.100 32.743 23.465 1.395 possible 6085 199 H GLN CD 2 C3H0b 0.770 1.610 4.263 13.807 9.659 1.429 possible 6086 199 H GLN OE1 16 O1H0u 0.660 1.420 4.462 30.220 17.091 1.768 possible 6087 199 H GLN NE2 15 N3H2u 0.700 1.640 30.655 -1.000 24.150 -1.000 bad 6088 200 H SER N 12 N3H1s 0.700 1.640 6.149 33.695 14.103 2.389 possible 6089 200 H SER CA 3 C4H1s 0.770 1.880 4.317 19.159 13.476 1.422 possible 6090 200 H SER C 1 C3H0s 0.770 1.610 2.908 9.324 8.923 1.045 [OK] 6091 200 H SER O 16 O1H0u 0.660 1.420 12.739 -1.000 16.179 -1.000 bad 6092 200 H SER CB 8 C4H2s 0.770 1.880 43.354 -1.000 23.884 -1.000 bad 6093 200 H SER OG 17 O2H1u 0.660 1.460 30.519 -1.000 18.732 -1.000 bad 6094 201 H ASN N 12 N3H1s 0.700 1.640 2.502 13.081 13.695 0.955 [OK] 6095 201 H ASN CA 3 C4H1s 0.770 1.880 6.135 20.972 13.167 1.593 possible 6096 201 H ASN C 1 C3H0s 0.770 1.610 2.374 8.381 8.928 0.939 [OK] 6097 201 H ASN O 16 O1H0u 0.660 1.420 7.425 44.311 16.199 2.735 possible 6098 201 H ASN CB 8 C4H2s 0.770 1.880 32.345 -1.000 23.128 -1.000 bad 6099 201 H ASN CG 2 C3H0b 0.770 1.610 6.456 16.456 9.599 1.714 possible 6100 201 H ASN OD1 16 O1H0u 0.660 1.420 7.296 34.478 16.664 2.069 possible 6101 201 H ASN ND2 15 N3H2u 0.700 1.640 34.854 -1.000 23.083 -1.000 bad 6102 202 H ARG N 12 N3H1s 0.700 1.640 2.442 14.284 13.650 1.046 [OK] 6103 202 H ARG CA 3 C4H1s 0.770 1.880 2.552 13.586 13.422 1.012 [OK] 6104 202 H ARG C 1 C3H0s 0.770 1.610 2.614 8.698 8.838 0.984 [OK] 6105 202 H ARG O 16 O1H0u 0.660 1.420 2.472 15.488 16.084 0.963 [OK] 6106 202 H ARG CB 8 C4H2s 0.770 1.880 3.994 25.318 23.088 1.097 possible 6107 202 H ARG CG 8 C4H2s 0.770 1.880 3.656 26.462 23.640 1.119 possible 6108 202 H ARG CD 8 C4H2s 0.770 1.880 2.879 21.212 23.300 0.910 [OK] 6109 202 H ARG NE 13 N3H1b 0.700 1.640 3.793 20.401 15.569 1.310 possible 6110 202 H ARG CZ 2 C3H0b 0.770 1.610 2.817 9.687 9.747 0.994 [OK] 6111 202 H ARG NH1 15 N3H2u 0.700 1.640 7.893 55.099 22.782 2.419 possible 6112 202 H ARG NH2 15 N3H2u 0.700 1.640 35.183 -1.000 23.810 -1.000 bad 6113 203 H VAL N 12 N3H1s 0.700 1.640 2.359 12.035 13.676 0.880 [OK] 6114 203 H VAL CA 3 C4H1s 0.770 1.880 2.578 12.336 13.123 0.940 [OK] 6115 203 H VAL C 1 C3H0s 0.770 1.610 2.459 8.216 8.563 0.959 [OK] 6116 203 H VAL O 16 O1H0u 0.660 1.420 2.400 15.106 16.181 0.934 [OK] 6117 203 H VAL CB 4 C4H1b 0.770 1.880 2.886 14.393 14.598 0.986 [OK] 6118 203 H VAL CG1 10 C4H3u 0.770 1.880 3.446 39.035 36.584 1.067 possible 6119 203 H VAL CG2 10 C4H3u 0.770 1.880 3.006 33.520 36.332 0.923 possible 6120 204 H HIS N 12 N3H1s 0.700 1.640 2.648 14.839 13.715 1.082 [OK] 6121 204 H HIS CA 3 C4H1s 0.770 1.880 2.573 12.969 13.467 0.963 [OK] 6122 204 H HIS C 1 C3H0s 0.770 1.610 2.554 9.138 8.882 1.029 [OK] 6123 204 H HIS O 16 O1H0u 0.660 1.420 2.360 15.355 16.082 0.955 [OK] 6124 204 H HIS CB 8 C4H2s 0.770 1.880 3.323 24.041 23.653 1.016 possible 6125 204 H HIS CG 2 C3H0b 0.770 1.610 3.056 10.314 9.952 1.036 possible 6126 204 H HIS ND1 13 N3H1b 0.700 1.640 2.448 14.710 15.506 0.949 [OK] 6127 204 H HIS CD2 5 C3H1s 0.770 1.760 4.524 39.762 21.085 1.886 possible 6128 204 H HIS CE1 5 C3H1s 0.770 1.760 3.121 24.287 20.636 1.177 possible 6129 204 H HIS NE2 13 N3H1b 0.700 1.640 4.115 21.317 15.337 1.390 possible 6130 205 H VAL N 12 N3H1s 0.700 1.640 2.622 13.555 13.676 0.991 [OK] 6131 205 H VAL CA 3 C4H1s 0.770 1.880 2.648 13.236 13.123 1.009 [OK] 6132 205 H VAL C 1 C3H0s 0.770 1.610 2.190 8.132 8.563 0.950 [OK] 6133 205 H VAL O 16 O1H0u 0.660 1.420 2.349 17.511 16.181 1.082 [OK] 6134 205 H VAL CB 4 C4H1b 0.770 1.880 2.836 14.784 14.598 1.013 [OK] 6135 205 H VAL CG1 10 C4H3u 0.770 1.880 3.210 39.733 36.584 1.086 possible 6136 205 H VAL CG2 10 C4H3u 0.770 1.880 3.313 36.674 36.332 1.009 possible 6137 206 H ASN N 12 N3H1s 0.700 1.640 2.334 12.750 13.695 0.931 [OK] 6138 206 H ASN CA 3 C4H1s 0.770 1.880 2.670 13.562 13.167 1.030 [OK] 6139 206 H ASN C 1 C3H0s 0.770 1.610 2.326 8.495 8.928 0.952 [OK] 6140 206 H ASN O 16 O1H0u 0.660 1.420 2.300 14.099 16.199 0.870 [OK] 6141 206 H ASN CB 8 C4H2s 0.770 1.880 3.647 29.529 23.128 1.277 possible 6142 206 H ASN CG 2 C3H0b 0.770 1.610 3.501 11.876 9.599 1.237 possible 6143 206 H ASN OD1 16 O1H0u 0.660 1.420 3.742 23.510 16.664 1.411 possible 6144 206 H ASN ND2 15 N3H2u 0.700 1.640 4.298 35.910 23.083 1.556 possible 6145 207 H ALA N 12 N3H1s 0.700 1.640 2.524 13.338 14.046 0.950 [OK] 6146 207 H ALA CA 4 C4H1b 0.770 1.880 2.566 13.349 14.063 0.949 [OK] 6147 207 H ALA C 1 C3H0s 0.770 1.610 2.308 8.696 8.900 0.977 [OK] 6148 207 H ALA O 16 O1H0u 0.660 1.420 2.408 15.567 16.188 0.962 [OK] 6149 207 H ALA CB 10 C4H3u 0.770 1.880 2.941 35.248 36.782 0.958 [OK] 6150 208 H LEU N 12 N3H1s 0.700 1.640 2.556 15.588 13.655 1.142 [OK] 6151 208 H LEU CA 3 C4H1s 0.770 1.880 2.718 13.041 13.122 0.994 [OK] 6152 208 H LEU C 1 C3H0s 0.770 1.610 2.410 8.458 8.825 0.958 [OK] 6153 208 H LEU O 16 O1H0u 0.660 1.420 2.289 15.221 16.208 0.939 [OK] 6154 208 H LEU CB 8 C4H2s 0.770 1.880 2.784 21.182 22.951 0.923 [OK] 6155 208 H LEU CG 4 C4H1b 0.770 1.880 2.908 16.706 14.764 1.132 [OK] 6156 208 H LEU CD1 10 C4H3u 0.770 1.880 2.799 34.878 37.425 0.932 [OK] 6157 208 H LEU CD2 10 C4H3u 0.770 1.880 2.841 37.201 37.143 1.002 [OK] 6158 209 H SER N 12 N3H1s 0.700 1.640 2.438 14.440 14.103 1.024 [OK] 6159 209 H SER CA 3 C4H1s 0.770 1.880 2.540 13.572 13.476 1.007 [OK] 6160 209 H SER C 1 C3H0s 0.770 1.610 2.340 9.198 8.923 1.031 [OK] 6161 209 H SER O 16 O1H0u 0.660 1.420 2.317 14.068 16.179 0.870 [OK] 6162 209 H SER CB 8 C4H2s 0.770 1.880 2.960 23.918 23.884 1.001 [OK] 6163 209 H SER OG 17 O2H1u 0.660 1.460 2.516 18.399 18.732 0.982 [OK] 6164 210 H SER N 12 N3H1s 0.700 1.640 2.537 14.060 14.103 0.997 [OK] 6165 210 H SER CA 3 C4H1s 0.770 1.880 2.868 13.500 13.476 1.002 [OK] 6166 210 H SER C 1 C3H0s 0.770 1.610 4.453 9.415 8.923 1.055 possible 6167 210 H SER O 16 O1H0u 0.660 1.420 4.003 20.947 16.179 1.295 possible 6168 210 H SER CB 8 C4H2s 0.770 1.880 5.041 33.928 23.884 1.421 possible 6169 210 H SER OG 17 O2H1u 0.660 1.460 6.844 51.170 18.732 2.732 possible 6170 211 H ASP N 12 N3H1s 0.700 1.640 4.517 16.333 13.895 1.175 possible 6171 211 H ASP CA 3 C4H1s 0.770 1.880 8.746 -1.000 13.377 -1.000 bad 6172 211 H ASP C 1 C3H0s 0.770 1.610 2.474 8.675 8.816 0.984 [OK] 6173 211 H ASP O 16 O1H0u 0.660 1.420 17.048 -1.000 16.091 -1.000 bad 6174 211 H ASP CB 8 C4H2s 0.770 1.880 36.266 -1.000 23.481 -1.000 bad 6175 211 H ASP CG 2 C3H0b 0.770 1.610 7.932 17.222 9.422 1.828 possible 6176 211 H ASP OD1 16 O1H0u 0.660 1.420 7.823 37.025 15.505 2.388 possible 6177 211 H ASP OD2 16 O1H0u 0.660 1.420 10.076 -1.000 16.324 -1.000 bad 6178 212 H LEU N 12 N3H1s 0.700 1.640 2.359 12.422 13.655 0.910 [OK] 6179 212 H LEU CA 3 C4H1s 0.770 1.880 3.399 13.539 13.122 1.032 possible 6180 212 H LEU C 1 C3H0s 0.770 1.610 2.631 9.808 8.825 1.111 [OK] 6181 212 H LEU O 16 O1H0u 0.660 1.420 2.912 16.928 16.208 1.044 [OK] 6182 212 H LEU CB 8 C4H2s 0.770 1.880 2.768 22.903 22.951 0.998 [OK] 6183 212 H LEU CG 4 C4H1b 0.770 1.880 2.501 13.588 14.764 0.920 [OK] 6184 212 H LEU CD1 10 C4H3u 0.770 1.880 3.933 40.422 37.425 1.080 possible 6185 212 H LEU CD2 10 C4H3u 0.770 1.880 6.078 73.756 37.143 1.986 possible 6186 213 H PHE N 12 N3H1s 0.700 1.640 2.518 13.751 13.691 1.004 [OK] 6187 213 H PHE CA 3 C4H1s 0.770 1.880 2.796 13.432 13.449 0.999 [OK] 6188 213 H PHE C 1 C3H0s 0.770 1.610 2.310 8.309 8.753 0.949 [OK] 6189 213 H PHE O 16 O1H0u 0.660 1.420 2.619 15.277 16.151 0.946 [OK] 6190 213 H PHE CB 8 C4H2s 0.770 1.880 3.149 26.030 23.777 1.095 possible 6191 213 H PHE CG 2 C3H0b 0.770 1.610 2.496 9.497 9.721 0.977 [OK] 6192 213 H PHE CD1 5 C3H1s 0.770 1.760 2.640 16.999 20.405 0.833 [OK] 6193 213 H PHE CD2 6 C3H1b 0.770 1.760 3.126 23.984 21.051 1.139 possible 6194 213 H PHE CE1 6 C3H1b 0.770 1.760 2.660 19.445 21.580 0.901 [OK] 6195 213 H PHE CE2 6 C3H1b 0.770 1.760 2.851 21.515 21.680 0.992 [OK] 6196 213 H PHE CZ 6 C3H1b 0.770 1.760 2.903 22.107 21.666 1.020 [OK] 6197 214 H ALA N 12 N3H1s 0.700 1.640 2.776 15.243 14.046 1.085 [OK] 6198 214 H ALA CA 4 C4H1b 0.770 1.880 2.610 12.921 14.063 0.919 [OK] 6199 214 H ALA C 1 C3H0s 0.770 1.610 3.835 8.954 8.900 1.006 possible 6200 214 H ALA O 16 O1H0u 0.660 1.420 4.158 -1.000 16.188 -1.000 bad 6201 214 H ALA CB 10 C4H3u 0.770 1.880 33.886 -1.000 36.782 -1.000 bad 6202 215 H GLY N 12 N3H1s 0.700 1.640 4.771 22.879 14.854 1.540 possible 6203 215 H GLY CA 8 C4H2s 0.770 1.880 6.076 56.423 23.688 2.382 possible 6204 215 H GLY C 2 C3H0b 0.770 1.610 2.380 9.437 9.840 0.959 [OK] 6205 215 H GLY O 16 O1H0u 0.660 1.420 5.046 34.833 16.391 2.125 possible 6206 216 H ILE N 12 N3H1s 0.700 1.640 2.292 13.495 13.633 0.990 [OK] 6207 216 H ILE CA 3 C4H1s 0.770 1.880 2.561 11.695 13.007 0.899 [OK] 6208 216 H ILE C 1 C3H0s 0.770 1.610 2.493 7.847 8.470 0.926 [OK] 6209 216 H ILE O 16 O1H0u 0.660 1.420 2.276 14.100 16.144 0.873 [OK] 6210 216 H ILE CB 4 C4H1b 0.770 1.880 2.451 12.428 14.227 0.874 [OK] 6211 216 H ILE CG1 9 C4H2b 0.770 1.880 2.865 22.022 24.187 0.910 [OK] 6212 216 H ILE CG2 10 C4H3u 0.770 1.880 3.007 37.794 35.961 1.051 possible 6213 216 H ILE CD1 10 C4H3u 0.770 1.880 3.098 36.188 38.377 0.943 possible 6214 217 H PRO N 11 N3H0u 0.700 1.640 3.078 9.222 8.823 1.045 possible 6215 217 H PRO CA 4 C4H1b 0.770 1.880 5.893 24.871 13.955 1.782 possible 6216 217 H PRO C 1 C3H0s 0.770 1.610 2.912 9.148 8.812 1.038 [OK] 6217 217 H PRO O 16 O1H0u 0.660 1.420 2.750 16.324 16.169 1.010 [OK] 6218 217 H PRO CB 9 C4H2b 0.770 1.880 4.464 31.282 25.563 1.224 possible 6219 217 H PRO CG 9 C4H2b 0.770 1.880 6.826 67.903 25.832 2.629 possible 6220 217 H PRO CD 8 C4H2s 0.770 1.880 3.166 23.697 23.836 0.994 possible 6221 218 H THR N 12 N3H1s 0.700 1.640 3.827 17.219 13.832 1.245 possible 6222 218 H THR CA 3 C4H1s 0.770 1.880 2.550 12.196 13.099 0.931 [OK] 6223 218 H THR C 1 C3H0s 0.770 1.610 2.743 10.118 8.738 1.158 [OK] 6224 218 H THR O 16 O1H0u 0.660 1.420 2.771 18.356 16.020 1.146 [OK] 6225 218 H THR CB 4 C4H1b 0.770 1.880 5.907 25.125 14.829 1.694 possible 6226 218 H THR OG1 17 O2H1u 0.660 1.460 25.969 -1.000 18.123 -1.000 bad 6227 218 H THR CG2 10 C4H3u 0.770 1.880 5.323 57.432 36.542 1.572 possible 6228 219 H ILE N 12 N3H1s 0.700 1.640 2.682 13.043 13.633 0.957 [OK] 6229 219 H ILE CA 3 C4H1s 0.770 1.880 2.538 12.149 13.007 0.934 [OK] 6230 219 H ILE C 1 C3H0s 0.770 1.610 2.583 9.537 8.470 1.126 [OK] 6231 219 H ILE O 16 O1H0u 0.660 1.420 6.773 67.764 16.144 4.197 possible 6232 219 H ILE CB 4 C4H1b 0.770 1.880 2.592 13.667 14.227 0.961 [OK] 6233 219 H ILE CG1 9 C4H2b 0.770 1.880 4.500 29.817 24.187 1.233 possible 6234 219 H ILE CG2 10 C4H3u 0.770 1.880 2.987 34.075 35.961 0.948 [OK] 6235 219 H ILE CD1 10 C4H3u 0.770 1.880 3.153 37.138 38.377 0.968 possible 6236 220 H LYS N 12 N3H1s 0.700 1.640 2.599 12.888 13.675 0.942 [OK] 6237 220 H LYS CA 3 C4H1s 0.770 1.880 7.525 26.057 13.324 1.956 possible 6238 220 H LYS C 1 C3H0s 0.770 1.610 3.575 9.722 8.759 1.110 possible 6239 220 H LYS O 16 O1H0u 0.660 1.420 27.364 -1.000 16.049 -1.000 bad 6240 220 H LYS CB 8 C4H2s 0.770 1.880 11.656 -1.000 22.904 -1.000 bad 6241 220 H LYS CG 8 C4H2s 0.770 1.880 14.091 -1.000 23.131 -1.000 bad 6242 220 H LYS CD 8 C4H2s 0.770 1.880 33.182 -1.000 23.837 -1.000 bad 6243 220 H LYS CE 9 C4H2b 0.770 1.880 7.207 -1.000 23.934 -1.000 bad 6244 220 H LYS NZ 14 N4H3u 0.700 1.640 20.207 -1.000 21.213 -1.000 bad 6245 221 H SER N 12 N3H1s 0.700 1.640 3.643 14.288 14.103 1.013 possible 6246 221 H SER CA 3 C4H1s 0.770 1.880 5.657 18.969 13.476 1.408 possible 6247 221 H SER C 1 C3H0s 0.770 1.610 3.291 9.480 8.923 1.062 possible 6248 221 H SER O 16 O1H0u 0.660 1.420 2.904 16.345 16.179 1.010 [OK] 6249 221 H SER CB 8 C4H2s 0.770 1.880 13.316 -1.000 23.884 -1.000 bad 6250 221 H SER OG 17 O2H1u 0.660 1.460 13.844 -1.000 18.732 -1.000 bad 6251 222 H PRO N 11 N3H0u 0.700 1.640 3.592 9.685 8.823 1.098 possible 6252 222 H PRO CA 4 C4H1b 0.770 1.880 4.251 17.528 13.955 1.256 possible 6253 222 H PRO C 1 C3H0s 0.770 1.610 2.592 9.257 8.812 1.050 [OK] 6254 222 H PRO O 16 O1H0u 0.660 1.420 3.645 22.563 16.169 1.395 possible 6255 222 H PRO CB 9 C4H2b 0.770 1.880 25.510 -1.000 25.563 -1.000 bad 6256 222 H PRO CG 9 C4H2b 0.770 1.880 44.429 -1.000 25.832 -1.000 bad 6257 222 H PRO CD 8 C4H2s 0.770 1.880 22.722 -1.000 23.836 -1.000 bad 6258 223 H THR N 12 N3H1s 0.700 1.640 2.845 13.953 13.832 1.009 [OK] 6259 223 H THR CA 3 C4H1s 0.770 1.880 2.589 12.276 13.099 0.937 [OK] 6260 223 H THR C 1 C3H0s 0.770 1.610 2.402 9.341 8.738 1.069 [OK] 6261 223 H THR O 16 O1H0u 0.660 1.420 2.831 17.389 16.020 1.085 [OK] 6262 223 H THR CB 4 C4H1b 0.770 1.880 4.084 18.668 14.829 1.259 possible 6263 223 H THR OG1 17 O2H1u 0.660 1.460 11.352 -1.000 18.123 -1.000 bad 6264 223 H THR CG2 10 C4H3u 0.770 1.880 40.765 -1.000 36.542 -1.000 bad 6265 224 H GLU N 12 N3H1s 0.700 1.640 2.557 14.794 13.615 1.087 [OK] 6266 224 H GLU CA 3 C4H1s 0.770 1.880 2.930 13.190 13.399 0.984 [OK] 6267 224 H GLU C 1 C3H0s 0.770 1.610 2.778 8.707 8.675 1.004 [OK] 6268 224 H GLU O 16 O1H0u 0.660 1.420 2.583 16.399 16.023 1.023 [OK] 6269 224 H GLU CB 8 C4H2s 0.770 1.880 2.738 20.539 23.529 0.873 [OK] 6270 224 H GLU CG 8 C4H2s 0.770 1.880 3.012 24.070 23.513 1.024 possible 6271 224 H GLU CD 2 C3H0b 0.770 1.610 4.209 11.266 9.460 1.191 possible 6272 224 H GLU OE1 16 O1H0u 0.660 1.420 12.589 -1.000 15.999 -1.000 bad 6273 224 H GLU OE2 16 O1H0u 0.660 1.420 16.759 -1.000 17.432 -1.000 bad 6274 225 H VAL N 12 N3H1s 0.700 1.640 2.717 13.462 13.676 0.984 [OK] 6275 225 H VAL CA 3 C4H1s 0.770 1.880 2.926 13.185 13.123 1.005 [OK] 6276 225 H VAL C 1 C3H0s 0.770 1.610 2.819 9.848 8.563 1.150 [OK] 6277 225 H VAL O 16 O1H0u 0.660 1.420 2.381 15.002 16.181 0.927 [OK] 6278 225 H VAL CB 4 C4H1b 0.770 1.880 2.764 15.011 14.598 1.028 [OK] 6279 225 H VAL CG1 10 C4H3u 0.770 1.880 3.024 38.399 36.584 1.050 possible 6280 225 H VAL CG2 10 C4H3u 0.770 1.880 3.121 33.176 36.332 0.913 possible 6281 226 H THR N 12 N3H1s 0.700 1.640 2.813 12.616 13.832 0.912 [OK] 6282 226 H THR CA 3 C4H1s 0.770 1.880 2.553 12.079 13.099 0.922 [OK] 6283 226 H THR C 1 C3H0s 0.770 1.610 2.518 9.217 8.738 1.055 [OK] 6284 226 H THR O 16 O1H0u 0.660 1.420 2.421 13.229 16.020 0.826 [OK] 6285 226 H THR CB 4 C4H1b 0.770 1.880 2.569 12.839 14.829 0.866 [OK] 6286 226 H THR OG1 17 O2H1u 0.660 1.460 2.537 15.897 18.123 0.877 [OK] 6287 226 H THR CG2 10 C4H3u 0.770 1.880 3.590 39.976 36.542 1.094 possible 6288 227 H LEU N 12 N3H1s 0.700 1.640 2.492 14.360 13.655 1.052 [OK] 6289 227 H LEU CA 3 C4H1s 0.770 1.880 2.807 13.422 13.122 1.023 [OK] 6290 227 H LEU C 1 C3H0s 0.770 1.610 2.107 8.165 8.825 0.925 [OK] 6291 227 H LEU O 16 O1H0u 0.660 1.420 2.333 14.552 16.208 0.898 [OK] 6292 227 H LEU CB 8 C4H2s 0.770 1.880 2.728 21.151 22.951 0.922 [OK] 6293 227 H LEU CG 4 C4H1b 0.770 1.880 2.949 15.135 14.764 1.025 [OK] 6294 227 H LEU CD1 10 C4H3u 0.770 1.880 3.254 42.584 37.425 1.138 possible 6295 227 H LEU CD2 10 C4H3u 0.770 1.880 2.864 33.164 37.143 0.893 [OK] 6296 228 H LEU N 12 N3H1s 0.700 1.640 2.305 13.582 13.655 0.995 [OK] 6297 228 H LEU CA 3 C4H1s 0.770 1.880 2.917 14.759 13.122 1.125 [OK] 6298 228 H LEU C 1 C3H0s 0.770 1.610 2.598 8.188 8.825 0.928 [OK] 6299 228 H LEU O 16 O1H0u 0.660 1.420 2.620 16.748 16.208 1.033 [OK] 6300 228 H LEU CB 8 C4H2s 0.770 1.880 2.938 20.293 22.951 0.884 [OK] 6301 228 H LEU CG 4 C4H1b 0.770 1.880 2.997 15.328 14.764 1.038 [OK] 6302 228 H LEU CD1 10 C4H3u 0.770 1.880 4.285 38.336 37.425 1.024 possible 6303 228 H LEU CD2 10 C4H3u 0.770 1.880 19.951 -1.000 37.143 -1.000 bad 6304 229 H GLU N 12 N3H1s 0.700 1.640 2.675 12.975 13.615 0.953 [OK] 6305 229 H GLU CA 3 C4H1s 0.770 1.880 3.277 16.377 13.399 1.222 possible 6306 229 H GLU C 1 C3H0s 0.770 1.610 2.310 8.416 8.675 0.970 [OK] 6307 229 H GLU O 16 O1H0u 0.660 1.420 2.835 14.842 16.023 0.926 [OK] 6308 229 H GLU CB 8 C4H2s 0.770 1.880 3.318 22.808 23.529 0.969 possible 6309 229 H GLU CG 8 C4H2s 0.770 1.880 3.068 24.050 23.513 1.023 possible 6310 229 H GLU CD 2 C3H0b 0.770 1.610 2.448 9.066 9.460 0.958 [OK] 6311 229 H GLU OE1 16 O1H0u 0.660 1.420 2.376 14.700 15.999 0.919 [OK] 6312 229 H GLU OE2 16 O1H0u 0.660 1.420 2.391 15.827 17.432 0.908 [OK] 6313 230 H GLU N 12 N3H1s 0.700 1.640 2.429 12.698 13.615 0.933 [OK] 6314 230 H GLU CA 3 C4H1s 0.770 1.880 3.090 15.968 13.399 1.192 possible 6315 230 H GLU C 1 C3H0s 0.770 1.610 2.932 8.549 8.675 0.985 [OK] 6316 230 H GLU O 16 O1H0u 0.660 1.420 2.943 16.139 16.023 1.007 [OK] 6317 230 H GLU CB 8 C4H2s 0.770 1.880 3.089 23.323 23.529 0.991 possible 6318 230 H GLU CG 8 C4H2s 0.770 1.880 3.054 22.340 23.513 0.950 possible 6319 230 H GLU CD 2 C3H0b 0.770 1.610 2.524 9.141 9.460 0.966 [OK] 6320 230 H GLU OE1 16 O1H0u 0.660 1.420 2.600 16.305 15.999 1.019 [OK] 6321 230 H GLU OE2 16 O1H0u 0.660 1.420 2.470 16.619 17.432 0.953 [OK] 6322 231 H ASP N 12 N3H1s 0.700 1.640 2.589 12.129 13.895 0.873 [OK] 6323 231 H ASP CA 3 C4H1s 0.770 1.880 3.323 14.971 13.377 1.119 possible 6324 231 H ASP C 1 C3H0s 0.770 1.610 2.228 8.073 8.816 0.916 [OK] 6325 231 H ASP O 16 O1H0u 0.660 1.420 2.576 18.077 16.091 1.123 [OK] 6326 231 H ASP CB 8 C4H2s 0.770 1.880 3.075 25.105 23.481 1.069 possible 6327 231 H ASP CG 2 C3H0b 0.770 1.610 2.487 8.983 9.422 0.953 [OK] 6328 231 H ASP OD1 16 O1H0u 0.660 1.420 2.846 16.691 15.505 1.076 [OK] 6329 231 H ASP OD2 16 O1H0u 0.660 1.420 2.465 15.497 16.324 0.949 [OK] 6330 232 H LYS N 12 N3H1s 0.700 1.640 2.726 12.741 13.675 0.932 [OK] 6331 232 H LYS CA 3 C4H1s 0.770 1.880 2.994 13.774 13.324 1.034 [OK] 6332 232 H LYS C 1 C3H0s 0.770 1.610 2.199 8.492 8.759 0.970 [OK] 6333 232 H LYS O 16 O1H0u 0.660 1.420 2.674 17.632 16.049 1.099 [OK] 6334 232 H LYS CB 8 C4H2s 0.770 1.880 3.513 25.107 22.904 1.096 possible 6335 232 H LYS CG 8 C4H2s 0.770 1.880 3.111 22.802 23.131 0.986 possible 6336 232 H LYS CD 8 C4H2s 0.770 1.880 5.133 40.554 23.837 1.701 possible 6337 232 H LYS CE 9 C4H2b 0.770 1.880 3.254 23.207 23.934 0.970 possible 6338 232 H LYS NZ 14 N4H3u 0.700 1.640 35.597 -1.000 21.213 -1.000 bad 6339 233 H ILE N 12 N3H1s 0.700 1.640 2.469 12.261 13.633 0.899 [OK] 6340 233 H ILE CA 3 C4H1s 0.770 1.880 2.874 14.215 13.007 1.093 [OK] 6341 233 H ILE C 1 C3H0s 0.770 1.610 2.353 7.870 8.470 0.929 [OK] 6342 233 H ILE O 16 O1H0u 0.660 1.420 2.461 15.239 16.144 0.944 [OK] 6343 233 H ILE CB 4 C4H1b 0.770 1.880 2.956 14.777 14.227 1.039 [OK] 6344 233 H ILE CG1 9 C4H2b 0.770 1.880 3.374 23.513 24.187 0.972 possible 6345 233 H ILE CG2 10 C4H3u 0.770 1.880 2.894 35.503 35.961 0.987 [OK] 6346 233 H ILE CD1 10 C4H3u 0.770 1.880 3.335 42.168 38.377 1.099 possible 6347 234 H CYS N 12 N3H1s 0.700 1.640 2.430 12.712 13.981 0.909 [OK] 6348 234 H CYS CA 3 C4H1s 0.770 1.880 2.628 13.439 13.656 0.984 [OK] 6349 234 H CYS C 1 C3H0s 0.770 1.610 2.236 8.407 8.897 0.945 [OK] 6350 234 H CYS O 16 O1H0u 0.660 1.420 2.264 14.500 16.543 0.877 [OK] 6351 234 H CYS CB 9 C4H2b 0.770 1.880 3.394 24.425 23.536 1.038 possible 6352 234 H CYS SG 20 S2H1u 1.040 1.770 3.423 38.938 34.603 1.125 possible 6353 235 H GLY N 12 N3H1s 0.700 1.640 2.696 14.506 14.854 0.977 [OK] 6354 235 H GLY CA 8 C4H2s 0.770 1.880 3.163 26.395 23.688 1.114 possible 6355 235 H GLY C 2 C3H0b 0.770 1.610 2.571 9.276 9.840 0.943 [OK] 6356 235 H GLY O 16 O1H0u 0.660 1.420 2.371 15.197 16.391 0.927 [OK] 6357 236 H TYR N 12 N3H1s 0.700 1.640 2.887 14.251 13.691 1.041 [OK] 6358 236 H TYR CA 3 C4H1s 0.770 1.880 2.978 15.476 13.330 1.161 [OK] 6359 236 H TYR C 1 C3H0s 0.770 1.610 2.164 7.770 8.770 0.886 [OK] 6360 236 H TYR O 16 O1H0u 0.660 1.420 2.411 16.990 16.124 1.054 [OK] 6361 236 H TYR CB 8 C4H2s 0.770 1.880 2.934 21.845 23.678 0.923 [OK] 6362 236 H TYR CG 2 C3H0b 0.770 1.610 2.461 9.377 9.732 0.963 [OK] 6363 236 H TYR CD1 5 C3H1s 0.770 1.760 2.844 20.669 20.171 1.025 [OK] 6364 236 H TYR CD2 5 C3H1s 0.770 1.760 3.715 25.604 20.728 1.235 possible 6365 236 H TYR CE1 5 C3H1s 0.770 1.760 2.730 20.170 20.675 0.976 [OK] 6366 236 H TYR CE2 5 C3H1s 0.770 1.760 3.507 24.758 20.810 1.190 possible 6367 236 H TYR CZ 2 C3H0b 0.770 1.610 2.398 9.365 9.926 0.943 [OK] 6368 236 H TYR OH 17 O2H1u 0.660 1.460 2.747 18.910 19.173 0.986 [OK] 6369 237 H VAL N 12 N3H1s 0.700 1.640 2.400 12.610 13.676 0.922 [OK] 6370 237 H VAL CA 3 C4H1s 0.770 1.880 2.615 13.096 13.123 0.998 [OK] 6371 237 H VAL C 1 C3H0s 0.770 1.610 2.275 8.014 8.563 0.936 [OK] 6372 237 H VAL O 16 O1H0u 0.660 1.420 2.322 16.054 16.181 0.992 [OK] 6373 237 H VAL CB 4 C4H1b 0.770 1.880 2.634 14.594 14.598 1.000 [OK] 6374 237 H VAL CG1 10 C4H3u 0.770 1.880 3.164 38.220 36.584 1.045 possible 6375 237 H VAL CG2 10 C4H3u 0.770 1.880 3.044 35.795 36.332 0.985 possible 6376 238 H ALA N 12 N3H1s 0.700 1.640 2.465 13.874 14.046 0.988 [OK] 6377 238 H ALA CA 4 C4H1b 0.770 1.880 2.751 14.059 14.063 1.000 [OK] 6378 238 H ALA C 1 C3H0s 0.770 1.610 2.635 8.503 8.900 0.955 [OK] 6379 238 H ALA O 16 O1H0u 0.660 1.420 2.463 15.903 16.188 0.982 [OK] 6380 238 H ALA CB 10 C4H3u 0.770 1.880 2.873 36.061 36.782 0.980 [OK] 6381 239 H GLY N 12 N3H1s 0.700 1.640 2.414 13.062 14.854 0.879 [OK] 6382 239 H GLY CA 8 C4H2s 0.770 1.880 2.702 22.659 23.688 0.957 [OK] 6383 239 H GLY C 2 C3H0b 0.770 1.610 2.401 8.771 9.840 0.891 [OK] 6384 239 H GLY O 16 O1H0u 0.660 1.420 2.219 15.171 16.391 0.926 [OK] 6385 240 H GLY N 12 N3H1s 0.700 1.640 2.378 13.474 14.854 0.907 [OK] 6386 240 H GLY CA 8 C4H2s 0.770 1.880 2.866 23.464 23.688 0.991 [OK] 6387 240 H GLY C 2 C3H0b 0.770 1.610 2.309 8.822 9.840 0.897 [OK] 6388 240 H GLY O 16 O1H0u 0.660 1.420 2.242 14.037 16.391 0.856 [OK] 6389 241 H LEU N 12 N3H1s 0.700 1.640 2.508 13.819 13.655 1.012 [OK] 6390 241 H LEU CA 3 C4H1s 0.770 1.880 2.821 12.589 13.122 0.959 [OK] 6391 241 H LEU C 1 C3H0s 0.770 1.610 2.600 8.732 8.825 0.989 [OK] 6392 241 H LEU O 16 O1H0u 0.660 1.420 3.667 22.682 16.208 1.399 possible 6393 241 H LEU CB 8 C4H2s 0.770 1.880 4.117 27.110 22.951 1.181 possible 6394 241 H LEU CG 4 C4H1b 0.770 1.880 2.761 14.378 14.764 0.974 [OK] 6395 241 H LEU CD1 10 C4H3u 0.770 1.880 3.585 41.818 37.425 1.117 possible 6396 241 H LEU CD2 10 C4H3u 0.770 1.880 3.919 42.259 37.143 1.138 possible 6397 242 H MET N 12 N3H1s 0.700 1.640 2.488 12.549 13.564 0.925 [OK] 6398 242 H MET CA 3 C4H1s 0.770 1.880 3.151 13.649 13.231 1.032 possible 6399 242 H MET C 1 C3H0s 0.770 1.610 2.465 8.736 8.782 0.995 [OK] 6400 242 H MET O 16 O1H0u 0.660 1.420 5.825 45.581 16.277 2.800 possible 6401 242 H MET CB 8 C4H2s 0.770 1.880 3.027 23.180 23.645 0.980 possible 6402 242 H MET CG 9 C4H2b 0.770 1.880 6.317 53.208 24.009 2.216 possible 6403 242 H MET SD 19 S2H0u 1.040 1.770 4.724 33.999 30.093 1.130 possible 6404 242 H MET CE 10 C4H3u 0.770 1.880 3.216 38.662 37.161 1.040 possible 6405 243 H TYR N 12 N3H1s 0.700 1.640 2.295 12.629 13.691 0.922 [OK] 6406 243 H TYR CA 3 C4H1s 0.770 1.880 4.401 15.751 13.330 1.182 possible 6407 243 H TYR C 1 C3H0s 0.770 1.610 3.087 9.826 8.770 1.120 possible 6408 243 H TYR O 16 O1H0u 0.660 1.420 6.497 62.125 16.124 3.853 possible 6409 243 H TYR CB 8 C4H2s 0.770 1.880 4.644 33.916 23.678 1.432 possible 6410 243 H TYR CG 2 C3H0b 0.770 1.610 2.693 9.858 9.732 1.013 [OK] 6411 243 H TYR CD1 5 C3H1s 0.770 1.760 12.680 -1.000 20.171 -1.000 bad 6412 243 H TYR CD2 5 C3H1s 0.770 1.760 2.582 20.307 20.728 0.980 [OK] 6413 243 H TYR CE1 5 C3H1s 0.770 1.760 6.247 33.022 20.675 1.597 possible 6414 243 H TYR CE2 5 C3H1s 0.770 1.760 2.687 19.924 20.810 0.957 [OK] 6415 243 H TYR CZ 2 C3H0b 0.770 1.610 2.278 9.076 9.926 0.914 [OK] 6416 243 H TYR OH 17 O2H1u 0.660 1.460 2.532 20.992 19.173 1.095 [OK] 6417 244 H ALA N 12 N3H1s 0.700 1.640 2.904 14.508 14.046 1.033 [OK] 6418 244 H ALA CA 4 C4H1b 0.770 1.880 3.104 16.571 14.063 1.178 possible 6419 244 H ALA C 1 C3H0s 0.770 1.610 2.885 9.525 8.900 1.070 [OK] 6420 244 H ALA O 16 O1H0u 0.660 1.420 2.708 17.473 16.188 1.079 [OK] 6421 244 H ALA CB 10 C4H3u 0.770 1.880 2.858 36.650 36.782 0.996 [OK] 6422 245 H ALA N 12 N3H1s 0.700 1.640 2.467 14.315 14.046 1.019 [OK] 6423 245 H ALA CA 4 C4H1b 0.770 1.880 3.292 13.849 14.063 0.985 possible 6424 245 H ALA C 1 C3H0s 0.770 1.610 2.688 8.555 8.900 0.961 [OK] 6425 245 H ALA O 16 O1H0u 0.660 1.420 3.614 21.616 16.188 1.335 possible 6426 245 H ALA CB 10 C4H3u 0.770 1.880 7.826 93.261 36.782 2.536 possible 6427 246 H PRO N 11 N3H0u 0.700 1.640 2.929 9.071 8.823 1.028 [OK] 6428 246 H PRO CA 4 C4H1b 0.770 1.880 6.344 22.973 13.955 1.646 possible 6429 246 H PRO C 1 C3H0s 0.770 1.610 3.213 9.168 8.812 1.040 possible 6430 246 H PRO O 16 O1H0u 0.660 1.420 29.828 -1.000 16.169 -1.000 bad 6431 246 H PRO CB 9 C4H2b 0.770 1.880 28.306 -1.000 25.563 -1.000 bad 6432 246 H PRO CG 9 C4H2b 0.770 1.880 43.208 -1.000 25.832 -1.000 bad 6433 246 H PRO CD 8 C4H2s 0.770 1.880 5.468 38.873 23.836 1.631 possible 6434 247 H LYS N 12 N3H1s 0.700 1.640 2.770 12.843 13.675 0.939 [OK] 6435 247 H LYS CA 3 C4H1s 0.770 1.880 4.049 16.209 13.324 1.217 possible 6436 247 H LYS C 1 C3H0s 0.770 1.610 3.276 10.926 8.759 1.247 possible 6437 247 H LYS O 16 O1H0u 0.660 1.420 3.176 17.034 16.049 1.061 possible 6438 247 H LYS CB 8 C4H2s 0.770 1.880 3.516 25.415 22.904 1.110 possible 6439 247 H LYS CG 8 C4H2s 0.770 1.880 19.786 -1.000 23.131 -1.000 bad 6440 247 H LYS CD 8 C4H2s 0.770 1.880 3.226 25.039 23.837 1.050 possible 6441 247 H LYS CE 9 C4H2b 0.770 1.880 31.906 -1.000 23.934 -1.000 bad 6442 247 H LYS NZ 14 N4H3u 0.700 1.640 21.113 -1.000 21.213 -1.000 bad 6443 248 H ARG N 12 N3H1s 0.700 1.640 2.684 14.746 13.650 1.080 [OK] 6444 248 H ARG CA 3 C4H1s 0.770 1.880 2.539 12.622 13.422 0.940 [OK] 6445 248 H ARG C 1 C3H0s 0.770 1.610 3.141 8.804 8.838 0.996 possible 6446 248 H ARG O 16 O1H0u 0.660 1.420 6.108 59.802 16.084 3.718 possible 6447 248 H ARG CB 8 C4H2s 0.770 1.880 4.181 24.160 23.088 1.046 possible 6448 248 H ARG CG 8 C4H2s 0.770 1.880 6.193 48.638 23.640 2.057 possible 6449 248 H ARG CD 8 C4H2s 0.770 1.880 3.631 21.044 23.300 0.903 possible 6450 248 H ARG NE 13 N3H1b 0.700 1.640 5.407 25.683 15.569 1.650 possible 6451 248 H ARG CZ 2 C3H0b 0.770 1.610 2.557 10.294 9.747 1.056 [OK] 6452 248 H ARG NH1 15 N3H2u 0.700 1.640 2.644 23.400 22.782 1.027 [OK] 6453 248 H ARG NH2 15 N3H2u 0.700 1.640 4.484 27.362 23.810 1.149 possible 6454 249 H LYS N 12 N3H1s 0.700 1.640 2.804 13.618 13.675 0.996 [OK] 6455 249 H LYS CA 3 C4H1s 0.770 1.880 5.884 17.940 13.324 1.346 possible 6456 249 H LYS C 1 C3H0s 0.770 1.610 2.759 8.989 8.759 1.026 [OK] 6457 249 H LYS O 16 O1H0u 0.660 1.420 4.077 26.948 16.049 1.679 possible 6458 249 H LYS CB 8 C4H2s 0.770 1.880 3.264 25.569 22.904 1.116 possible 6459 249 H LYS CG 8 C4H2s 0.770 1.880 7.684 49.239 23.131 2.129 possible 6460 249 H LYS CD 8 C4H2s 0.770 1.880 4.365 33.751 23.837 1.416 possible 6461 249 H LYS CE 9 C4H2b 0.770 1.880 21.578 -1.000 23.934 -1.000 bad 6462 249 H LYS NZ 14 N4H3u 0.700 1.640 50.043 -1.000 21.213 -1.000 bad 6463 250 H SER N 12 N3H1s 0.700 1.640 6.879 30.212 14.103 2.142 possible 6464 250 H SER CA 3 C4H1s 0.770 1.880 6.726 36.555 13.476 2.713 possible 6465 250 H SER C 1 C3H0s 0.770 1.610 3.155 9.021 8.923 1.011 possible 6466 250 H SER O 16 O1H0u 0.660 1.420 3.261 17.406 16.179 1.076 possible 6467 250 H SER CB 8 C4H2s 0.770 1.880 33.451 -1.000 23.884 -1.000 bad 6468 250 H SER OG 17 O2H1u 0.660 1.460 12.248 -1.000 18.732 -1.000 bad 6469 251 H VAL N 12 N3H1s 0.700 1.640 4.089 22.496 13.676 1.645 possible 6470 251 H VAL CA 3 C4H1s 0.770 1.880 4.560 21.898 13.123 1.669 possible 6471 251 H VAL C 1 C3H0s 0.770 1.610 3.270 8.652 8.563 1.010 possible 6472 251 H VAL O 16 O1H0u 0.660 1.420 3.723 21.387 16.181 1.322 possible 6473 251 H VAL CB 4 C4H1b 0.770 1.880 7.232 -1.000 14.598 -1.000 bad 6474 251 H VAL CG1 10 C4H3u 0.770 1.880 49.652 -1.000 36.584 -1.000 bad 6475 251 H VAL CG2 10 C4H3u 0.770 1.880 61.181 -1.000 36.332 -1.000 bad 6476 252 H VAL N 12 N3H1s 0.700 1.640 3.675 14.703 13.676 1.075 possible 6477 252 H VAL CA 3 C4H1s 0.770 1.880 4.367 22.824 13.123 1.739 possible 6478 252 H VAL C 1 C3H0s 0.770 1.610 2.952 8.385 8.563 0.979 [OK] 6479 252 H VAL O 16 O1H0u 0.660 1.420 3.679 24.116 16.181 1.490 possible 6480 252 H VAL CB 4 C4H1b 0.770 1.880 4.756 16.301 14.598 1.117 possible 6481 252 H VAL CG1 10 C4H3u 0.770 1.880 56.485 -1.000 36.584 -1.000 bad 6482 252 H VAL CG2 10 C4H3u 0.770 1.880 50.246 -1.000 36.332 -1.000 bad 6483 253 H ALA N 12 N3H1s 0.700 1.640 3.881 15.212 14.046 1.083 possible 6484 253 H ALA CA 4 C4H1b 0.770 1.880 5.247 22.699 14.063 1.614 possible 6485 253 H ALA C 1 C3H0s 0.770 1.610 2.259 8.215 8.900 0.923 [OK] 6486 253 H ALA O 16 O1H0u 0.660 1.420 5.950 38.382 16.188 2.371 possible 6487 253 H ALA CB 10 C4H3u 0.770 1.880 23.112 -1.000 36.782 -1.000 bad 6488 254 H ALA N 12 N3H1s 0.700 1.640 2.733 13.645 14.046 0.971 [OK] 6489 254 H ALA CA 4 C4H1b 0.770 1.880 3.305 14.456 14.063 1.028 possible 6490 254 H ALA C 1 C3H0s 0.770 1.610 3.506 9.429 8.900 1.059 possible 6491 254 H ALA O 16 O1H0u 0.660 1.420 5.569 55.039 16.188 3.400 possible 6492 254 H ALA CB 10 C4H3u 0.770 1.880 5.164 79.380 36.782 2.158 possible 6493 255 H MET N 12 N3H1s 0.700 1.640 3.365 14.326 13.564 1.056 possible 6494 255 H MET CA 3 C4H1s 0.770 1.880 6.517 22.623 13.231 1.710 possible 6495 255 H MET C 1 C3H0s 0.770 1.610 5.599 14.575 8.782 1.660 possible 6496 255 H MET O 16 O1H0u 0.660 1.420 15.129 -1.000 16.277 -1.000 bad 6497 255 H MET CB 8 C4H2s 0.770 1.880 6.311 38.456 23.645 1.626 possible 6498 255 H MET CG 9 C4H2b 0.770 1.880 29.087 -1.000 24.009 -1.000 bad 6499 255 H MET SD 19 S2H0u 1.040 1.770 33.328 -1.000 30.093 -1.000 bad 6500 255 H MET CE 10 C4H3u 0.770 1.880 69.031 -1.000 37.161 -1.000 bad 6501 256 H LEU N 12 N3H1s 0.700 1.640 5.961 21.129 13.655 1.547 possible 6502 256 H LEU CA 3 C4H1s 0.770 1.880 4.764 18.388 13.122 1.401 possible 6503 256 H LEU C 1 C3H0s 0.770 1.610 4.741 10.970 8.825 1.243 possible 6504 256 H LEU O 16 O1H0u 0.660 1.420 45.562 -1.000 16.208 -1.000 bad 6505 256 H LEU CB 8 C4H2s 0.770 1.880 3.742 23.826 22.951 1.038 possible 6506 256 H LEU CG 4 C4H1b 0.770 1.880 11.343 -1.000 14.764 -1.000 bad 6507 256 H LEU CD1 10 C4H3u 0.770 1.880 56.574 -1.000 37.425 -1.000 bad 6508 256 H LEU CD2 10 C4H3u 0.770 1.880 50.375 -1.000 37.143 -1.000 bad 6509 256 H LEU OXT 16 O1H0u 0.660 1.420 32.824 -1.000 1.420 -1.000 bad 6511 1 c BCL MG c o 25 DEFAULT 0.770 1.800 2.973 15.716 1.800 8.731 [OK] 6512 1 c BCL CHA 9 C4H2b 0.770 1.880 3.053 11.784 1.880 6.268 possible 6513 1 c BCL CHB 9 C4H2b 0.770 1.880 3.895 23.791 1.880 12.655 possible 6514 1 c BCL CHC 9 C4H2b 0.770 1.880 2.835 18.603 1.880 9.895 [OK] 6515 1 c BCL CHD 9 C4H2b 0.770 1.880 3.060 22.965 1.880 12.215 possible 6516 1 c BCL N A 14 N4H3u 0.700 1.640 2.594 11.275 1.640 6.875 [OK] 6517 1 c BCL C1A 9 C4H2b 0.770 1.880 2.853 11.003 1.880 5.853 [OK] 6518 1 c BCL C2A 9 C4H2b 0.770 1.880 5.161 18.362 1.880 9.767 possible 6519 1 c BCL C3A 9 C4H2b 0.770 1.880 4.617 20.396 1.880 10.849 possible 6520 1 c BCL C4A 9 C4H2b 0.770 1.880 2.796 10.769 1.880 5.728 [OK] 6521 1 c BCL CMA 9 C4H2b 0.770 1.880 27.747 -1.000 1.880 -1.000 bad 6522 1 c BCL CAA 9 C4H2b 0.770 1.880 12.903 -1.000 1.880 -1.000 bad 6523 1 c BCL CBA 9 C4H2b 0.770 1.880 3.097 22.679 1.880 12.063 possible 6524 1 c BCL CGA 9 C4H2b 0.770 1.880 3.685 11.383 1.880 6.055 possible 6525 1 c BCL O1A 17 O2H1u 0.660 1.460 3.622 20.073 1.460 13.749 possible 6526 1 c BCL O2A 17 O2H1u 0.660 1.460 3.953 15.872 1.460 10.871 possible 6527 1 c BCL N B 14 N4H3u 0.700 1.640 2.719 11.054 1.640 6.740 [OK] 6528 1 c BCL C1B 9 C4H2b 0.770 1.880 2.617 9.942 1.880 5.288 [OK] 6529 1 c BCL C2B 9 C4H2b 0.770 1.880 2.882 11.170 1.880 5.942 [OK] 6530 1 c BCL C3B 9 C4H2b 0.770 1.880 2.750 10.608 1.880 5.643 [OK] 6531 1 c BCL C4B 9 C4H2b 0.770 1.880 2.692 10.538 1.880 5.605 [OK] 6532 1 c BCL CMB 9 C4H2b 0.770 1.880 4.155 46.599 1.880 24.787 possible 6533 1 c BCL CAB 9 C4H2b 0.770 1.880 2.824 10.403 1.880 5.534 [OK] 6534 1 c BCL OBB 17 O2H1u 0.660 1.460 2.792 20.231 1.460 13.857 [OK] 6535 1 c BCL CBB 9 C4H2b 0.770 1.880 3.008 29.755 1.880 15.827 possible 6536 1 c BCL N C 14 N4H3u 0.700 1.640 2.833 11.409 1.640 6.956 [OK] 6537 1 c BCL C1C 9 C4H2b 0.770 1.880 2.708 10.521 1.880 5.596 [OK] 6538 1 c BCL C2C 9 C4H2b 0.770 1.880 2.887 14.428 1.880 7.675 [OK] 6539 1 c BCL C3C 9 C4H2b 0.770 1.880 3.087 13.296 1.880 7.072 possible 6540 1 c BCL C4C 9 C4H2b 0.770 1.880 2.917 11.080 1.880 5.894 [OK] 6541 1 c BCL CMC 9 C4H2b 0.770 1.880 3.124 37.421 1.880 19.905 possible 6542 1 c BCL CAC 9 C4H2b 0.770 1.880 3.045 21.709 1.880 11.547 possible 6543 1 c BCL CBC 9 C4H2b 0.770 1.880 3.047 35.789 1.880 19.037 possible 6544 1 c BCL N D 14 N4H3u 0.700 1.640 2.462 10.918 1.640 6.657 [OK] 6545 1 c BCL C1D 9 C4H2b 0.770 1.880 2.905 11.601 1.880 6.171 [OK] 6546 1 c BCL C2D 9 C4H2b 0.770 1.880 2.863 11.455 1.880 6.093 [OK] 6547 1 c BCL C3D 9 C4H2b 0.770 1.880 2.531 11.250 1.880 5.984 [OK] 6548 1 c BCL C4D 9 C4H2b 0.770 1.880 2.703 11.160 1.880 5.936 [OK] 6549 1 c BCL CMD 9 C4H2b 0.770 1.880 3.060 33.204 1.880 17.662 possible 6550 1 c BCL CAD 9 C4H2b 0.770 1.880 2.522 9.699 1.880 5.159 [OK] 6551 1 c BCL OBD 17 O2H1u 0.660 1.460 2.543 17.379 1.460 11.903 [OK] 6552 1 c BCL CBD 9 C4H2b 0.770 1.880 3.097 16.904 1.880 8.991 possible 6553 1 c BCL CGD 9 C4H2b 0.770 1.880 2.707 9.241 1.880 4.916 [OK] 6554 1 c BCL O1D 17 O2H1u 0.660 1.460 5.922 48.774 1.460 33.407 possible 6555 1 c BCL O2D 17 O2H1u 0.660 1.460 2.543 13.485 1.460 9.236 [OK] 6556 1 c BCL CED 9 C4H2b 0.770 1.880 5.126 52.455 1.880 27.902 possible 6557 1 c BCL C1 9 C4H2b 0.770 1.880 3.222 24.494 1.880 13.029 possible 6558 1 c BCL C2 9 C4H2b 0.770 1.880 5.295 40.552 1.880 21.570 possible 6559 1 c BCL C3 9 C4H2b 0.770 1.880 4.545 16.173 1.880 8.603 possible 6560 1 c BCL C4 9 C4H2b 0.770 1.880 3.322 35.446 1.880 18.854 possible 6561 1 c BCL C5 9 C4H2b 0.770 1.880 40.177 -1.000 1.880 -1.000 bad 6562 2 c BCL MG c ¢ 25 DEFAULT 0.770 1.800 2.219 12.989 1.800 7.216 [OK] 6563 2 c BCL CHA 9 C4H2b 0.770 1.880 3.004 12.224 1.880 6.502 possible 6564 2 c BCL CHB 9 C4H2b 0.770 1.880 3.293 20.636 1.880 10.976 possible 6565 2 c BCL CHC 9 C4H2b 0.770 1.880 2.494 16.554 1.880 8.805 [OK] 6566 2 c BCL CHD 9 C4H2b 0.770 1.880 2.722 18.472 1.880 9.826 [OK] 6567 2 c BCL N A 14 N4H3u 0.700 1.640 2.340 10.289 1.640 6.274 [OK] 6568 2 c BCL C1A 9 C4H2b 0.770 1.880 3.012 11.927 1.880 6.344 possible 6569 2 c BCL C2A 9 C4H2b 0.770 1.880 2.972 13.249 1.880 7.047 [OK] 6570 2 c BCL C3A 9 C4H2b 0.770 1.880 3.390 16.275 1.880 8.657 possible 6571 2 c BCL C4A 9 C4H2b 0.770 1.880 2.718 10.863 1.880 5.778 [OK] 6572 2 c BCL CMA 9 C4H2b 0.770 1.880 3.157 33.470 1.880 17.803 possible 6573 2 c BCL CAA 9 C4H2b 0.770 1.880 2.869 19.695 1.880 10.476 [OK] 6574 2 c BCL CBA 9 C4H2b 0.770 1.880 3.068 23.110 1.880 12.293 possible 6575 2 c BCL CGA 9 C4H2b 0.770 1.880 2.840 10.107 1.880 5.376 [OK] 6576 2 c BCL O1A 17 O2H1u 0.660 1.460 2.568 15.937 1.460 10.916 [OK] 6577 2 c BCL O2A 17 O2H1u 0.660 1.460 2.849 18.626 1.460 12.758 [OK] 6578 2 c BCL N B 14 N4H3u 0.700 1.640 2.119 9.333 1.640 5.691 [OK] 6579 2 c BCL C1B 9 C4H2b 0.770 1.880 2.325 9.426 1.880 5.014 [OK] 6580 2 c BCL C2B 9 C4H2b 0.770 1.880 2.471 10.081 1.880 5.362 [OK] 6581 2 c BCL C3B 9 C4H2b 0.770 1.880 2.660 10.569 1.880 5.622 [OK] 6582 2 c BCL C4B 9 C4H2b 0.770 1.880 2.672 10.292 1.880 5.474 [OK] 6583 2 c BCL CMB 9 C4H2b 0.770 1.880 3.293 35.695 1.880 18.987 possible 6584 2 c BCL CAB 9 C4H2b 0.770 1.880 2.423 9.653 1.880 5.134 [OK] 6585 2 c BCL OBB 17 O2H1u 0.660 1.460 2.284 15.262 1.460 10.453 [OK] 6586 2 c BCL CBB 9 C4H2b 0.770 1.880 2.870 33.458 1.880 17.797 [OK] 6587 2 c BCL N C 14 N4H3u 0.700 1.640 2.593 10.499 1.640 6.402 [OK] 6588 2 c BCL C1C 9 C4H2b 0.770 1.880 2.789 10.796 1.880 5.742 [OK] 6589 2 c BCL C2C 9 C4H2b 0.770 1.880 2.611 12.436 1.880 6.615 [OK] 6590 2 c BCL C3C 9 C4H2b 0.770 1.880 2.425 12.591 1.880 6.697 [OK] 6591 2 c BCL C4C 9 C4H2b 0.770 1.880 2.500 10.419 1.880 5.542 [OK] 6592 2 c BCL CMC 9 C4H2b 0.770 1.880 3.176 32.530 1.880 17.303 possible 6593 2 c BCL CAC 9 C4H2b 0.770 1.880 2.756 23.654 1.880 12.582 [OK] 6594 2 c BCL CBC 9 C4H2b 0.770 1.880 2.954 36.253 1.880 19.284 [OK] 6595 2 c BCL N D 14 N4H3u 0.700 1.640 2.557 11.322 1.640 6.904 [OK] 6596 2 c BCL C1D 9 C4H2b 0.770 1.880 2.423 9.960 1.880 5.298 [OK] 6597 2 c BCL C2D 9 C4H2b 0.770 1.880 2.674 11.217 1.880 5.966 [OK] 6598 2 c BCL C3D 9 C4H2b 0.770 1.880 2.941 13.671 1.880 7.272 [OK] 6599 2 c BCL C4D 9 C4H2b 0.770 1.880 3.135 12.985 1.880 6.907 possible 6600 2 c BCL CMD 9 C4H2b 0.770 1.880 3.073 36.559 1.880 19.446 possible 6601 2 c BCL CAD 9 C4H2b 0.770 1.880 2.822 10.669 1.880 5.675 [OK] 6602 2 c BCL OBD 17 O2H1u 0.660 1.460 2.471 19.051 1.460 13.049 [OK] 6603 2 c BCL CBD 9 C4H2b 0.770 1.880 2.551 12.363 1.880 6.576 [OK] 6604 2 c BCL CGD 9 C4H2b 0.770 1.880 2.259 8.789 1.880 4.675 [OK] 6605 2 c BCL O1D 17 O2H1u 0.660 1.460 2.666 17.340 1.460 11.876 [OK] 6606 2 c BCL O2D 17 O2H1u 0.660 1.460 2.508 12.324 1.460 8.441 [OK] 6607 2 c BCL CED 9 C4H2b 0.770 1.880 3.035 37.628 1.880 20.015 possible 6608 2 c BCL C1 9 C4H2b 0.770 1.880 3.015 23.369 1.880 12.431 possible 6609 2 c BCL C2 9 C4H2b 0.770 1.880 3.017 26.603 1.880 14.150 possible 6610 2 c BCL C3 9 C4H2b 0.770 1.880 2.940 12.890 1.880 6.856 [OK] 6611 2 c BCL C4 9 C4H2b 0.770 1.880 3.198 37.966 1.880 20.195 possible 6612 2 c BCL C5 9 C4H2b 0.770 1.880 2.855 21.525 1.880 11.450 [OK] 6613 2 c BCL C6 9 C4H2b 0.770 1.880 2.727 21.341 1.880 11.352 [OK] 6614 2 c BCL C7 9 C4H2b 0.770 1.880 3.075 21.796 1.880 11.594 possible 6615 2 c BCL C8 9 C4H2b 0.770 1.880 2.839 14.128 1.880 7.515 [OK] 6616 2 c BCL C9 9 C4H2b 0.770 1.880 3.225 33.648 1.880 17.898 possible 6617 2 c BCL C10 9 C4H2b 0.770 1.880 3.141 24.271 1.880 12.910 possible 6618 2 c BCL C11 9 C4H2b 0.770 1.880 2.806 20.518 1.880 10.914 [OK] 6619 2 c BCL C12 9 C4H2b 0.770 1.880 2.844 19.903 1.880 10.587 [OK] 6620 2 c BCL C13 9 C4H2b 0.770 1.880 2.909 14.722 1.880 7.831 [OK] 6621 2 c BCL C14 9 C4H2b 0.770 1.880 2.876 36.777 1.880 19.562 [OK] 6622 2 c BCL C15 9 C4H2b 0.770 1.880 2.876 23.134 1.880 12.305 [OK] 6623 2 c BCL C16 9 C4H2b 0.770 1.880 2.963 24.370 1.880 12.963 [OK] 6624 2 c BCL C17 9 C4H2b 0.770 1.880 3.288 31.030 1.880 16.506 possible 6625 2 c BCL C18 9 C4H2b 0.770 1.880 3.889 18.449 1.880 9.813 possible 6626 2 c BCL C19 9 C4H2b 0.770 1.880 7.534 64.233 1.880 34.167 possible 6627 2 c BCL C20 9 C4H2b 0.770 1.880 43.414 -1.000 1.880 -1.000 bad 6628 3 c BCL MG c 25 DEFAULT 0.770 1.800 2.257 12.897 1.800 7.165 [OK] 6629 3 c BCL CHA 9 C4H2b 0.770 1.880 2.498 10.190 1.880 5.420 [OK] 6630 3 c BCL CHB 9 C4H2b 0.770 1.880 2.901 18.167 1.880 9.663 [OK] 6631 3 c BCL CHC 9 C4H2b 0.770 1.880 2.711 16.590 1.880 8.825 [OK] 6632 3 c BCL CHD 9 C4H2b 0.770 1.880 2.877 20.154 1.880 10.720 [OK] 6633 3 c BCL N A 14 N4H3u 0.700 1.640 2.646 10.682 1.640 6.514 [OK] 6634 3 c BCL C1A 9 C4H2b 0.770 1.880 2.933 11.675 1.880 6.210 [OK] 6635 3 c BCL C2A 9 C4H2b 0.770 1.880 2.811 13.505 1.880 7.183 [OK] 6636 3 c BCL C3A 9 C4H2b 0.770 1.880 2.876 14.040 1.880 7.468 [OK] 6637 3 c BCL C4A 9 C4H2b 0.770 1.880 2.889 11.481 1.880 6.107 [OK] 6638 3 c BCL CMA 9 C4H2b 0.770 1.880 3.055 30.503 1.880 16.225 possible 6639 3 c BCL CAA 9 C4H2b 0.770 1.880 2.847 21.099 1.880 11.223 [OK] 6640 3 c BCL CBA 9 C4H2b 0.770 1.880 3.200 25.808 1.880 13.727 possible 6641 3 c BCL CGA 9 C4H2b 0.770 1.880 2.526 10.141 1.880 5.394 [OK] 6642 3 c BCL O1A 17 O2H1u 0.660 1.460 2.569 21.476 1.460 14.709 [OK] 6643 3 c BCL O2A 17 O2H1u 0.660 1.460 2.308 11.701 1.460 8.015 [OK] 6644 3 c BCL N B 14 N4H3u 0.700 1.640 2.265 9.715 1.640 5.924 [OK] 6645 3 c BCL C1B 9 C4H2b 0.770 1.880 2.467 9.381 1.880 4.990 [OK] 6646 3 c BCL C2B 9 C4H2b 0.770 1.880 2.512 10.262 1.880 5.459 [OK] 6647 3 c BCL C3B 9 C4H2b 0.770 1.880 2.558 10.594 1.880 5.635 [OK] 6648 3 c BCL C4B 9 C4H2b 0.770 1.880 2.545 10.162 1.880 5.405 [OK] 6649 3 c BCL CMB 9 C4H2b 0.770 1.880 3.339 35.554 1.880 18.912 possible 6650 3 c BCL CAB 9 C4H2b 0.770 1.880 2.422 9.795 1.880 5.210 [OK] 6651 3 c BCL OBB 17 O2H1u 0.660 1.460 2.656 19.050 1.460 13.048 [OK] 6652 3 c BCL CBB 9 C4H2b 0.770 1.880 2.768 27.500 1.880 14.628 [OK] 6653 3 c BCL N C 14 N4H3u 0.700 1.640 2.590 10.335 1.640 6.302 [OK] 6654 3 c BCL C1C 9 C4H2b 0.770 1.880 2.614 10.298 1.880 5.477 [OK] 6655 3 c BCL C2C 9 C4H2b 0.770 1.880 2.643 12.357 1.880 6.573 [OK] 6656 3 c BCL C3C 9 C4H2b 0.770 1.880 2.605 12.767 1.880 6.791 [OK] 6657 3 c BCL C4C 9 C4H2b 0.770 1.880 2.744 11.581 1.880 6.160 [OK] 6658 3 c BCL CMC 9 C4H2b 0.770 1.880 2.978 36.196 1.880 19.253 [OK] 6659 3 c BCL CAC 9 C4H2b 0.770 1.880 2.585 23.035 1.880 12.252 [OK] 6660 3 c BCL CBC 9 C4H2b 0.770 1.880 3.034 34.228 1.880 18.207 possible 6661 3 c BCL N D 14 N4H3u 0.700 1.640 2.453 10.730 1.640 6.543 [OK] 6662 3 c BCL C1D 9 C4H2b 0.770 1.880 2.587 9.856 1.880 5.242 [OK] 6663 3 c BCL C2D 9 C4H2b 0.770 1.880 2.592 10.510 1.880 5.591 [OK] 6664 3 c BCL C3D 9 C4H2b 0.770 1.880 2.786 11.888 1.880 6.323 [OK] 6665 3 c BCL C4D 9 C4H2b 0.770 1.880 2.641 10.549 1.880 5.611 [OK] 6666 3 c BCL CMD 9 C4H2b 0.770 1.880 3.232 36.869 1.880 19.611 possible 6667 3 c BCL CAD 9 C4H2b 0.770 1.880 2.279 8.935 1.880 4.753 [OK] 6668 3 c BCL OBD 17 O2H1u 0.660 1.460 2.839 21.022 1.460 14.399 [OK] 6669 3 c BCL CBD 9 C4H2b 0.770 1.880 2.933 14.054 1.880 7.475 [OK] 6670 3 c BCL CGD 9 C4H2b 0.770 1.880 2.471 8.933 1.880 4.751 [OK] 6671 3 c BCL O1D 17 O2H1u 0.660 1.460 2.735 18.484 1.460 12.660 [OK] 6672 3 c BCL O2D 17 O2H1u 0.660 1.460 2.472 11.768 1.460 8.060 [OK] 6673 3 c BCL CED 9 C4H2b 0.770 1.880 3.253 38.072 1.880 20.251 possible 6674 3 c BCL C1 9 C4H2b 0.770 1.880 3.004 22.168 1.880 11.792 possible 6675 3 c BCL C2 9 C4H2b 0.770 1.880 2.732 18.954 1.880 10.082 [OK] 6676 3 c BCL C3 9 C4H2b 0.770 1.880 2.600 10.615 1.880 5.646 [OK] 6677 3 c BCL C4 9 C4H2b 0.770 1.880 3.094 32.560 1.880 17.319 possible 6678 3 c BCL C5 9 C4H2b 0.770 1.880 2.960 25.610 1.880 13.622 [OK] 6679 3 c BCL C6 9 C4H2b 0.770 1.880 2.924 22.029 1.880 11.718 [OK] 6680 3 c BCL C7 9 C4H2b 0.770 1.880 3.240 23.144 1.880 12.310 possible 6681 3 c BCL C8 9 C4H2b 0.770 1.880 2.836 14.257 1.880 7.583 [OK] 6682 3 c BCL C9 9 C4H2b 0.770 1.880 3.224 38.957 1.880 20.722 possible 6683 3 c BCL C10 9 C4H2b 0.770 1.880 2.971 22.463 1.880 11.948 [OK] 6684 3 c BCL C11 9 C4H2b 0.770 1.880 3.144 28.511 1.880 15.165 possible 6685 3 c BCL C12 9 C4H2b 0.770 1.880 2.741 20.988 1.880 11.164 [OK] 6686 3 c BCL C13 9 C4H2b 0.770 1.880 3.192 16.336 1.880 8.689 possible 6687 3 c BCL C14 9 C4H2b 0.770 1.880 3.494 42.462 1.880 22.586 possible 6688 3 c BCL C15 9 C4H2b 0.770 1.880 4.402 31.372 1.880 16.687 possible 6689 3 c BCL C16 9 C4H2b 0.770 1.880 5.724 47.665 1.880 25.354 possible 6690 3 c BCL C17 9 C4H2b 0.770 1.880 3.936 28.081 1.880 14.937 possible 6691 3 c BCL C18 9 C4H2b 0.770 1.880 7.461 46.566 1.880 24.769 possible 6692 3 c BCL C19 9 C4H2b 0.770 1.880 23.104 -1.000 1.880 -1.000 bad 6693 3 c BCL C20 9 C4H2b 0.770 1.880 25.979 -1.000 1.880 -1.000 bad 6694 4 c BCL MG c 25 DEFAULT 0.770 1.800 2.725 14.973 1.800 8.319 [OK] 6695 4 c BCL CHA 9 C4H2b 0.770 1.880 2.901 11.241 1.880 5.979 [OK] 6696 4 c BCL CHB 9 C4H2b 0.770 1.880 2.771 19.875 1.880 10.572 [OK] 6697 4 c BCL CHC 9 C4H2b 0.770 1.880 3.016 20.874 1.880 11.103 possible 6698 4 c BCL CHD 9 C4H2b 0.770 1.880 3.160 21.669 1.880 11.526 possible 6699 4 c BCL N A 14 N4H3u 0.700 1.640 2.608 11.135 1.640 6.790 [OK] 6700 4 c BCL C1A 9 C4H2b 0.770 1.880 2.902 10.641 1.880 5.660 [OK] 6701 4 c BCL C2A 9 C4H2b 0.770 1.880 5.359 18.542 1.880 9.863 possible 6702 4 c BCL C3A 9 C4H2b 0.770 1.880 2.846 13.704 1.880 7.289 [OK] 6703 4 c BCL C4A 9 C4H2b 0.770 1.880 2.633 10.826 1.880 5.758 [OK] 6704 4 c BCL CMA 9 C4H2b 0.770 1.880 7.194 71.868 1.880 38.228 possible 6705 4 c BCL CAA 9 C4H2b 0.770 1.880 6.109 43.383 1.880 23.076 possible 6706 4 c BCL CBA 9 C4H2b 0.770 1.880 2.982 23.327 1.880 12.408 [OK] 6707 4 c BCL CGA 9 C4H2b 0.770 1.880 2.772 11.407 1.880 6.068 [OK] 6708 4 c BCL O1A 17 O2H1u 0.660 1.460 3.901 22.056 1.460 15.107 possible 6709 4 c BCL O2A 17 O2H1u 0.660 1.460 2.399 12.279 1.460 8.410 [OK] 6710 4 c BCL N B 14 N4H3u 0.700 1.640 2.343 10.726 1.640 6.540 [OK] 6711 4 c BCL C1B 9 C4H2b 0.770 1.880 2.512 9.780 1.880 5.202 [OK] 6712 4 c BCL C2B 9 C4H2b 0.770 1.880 2.826 11.614 1.880 6.178 [OK] 6713 4 c BCL C3B 9 C4H2b 0.770 1.880 2.850 11.862 1.880 6.310 [OK] 6714 4 c BCL C4B 9 C4H2b 0.770 1.880 2.631 11.078 1.880 5.892 [OK] 6715 4 c BCL CMB 9 C4H2b 0.770 1.880 2.833 31.873 1.880 16.954 [OK] 6716 4 c BCL CAB 9 C4H2b 0.770 1.880 2.898 12.273 1.880 6.528 [OK] 6717 4 c BCL OBB 17 O2H1u 0.660 1.460 2.737 18.695 1.460 12.805 [OK] 6718 4 c BCL CBB 9 C4H2b 0.770 1.880 3.012 35.472 1.880 18.868 possible 6719 4 c BCL N C 14 N4H3u 0.700 1.640 2.633 10.654 1.640 6.496 [OK] 6720 4 c BCL C1C 9 C4H2b 0.770 1.880 2.860 10.756 1.880 5.721 [OK] 6721 4 c BCL C2C 9 C4H2b 0.770 1.880 2.953 13.587 1.880 7.227 [OK] 6722 4 c BCL C3C 9 C4H2b 0.770 1.880 2.926 14.908 1.880 7.930 [OK] 6723 4 c BCL C4C 9 C4H2b 0.770 1.880 2.779 10.591 1.880 5.633 [OK] 6724 4 c BCL CMC 9 C4H2b 0.770 1.880 3.150 34.671 1.880 18.442 possible 6725 4 c BCL CAC 9 C4H2b 0.770 1.880 3.183 25.950 1.880 13.803 possible 6726 4 c BCL CBC 9 C4H2b 0.770 1.880 3.223 35.297 1.880 18.775 possible 6727 4 c BCL N D 14 N4H3u 0.700 1.640 2.567 10.698 1.640 6.523 [OK] 6728 4 c BCL C1D 9 C4H2b 0.770 1.880 2.565 10.326 1.880 5.493 [OK] 6729 4 c BCL C2D 9 C4H2b 0.770 1.880 2.580 10.671 1.880 5.676 [OK] 6730 4 c BCL C3D 9 C4H2b 0.770 1.880 2.680 10.927 1.880 5.812 [OK] 6731 4 c BCL C4D 9 C4H2b 0.770 1.880 2.685 10.691 1.880 5.687 [OK] 6732 4 c BCL CMD 9 C4H2b 0.770 1.880 3.018 36.102 1.880 19.203 possible 6733 4 c BCL CAD 9 C4H2b 0.770 1.880 2.567 9.778 1.880 5.201 [OK] 6734 4 c BCL OBD 17 O2H1u 0.660 1.460 2.683 19.017 1.460 13.026 [OK] 6735 4 c BCL CBD 9 C4H2b 0.770 1.880 3.041 17.040 1.880 9.064 possible 6736 4 c BCL CGD 9 C4H2b 0.770 1.880 2.958 9.847 1.880 5.238 [OK] 6737 4 c BCL O1D 17 O2H1u 0.660 1.460 4.923 55.394 1.460 37.941 possible 6738 4 c BCL O2D 17 O2H1u 0.660 1.460 2.903 13.936 1.460 9.545 [OK] 6739 4 c BCL CED 9 C4H2b 0.770 1.880 5.472 52.864 1.880 28.119 possible 6740 4 c BCL C1 9 C4H2b 0.770 1.880 3.149 22.080 1.880 11.745 possible 6741 4 c BCL C2 9 C4H2b 0.770 1.880 3.083 21.130 1.880 11.239 possible 6742 4 c BCL C3 9 C4H2b 0.770 1.880 2.567 10.487 1.880 5.578 [OK] 6743 4 c BCL C4 9 C4H2b 0.770 1.880 4.281 53.501 1.880 28.458 possible 6744 4 c BCL C5 9 C4H2b 0.770 1.880 2.939 23.417 1.880 12.456 [OK] 6745 4 c BCL C6 9 C4H2b 0.770 1.880 4.050 29.951 1.880 15.931 possible 6746 4 c BCL C7 9 C4H2b 0.770 1.880 2.963 21.807 1.880 11.599 [OK] 6747 4 c BCL C8 9 C4H2b 0.770 1.880 5.560 21.824 1.880 11.609 possible 6748 4 c BCL C9 9 C4H2b 0.770 1.880 31.510 -1.000 1.880 -1.000 bad 6749 4 c BCL C10 9 C4H2b 0.770 1.880 2.951 23.225 1.880 12.353 [OK] 6750 4 c BCL C11 9 C4H2b 0.770 1.880 8.728 -1.000 1.880 -1.000 bad 6751 4 c BCL C12 9 C4H2b 0.770 1.880 2.799 21.649 1.880 11.515 [OK] 6752 4 c BCL C13 9 C4H2b 0.770 1.880 3.807 17.340 1.880 9.223 possible 6753 4 c BCL C14 9 C4H2b 0.770 1.880 30.787 -1.000 1.880 -1.000 bad 6754 4 c BCL C15 9 C4H2b 0.770 1.880 3.434 22.629 1.880 12.037 possible 6755 4 c BCL C16 9 C4H2b 0.770 1.880 5.386 40.428 1.880 21.504 possible 6756 4 c BCL C17 9 C4H2b 0.770 1.880 2.917 25.669 1.880 13.654 [OK] 6757 4 c BCL C18 9 C4H2b 0.770 1.880 3.117 15.920 1.880 8.468 possible 6758 4 c BCL C19 9 C4H2b 0.770 1.880 5.058 48.732 1.880 25.922 possible 6759 4 c BCL C20 9 C4H2b 0.770 1.880 37.941 -1.000 1.880 -1.000 bad 6760 5 c BPH CHA 9 C4H2b 0.770 1.880 2.556 10.014 1.880 5.327 [OK] 6761 5 c BPH CHB 9 C4H2b 0.770 1.880 2.897 18.007 1.880 9.578 [OK] 6762 5 c BPH CHC 9 C4H2b 0.770 1.880 3.241 19.186 1.880 10.205 possible 6763 5 c BPH CHD 9 C4H2b 0.770 1.880 2.920 21.179 1.880 11.265 [OK] 6764 5 c BPH N A 14 N4H3u 0.700 1.640 2.913 17.316 1.640 10.558 [OK] 6765 5 c BPH C1A 9 C4H2b 0.770 1.880 3.155 11.836 1.880 6.296 possible 6766 5 c BPH C2A 9 C4H2b 0.770 1.880 3.663 14.533 1.880 7.731 possible 6767 5 c BPH C3A 9 C4H2b 0.770 1.880 2.700 13.481 1.880 7.171 [OK] 6768 5 c BPH C4A 9 C4H2b 0.770 1.880 2.841 11.453 1.880 6.092 [OK] 6769 5 c BPH CMA 9 C4H2b 0.770 1.880 3.628 40.808 1.880 21.706 possible 6770 5 c BPH CAA 9 C4H2b 0.770 1.880 2.987 22.602 1.880 12.022 [OK] 6771 5 c BPH CBA 9 C4H2b 0.770 1.880 3.765 30.588 1.880 16.270 possible 6772 5 c BPH CGA 9 C4H2b 0.770 1.880 2.741 10.689 1.880 5.685 [OK] 6773 5 c BPH O1A 17 O2H1u 0.660 1.460 2.566 19.888 1.460 13.622 [OK] 6774 5 c BPH O2A 17 O2H1u 0.660 1.460 3.086 14.143 1.460 9.687 possible 6775 5 c BPH N B 14 N4H3u 0.700 1.640 2.831 15.883 1.640 9.685 [OK] 6776 5 c BPH C1B 9 C4H2b 0.770 1.880 2.643 10.118 1.880 5.382 [OK] 6777 5 c BPH C2B 9 C4H2b 0.770 1.880 2.910 11.543 1.880 6.140 [OK] 6778 5 c BPH C3B 9 C4H2b 0.770 1.880 2.682 10.351 1.880 5.506 [OK] 6779 5 c BPH C4B 9 C4H2b 0.770 1.880 3.119 11.253 1.880 5.986 possible 6780 5 c BPH CMB 9 C4H2b 0.770 1.880 4.531 45.697 1.880 24.307 possible 6781 5 c BPH CAB 9 C4H2b 0.770 1.880 2.300 9.881 1.880 5.256 [OK] 6782 5 c BPH OBB 17 O2H1u 0.660 1.460 2.803 17.273 1.460 11.831 [OK] 6783 5 c BPH CBB 9 C4H2b 0.770 1.880 3.061 32.901 1.880 17.500 possible 6784 5 c BPH N C 14 N4H3u 0.700 1.640 2.781 14.335 1.640 8.741 [OK] 6785 5 c BPH C1C 9 C4H2b 0.770 1.880 2.858 11.705 1.880 6.226 [OK] 6786 5 c BPH C2C 9 C4H2b 0.770 1.880 2.983 15.099 1.880 8.031 [OK] 6787 5 c BPH C3C 9 C4H2b 0.770 1.880 2.889 14.034 1.880 7.465 [OK] 6788 5 c BPH C4C 9 C4H2b 0.770 1.880 2.342 9.928 1.880 5.281 [OK] 6789 5 c BPH CMC 9 C4H2b 0.770 1.880 3.087 35.066 1.880 18.652 possible 6790 5 c BPH CAC 9 C4H2b 0.770 1.880 3.088 22.574 1.880 12.008 possible 6791 5 c BPH CBC 9 C4H2b 0.770 1.880 3.088 38.970 1.880 20.729 possible 6792 5 c BPH N D 14 N4H3u 0.700 1.640 2.938 14.621 1.640 8.915 [OK] 6793 5 c BPH C1D 9 C4H2b 0.770 1.880 2.858 10.590 1.880 5.633 [OK] 6794 5 c BPH C2D 9 C4H2b 0.770 1.880 2.906 11.107 1.880 5.908 [OK] 6795 5 c BPH C3D 9 C4H2b 0.770 1.880 2.608 10.894 1.880 5.795 [OK] 6796 5 c BPH C4D 9 C4H2b 0.770 1.880 2.568 10.025 1.880 5.332 [OK] 6797 5 c BPH CMD 9 C4H2b 0.770 1.880 3.130 34.954 1.880 18.592 possible 6798 5 c BPH CAD 9 C4H2b 0.770 1.880 2.302 9.260 1.880 4.926 [OK] 6799 5 c BPH OBD 17 O2H1u 0.660 1.460 2.708 20.090 1.460 13.760 [OK] 6800 5 c BPH CBD 9 C4H2b 0.770 1.880 2.643 14.159 1.880 7.531 [OK] 6801 5 c BPH CGD 9 C4H2b 0.770 1.880 2.991 9.327 1.880 4.961 [OK] 6802 5 c BPH O1D 17 O2H1u 0.660 1.460 3.191 21.354 1.460 14.626 possible 6803 5 c BPH O2D 17 O2H1u 0.660 1.460 2.819 14.101 1.460 9.658 [OK] 6804 5 c BPH CED 9 C4H2b 0.770 1.880 3.641 46.212 1.880 24.581 possible 6805 5 c BPH C1 9 C4H2b 0.770 1.880 2.990 24.399 1.880 12.978 [OK] 6806 5 c BPH C2 9 C4H2b 0.770 1.880 3.488 26.377 1.880 14.030 possible 6807 5 c BPH C3 9 C4H2b 0.770 1.880 2.982 12.536 1.880 6.668 [OK] 6808 5 c BPH C4 9 C4H2b 0.770 1.880 4.600 46.080 1.880 24.510 possible 6809 5 c BPH C5 9 C4H2b 0.770 1.880 3.897 32.894 1.880 17.497 possible 6810 5 c BPH C6 9 C4H2b 0.770 1.880 28.297 -1.000 1.880 -1.000 bad 6811 6 c BPH CHA 9 C4H2b 0.770 1.880 2.427 9.872 1.880 5.251 [OK] 6812 6 c BPH CHB 9 C4H2b 0.770 1.880 2.963 19.691 1.880 10.474 [OK] 6813 6 c BPH CHC 9 C4H2b 0.770 1.880 3.160 20.962 1.880 11.150 possible 6814 6 c BPH CHD 9 C4H2b 0.770 1.880 3.021 21.036 1.880 11.189 possible 6815 6 c BPH N A 14 N4H3u 0.700 1.640 2.859 16.276 1.640 9.924 [OK] 6816 6 c BPH C1A 9 C4H2b 0.770 1.880 2.965 10.991 1.880 5.846 [OK] 6817 6 c BPH C2A 9 C4H2b 0.770 1.880 2.802 13.219 1.880 7.031 [OK] 6818 6 c BPH C3A 9 C4H2b 0.770 1.880 2.614 12.381 1.880 6.585 [OK] 6819 6 c BPH C4A 9 C4H2b 0.770 1.880 2.830 11.399 1.880 6.063 [OK] 6820 6 c BPH CMA 9 C4H2b 0.770 1.880 3.111 40.114 1.880 21.337 possible 6821 6 c BPH CAA 9 C4H2b 0.770 1.880 2.757 20.449 1.880 10.877 [OK] 6822 6 c BPH CBA 9 C4H2b 0.770 1.880 2.956 23.923 1.880 12.725 [OK] 6823 6 c BPH CGA 9 C4H2b 0.770 1.880 2.602 10.364 1.880 5.513 [OK] 6824 6 c BPH O1A 17 O2H1u 0.660 1.460 2.420 18.285 1.460 12.524 [OK] 6825 6 c BPH O2A 17 O2H1u 0.660 1.460 2.760 14.750 1.460 10.103 [OK] 6826 6 c BPH N B 14 N4H3u 0.700 1.640 2.892 17.221 1.640 10.501 [OK] 6827 6 c BPH C1B 9 C4H2b 0.770 1.880 2.653 10.771 1.880 5.729 [OK] 6828 6 c BPH C2B 9 C4H2b 0.770 1.880 2.847 11.204 1.880 5.959 [OK] 6829 6 c BPH C3B 9 C4H2b 0.770 1.880 2.759 10.641 1.880 5.660 [OK] 6830 6 c BPH C4B 9 C4H2b 0.770 1.880 3.124 11.782 1.880 6.267 possible 6831 6 c BPH CMB 9 C4H2b 0.770 1.880 2.963 33.592 1.880 17.868 [OK] 6832 6 c BPH CAB 9 C4H2b 0.770 1.880 2.615 10.206 1.880 5.429 [OK] 6833 6 c BPH OBB 17 O2H1u 0.660 1.460 2.954 22.008 1.460 15.074 [OK] 6834 6 c BPH CBB 9 C4H2b 0.770 1.880 2.940 35.177 1.880 18.711 [OK] 6835 6 c BPH N C 14 N4H3u 0.700 1.640 2.795 14.659 1.640 8.939 [OK] 6836 6 c BPH C1C 9 C4H2b 0.770 1.880 2.828 11.688 1.880 6.217 [OK] 6837 6 c BPH C2C 9 C4H2b 0.770 1.880 3.017 15.134 1.880 8.050 possible 6838 6 c BPH C3C 9 C4H2b 0.770 1.880 2.767 13.953 1.880 7.422 [OK] 6839 6 c BPH C4C 9 C4H2b 0.770 1.880 2.398 10.199 1.880 5.425 [OK] 6840 6 c BPH CMC 9 C4H2b 0.770 1.880 3.423 38.182 1.880 20.310 possible 6841 6 c BPH CAC 9 C4H2b 0.770 1.880 3.005 25.955 1.880 13.806 possible 6842 6 c BPH CBC 9 C4H2b 0.770 1.880 3.021 32.773 1.880 17.433 possible 6843 6 c BPH N D 14 N4H3u 0.700 1.640 2.841 14.129 1.640 8.615 [OK] 6844 6 c BPH C1D 9 C4H2b 0.770 1.880 2.742 11.270 1.880 5.995 [OK] 6845 6 c BPH C2D 9 C4H2b 0.770 1.880 2.709 11.072 1.880 5.889 [OK] 6846 6 c BPH C3D 9 C4H2b 0.770 1.880 2.653 11.735 1.880 6.242 [OK] 6847 6 c BPH C4D 9 C4H2b 0.770 1.880 2.651 9.760 1.880 5.192 [OK] 6848 6 c BPH CMD 9 C4H2b 0.770 1.880 3.112 37.565 1.880 19.982 possible 6849 6 c BPH CAD 9 C4H2b 0.770 1.880 2.636 10.181 1.880 5.415 [OK] 6850 6 c BPH OBD 17 O2H1u 0.660 1.460 2.415 18.263 1.460 12.509 [OK] 6851 6 c BPH CBD 9 C4H2b 0.770 1.880 2.807 14.797 1.880 7.871 [OK] 6852 6 c BPH CGD 9 C4H2b 0.770 1.880 2.611 9.224 1.880 4.906 [OK] 6853 6 c BPH O1D 17 O2H1u 0.660 1.460 2.477 19.287 1.460 13.210 [OK] 6854 6 c BPH O2D 17 O2H1u 0.660 1.460 2.675 13.301 1.460 9.110 [OK] 6855 6 c BPH CED 9 C4H2b 0.770 1.880 3.111 37.877 1.880 20.147 possible 6856 6 c BPH C1 9 C4H2b 0.770 1.880 2.835 24.183 1.880 12.863 [OK] 6857 6 c BPH C2 9 C4H2b 0.770 1.880 2.849 21.376 1.880 11.370 [OK] 6858 6 c BPH C3 9 C4H2b 0.770 1.880 2.799 12.469 1.880 6.633 [OK] 6859 6 c BPH C4 9 C4H2b 0.770 1.880 4.996 70.765 1.880 37.641 possible 6860 6 c BPH C5 9 C4H2b 0.770 1.880 4.015 32.272 1.880 17.166 possible 6861 6 c BPH C6 9 C4H2b 0.770 1.880 3.029 23.506 1.880 12.503 possible 6862 6 c BPH C7 9 C4H2b 0.770 1.880 2.883 23.548 1.880 12.526 [OK] 6863 6 c BPH C8 9 C4H2b 0.770 1.880 3.009 14.301 1.880 7.607 possible 6864 6 c BPH C9 9 C4H2b 0.770 1.880 3.002 35.760 1.880 19.021 possible 6865 6 c BPH C10 9 C4H2b 0.770 1.880 3.019 24.107 1.880 12.823 possible 6866 6 c BPH C11 9 C4H2b 0.770 1.880 2.898 23.679 1.880 12.595 [OK] 6867 6 c BPH C12 9 C4H2b 0.770 1.880 3.243 25.630 1.880 13.633 possible 6868 6 c BPH C13 9 C4H2b 0.770 1.880 2.800 13.898 1.880 7.393 [OK] 6869 6 c BPH C14 9 C4H2b 0.770 1.880 3.030 37.271 1.880 19.825 possible 6870 6 c BPH C15 9 C4H2b 0.770 1.880 3.162 23.439 1.880 12.468 possible 6871 6 c BPH C16 9 C4H2b 0.770 1.880 3.622 23.695 1.880 12.604 possible 6872 6 c BPH C17 9 C4H2b 0.770 1.880 4.736 36.160 1.880 19.234 possible 6873 6 c BPH C18 9 C4H2b 0.770 1.880 2.707 12.894 1.880 6.858 [OK] 6874 6 c BPH C19 9 C4H2b 0.770 1.880 2.874 35.496 1.880 18.881 [OK] 6875 6 c BPH C20 9 C4H2b 0.770 1.880 3.283 37.701 1.880 20.054 possible 6876 7 c FE2 FE c 25 DEFAULT 0.770 1.800 2.302 13.697 1.800 7.609 [OK] 6877 8 c U10 C1 9 C4H2b 0.770 1.880 2.477 10.294 1.880 5.475 [OK] 6878 8 c U10 C2 9 C4H2b 0.770 1.880 2.487 9.968 1.880 5.302 [OK] 6879 8 c U10 C3 9 C4H2b 0.770 1.880 2.745 11.054 1.880 5.880 [OK] 6880 8 c U10 C4 9 C4H2b 0.770 1.880 2.709 11.345 1.880 6.035 [OK] 6881 8 c U10 C5 9 C4H2b 0.770 1.880 2.565 9.279 1.880 4.936 [OK] 6882 8 c U10 C6 9 C4H2b 0.770 1.880 2.491 10.023 1.880 5.332 [OK] 6883 8 c U10 C1M 9 C4H2b 0.770 1.880 2.819 31.957 1.880 16.998 [OK] 6884 8 c U10 C3M 9 C4H2b 0.770 1.880 3.036 35.506 1.880 18.886 possible 6885 8 c U10 C4M 9 C4H2b 0.770 1.880 3.155 38.723 1.880 20.598 possible 6886 8 c U10 C7 9 C4H2b 0.770 1.880 2.774 19.856 1.880 10.561 [OK] 6887 8 c U10 C8 9 C4H2b 0.770 1.880 2.593 18.224 1.880 9.693 [OK] 6888 8 c U10 C9 9 C4H2b 0.770 1.880 2.679 11.088 1.880 5.898 [OK] 6889 8 c U10 C10 9 C4H2b 0.770 1.880 2.814 33.164 1.880 17.640 [OK] 6890 8 c U10 C11 9 C4H2b 0.770 1.880 2.836 21.843 1.880 11.619 [OK] 6891 8 c U10 C12 9 C4H2b 0.770 1.880 2.851 22.463 1.880 11.948 [OK] 6892 8 c U10 C13 9 C4H2b 0.770 1.880 2.848 21.296 1.880 11.328 [OK] 6893 8 c U10 C14 9 C4H2b 0.770 1.880 2.760 11.573 1.880 6.156 [OK] 6894 8 c U10 C15 9 C4H2b 0.770 1.880 3.215 38.284 1.880 20.364 possible 6895 8 c U10 C16 9 C4H2b 0.770 1.880 3.110 24.886 1.880 13.237 possible 6896 8 c U10 C17 9 C4H2b 0.770 1.880 3.111 24.436 1.880 12.998 possible 6897 8 c U10 C18 9 C4H2b 0.770 1.880 3.078 23.218 1.880 12.350 possible 6898 8 c U10 C19 9 C4H2b 0.770 1.880 2.852 12.714 1.880 6.763 [OK] 6899 8 c U10 C20 9 C4H2b 0.770 1.880 6.019 58.711 1.880 31.229 possible 6900 8 c U10 C21 9 C4H2b 0.770 1.880 5.511 32.159 1.880 17.106 possible 6901 8 c U10 C22 9 C4H2b 0.770 1.880 4.350 27.248 1.880 14.494 possible 6902 8 c U10 C23 9 C4H2b 0.770 1.880 6.175 47.470 1.880 25.250 possible 6903 8 c U10 C24 9 C4H2b 0.770 1.880 2.925 11.995 1.880 6.380 [OK] 6904 8 c U10 C25 9 C4H2b 0.770 1.880 3.274 42.798 1.880 22.765 possible 6905 8 c U10 C26 9 C4H2b 0.770 1.880 4.847 29.457 1.880 15.669 possible 6906 8 c U10 C27 9 C4H2b 0.770 1.880 7.107 55.743 1.880 29.651 possible 6907 8 c U10 C28 9 C4H2b 0.770 1.880 3.884 28.315 1.880 15.061 possible 6908 8 c U10 C29 9 C4H2b 0.770 1.880 4.910 16.863 1.880 8.970 possible 6909 8 c U10 C30 9 C4H2b 0.770 1.880 49.201 -1.000 1.880 -1.000 bad 6910 8 c U10 C31 9 C4H2b 0.770 1.880 5.980 114.247 1.880 60.769 possible 6911 8 c U10 O2 17 O2H1u 0.660 1.460 2.370 15.035 1.460 10.298 [OK] 6912 8 c U10 O3 17 O2H1u 0.660 1.460 2.598 12.587 1.460 8.621 [OK] 6913 8 c U10 O4 17 O2H1u 0.660 1.460 2.318 12.588 1.460 8.622 [OK] 6914 8 c U10 O5 17 O2H1u 0.660 1.460 2.456 15.871 1.460 10.870 [OK] 6915 9 c U10 C1 9 C4H2b 0.770 1.880 2.960 12.881 1.880 6.851 [OK] 6916 9 c U10 C2 9 C4H2b 0.770 1.880 2.772 10.160 1.880 5.404 [OK] 6917 9 c U10 C3 9 C4H2b 0.770 1.880 2.767 10.402 1.880 5.533 [OK] 6918 9 c U10 C4 9 C4H2b 0.770 1.880 2.817 10.817 1.880 5.754 [OK] 6919 9 c U10 C5 9 C4H2b 0.770 1.880 2.840 10.802 1.880 5.746 [OK] 6920 9 c U10 C6 9 C4H2b 0.770 1.880 2.825 11.589 1.880 6.165 [OK] 6921 9 c U10 C1M 9 C4H2b 0.770 1.880 5.784 60.179 1.880 32.010 possible 6922 9 c U10 C3M 9 C4H2b 0.770 1.880 3.211 34.161 1.880 18.171 possible 6923 9 c U10 C4M 9 C4H2b 0.770 1.880 2.830 31.768 1.880 16.898 [OK] 6924 9 c U10 C7 9 C4H2b 0.770 1.880 3.237 23.431 1.880 12.463 possible 6925 9 c U10 C8 9 C4H2b 0.770 1.880 3.226 23.350 1.880 12.420 possible 6926 9 c U10 C9 9 C4H2b 0.770 1.880 3.210 12.388 1.880 6.589 possible 6927 9 c U10 C10 9 C4H2b 0.770 1.880 18.161 -1.000 1.880 -1.000 bad 6928 9 c U10 C11 9 C4H2b 0.770 1.880 3.400 27.793 1.880 14.784 possible 6929 9 c U10 C12 9 C4H2b 0.770 1.880 3.186 26.253 1.880 13.964 possible 6930 9 c U10 C13 9 C4H2b 0.770 1.880 4.311 28.763 1.880 15.299 possible 6931 9 c U10 C14 9 C4H2b 0.770 1.880 4.383 15.352 1.880 8.166 possible 6932 9 c U10 C15 9 C4H2b 0.770 1.880 5.411 69.458 1.880 36.946 possible 6933 9 c U10 C16 9 C4H2b 0.770 1.880 24.322 -1.000 1.880 -1.000 bad 6934 9 c U10 C17 9 C4H2b 0.770 1.880 3.927 26.746 1.880 14.227 possible 6935 9 c U10 C18 9 C4H2b 0.770 1.880 4.915 28.481 1.880 15.149 possible 6936 9 c U10 C19 9 C4H2b 0.770 1.880 7.166 17.290 1.880 9.197 possible 6937 9 c U10 C20 9 C4H2b 0.770 1.880 27.622 -1.000 1.880 -1.000 bad 6938 9 c U10 C21 9 C4H2b 0.770 1.880 15.121 -1.000 1.880 -1.000 bad 6939 9 c U10 C22 9 C4H2b 0.770 1.880 9.513 -1.000 1.880 -1.000 bad 6940 9 c U10 C23 9 C4H2b 0.770 1.880 4.956 -1.000 1.880 -1.000 bad 6941 9 c U10 C24 9 C4H2b 0.770 1.880 2.757 -1.000 1.880 -1.000 bad 6942 9 c U10 C25 9 C4H2b 0.770 1.880 28.934 -1.000 1.880 -1.000 bad 6943 9 c U10 C26 9 C4H2b 0.770 1.880 13.125 -1.000 1.880 -1.000 bad 6944 9 c U10 C27 9 C4H2b 0.770 1.880 2.903 22.717 1.880 12.083 [OK] 6945 9 c U10 C28 9 C4H2b 0.770 1.880 4.217 24.785 1.880 13.183 possible 6946 9 c U10 C29 9 C4H2b 0.770 1.880 5.727 17.084 1.880 9.087 possible 6947 9 c U10 C30 9 C4H2b 0.770 1.880 18.722 -1.000 1.880 -1.000 bad 6948 9 c U10 C31 9 C4H2b 0.770 1.880 4.087 24.779 1.880 13.180 possible 6949 9 c U10 C32 9 C4H2b 0.770 1.880 23.683 -1.000 1.880 -1.000 bad 6950 9 c U10 C33 9 C4H2b 0.770 1.880 9.372 -1.000 1.880 -1.000 bad 6951 9 c U10 C34 9 C4H2b 0.770 1.880 2.891 -1.000 1.880 -1.000 bad 6952 9 c U10 C35 9 C4H2b 0.770 1.880 48.636 -1.000 1.880 -1.000 bad 6953 9 c U10 C36 9 C4H2b 0.770 1.880 26.353 -1.000 1.880 -1.000 bad 6954 9 c U10 C37 9 C4H2b 0.770 1.880 51.778 -1.000 1.880 -1.000 bad 6955 9 c U10 O2 17 O2H1u 0.660 1.460 2.707 19.706 1.460 13.497 [OK] 6956 9 c U10 O3 17 O2H1u 0.660 1.460 2.329 12.575 1.460 8.613 [OK] 6957 9 c U10 O4 17 O2H1u 0.660 1.460 2.461 12.449 1.460 8.527 [OK] 6958 9 c U10 O5 17 O2H1u 0.660 1.460 2.393 17.443 1.460 11.947 [OK] 6959 10 c LDA N1 14 N4H3u 0.700 1.640 2.375 4.341 1.640 2.647 [OK] 6960 10 c LDA O1 17 O2H1u 0.660 1.460 4.083 26.599 1.460 18.219 possible 6961 10 c LDA CM1 9 C4H2b 0.770 1.880 3.430 30.827 1.880 16.397 possible 6962 10 c LDA CM2 9 C4H2b 0.770 1.880 41.381 -1.000 1.880 -1.000 bad 6963 10 c LDA C1 9 C4H2b 0.770 1.880 13.750 -1.000 1.880 -1.000 bad 6964 10 c LDA C2 9 C4H2b 0.770 1.880 3.181 25.798 1.880 13.722 possible 6965 10 c LDA C3 9 C4H2b 0.770 1.880 3.158 27.023 1.880 14.374 possible 6966 10 c LDA C4 9 C4H2b 0.770 1.880 4.411 25.105 1.880 13.354 possible 6967 10 c LDA C5 9 C4H2b 0.770 1.880 2.875 23.649 1.880 12.579 [OK] 6968 10 c LDA C6 9 C4H2b 0.770 1.880 7.725 53.408 1.880 28.409 possible 6969 10 c LDA C7 9 C4H2b 0.770 1.880 3.905 26.732 1.880 14.219 possible 6970 10 c LDA C8 9 C4H2b 0.770 1.880 18.453 -1.000 1.880 -1.000 bad 6971 10 c LDA C9 9 C4H2b 0.770 1.880 2.928 21.775 1.880 11.582 [OK] 6972 10 c LDA C10 9 C4H2b 0.770 1.880 15.496 -1.000 1.880 -1.000 bad 6973 10 c LDA C11 9 C4H2b 0.770 1.880 4.301 30.882 1.880 16.426 possible 6974 10 c LDA C12 9 C4H2b 0.770 1.880 35.317 -1.000 1.880 -1.000 bad 6975 11 c LDA N1 14 N4H3u 0.700 1.640 1.984 4.299 1.640 2.622 [OK] 6976 11 c LDA O1 17 O2H1u 0.660 1.460 7.355 82.661 1.460 56.617 possible 6977 11 c LDA CM1 9 C4H2b 0.770 1.880 5.941 62.493 1.880 33.241 possible 6978 11 c LDA CM2 9 C4H2b 0.770 1.880 31.759 -1.000 1.880 -1.000 bad 6979 11 c LDA C1 9 C4H2b 0.770 1.880 3.126 25.516 1.880 13.572 possible 6980 11 c LDA C2 9 C4H2b 0.770 1.880 8.192 -1.000 1.880 -1.000 bad 6981 11 c LDA C3 9 C4H2b 0.770 1.880 7.717 -1.000 1.880 -1.000 bad 6982 11 c LDA C4 9 C4H2b 0.770 1.880 13.421 -1.000 1.880 -1.000 bad 6983 11 c LDA C5 9 C4H2b 0.770 1.880 3.446 27.124 1.880 14.428 possible 6984 11 c LDA C6 9 C4H2b 0.770 1.880 10.650 -1.000 1.880 -1.000 bad 6985 11 c LDA C7 9 C4H2b 0.770 1.880 3.555 26.975 1.880 14.348 possible 6986 11 c LDA C8 9 C4H2b 0.770 1.880 5.316 60.858 1.880 32.371 possible 6987 11 c LDA C9 9 C4H2b 0.770 1.880 3.619 26.422 1.880 14.054 possible 6988 11 c LDA C10 9 C4H2b 0.770 1.880 3.056 25.984 1.880 13.821 possible 6989 11 c LDA C11 9 C4H2b 0.770 1.880 3.288 27.369 1.880 14.558 possible 6990 11 c LDA C12 9 C4H2b 0.770 1.880 2.994 38.370 1.880 20.409 [OK] 6991 12 c LDA N1 14 N4H3u 0.700 1.640 2.255 4.334 1.640 2.643 [OK] 6992 12 c LDA O1 17 O2H1u 0.660 1.460 6.526 -1.000 1.460 -1.000 bad 6993 12 c LDA CM1 9 C4H2b 0.770 1.880 4.326 48.843 1.880 25.980 possible 6994 12 c LDA CM2 9 C4H2b 0.770 1.880 45.665 -1.000 1.880 -1.000 bad 6995 12 c LDA C1 9 C4H2b 0.770 1.880 4.179 25.639 1.880 13.638 possible 6996 12 c LDA C2 9 C4H2b 0.770 1.880 7.829 -1.000 1.880 -1.000 bad 6997 12 c LDA C3 9 C4H2b 0.770 1.880 21.461 -1.000 1.880 -1.000 bad 6998 12 c LDA C4 9 C4H2b 0.770 1.880 18.170 -1.000 1.880 -1.000 bad 6999 12 c LDA C5 9 C4H2b 0.770 1.880 6.567 -1.000 1.880 -1.000 bad 7000 12 c LDA C6 9 C4H2b 0.770 1.880 9.969 -1.000 1.880 -1.000 bad 7001 12 c LDA C7 9 C4H2b 0.770 1.880 10.526 -1.000 1.880 -1.000 bad 7002 12 c LDA C8 9 C4H2b 0.770 1.880 21.178 -1.000 1.880 -1.000 bad 7003 12 c LDA C9 9 C4H2b 0.770 1.880 3.085 23.378 1.880 12.435 possible 7004 12 c LDA C10 9 C4H2b 0.770 1.880 17.546 -1.000 1.880 -1.000 bad 7005 12 c LDA C11 9 C4H2b 0.770 1.880 3.602 29.869 1.880 15.888 possible 7006 12 c LDA C12 9 C4H2b 0.770 1.880 44.698 -1.000 1.880 -1.000 bad 7007 13 c LDA N1 14 N4H3u 0.700 1.640 1.981 4.303 1.640 2.624 [OK] 7008 13 c LDA O1 17 O2H1u 0.660 1.460 2.648 17.819 1.460 12.205 [OK] 7009 13 c LDA CM1 9 C4H2b 0.770 1.880 3.173 33.323 1.880 17.725 possible 7010 13 c LDA CM2 9 C4H2b 0.770 1.880 3.189 26.337 1.880 14.009 possible 7011 13 c LDA C1 9 C4H2b 0.770 1.880 2.855 20.488 1.880 10.898 [OK] 7012 13 c LDA C2 9 C4H2b 0.770 1.880 3.241 24.138 1.880 12.839 possible 7013 13 c LDA C3 9 C4H2b 0.770 1.880 2.867 23.507 1.880 12.504 [OK] 7014 13 c LDA C4 9 C4H2b 0.770 1.880 3.121 23.996 1.880 12.764 possible 7015 13 c LDA C5 9 C4H2b 0.770 1.880 3.032 27.133 1.880 14.432 possible 7016 13 c LDA C6 9 C4H2b 0.770 1.880 4.299 32.103 1.880 17.076 possible 7017 13 c LDA C7 9 C4H2b 0.770 1.880 2.896 26.409 1.880 14.047 [OK] 7018 13 c LDA C8 9 C4H2b 0.770 1.880 5.553 49.152 1.880 26.145 possible 7019 13 c LDA C9 9 C4H2b 0.770 1.880 3.131 26.754 1.880 14.231 possible 7020 13 c LDA C10 9 C4H2b 0.770 1.880 7.657 74.653 1.880 39.709 possible 7021 13 c LDA C11 9 C4H2b 0.770 1.880 3.592 30.052 1.880 15.985 possible 7022 13 c LDA C12 9 C4H2b 0.770 1.880 5.787 75.189 1.880 39.994 possible 7023 1 R ALA N 12 N3H1s 0.700 1.640 4.745 42.941 14.046 3.057 possible 7024 1 R ALA CA 4 C4H1b 0.770 1.880 2.855 15.553 14.063 1.106 [OK] 7025 1 R ALA C 1 C3H0s 0.770 1.610 2.526 8.587 8.900 0.965 [OK] 7026 1 R ALA O 16 O1H0u 0.660 1.420 3.760 33.892 16.188 2.094 possible 7027 1 R ALA CB 10 C4H3u 0.770 1.880 4.578 56.328 36.782 1.531 possible 7028 2 R LEU N 12 N3H1s 0.700 1.640 2.674 14.918 13.655 1.092 [OK] 7029 2 R LEU CA 3 C4H1s 0.770 1.880 2.648 13.249 13.122 1.010 [OK] 7030 2 R LEU C 1 C3H0s 0.770 1.610 2.593 8.500 8.825 0.963 [OK] 7031 2 R LEU O 16 O1H0u 0.660 1.420 2.553 14.988 16.208 0.925 [OK] 7032 2 R LEU CB 8 C4H2s 0.770 1.880 3.138 22.487 22.951 0.980 possible 7033 2 R LEU CG 4 C4H1b 0.770 1.880 2.774 13.663 14.764 0.925 [OK] 7034 2 R LEU CD1 10 C4H3u 0.770 1.880 3.526 40.996 37.425 1.095 possible 7035 2 R LEU CD2 10 C4H3u 0.770 1.880 3.686 43.917 37.143 1.182 possible 7036 3 R LEU N 12 N3H1s 0.700 1.640 2.605 14.416 13.655 1.056 [OK] 7037 3 R LEU CA 3 C4H1s 0.770 1.880 2.643 12.214 13.122 0.931 [OK] 7038 3 R LEU C 1 C3H0s 0.770 1.610 2.509 8.475 8.825 0.960 [OK] 7039 3 R LEU O 16 O1H0u 0.660 1.420 2.503 14.999 16.208 0.925 [OK] 7040 3 R LEU CB 8 C4H2s 0.770 1.880 2.728 22.724 22.951 0.990 [OK] 7041 3 R LEU CG 4 C4H1b 0.770 1.880 2.725 13.653 14.764 0.925 [OK] 7042 3 R LEU CD1 10 C4H3u 0.770 1.880 3.232 35.566 37.425 0.950 possible 7043 3 R LEU CD2 10 C4H3u 0.770 1.880 3.300 34.581 37.143 0.931 possible 7044 4 R SER N 12 N3H1s 0.700 1.640 2.629 15.162 14.103 1.075 [OK] 7045 4 R SER CA 3 C4H1s 0.770 1.880 2.852 14.087 13.476 1.045 [OK] 7046 4 R SER C 1 C3H0s 0.770 1.610 2.240 8.590 8.923 0.963 [OK] 7047 4 R SER O 16 O1H0u 0.660 1.420 4.082 27.858 16.179 1.722 possible 7048 4 R SER CB 8 C4H2s 0.770 1.880 4.097 28.321 23.884 1.186 possible 7049 4 R SER OG 17 O2H1u 0.660 1.460 3.257 24.324 18.732 1.299 possible 7050 5 R PHE N 12 N3H1s 0.700 1.640 2.497 14.038 13.691 1.025 [OK] 7051 5 R PHE CA 3 C4H1s 0.770 1.880 2.869 14.129 13.449 1.051 [OK] 7052 5 R PHE C 1 C3H0s 0.770 1.610 2.430 8.826 8.753 1.008 [OK] 7053 5 R PHE O 16 O1H0u 0.660 1.420 2.314 15.649 16.151 0.969 [OK] 7054 5 R PHE CB 8 C4H2s 0.770 1.880 2.802 22.930 23.777 0.964 [OK] 7055 5 R PHE CG 2 C3H0b 0.770 1.610 2.346 9.327 9.721 0.959 [OK] 7056 5 R PHE CD1 5 C3H1s 0.770 1.760 2.744 19.913 20.405 0.976 [OK] 7057 5 R PHE CD2 6 C3H1b 0.770 1.760 2.754 20.657 21.051 0.981 [OK] 7058 5 R PHE CE1 6 C3H1b 0.770 1.760 2.741 20.177 21.580 0.935 [OK] 7059 5 R PHE CE2 6 C3H1b 0.770 1.760 3.079 23.592 21.680 1.088 possible 7060 5 R PHE CZ 6 C3H1b 0.770 1.760 3.446 23.333 21.666 1.077 possible 7061 6 R GLU N 12 N3H1s 0.700 1.640 2.456 13.019 13.615 0.956 [OK] 7062 6 R GLU CA 3 C4H1s 0.770 1.880 2.706 13.403 13.399 1.000 [OK] 7063 6 R GLU C 1 C3H0s 0.770 1.610 2.453 8.814 8.675 1.016 [OK] 7064 6 R GLU O 16 O1H0u 0.660 1.420 2.355 15.136 16.023 0.945 [OK] 7065 6 R GLU CB 8 C4H2s 0.770 1.880 2.745 20.246 23.529 0.860 [OK] 7066 6 R GLU CG 8 C4H2s 0.770 1.880 2.795 21.688 23.513 0.922 [OK] 7067 6 R GLU CD 2 C3H0b 0.770 1.610 2.476 8.790 9.460 0.929 [OK] 7068 6 R GLU OE1 16 O1H0u 0.660 1.420 2.314 15.200 15.999 0.950 [OK] 7069 6 R GLU OE2 16 O1H0u 0.660 1.420 2.556 16.447 17.432 0.943 [OK] 7070 7 R ARG N 12 N3H1s 0.700 1.640 2.587 13.985 13.650 1.025 [OK] 7071 7 R ARG CA 3 C4H1s 0.770 1.880 3.168 14.235 13.422 1.061 possible 7072 7 R ARG C 1 C3H0s 0.770 1.610 2.490 7.912 8.838 0.895 [OK] 7073 7 R ARG O 16 O1H0u 0.660 1.420 2.689 16.649 16.084 1.035 [OK] 7074 7 R ARG CB 8 C4H2s 0.770 1.880 3.513 25.707 23.088 1.113 possible 7075 7 R ARG CG 8 C4H2s 0.770 1.880 3.606 32.431 23.640 1.372 possible 7076 7 R ARG CD 8 C4H2s 0.770 1.880 2.905 25.018 23.300 1.074 [OK] 7077 7 R ARG NE 13 N3H1b 0.700 1.640 3.418 25.207 15.569 1.619 possible 7078 7 R ARG CZ 2 C3H0b 0.770 1.610 4.114 14.198 9.747 1.457 possible 7079 7 R ARG NH1 15 N3H2u 0.700 1.640 12.478 -1.000 22.782 -1.000 bad 7080 7 R ARG NH2 15 N3H2u 0.700 1.640 40.284 -1.000 23.810 -1.000 bad 7081 8 R LYS N 12 N3H1s 0.700 1.640 2.666 13.769 13.675 1.007 [OK] 7082 8 R LYS CA 3 C4H1s 0.770 1.880 2.724 13.052 13.324 0.980 [OK] 7083 8 R LYS C 1 C3H0s 0.770 1.610 2.470 8.627 8.759 0.985 [OK] 7084 8 R LYS O 16 O1H0u 0.660 1.420 2.367 16.193 16.049 1.009 [OK] 7085 8 R LYS CB 8 C4H2s 0.770 1.880 3.076 23.555 22.904 1.028 possible 7086 8 R LYS CG 8 C4H2s 0.770 1.880 2.694 20.708 23.131 0.895 [OK] 7087 8 R LYS CD 8 C4H2s 0.770 1.880 3.098 23.913 23.837 1.003 possible 7088 8 R LYS CE 9 C4H2b 0.770 1.880 3.195 24.664 23.934 1.030 possible 7089 8 R LYS NZ 14 N4H3u 0.700 1.640 3.065 22.722 21.213 1.071 possible 7090 9 R TYR N 12 N3H1s 0.700 1.640 2.525 12.083 13.691 0.883 [OK] 7091 9 R TYR CA 3 C4H1s 0.770 1.880 2.789 13.111 13.330 0.984 [OK] 7092 9 R TYR C 1 C3H0s 0.770 1.610 2.404 9.207 8.770 1.050 [OK] 7093 9 R TYR O 16 O1H0u 0.660 1.420 2.573 17.348 16.124 1.076 [OK] 7094 9 R TYR CB 8 C4H2s 0.770 1.880 2.796 22.302 23.678 0.942 [OK] 7095 9 R TYR CG 2 C3H0b 0.770 1.610 2.744 9.827 9.732 1.010 [OK] 7096 9 R TYR CD1 5 C3H1s 0.770 1.760 3.114 23.540 20.171 1.167 possible 7097 9 R TYR CD2 5 C3H1s 0.770 1.760 2.871 17.552 20.728 0.847 [OK] 7098 9 R TYR CE1 5 C3H1s 0.770 1.760 2.945 19.205 20.675 0.929 [OK] 7099 9 R TYR CE2 5 C3H1s 0.770 1.760 2.933 19.508 20.810 0.937 [OK] 7100 9 R TYR CZ 2 C3H0b 0.770 1.610 2.815 10.541 9.926 1.062 [OK] 7101 9 R TYR OH 17 O2H1u 0.660 1.460 2.580 17.946 19.173 0.936 [OK] 7102 10 R ARG N 12 N3H1s 0.700 1.640 2.611 14.090 13.650 1.032 [OK] 7103 10 R ARG CA 3 C4H1s 0.770 1.880 2.743 13.773 13.422 1.026 [OK] 7104 10 R ARG C 1 C3H0s 0.770 1.610 2.625 10.243 8.838 1.159 [OK] 7105 10 R ARG O 16 O1H0u 0.660 1.420 2.637 18.697 16.084 1.162 [OK] 7106 10 R ARG CB 8 C4H2s 0.770 1.880 3.607 29.679 23.088 1.285 possible 7107 10 R ARG CG 8 C4H2s 0.770 1.880 3.601 25.996 23.640 1.100 possible 7108 10 R ARG CD 8 C4H2s 0.770 1.880 2.509 20.308 23.300 0.872 [OK] 7109 10 R ARG NE 13 N3H1b 0.700 1.640 3.264 19.939 15.569 1.281 possible 7110 10 R ARG CZ 2 C3H0b 0.770 1.610 2.225 8.416 9.747 0.863 [OK] 7111 10 R ARG NH1 15 N3H2u 0.700 1.640 2.968 25.180 22.782 1.105 [OK] 7112 10 R ARG NH2 15 N3H2u 0.700 1.640 3.902 34.637 23.810 1.455 possible 7113 11 R VAL N 12 N3H1s 0.700 1.640 2.679 13.304 13.676 0.973 [OK] 7114 11 R VAL CA 3 C4H1s 0.770 1.880 2.523 11.889 13.123 0.906 [OK] 7115 11 R VAL C 1 C3H0s 0.770 1.610 2.538 9.174 8.563 1.071 [OK] 7116 11 R VAL O 16 O1H0u 0.660 1.420 2.708 18.836 16.181 1.164 [OK] 7117 11 R VAL CB 4 C4H1b 0.770 1.880 3.224 16.871 14.598 1.156 possible 7118 11 R VAL CG1 10 C4H3u 0.770 1.880 3.093 30.680 36.584 0.839 possible 7119 11 R VAL CG2 10 C4H3u 0.770 1.880 3.050 33.129 36.332 0.912 possible 7120 12 R PRO N 11 N3H0u 0.700 1.640 2.333 7.895 8.823 0.895 [OK] 7121 12 R PRO CA 4 C4H1b 0.770 1.880 2.688 13.212 13.955 0.947 [OK] 7122 12 R PRO C 1 C3H0s 0.770 1.610 2.962 9.755 8.812 1.107 [OK] 7123 12 R PRO O 16 O1H0u 0.660 1.420 2.689 16.217 16.169 1.003 [OK] 7124 12 R PRO CB 9 C4H2b 0.770 1.880 6.871 58.898 25.563 2.304 possible 7125 12 R PRO CG 9 C4H2b 0.770 1.880 16.050 -1.000 25.832 -1.000 bad 7126 12 R PRO CD 8 C4H2s 0.770 1.880 3.198 22.495 23.836 0.944 possible 7127 13 R GLY N 12 N3H1s 0.700 1.640 3.962 16.989 14.854 1.144 possible 7128 13 R GLY CA 8 C4H2s 0.770 1.880 4.343 26.634 23.688 1.124 possible 7129 13 R GLY C 2 C3H0b 0.770 1.610 2.454 9.654 9.840 0.981 [OK] 7130 13 R GLY O 16 O1H0u 0.660 1.420 2.914 18.054 16.391 1.101 [OK] 7131 14 R GLY N 12 N3H1s 0.700 1.640 3.069 15.774 14.854 1.062 possible 7132 14 R GLY CA 8 C4H2s 0.770 1.880 3.952 29.219 23.688 1.233 possible 7133 14 R GLY C 2 C3H0b 0.770 1.610 3.182 11.457 9.840 1.164 possible 7134 14 R GLY O 16 O1H0u 0.660 1.420 2.410 16.007 16.391 0.977 [OK] 7135 15 R THR N 12 N3H1s 0.700 1.640 3.038 16.806 13.832 1.215 possible 7136 15 R THR CA 3 C4H1s 0.770 1.880 2.963 12.973 13.099 0.990 [OK] 7137 15 R THR C 1 C3H0s 0.770 1.610 2.549 8.728 8.738 0.999 [OK] 7138 15 R THR O 16 O1H0u 0.660 1.420 5.996 37.840 16.020 2.362 possible 7139 15 R THR CB 4 C4H1b 0.770 1.880 2.888 15.251 14.829 1.028 [OK] 7140 15 R THR OG1 17 O2H1u 0.660 1.460 3.113 20.557 18.123 1.134 possible 7141 15 R THR CG2 10 C4H3u 0.770 1.880 3.266 39.123 36.542 1.071 possible 7142 16 R LEU N 12 N3H1s 0.700 1.640 2.426 13.402 13.655 0.981 [OK] 7143 16 R LEU CA 3 C4H1s 0.770 1.880 3.773 16.076 13.122 1.225 possible 7144 16 R LEU C 1 C3H0s 0.770 1.610 3.106 9.124 8.825 1.034 possible 7145 16 R LEU O 16 O1H0u 0.660 1.420 29.528 -1.000 16.208 -1.000 bad 7146 16 R LEU CB 8 C4H2s 0.770 1.880 4.378 25.407 22.951 1.107 possible 7147 16 R LEU CG 4 C4H1b 0.770 1.880 2.743 14.388 14.764 0.975 [OK] 7148 16 R LEU CD1 10 C4H3u 0.770 1.880 4.861 46.795 37.425 1.250 possible 7149 16 R LEU CD2 10 C4H3u 0.770 1.880 33.588 -1.000 37.143 -1.000 bad 7150 17 R VAL N 12 N3H1s 0.700 1.640 3.059 15.635 13.676 1.143 possible 7151 17 R VAL CA 3 C4H1s 0.770 1.880 5.043 18.255 13.123 1.391 possible 7152 17 R VAL C 1 C3H0s 0.770 1.610 2.981 9.665 8.563 1.129 [OK] 7153 17 R VAL O 16 O1H0u 0.660 1.420 2.812 21.703 16.181 1.341 [OK] 7154 17 R VAL CB 4 C4H1b 0.770 1.880 2.865 14.070 14.598 0.964 [OK] 7155 17 R VAL CG1 10 C4H3u 0.770 1.880 36.999 -1.000 36.584 -1.000 bad 7156 17 R VAL CG2 10 C4H3u 0.770 1.880 26.485 -1.000 36.332 -1.000 bad 7157 18 R GLY N 12 N3H1s 0.700 1.640 6.372 -1.000 14.854 -1.000 bad 7158 18 R GLY CA 8 C4H2s 0.770 1.880 15.643 -1.000 23.688 -1.000 bad 7159 18 R GLY C 2 C3H0b 0.770 1.610 1.899 -1.000 9.840 -1.000 bad 7160 18 R GLY O 16 O1H0u 0.660 1.420 6.770 -1.000 16.391 -1.000 bad 7161 19 R GLY N 12 N3H1s 0.700 1.640 6.347 -1.000 14.854 -1.000 bad 7162 19 R GLY CA 8 C4H2s 0.770 1.880 36.743 -1.000 23.688 -1.000 bad 7163 19 R GLY C 2 C3H0b 0.770 1.610 3.329 10.293 9.840 1.046 possible 7164 19 R GLY O 16 O1H0u 0.660 1.420 2.797 18.611 16.391 1.135 [OK] 7165 20 R ASN N 12 N3H1s 0.700 1.640 5.598 22.555 13.695 1.647 possible 7166 20 R ASN CA 3 C4H1s 0.770 1.880 2.551 12.475 13.167 0.947 [OK] 7167 20 R ASN C 1 C3H0s 0.770 1.610 2.921 9.497 8.928 1.064 [OK] 7168 20 R ASN O 16 O1H0u 0.660 1.420 4.656 33.158 16.199 2.047 possible 7169 20 R ASN CB 8 C4H2s 0.770 1.880 6.662 50.875 23.128 2.200 possible 7170 20 R ASN CG 2 C3H0b 0.770 1.610 7.294 19.428 9.599 2.024 possible 7171 20 R ASN OD1 16 O1H0u 0.660 1.420 33.211 -1.000 16.664 -1.000 bad 7172 20 R ASN ND2 15 N3H2u 0.700 1.640 56.318 -1.000 23.083 -1.000 bad 7173 21 R LEU N 12 N3H1s 0.700 1.640 3.581 17.680 13.655 1.295 possible 7174 21 R LEU CA 3 C4H1s 0.770 1.880 6.549 31.642 13.122 2.411 possible 7175 21 R LEU C 1 C3H0s 0.770 1.610 2.228 8.271 8.825 0.937 [OK] 7176 21 R LEU O 16 O1H0u 0.660 1.420 6.568 52.469 16.208 3.237 possible 7177 21 R LEU CB 8 C4H2s 0.770 1.880 4.627 23.218 22.951 1.012 possible 7178 21 R LEU CG 4 C4H1b 0.770 1.880 14.297 -1.000 14.764 -1.000 bad 7179 21 R LEU CD1 10 C4H3u 0.770 1.880 42.503 -1.000 37.425 -1.000 bad 7180 21 R LEU CD2 10 C4H3u 0.770 1.880 36.201 -1.000 37.143 -1.000 bad 7181 22 R PHE N 12 N3H1s 0.700 1.640 3.086 16.288 13.691 1.190 possible 7182 22 R PHE CA 3 C4H1s 0.770 1.880 2.788 12.317 13.449 0.916 [OK] 7183 22 R PHE C 1 C3H0s 0.770 1.610 2.603 9.455 8.753 1.080 [OK] 7184 22 R PHE O 16 O1H0u 0.660 1.420 2.363 16.074 16.151 0.995 [OK] 7185 22 R PHE CB 8 C4H2s 0.770 1.880 3.317 23.877 23.777 1.004 possible 7186 22 R PHE CG 2 C3H0b 0.770 1.610 2.565 10.229 9.721 1.052 [OK] 7187 22 R PHE CD1 5 C3H1s 0.770 1.760 3.841 27.346 20.405 1.340 possible 7188 22 R PHE CD2 6 C3H1b 0.770 1.760 3.094 23.064 21.051 1.096 possible 7189 22 R PHE CE1 6 C3H1b 0.770 1.760 19.282 -1.000 21.580 -1.000 bad 7190 22 R PHE CE2 6 C3H1b 0.770 1.760 6.029 36.006 21.680 1.661 possible 7191 22 R PHE CZ 6 C3H1b 0.770 1.760 21.621 -1.000 21.666 -1.000 bad 7192 23 R ASP N 12 N3H1s 0.700 1.640 2.790 15.702 13.895 1.130 [OK] 7193 23 R ASP CA 3 C4H1s 0.770 1.880 2.727 14.159 13.377 1.058 [OK] 7194 23 R ASP C 1 C3H0s 0.770 1.610 2.691 10.062 8.816 1.141 [OK] 7195 23 R ASP O 16 O1H0u 0.660 1.420 3.521 22.588 16.091 1.404 possible 7196 23 R ASP CB 8 C4H2s 0.770 1.880 3.190 22.465 23.481 0.957 possible 7197 23 R ASP CG 2 C3H0b 0.770 1.610 2.519 9.025 9.422 0.958 [OK] 7198 23 R ASP OD1 16 O1H0u 0.660 1.420 2.603 17.927 15.505 1.156 [OK] 7199 23 R ASP OD2 16 O1H0u 0.660 1.420 2.993 20.275 16.324 1.242 [OK] 7200 24 R PHE N 12 N3H1s 0.700 1.640 2.692 14.002 13.691 1.023 [OK] 7201 24 R PHE CA 3 C4H1s 0.770 1.880 2.782 14.343 13.449 1.066 [OK] 7202 24 R PHE C 1 C3H0s 0.770 1.610 2.548 9.018 8.753 1.030 [OK] 7203 24 R PHE O 16 O1H0u 0.660 1.420 2.375 16.305 16.151 1.010 [OK] 7204 24 R PHE CB 8 C4H2s 0.770 1.880 3.186 23.286 23.777 0.979 possible 7205 24 R PHE CG 2 C3H0b 0.770 1.610 2.718 10.325 9.721 1.062 [OK] 7206 24 R PHE CD1 5 C3H1s 0.770 1.760 3.427 23.967 20.405 1.175 possible 7207 24 R PHE CD2 6 C3H1b 0.770 1.760 4.886 27.974 21.051 1.329 possible 7208 24 R PHE CE1 6 C3H1b 0.770 1.760 6.640 36.384 21.580 1.686 possible 7209 24 R PHE CE2 6 C3H1b 0.770 1.760 15.962 -1.000 21.680 -1.000 bad 7210 24 R PHE CZ 6 C3H1b 0.770 1.760 21.456 -1.000 21.666 -1.000 bad 7211 25 R TRP N 12 N3H1s 0.700 1.640 2.353 11.807 13.791 0.856 [OK] 7212 25 R TRP CA 3 C4H1s 0.770 1.880 2.559 12.858 13.377 0.961 [OK] 7213 25 R TRP C 1 C3H0s 0.770 1.610 2.767 9.575 8.724 1.098 [OK] 7214 25 R TRP O 16 O1H0u 0.660 1.420 4.773 32.039 15.951 2.009 possible 7215 25 R TRP CB 8 C4H2s 0.770 1.880 3.150 23.347 24.004 0.973 possible 7216 25 R TRP CG 2 C3H0b 0.770 1.610 2.388 9.137 9.965 0.917 [OK] 7217 25 R TRP CD1 5 C3H1s 0.770 1.760 2.647 18.912 20.874 0.906 [OK] 7218 25 R TRP CD2 2 C3H0b 0.770 1.610 2.382 9.589 10.097 0.950 [OK] 7219 25 R TRP NE1 13 N3H1b 0.700 1.640 2.528 15.680 16.969 0.924 [OK] 7220 25 R TRP CE2 2 C3H0b 0.770 1.610 2.317 8.949 9.889 0.905 [OK] 7221 25 R TRP CE3 6 C3H1b 0.770 1.760 2.935 21.260 20.448 1.040 [OK] 7222 25 R TRP CZ2 6 C3H1b 0.770 1.760 2.810 19.069 21.012 0.908 [OK] 7223 25 R TRP CZ3 6 C3H1b 0.770 1.760 2.942 24.671 21.516 1.147 [OK] 7224 25 R TRP CH2 6 C3H1b 0.770 1.760 2.872 19.141 21.339 0.897 [OK] 7225 26 R VAL N 12 N3H1s 0.700 1.640 2.616 13.562 13.676 0.992 [OK] 7226 26 R VAL CA 3 C4H1s 0.770 1.880 4.954 19.499 13.123 1.486 possible 7227 26 R VAL C 1 C3H0s 0.770 1.610 3.198 8.656 8.563 1.011 possible 7228 26 R VAL O 16 O1H0u 0.660 1.420 4.131 20.223 16.181 1.250 possible 7229 26 R VAL CB 4 C4H1b 0.770 1.880 6.110 22.964 14.598 1.573 possible 7230 26 R VAL CG1 10 C4H3u 0.770 1.880 58.110 -1.000 36.584 -1.000 bad 7231 26 R VAL CG2 10 C4H3u 0.770 1.880 28.023 -1.000 36.332 -1.000 bad 7232 27 R GLY N 12 N3H1s 0.700 1.640 7.446 51.575 14.854 3.472 possible 7233 27 R GLY CA 8 C4H2s 0.770 1.880 7.076 79.830 23.688 3.370 possible 7234 27 R GLY C 2 C3H0b 0.770 1.610 2.742 10.151 9.840 1.032 [OK] 7235 27 R GLY O 16 O1H0u 0.660 1.420 3.560 26.497 16.391 1.617 possible 7236 28 R PRO N 11 N3H0u 0.700 1.640 2.637 8.207 8.823 0.930 [OK] 7237 28 R PRO CA 4 C4H1b 0.770 1.880 2.938 14.660 13.955 1.051 [OK] 7238 28 R PRO C 1 C3H0s 0.770 1.610 2.505 9.665 8.812 1.097 [OK] 7239 28 R PRO O 16 O1H0u 0.660 1.420 2.714 18.215 16.169 1.127 [OK] 7240 28 R PRO CB 9 C4H2b 0.770 1.880 2.704 23.880 25.563 0.934 [OK] 7241 28 R PRO CG 9 C4H2b 0.770 1.880 6.628 61.357 25.832 2.375 possible 7242 28 R PRO CD 8 C4H2s 0.770 1.880 6.560 58.107 23.836 2.438 possible 7243 29 R PHE N 12 N3H1s 0.700 1.640 2.638 13.647 13.691 0.997 [OK] 7244 29 R PHE CA 3 C4H1s 0.770 1.880 2.947 14.067 13.449 1.046 [OK] 7245 29 R PHE C 1 C3H0s 0.770 1.610 2.657 8.679 8.753 0.992 [OK] 7246 29 R PHE O 16 O1H0u 0.660 1.420 2.712 16.577 16.151 1.026 [OK] 7247 29 R PHE CB 8 C4H2s 0.770 1.880 6.395 43.844 23.777 1.844 possible 7248 29 R PHE CG 2 C3H0b 0.770 1.610 5.922 17.879 9.721 1.839 possible 7249 29 R PHE CD1 5 C3H1s 0.770 1.760 6.171 31.784 20.405 1.558 possible 7250 29 R PHE CD2 6 C3H1b 0.770 1.760 9.708 -1.000 21.051 -1.000 bad 7251 29 R PHE CE1 6 C3H1b 0.770 1.760 23.966 -1.000 21.580 -1.000 bad 7252 29 R PHE CE2 6 C3H1b 0.770 1.760 17.060 -1.000 21.680 -1.000 bad 7253 29 R PHE CZ 6 C3H1b 0.770 1.760 25.436 -1.000 21.666 -1.000 bad 7254 30 R TYR N 12 N3H1s 0.700 1.640 2.442 13.948 13.691 1.019 [OK] 7255 30 R TYR CA 3 C4H1s 0.770 1.880 2.631 12.731 13.330 0.955 [OK] 7256 30 R TYR C 1 C3H0s 0.770 1.610 2.783 8.913 8.770 1.016 [OK] 7257 30 R TYR O 16 O1H0u 0.660 1.420 4.276 22.819 16.124 1.415 possible 7258 30 R TYR CB 8 C4H2s 0.770 1.880 2.841 23.605 23.678 0.997 [OK] 7259 30 R TYR CG 2 C3H0b 0.770 1.610 3.114 11.104 9.732 1.141 possible 7260 30 R TYR CD1 5 C3H1s 0.770 1.760 3.208 21.759 20.171 1.079 possible 7261 30 R TYR CD2 5 C3H1s 0.770 1.760 3.249 21.585 20.728 1.041 possible 7262 30 R TYR CE1 5 C3H1s 0.770 1.760 3.213 21.192 20.675 1.025 possible 7263 30 R TYR CE2 5 C3H1s 0.770 1.760 3.245 23.805 20.810 1.144 possible 7264 30 R TYR CZ 2 C3H0b 0.770 1.610 3.082 11.986 9.926 1.208 possible 7265 30 R TYR OH 17 O2H1u 0.660 1.460 2.972 22.643 19.173 1.181 [OK] 7266 31 R VAL N 12 N3H1s 0.700 1.640 2.483 13.741 13.676 1.005 [OK] 7267 31 R VAL CA 3 C4H1s 0.770 1.880 4.334 16.179 13.123 1.233 possible 7268 31 R VAL C 1 C3H0s 0.770 1.610 2.259 8.438 8.563 0.985 [OK] 7269 31 R VAL O 16 O1H0u 0.660 1.420 2.424 15.879 16.181 0.981 [OK] 7270 31 R VAL CB 4 C4H1b 0.770 1.880 2.763 14.261 14.598 0.977 [OK] 7271 31 R VAL CG1 10 C4H3u 0.770 1.880 4.910 50.063 36.584 1.368 possible 7272 31 R VAL CG2 10 C4H3u 0.770 1.880 4.952 57.138 36.332 1.573 possible 7273 32 R GLY N 12 N3H1s 0.700 1.640 2.583 14.137 14.854 0.952 [OK] 7274 32 R GLY CA 8 C4H2s 0.770 1.880 2.731 22.431 23.688 0.947 [OK] 7275 32 R GLY C 2 C3H0b 0.770 1.610 2.114 8.257 9.840 0.839 [OK] 7276 32 R GLY O 16 O1H0u 0.660 1.420 2.358 15.273 16.391 0.932 [OK] 7277 33 R PHE N 12 N3H1s 0.700 1.640 2.895 17.959 13.691 1.312 [OK] 7278 33 R PHE CA 3 C4H1s 0.770 1.880 2.757 13.605 13.449 1.012 [OK] 7279 33 R PHE C 1 C3H0s 0.770 1.610 2.300 7.840 8.753 0.896 [OK] 7280 33 R PHE O 16 O1H0u 0.660 1.420 2.667 15.003 16.151 0.929 [OK] 7281 33 R PHE CB 8 C4H2s 0.770 1.880 2.994 26.085 23.777 1.097 [OK] 7282 33 R PHE CG 2 C3H0b 0.770 1.610 2.759 9.782 9.721 1.006 [OK] 7283 33 R PHE CD1 5 C3H1s 0.770 1.760 4.130 24.938 20.405 1.222 possible 7284 33 R PHE CD2 6 C3H1b 0.770 1.760 2.608 18.844 21.051 0.895 [OK] 7285 33 R PHE CE1 6 C3H1b 0.770 1.760 26.096 -1.000 21.580 -1.000 bad 7286 33 R PHE CE2 6 C3H1b 0.770 1.760 12.901 -1.000 21.680 -1.000 bad 7287 33 R PHE CZ 6 C3H1b 0.770 1.760 28.748 -1.000 21.666 -1.000 bad 7288 34 R PHE N 12 N3H1s 0.700 1.640 2.616 12.353 13.691 0.902 [OK] 7289 34 R PHE CA 3 C4H1s 0.770 1.880 2.738 12.228 13.449 0.909 [OK] 7290 34 R PHE C 1 C3H0s 0.770 1.610 2.283 8.826 8.753 1.008 [OK] 7291 34 R PHE O 16 O1H0u 0.660 1.420 2.381 14.676 16.151 0.909 [OK] 7292 34 R PHE CB 8 C4H2s 0.770 1.880 2.659 20.082 23.777 0.845 [OK] 7293 34 R PHE CG 2 C3H0b 0.770 1.610 2.310 8.801 9.721 0.905 [OK] 7294 34 R PHE CD1 5 C3H1s 0.770 1.760 3.263 22.209 20.405 1.088 possible 7295 34 R PHE CD2 6 C3H1b 0.770 1.760 2.677 21.024 21.051 0.999 [OK] 7296 34 R PHE CE1 6 C3H1b 0.770 1.760 12.815 -1.000 21.580 -1.000 bad 7297 34 R PHE CE2 6 C3H1b 0.770 1.760 3.233 23.159 21.680 1.068 possible 7298 34 R PHE CZ 6 C3H1b 0.770 1.760 9.239 -1.000 21.666 -1.000 bad 7299 35 R GLY N 12 N3H1s 0.700 1.640 2.265 12.705 14.854 0.855 [OK] 7300 35 R GLY CA 8 C4H2s 0.770 1.880 4.419 31.097 23.688 1.313 possible 7301 35 R GLY C 2 C3H0b 0.770 1.610 3.438 11.144 9.840 1.132 possible 7302 35 R GLY O 16 O1H0u 0.660 1.420 4.472 32.348 16.391 1.974 possible 7303 36 R VAL N 12 N3H1s 0.700 1.640 3.049 13.792 13.676 1.008 possible 7304 36 R VAL CA 3 C4H1s 0.770 1.880 3.815 15.688 13.123 1.195 possible 7305 36 R VAL C 1 C3H0s 0.770 1.610 3.045 8.465 8.563 0.989 possible 7306 36 R VAL O 16 O1H0u 0.660 1.420 4.801 24.566 16.181 1.518 possible 7307 36 R VAL CB 4 C4H1b 0.770 1.880 12.556 -1.000 14.598 -1.000 bad 7308 36 R VAL CG1 10 C4H3u 0.770 1.880 24.253 -1.000 36.584 -1.000 bad 7309 36 R VAL CG2 10 C4H3u 0.770 1.880 7.175 74.307 36.332 2.045 possible 7310 37 R ALA N 12 N3H1s 0.700 1.640 3.188 13.438 14.046 0.957 possible 7311 37 R ALA CA 4 C4H1b 0.770 1.880 4.856 24.554 14.063 1.746 possible 7312 37 R ALA C 1 C3H0s 0.770 1.610 2.460 8.570 8.900 0.963 [OK] 7313 37 R ALA O 16 O1H0u 0.660 1.420 2.705 14.762 16.188 0.912 [OK] 7314 37 R ALA CB 10 C4H3u 0.770 1.880 4.762 52.872 36.782 1.437 possible 7315 38 R THR N 12 N3H1s 0.700 1.640 2.537 12.225 13.832 0.884 [OK] 7316 38 R THR CA 3 C4H1s 0.770 1.880 2.795 14.672 13.099 1.120 [OK] 7317 38 R THR C 1 C3H0s 0.770 1.610 2.843 7.917 8.738 0.906 [OK] 7318 38 R THR O 16 O1H0u 0.660 1.420 2.709 15.577 16.020 0.972 [OK] 7319 38 R THR CB 4 C4H1b 0.770 1.880 3.408 15.889 14.829 1.071 possible 7320 38 R THR OG1 17 O2H1u 0.660 1.460 2.566 18.917 18.123 1.044 [OK] 7321 38 R THR CG2 10 C4H3u 0.770 1.880 4.661 54.452 36.542 1.490 possible 7322 39 R PHE N 12 N3H1s 0.700 1.640 3.570 15.123 13.691 1.105 possible 7323 39 R PHE CA 3 C4H1s 0.770 1.880 4.010 20.037 13.449 1.490 possible 7324 39 R PHE C 1 C3H0s 0.770 1.610 2.564 8.232 8.753 0.941 [OK] 7325 39 R PHE O 16 O1H0u 0.660 1.420 3.692 18.979 16.151 1.175 possible 7326 39 R PHE CB 8 C4H2s 0.770 1.880 3.868 27.325 23.777 1.149 possible 7327 39 R PHE CG 2 C3H0b 0.770 1.610 4.641 14.632 9.721 1.505 possible 7328 39 R PHE CD1 5 C3H1s 0.770 1.760 16.745 -1.000 20.405 -1.000 bad 7329 39 R PHE CD2 6 C3H1b 0.770 1.760 28.251 -1.000 21.051 -1.000 bad 7330 39 R PHE CE1 6 C3H1b 0.770 1.760 28.529 -1.000 21.580 -1.000 bad 7331 39 R PHE CE2 6 C3H1b 0.770 1.760 36.248 -1.000 21.680 -1.000 bad 7332 39 R PHE CZ 6 C3H1b 0.770 1.760 36.574 -1.000 21.666 -1.000 bad 7333 40 R PHE N 12 N3H1s 0.700 1.640 3.701 14.504 13.691 1.059 possible 7334 40 R PHE CA 3 C4H1s 0.770 1.880 4.734 23.173 13.449 1.723 possible 7335 40 R PHE C 1 C3H0s 0.770 1.610 2.280 7.972 8.753 0.911 [OK] 7336 40 R PHE O 16 O1H0u 0.660 1.420 3.493 17.877 16.151 1.107 possible 7337 40 R PHE CB 8 C4H2s 0.770 1.880 5.767 45.438 23.777 1.911 possible 7338 40 R PHE CG 2 C3H0b 0.770 1.610 6.971 18.824 9.721 1.936 possible 7339 40 R PHE CD1 5 C3H1s 0.770 1.760 24.869 -1.000 20.405 -1.000 bad 7340 40 R PHE CD2 6 C3H1b 0.770 1.760 7.516 40.084 21.051 1.904 possible 7341 40 R PHE CE1 6 C3H1b 0.770 1.760 30.319 -1.000 21.580 -1.000 bad 7342 40 R PHE CE2 6 C3H1b 0.770 1.760 13.895 -1.000 21.680 -1.000 bad 7343 40 R PHE CZ 6 C3H1b 0.770 1.760 22.376 -1.000 21.666 -1.000 bad 7344 41 R PHE N 12 N3H1s 0.700 1.640 2.344 12.413 13.691 0.907 [OK] 7345 41 R PHE CA 3 C4H1s 0.770 1.880 2.942 14.891 13.449 1.107 [OK] 7346 41 R PHE C 1 C3H0s 0.770 1.610 2.481 8.610 8.753 0.984 [OK] 7347 41 R PHE O 16 O1H0u 0.660 1.420 2.436 15.444 16.151 0.956 [OK] 7348 41 R PHE CB 8 C4H2s 0.770 1.880 2.652 19.732 23.777 0.830 [OK] 7349 41 R PHE CG 2 C3H0b 0.770 1.610 2.250 9.359 9.721 0.963 [OK] 7350 41 R PHE CD1 5 C3H1s 0.770 1.760 3.457 24.044 20.405 1.178 possible 7351 41 R PHE CD2 6 C3H1b 0.770 1.760 2.861 19.235 21.051 0.914 [OK] 7352 41 R PHE CE1 6 C3H1b 0.770 1.760 13.948 -1.000 21.580 -1.000 bad 7353 41 R PHE CE2 6 C3H1b 0.770 1.760 5.153 42.810 21.680 1.975 possible 7354 41 R PHE CZ 6 C3H1b 0.770 1.760 27.548 -1.000 21.666 -1.000 bad 7355 42 R ALA N 12 N3H1s 0.700 1.640 2.421 13.044 14.046 0.929 [OK] 7356 42 R ALA CA 4 C4H1b 0.770 1.880 2.600 13.383 14.063 0.952 [OK] 7357 42 R ALA C 1 C3H0s 0.770 1.610 2.573 8.546 8.900 0.960 [OK] 7358 42 R ALA O 16 O1H0u 0.660 1.420 2.289 14.023 16.188 0.866 [OK] 7359 42 R ALA CB 10 C4H3u 0.770 1.880 5.023 51.126 36.782 1.390 possible 7360 43 R ALA N 12 N3H1s 0.700 1.640 4.319 16.289 14.046 1.160 possible 7361 43 R ALA CA 4 C4H1b 0.770 1.880 4.865 24.019 14.063 1.708 possible 7362 43 R ALA C 1 C3H0s 0.770 1.610 2.624 8.369 8.900 0.940 [OK] 7363 43 R ALA O 16 O1H0u 0.660 1.420 3.695 16.252 16.188 1.004 possible 7364 43 R ALA CB 10 C4H3u 0.770 1.880 7.328 116.675 36.782 3.172 possible 7365 44 R LEU N 12 N3H1s 0.700 1.640 4.062 16.205 13.655 1.187 possible 7366 44 R LEU CA 3 C4H1s 0.770 1.880 4.104 15.240 13.122 1.161 possible 7367 44 R LEU C 1 C3H0s 0.770 1.610 2.321 8.121 8.825 0.920 [OK] 7368 44 R LEU O 16 O1H0u 0.660 1.420 2.555 14.740 16.208 0.909 [OK] 7369 44 R LEU CB 8 C4H2s 0.770 1.880 4.326 26.538 22.951 1.156 possible 7370 44 R LEU CG 4 C4H1b 0.770 1.880 3.182 14.262 14.764 0.966 possible 7371 44 R LEU CD1 10 C4H3u 0.770 1.880 36.589 -1.000 37.425 -1.000 bad 7372 44 R LEU CD2 10 C4H3u 0.770 1.880 20.313 -1.000 37.143 -1.000 bad 7373 45 R GLY N 12 N3H1s 0.700 1.640 2.325 12.927 14.854 0.870 [OK] 7374 45 R GLY CA 8 C4H2s 0.770 1.880 2.900 24.987 23.688 1.055 [OK] 7375 45 R GLY C 2 C3H0b 0.770 1.610 2.552 9.990 9.840 1.015 [OK] 7376 45 R GLY O 16 O1H0u 0.660 1.420 2.373 15.161 16.391 0.925 [OK] 7377 46 R ILE N 12 N3H1s 0.700 1.640 2.594 12.664 13.633 0.929 [OK] 7378 46 R ILE CA 3 C4H1s 0.770 1.880 3.360 14.370 13.007 1.105 possible 7379 46 R ILE C 1 C3H0s 0.770 1.610 2.880 8.337 8.470 0.984 [OK] 7380 46 R ILE O 16 O1H0u 0.660 1.420 3.900 20.349 16.144 1.260 possible 7381 46 R ILE CB 4 C4H1b 0.770 1.880 3.305 14.983 14.227 1.053 possible 7382 46 R ILE CG1 9 C4H2b 0.770 1.880 3.283 23.025 24.187 0.952 possible 7383 46 R ILE CG2 10 C4H3u 0.770 1.880 47.395 -1.000 35.961 -1.000 bad 7384 46 R ILE CD1 10 C4H3u 0.770 1.880 27.228 -1.000 38.377 -1.000 bad 7385 47 R ILE N 12 N3H1s 0.700 1.640 3.110 13.496 13.633 0.990 possible 7386 47 R ILE CA 3 C4H1s 0.770 1.880 4.098 18.761 13.007 1.442 possible 7387 47 R ILE C 1 C3H0s 0.770 1.610 2.664 7.819 8.470 0.923 [OK] 7388 47 R ILE O 16 O1H0u 0.660 1.420 4.504 20.358 16.144 1.261 possible 7389 47 R ILE CB 4 C4H1b 0.770 1.880 2.845 13.762 14.227 0.967 [OK] 7390 47 R ILE CG1 9 C4H2b 0.770 1.880 22.160 -1.000 24.187 -1.000 bad 7391 47 R ILE CG2 10 C4H3u 0.770 1.880 38.032 -1.000 35.961 -1.000 bad 7392 47 R ILE CD1 10 C4H3u 0.770 1.880 44.691 -1.000 38.377 -1.000 bad 7393 48 R LEU N 12 N3H1s 0.700 1.640 2.683 13.091 13.655 0.959 [OK] 7394 48 R LEU CA 3 C4H1s 0.770 1.880 3.246 14.757 13.122 1.125 possible 7395 48 R LEU C 1 C3H0s 0.770 1.610 2.179 8.443 8.825 0.957 [OK] 7396 48 R LEU O 16 O1H0u 0.660 1.420 2.521 15.532 16.208 0.958 [OK] 7397 48 R LEU CB 8 C4H2s 0.770 1.880 2.858 20.820 22.951 0.907 [OK] 7398 48 R LEU CG 4 C4H1b 0.770 1.880 2.976 13.673 14.764 0.926 [OK] 7399 48 R LEU CD1 10 C4H3u 0.770 1.880 3.561 36.839 37.425 0.984 possible 7400 48 R LEU CD2 10 C4H3u 0.770 1.880 7.792 103.681 37.143 2.791 possible 7401 49 R ILE N 12 N3H1s 0.700 1.640 2.285 12.721 13.633 0.933 [OK] 7402 49 R ILE CA 3 C4H1s 0.770 1.880 2.644 13.686 13.007 1.052 [OK] 7403 49 R ILE C 1 C3H0s 0.770 1.610 2.826 8.157 8.470 0.963 [OK] 7404 49 R ILE O 16 O1H0u 0.660 1.420 2.820 16.199 16.144 1.003 [OK] 7405 49 R ILE CB 4 C4H1b 0.770 1.880 3.590 15.631 14.227 1.099 possible 7406 49 R ILE CG1 9 C4H2b 0.770 1.880 3.321 23.544 24.187 0.973 possible 7407 49 R ILE CG2 10 C4H3u 0.770 1.880 5.138 81.074 35.961 2.254 possible 7408 49 R ILE CD1 10 C4H3u 0.770 1.880 4.033 49.087 38.377 1.279 possible 7409 50 R ALA N 12 N3H1s 0.700 1.640 4.062 15.668 14.046 1.115 possible 7410 50 R ALA CA 4 C4H1b 0.770 1.880 4.515 18.887 14.063 1.343 possible 7411 50 R ALA C 1 C3H0s 0.770 1.610 3.865 9.309 8.900 1.046 possible 7412 50 R ALA O 16 O1H0u 0.660 1.420 3.425 15.214 16.188 0.940 possible 7413 50 R ALA CB 10 C4H3u 0.770 1.880 33.766 -1.000 36.782 -1.000 bad 7414 51 R TRP N 12 N3H1s 0.700 1.640 5.112 16.594 13.791 1.203 possible 7415 51 R TRP CA 3 C4H1s 0.770 1.880 5.480 16.253 13.377 1.215 possible 7416 51 R TRP C 1 C3H0s 0.770 1.610 2.639 8.839 8.724 1.013 [OK] 7417 51 R TRP O 16 O1H0u 0.660 1.420 2.466 15.088 15.951 0.946 [OK] 7418 51 R TRP CB 8 C4H2s 0.770 1.880 5.433 35.830 24.004 1.493 possible 7419 51 R TRP CG 2 C3H0b 0.770 1.610 5.284 16.166 9.965 1.622 possible 7420 51 R TRP CD1 5 C3H1s 0.770 1.760 12.450 -1.000 20.874 -1.000 bad 7421 51 R TRP CD2 2 C3H0b 0.770 1.610 5.940 17.693 10.097 1.752 possible 7422 51 R TRP NE1 13 N3H1b 0.700 1.640 17.832 -1.000 16.969 -1.000 bad 7423 51 R TRP CE2 2 C3H0b 0.770 1.610 1.579 -1.000 9.889 -1.000 bad 7424 51 R TRP CE3 6 C3H1b 0.770 1.760 6.179 32.171 20.448 1.573 possible 7425 51 R TRP CZ2 6 C3H1b 0.770 1.760 28.600 -1.000 21.012 -1.000 bad 7426 51 R TRP CZ3 6 C3H1b 0.770 1.760 10.119 -1.000 21.516 -1.000 bad 7427 51 R TRP CH2 6 C3H1b 0.770 1.760 19.244 -1.000 21.339 -1.000 bad 7428 52 R SER N 12 N3H1s 0.700 1.640 2.560 12.723 14.103 0.902 [OK] 7429 52 R SER CA 3 C4H1s 0.770 1.880 4.221 18.155 13.476 1.347 possible 7430 52 R SER C 1 C3H0s 0.770 1.610 2.964 9.089 8.923 1.019 [OK] 7431 52 R SER O 16 O1H0u 0.660 1.420 4.326 22.948 16.179 1.418 possible 7432 52 R SER CB 8 C4H2s 0.770 1.880 4.890 39.206 23.884 1.642 possible 7433 52 R SER OG 17 O2H1u 0.660 1.460 3.955 22.763 18.732 1.215 possible 7434 53 R ALA N 12 N3H1s 0.700 1.640 2.803 13.728 14.046 0.977 [OK] 7435 53 R ALA CA 4 C4H1b 0.770 1.880 3.009 16.298 14.063 1.159 possible 7436 53 R ALA C 1 C3H0s 0.770 1.610 2.619 8.918 8.900 1.002 [OK] 7437 53 R ALA O 16 O1H0u 0.660 1.420 2.450 15.232 16.188 0.941 [OK] 7438 53 R ALA CB 10 C4H3u 0.770 1.880 3.214 34.231 36.782 0.931 possible 7439 54 R VAL N 12 N3H1s 0.700 1.640 2.571 13.381 13.676 0.978 [OK] 7440 54 R VAL CA 3 C4H1s 0.770 1.880 2.685 12.644 13.123 0.963 [OK] 7441 54 R VAL C 1 C3H0s 0.770 1.610 2.745 7.866 8.563 0.919 [OK] 7442 54 R VAL O 16 O1H0u 0.660 1.420 11.082 -1.000 16.181 -1.000 bad 7443 54 R VAL CB 4 C4H1b 0.770 1.880 2.728 12.922 14.598 0.885 [OK] 7444 54 R VAL CG1 10 C4H3u 0.770 1.880 40.168 -1.000 36.584 -1.000 bad 7445 54 R VAL CG2 10 C4H3u 0.770 1.880 22.511 -1.000 36.332 -1.000 bad 7446 55 R LEU N 12 N3H1s 0.700 1.640 2.757 13.346 13.655 0.977 [OK] 7447 55 R LEU CA 3 C4H1s 0.770 1.880 4.992 18.223 13.122 1.389 possible 7448 55 R LEU C 1 C3H0s 0.770 1.610 3.352 9.629 8.825 1.091 possible 7449 55 R LEU O 16 O1H0u 0.660 1.420 20.787 -1.000 16.208 -1.000 bad 7450 55 R LEU CB 8 C4H2s 0.770 1.880 4.658 34.861 22.951 1.519 possible 7451 55 R LEU CG 4 C4H1b 0.770 1.880 3.061 16.173 14.764 1.095 possible 7452 55 R LEU CD1 10 C4H3u 0.770 1.880 5.136 57.127 37.425 1.526 possible 7453 55 R LEU CD2 10 C4H3u 0.770 1.880 50.234 -1.000 37.143 -1.000 bad 7454 56 R GLN N 12 N3H1s 0.700 1.640 3.692 13.290 13.616 0.976 possible 7455 56 R GLN CA 3 C4H1s 0.770 1.880 3.209 12.904 13.334 0.968 possible 7456 56 R GLN C 1 C3H0s 0.770 1.610 3.645 10.469 8.787 1.191 possible 7457 56 R GLN O 16 O1H0u 0.660 1.420 24.032 -1.000 15.993 -1.000 bad 7458 56 R GLN CB 8 C4H2s 0.770 1.880 4.591 26.327 23.275 1.131 possible 7459 56 R GLN CG 8 C4H2s 0.770 1.880 6.091 55.296 23.465 2.357 possible 7460 56 R GLN CD 2 C3H0b 0.770 1.610 3.488 12.152 9.659 1.258 possible 7461 56 R GLN OE1 16 O1H0u 0.660 1.420 3.198 22.646 17.091 1.325 possible 7462 56 R GLN NE2 15 N3H2u 0.700 1.640 7.858 68.531 24.150 2.838 possible 7463 57 R GLY N 12 N3H1s 0.700 1.640 3.669 14.146 14.854 0.952 possible 7464 57 R GLY CA 8 C4H2s 0.770 1.880 27.578 -1.000 23.688 -1.000 bad 7465 57 R GLY C 2 C3H0b 0.770 1.610 3.537 12.056 9.840 1.225 possible 7466 57 R GLY O 16 O1H0u 0.660 1.420 31.468 -1.000 16.391 -1.000 bad 7467 58 R THR N 12 N3H1s 0.700 1.640 3.133 16.006 13.832 1.157 possible 7468 58 R THR CA 3 C4H1s 0.770 1.880 5.397 19.832 13.099 1.514 possible 7469 58 R THR C 1 C3H0s 0.770 1.610 2.587 8.905 8.738 1.019 [OK] 7470 58 R THR O 16 O1H0u 0.660 1.420 2.453 17.371 16.020 1.084 [OK] 7471 58 R THR CB 4 C4H1b 0.770 1.880 5.946 27.346 14.829 1.844 possible 7472 58 R THR OG1 17 O2H1u 0.660 1.460 10.710 -1.000 18.123 -1.000 bad 7473 58 R THR CG2 10 C4H3u 0.770 1.880 3.914 40.123 36.542 1.098 possible 7474 59 R TRP N 12 N3H1s 0.700 1.640 3.853 -1.000 13.791 -1.000 bad 7475 59 R TRP CA 3 C4H1s 0.770 1.880 2.726 13.891 13.377 1.038 [OK] 7476 59 R TRP C 1 C3H0s 0.770 1.610 4.757 10.942 8.724 1.254 possible 7477 59 R TRP O 16 O1H0u 0.660 1.420 12.078 -1.000 15.951 -1.000 bad 7478 59 R TRP CB 8 C4H2s 0.770 1.880 27.860 -1.000 24.004 -1.000 bad 7479 59 R TRP CG 2 C3H0b 0.770 1.610 1.084 -1.000 9.965 -1.000 bad 7480 59 R TRP CD1 5 C3H1s 0.770 1.760 26.468 -1.000 20.874 -1.000 bad 7481 59 R TRP CD2 2 C3H0b 0.770 1.610 1.807 -1.000 10.097 -1.000 bad 7482 59 R TRP NE1 13 N3H1b 0.700 1.640 12.067 -1.000 16.969 -1.000 bad 7483 59 R TRP CE2 2 C3H0b 0.770 1.610 1.673 -1.000 9.889 -1.000 bad 7484 59 R TRP CE3 6 C3H1b 0.770 1.760 15.973 -1.000 20.448 -1.000 bad 7485 59 R TRP CZ2 6 C3H1b 0.770 1.760 13.610 -1.000 21.012 -1.000 bad 7486 59 R TRP CZ3 6 C3H1b 0.770 1.760 13.598 -1.000 21.516 -1.000 bad 7487 59 R TRP CH2 6 C3H1b 0.770 1.760 12.270 -1.000 21.339 -1.000 bad 7488 60 R ASN N 12 N3H1s 0.700 1.640 6.057 25.504 13.695 1.862 possible 7489 60 R ASN CA 3 C4H1s 0.770 1.880 5.870 -1.000 13.167 -1.000 bad 7490 60 R ASN C 1 C3H0s 0.770 1.610 2.275 8.206 8.928 0.919 [OK] 7491 60 R ASN O 16 O1H0u 0.660 1.420 2.360 15.042 16.199 0.929 [OK] 7492 60 R ASN CB 8 C4H2s 0.770 1.880 13.250 -1.000 23.128 -1.000 bad 7493 60 R ASN CG 2 C3H0b 0.770 1.610 5.802 14.824 9.599 1.544 possible 7494 60 R ASN OD1 16 O1H0u 0.660 1.420 7.628 29.327 16.664 1.760 possible 7495 60 R ASN ND2 15 N3H2u 0.700 1.640 42.077 -1.000 23.083 -1.000 bad 7496 61 R PRO N 11 N3H0u 0.700 1.640 2.712 8.668 8.823 0.982 [OK] 7497 61 R PRO CA 4 C4H1b 0.770 1.880 4.802 18.693 13.955 1.340 possible 7498 61 R PRO C 1 C3H0s 0.770 1.610 2.539 8.885 8.812 1.008 [OK] 7499 61 R PRO O 16 O1H0u 0.660 1.420 4.427 30.814 16.169 1.906 possible 7500 61 R PRO CB 9 C4H2b 0.770 1.880 18.761 -1.000 25.563 -1.000 bad 7501 61 R PRO CG 9 C4H2b 0.770 1.880 41.257 -1.000 25.832 -1.000 bad 7502 61 R PRO CD 8 C4H2s 0.770 1.880 19.722 -1.000 23.836 -1.000 bad 7503 62 R GLN N 12 N3H1s 0.700 1.640 2.553 13.200 13.616 0.969 [OK] 7504 62 R GLN CA 3 C4H1s 0.770 1.880 2.891 15.382 13.334 1.154 [OK] 7505 62 R GLN C 1 C3H0s 0.770 1.610 2.657 8.779 8.787 0.999 [OK] 7506 62 R GLN O 16 O1H0u 0.660 1.420 3.787 27.578 15.993 1.724 possible 7507 62 R GLN CB 8 C4H2s 0.770 1.880 7.153 41.365 23.275 1.777 possible 7508 62 R GLN CG 8 C4H2s 0.770 1.880 20.589 -1.000 23.465 -1.000 bad 7509 62 R GLN CD 2 C3H0b 0.770 1.610 1.584 -1.000 9.659 -1.000 bad 7510 62 R GLN OE1 16 O1H0u 0.660 1.420 6.873 83.444 17.091 4.882 possible 7511 62 R GLN NE2 15 N3H2u 0.700 1.640 32.092 -1.000 24.150 -1.000 bad 7512 63 R LEU N 12 N3H1s 0.700 1.640 2.443 12.681 13.655 0.929 [OK] 7513 63 R LEU CA 3 C4H1s 0.770 1.880 3.845 15.234 13.122 1.161 possible 7514 63 R LEU C 1 C3H0s 0.770 1.610 2.721 9.666 8.825 1.095 [OK] 7515 63 R LEU O 16 O1H0u 0.660 1.420 3.362 23.691 16.208 1.462 possible 7516 63 R LEU CB 8 C4H2s 0.770 1.880 4.205 24.799 22.951 1.081 possible 7517 63 R LEU CG 4 C4H1b 0.770 1.880 4.007 16.700 14.764 1.131 possible 7518 63 R LEU CD1 10 C4H3u 0.770 1.880 31.749 -1.000 37.425 -1.000 bad 7519 63 R LEU CD2 10 C4H3u 0.770 1.880 57.196 -1.000 37.143 -1.000 bad 7520 64 R ILE N 12 N3H1s 0.700 1.640 2.550 14.847 13.633 1.089 [OK] 7521 64 R ILE CA 3 C4H1s 0.770 1.880 2.836 12.873 13.007 0.990 [OK] 7522 64 R ILE C 1 C3H0s 0.770 1.610 2.931 8.682 8.470 1.025 [OK] 7523 64 R ILE O 16 O1H0u 0.660 1.420 4.058 26.061 16.144 1.614 possible 7524 64 R ILE CB 4 C4H1b 0.770 1.880 4.830 24.252 14.227 1.705 possible 7525 64 R ILE CG1 9 C4H2b 0.770 1.880 2.886 23.787 24.187 0.983 [OK] 7526 64 R ILE CG2 10 C4H3u 0.770 1.880 3.907 44.323 35.961 1.233 possible 7527 64 R ILE CD1 10 C4H3u 0.770 1.880 7.144 90.915 38.377 2.369 possible 7528 65 R SER N 12 N3H1s 0.700 1.640 2.961 15.306 14.103 1.085 [OK] 7529 65 R SER CA 3 C4H1s 0.770 1.880 2.915 12.696 13.476 0.942 [OK] 7530 65 R SER C 1 C3H0s 0.770 1.610 2.882 9.766 8.923 1.094 [OK] 7531 65 R SER O 16 O1H0u 0.660 1.420 4.273 37.603 16.179 2.324 possible 7532 65 R SER CB 8 C4H2s 0.770 1.880 3.178 25.554 23.884 1.070 possible 7533 65 R SER OG 17 O2H1u 0.660 1.460 2.423 19.093 18.732 1.019 [OK] 7534 66 R VAL N 12 N3H1s 0.700 1.640 2.819 14.466 13.676 1.058 [OK] 7535 66 R VAL CA 3 C4H1s 0.770 1.880 4.638 17.459 13.123 1.330 possible 7536 66 R VAL C 1 C3H0s 0.770 1.610 2.583 9.090 8.563 1.062 [OK] 7537 66 R VAL O 16 O1H0u 0.660 1.420 2.445 16.184 16.181 1.000 [OK] 7538 66 R VAL CB 4 C4H1b 0.770 1.880 2.940 14.739 14.598 1.010 [OK] 7539 66 R VAL CG1 10 C4H3u 0.770 1.880 4.497 42.830 36.584 1.171 possible 7540 66 R VAL CG2 10 C4H3u 0.770 1.880 3.360 42.735 36.332 1.176 possible 7541 67 R TYR N 12 N3H1s 0.700 1.640 4.259 25.274 13.691 1.846 possible 7542 67 R TYR CA 3 C4H1s 0.770 1.880 2.599 12.054 13.330 0.904 [OK] 7543 67 R TYR C 1 C3H0s 0.770 1.610 2.278 8.628 8.770 0.984 [OK] 7544 67 R TYR O 16 O1H0u 0.660 1.420 3.650 24.060 16.124 1.492 possible 7545 67 R TYR CB 8 C4H2s 0.770 1.880 6.625 61.338 23.678 2.591 possible 7546 67 R TYR CG 2 C3H0b 0.770 1.610 0.462 -1.000 9.732 -1.000 bad 7547 67 R TYR CD1 5 C3H1s 0.770 1.760 14.113 -1.000 20.171 -1.000 bad 7548 67 R TYR CD2 5 C3H1s 0.770 1.760 12.548 -1.000 20.728 -1.000 bad 7549 67 R TYR CE1 5 C3H1s 0.770 1.760 12.641 -1.000 20.675 -1.000 bad 7550 67 R TYR CE2 5 C3H1s 0.770 1.760 21.720 -1.000 20.810 -1.000 bad 7551 67 R TYR CZ 2 C3H0b 0.770 1.610 1.858 -1.000 9.926 -1.000 bad 7552 67 R TYR OH 17 O2H1u 0.660 1.460 16.454 -1.000 19.173 -1.000 bad 7553 68 R PRO N 11 N3H0u 0.700 1.640 2.788 8.679 8.823 0.984 [OK] 7554 68 R PRO CA 4 C4H1b 0.770 1.880 2.619 12.562 13.955 0.900 [OK] 7555 68 R PRO C 1 C3H0s 0.770 1.610 2.524 8.932 8.812 1.014 [OK] 7556 68 R PRO O 16 O1H0u 0.660 1.420 4.681 37.671 16.169 2.330 possible 7557 68 R PRO CB 9 C4H2b 0.770 1.880 3.612 25.647 25.563 1.003 possible 7558 68 R PRO CG 9 C4H2b 0.770 1.880 2.670 23.391 25.832 0.906 [OK] 7559 68 R PRO CD 8 C4H2s 0.770 1.880 3.581 25.811 23.836 1.083 possible 7560 69 R PRO N 11 N3H0u 0.700 1.640 2.472 8.053 8.823 0.913 [OK] 7561 69 R PRO CA 4 C4H1b 0.770 1.880 2.717 13.848 13.955 0.992 [OK] 7562 69 R PRO C 1 C3H0s 0.770 1.610 2.752 8.625 8.812 0.979 [OK] 7563 69 R PRO O 16 O1H0u 0.660 1.420 3.708 20.108 16.169 1.244 possible 7564 69 R PRO CB 9 C4H2b 0.770 1.880 3.447 28.007 25.563 1.096 possible 7565 69 R PRO CG 9 C4H2b 0.770 1.880 3.141 25.406 25.832 0.984 possible 7566 69 R PRO CD 8 C4H2s 0.770 1.880 2.882 23.500 23.836 0.986 [OK] 7567 70 R ALA N 12 N3H1s 0.700 1.640 4.150 21.632 14.046 1.540 possible 7568 70 R ALA CA 4 C4H1b 0.770 1.880 6.539 37.563 14.063 2.671 possible 7569 70 R ALA C 1 C3H0s 0.770 1.610 2.589 8.281 8.900 0.930 [OK] 7570 70 R ALA O 16 O1H0u 0.660 1.420 2.938 17.145 16.188 1.059 [OK] 7571 70 R ALA CB 10 C4H3u 0.770 1.880 37.743 -1.000 36.782 -1.000 bad 7572 71 R LEU N 12 N3H1s 0.700 1.640 4.044 21.076 13.655 1.543 possible 7573 71 R LEU CA 3 C4H1s 0.770 1.880 3.204 14.767 13.122 1.125 possible 7574 71 R LEU C 1 C3H0s 0.770 1.610 4.027 9.697 8.825 1.099 possible 7575 71 R LEU O 16 O1H0u 0.660 1.420 12.269 -1.000 16.208 -1.000 bad 7576 71 R LEU CB 8 C4H2s 0.770 1.880 10.597 -1.000 22.951 -1.000 bad 7577 71 R LEU CG 4 C4H1b 0.770 1.880 6.693 33.430 14.764 2.264 possible 7578 71 R LEU CD1 10 C4H3u 0.770 1.880 54.244 -1.000 37.425 -1.000 bad 7579 71 R LEU CD2 10 C4H3u 0.770 1.880 3.782 38.406 37.143 1.034 possible 7580 72 R GLU N 12 N3H1s 0.700 1.640 3.701 13.414 13.615 0.985 possible 7581 72 R GLU CA 3 C4H1s 0.770 1.880 10.150 -1.000 13.399 -1.000 bad 7582 72 R GLU C 1 C3H0s 0.770 1.610 3.167 9.598 8.675 1.106 possible 7583 72 R GLU O 16 O1H0u 0.660 1.420 32.158 -1.000 16.023 -1.000 bad 7584 72 R GLU CB 8 C4H2s 0.770 1.880 21.665 -1.000 23.529 -1.000 bad 7585 72 R GLU CG 8 C4H2s 0.770 1.880 39.184 -1.000 23.513 -1.000 bad 7586 72 R GLU CD 2 C3H0b 0.770 1.610 3.402 -1.000 9.460 -1.000 bad 7587 72 R GLU OE1 16 O1H0u 0.660 1.420 26.376 -1.000 15.999 -1.000 bad 7588 72 R GLU OE2 16 O1H0u 0.660 1.420 21.932 -1.000 17.432 -1.000 bad 7589 73 R TYR N 12 N3H1s 0.700 1.640 2.919 13.637 13.691 0.996 [OK] 7590 73 R TYR CA 3 C4H1s 0.770 1.880 4.699 16.944 13.330 1.271 possible 7591 73 R TYR C 1 C3H0s 0.770 1.610 3.505 10.070 8.770 1.148 possible 7592 73 R TYR O 16 O1H0u 0.660 1.420 14.373 -1.000 16.124 -1.000 bad 7593 73 R TYR CB 8 C4H2s 0.770 1.880 3.267 29.571 23.678 1.249 possible 7594 73 R TYR CG 2 C3H0b 0.770 1.610 2.905 10.159 9.732 1.044 [OK] 7595 73 R TYR CD1 5 C3H1s 0.770 1.760 9.315 -1.000 20.171 -1.000 bad 7596 73 R TYR CD2 5 C3H1s 0.770 1.760 3.041 18.860 20.728 0.910 possible 7597 73 R TYR CE1 5 C3H1s 0.770 1.760 19.934 -1.000 20.675 -1.000 bad 7598 73 R TYR CE2 5 C3H1s 0.770 1.760 4.245 31.446 20.810 1.511 possible 7599 73 R TYR CZ 2 C3H0b 0.770 1.610 4.300 13.797 9.926 1.390 possible 7600 73 R TYR OH 17 O2H1u 0.660 1.460 7.689 77.534 19.173 4.044 possible 7601 74 R GLY N 12 N3H1s 0.700 1.640 3.831 19.136 14.854 1.288 possible 7602 74 R GLY CA 8 C4H2s 0.770 1.880 19.471 -1.000 23.688 -1.000 bad 7603 74 R GLY C 2 C3H0b 0.770 1.610 2.253 8.674 9.840 0.882 [OK] 7604 74 R GLY O 16 O1H0u 0.660 1.420 2.988 19.205 16.391 1.172 [OK] 7605 75 R LEU N 12 N3H1s 0.700 1.640 4.086 -1.000 13.655 -1.000 bad 7606 75 R LEU CA 3 C4H1s 0.770 1.880 2.435 11.587 13.122 0.883 [OK] 7607 75 R LEU C 1 C3H0s 0.770 1.610 5.680 11.541 8.825 1.308 possible 7608 75 R LEU O 16 O1H0u 0.660 1.420 21.763 -1.000 16.208 -1.000 bad 7609 75 R LEU CB 8 C4H2s 0.770 1.880 17.088 -1.000 22.951 -1.000 bad 7610 75 R LEU CG 4 C4H1b 0.770 1.880 4.211 15.025 14.764 1.018 possible 7611 75 R LEU CD1 10 C4H3u 0.770 1.880 35.953 -1.000 37.425 -1.000 bad 7612 75 R LEU CD2 10 C4H3u 0.770 1.880 3.559 36.889 37.143 0.993 possible 7613 76 R GLY N 12 N3H1s 0.700 1.640 3.047 -1.000 14.854 -1.000 bad 7614 76 R GLY CA 8 C4H2s 0.770 1.880 32.035 -1.000 23.688 -1.000 bad 7615 76 R GLY C 2 C3H0b 0.770 1.610 4.544 13.446 9.840 1.366 possible 7616 76 R GLY O 16 O1H0u 0.660 1.420 4.218 23.031 16.391 1.405 possible 7617 77 R GLY N 12 N3H1s 0.700 1.640 13.974 -1.000 14.854 -1.000 bad 7618 77 R GLY CA 8 C4H2s 0.770 1.880 29.296 -1.000 23.688 -1.000 bad 7619 77 R GLY C 2 C3H0b 0.770 1.610 7.534 16.813 9.840 1.709 possible 7620 77 R GLY O 16 O1H0u 0.660 1.420 16.099 -1.000 16.391 -1.000 bad 7621 78 R ALA N 12 N3H1s 0.700 1.640 3.390 17.283 14.046 1.230 possible 7622 78 R ALA CA 4 C4H1b 0.770 1.880 2.917 12.912 14.063 0.918 [OK] 7623 78 R ALA C 1 C3H0s 0.770 1.610 5.749 11.994 8.900 1.348 possible 7624 78 R ALA O 16 O1H0u 0.660 1.420 11.890 -1.000 16.188 -1.000 bad 7625 78 R ALA CB 10 C4H3u 0.770 1.880 3.070 33.737 36.782 0.917 possible 7626 79 R PRO N 11 N3H0u 0.700 1.640 6.488 13.307 8.823 1.508 possible 7627 79 R PRO CA 4 C4H1b 0.770 1.880 11.363 -1.000 13.955 -1.000 bad 7628 79 R PRO C 1 C3H0s 0.770 1.610 2.583 8.610 8.812 0.977 [OK] 7629 79 R PRO O 16 O1H0u 0.660 1.420 2.266 13.095 16.169 0.810 [OK] 7630 79 R PRO CB 9 C4H2b 0.770 1.880 18.901 -1.000 25.563 -1.000 bad 7631 79 R PRO CG 9 C4H2b 0.770 1.880 29.391 -1.000 25.832 -1.000 bad 7632 79 R PRO CD 8 C4H2s 0.770 1.880 6.248 39.068 23.836 1.639 possible 7633 80 R LEU N 12 N3H1s 0.700 1.640 5.491 30.122 13.655 2.206 possible 7634 80 R LEU CA 3 C4H1s 0.770 1.880 2.560 12.008 13.122 0.915 [OK] 7635 80 R LEU C 1 C3H0s 0.770 1.610 2.845 8.932 8.825 1.012 [OK] 7636 80 R LEU O 16 O1H0u 0.660 1.420 3.632 21.207 16.208 1.308 possible 7637 80 R LEU CB 8 C4H2s 0.770 1.880 7.237 42.904 22.951 1.869 possible 7638 80 R LEU CG 4 C4H1b 0.770 1.880 9.070 -1.000 14.764 -1.000 bad 7639 80 R LEU CD1 10 C4H3u 0.770 1.880 40.394 -1.000 37.425 -1.000 bad 7640 80 R LEU CD2 10 C4H3u 0.770 1.880 20.239 -1.000 37.143 -1.000 bad 7641 81 R ALA N 12 N3H1s 0.700 1.640 5.740 25.536 14.046 1.818 possible 7642 81 R ALA CA 4 C4H1b 0.770 1.880 4.142 20.871 14.063 1.484 possible 7643 81 R ALA C 1 C3H0s 0.770 1.610 3.071 9.318 8.900 1.047 possible 7644 81 R ALA O 16 O1H0u 0.660 1.420 7.653 89.381 16.188 5.521 possible 7645 81 R ALA CB 10 C4H3u 0.770 1.880 42.604 -1.000 36.782 -1.000 bad 7646 82 R LYS N 12 N3H1s 0.700 1.640 2.955 13.153 13.675 0.962 [OK] 7647 82 R LYS CA 3 C4H1s 0.770 1.880 7.695 34.563 13.324 2.594 possible 7648 82 R LYS C 1 C3H0s 0.770 1.610 4.776 14.007 8.759 1.599 possible 7649 82 R LYS O 16 O1H0u 0.660 1.420 4.526 25.729 16.049 1.603 possible 7650 82 R LYS CB 8 C4H2s 0.770 1.880 5.570 30.268 22.904 1.322 possible 7651 82 R LYS CG 8 C4H2s 0.770 1.880 15.933 -1.000 23.131 -1.000 bad 7652 82 R LYS CD 8 C4H2s 0.770 1.880 7.458 -1.000 23.837 -1.000 bad 7653 82 R LYS CE 9 C4H2b 0.770 1.880 36.700 -1.000 23.934 -1.000 bad 7654 82 R LYS NZ 14 N4H3u 0.700 1.640 49.663 -1.000 21.213 -1.000 bad 7655 83 R GLY N 12 N3H1s 0.700 1.640 3.660 21.396 14.854 1.440 possible 7656 83 R GLY CA 8 C4H2s 0.770 1.880 3.809 25.555 23.688 1.079 possible 7657 83 R GLY C 2 C3H0b 0.770 1.610 3.153 10.594 9.840 1.077 possible 7658 83 R GLY O 16 O1H0u 0.660 1.420 2.645 15.893 16.391 0.970 [OK] 7659 84 R GLY N 12 N3H1s 0.700 1.640 2.582 13.384 14.854 0.901 [OK] 7660 84 R GLY CA 8 C4H2s 0.770 1.880 3.842 26.385 23.688 1.114 possible 7661 84 R GLY C 2 C3H0b 0.770 1.610 2.671 9.288 9.840 0.944 [OK] 7662 84 R GLY O 16 O1H0u 0.660 1.420 3.160 16.910 16.391 1.032 possible 7663 85 R LEU N 12 N3H1s 0.700 1.640 3.048 13.706 13.655 1.004 possible 7664 85 R LEU CA 3 C4H1s 0.770 1.880 2.689 12.541 13.122 0.956 [OK] 7665 85 R LEU C 1 C3H0s 0.770 1.610 2.344 8.463 8.825 0.959 [OK] 7666 85 R LEU O 16 O1H0u 0.660 1.420 2.447 14.326 16.208 0.884 [OK] 7667 85 R LEU CB 8 C4H2s 0.770 1.880 4.332 28.449 22.951 1.240 possible 7668 85 R LEU CG 4 C4H1b 0.770 1.880 2.927 16.582 14.764 1.123 [OK] 7669 85 R LEU CD1 10 C4H3u 0.770 1.880 4.034 40.001 37.425 1.069 possible 7670 85 R LEU CD2 10 C4H3u 0.770 1.880 4.000 43.358 37.143 1.167 possible 7671 86 R TRP N 12 N3H1s 0.700 1.640 3.539 16.375 13.791 1.187 possible 7672 86 R TRP CA 3 C4H1s 0.770 1.880 2.914 13.978 13.377 1.045 [OK] 7673 86 R TRP C 1 C3H0s 0.770 1.610 2.014 7.614 8.724 0.873 [OK] 7674 86 R TRP O 16 O1H0u 0.660 1.420 2.446 14.629 15.951 0.917 [OK] 7675 86 R TRP CB 8 C4H2s 0.770 1.880 2.902 21.564 24.004 0.898 [OK] 7676 86 R TRP CG 2 C3H0b 0.770 1.610 2.369 9.364 9.965 0.940 [OK] 7677 86 R TRP CD1 5 C3H1s 0.770 1.760 2.644 20.275 20.874 0.971 [OK] 7678 86 R TRP CD2 2 C3H0b 0.770 1.610 2.309 9.545 10.097 0.945 [OK] 7679 86 R TRP NE1 13 N3H1b 0.700 1.640 2.430 15.516 16.969 0.914 [OK] 7680 86 R TRP CE2 2 C3H0b 0.770 1.610 2.325 9.280 9.889 0.938 [OK] 7681 86 R TRP CE3 6 C3H1b 0.770 1.760 2.772 19.506 20.448 0.954 [OK] 7682 86 R TRP CZ2 6 C3H1b 0.770 1.760 2.707 19.106 21.012 0.909 [OK] 7683 86 R TRP CZ3 6 C3H1b 0.770 1.760 3.647 27.628 21.516 1.284 possible 7684 86 R TRP CH2 6 C3H1b 0.770 1.760 2.914 20.714 21.339 0.971 [OK] 7685 87 R GLN N 12 N3H1s 0.700 1.640 2.488 12.388 13.616 0.910 [OK] 7686 87 R GLN CA 3 C4H1s 0.770 1.880 3.946 16.447 13.334 1.233 possible 7687 87 R GLN C 1 C3H0s 0.770 1.610 3.216 9.256 8.787 1.053 possible 7688 87 R GLN O 16 O1H0u 0.660 1.420 3.393 18.397 15.993 1.150 possible 7689 87 R GLN CB 8 C4H2s 0.770 1.880 5.308 42.745 23.275 1.837 possible 7690 87 R GLN CG 8 C4H2s 0.770 1.880 3.578 25.745 23.465 1.097 possible 7691 87 R GLN CD 2 C3H0b 0.770 1.610 4.842 11.516 9.659 1.192 possible 7692 87 R GLN OE1 16 O1H0u 0.660 1.420 4.797 28.343 17.091 1.658 possible 7693 87 R GLN NE2 15 N3H2u 0.700 1.640 6.784 59.990 24.150 2.484 possible 7694 88 R ILE N 12 N3H1s 0.700 1.640 2.746 12.569 13.633 0.922 [OK] 7695 88 R ILE CA 3 C4H1s 0.770 1.880 3.224 14.189 13.007 1.091 possible 7696 88 R ILE C 1 C3H0s 0.770 1.610 2.246 8.265 8.470 0.976 [OK] 7697 88 R ILE O 16 O1H0u 0.660 1.420 3.012 15.235 16.144 0.944 possible 7698 88 R ILE CB 4 C4H1b 0.770 1.880 2.981 15.021 14.227 1.056 [OK] 7699 88 R ILE CG1 9 C4H2b 0.770 1.880 5.563 32.648 24.187 1.350 possible 7700 88 R ILE CG2 10 C4H3u 0.770 1.880 26.959 -1.000 35.961 -1.000 bad 7701 88 R ILE CD1 10 C4H3u 0.770 1.880 43.253 -1.000 38.377 -1.000 bad 7702 89 R ILE N 12 N3H1s 0.700 1.640 2.430 12.241 13.633 0.898 [OK] 7703 89 R ILE CA 3 C4H1s 0.770 1.880 2.724 14.024 13.007 1.078 [OK] 7704 89 R ILE C 1 C3H0s 0.770 1.610 2.524 8.509 8.470 1.005 [OK] 7705 89 R ILE O 16 O1H0u 0.660 1.420 2.586 16.241 16.144 1.006 [OK] 7706 89 R ILE CB 4 C4H1b 0.770 1.880 2.903 14.768 14.227 1.038 [OK] 7707 89 R ILE CG1 9 C4H2b 0.770 1.880 2.873 20.381 24.187 0.843 [OK] 7708 89 R ILE CG2 10 C4H3u 0.770 1.880 3.087 39.925 35.961 1.110 possible 7709 89 R ILE CD1 10 C4H3u 0.770 1.880 3.033 35.387 38.377 0.922 possible 7710 90 R THR N 12 N3H1s 0.700 1.640 2.596 12.763 13.832 0.923 [OK] 7711 90 R THR CA 3 C4H1s 0.770 1.880 2.990 14.463 13.099 1.104 [OK] 7712 90 R THR C 1 C3H0s 0.770 1.610 2.402 8.180 8.738 0.936 [OK] 7713 90 R THR O 16 O1H0u 0.660 1.420 2.313 14.718 16.020 0.919 [OK] 7714 90 R THR CB 4 C4H1b 0.770 1.880 3.812 16.474 14.829 1.111 possible 7715 90 R THR OG1 17 O2H1u 0.660 1.460 2.428 16.538 18.123 0.913 [OK] 7716 90 R THR CG2 10 C4H3u 0.770 1.880 3.952 45.953 36.542 1.258 possible 7717 91 R ILE N 12 N3H1s 0.700 1.640 2.596 13.208 13.633 0.969 [OK] 7718 91 R ILE CA 3 C4H1s 0.770 1.880 3.565 15.000 13.007 1.153 possible 7719 91 R ILE C 1 C3H0s 0.770 1.610 2.872 8.198 8.470 0.968 [OK] 7720 91 R ILE O 16 O1H0u 0.660 1.420 3.883 20.869 16.144 1.293 possible 7721 91 R ILE CB 4 C4H1b 0.770 1.880 3.585 16.235 14.227 1.141 possible 7722 91 R ILE CG1 9 C4H2b 0.770 1.880 10.335 -1.000 24.187 -1.000 bad 7723 91 R ILE CG2 10 C4H3u 0.770 1.880 45.177 -1.000 35.961 -1.000 bad 7724 91 R ILE CD1 10 C4H3u 0.770 1.880 44.879 -1.000 38.377 -1.000 bad 7725 92 R CYS N 12 N3H1s 0.700 1.640 3.226 14.034 13.981 1.004 possible 7726 92 R CYS CA 3 C4H1s 0.770 1.880 3.315 14.437 13.656 1.057 possible 7727 92 R CYS C 1 C3H0s 0.770 1.610 2.264 8.149 8.897 0.916 [OK] 7728 92 R CYS O 16 O1H0u 0.660 1.420 2.320 14.775 16.543 0.893 [OK] 7729 92 R CYS CB 9 C4H2b 0.770 1.880 2.881 21.652 23.536 0.920 [OK] 7730 92 R CYS SG 20 S2H1u 1.040 1.770 3.796 40.280 34.603 1.164 possible 7731 93 R ALA N 12 N3H1s 0.700 1.640 2.462 12.601 14.046 0.897 [OK] 7732 93 R ALA CA 4 C4H1b 0.770 1.880 3.035 14.701 14.063 1.045 possible 7733 93 R ALA C 1 C3H0s 0.770 1.610 2.429 8.514 8.900 0.957 [OK] 7734 93 R ALA O 16 O1H0u 0.660 1.420 2.562 14.176 16.188 0.876 [OK] 7735 93 R ALA CB 10 C4H3u 0.770 1.880 3.110 36.556 36.782 0.994 possible 7736 94 R THR N 12 N3H1s 0.700 1.640 2.487 13.201 13.832 0.954 [OK] 7737 94 R THR CA 3 C4H1s 0.770 1.880 3.199 16.897 13.099 1.290 possible 7738 94 R THR C 1 C3H0s 0.770 1.610 3.110 8.324 8.738 0.953 possible 7739 94 R THR O 16 O1H0u 0.660 1.420 2.930 15.708 16.020 0.980 [OK] 7740 94 R THR CB 4 C4H1b 0.770 1.880 3.940 17.626 14.829 1.189 possible 7741 94 R THR OG1 17 O2H1u 0.660 1.460 2.641 19.116 18.123 1.055 [OK] 7742 94 R THR CG2 10 C4H3u 0.770 1.880 23.717 -1.000 36.542 -1.000 bad 7743 95 R GLY N 12 N3H1s 0.700 1.640 4.310 16.523 14.854 1.112 possible 7744 95 R GLY CA 8 C4H2s 0.770 1.880 6.872 48.776 23.688 2.059 possible 7745 95 R GLY C 2 C3H0b 0.770 1.610 2.113 8.327 9.840 0.846 [OK] 7746 95 R GLY O 16 O1H0u 0.660 1.420 3.451 17.210 16.391 1.050 possible 7747 96 R ALA N 12 N3H1s 0.700 1.640 2.211 11.877 14.046 0.846 [OK] 7748 96 R ALA CA 4 C4H1b 0.770 1.880 2.786 14.709 14.063 1.046 [OK] 7749 96 R ALA C 1 C3H0s 0.770 1.610 2.416 8.743 8.900 0.982 [OK] 7750 96 R ALA O 16 O1H0u 0.660 1.420 2.283 16.660 16.188 1.029 [OK] 7751 96 R ALA CB 10 C4H3u 0.770 1.880 3.040 38.839 36.782 1.056 possible 7752 97 R PHE N 12 N3H1s 0.700 1.640 2.402 12.255 13.691 0.895 [OK] 7753 97 R PHE CA 3 C4H1s 0.770 1.880 2.665 14.108 13.449 1.049 [OK] 7754 97 R PHE C 1 C3H0s 0.770 1.610 2.263 8.377 8.753 0.957 [OK] 7755 97 R PHE O 16 O1H0u 0.660 1.420 2.282 14.694 16.151 0.910 [OK] 7756 97 R PHE CB 8 C4H2s 0.770 1.880 2.941 23.473 23.777 0.987 [OK] 7757 97 R PHE CG 2 C3H0b 0.770 1.610 2.566 10.247 9.721 1.054 [OK] 7758 97 R PHE CD1 5 C3H1s 0.770 1.760 2.713 20.302 20.405 0.995 [OK] 7759 97 R PHE CD2 6 C3H1b 0.770 1.760 3.047 22.477 21.051 1.068 possible 7760 97 R PHE CE1 6 C3H1b 0.770 1.760 2.905 22.664 21.580 1.050 [OK] 7761 97 R PHE CE2 6 C3H1b 0.770 1.760 2.720 21.017 21.680 0.969 [OK] 7762 97 R PHE CZ 6 C3H1b 0.770 1.760 2.698 21.121 21.666 0.975 [OK] 7763 98 R VAL N 12 N3H1s 0.700 1.640 2.662 13.189 13.676 0.964 [OK] 7764 98 R VAL CA 3 C4H1s 0.770 1.880 3.845 16.091 13.123 1.226 possible 7765 98 R VAL C 1 C3H0s 0.770 1.610 2.464 7.889 8.563 0.921 [OK] 7766 98 R VAL O 16 O1H0u 0.660 1.420 3.153 15.239 16.181 0.942 possible 7767 98 R VAL CB 4 C4H1b 0.770 1.880 4.121 16.956 14.598 1.162 possible 7768 98 R VAL CG1 10 C4H3u 0.770 1.880 35.213 -1.000 36.584 -1.000 bad 7769 98 R VAL CG2 10 C4H3u 0.770 1.880 24.304 -1.000 36.332 -1.000 bad 7770 99 R SER N 12 N3H1s 0.700 1.640 2.916 13.797 14.103 0.978 [OK] 7771 99 R SER CA 3 C4H1s 0.770 1.880 3.083 14.506 13.476 1.076 possible 7772 99 R SER C 1 C3H0s 0.770 1.610 2.287 8.188 8.923 0.918 [OK] 7773 99 R SER O 16 O1H0u 0.660 1.420 2.477 14.320 16.179 0.885 [OK] 7774 99 R SER CB 8 C4H2s 0.770 1.880 2.715 21.396 23.884 0.896 [OK] 7775 99 R SER OG 17 O2H1u 0.660 1.460 4.419 29.936 18.732 1.598 possible 7776 100 R TRP N 12 N3H1s 0.700 1.640 2.264 12.366 13.791 0.897 [OK] 7777 100 R TRP CA 3 C4H1s 0.770 1.880 2.926 15.381 13.377 1.150 [OK] 7778 100 R TRP C 1 C3H0s 0.770 1.610 2.534 8.210 8.724 0.941 [OK] 7779 100 R TRP O 16 O1H0u 0.660 1.420 2.446 13.552 15.951 0.850 [OK] 7780 100 R TRP CB 8 C4H2s 0.770 1.880 2.681 22.753 24.004 0.948 [OK] 7781 100 R TRP CG 2 C3H0b 0.770 1.610 2.188 8.991 9.965 0.902 [OK] 7782 100 R TRP CD1 5 C3H1s 0.770 1.760 2.722 20.542 20.874 0.984 [OK] 7783 100 R TRP CD2 2 C3H0b 0.770 1.610 2.437 9.533 10.097 0.944 [OK] 7784 100 R TRP NE1 13 N3H1b 0.700 1.640 2.382 14.949 16.969 0.881 [OK] 7785 100 R TRP CE2 2 C3H0b 0.770 1.610 2.440 9.477 9.889 0.958 [OK] 7786 100 R TRP CE3 6 C3H1b 0.770 1.760 3.161 21.859 20.448 1.069 possible 7787 100 R TRP CZ2 6 C3H1b 0.770 1.760 2.781 20.585 21.012 0.980 [OK] 7788 100 R TRP CZ3 6 C3H1b 0.770 1.760 5.474 51.706 21.516 2.403 possible 7789 100 R TRP CH2 6 C3H1b 0.770 1.760 4.635 30.715 21.339 1.439 possible 7790 101 R ALA N 12 N3H1s 0.700 1.640 2.604 12.845 14.046 0.915 [OK] 7791 101 R ALA CA 4 C4H1b 0.770 1.880 2.914 15.855 14.063 1.127 [OK] 7792 101 R ALA C 1 C3H0s 0.770 1.610 3.142 9.242 8.900 1.038 possible 7793 101 R ALA O 16 O1H0u 0.660 1.420 2.666 14.477 16.188 0.894 [OK] 7794 101 R ALA CB 10 C4H3u 0.770 1.880 5.301 66.717 36.782 1.814 possible 7795 102 R LEU N 12 N3H1s 0.700 1.640 3.176 13.333 13.655 0.976 possible 7796 102 R LEU CA 3 C4H1s 0.770 1.880 2.907 12.685 13.122 0.967 [OK] 7797 102 R LEU C 1 C3H0s 0.770 1.610 2.308 8.515 8.825 0.965 [OK] 7798 102 R LEU O 16 O1H0u 0.660 1.420 2.316 15.363 16.208 0.948 [OK] 7799 102 R LEU CB 8 C4H2s 0.770 1.880 2.692 20.808 22.951 0.907 [OK] 7800 102 R LEU CG 4 C4H1b 0.770 1.880 4.946 20.005 14.764 1.355 possible 7801 102 R LEU CD1 10 C4H3u 0.770 1.880 19.524 -1.000 37.425 -1.000 bad 7802 102 R LEU CD2 10 C4H3u 0.770 1.880 34.282 -1.000 37.143 -1.000 bad 7803 103 R ARG N 12 N3H1s 0.700 1.640 2.366 11.846 13.650 0.868 [OK] 7804 103 R ARG CA 3 C4H1s 0.770 1.880 2.777 14.225 13.422 1.060 [OK] 7805 103 R ARG C 1 C3H0s 0.770 1.610 2.449 8.137 8.838 0.921 [OK] 7806 103 R ARG O 16 O1H0u 0.660 1.420 2.611 14.549 16.084 0.905 [OK] 7807 103 R ARG CB 8 C4H2s 0.770 1.880 2.985 20.915 23.088 0.906 [OK] 7808 103 R ARG CG 8 C4H2s 0.770 1.880 3.022 24.520 23.640 1.037 possible 7809 103 R ARG CD 8 C4H2s 0.770 1.880 3.579 26.254 23.300 1.127 possible 7810 103 R ARG NE 13 N3H1b 0.700 1.640 4.248 21.059 15.569 1.353 possible 7811 103 R ARG CZ 2 C3H0b 0.770 1.610 4.635 13.371 9.747 1.372 possible 7812 103 R ARG NH1 15 N3H2u 0.700 1.640 3.049 21.020 22.782 0.923 possible 7813 103 R ARG NH2 15 N3H2u 0.700 1.640 4.767 30.029 23.810 1.261 possible 7814 104 R GLU N 12 N3H1s 0.700 1.640 2.540 12.506 13.615 0.919 [OK] 7815 104 R GLU CA 3 C4H1s 0.770 1.880 2.881 14.737 13.399 1.100 [OK] 7816 104 R GLU C 1 C3H0s 0.770 1.610 2.216 8.049 8.675 0.928 [OK] 7817 104 R GLU O 16 O1H0u 0.660 1.420 2.235 14.061 16.023 0.878 [OK] 7818 104 R GLU CB 8 C4H2s 0.770 1.880 2.728 19.917 23.529 0.846 [OK] 7819 104 R GLU CG 8 C4H2s 0.770 1.880 2.829 21.706 23.513 0.923 [OK] 7820 104 R GLU CD 2 C3H0b 0.770 1.610 2.505 9.770 9.460 1.033 [OK] 7821 104 R GLU OE1 16 O1H0u 0.660 1.420 2.485 20.211 15.999 1.263 [OK] 7822 104 R GLU OE2 16 O1H0u 0.660 1.420 2.370 17.983 17.432 1.032 [OK] 7823 105 R VAL N 12 N3H1s 0.700 1.640 2.205 12.054 13.676 0.881 [OK] 7824 105 R VAL CA 3 C4H1s 0.770 1.880 2.925 14.396 13.123 1.097 [OK] 7825 105 R VAL C 1 C3H0s 0.770 1.610 2.418 7.922 8.563 0.925 [OK] 7826 105 R VAL O 16 O1H0u 0.660 1.420 2.138 13.618 16.181 0.842 [OK] 7827 105 R VAL CB 4 C4H1b 0.770 1.880 2.741 13.845 14.598 0.948 [OK] 7828 105 R VAL CG1 10 C4H3u 0.770 1.880 7.895 74.552 36.584 2.038 possible 7829 105 R VAL CG2 10 C4H3u 0.770 1.880 14.311 -1.000 36.332 -1.000 bad 7830 106 R GLU N 12 N3H1s 0.700 1.640 2.492 12.928 13.615 0.950 [OK] 7831 106 R GLU CA 3 C4H1s 0.770 1.880 2.678 13.853 13.399 1.034 [OK] 7832 106 R GLU C 1 C3H0s 0.770 1.610 2.665 8.577 8.675 0.989 [OK] 7833 106 R GLU O 16 O1H0u 0.660 1.420 2.945 19.630 16.023 1.225 [OK] 7834 106 R GLU CB 8 C4H2s 0.770 1.880 3.315 25.775 23.529 1.095 possible 7835 106 R GLU CG 8 C4H2s 0.770 1.880 2.720 22.984 23.513 0.978 [OK] 7836 106 R GLU CD 2 C3H0b 0.770 1.610 2.502 9.578 9.460 1.012 [OK] 7837 106 R GLU OE1 16 O1H0u 0.660 1.420 2.581 17.543 15.999 1.097 [OK] 7838 106 R GLU OE2 16 O1H0u 0.660 1.420 2.438 18.432 17.432 1.057 [OK] 7839 107 R ILE N 12 N3H1s 0.700 1.640 2.678 12.316 13.633 0.903 [OK] 7840 107 R ILE CA 3 C4H1s 0.770 1.880 3.452 16.467 13.007 1.266 possible 7841 107 R ILE C 1 C3H0s 0.770 1.610 2.327 8.398 8.470 0.991 [OK] 7842 107 R ILE O 16 O1H0u 0.660 1.420 2.543 16.024 16.144 0.993 [OK] 7843 107 R ILE CB 4 C4H1b 0.770 1.880 2.873 14.157 14.227 0.995 [OK] 7844 107 R ILE CG1 9 C4H2b 0.770 1.880 3.324 22.833 24.187 0.944 possible 7845 107 R ILE CG2 10 C4H3u 0.770 1.880 2.946 33.174 35.961 0.922 [OK] 7846 107 R ILE CD1 10 C4H3u 0.770 1.880 2.877 37.652 38.377 0.981 [OK] 7847 108 R CYS N 12 N3H1s 0.700 1.640 2.385 12.322 13.981 0.881 [OK] 7848 108 R CYS CA 3 C4H1s 0.770 1.880 2.864 13.697 13.656 1.003 [OK] 7849 108 R CYS C 1 C3H0s 0.770 1.610 2.560 8.700 8.897 0.978 [OK] 7850 108 R CYS O 16 O1H0u 0.660 1.420 3.047 16.840 16.543 1.018 possible 7851 108 R CYS CB 9 C4H2b 0.770 1.880 2.624 20.743 23.536 0.881 [OK] 7852 108 R CYS SG 20 S2H1u 1.040 1.770 2.788 31.178 34.603 0.901 [OK] 7853 109 R ARG N 12 N3H1s 0.700 1.640 2.614 12.627 13.650 0.925 [OK] 7854 109 R ARG CA 3 C4H1s 0.770 1.880 3.471 17.269 13.422 1.287 possible 7855 109 R ARG C 1 C3H0s 0.770 1.610 2.547 8.480 8.838 0.960 [OK] 7856 109 R ARG O 16 O1H0u 0.660 1.420 3.375 19.217 16.084 1.195 possible 7857 109 R ARG CB 8 C4H2s 0.770 1.880 4.225 27.517 23.088 1.192 possible 7858 109 R ARG CG 8 C4H2s 0.770 1.880 4.251 24.189 23.640 1.023 possible 7859 109 R ARG CD 8 C4H2s 0.770 1.880 2.755 21.700 23.300 0.931 [OK] 7860 109 R ARG NE 13 N3H1b 0.700 1.640 4.816 27.787 15.569 1.785 possible 7861 109 R ARG CZ 2 C3H0b 0.770 1.610 4.126 13.686 9.747 1.404 possible 7862 109 R ARG NH1 15 N3H2u 0.700 1.640 4.294 42.124 22.782 1.849 possible 7863 109 R ARG NH2 15 N3H2u 0.700 1.640 50.172 -1.000 23.810 -1.000 bad 7864 110 R LYS N 12 N3H1s 0.700 1.640 2.438 13.372 13.675 0.978 [OK] 7865 110 R LYS CA 3 C4H1s 0.770 1.880 2.537 12.684 13.324 0.952 [OK] 7866 110 R LYS C 1 C3H0s 0.770 1.610 2.722 8.291 8.759 0.947 [OK] 7867 110 R LYS O 16 O1H0u 0.660 1.420 2.751 15.937 16.049 0.993 [OK] 7868 110 R LYS CB 8 C4H2s 0.770 1.880 3.395 27.618 22.904 1.206 possible 7869 110 R LYS CG 8 C4H2s 0.770 1.880 3.224 28.085 23.131 1.214 possible 7870 110 R LYS CD 8 C4H2s 0.770 1.880 3.434 26.035 23.837 1.092 possible 7871 110 R LYS CE 9 C4H2b 0.770 1.880 3.484 24.614 23.934 1.028 possible 7872 110 R LYS NZ 14 N4H3u 0.700 1.640 2.766 24.675 21.213 1.163 [OK] 7873 111 R LEU N 12 N3H1s 0.700 1.640 2.583 12.957 13.655 0.949 [OK] 7874 111 R LEU CA 3 C4H1s 0.770 1.880 3.007 13.532 13.122 1.031 possible 7875 111 R LEU C 1 C3H0s 0.770 1.610 2.557 9.345 8.825 1.059 [OK] 7876 111 R LEU O 16 O1H0u 0.660 1.420 2.669 16.840 16.208 1.039 [OK] 7877 111 R LEU CB 8 C4H2s 0.770 1.880 2.894 22.282 22.951 0.971 [OK] 7878 111 R LEU CG 4 C4H1b 0.770 1.880 3.046 14.412 14.764 0.976 possible 7879 111 R LEU CD1 10 C4H3u 0.770 1.880 2.943 35.425 37.425 0.947 [OK] 7880 111 R LEU CD2 10 C4H3u 0.770 1.880 3.057 37.977 37.143 1.022 possible 7881 112 R GLY N 12 N3H1s 0.700 1.640 2.465 13.666 14.854 0.920 [OK] 7882 112 R GLY CA 8 C4H2s 0.770 1.880 3.073 25.176 23.688 1.063 possible 7883 112 R GLY C 2 C3H0b 0.770 1.610 3.024 11.043 9.840 1.122 possible 7884 112 R GLY O 16 O1H0u 0.660 1.420 2.439 17.409 16.391 1.062 [OK] 7885 113 R ILE N 12 N3H1s 0.700 1.640 2.797 13.143 13.633 0.964 [OK] 7886 113 R ILE CA 3 C4H1s 0.770 1.880 2.806 13.261 13.007 1.020 [OK] 7887 113 R ILE C 1 C3H0s 0.770 1.610 2.158 8.164 8.470 0.964 [OK] 7888 113 R ILE O 16 O1H0u 0.660 1.420 3.067 20.228 16.144 1.253 possible 7889 113 R ILE CB 4 C4H1b 0.770 1.880 2.690 13.562 14.227 0.953 [OK] 7890 113 R ILE CG1 9 C4H2b 0.770 1.880 2.855 21.848 24.187 0.903 [OK] 7891 113 R ILE CG2 10 C4H3u 0.770 1.880 3.024 32.744 35.961 0.911 possible 7892 113 R ILE CD1 10 C4H3u 0.770 1.880 3.243 43.344 38.377 1.129 possible 7893 114 R GLY N 12 N3H1s 0.700 1.640 2.607 14.010 14.854 0.943 [OK] 7894 114 R GLY CA 8 C4H2s 0.770 1.880 3.184 24.979 23.688 1.054 possible 7895 114 R GLY C 2 C3H0b 0.770 1.610 2.422 9.714 9.840 0.987 [OK] 7896 114 R GLY O 16 O1H0u 0.660 1.420 2.204 14.451 16.391 0.882 [OK] 7897 115 R TYR N 12 N3H1s 0.700 1.640 3.020 17.072 13.691 1.247 possible 7898 115 R TYR CA 3 C4H1s 0.770 1.880 2.809 13.405 13.330 1.006 [OK] 7899 115 R TYR C 1 C3H0s 0.770 1.610 3.489 11.184 8.770 1.275 possible 7900 115 R TYR O 16 O1H0u 0.660 1.420 3.779 21.401 16.124 1.327 possible 7901 115 R TYR CB 8 C4H2s 0.770 1.880 6.012 53.742 23.678 2.270 possible 7902 115 R TYR CG 2 C3H0b 0.770 1.610 3.732 11.781 9.732 1.211 possible 7903 115 R TYR CD1 5 C3H1s 0.770 1.760 2.783 20.083 20.171 0.996 [OK] 7904 115 R TYR CD2 5 C3H1s 0.770 1.760 22.150 -1.000 20.728 -1.000 bad 7905 115 R TYR CE1 5 C3H1s 0.770 1.760 3.193 22.106 20.675 1.069 possible 7906 115 R TYR CE2 5 C3H1s 0.770 1.760 26.432 -1.000 20.810 -1.000 bad 7907 115 R TYR CZ 2 C3H0b 0.770 1.610 3.704 12.639 9.926 1.273 possible 7908 115 R TYR OH 17 O2H1u 0.660 1.460 6.076 64.271 19.173 3.352 possible 7909 116 R HIS N 12 N3H1s 0.700 1.640 3.079 14.162 13.715 1.033 possible 7910 116 R HIS CA 3 C4H1s 0.770 1.880 4.008 19.024 13.467 1.413 possible 7911 116 R HIS C 1 C3H0s 0.770 1.610 2.143 8.177 8.882 0.921 [OK] 7912 116 R HIS O 16 O1H0u 0.660 1.420 2.999 18.558 16.082 1.154 [OK] 7913 116 R HIS CB 8 C4H2s 0.770 1.880 3.317 22.648 23.653 0.958 possible 7914 116 R HIS CG 2 C3H0b 0.770 1.610 3.041 10.542 9.952 1.059 possible 7915 116 R HIS ND1 13 N3H1b 0.700 1.640 2.769 16.330 15.506 1.053 [OK] 7916 116 R HIS CD2 5 C3H1s 0.770 1.760 3.966 32.309 21.085 1.532 possible 7917 116 R HIS CE1 5 C3H1s 0.770 1.760 3.075 23.202 20.636 1.124 possible 7918 116 R HIS NE2 13 N3H1b 0.700 1.640 3.265 17.221 15.337 1.123 possible 7919 117 R ILE N 12 N3H1s 0.700 1.640 2.547 11.609 13.633 0.852 [OK] 7920 117 R ILE CA 3 C4H1s 0.770 1.880 3.179 14.084 13.007 1.083 possible 7921 117 R ILE C 1 C3H0s 0.770 1.610 2.372 8.188 8.470 0.967 [OK] 7922 117 R ILE O 16 O1H0u 0.660 1.420 2.386 15.200 16.144 0.942 [OK] 7923 117 R ILE CB 4 C4H1b 0.770 1.880 2.597 12.245 14.227 0.861 [OK] 7924 117 R ILE CG1 9 C4H2b 0.770 1.880 3.107 23.591 24.187 0.975 possible 7925 117 R ILE CG2 10 C4H3u 0.770 1.880 3.166 34.882 35.961 0.970 possible 7926 117 R ILE CD1 10 C4H3u 0.770 1.880 3.243 35.731 38.377 0.931 possible 7927 118 R PRO N 11 N3H0u 0.700 1.640 2.486 8.870 8.823 1.005 [OK] 7928 118 R PRO CA 4 C4H1b 0.770 1.880 2.932 15.653 13.955 1.122 [OK] 7929 118 R PRO C 1 C3H0s 0.770 1.610 4.632 9.729 8.812 1.104 possible 7930 118 R PRO O 16 O1H0u 0.660 1.420 4.532 23.049 16.169 1.425 possible 7931 118 R PRO CB 9 C4H2b 0.770 1.880 5.194 38.593 25.563 1.510 possible 7932 118 R PRO CG 9 C4H2b 0.770 1.880 2.928 24.578 25.832 0.951 [OK] 7933 118 R PRO CD 8 C4H2s 0.770 1.880 2.733 21.271 23.836 0.892 [OK] 7934 119 R PHE N 12 N3H1s 0.700 1.640 4.651 17.881 13.691 1.306 possible 7935 119 R PHE CA 3 C4H1s 0.770 1.880 5.609 22.754 13.449 1.692 possible 7936 119 R PHE C 1 C3H0s 0.770 1.610 2.434 8.118 8.753 0.927 [OK] 7937 119 R PHE O 16 O1H0u 0.660 1.420 2.989 17.545 16.151 1.086 [OK] 7938 119 R PHE CB 8 C4H2s 0.770 1.880 4.938 35.562 23.777 1.496 possible 7939 119 R PHE CG 2 C3H0b 0.770 1.610 3.932 14.468 9.721 1.488 possible 7940 119 R PHE CD1 5 C3H1s 0.770 1.760 23.399 -1.000 20.405 -1.000 bad 7941 119 R PHE CD2 6 C3H1b 0.770 1.760 4.116 38.088 21.051 1.809 possible 7942 119 R PHE CE1 6 C3H1b 0.770 1.760 33.364 -1.000 21.580 -1.000 bad 7943 119 R PHE CE2 6 C3H1b 0.770 1.760 5.891 54.154 21.680 2.498 possible 7944 119 R PHE CZ 6 C3H1b 0.770 1.760 27.131 -1.000 21.666 -1.000 bad 7945 120 R ALA N 12 N3H1s 0.700 1.640 3.054 13.600 14.046 0.968 possible 7946 120 R ALA CA 4 C4H1b 0.770 1.880 3.212 15.310 14.063 1.089 possible 7947 120 R ALA C 1 C3H0s 0.770 1.610 2.524 8.227 8.900 0.924 [OK] 7948 120 R ALA O 16 O1H0u 0.660 1.420 2.498 17.723 16.188 1.095 [OK] 7949 120 R ALA CB 10 C4H3u 0.770 1.880 3.228 35.837 36.782 0.974 possible 7950 121 R PHE N 12 N3H1s 0.700 1.640 2.229 11.956 13.691 0.873 [OK] 7951 121 R PHE CA 3 C4H1s 0.770 1.880 2.843 13.272 13.449 0.987 [OK] 7952 121 R PHE C 1 C3H0s 0.770 1.610 2.440 8.347 8.753 0.954 [OK] 7953 121 R PHE O 16 O1H0u 0.660 1.420 2.475 14.240 16.151 0.882 [OK] 7954 121 R PHE CB 8 C4H2s 0.770 1.880 2.899 23.257 23.777 0.978 [OK] 7955 121 R PHE CG 2 C3H0b 0.770 1.610 2.473 9.730 9.721 1.001 [OK] 7956 121 R PHE CD1 5 C3H1s 0.770 1.760 2.769 17.742 20.405 0.870 [OK] 7957 121 R PHE CD2 6 C3H1b 0.770 1.760 2.931 22.251 21.051 1.057 [OK] 7958 121 R PHE CE1 6 C3H1b 0.770 1.760 3.065 21.576 21.580 1.000 possible 7959 121 R PHE CE2 6 C3H1b 0.770 1.760 2.545 18.145 21.680 0.837 [OK] 7960 121 R PHE CZ 6 C3H1b 0.770 1.760 2.697 20.608 21.666 0.951 [OK] 7961 122 R ALA N 12 N3H1s 0.700 1.640 2.867 14.342 14.046 1.021 [OK] 7962 122 R ALA CA 4 C4H1b 0.770 1.880 3.577 16.507 14.063 1.174 possible 7963 122 R ALA C 1 C3H0s 0.770 1.610 2.930 8.785 8.900 0.987 [OK] 7964 122 R ALA O 16 O1H0u 0.660 1.420 3.530 16.883 16.188 1.043 possible 7965 122 R ALA CB 10 C4H3u 0.770 1.880 33.627 -1.000 36.782 -1.000 bad 7966 123 R PHE N 12 N3H1s 0.700 1.640 2.921 13.258 13.691 0.968 [OK] 7967 123 R PHE CA 3 C4H1s 0.770 1.880 3.504 16.502 13.449 1.227 possible 7968 123 R PHE C 1 C3H0s 0.770 1.610 2.312 8.233 8.753 0.941 [OK] 7969 123 R PHE O 16 O1H0u 0.660 1.420 3.500 19.234 16.151 1.191 possible 7970 123 R PHE CB 8 C4H2s 0.770 1.880 2.988 23.602 23.777 0.993 [OK] 7971 123 R PHE CG 2 C3H0b 0.770 1.610 3.007 10.137 9.721 1.043 possible 7972 123 R PHE CD1 5 C3H1s 0.770 1.760 3.377 22.644 20.405 1.110 possible 7973 123 R PHE CD2 6 C3H1b 0.770 1.760 4.054 30.979 21.051 1.472 possible 7974 123 R PHE CE1 6 C3H1b 0.770 1.760 4.805 31.886 21.580 1.478 possible 7975 123 R PHE CE2 6 C3H1b 0.770 1.760 5.422 44.726 21.680 2.063 possible 7976 123 R PHE CZ 6 C3H1b 0.770 1.760 25.158 -1.000 21.666 -1.000 bad 7977 124 R ALA N 12 N3H1s 0.700 1.640 2.695 14.101 14.046 1.004 [OK] 7978 124 R ALA CA 4 C4H1b 0.770 1.880 3.042 16.032 14.063 1.140 possible 7979 124 R ALA C 1 C3H0s 0.770 1.610 2.104 8.030 8.900 0.902 [OK] 7980 124 R ALA O 16 O1H0u 0.660 1.420 2.318 14.869 16.188 0.919 [OK] 7981 124 R ALA CB 10 C4H3u 0.770 1.880 3.230 37.672 36.782 1.024 possible 7982 125 R ILE N 12 N3H1s 0.700 1.640 2.533 12.834 13.633 0.941 [OK] 7983 125 R ILE CA 3 C4H1s 0.770 1.880 2.944 13.516 13.007 1.039 [OK] 7984 125 R ILE C 1 C3H0s 0.770 1.610 2.508 8.086 8.470 0.955 [OK] 7985 125 R ILE O 16 O1H0u 0.660 1.420 2.414 14.479 16.144 0.897 [OK] 7986 125 R ILE CB 4 C4H1b 0.770 1.880 3.850 15.856 14.227 1.115 possible 7987 125 R ILE CG1 9 C4H2b 0.770 1.880 2.720 21.824 24.187 0.902 [OK] 7988 125 R ILE CG2 10 C4H3u 0.770 1.880 4.720 51.190 35.961 1.423 possible 7989 125 R ILE CD1 10 C4H3u 0.770 1.880 4.388 44.732 38.377 1.166 possible 7990 126 R LEU N 12 N3H1s 0.700 1.640 2.797 13.127 13.655 0.961 [OK] 7991 126 R LEU CA 3 C4H1s 0.770 1.880 2.693 13.166 13.122 1.003 [OK] 7992 126 R LEU C 1 C3H0s 0.770 1.610 3.140 9.317 8.825 1.056 possible 7993 126 R LEU O 16 O1H0u 0.660 1.420 3.088 16.981 16.208 1.048 possible 7994 126 R LEU CB 8 C4H2s 0.770 1.880 5.547 43.462 22.951 1.894 possible 7995 126 R LEU CG 4 C4H1b 0.770 1.880 4.330 18.983 14.764 1.286 possible 7996 126 R LEU CD1 10 C4H3u 0.770 1.880 46.018 -1.000 37.425 -1.000 bad 7997 126 R LEU CD2 10 C4H3u 0.770 1.880 30.795 -1.000 37.143 -1.000 bad 7998 127 R ALA N 12 N3H1s 0.700 1.640 3.531 15.403 14.046 1.097 possible 7999 127 R ALA CA 4 C4H1b 0.770 1.880 3.252 16.147 14.063 1.148 possible 8000 127 R ALA C 1 C3H0s 0.770 1.610 2.615 8.611 8.900 0.968 [OK] 8001 127 R ALA O 16 O1H0u 0.660 1.420 2.553 16.937 16.188 1.046 [OK] 8002 127 R ALA CB 10 C4H3u 0.770 1.880 3.314 38.931 36.782 1.058 possible 8003 128 R TYR N 12 N3H1s 0.700 1.640 2.364 12.594 13.691 0.920 [OK] 8004 128 R TYR CA 3 C4H1s 0.770 1.880 3.163 16.014 13.330 1.201 possible 8005 128 R TYR C 1 C3H0s 0.770 1.610 2.296 7.859 8.770 0.896 [OK] 8006 128 R TYR O 16 O1H0u 0.660 1.420 2.466 15.082 16.124 0.935 [OK] 8007 128 R TYR CB 8 C4H2s 0.770 1.880 2.907 23.316 23.678 0.985 [OK] 8008 128 R TYR CG 2 C3H0b 0.770 1.610 2.562 10.171 9.732 1.045 [OK] 8009 128 R TYR CD1 5 C3H1s 0.770 1.760 3.021 20.951 20.171 1.039 possible 8010 128 R TYR CD2 5 C3H1s 0.770 1.760 3.063 21.837 20.728 1.054 possible 8011 128 R TYR CE1 5 C3H1s 0.770 1.760 2.801 20.495 20.675 0.991 [OK] 8012 128 R TYR CE2 5 C3H1s 0.770 1.760 2.819 21.920 20.810 1.053 [OK] 8013 128 R TYR CZ 2 C3H0b 0.770 1.610 2.507 9.891 9.926 0.997 [OK] 8014 128 R TYR OH 17 O2H1u 0.660 1.460 2.621 19.146 19.173 0.999 [OK] 8015 129 R LEU N 12 N3H1s 0.700 1.640 2.357 12.381 13.655 0.907 [OK] 8016 129 R LEU CA 3 C4H1s 0.770 1.880 2.595 12.088 13.122 0.921 [OK] 8017 129 R LEU C 1 C3H0s 0.770 1.610 2.260 8.230 8.825 0.933 [OK] 8018 129 R LEU O 16 O1H0u 0.660 1.420 2.375 13.732 16.208 0.847 [OK] 8019 129 R LEU CB 8 C4H2s 0.770 1.880 2.810 21.022 22.951 0.916 [OK] 8020 129 R LEU CG 4 C4H1b 0.770 1.880 3.903 19.418 14.764 1.315 possible 8021 129 R LEU CD1 10 C4H3u 0.770 1.880 3.452 39.035 37.425 1.043 possible 8022 129 R LEU CD2 10 C4H3u 0.770 1.880 7.884 80.139 37.143 2.158 possible 8023 130 R THR N 12 N3H1s 0.700 1.640 2.215 11.562 13.832 0.836 [OK] 8024 130 R THR CA 3 C4H1s 0.770 1.880 2.671 12.341 13.099 0.942 [OK] 8025 130 R THR C 1 C3H0s 0.770 1.610 2.778 8.359 8.738 0.957 [OK] 8026 130 R THR O 16 O1H0u 0.660 1.420 2.675 15.850 16.020 0.989 [OK] 8027 130 R THR CB 4 C4H1b 0.770 1.880 2.992 14.263 14.829 0.962 [OK] 8028 130 R THR OG1 17 O2H1u 0.660 1.460 6.055 38.283 18.123 2.112 possible 8029 130 R THR CG2 10 C4H3u 0.770 1.880 3.444 41.065 36.542 1.124 possible 8030 131 R LEU N 12 N3H1s 0.700 1.640 2.521 12.826 13.655 0.939 [OK] 8031 131 R LEU CA 3 C4H1s 0.770 1.880 3.063 14.240 13.122 1.085 possible 8032 131 R LEU C 1 C3H0s 0.770 1.610 2.445 8.993 8.825 1.019 [OK] 8033 131 R LEU O 16 O1H0u 0.660 1.420 2.672 17.463 16.208 1.077 [OK] 8034 131 R LEU CB 8 C4H2s 0.770 1.880 3.155 23.476 22.951 1.023 possible 8035 131 R LEU CG 4 C4H1b 0.770 1.880 2.899 14.762 14.764 1.000 [OK] 8036 131 R LEU CD1 10 C4H3u 0.770 1.880 3.121 39.622 37.425 1.059 possible 8037 131 R LEU CD2 10 C4H3u 0.770 1.880 3.168 38.498 37.143 1.036 possible 8038 132 R VAL N 12 N3H1s 0.700 1.640 2.426 12.781 13.676 0.935 [OK] 8039 132 R VAL CA 3 C4H1s 0.770 1.880 2.662 12.229 13.123 0.932 [OK] 8040 132 R VAL C 1 C3H0s 0.770 1.610 2.409 8.594 8.563 1.004 [OK] 8041 132 R VAL O 16 O1H0u 0.660 1.420 2.681 20.146 16.181 1.245 [OK] 8042 132 R VAL CB 4 C4H1b 0.770 1.880 2.630 13.641 14.598 0.934 [OK] 8043 132 R VAL CG1 10 C4H3u 0.770 1.880 2.918 32.976 36.584 0.901 [OK] 8044 132 R VAL CG2 10 C4H3u 0.770 1.880 3.148 33.439 36.332 0.920 possible 8045 133 R LEU N 12 N3H1s 0.700 1.640 2.358 13.906 13.655 1.018 [OK] 8046 133 R LEU CA 3 C4H1s 0.770 1.880 2.774 13.433 13.122 1.024 [OK] 8047 133 R LEU C 1 C3H0s 0.770 1.610 3.011 8.941 8.825 1.013 possible 8048 133 R LEU O 16 O1H0u 0.660 1.420 3.030 15.881 16.208 0.980 possible 8049 133 R LEU CB 8 C4H2s 0.770 1.880 3.040 21.847 22.951 0.952 possible 8050 133 R LEU CG 4 C4H1b 0.770 1.880 4.440 19.540 14.764 1.324 possible 8051 133 R LEU CD1 10 C4H3u 0.770 1.880 14.523 -1.000 37.425 -1.000 bad 8052 133 R LEU CD2 10 C4H3u 0.770 1.880 30.614 -1.000 37.143 -1.000 bad 8053 134 R PHE N 12 N3H1s 0.700 1.640 2.937 13.379 13.691 0.977 [OK] 8054 134 R PHE CA 3 C4H1s 0.770 1.880 4.252 18.603 13.449 1.383 possible 8055 134 R PHE C 1 C3H0s 0.770 1.610 2.376 8.245 8.753 0.942 [OK] 8056 134 R PHE O 16 O1H0u 0.660 1.420 3.769 18.446 16.151 1.142 possible 8057 134 R PHE CB 8 C4H2s 0.770 1.880 5.241 34.476 23.777 1.450 possible 8058 134 R PHE CG 2 C3H0b 0.770 1.610 7.881 19.976 9.721 2.055 possible 8059 134 R PHE CD1 5 C3H1s 0.770 1.760 15.968 -1.000 20.405 -1.000 bad 8060 134 R PHE CD2 6 C3H1b 0.770 1.760 7.356 -1.000 21.051 -1.000 bad 8061 134 R PHE CE1 6 C3H1b 0.770 1.760 21.797 -1.000 21.580 -1.000 bad 8062 134 R PHE CE2 6 C3H1b 0.770 1.760 7.361 -1.000 21.680 -1.000 bad 8063 134 R PHE CZ 6 C3H1b 0.770 1.760 15.537 -1.000 21.666 -1.000 bad 8064 135 R ARG N 12 N3H1s 0.700 1.640 2.421 12.692 13.650 0.930 [OK] 8065 135 R ARG CA 3 C4H1s 0.770 1.880 2.917 13.354 13.422 0.995 [OK] 8066 135 R ARG C 1 C3H0s 0.770 1.610 2.715 8.765 8.838 0.992 [OK] 8067 135 R ARG O 16 O1H0u 0.660 1.420 2.385 14.030 16.084 0.872 [OK] 8068 135 R ARG CB 8 C4H2s 0.770 1.880 3.168 24.831 23.088 1.075 possible 8069 135 R ARG CG 8 C4H2s 0.770 1.880 3.006 24.764 23.640 1.048 possible 8070 135 R ARG CD 8 C4H2s 0.770 1.880 3.152 22.758 23.300 0.977 possible 8071 135 R ARG NE 13 N3H1b 0.700 1.640 2.821 18.212 15.569 1.170 [OK] 8072 135 R ARG CZ 2 C3H0b 0.770 1.610 2.537 9.743 9.747 1.000 [OK] 8073 135 R ARG NH1 15 N3H2u 0.700 1.640 2.790 25.699 22.782 1.128 [OK] 8074 135 R ARG NH2 15 N3H2u 0.700 1.640 2.692 24.718 23.810 1.038 [OK] 8075 136 R PRO N 11 N3H0u 0.700 1.640 2.787 9.585 8.823 1.086 [OK] 8076 136 R PRO CA 4 C4H1b 0.770 1.880 2.775 14.279 13.955 1.023 [OK] 8077 136 R PRO C 1 C3H0s 0.770 1.610 2.642 8.938 8.812 1.014 [OK] 8078 136 R PRO O 16 O1H0u 0.660 1.420 2.357 14.832 16.169 0.917 [OK] 8079 136 R PRO CB 9 C4H2b 0.770 1.880 3.008 27.965 25.563 1.094 possible 8080 136 R PRO CG 9 C4H2b 0.770 1.880 2.937 23.179 25.832 0.897 [OK] 8081 136 R PRO CD 8 C4H2s 0.770 1.880 2.668 20.710 23.836 0.869 [OK] 8082 137 R VAL N 12 N3H1s 0.700 1.640 2.799 13.392 13.676 0.979 [OK] 8083 137 R VAL CA 3 C4H1s 0.770 1.880 2.569 12.053 13.123 0.918 [OK] 8084 137 R VAL C 1 C3H0s 0.770 1.610 2.889 8.138 8.563 0.950 [OK] 8085 137 R VAL O 16 O1H0u 0.660 1.420 11.037 -1.000 16.181 -1.000 bad 8086 137 R VAL CB 4 C4H1b 0.770 1.880 3.816 17.410 14.598 1.193 possible 8087 137 R VAL CG1 10 C4H3u 0.770 1.880 45.919 -1.000 36.584 -1.000 bad 8088 137 R VAL CG2 10 C4H3u 0.770 1.880 7.693 64.224 36.332 1.768 possible 8089 138 R MET N 12 N3H1s 0.700 1.640 3.101 13.878 13.564 1.023 possible 8090 138 R MET CA 3 C4H1s 0.770 1.880 6.463 -1.000 13.231 -1.000 bad 8091 138 R MET C 1 C3H0s 0.770 1.610 2.321 8.534 8.782 0.972 [OK] 8092 138 R MET O 16 O1H0u 0.660 1.420 28.500 -1.000 16.277 -1.000 bad 8093 138 R MET CB 8 C4H2s 0.770 1.880 3.432 22.547 23.645 0.954 possible 8094 138 R MET CG 9 C4H2b 0.770 1.880 19.299 -1.000 24.009 -1.000 bad 8095 138 R MET SD 19 S2H0u 1.040 1.770 10.064 -1.000 30.093 -1.000 bad 8096 138 R MET CE 10 C4H3u 0.770 1.880 51.990 -1.000 37.161 -1.000 bad 8097 139 R MET N 12 N3H1s 0.700 1.640 2.353 11.696 13.564 0.862 [OK] 8098 139 R MET CA 3 C4H1s 0.770 1.880 4.613 19.309 13.231 1.459 possible 8099 139 R MET C 1 C3H0s 0.770 1.610 4.172 11.605 8.782 1.321 possible 8100 139 R MET O 16 O1H0u 0.660 1.420 21.235 -1.000 16.277 -1.000 bad 8101 139 R MET CB 8 C4H2s 0.770 1.880 3.359 22.463 23.645 0.950 possible 8102 139 R MET CG 9 C4H2b 0.770 1.880 3.264 24.181 24.009 1.007 possible 8103 139 R MET SD 19 S2H0u 1.040 1.770 2.929 28.043 30.093 0.932 [OK] 8104 139 R MET CE 10 C4H3u 0.770 1.880 3.600 37.190 37.161 1.001 possible 8105 140 R GLY N 12 N3H1s 0.700 1.640 3.869 15.193 14.854 1.023 possible 8106 140 R GLY CA 8 C4H2s 0.770 1.880 24.242 -1.000 23.688 -1.000 bad 8107 140 R GLY C 2 C3H0b 0.770 1.610 3.786 11.355 9.840 1.154 possible 8108 140 R GLY O 16 O1H0u 0.660 1.420 10.875 -1.000 16.391 -1.000 bad 8109 141 R ALA N 12 N3H1s 0.700 1.640 2.714 14.700 14.046 1.047 [OK] 8110 141 R ALA CA 4 C4H1b 0.770 1.880 2.422 11.811 14.063 0.840 [OK] 8111 141 R ALA C 1 C3H0s 0.770 1.610 2.628 9.089 8.900 1.021 [OK] 8112 141 R ALA O 16 O1H0u 0.660 1.420 2.308 15.205 16.188 0.939 [OK] 8113 141 R ALA CB 10 C4H3u 0.770 1.880 5.261 47.656 36.782 1.296 possible 8114 142 R TRP N 12 N3H1s 0.700 1.640 3.233 16.213 13.791 1.176 possible 8115 142 R TRP CA 3 C4H1s 0.770 1.880 2.962 13.961 13.377 1.044 [OK] 8116 142 R TRP C 1 C3H0s 0.770 1.610 2.389 8.556 8.724 0.981 [OK] 8117 142 R TRP O 16 O1H0u 0.660 1.420 2.588 16.416 15.951 1.029 [OK] 8118 142 R TRP CB 8 C4H2s 0.770 1.880 3.034 23.821 24.004 0.992 possible 8119 142 R TRP CG 2 C3H0b 0.770 1.610 2.677 10.279 9.965 1.031 [OK] 8120 142 R TRP CD1 5 C3H1s 0.770 1.760 2.843 21.010 20.874 1.007 [OK] 8121 142 R TRP CD2 2 C3H0b 0.770 1.610 3.031 11.958 10.097 1.184 possible 8122 142 R TRP NE1 13 N3H1b 0.700 1.640 3.700 16.967 16.969 1.000 possible 8123 142 R TRP CE2 2 C3H0b 0.770 1.610 3.030 10.882 9.889 1.100 possible 8124 142 R TRP CE3 6 C3H1b 0.770 1.760 3.258 24.365 20.448 1.192 possible 8125 142 R TRP CZ2 6 C3H1b 0.770 1.760 20.901 -1.000 21.012 -1.000 bad 8126 142 R TRP CZ3 6 C3H1b 0.770 1.760 3.766 28.416 21.516 1.321 possible 8127 142 R TRP CH2 6 C3H1b 0.770 1.760 15.897 -1.000 21.339 -1.000 bad 8128 143 R GLY N 12 N3H1s 0.700 1.640 3.186 16.851 14.854 1.134 possible 8129 143 R GLY CA 8 C4H2s 0.770 1.880 4.036 27.497 23.688 1.161 possible 8130 143 R GLY C 2 C3H0b 0.770 1.610 2.666 9.482 9.840 0.964 [OK] 8131 143 R GLY O 16 O1H0u 0.660 1.420 4.780 27.877 16.391 1.701 possible 8132 144 R TYR N 12 N3H1s 0.700 1.640 2.590 13.818 13.691 1.009 [OK] 8133 144 R TYR CA 3 C4H1s 0.770 1.880 2.705 11.993 13.330 0.900 [OK] 8134 144 R TYR C 1 C3H0s 0.770 1.610 2.411 8.956 8.770 1.021 [OK] 8135 144 R TYR O 16 O1H0u 0.660 1.420 2.355 15.222 16.124 0.944 [OK] 8136 144 R TYR CB 8 C4H2s 0.770 1.880 3.013 25.195 23.678 1.064 possible 8137 144 R TYR CG 2 C3H0b 0.770 1.610 2.296 8.985 9.732 0.923 [OK] 8138 144 R TYR CD1 5 C3H1s 0.770 1.760 3.280 22.214 20.171 1.101 possible 8139 144 R TYR CD2 5 C3H1s 0.770 1.760 2.562 18.463 20.728 0.891 [OK] 8140 144 R TYR CE1 5 C3H1s 0.770 1.760 5.353 48.627 20.675 2.352 possible 8141 144 R TYR CE2 5 C3H1s 0.770 1.760 3.743 22.831 20.810 1.097 possible 8142 144 R TYR CZ 2 C3H0b 0.770 1.610 2.887 10.011 9.926 1.009 [OK] 8143 144 R TYR OH 17 O2H1u 0.660 1.460 31.990 -1.000 19.173 -1.000 bad 8144 145 R ALA N 12 N3H1s 0.700 1.640 2.454 12.975 14.046 0.924 [OK] 8145 145 R ALA CA 4 C4H1b 0.770 1.880 2.978 13.956 14.063 0.992 [OK] 8146 145 R ALA C 1 C3H0s 0.770 1.610 2.396 8.909 8.900 1.001 [OK] 8147 145 R ALA O 16 O1H0u 0.660 1.420 2.334 14.932 16.188 0.922 [OK] 8148 145 R ALA CB 10 C4H3u 0.770 1.880 3.034 31.071 36.782 0.845 possible 8149 146 R PHE N 12 N3H1s 0.700 1.640 2.944 17.334 13.691 1.266 [OK] 8150 146 R PHE CA 3 C4H1s 0.770 1.880 2.302 11.407 13.449 0.848 [OK] 8151 146 R PHE C 1 C3H0s 0.770 1.610 2.336 8.673 8.753 0.991 [OK] 8152 146 R PHE O 16 O1H0u 0.660 1.420 2.340 17.995 16.151 1.114 [OK] 8153 146 R PHE CB 8 C4H2s 0.770 1.880 3.117 24.184 23.777 1.017 possible 8154 146 R PHE CG 2 C3H0b 0.770 1.610 2.646 9.769 9.721 1.005 [OK] 8155 146 R PHE CD1 5 C3H1s 0.770 1.760 3.081 21.854 20.405 1.071 possible 8156 146 R PHE CD2 6 C3H1b 0.770 1.760 2.765 19.652 21.051 0.934 [OK] 8157 146 R PHE CE1 6 C3H1b 0.770 1.760 3.007 20.905 21.580 0.969 possible 8158 146 R PHE CE2 6 C3H1b 0.770 1.760 2.835 19.943 21.680 0.920 [OK] 8159 146 R PHE CZ 6 C3H1b 0.770 1.760 2.831 20.490 21.666 0.946 [OK] 8160 147 R PRO N 11 N3H0u 0.700 1.640 2.472 8.551 8.823 0.969 [OK] 8161 147 R PRO CA 4 C4H1b 0.770 1.880 2.669 13.190 13.955 0.945 [OK] 8162 147 R PRO C 1 C3H0s 0.770 1.610 2.481 8.987 8.812 1.020 [OK] 8163 147 R PRO O 16 O1H0u 0.660 1.420 2.366 16.427 16.169 1.016 [OK] 8164 147 R PRO CB 9 C4H2b 0.770 1.880 2.849 26.024 25.563 1.018 [OK] 8165 147 R PRO CG 9 C4H2b 0.770 1.880 4.378 29.911 25.832 1.158 possible 8166 147 R PRO CD 8 C4H2s 0.770 1.880 4.217 25.547 23.836 1.072 possible 8167 148 R TYR N 12 N3H1s 0.700 1.640 2.653 14.559 13.691 1.063 [OK] 8168 148 R TYR CA 3 C4H1s 0.770 1.880 2.540 12.370 13.330 0.928 [OK] 8169 148 R TYR C 1 C3H0s 0.770 1.610 2.878 9.803 8.770 1.118 [OK] 8170 148 R TYR O 16 O1H0u 0.660 1.420 4.038 26.289 16.124 1.630 possible 8171 148 R TYR CB 8 C4H2s 0.770 1.880 3.782 29.201 23.678 1.233 possible 8172 148 R TYR CG 2 C3H0b 0.770 1.610 2.530 9.999 9.732 1.027 [OK] 8173 148 R TYR CD1 5 C3H1s 0.770 1.760 2.641 18.008 20.171 0.893 [OK] 8174 148 R TYR CD2 5 C3H1s 0.770 1.760 2.962 24.150 20.728 1.165 [OK] 8175 148 R TYR CE1 5 C3H1s 0.770 1.760 2.782 20.805 20.675 1.006 [OK] 8176 148 R TYR CE2 5 C3H1s 0.770 1.760 2.967 22.297 20.810 1.071 [OK] 8177 148 R TYR CZ 2 C3H0b 0.770 1.610 2.503 9.381 9.926 0.945 [OK] 8178 148 R TYR OH 17 O2H1u 0.660 1.460 2.375 16.559 19.173 0.864 [OK] 8179 149 R GLY N 12 N3H1s 0.700 1.640 2.703 16.396 14.854 1.104 [OK] 8180 149 R GLY CA 8 C4H2s 0.770 1.880 4.653 27.410 23.688 1.157 possible 8181 149 R GLY C 2 C3H0b 0.770 1.610 2.532 8.989 9.840 0.913 [OK] 8182 149 R GLY O 16 O1H0u 0.660 1.420 2.235 14.310 16.391 0.873 [OK] 8183 150 R ILE N 12 N3H1s 0.700 1.640 3.778 19.300 13.633 1.416 possible 8184 150 R ILE CA 3 C4H1s 0.770 1.880 3.151 13.984 13.007 1.075 possible 8185 150 R ILE C 1 C3H0s 0.770 1.610 2.485 7.704 8.470 0.910 [OK] 8186 150 R ILE O 16 O1H0u 0.660 1.420 2.814 19.248 16.144 1.192 [OK] 8187 150 R ILE CB 4 C4H1b 0.770 1.880 2.951 15.757 14.227 1.108 [OK] 8188 150 R ILE CG1 9 C4H2b 0.770 1.880 4.933 37.613 24.187 1.555 possible 8189 150 R ILE CG2 10 C4H3u 0.770 1.880 6.167 66.698 35.961 1.855 possible 8190 150 R ILE CD1 10 C4H3u 0.770 1.880 25.860 -1.000 38.377 -1.000 bad 8191 151 R TRP N 12 N3H1s 0.700 1.640 2.516 12.118 13.791 0.879 [OK] 8192 151 R TRP CA 3 C4H1s 0.770 1.880 2.717 13.227 13.377 0.989 [OK] 8193 151 R TRP C 1 C3H0s 0.770 1.610 3.098 9.887 8.724 1.133 possible 8194 151 R TRP O 16 O1H0u 0.660 1.420 3.054 17.263 15.951 1.082 possible 8195 151 R TRP CB 8 C4H2s 0.770 1.880 5.978 60.433 24.004 2.518 possible 8196 151 R TRP CG 2 C3H0b 0.770 1.610 5.173 15.076 9.965 1.513 possible 8197 151 R TRP CD1 5 C3H1s 0.770 1.760 5.420 32.580 20.874 1.561 possible 8198 151 R TRP CD2 2 C3H0b 0.770 1.610 4.354 14.637 10.097 1.450 possible 8199 151 R TRP NE1 13 N3H1b 0.700 1.640 5.049 27.131 16.969 1.599 possible 8200 151 R TRP CE2 2 C3H0b 0.770 1.610 4.640 15.983 9.889 1.616 possible 8201 151 R TRP CE3 6 C3H1b 0.770 1.760 3.617 29.717 20.448 1.453 possible 8202 151 R TRP CZ2 6 C3H1b 0.770 1.760 6.376 76.480 21.012 3.640 possible 8203 151 R TRP CZ3 6 C3H1b 0.770 1.760 3.297 23.796 21.516 1.106 possible 8204 151 R TRP CH2 6 C3H1b 0.770 1.760 4.183 44.164 21.339 2.070 possible 8205 152 R THR N 12 N3H1s 0.700 1.640 2.914 12.911 13.832 0.933 [OK] 8206 152 R THR CA 3 C4H1s 0.770 1.880 2.942 12.851 13.099 0.981 [OK] 8207 152 R THR C 1 C3H0s 0.770 1.610 2.275 8.389 8.738 0.960 [OK] 8208 152 R THR O 16 O1H0u 0.660 1.420 3.669 18.012 16.020 1.124 possible 8209 152 R THR CB 4 C4H1b 0.770 1.880 3.563 16.802 14.829 1.133 possible 8210 152 R THR OG1 17 O2H1u 0.660 1.460 2.426 16.557 18.123 0.914 [OK] 8211 152 R THR CG2 10 C4H3u 0.770 1.880 5.419 60.443 36.542 1.654 possible 8212 153 R HIS N 12 N3H1s 0.700 1.640 2.574 14.305 13.715 1.043 [OK] 8213 153 R HIS CA 3 C4H1s 0.770 1.880 2.778 14.428 13.467 1.071 [OK] 8214 153 R HIS C 1 C3H0s 0.770 1.610 2.647 8.852 8.882 0.997 [OK] 8215 153 R HIS O 16 O1H0u 0.660 1.420 2.602 16.141 16.082 1.004 [OK] 8216 153 R HIS CB 8 C4H2s 0.770 1.880 3.119 23.918 23.653 1.011 possible 8217 153 R HIS CG 2 C3H0b 0.770 1.610 2.396 9.688 9.952 0.973 [OK] 8218 153 R HIS ND1 13 N3H1b 0.700 1.640 2.304 13.852 15.506 0.893 [OK] 8219 153 R HIS CD2 5 C3H1s 0.770 1.760 2.978 21.495 21.085 1.019 [OK] 8220 153 R HIS CE1 5 C3H1s 0.770 1.760 3.119 21.841 20.636 1.058 possible 8221 153 R HIS NE2 13 N3H1b 0.700 1.640 2.325 11.389 15.337 0.743 [OK] 8222 154 R LEU N 12 N3H1s 0.700 1.640 2.480 13.499 13.655 0.989 [OK] 8223 154 R LEU CA 3 C4H1s 0.770 1.880 3.000 13.638 13.122 1.039 possible 8224 154 R LEU C 1 C3H0s 0.770 1.610 2.620 8.570 8.825 0.971 [OK] 8225 154 R LEU O 16 O1H0u 0.660 1.420 2.430 15.598 16.208 0.962 [OK] 8226 154 R LEU CB 8 C4H2s 0.770 1.880 3.757 28.326 22.951 1.234 possible 8227 154 R LEU CG 4 C4H1b 0.770 1.880 2.790 15.505 14.764 1.050 [OK] 8228 154 R LEU CD1 10 C4H3u 0.770 1.880 3.246 40.520 37.425 1.083 possible 8229 154 R LEU CD2 10 C4H3u 0.770 1.880 3.006 31.612 37.143 0.851 possible 8230 155 R ASP N 12 N3H1s 0.700 1.640 2.854 13.664 13.895 0.983 [OK] 8231 155 R ASP CA 3 C4H1s 0.770 1.880 3.865 17.404 13.377 1.301 possible 8232 155 R ASP C 1 C3H0s 0.770 1.610 3.639 8.828 8.816 1.001 possible 8233 155 R ASP O 16 O1H0u 0.660 1.420 3.214 15.526 16.091 0.965 possible 8234 155 R ASP CB 8 C4H2s 0.770 1.880 5.233 43.219 23.481 1.841 possible 8235 155 R ASP CG 2 C3H0b 0.770 1.610 5.094 14.904 9.422 1.582 possible 8236 155 R ASP OD1 16 O1H0u 0.660 1.420 4.506 38.747 15.505 2.499 possible 8237 155 R ASP OD2 16 O1H0u 0.660 1.420 26.952 -1.000 16.324 -1.000 bad 8238 156 R TRP N 12 N3H1s 0.700 1.640 4.588 16.272 13.791 1.180 possible 8239 156 R TRP CA 3 C4H1s 0.770 1.880 5.327 23.644 13.377 1.768 possible 8240 156 R TRP C 1 C3H0s 0.770 1.610 2.024 7.918 8.724 0.908 [OK] 8241 156 R TRP O 16 O1H0u 0.660 1.420 2.612 14.656 15.951 0.919 [OK] 8242 156 R TRP CB 8 C4H2s 0.770 1.880 4.506 24.147 24.004 1.006 possible 8243 156 R TRP CG 2 C3H0b 0.770 1.610 2.273 9.073 9.965 0.910 [OK] 8244 156 R TRP CD1 5 C3H1s 0.770 1.760 4.947 30.477 20.874 1.460 possible 8245 156 R TRP CD2 2 C3H0b 0.770 1.610 2.295 9.054 10.097 0.897 [OK] 8246 156 R TRP NE1 13 N3H1b 0.700 1.640 2.538 16.477 16.969 0.971 [OK] 8247 156 R TRP CE2 2 C3H0b 0.770 1.610 2.409 9.317 9.889 0.942 [OK] 8248 156 R TRP CE3 6 C3H1b 0.770 1.760 3.017 20.129 20.448 0.984 possible 8249 156 R TRP CZ2 6 C3H1b 0.770 1.760 3.105 22.725 21.012 1.082 possible 8250 156 R TRP CZ3 6 C3H1b 0.770 1.760 2.772 23.785 21.516 1.105 [OK] 8251 156 R TRP CH2 6 C3H1b 0.770 1.760 3.008 23.905 21.339 1.120 possible 8252 157 R VAL N 12 N3H1s 0.700 1.640 2.177 11.930 13.676 0.872 [OK] 8253 157 R VAL CA 3 C4H1s 0.770 1.880 2.744 13.265 13.123 1.011 [OK] 8254 157 R VAL C 1 C3H0s 0.770 1.610 2.393 8.010 8.563 0.935 [OK] 8255 157 R VAL O 16 O1H0u 0.660 1.420 2.156 14.586 16.181 0.901 [OK] 8256 157 R VAL CB 4 C4H1b 0.770 1.880 2.992 15.501 14.598 1.062 [OK] 8257 157 R VAL CG1 10 C4H3u 0.770 1.880 3.139 32.816 36.584 0.897 possible 8258 157 R VAL CG2 10 C4H3u 0.770 1.880 3.033 37.944 36.332 1.044 possible 8259 158 R SER N 12 N3H1s 0.700 1.640 2.516 13.293 14.103 0.943 [OK] 8260 158 R SER CA 3 C4H1s 0.770 1.880 2.650 13.106 13.476 0.973 [OK] 8261 158 R SER C 1 C3H0s 0.770 1.610 3.427 9.225 8.923 1.034 possible 8262 158 R SER O 16 O1H0u 0.660 1.420 3.020 15.809 16.179 0.977 possible 8263 158 R SER CB 8 C4H2s 0.770 1.880 3.748 25.284 23.884 1.059 possible 8264 158 R SER OG 17 O2H1u 0.660 1.460 4.800 35.902 18.732 1.917 possible 8265 159 R ASN N 12 N3H1s 0.700 1.640 3.606 14.106 13.695 1.030 possible 8266 159 R ASN CA 3 C4H1s 0.770 1.880 3.789 17.310 13.167 1.315 possible 8267 159 R ASN C 1 C3H0s 0.770 1.610 2.989 8.933 8.928 1.001 [OK] 8268 159 R ASN O 16 O1H0u 0.660 1.420 4.337 24.037 16.199 1.484 possible 8269 159 R ASN CB 8 C4H2s 0.770 1.880 5.515 45.114 23.128 1.951 possible 8270 159 R ASN CG 2 C3H0b 0.770 1.610 2.268 -1.000 9.599 -1.000 bad 8271 159 R ASN OD1 16 O1H0u 0.660 1.420 41.570 -1.000 16.664 -1.000 bad 8272 159 R ASN ND2 15 N3H2u 0.700 1.640 30.347 -1.000 23.083 -1.000 bad 8273 160 R THR N 12 N3H1s 0.700 1.640 2.623 13.176 13.832 0.953 [OK] 8274 160 R THR CA 3 C4H1s 0.770 1.880 3.400 16.529 13.099 1.262 possible 8275 160 R THR C 1 C3H0s 0.770 1.610 2.795 8.571 8.738 0.981 [OK] 8276 160 R THR O 16 O1H0u 0.660 1.420 2.671 16.672 16.020 1.041 [OK] 8277 160 R THR CB 4 C4H1b 0.770 1.880 2.763 14.145 14.829 0.954 [OK] 8278 160 R THR OG1 17 O2H1u 0.660 1.460 2.491 17.395 18.123 0.960 [OK] 8279 160 R THR CG2 10 C4H3u 0.770 1.880 3.158 41.549 36.542 1.137 possible 8280 161 R GLY N 12 N3H1s 0.700 1.640 2.722 13.104 14.854 0.882 [OK] 8281 161 R GLY CA 8 C4H2s 0.770 1.880 3.036 23.790 23.688 1.004 possible 8282 161 R GLY C 2 C3H0b 0.770 1.610 2.223 8.186 9.840 0.832 [OK] 8283 161 R GLY O 16 O1H0u 0.660 1.420 2.535 16.533 16.391 1.009 [OK] 8284 162 R TYR N 12 N3H1s 0.700 1.640 2.504 13.562 13.691 0.991 [OK] 8285 162 R TYR CA 3 C4H1s 0.770 1.880 2.497 11.478 13.330 0.861 [OK] 8286 162 R TYR C 1 C3H0s 0.770 1.610 4.632 10.244 8.770 1.168 possible 8287 162 R TYR O 16 O1H0u 0.660 1.420 7.035 -1.000 16.124 -1.000 bad 8288 162 R TYR CB 8 C4H2s 0.770 1.880 18.373 -1.000 23.678 -1.000 bad 8289 162 R TYR CG 2 C3H0b 0.770 1.610 7.388 18.867 9.732 1.939 possible 8290 162 R TYR CD1 5 C3H1s 0.770 1.760 5.441 26.568 20.171 1.317 possible 8291 162 R TYR CD2 5 C3H1s 0.770 1.760 9.932 -1.000 20.728 -1.000 bad 8292 162 R TYR CE1 5 C3H1s 0.770 1.760 4.186 26.337 20.675 1.274 possible 8293 162 R TYR CE2 5 C3H1s 0.770 1.760 4.498 27.321 20.810 1.313 possible 8294 162 R TYR CZ 2 C3H0b 0.770 1.610 3.732 11.847 9.926 1.194 possible 8295 162 R TYR OH 17 O2H1u 0.660 1.460 2.458 17.834 19.173 0.930 [OK] 8296 163 R THR N 12 N3H1s 0.700 1.640 4.035 14.487 13.832 1.047 possible 8297 163 R THR CA 3 C4H1s 0.770 1.880 10.246 -1.000 13.099 -1.000 bad 8298 163 R THR C 1 C3H0s 0.770 1.610 2.265 8.383 8.738 0.959 [OK] 8299 163 R THR O 16 O1H0u 0.660 1.420 15.143 -1.000 16.020 -1.000 bad 8300 163 R THR CB 4 C4H1b 0.770 1.880 3.096 13.524 14.829 0.912 possible 8301 163 R THR OG1 17 O2H1u 0.660 1.460 20.148 -1.000 18.123 -1.000 bad 8302 163 R THR CG2 10 C4H3u 0.770 1.880 26.946 -1.000 36.542 -1.000 bad 8303 164 R TYR N 12 N3H1s 0.700 1.640 2.210 11.407 13.691 0.833 [OK] 8304 164 R TYR CA 3 C4H1s 0.770 1.880 3.044 14.454 13.330 1.084 possible 8305 164 R TYR C 1 C3H0s 0.770 1.610 2.694 10.061 8.770 1.147 [OK] 8306 164 R TYR O 16 O1H0u 0.660 1.420 2.528 17.141 16.124 1.063 [OK] 8307 164 R TYR CB 8 C4H2s 0.770 1.880 2.970 23.183 23.678 0.979 [OK] 8308 164 R TYR CG 2 C3H0b 0.770 1.610 2.426 9.873 9.732 1.015 [OK] 8309 164 R TYR CD1 5 C3H1s 0.770 1.760 3.005 21.993 20.171 1.090 possible 8310 164 R TYR CD2 5 C3H1s 0.770 1.760 2.963 18.536 20.728 0.894 [OK] 8311 164 R TYR CE1 5 C3H1s 0.770 1.760 3.021 22.027 20.675 1.065 possible 8312 164 R TYR CE2 5 C3H1s 0.770 1.760 2.984 20.840 20.810 1.001 [OK] 8313 164 R TYR CZ 2 C3H0b 0.770 1.610 2.699 9.476 9.926 0.955 [OK] 8314 164 R TYR OH 17 O2H1u 0.660 1.460 3.080 20.205 19.173 1.054 possible 8315 165 R GLY N 12 N3H1s 0.700 1.640 2.633 13.532 14.854 0.911 [OK] 8316 165 R GLY CA 8 C4H2s 0.770 1.880 3.736 24.714 23.688 1.043 possible 8317 165 R GLY C 2 C3H0b 0.770 1.610 2.781 10.819 9.840 1.099 [OK] 8318 165 R GLY O 16 O1H0u 0.660 1.420 2.520 15.118 16.391 0.922 [OK] 8319 166 R ASN N 12 N3H1s 0.700 1.640 3.000 16.126 13.695 1.177 possible 8320 166 R ASN CA 3 C4H1s 0.770 1.880 3.109 15.700 13.167 1.192 possible 8321 166 R ASN C 1 C3H0s 0.770 1.610 2.748 8.498 8.928 0.952 [OK] 8322 166 R ASN O 16 O1H0u 0.660 1.420 2.659 16.688 16.199 1.030 [OK] 8323 166 R ASN CB 8 C4H2s 0.770 1.880 3.011 23.791 23.128 1.029 possible 8324 166 R ASN CG 2 C3H0b 0.770 1.610 2.531 10.102 9.599 1.052 [OK] 8325 166 R ASN OD1 16 O1H0u 0.660 1.420 2.730 16.722 16.664 1.003 [OK] 8326 166 R ASN ND2 15 N3H2u 0.700 1.640 2.747 24.320 23.083 1.054 [OK] 8327 167 R PHE N 12 N3H1s 0.700 1.640 2.826 13.610 13.691 0.994 [OK] 8328 167 R PHE CA 3 C4H1s 0.770 1.880 3.138 15.332 13.449 1.140 possible 8329 167 R PHE C 1 C3H0s 0.770 1.610 2.537 9.034 8.753 1.032 [OK] 8330 167 R PHE O 16 O1H0u 0.660 1.420 2.393 16.726 16.151 1.036 [OK] 8331 167 R PHE CB 8 C4H2s 0.770 1.880 2.767 19.973 23.777 0.840 [OK] 8332 167 R PHE CG 2 C3H0b 0.770 1.610 2.539 9.817 9.721 1.010 [OK] 8333 167 R PHE CD1 5 C3H1s 0.770 1.760 2.882 21.164 20.405 1.037 [OK] 8334 167 R PHE CD2 6 C3H1b 0.770 1.760 2.638 18.338 21.051 0.871 [OK] 8335 167 R PHE CE1 6 C3H1b 0.770 1.760 2.992 22.210 21.580 1.029 [OK] 8336 167 R PHE CE2 6 C3H1b 0.770 1.760 2.870 22.382 21.680 1.032 [OK] 8337 167 R PHE CZ 6 C3H1b 0.770 1.760 2.999 21.903 21.666 1.011 [OK] 8338 168 R HIS N 12 N3H1s 0.700 1.640 2.552 13.678 13.715 0.997 [OK] 8339 168 R HIS CA 3 C4H1s 0.770 1.880 2.554 12.545 13.467 0.932 [OK] 8340 168 R HIS C 1 C3H0s 0.770 1.610 2.606 8.342 8.882 0.939 [OK] 8341 168 R HIS O 16 O1H0u 0.660 1.420 2.531 16.400 16.082 1.020 [OK] 8342 168 R HIS CB 8 C4H2s 0.770 1.880 2.947 24.688 23.653 1.044 [OK] 8343 168 R HIS CG 2 C3H0b 0.770 1.610 2.541 9.827 9.952 0.987 [OK] 8344 168 R HIS ND1 13 N3H1b 0.700 1.640 2.520 15.550 15.506 1.003 [OK] 8345 168 R HIS CD2 5 C3H1s 0.770 1.760 2.638 19.233 21.085 0.912 [OK] 8346 168 R HIS CE1 5 C3H1s 0.770 1.760 2.853 20.741 20.636 1.005 [OK] 8347 168 R HIS NE2 13 N3H1b 0.700 1.640 2.453 13.870 15.337 0.904 [OK] 8348 169 R TYR N 12 N3H1s 0.700 1.640 2.684 13.934 13.691 1.018 [OK] 8349 169 R TYR CA 3 C4H1s 0.770 1.880 2.887 13.684 13.330 1.027 [OK] 8350 169 R TYR C 1 C3H0s 0.770 1.610 2.510 9.413 8.770 1.073 [OK] 8351 169 R TYR O 16 O1H0u 0.660 1.420 2.429 17.021 16.124 1.056 [OK] 8352 169 R TYR CB 8 C4H2s 0.770 1.880 2.679 20.372 23.678 0.860 [OK] 8353 169 R TYR CG 2 C3H0b 0.770 1.610 2.644 9.468 9.732 0.973 [OK] 8354 169 R TYR CD1 5 C3H1s 0.770 1.760 3.032 21.556 20.171 1.069 possible 8355 169 R TYR CD2 5 C3H1s 0.770 1.760 2.770 21.594 20.728 1.042 [OK] 8356 169 R TYR CE1 5 C3H1s 0.770 1.760 3.209 21.267 20.675 1.029 possible 8357 169 R TYR CE2 5 C3H1s 0.770 1.760 3.075 24.725 20.810 1.188 possible 8358 169 R TYR CZ 2 C3H0b 0.770 1.610 2.652 11.189 9.926 1.127 [OK] 8359 169 R TYR OH 17 O2H1u 0.660 1.460 3.288 21.229 19.173 1.107 possible 8360 170 R ASN N 12 N3H1s 0.700 1.640 2.647 13.837 13.695 1.010 [OK] 8361 170 R ASN CA 3 C4H1s 0.770 1.880 2.548 12.155 13.167 0.923 [OK] 8362 170 R ASN C 1 C3H0s 0.770 1.610 2.563 8.290 8.928 0.929 [OK] 8363 170 R ASN O 16 O1H0u 0.660 1.420 2.455 14.638 16.199 0.904 [OK] 8364 170 R ASN CB 8 C4H2s 0.770 1.880 2.727 21.860 23.128 0.945 [OK] 8365 170 R ASN CG 2 C3H0b 0.770 1.610 2.401 9.444 9.599 0.984 [OK] 8366 170 R ASN OD1 16 O1H0u 0.660 1.420 2.471 15.831 16.664 0.950 [OK] 8367 170 R ASN ND2 15 N3H2u 0.700 1.640 2.624 21.894 23.083 0.948 [OK] 8368 171 R PRO N 11 N3H0u 0.700 1.640 2.590 8.449 8.823 0.958 [OK] 8369 171 R PRO CA 4 C4H1b 0.770 1.880 3.543 15.320 13.955 1.098 possible 8370 171 R PRO C 1 C3H0s 0.770 1.610 3.018 9.303 8.812 1.056 possible 8371 171 R PRO O 16 O1H0u 0.660 1.420 3.734 19.124 16.169 1.183 possible 8372 171 R PRO CB 9 C4H2b 0.770 1.880 5.186 46.115 25.563 1.804 possible 8373 171 R PRO CG 9 C4H2b 0.770 1.880 5.765 49.441 25.832 1.914 possible 8374 171 R PRO CD 8 C4H2s 0.770 1.880 2.900 23.214 23.836 0.974 [OK] 8375 172 R ALA N 12 N3H1s 0.700 1.640 4.140 16.398 14.046 1.167 possible 8376 172 R ALA CA 4 C4H1b 0.770 1.880 3.592 15.365 14.063 1.093 possible 8377 172 R ALA C 1 C3H0s 0.770 1.610 2.328 8.494 8.900 0.954 [OK] 8378 172 R ALA O 16 O1H0u 0.660 1.420 2.482 16.066 16.188 0.992 [OK] 8379 172 R ALA CB 10 C4H3u 0.770 1.880 4.991 46.923 36.782 1.276 possible 8380 173 R HIS N 12 N3H1s 0.700 1.640 2.351 12.011 13.715 0.876 [OK] 8381 173 R HIS CA 3 C4H1s 0.770 1.880 3.159 15.514 13.467 1.152 possible 8382 173 R HIS C 1 C3H0s 0.770 1.610 2.276 8.333 8.882 0.938 [OK] 8383 173 R HIS O 16 O1H0u 0.660 1.420 2.490 14.732 16.082 0.916 [OK] 8384 173 R HIS CB 8 C4H2s 0.770 1.880 2.919 21.818 23.653 0.922 [OK] 8385 173 R HIS CG 2 C3H0b 0.770 1.610 2.634 10.656 9.952 1.071 [OK] 8386 173 R HIS ND1 13 N3H1b 0.700 1.640 2.634 15.430 15.506 0.995 [OK] 8387 173 R HIS CD2 5 C3H1s 0.770 1.760 3.050 23.305 21.085 1.105 possible 8388 173 R HIS CE1 5 C3H1s 0.770 1.760 2.667 18.883 20.636 0.915 [OK] 8389 173 R HIS NE2 13 N3H1b 0.700 1.640 2.535 10.984 15.337 0.716 [OK] 8390 174 R MET N 12 N3H1s 0.700 1.640 2.395 12.978 13.564 0.957 [OK] 8391 174 R MET CA 3 C4H1s 0.770 1.880 2.445 12.952 13.231 0.979 [OK] 8392 174 R MET C 1 C3H0s 0.770 1.610 3.491 9.131 8.782 1.040 possible 8393 174 R MET O 16 O1H0u 0.660 1.420 2.781 15.504 16.277 0.952 [OK] 8394 174 R MET CB 8 C4H2s 0.770 1.880 4.774 28.904 23.645 1.222 possible 8395 174 R MET CG 9 C4H2b 0.770 1.880 2.969 22.733 24.009 0.947 [OK] 8396 174 R MET SD 19 S2H0u 1.040 1.770 5.193 41.038 30.093 1.364 possible 8397 174 R MET CE 10 C4H3u 0.770 1.880 3.493 38.819 37.161 1.045 possible 8398 175 R ILE N 12 N3H1s 0.700 1.640 3.804 14.503 13.633 1.064 possible 8399 175 R ILE CA 3 C4H1s 0.770 1.880 3.892 17.113 13.007 1.316 possible 8400 175 R ILE C 1 C3H0s 0.770 1.610 2.501 8.135 8.470 0.960 [OK] 8401 175 R ILE O 16 O1H0u 0.660 1.420 2.864 14.689 16.144 0.910 [OK] 8402 175 R ILE CB 4 C4H1b 0.770 1.880 2.602 13.768 14.227 0.968 [OK] 8403 175 R ILE CG1 9 C4H2b 0.770 1.880 18.908 -1.000 24.187 -1.000 bad 8404 175 R ILE CG2 10 C4H3u 0.770 1.880 13.448 -1.000 35.961 -1.000 bad 8405 175 R ILE CD1 10 C4H3u 0.770 1.880 38.220 -1.000 38.377 -1.000 bad 8406 176 R ALA N 12 N3H1s 0.700 1.640 2.539 12.463 14.046 0.887 [OK] 8407 176 R ALA CA 4 C4H1b 0.770 1.880 2.915 14.960 14.063 1.064 [OK] 8408 176 R ALA C 1 C3H0s 0.770 1.610 2.350 8.305 8.900 0.933 [OK] 8409 176 R ALA O 16 O1H0u 0.660 1.420 2.334 14.413 16.188 0.890 [OK] 8410 176 R ALA CB 10 C4H3u 0.770 1.880 3.189 33.932 36.782 0.923 possible 8411 177 R ILE N 12 N3H1s 0.700 1.640 2.378 12.292 13.633 0.902 [OK] 8412 177 R ILE CA 3 C4H1s 0.770 1.880 3.261 15.377 13.007 1.182 possible 8413 177 R ILE C 1 C3H0s 0.770 1.610 2.652 7.741 8.470 0.914 [OK] 8414 177 R ILE O 16 O1H0u 0.660 1.420 2.730 15.016 16.144 0.930 [OK] 8415 177 R ILE CB 4 C4H1b 0.770 1.880 2.645 13.202 14.227 0.928 [OK] 8416 177 R ILE CG1 9 C4H2b 0.770 1.880 3.124 21.204 24.187 0.877 possible 8417 177 R ILE CG2 10 C4H3u 0.770 1.880 3.186 32.010 35.961 0.890 possible 8418 177 R ILE CD1 10 C4H3u 0.770 1.880 2.683 28.300 38.377 0.737 [OK] 8419 178 R SER N 12 N3H1s 0.700 1.640 2.833 13.403 14.103 0.950 [OK] 8420 178 R SER CA 3 C4H1s 0.770 1.880 3.032 13.391 13.476 0.994 possible 8421 178 R SER C 1 C3H0s 0.770 1.610 3.624 9.462 8.923 1.060 possible 8422 178 R SER O 16 O1H0u 0.660 1.420 2.999 15.018 16.179 0.928 [OK] 8423 178 R SER CB 8 C4H2s 0.770 1.880 22.426 -1.000 23.884 -1.000 bad 8424 178 R SER OG 17 O2H1u 0.660 1.460 6.943 -1.000 18.732 -1.000 bad 8425 179 R PHE N 12 N3H1s 0.700 1.640 3.331 14.203 13.691 1.037 possible 8426 179 R PHE CA 3 C4H1s 0.770 1.880 3.310 13.950 13.449 1.037 possible 8427 179 R PHE C 1 C3H0s 0.770 1.610 2.325 8.433 8.753 0.963 [OK] 8428 179 R PHE O 16 O1H0u 0.660 1.420 2.586 17.678 16.151 1.095 [OK] 8429 179 R PHE CB 8 C4H2s 0.770 1.880 2.749 20.457 23.777 0.860 [OK] 8430 179 R PHE CG 2 C3H0b 0.770 1.610 3.257 10.225 9.721 1.052 possible 8431 179 R PHE CD1 5 C3H1s 0.770 1.760 3.994 23.439 20.405 1.149 possible 8432 179 R PHE CD2 6 C3H1b 0.770 1.760 3.413 21.294 21.051 1.012 possible 8433 179 R PHE CE1 6 C3H1b 0.770 1.760 7.503 59.713 21.580 2.767 possible 8434 179 R PHE CE2 6 C3H1b 0.770 1.760 4.688 28.131 21.680 1.298 possible 8435 179 R PHE CZ 6 C3H1b 0.770 1.760 28.396 -1.000 21.666 -1.000 bad 8436 180 R PHE N 12 N3H1s 0.700 1.640 2.307 12.444 13.691 0.909 [OK] 8437 180 R PHE CA 3 C4H1s 0.770 1.880 3.190 14.608 13.449 1.086 possible 8438 180 R PHE C 1 C3H0s 0.770 1.610 2.343 8.466 8.753 0.967 [OK] 8439 180 R PHE O 16 O1H0u 0.660 1.420 2.354 15.281 16.151 0.946 [OK] 8440 180 R PHE CB 8 C4H2s 0.770 1.880 3.261 25.462 23.777 1.071 possible 8441 180 R PHE CG 2 C3H0b 0.770 1.610 2.877 9.882 9.721 1.017 [OK] 8442 180 R PHE CD1 5 C3H1s 0.770 1.760 3.078 21.334 20.405 1.046 possible 8443 180 R PHE CD2 6 C3H1b 0.770 1.760 3.136 20.158 21.051 0.958 possible 8444 180 R PHE CE1 6 C3H1b 0.770 1.760 3.020 23.041 21.580 1.068 possible 8445 180 R PHE CE2 6 C3H1b 0.770 1.760 3.020 18.471 21.680 0.852 possible 8446 180 R PHE CZ 6 C3H1b 0.770 1.760 3.030 23.953 21.666 1.106 possible 8447 181 R PHE N 12 N3H1s 0.700 1.640 2.372 12.512 13.691 0.914 [OK] 8448 181 R PHE CA 3 C4H1s 0.770 1.880 2.960 14.046 13.449 1.044 [OK] 8449 181 R PHE C 1 C3H0s 0.770 1.610 2.748 9.031 8.753 1.032 [OK] 8450 181 R PHE O 16 O1H0u 0.660 1.420 2.595 15.504 16.151 0.960 [OK] 8451 181 R PHE CB 8 C4H2s 0.770 1.880 2.847 22.624 23.777 0.952 [OK] 8452 181 R PHE CG 2 C3H0b 0.770 1.610 2.573 10.598 9.721 1.090 [OK] 8453 181 R PHE CD1 5 C3H1s 0.770 1.760 2.966 20.449 20.405 1.002 [OK] 8454 181 R PHE CD2 6 C3H1b 0.770 1.760 2.929 20.726 21.051 0.985 [OK] 8455 181 R PHE CE1 6 C3H1b 0.770 1.760 3.068 22.470 21.580 1.041 possible 8456 181 R PHE CE2 6 C3H1b 0.770 1.760 3.025 22.942 21.680 1.058 possible 8457 181 R PHE CZ 6 C3H1b 0.770 1.760 2.742 21.359 21.666 0.986 [OK] 8458 182 R THR N 12 N3H1s 0.700 1.640 2.535 13.079 13.832 0.946 [OK] 8459 182 R THR CA 3 C4H1s 0.770 1.880 2.879 14.067 13.099 1.074 [OK] 8460 182 R THR C 1 C3H0s 0.770 1.610 2.211 8.135 8.738 0.931 [OK] 8461 182 R THR O 16 O1H0u 0.660 1.420 2.575 15.505 16.020 0.968 [OK] 8462 182 R THR CB 4 C4H1b 0.770 1.880 3.430 16.754 14.829 1.130 possible 8463 182 R THR OG1 17 O2H1u 0.660 1.460 5.185 31.362 18.123 1.730 possible 8464 182 R THR CG2 10 C4H3u 0.770 1.880 5.746 48.476 36.542 1.327 possible 8465 183 R ASN N 12 N3H1s 0.700 1.640 2.607 13.549 13.695 0.989 [OK] 8466 183 R ASN CA 3 C4H1s 0.770 1.880 2.980 13.517 13.167 1.027 [OK] 8467 183 R ASN C 1 C3H0s 0.770 1.610 2.290 7.829 8.928 0.877 [OK] 8468 183 R ASN O 16 O1H0u 0.660 1.420 2.576 15.559 16.199 0.960 [OK] 8469 183 R ASN CB 8 C4H2s 0.770 1.880 3.190 24.767 23.128 1.071 possible 8470 183 R ASN CG 2 C3H0b 0.770 1.610 2.728 9.404 9.599 0.980 [OK] 8471 183 R ASN OD1 16 O1H0u 0.660 1.420 2.548 17.418 16.664 1.045 [OK] 8472 183 R ASN ND2 15 N3H2u 0.700 1.640 2.622 22.255 23.083 0.964 [OK] 8473 184 R ALA N 12 N3H1s 0.700 1.640 2.339 13.406 14.046 0.954 [OK] 8474 184 R ALA CA 4 C4H1b 0.770 1.880 2.854 15.154 14.063 1.078 [OK] 8475 184 R ALA C 1 C3H0s 0.770 1.610 2.449 8.602 8.900 0.966 [OK] 8476 184 R ALA O 16 O1H0u 0.660 1.420 2.384 15.751 16.188 0.973 [OK] 8477 184 R ALA CB 10 C4H3u 0.770 1.880 3.019 40.147 36.782 1.091 possible 8478 185 R LEU N 12 N3H1s 0.700 1.640 2.168 12.291 13.655 0.900 [OK] 8479 185 R LEU CA 3 C4H1s 0.770 1.880 2.698 12.955 13.122 0.987 [OK] 8480 185 R LEU C 1 C3H0s 0.770 1.610 2.375 8.035 8.825 0.910 [OK] 8481 185 R LEU O 16 O1H0u 0.660 1.420 2.225 15.348 16.208 0.947 [OK] 8482 185 R LEU CB 8 C4H2s 0.770 1.880 3.007 19.947 22.951 0.869 possible 8483 185 R LEU CG 4 C4H1b 0.770 1.880 3.050 16.887 14.764 1.144 possible 8484 185 R LEU CD1 10 C4H3u 0.770 1.880 3.246 31.584 37.425 0.844 possible 8485 185 R LEU CD2 10 C4H3u 0.770 1.880 3.475 37.953 37.143 1.022 possible 8486 186 R ALA N 12 N3H1s 0.700 1.640 2.785 13.202 14.046 0.940 [OK] 8487 186 R ALA CA 4 C4H1b 0.770 1.880 2.945 14.670 14.063 1.043 [OK] 8488 186 R ALA C 1 C3H0s 0.770 1.610 2.120 8.370 8.900 0.940 [OK] 8489 186 R ALA O 16 O1H0u 0.660 1.420 2.346 16.027 16.188 0.990 [OK] 8490 186 R ALA CB 10 C4H3u 0.770 1.880 3.117 40.602 36.782 1.104 possible 8491 187 R LEU N 12 N3H1s 0.700 1.640 2.339 12.487 13.655 0.914 [OK] 8492 187 R LEU CA 3 C4H1s 0.770 1.880 2.868 13.002 13.122 0.991 [OK] 8493 187 R LEU C 1 C3H0s 0.770 1.610 2.578 8.506 8.825 0.964 [OK] 8494 187 R LEU O 16 O1H0u 0.660 1.420 2.682 18.255 16.208 1.126 [OK] 8495 187 R LEU CB 8 C4H2s 0.770 1.880 2.876 22.910 22.951 0.998 [OK] 8496 187 R LEU CG 4 C4H1b 0.770 1.880 2.666 14.211 14.764 0.963 [OK] 8497 187 R LEU CD1 10 C4H3u 0.770 1.880 3.336 40.347 37.425 1.078 possible 8498 187 R LEU CD2 10 C4H3u 0.770 1.880 2.829 34.537 37.143 0.930 [OK] 8499 188 R ALA N 12 N3H1s 0.700 1.640 2.627 12.749 14.046 0.908 [OK] 8500 188 R ALA CA 4 C4H1b 0.770 1.880 2.921 15.698 14.063 1.116 [OK] 8501 188 R ALA C 1 C3H0s 0.770 1.610 2.837 9.073 8.900 1.019 [OK] 8502 188 R ALA O 16 O1H0u 0.660 1.420 2.703 16.944 16.188 1.047 [OK] 8503 188 R ALA CB 10 C4H3u 0.770 1.880 3.220 38.254 36.782 1.040 possible 8504 189 R LEU N 12 N3H1s 0.700 1.640 2.865 13.649 13.655 1.000 [OK] 8505 189 R LEU CA 3 C4H1s 0.770 1.880 3.147 13.605 13.122 1.037 possible 8506 189 R LEU C 1 C3H0s 0.770 1.610 2.142 8.165 8.825 0.925 [OK] 8507 189 R LEU O 16 O1H0u 0.660 1.420 2.270 14.722 16.208 0.908 [OK] 8508 189 R LEU CB 8 C4H2s 0.770 1.880 2.727 19.335 22.951 0.842 [OK] 8509 189 R LEU CG 4 C4H1b 0.770 1.880 2.793 14.632 14.764 0.991 [OK] 8510 189 R LEU CD1 10 C4H3u 0.770 1.880 3.227 36.959 37.425 0.988 possible 8511 189 R LEU CD2 10 C4H3u 0.770 1.880 3.152 34.769 37.143 0.936 possible 8512 190 R HIS N 12 N3H1s 0.700 1.640 2.604 13.347 13.715 0.973 [OK] 8513 190 R HIS CA 3 C4H1s 0.770 1.880 2.719 13.420 13.467 0.996 [OK] 8514 190 R HIS C 1 C3H0s 0.770 1.610 2.363 8.311 8.882 0.936 [OK] 8515 190 R HIS O 16 O1H0u 0.660 1.420 2.562 16.408 16.082 1.020 [OK] 8516 190 R HIS CB 8 C4H2s 0.770 1.880 3.101 24.077 23.653 1.018 possible 8517 190 R HIS CG 2 C3H0b 0.770 1.610 2.462 9.123 9.952 0.917 [OK] 8518 190 R HIS ND1 13 N3H1b 0.700 1.640 2.668 14.325 15.506 0.924 [OK] 8519 190 R HIS CD2 5 C3H1s 0.770 1.760 3.088 26.617 21.085 1.262 possible 8520 190 R HIS CE1 5 C3H1s 0.770 1.760 2.674 18.619 20.636 0.902 [OK] 8521 190 R HIS NE2 13 N3H1b 0.700 1.640 2.726 10.815 15.337 0.705 [OK] 8522 191 R GLY N 12 N3H1s 0.700 1.640 2.900 15.613 14.854 1.051 [OK] 8523 191 R GLY CA 8 C4H2s 0.770 1.880 3.001 24.784 23.688 1.046 possible 8524 191 R GLY C 2 C3H0b 0.770 1.610 2.468 9.635 9.840 0.979 [OK] 8525 191 R GLY O 16 O1H0u 0.660 1.420 2.275 15.731 16.391 0.960 [OK] 8526 192 R ALA N 12 N3H1s 0.700 1.640 2.452 13.348 14.046 0.950 [OK] 8527 192 R ALA CA 4 C4H1b 0.770 1.880 2.873 13.744 14.063 0.977 [OK] 8528 192 R ALA C 1 C3H0s 0.770 1.610 2.506 8.724 8.900 0.980 [OK] 8529 192 R ALA O 16 O1H0u 0.660 1.420 2.514 15.475 16.188 0.956 [OK] 8530 192 R ALA CB 10 C4H3u 0.770 1.880 3.227 35.320 36.782 0.960 possible 8531 193 R LEU N 12 N3H1s 0.700 1.640 2.520 13.611 13.655 0.997 [OK] 8532 193 R LEU CA 3 C4H1s 0.770 1.880 2.727 13.423 13.122 1.023 [OK] 8533 193 R LEU C 1 C3H0s 0.770 1.610 2.235 8.166 8.825 0.925 [OK] 8534 193 R LEU O 16 O1H0u 0.660 1.420 2.288 15.063 16.208 0.929 [OK] 8535 193 R LEU CB 8 C4H2s 0.770 1.880 3.001 23.819 22.951 1.038 possible 8536 193 R LEU CG 4 C4H1b 0.770 1.880 2.906 13.774 14.764 0.933 [OK] 8537 193 R LEU CD1 10 C4H3u 0.770 1.880 2.878 34.573 37.425 0.924 [OK] 8538 193 R LEU CD2 10 C4H3u 0.770 1.880 3.275 36.462 37.143 0.982 possible 8539 194 R VAL N 12 N3H1s 0.700 1.640 2.599 13.582 13.676 0.993 [OK] 8540 194 R VAL CA 3 C4H1s 0.770 1.880 2.859 13.612 13.123 1.037 [OK] 8541 194 R VAL C 1 C3H0s 0.770 1.610 2.894 8.100 8.563 0.946 [OK] 8542 194 R VAL O 16 O1H0u 0.660 1.420 2.715 14.514 16.181 0.897 [OK] 8543 194 R VAL CB 4 C4H1b 0.770 1.880 2.706 14.422 14.598 0.988 [OK] 8544 194 R VAL CG1 10 C4H3u 0.770 1.880 3.179 40.131 36.584 1.097 possible 8545 194 R VAL CG2 10 C4H3u 0.770 1.880 3.043 35.127 36.332 0.967 possible 8546 195 R LEU N 12 N3H1s 0.700 1.640 2.855 14.059 13.655 1.030 [OK] 8547 195 R LEU CA 3 C4H1s 0.770 1.880 3.135 13.499 13.122 1.029 possible 8548 195 R LEU C 1 C3H0s 0.770 1.610 2.159 8.182 8.825 0.927 [OK] 8549 195 R LEU O 16 O1H0u 0.660 1.420 2.468 14.994 16.208 0.925 [OK] 8550 195 R LEU CB 8 C4H2s 0.770 1.880 2.872 21.359 22.951 0.931 [OK] 8551 195 R LEU CG 4 C4H1b 0.770 1.880 2.795 13.574 14.764 0.919 [OK] 8552 195 R LEU CD1 10 C4H3u 0.770 1.880 3.403 38.531 37.425 1.030 possible 8553 195 R LEU CD2 10 C4H3u 0.770 1.880 3.179 36.761 37.143 0.990 possible 8554 196 R SER N 12 N3H1s 0.700 1.640 2.261 12.350 14.103 0.876 [OK] 8555 196 R SER CA 3 C4H1s 0.770 1.880 2.585 13.029 13.476 0.967 [OK] 8556 196 R SER C 1 C3H0s 0.770 1.610 2.200 8.657 8.923 0.970 [OK] 8557 196 R SER O 16 O1H0u 0.660 1.420 2.355 16.887 16.179 1.044 [OK] 8558 196 R SER CB 8 C4H2s 0.770 1.880 2.900 22.145 23.884 0.927 [OK] 8559 196 R SER OG 17 O2H1u 0.660 1.460 2.432 16.400 18.732 0.876 [OK] 8560 197 R ALA N 12 N3H1s 0.700 1.640 2.307 12.380 14.046 0.881 [OK] 8561 197 R ALA CA 4 C4H1b 0.770 1.880 2.673 13.176 14.063 0.937 [OK] 8562 197 R ALA C 1 C3H0s 0.770 1.610 2.519 8.853 8.900 0.995 [OK] 8563 197 R ALA O 16 O1H0u 0.660 1.420 2.482 17.546 16.188 1.084 [OK] 8564 197 R ALA CB 10 C4H3u 0.770 1.880 2.952 33.873 36.782 0.921 [OK] 8565 198 R ALA N 12 N3H1s 0.700 1.640 2.366 12.207 14.046 0.869 [OK] 8566 198 R ALA CA 4 C4H1b 0.770 1.880 2.751 13.639 14.063 0.970 [OK] 8567 198 R ALA C 1 C3H0s 0.770 1.610 2.269 8.507 8.900 0.956 [OK] 8568 198 R ALA O 16 O1H0u 0.660 1.420 2.647 17.030 16.188 1.052 [OK] 8569 198 R ALA CB 10 C4H3u 0.770 1.880 3.179 40.993 36.782 1.114 possible 8570 199 R ASN N 12 N3H1s 0.700 1.640 2.452 13.008 13.695 0.950 [OK] 8571 199 R ASN CA 3 C4H1s 0.770 1.880 3.527 13.372 13.167 1.016 possible 8572 199 R ASN C 1 C3H0s 0.770 1.610 2.725 9.175 8.928 1.028 [OK] 8573 199 R ASN O 16 O1H0u 0.660 1.420 4.303 20.780 16.199 1.283 possible 8574 199 R ASN CB 8 C4H2s 0.770 1.880 6.309 47.953 23.128 2.073 possible 8575 199 R ASN CG 2 C3H0b 0.770 1.610 4.340 11.403 9.599 1.188 possible 8576 199 R ASN OD1 16 O1H0u 0.660 1.420 2.463 16.627 16.664 0.998 [OK] 8577 199 R ASN ND2 15 N3H2u 0.700 1.640 4.742 28.827 23.083 1.249 possible 8578 200 R PRO N 11 N3H0u 0.700 1.640 2.767 8.785 8.823 0.996 [OK] 8579 200 R PRO CA 4 C4H1b 0.770 1.880 2.628 13.175 13.955 0.944 [OK] 8580 200 R PRO C 1 C3H0s 0.770 1.610 2.733 9.305 8.812 1.056 [OK] 8581 200 R PRO O 16 O1H0u 0.660 1.420 6.307 53.871 16.169 3.332 possible 8582 200 R PRO CB 9 C4H2b 0.770 1.880 2.881 23.407 25.563 0.916 [OK] 8583 200 R PRO CG 9 C4H2b 0.770 1.880 4.081 27.796 25.832 1.076 possible 8584 200 R PRO CD 8 C4H2s 0.770 1.880 3.699 27.895 23.836 1.170 possible 8585 201 R GLU N 12 N3H1s 0.700 1.640 2.815 14.827 13.615 1.089 [OK] 8586 201 R GLU CA 3 C4H1s 0.770 1.880 6.018 28.180 13.399 2.103 possible 8587 201 R GLU C 1 C3H0s 0.770 1.610 2.669 8.759 8.675 1.010 [OK] 8588 201 R GLU O 16 O1H0u 0.660 1.420 3.632 17.476 16.023 1.091 possible 8589 201 R GLU CB 8 C4H2s 0.770 1.880 6.545 40.427 23.529 1.718 possible 8590 201 R GLU CG 8 C4H2s 0.770 1.880 7.105 45.481 23.513 1.934 possible 8591 201 R GLU CD 2 C3H0b 0.770 1.610 5.287 14.043 9.460 1.484 possible 8592 201 R GLU OE1 16 O1H0u 0.660 1.420 19.554 -1.000 15.999 -1.000 bad 8593 201 R GLU OE2 16 O1H0u 0.660 1.420 3.367 19.277 17.432 1.106 possible 8594 202 R LYS N 12 N3H1s 0.700 1.640 7.967 61.859 13.675 4.524 possible 8595 202 R LYS CA 3 C4H1s 0.770 1.880 4.904 23.879 13.324 1.792 possible 8596 202 R LYS C 1 C3H0s 0.770 1.610 3.009 8.121 8.759 0.927 possible 8597 202 R LYS O 16 O1H0u 0.660 1.420 24.023 -1.000 16.049 -1.000 bad 8598 202 R LYS CB 8 C4H2s 0.770 1.880 27.992 -1.000 22.904 -1.000 bad 8599 202 R LYS CG 8 C4H2s 0.770 1.880 14.777 -1.000 23.131 -1.000 bad 8600 202 R LYS CD 8 C4H2s 0.770 1.880 34.206 -1.000 23.837 -1.000 bad 8601 202 R LYS CE 9 C4H2b 0.770 1.880 40.370 -1.000 23.934 -1.000 bad 8602 202 R LYS NZ 14 N4H3u 0.700 1.640 56.745 -1.000 21.213 -1.000 bad 8603 203 R GLY N 12 N3H1s 0.700 1.640 4.585 32.517 14.854 2.189 possible 8604 203 R GLY CA 8 C4H2s 0.770 1.880 28.370 -1.000 23.688 -1.000 bad 8605 203 R GLY C 2 C3H0b 0.770 1.610 3.900 12.368 9.840 1.257 possible 8606 203 R GLY O 16 O1H0u 0.660 1.420 24.397 -1.000 16.391 -1.000 bad 8607 204 R LYS N 12 N3H1s 0.700 1.640 2.880 14.074 13.675 1.029 [OK] 8608 204 R LYS CA 3 C4H1s 0.770 1.880 5.336 17.145 13.324 1.287 possible 8609 204 R LYS C 1 C3H0s 0.770 1.610 2.727 9.383 8.759 1.071 [OK] 8610 204 R LYS O 16 O1H0u 0.660 1.420 3.927 29.081 16.049 1.812 possible 8611 204 R LYS CB 8 C4H2s 0.770 1.880 3.883 24.043 22.904 1.050 possible 8612 204 R LYS CG 8 C4H2s 0.770 1.880 7.014 52.626 23.131 2.275 possible 8613 204 R LYS CD 8 C4H2s 0.770 1.880 4.210 26.961 23.837 1.131 possible 8614 204 R LYS CE 9 C4H2b 0.770 1.880 29.751 -1.000 23.934 -1.000 bad 8615 204 R LYS NZ 14 N4H3u 0.700 1.640 6.715 -1.000 21.213 -1.000 bad 8616 205 R GLU N 12 N3H1s 0.700 1.640 4.671 24.521 13.615 1.801 possible 8617 205 R GLU CA 3 C4H1s 0.770 1.880 2.601 13.075 13.399 0.976 [OK] 8618 205 R GLU C 1 C3H0s 0.770 1.610 2.366 8.262 8.675 0.952 [OK] 8619 205 R GLU O 16 O1H0u 0.660 1.420 2.203 13.727 16.023 0.857 [OK] 8620 205 R GLU CB 8 C4H2s 0.770 1.880 3.454 23.643 23.529 1.005 possible 8621 205 R GLU CG 8 C4H2s 0.770 1.880 18.309 -1.000 23.513 -1.000 bad 8622 205 R GLU CD 2 C3H0b 0.770 1.610 3.092 -1.000 9.460 -1.000 bad 8623 205 R GLU OE1 16 O1H0u 0.660 1.420 28.098 -1.000 15.999 -1.000 bad 8624 205 R GLU OE2 16 O1H0u 0.660 1.420 15.969 -1.000 17.432 -1.000 bad 8625 206 R MET N 12 N3H1s 0.700 1.640 3.395 15.657 13.564 1.154 possible 8626 206 R MET CA 3 C4H1s 0.770 1.880 3.396 14.584 13.231 1.102 possible 8627 206 R MET C 1 C3H0s 0.770 1.610 2.611 8.491 8.782 0.967 [OK] 8628 206 R MET O 16 O1H0u 0.660 1.420 2.528 16.606 16.277 1.020 [OK] 8629 206 R MET CB 8 C4H2s 0.770 1.880 3.590 26.066 23.645 1.102 possible 8630 206 R MET CG 9 C4H2b 0.770 1.880 3.035 26.482 24.009 1.103 possible 8631 206 R MET SD 19 S2H0u 1.040 1.770 3.259 33.322 30.093 1.107 possible 8632 206 R MET CE 10 C4H3u 0.770 1.880 3.076 38.469 37.161 1.035 possible 8633 207 R ARG N 12 N3H1s 0.700 1.640 2.411 13.041 13.650 0.955 [OK] 8634 207 R ARG CA 3 C4H1s 0.770 1.880 2.753 12.446 13.422 0.927 [OK] 8635 207 R ARG C 1 C3H0s 0.770 1.610 2.506 9.627 8.838 1.089 [OK] 8636 207 R ARG O 16 O1H0u 0.660 1.420 2.475 19.028 16.084 1.183 [OK] 8637 207 R ARG CB 8 C4H2s 0.770 1.880 2.877 21.317 23.088 0.923 [OK] 8638 207 R ARG CG 8 C4H2s 0.770 1.880 2.857 20.740 23.640 0.877 [OK] 8639 207 R ARG CD 8 C4H2s 0.770 1.880 2.905 21.650 23.300 0.929 [OK] 8640 207 R ARG NE 13 N3H1b 0.700 1.640 2.493 14.822 15.569 0.952 [OK] 8641 207 R ARG CZ 2 C3H0b 0.770 1.610 2.572 10.252 9.747 1.052 [OK] 8642 207 R ARG NH1 15 N3H2u 0.700 1.640 4.470 30.280 22.782 1.329 possible 8643 207 R ARG NH2 15 N3H2u 0.700 1.640 3.722 25.101 23.810 1.054 possible 8644 208 R THR N 12 N3H1s 0.700 1.640 2.355 12.256 13.832 0.886 [OK] 8645 208 R THR CA 3 C4H1s 0.770 1.880 2.753 12.683 13.099 0.968 [OK] 8646 208 R THR C 1 C3H0s 0.770 1.610 2.225 8.380 8.738 0.959 [OK] 8647 208 R THR O 16 O1H0u 0.660 1.420 2.491 15.566 16.020 0.972 [OK] 8648 208 R THR CB 4 C4H1b 0.770 1.880 3.040 15.920 14.829 1.074 possible 8649 208 R THR OG1 17 O2H1u 0.660 1.460 2.473 17.095 18.123 0.943 [OK] 8650 208 R THR CG2 10 C4H3u 0.770 1.880 3.230 35.787 36.542 0.979 possible 8651 209 R PRO N 11 N3H0u 0.700 1.640 2.557 7.958 8.823 0.902 [OK] 8652 209 R PRO CA 4 C4H1b 0.770 1.880 2.509 13.306 13.955 0.953 [OK] 8653 209 R PRO C 1 C3H0s 0.770 1.610 2.188 8.464 8.812 0.960 [OK] 8654 209 R PRO O 16 O1H0u 0.660 1.420 2.284 14.625 16.169 0.905 [OK] 8655 209 R PRO CB 9 C4H2b 0.770 1.880 2.795 21.976 25.563 0.860 [OK] 8656 209 R PRO CG 9 C4H2b 0.770 1.880 3.197 29.453 25.832 1.140 possible 8657 209 R PRO CD 8 C4H2s 0.770 1.880 3.488 27.799 23.836 1.166 possible 8658 210 R ASP N 12 N3H1s 0.700 1.640 2.524 13.351 13.895 0.961 [OK] 8659 210 R ASP CA 3 C4H1s 0.770 1.880 2.884 15.445 13.377 1.155 [OK] 8660 210 R ASP C 1 C3H0s 0.770 1.610 2.110 8.180 8.816 0.928 [OK] 8661 210 R ASP O 16 O1H0u 0.660 1.420 2.535 14.833 16.091 0.922 [OK] 8662 210 R ASP CB 8 C4H2s 0.770 1.880 3.349 24.551 23.481 1.046 possible 8663 210 R ASP CG 2 C3H0b 0.770 1.610 2.667 9.571 9.422 1.016 [OK] 8664 210 R ASP OD1 16 O1H0u 0.660 1.420 2.537 16.262 15.505 1.049 [OK] 8665 210 R ASP OD2 16 O1H0u 0.660 1.420 3.528 30.915 16.324 1.894 possible 8666 211 R HIS N 12 N3H1s 0.700 1.640 2.427 12.822 13.715 0.935 [OK] 8667 211 R HIS CA 3 C4H1s 0.770 1.880 2.854 14.705 13.467 1.092 [OK] 8668 211 R HIS C 1 C3H0s 0.770 1.610 2.186 8.122 8.882 0.914 [OK] 8669 211 R HIS O 16 O1H0u 0.660 1.420 2.371 14.783 16.082 0.919 [OK] 8670 211 R HIS CB 8 C4H2s 0.770 1.880 2.902 23.002 23.653 0.972 [OK] 8671 211 R HIS CG 2 C3H0b 0.770 1.610 2.619 9.713 9.952 0.976 [OK] 8672 211 R HIS ND1 13 N3H1b 0.700 1.640 2.701 18.374 15.506 1.185 [OK] 8673 211 R HIS CD2 5 C3H1s 0.770 1.760 2.583 16.860 21.085 0.800 [OK] 8674 211 R HIS CE1 5 C3H1s 0.770 1.760 2.853 21.895 20.636 1.061 [OK] 8675 211 R HIS NE2 13 N3H1b 0.700 1.640 3.625 18.202 15.337 1.187 possible 8676 212 R GLU N 12 N3H1s 0.700 1.640 2.687 14.005 13.615 1.029 [OK] 8677 212 R GLU CA 3 C4H1s 0.770 1.880 2.578 13.418 13.399 1.001 [OK] 8678 212 R GLU C 1 C3H0s 0.770 1.610 3.150 9.040 8.675 1.042 possible 8679 212 R GLU O 16 O1H0u 0.660 1.420 2.693 17.731 16.023 1.107 [OK] 8680 212 R GLU CB 8 C4H2s 0.770 1.880 3.341 24.984 23.529 1.062 possible 8681 212 R GLU CG 8 C4H2s 0.770 1.880 2.899 23.773 23.513 1.011 [OK] 8682 212 R GLU CD 2 C3H0b 0.770 1.610 2.768 9.093 9.460 0.961 [OK] 8683 212 R GLU OE1 16 O1H0u 0.660 1.420 2.748 19.402 15.999 1.213 [OK] 8684 212 R GLU OE2 16 O1H0u 0.660 1.420 2.583 19.467 17.432 1.117 [OK] 8685 213 R ASP N 12 N3H1s 0.700 1.640 3.168 14.085 13.895 1.014 possible 8686 213 R ASP CA 3 C4H1s 0.770 1.880 3.032 13.912 13.377 1.040 possible 8687 213 R ASP C 1 C3H0s 0.770 1.610 2.572 8.687 8.816 0.985 [OK] 8688 213 R ASP O 16 O1H0u 0.660 1.420 2.321 14.971 16.091 0.930 [OK] 8689 213 R ASP CB 8 C4H2s 0.770 1.880 2.775 22.957 23.481 0.978 [OK] 8690 213 R ASP CG 2 C3H0b 0.770 1.610 3.020 10.621 9.422 1.127 possible 8691 213 R ASP OD1 16 O1H0u 0.660 1.420 2.846 23.119 15.505 1.491 [OK] 8692 213 R ASP OD2 16 O1H0u 0.660 1.420 2.883 22.281 16.324 1.365 [OK] 8693 214 R THR N 12 N3H1s 0.700 1.640 2.563 12.877 13.832 0.931 [OK] 8694 214 R THR CA 3 C4H1s 0.770 1.880 2.712 14.323 13.099 1.093 [OK] 8695 214 R THR C 1 C3H0s 0.770 1.610 2.354 8.191 8.738 0.937 [OK] 8696 214 R THR O 16 O1H0u 0.660 1.420 2.484 14.723 16.020 0.919 [OK] 8697 214 R THR CB 4 C4H1b 0.770 1.880 2.846 14.519 14.829 0.979 [OK] 8698 214 R THR OG1 17 O2H1u 0.660 1.460 2.641 17.381 18.123 0.959 [OK] 8699 214 R THR CG2 10 C4H3u 0.770 1.880 2.876 32.591 36.542 0.892 [OK] 8700 215 R PHE N 12 N3H1s 0.700 1.640 2.261 12.094 13.691 0.883 [OK] 8701 215 R PHE CA 3 C4H1s 0.770 1.880 3.148 14.748 13.449 1.097 possible 8702 215 R PHE C 1 C3H0s 0.770 1.610 2.157 7.600 8.753 0.868 [OK] 8703 215 R PHE O 16 O1H0u 0.660 1.420 2.653 17.453 16.151 1.081 [OK] 8704 215 R PHE CB 8 C4H2s 0.770 1.880 2.641 22.088 23.777 0.929 [OK] 8705 215 R PHE CG 2 C3H0b 0.770 1.610 2.571 10.113 9.721 1.040 [OK] 8706 215 R PHE CD1 5 C3H1s 0.770 1.760 3.003 23.354 20.405 1.145 possible 8707 215 R PHE CD2 6 C3H1b 0.770 1.760 2.744 18.793 21.051 0.893 [OK] 8708 215 R PHE CE1 6 C3H1b 0.770 1.760 2.886 21.508 21.580 0.997 [OK] 8709 215 R PHE CE2 6 C3H1b 0.770 1.760 2.863 21.494 21.680 0.991 [OK] 8710 215 R PHE CZ 6 C3H1b 0.770 1.760 2.826 22.610 21.666 1.044 [OK] 8711 216 R PHE N 12 N3H1s 0.700 1.640 2.589 13.570 13.691 0.991 [OK] 8712 216 R PHE CA 3 C4H1s 0.770 1.880 2.839 13.221 13.449 0.983 [OK] 8713 216 R PHE C 1 C3H0s 0.770 1.610 2.195 8.299 8.753 0.948 [OK] 8714 216 R PHE O 16 O1H0u 0.660 1.420 2.537 14.957 16.151 0.926 [OK] 8715 216 R PHE CB 8 C4H2s 0.770 1.880 2.948 24.129 23.777 1.015 [OK] 8716 216 R PHE CG 2 C3H0b 0.770 1.610 2.619 9.126 9.721 0.939 [OK] 8717 216 R PHE CD1 5 C3H1s 0.770 1.760 2.791 20.786 20.405 1.019 [OK] 8718 216 R PHE CD2 6 C3H1b 0.770 1.760 2.858 19.653 21.051 0.934 [OK] 8719 216 R PHE CE1 6 C3H1b 0.770 1.760 3.040 23.238 21.580 1.077 possible 8720 216 R PHE CE2 6 C3H1b 0.770 1.760 3.474 23.913 21.680 1.103 possible 8721 216 R PHE CZ 6 C3H1b 0.770 1.760 3.029 21.619 21.666 0.998 possible 8722 217 R ARG N 12 N3H1s 0.700 1.640 2.443 13.120 13.650 0.961 [OK] 8723 217 R ARG CA 3 C4H1s 0.770 1.880 2.598 13.302 13.422 0.991 [OK] 8724 217 R ARG C 1 C3H0s 0.770 1.610 2.248 8.286 8.838 0.938 [OK] 8725 217 R ARG O 16 O1H0u 0.660 1.420 2.220 13.693 16.084 0.851 [OK] 8726 217 R ARG CB 8 C4H2s 0.770 1.880 2.751 21.366 23.088 0.925 [OK] 8727 217 R ARG CG 8 C4H2s 0.770 1.880 2.750 22.741 23.640 0.962 [OK] 8728 217 R ARG CD 8 C4H2s 0.770 1.880 2.678 20.320 23.300 0.872 [OK] 8729 217 R ARG NE 13 N3H1b 0.700 1.640 2.538 15.838 15.569 1.017 [OK] 8730 217 R ARG CZ 2 C3H0b 0.770 1.610 2.649 9.939 9.747 1.020 [OK] 8731 217 R ARG NH1 15 N3H2u 0.700 1.640 3.267 28.882 22.782 1.268 possible 8732 217 R ARG NH2 15 N3H2u 0.700 1.640 3.182 23.471 23.810 0.986 possible 8733 218 R ASP N 12 N3H1s 0.700 1.640 2.469 12.673 13.895 0.912 [OK] 8734 218 R ASP CA 3 C4H1s 0.770 1.880 2.616 12.725 13.377 0.951 [OK] 8735 218 R ASP C 1 C3H0s 0.770 1.610 2.474 8.700 8.816 0.987 [OK] 8736 218 R ASP O 16 O1H0u 0.660 1.420 2.504 15.879 16.091 0.987 [OK] 8737 218 R ASP CB 8 C4H2s 0.770 1.880 3.061 24.292 23.481 1.035 possible 8738 218 R ASP CG 2 C3H0b 0.770 1.610 2.540 9.734 9.422 1.033 [OK] 8739 218 R ASP OD1 16 O1H0u 0.660 1.420 2.439 15.953 15.505 1.029 [OK] 8740 218 R ASP OD2 16 O1H0u 0.660 1.420 2.467 17.963 16.324 1.100 [OK] 8741 219 R LEU N 12 N3H1s 0.700 1.640 2.644 14.125 13.655 1.034 [OK] 8742 219 R LEU CA 3 C4H1s 0.770 1.880 2.931 14.664 13.122 1.118 [OK] 8743 219 R LEU C 1 C3H0s 0.770 1.610 2.371 8.599 8.825 0.974 [OK] 8744 219 R LEU O 16 O1H0u 0.660 1.420 2.846 16.680 16.208 1.029 [OK] 8745 219 R LEU CB 8 C4H2s 0.770 1.880 2.990 24.302 22.951 1.059 [OK] 8746 219 R LEU CG 4 C4H1b 0.770 1.880 3.172 16.259 14.764 1.101 possible 8747 219 R LEU CD1 10 C4H3u 0.770 1.880 3.023 36.808 37.425 0.984 possible 8748 219 R LEU CD2 10 C4H3u 0.770 1.880 3.160 44.624 37.143 1.201 possible 8749 220 R VAL N 12 N3H1s 0.700 1.640 2.702 12.769 13.676 0.934 [OK] 8750 220 R VAL CA 3 C4H1s 0.770 1.880 3.661 14.690 13.123 1.119 possible 8751 220 R VAL C 1 C3H0s 0.770 1.610 2.448 8.551 8.563 0.999 [OK] 8752 220 R VAL O 16 O1H0u 0.660 1.420 21.519 -1.000 16.181 -1.000 bad 8753 220 R VAL CB 4 C4H1b 0.770 1.880 3.099 17.265 14.598 1.183 possible 8754 220 R VAL CG1 10 C4H3u 0.770 1.880 4.337 42.304 36.584 1.156 possible 8755 220 R VAL CG2 10 C4H3u 0.770 1.880 38.210 -1.000 36.332 -1.000 bad 8756 221 R GLY N 12 N3H1s 0.700 1.640 2.373 12.875 14.854 0.867 [OK] 8757 221 R GLY CA 8 C4H2s 0.770 1.880 5.431 30.162 23.688 1.273 possible 8758 221 R GLY C 2 C3H0b 0.770 1.610 2.951 10.957 9.840 1.114 [OK] 8759 221 R GLY O 16 O1H0u 0.660 1.420 5.271 34.972 16.391 2.134 possible 8760 222 R TYR N 12 N3H1s 0.700 1.640 2.629 14.442 13.691 1.055 [OK] 8761 222 R TYR CA 3 C4H1s 0.770 1.880 2.643 12.573 13.330 0.943 [OK] 8762 222 R TYR C 1 C3H0s 0.770 1.610 2.391 9.077 8.770 1.035 [OK] 8763 222 R TYR O 16 O1H0u 0.660 1.420 2.621 17.338 16.124 1.075 [OK] 8764 222 R TYR CB 8 C4H2s 0.770 1.880 7.827 58.239 23.678 2.460 possible 8765 222 R TYR CG 2 C3H0b 0.770 1.610 4.841 13.143 9.732 1.351 possible 8766 222 R TYR CD1 5 C3H1s 0.770 1.760 3.195 20.529 20.171 1.018 possible 8767 222 R TYR CD2 5 C3H1s 0.770 1.760 7.615 44.994 20.728 2.171 possible 8768 222 R TYR CE1 5 C3H1s 0.770 1.760 2.893 20.430 20.675 0.988 [OK] 8769 222 R TYR CE2 5 C3H1s 0.770 1.760 4.974 34.328 20.810 1.650 possible 8770 222 R TYR CZ 2 C3H0b 0.770 1.610 2.599 9.607 9.926 0.968 [OK] 8771 222 R TYR OH 17 O2H1u 0.660 1.460 3.405 23.964 19.173 1.250 possible 8772 223 R SER N 12 N3H1s 0.700 1.640 2.314 13.087 14.103 0.928 [OK] 8773 223 R SER CA 3 C4H1s 0.770 1.880 2.652 13.288 13.476 0.986 [OK] 8774 223 R SER C 1 C3H0s 0.770 1.610 2.229 8.276 8.923 0.928 [OK] 8775 223 R SER O 16 O1H0u 0.660 1.420 2.243 13.484 16.179 0.833 [OK] 8776 223 R SER CB 8 C4H2s 0.770 1.880 3.033 24.623 23.884 1.031 possible 8777 223 R SER OG 17 O2H1u 0.660 1.460 2.882 21.586 18.732 1.152 [OK] 8778 224 R ILE N 12 N3H1s 0.700 1.640 2.291 12.554 13.633 0.921 [OK] 8779 224 R ILE CA 3 C4H1s 0.770 1.880 2.508 12.460 13.007 0.958 [OK] 8780 224 R ILE C 1 C3H0s 0.770 1.610 2.297 8.504 8.470 1.004 [OK] 8781 224 R ILE O 16 O1H0u 0.660 1.420 2.167 14.587 16.144 0.904 [OK] 8782 224 R ILE CB 4 C4H1b 0.770 1.880 3.024 14.028 14.227 0.986 possible 8783 224 R ILE CG1 9 C4H2b 0.770 1.880 3.485 23.055 24.187 0.953 possible 8784 224 R ILE CG2 10 C4H3u 0.770 1.880 2.897 31.315 35.961 0.871 [OK] 8785 224 R ILE CD1 10 C4H3u 0.770 1.880 5.055 63.405 38.377 1.652 possible 8786 225 R GLY N 12 N3H1s 0.700 1.640 2.645 15.881 14.854 1.069 [OK] 8787 225 R GLY CA 8 C4H2s 0.770 1.880 2.975 25.477 23.688 1.076 [OK] 8788 225 R GLY C 2 C3H0b 0.770 1.610 2.852 10.408 9.840 1.058 [OK] 8789 225 R GLY O 16 O1H0u 0.660 1.420 2.363 15.491 16.391 0.945 [OK] 8790 226 R THR N 12 N3H1s 0.700 1.640 2.743 14.868 13.832 1.075 [OK] 8791 226 R THR CA 3 C4H1s 0.770 1.880 2.873 14.902 13.099 1.138 [OK] 8792 226 R THR C 1 C3H0s 0.770 1.610 2.179 8.462 8.738 0.968 [OK] 8793 226 R THR O 16 O1H0u 0.660 1.420 2.562 16.142 16.020 1.008 [OK] 8794 226 R THR CB 4 C4H1b 0.770 1.880 2.846 14.313 14.829 0.965 [OK] 8795 226 R THR OG1 17 O2H1u 0.660 1.460 2.633 16.794 18.123 0.927 [OK] 8796 226 R THR CG2 10 C4H3u 0.770 1.880 3.202 38.467 36.542 1.053 possible 8797 227 R LEU N 12 N3H1s 0.700 1.640 2.472 14.074 13.655 1.031 [OK] 8798 227 R LEU CA 3 C4H1s 0.770 1.880 3.216 14.216 13.122 1.083 possible 8799 227 R LEU C 1 C3H0s 0.770 1.610 2.405 8.518 8.825 0.965 [OK] 8800 227 R LEU O 16 O1H0u 0.660 1.420 2.732 16.361 16.208 1.009 [OK] 8801 227 R LEU CB 8 C4H2s 0.770 1.880 3.150 23.410 22.951 1.020 possible 8802 227 R LEU CG 4 C4H1b 0.770 1.880 3.212 14.045 14.764 0.951 possible 8803 227 R LEU CD1 10 C4H3u 0.770 1.880 3.216 38.198 37.425 1.021 possible 8804 227 R LEU CD2 10 C4H3u 0.770 1.880 3.030 37.501 37.143 1.010 possible 8805 228 R GLY N 12 N3H1s 0.700 1.640 3.004 14.964 14.854 1.007 possible 8806 228 R GLY CA 8 C4H2s 0.770 1.880 2.833 24.732 23.688 1.044 [OK] 8807 228 R GLY C 2 C3H0b 0.770 1.610 2.159 8.548 9.840 0.869 [OK] 8808 228 R GLY O 16 O1H0u 0.660 1.420 2.483 15.087 16.391 0.920 [OK] 8809 229 R ILE N 12 N3H1s 0.700 1.640 2.315 13.175 13.633 0.966 [OK] 8810 229 R ILE CA 3 C4H1s 0.770 1.880 2.728 12.721 13.007 0.978 [OK] 8811 229 R ILE C 1 C3H0s 0.770 1.610 2.756 8.560 8.470 1.011 [OK] 8812 229 R ILE O 16 O1H0u 0.660 1.420 2.606 15.446 16.144 0.957 [OK] 8813 229 R ILE CB 4 C4H1b 0.770 1.880 2.866 15.259 14.227 1.073 [OK] 8814 229 R ILE CG1 9 C4H2b 0.770 1.880 3.047 21.372 24.187 0.884 possible 8815 229 R ILE CG2 10 C4H3u 0.770 1.880 2.946 31.392 35.961 0.873 [OK] 8816 229 R ILE CD1 10 C4H3u 0.770 1.880 3.126 37.413 38.377 0.975 possible 8817 230 R HIS N 12 N3H1s 0.700 1.640 2.518 12.622 13.715 0.920 [OK] 8818 230 R HIS CA 3 C4H1s 0.770 1.880 2.802 14.052 13.467 1.043 [OK] 8819 230 R HIS C 1 C3H0s 0.770 1.610 2.485 8.823 8.882 0.993 [OK] 8820 230 R HIS O 16 O1H0u 0.660 1.420 2.453 17.362 16.082 1.080 [OK] 8821 230 R HIS CB 8 C4H2s 0.770 1.880 3.216 26.160 23.653 1.106 possible 8822 230 R HIS CG 2 C3H0b 0.770 1.610 2.360 8.746 9.952 0.879 [OK] 8823 230 R HIS ND1 13 N3H1b 0.700 1.640 2.919 15.033 15.506 0.969 [OK] 8824 230 R HIS CD2 5 C3H1s 0.770 1.760 2.888 22.746 21.085 1.079 [OK] 8825 230 R HIS CE1 5 C3H1s 0.770 1.760 2.761 21.227 20.636 1.029 [OK] 8826 230 R HIS NE2 13 N3H1b 0.700 1.640 2.534 11.112 15.337 0.725 [OK] 8827 231 R ARG N 12 N3H1s 0.700 1.640 2.393 13.540 13.650 0.992 [OK] 8828 231 R ARG CA 3 C4H1s 0.770 1.880 3.269 14.888 13.422 1.109 possible 8829 231 R ARG C 1 C3H0s 0.770 1.610 2.141 8.033 8.838 0.909 [OK] 8830 231 R ARG O 16 O1H0u 0.660 1.420 3.190 19.010 16.084 1.182 possible 8831 231 R ARG CB 8 C4H2s 0.770 1.880 2.932 22.638 23.088 0.981 [OK] 8832 231 R ARG CG 8 C4H2s 0.770 1.880 3.358 24.468 23.640 1.035 possible 8833 231 R ARG CD 8 C4H2s 0.770 1.880 2.660 21.436 23.300 0.920 [OK] 8834 231 R ARG NE 13 N3H1b 0.700 1.640 2.871 16.481 15.569 1.059 [OK] 8835 231 R ARG CZ 2 C3H0b 0.770 1.610 2.514 8.862 9.747 0.909 [OK] 8836 231 R ARG NH1 15 N3H2u 0.700 1.640 2.778 23.231 22.782 1.020 [OK] 8837 231 R ARG NH2 15 N3H2u 0.700 1.640 2.934 21.754 23.810 0.914 [OK] 8838 232 R LEU N 12 N3H1s 0.700 1.640 2.295 12.448 13.655 0.912 [OK] 8839 232 R LEU CA 3 C4H1s 0.770 1.880 2.837 13.125 13.122 1.000 [OK] 8840 232 R LEU C 1 C3H0s 0.770 1.610 2.558 8.055 8.825 0.913 [OK] 8841 232 R LEU O 16 O1H0u 0.660 1.420 2.443 14.079 16.208 0.869 [OK] 8842 232 R LEU CB 8 C4H2s 0.770 1.880 2.845 21.519 22.951 0.938 [OK] 8843 232 R LEU CG 4 C4H1b 0.770 1.880 3.132 14.721 14.764 0.997 possible 8844 232 R LEU CD1 10 C4H3u 0.770 1.880 15.395 -1.000 37.425 -1.000 bad 8845 232 R LEU CD2 10 C4H3u 0.770 1.880 4.015 39.726 37.143 1.070 possible 8846 233 R GLY N 12 N3H1s 0.700 1.640 2.862 15.084 14.854 1.016 [OK] 8847 233 R GLY CA 8 C4H2s 0.770 1.880 3.019 23.749 23.688 1.003 possible 8848 233 R GLY C 2 C3H0b 0.770 1.610 2.477 9.632 9.840 0.979 [OK] 8849 233 R GLY O 16 O1H0u 0.660 1.420 2.373 16.184 16.391 0.987 [OK] 8850 234 R LEU N 12 N3H1s 0.700 1.640 2.621 15.025 13.655 1.100 [OK] 8851 234 R LEU CA 3 C4H1s 0.770 1.880 2.925 14.901 13.122 1.136 [OK] 8852 234 R LEU C 1 C3H0s 0.770 1.610 2.925 8.466 8.825 0.959 [OK] 8853 234 R LEU O 16 O1H0u 0.660 1.420 2.655 15.422 16.208 0.951 [OK] 8854 234 R LEU CB 8 C4H2s 0.770 1.880 3.183 23.204 22.951 1.011 possible 8855 234 R LEU CG 4 C4H1b 0.770 1.880 4.134 20.444 14.764 1.385 possible 8856 234 R LEU CD1 10 C4H3u 0.770 1.880 3.522 36.067 37.425 0.964 possible 8857 234 R LEU CD2 10 C4H3u 0.770 1.880 4.009 49.252 37.143 1.326 possible 8858 235 R LEU N 12 N3H1s 0.700 1.640 3.466 14.990 13.655 1.098 possible 8859 235 R LEU CA 3 C4H1s 0.770 1.880 3.662 16.406 13.122 1.250 possible 8860 235 R LEU C 1 C3H0s 0.770 1.610 2.411 8.263 8.825 0.936 [OK] 8861 235 R LEU O 16 O1H0u 0.660 1.420 2.892 15.451 16.208 0.953 [OK] 8862 235 R LEU CB 8 C4H2s 0.770 1.880 3.676 23.373 22.951 1.018 possible 8863 235 R LEU CG 4 C4H1b 0.770 1.880 4.192 18.986 14.764 1.286 possible 8864 235 R LEU CD1 10 C4H3u 0.770 1.880 29.324 -1.000 37.425 -1.000 bad 8865 235 R LEU CD2 10 C4H3u 0.770 1.880 38.268 -1.000 37.143 -1.000 bad 8866 236 R LEU N 12 N3H1s 0.700 1.640 2.668 13.143 13.655 0.962 [OK] 8867 236 R LEU CA 3 C4H1s 0.770 1.880 2.893 13.599 13.122 1.036 [OK] 8868 236 R LEU C 1 C3H0s 0.770 1.610 2.455 8.693 8.825 0.985 [OK] 8869 236 R LEU O 16 O1H0u 0.660 1.420 2.577 16.451 16.208 1.015 [OK] 8870 236 R LEU CB 8 C4H2s 0.770 1.880 2.917 23.398 22.951 1.019 [OK] 8871 236 R LEU CG 4 C4H1b 0.770 1.880 2.874 12.832 14.764 0.869 [OK] 8872 236 R LEU CD1 10 C4H3u 0.770 1.880 3.055 36.299 37.425 0.970 possible 8873 236 R LEU CD2 10 C4H3u 0.770 1.880 5.970 54.746 37.143 1.474 possible 8874 237 R SER N 12 N3H1s 0.700 1.640 2.482 13.484 14.103 0.956 [OK] 8875 237 R SER CA 3 C4H1s 0.770 1.880 3.152 16.018 13.476 1.189 possible 8876 237 R SER C 1 C3H0s 0.770 1.610 2.331 8.367 8.923 0.938 [OK] 8877 237 R SER O 16 O1H0u 0.660 1.420 2.546 16.815 16.179 1.039 [OK] 8878 237 R SER CB 8 C4H2s 0.770 1.880 2.870 23.076 23.884 0.966 [OK] 8879 237 R SER OG 17 O2H1u 0.660 1.460 2.362 16.897 18.732 0.902 [OK] 8880 238 R LEU N 12 N3H1s 0.700 1.640 2.268 12.271 13.655 0.899 [OK] 8881 238 R LEU CA 3 C4H1s 0.770 1.880 2.850 13.521 13.122 1.030 [OK] 8882 238 R LEU C 1 C3H0s 0.770 1.610 3.738 9.616 8.825 1.090 possible 8883 238 R LEU O 16 O1H0u 0.660 1.420 3.409 17.855 16.208 1.102 possible 8884 238 R LEU CB 8 C4H2s 0.770 1.880 4.291 29.690 22.951 1.294 possible 8885 238 R LEU CG 4 C4H1b 0.770 1.880 2.696 14.331 14.764 0.971 [OK] 8886 238 R LEU CD1 10 C4H3u 0.770 1.880 2.883 31.092 37.425 0.831 [OK] 8887 238 R LEU CD2 10 C4H3u 0.770 1.880 4.656 57.910 37.143 1.559 possible 8888 239 R SER N 12 N3H1s 0.700 1.640 3.560 13.806 14.103 0.979 possible 8889 239 R SER CA 3 C4H1s 0.770 1.880 3.966 17.065 13.476 1.266 possible 8890 239 R SER C 1 C3H0s 0.770 1.610 2.261 8.498 8.923 0.952 [OK] 8891 239 R SER O 16 O1H0u 0.660 1.420 2.546 15.348 16.179 0.949 [OK] 8892 239 R SER CB 8 C4H2s 0.770 1.880 3.298 23.540 23.884 0.986 possible 8893 239 R SER OG 17 O2H1u 0.660 1.460 6.560 61.395 18.732 3.278 possible 8894 240 R ALA N 12 N3H1s 0.700 1.640 2.310 12.395 14.046 0.882 [OK] 8895 240 R ALA CA 4 C4H1b 0.770 1.880 2.851 14.199 14.063 1.010 [OK] 8896 240 R ALA C 1 C3H0s 0.770 1.610 2.385 8.389 8.900 0.943 [OK] 8897 240 R ALA O 16 O1H0u 0.660 1.420 2.310 15.355 16.188 0.949 [OK] 8898 240 R ALA CB 10 C4H3u 0.770 1.880 3.190 35.062 36.782 0.953 possible 8899 241 R VAL N 12 N3H1s 0.700 1.640 2.422 12.829 13.676 0.938 [OK] 8900 241 R VAL CA 3 C4H1s 0.770 1.880 2.916 13.671 13.123 1.042 [OK] 8901 241 R VAL C 1 C3H0s 0.770 1.610 2.905 8.478 8.563 0.990 [OK] 8902 241 R VAL O 16 O1H0u 0.660 1.420 3.373 17.252 16.181 1.066 possible 8903 241 R VAL CB 4 C4H1b 0.770 1.880 2.856 15.682 14.598 1.074 [OK] 8904 241 R VAL CG1 10 C4H3u 0.770 1.880 3.841 40.743 36.584 1.114 possible 8905 241 R VAL CG2 10 C4H3u 0.770 1.880 3.030 35.866 36.332 0.987 possible 8906 242 R PHE N 12 N3H1s 0.700 1.640 3.169 14.777 13.691 1.079 possible 8907 242 R PHE CA 3 C4H1s 0.770 1.880 4.172 21.763 13.449 1.618 possible 8908 242 R PHE C 1 C3H0s 0.770 1.610 2.165 7.641 8.753 0.873 [OK] 8909 242 R PHE O 16 O1H0u 0.660 1.420 3.406 18.727 16.151 1.159 possible 8910 242 R PHE CB 8 C4H2s 0.770 1.880 4.803 31.235 23.777 1.314 possible 8911 242 R PHE CG 2 C3H0b 0.770 1.610 6.277 18.005 9.721 1.852 possible 8912 242 R PHE CD1 5 C3H1s 0.770 1.760 7.150 59.276 20.405 2.905 possible 8913 242 R PHE CD2 6 C3H1b 0.770 1.760 6.571 30.898 21.051 1.468 possible 8914 242 R PHE CE1 6 C3H1b 0.770 1.760 34.475 -1.000 21.580 -1.000 bad 8915 242 R PHE CE2 6 C3H1b 0.770 1.760 11.499 -1.000 21.680 -1.000 bad 8916 242 R PHE CZ 6 C3H1b 0.770 1.760 26.457 -1.000 21.666 -1.000 bad 8917 243 R PHE N 12 N3H1s 0.700 1.640 2.237 12.586 13.691 0.919 [OK] 8918 243 R PHE CA 3 C4H1s 0.770 1.880 2.754 12.630 13.449 0.939 [OK] 8919 243 R PHE C 1 C3H0s 0.770 1.610 2.297 8.333 8.753 0.952 [OK] 8920 243 R PHE O 16 O1H0u 0.660 1.420 2.421 16.147 16.151 1.000 [OK] 8921 243 R PHE CB 8 C4H2s 0.770 1.880 2.907 22.742 23.777 0.956 [OK] 8922 243 R PHE CG 2 C3H0b 0.770 1.610 2.503 9.141 9.721 0.940 [OK] 8923 243 R PHE CD1 5 C3H1s 0.770 1.760 2.940 21.559 20.405 1.057 [OK] 8924 243 R PHE CD2 6 C3H1b 0.770 1.760 2.817 18.919 21.051 0.899 [OK] 8925 243 R PHE CE1 6 C3H1b 0.770 1.760 7.921 -1.000 21.580 -1.000 bad 8926 243 R PHE CE2 6 C3H1b 0.770 1.760 7.453 51.768 21.680 2.388 possible 8927 243 R PHE CZ 6 C3H1b 0.770 1.760 23.816 -1.000 21.666 -1.000 bad 8928 244 R SER N 12 N3H1s 0.700 1.640 2.298 12.376 14.103 0.878 [OK] 8929 244 R SER CA 3 C4H1s 0.770 1.880 3.118 15.223 13.476 1.130 possible 8930 244 R SER C 1 C3H0s 0.770 1.610 2.087 7.876 8.923 0.883 [OK] 8931 244 R SER O 16 O1H0u 0.660 1.420 2.157 13.243 16.179 0.819 [OK] 8932 244 R SER CB 8 C4H2s 0.770 1.880 2.999 23.003 23.884 0.963 [OK] 8933 244 R SER OG 17 O2H1u 0.660 1.460 2.499 18.032 18.732 0.963 [OK] 8934 245 R ALA N 12 N3H1s 0.700 1.640 2.772 13.910 14.046 0.990 [OK] 8935 245 R ALA CA 4 C4H1b 0.770 1.880 3.049 15.204 14.063 1.081 possible 8936 245 R ALA C 1 C3H0s 0.770 1.610 3.482 9.077 8.900 1.020 possible 8937 245 R ALA O 16 O1H0u 0.660 1.420 3.122 15.693 16.188 0.969 possible 8938 245 R ALA CB 10 C4H3u 0.770 1.880 5.324 68.420 36.782 1.860 possible 8939 246 R LEU N 12 N3H1s 0.700 1.640 4.291 15.663 13.655 1.147 possible 8940 246 R LEU CA 3 C4H1s 0.770 1.880 4.610 15.531 13.122 1.184 possible 8941 246 R LEU C 1 C3H0s 0.770 1.610 2.501 8.209 8.825 0.930 [OK] 8942 246 R LEU O 16 O1H0u 0.660 1.420 2.358 13.945 16.208 0.860 [OK] 8943 246 R LEU CB 8 C4H2s 0.770 1.880 4.033 26.246 22.951 1.144 possible 8944 246 R LEU CG 4 C4H1b 0.770 1.880 3.864 17.416 14.764 1.180 possible 8945 246 R LEU CD1 10 C4H3u 0.770 1.880 31.617 -1.000 37.425 -1.000 bad 8946 246 R LEU CD2 10 C4H3u 0.770 1.880 25.994 -1.000 37.143 -1.000 bad 8947 247 R CYS N 12 N3H1s 0.700 1.640 2.358 12.413 13.981 0.888 [OK] 8948 247 R CYS CA 3 C4H1s 0.770 1.880 2.679 13.244 13.656 0.970 [OK] 8949 247 R CYS C 1 C3H0s 0.770 1.610 2.580 8.492 8.897 0.955 [OK] 8950 247 R CYS O 16 O1H0u 0.660 1.420 2.411 14.998 16.543 0.907 [OK] 8951 247 R CYS CB 9 C4H2b 0.770 1.880 2.776 19.465 23.536 0.827 [OK] 8952 247 R CYS SG 20 S2H1u 1.040 1.770 3.044 36.476 34.603 1.054 possible 8953 248 R MET N 12 N3H1s 0.700 1.640 2.329 12.210 13.564 0.900 [OK] 8954 248 R MET CA 3 C4H1s 0.770 1.880 2.685 11.838 13.231 0.895 [OK] 8955 248 R MET C 1 C3H0s 0.770 1.610 2.684 8.626 8.782 0.982 [OK] 8956 248 R MET O 16 O1H0u 0.660 1.420 2.519 14.693 16.277 0.903 [OK] 8957 248 R MET CB 8 C4H2s 0.770 1.880 3.168 26.458 23.645 1.119 possible 8958 248 R MET CG 9 C4H2b 0.770 1.880 2.553 18.928 24.009 0.788 [OK] 8959 248 R MET SD 19 S2H0u 1.040 1.770 2.896 29.076 30.093 0.966 [OK] 8960 248 R MET CE 10 C4H3u 0.770 1.880 3.136 38.814 37.161 1.044 possible 8961 249 R ILE N 12 N3H1s 0.700 1.640 2.731 13.681 13.633 1.004 [OK] 8962 249 R ILE CA 3 C4H1s 0.770 1.880 2.741 13.305 13.007 1.023 [OK] 8963 249 R ILE C 1 C3H0s 0.770 1.610 2.655 8.112 8.470 0.958 [OK] 8964 249 R ILE O 16 O1H0u 0.660 1.420 3.526 20.489 16.144 1.269 possible 8965 249 R ILE CB 4 C4H1b 0.770 1.880 4.352 16.062 14.227 1.129 possible 8966 249 R ILE CG1 9 C4H2b 0.770 1.880 13.086 -1.000 24.187 -1.000 bad 8967 249 R ILE CG2 10 C4H3u 0.770 1.880 17.092 -1.000 35.961 -1.000 bad 8968 249 R ILE CD1 10 C4H3u 0.770 1.880 5.089 43.663 38.377 1.138 possible 8969 250 R ILE N 12 N3H1s 0.700 1.640 2.585 12.161 13.633 0.892 [OK] 8970 250 R ILE CA 3 C4H1s 0.770 1.880 3.673 13.932 13.007 1.071 possible 8971 250 R ILE C 1 C3H0s 0.770 1.610 2.542 9.037 8.470 1.067 [OK] 8972 250 R ILE O 16 O1H0u 0.660 1.420 2.562 15.578 16.144 0.965 [OK] 8973 250 R ILE CB 4 C4H1b 0.770 1.880 3.493 15.157 14.227 1.065 possible 8974 250 R ILE CG1 9 C4H2b 0.770 1.880 2.964 21.419 24.187 0.886 [OK] 8975 250 R ILE CG2 10 C4H3u 0.770 1.880 6.277 67.690 35.961 1.882 possible 8976 250 R ILE CD1 10 C4H3u 0.770 1.880 6.612 79.938 38.377 2.083 possible 8977 251 R THR N 12 N3H1s 0.700 1.640 2.483 12.609 13.832 0.912 [OK] 8978 251 R THR CA 3 C4H1s 0.770 1.880 2.964 14.081 13.099 1.075 [OK] 8979 251 R THR C 1 C3H0s 0.770 1.610 2.460 8.447 8.738 0.967 [OK] 8980 251 R THR O 16 O1H0u 0.660 1.420 2.384 17.440 16.020 1.089 [OK] 8981 251 R THR CB 4 C4H1b 0.770 1.880 2.963 15.131 14.829 1.020 [OK] 8982 251 R THR OG1 17 O2H1u 0.660 1.460 2.551 16.620 18.123 0.917 [OK] 8983 251 R THR CG2 10 C4H3u 0.770 1.880 3.125 37.253 36.542 1.019 possible 8984 252 R GLY N 12 N3H1s 0.700 1.640 2.522 13.548 14.854 0.912 [OK] 8985 252 R GLY CA 8 C4H2s 0.770 1.880 2.626 21.474 23.688 0.907 [OK] 8986 252 R GLY C 2 C3H0b 0.770 1.610 2.631 10.475 9.840 1.065 [OK] 8987 252 R GLY O 16 O1H0u 0.660 1.420 4.313 23.858 16.391 1.456 possible 8988 253 R THR N 12 N3H1s 0.700 1.640 2.637 13.623 13.832 0.985 [OK] 8989 253 R THR CA 3 C4H1s 0.770 1.880 4.136 18.246 13.099 1.393 possible 8990 253 R THR C 1 C3H0s 0.770 1.610 2.731 9.389 8.738 1.075 [OK] 8991 253 R THR O 16 O1H0u 0.660 1.420 18.468 -1.000 16.020 -1.000 bad 8992 253 R THR CB 4 C4H1b 0.770 1.880 4.135 21.209 14.829 1.430 possible 8993 253 R THR OG1 17 O2H1u 0.660 1.460 3.536 20.561 18.123 1.135 possible 8994 253 R THR CG2 10 C4H3u 0.770 1.880 3.107 37.630 36.542 1.030 possible 8995 254 R ILE N 12 N3H1s 0.700 1.640 2.626 12.375 13.633 0.908 [OK] 8996 254 R ILE CA 3 C4H1s 0.770 1.880 4.561 16.312 13.007 1.254 possible 8997 254 R ILE C 1 C3H0s 0.770 1.610 3.012 9.400 8.470 1.110 possible 8998 254 R ILE O 16 O1H0u 0.660 1.420 18.325 -1.000 16.144 -1.000 bad 8999 254 R ILE CB 4 C4H1b 0.770 1.880 7.927 -1.000 14.227 -1.000 bad 9000 254 R ILE CG1 9 C4H2b 0.770 1.880 4.063 26.168 24.187 1.082 possible 9001 254 R ILE CG2 10 C4H3u 0.770 1.880 45.565 -1.000 35.961 -1.000 bad 9002 254 R ILE CD1 10 C4H3u 0.770 1.880 47.798 -1.000 38.377 -1.000 bad 9003 255 R TRP N 12 N3H1s 0.700 1.640 2.950 14.252 13.791 1.033 [OK] 9004 255 R TRP CA 3 C4H1s 0.770 1.880 2.939 13.162 13.377 0.984 [OK] 9005 255 R TRP C 1 C3H0s 0.770 1.610 2.465 8.357 8.724 0.958 [OK] 9006 255 R TRP O 16 O1H0u 0.660 1.420 2.493 16.900 15.951 1.060 [OK] 9007 255 R TRP CB 8 C4H2s 0.770 1.880 4.245 30.743 24.004 1.281 possible 9008 255 R TRP CG 2 C3H0b 0.770 1.610 2.396 8.629 9.965 0.866 [OK] 9009 255 R TRP CD1 5 C3H1s 0.770 1.760 2.829 20.864 20.874 1.000 [OK] 9010 255 R TRP CD2 2 C3H0b 0.770 1.610 2.453 10.078 10.097 0.998 [OK] 9011 255 R TRP NE1 13 N3H1b 0.700 1.640 2.474 13.673 16.969 0.806 [OK] 9012 255 R TRP CE2 2 C3H0b 0.770 1.610 2.506 10.025 9.889 1.014 [OK] 9013 255 R TRP CE3 6 C3H1b 0.770 1.760 6.705 47.724 20.448 2.334 possible 9014 255 R TRP CZ2 6 C3H1b 0.770 1.760 2.855 20.198 21.012 0.961 [OK] 9015 255 R TRP CZ3 6 C3H1b 0.770 1.760 17.902 -1.000 21.516 -1.000 bad 9016 255 R TRP CH2 6 C3H1b 0.770 1.760 7.118 41.404 21.339 1.940 possible 9017 256 R PHE N 12 N3H1s 0.700 1.640 2.324 12.023 13.691 0.878 [OK] 9018 256 R PHE CA 3 C4H1s 0.770 1.880 2.641 13.910 13.449 1.034 [OK] 9019 256 R PHE C 1 C3H0s 0.770 1.610 2.815 9.556 8.753 1.092 [OK] 9020 256 R PHE O 16 O1H0u 0.660 1.420 5.056 28.998 16.151 1.795 possible 9021 256 R PHE CB 8 C4H2s 0.770 1.880 12.849 -1.000 23.777 -1.000 bad 9022 256 R PHE CG 2 C3H0b 0.770 1.610 0.496 -1.000 9.721 -1.000 bad 9023 256 R PHE CD1 5 C3H1s 0.770 1.760 7.714 -1.000 20.405 -1.000 bad 9024 256 R PHE CD2 6 C3H1b 0.770 1.760 11.843 -1.000 21.051 -1.000 bad 9025 256 R PHE CE1 6 C3H1b 0.770 1.760 15.386 -1.000 21.580 -1.000 bad 9026 256 R PHE CE2 6 C3H1b 0.770 1.760 23.034 -1.000 21.680 -1.000 bad 9027 256 R PHE CZ 6 C3H1b 0.770 1.760 18.477 -1.000 21.666 -1.000 bad 9028 257 R ASP N 12 N3H1s 0.700 1.640 2.473 13.947 13.895 1.004 [OK] 9029 257 R ASP CA 3 C4H1s 0.770 1.880 5.413 20.770 13.377 1.553 possible 9030 257 R ASP C 1 C3H0s 0.770 1.610 3.775 11.775 8.816 1.336 possible 9031 257 R ASP O 16 O1H0u 0.660 1.420 2.811 15.748 16.091 0.979 [OK] 9032 257 R ASP CB 8 C4H2s 0.770 1.880 4.278 31.958 23.481 1.361 possible 9033 257 R ASP CG 2 C3H0b 0.770 1.610 5.286 13.894 9.422 1.475 possible 9034 257 R ASP OD1 16 O1H0u 0.660 1.420 38.343 -1.000 15.505 -1.000 bad 9035 257 R ASP OD2 16 O1H0u 0.660 1.420 27.755 -1.000 16.324 -1.000 bad 9036 258 R GLN N 12 N3H1s 0.700 1.640 3.850 19.536 13.616 1.435 possible 9037 258 R GLN CA 3 C4H1s 0.770 1.880 2.785 13.328 13.334 1.000 [OK] 9038 258 R GLN C 1 C3H0s 0.770 1.610 2.459 8.646 8.787 0.984 [OK] 9039 258 R GLN O 16 O1H0u 0.660 1.420 2.406 14.478 15.993 0.905 [OK] 9040 258 R GLN CB 8 C4H2s 0.770 1.880 3.611 24.534 23.275 1.054 possible 9041 258 R GLN CG 8 C4H2s 0.770 1.880 34.030 -1.000 23.465 -1.000 bad 9042 258 R GLN CD 2 C3H0b 0.770 1.610 2.326 -1.000 9.659 -1.000 bad 9043 258 R GLN OE1 16 O1H0u 0.660 1.420 12.474 -1.000 17.091 -1.000 bad 9044 258 R GLN NE2 15 N3H2u 0.700 1.640 21.233 -1.000 24.150 -1.000 bad 9045 259 R TRP N 12 N3H1s 0.700 1.640 2.446 13.965 13.791 1.013 [OK] 9046 259 R TRP CA 3 C4H1s 0.770 1.880 2.585 12.436 13.377 0.930 [OK] 9047 259 R TRP C 1 C3H0s 0.770 1.610 2.221 7.846 8.724 0.899 [OK] 9048 259 R TRP O 16 O1H0u 0.660 1.420 2.496 15.947 15.951 1.000 [OK] 9049 259 R TRP CB 8 C4H2s 0.770 1.880 3.014 23.681 24.004 0.987 possible 9050 259 R TRP CG 2 C3H0b 0.770 1.610 2.451 9.391 9.965 0.942 [OK] 9051 259 R TRP CD1 5 C3H1s 0.770 1.760 2.946 21.253 20.874 1.018 [OK] 9052 259 R TRP CD2 2 C3H0b 0.770 1.610 2.307 8.957 10.097 0.887 [OK] 9053 259 R TRP NE1 13 N3H1b 0.700 1.640 2.684 16.752 16.969 0.987 [OK] 9054 259 R TRP CE2 2 C3H0b 0.770 1.610 2.383 8.584 9.889 0.868 [OK] 9055 259 R TRP CE3 6 C3H1b 0.770 1.760 2.845 20.227 20.448 0.989 [OK] 9056 259 R TRP CZ2 6 C3H1b 0.770 1.760 2.785 19.313 21.012 0.919 [OK] 9057 259 R TRP CZ3 6 C3H1b 0.770 1.760 3.745 24.515 21.516 1.139 possible 9058 259 R TRP CH2 6 C3H1b 0.770 1.760 4.247 28.894 21.339 1.354 possible 9059 260 R VAL N 12 N3H1s 0.700 1.640 2.395 11.728 13.676 0.858 [OK] 9060 260 R VAL CA 3 C4H1s 0.770 1.880 2.554 12.726 13.123 0.970 [OK] 9061 260 R VAL C 1 C3H0s 0.770 1.610 2.956 8.509 8.563 0.994 [OK] 9062 260 R VAL O 16 O1H0u 0.660 1.420 2.719 17.611 16.181 1.088 [OK] 9063 260 R VAL CB 4 C4H1b 0.770 1.880 2.849 15.018 14.598 1.029 [OK] 9064 260 R VAL CG1 10 C4H3u 0.770 1.880 15.010 -1.000 36.584 -1.000 bad 9065 260 R VAL CG2 10 C4H3u 0.770 1.880 14.542 -1.000 36.332 -1.000 bad 9066 261 R ASP N 12 N3H1s 0.700 1.640 2.719 12.250 13.895 0.882 [OK] 9067 261 R ASP CA 3 C4H1s 0.770 1.880 3.222 15.475 13.377 1.157 possible 9068 261 R ASP C 1 C3H0s 0.770 1.610 2.838 8.752 8.816 0.993 [OK] 9069 261 R ASP O 16 O1H0u 0.660 1.420 6.693 33.938 16.091 2.109 possible 9070 261 R ASP CB 8 C4H2s 0.770 1.880 13.675 -1.000 23.481 -1.000 bad 9071 261 R ASP CG 2 C3H0b 0.770 1.610 6.936 17.472 9.422 1.854 possible 9072 261 R ASP OD1 16 O1H0u 0.660 1.420 26.071 -1.000 15.505 -1.000 bad 9073 261 R ASP OD2 16 O1H0u 0.660 1.420 22.697 -1.000 16.324 -1.000 bad 9074 262 R TRP N 12 N3H1s 0.700 1.640 2.513 13.328 13.791 0.966 [OK] 9075 262 R TRP CA 3 C4H1s 0.770 1.880 4.281 16.825 13.377 1.258 possible 9076 262 R TRP C 1 C3H0s 0.770 1.610 2.199 7.789 8.724 0.893 [OK] 9077 262 R TRP O 16 O1H0u 0.660 1.420 4.818 23.680 15.951 1.485 possible 9078 262 R TRP CB 8 C4H2s 0.770 1.880 3.014 22.614 24.004 0.942 possible 9079 262 R TRP CG 2 C3H0b 0.770 1.610 2.513 9.423 9.965 0.946 [OK] 9080 262 R TRP CD1 5 C3H1s 0.770 1.760 5.651 35.179 20.874 1.685 possible 9081 262 R TRP CD2 2 C3H0b 0.770 1.610 2.515 10.391 10.097 1.029 [OK] 9082 262 R TRP NE1 13 N3H1b 0.700 1.640 21.704 -1.000 16.969 -1.000 bad 9083 262 R TRP CE2 2 C3H0b 0.770 1.610 3.431 10.880 9.889 1.100 possible 9084 262 R TRP CE3 6 C3H1b 0.770 1.760 2.849 19.658 20.448 0.961 [OK] 9085 262 R TRP CZ2 6 C3H1b 0.770 1.760 22.629 -1.000 21.012 -1.000 bad 9086 262 R TRP CZ3 6 C3H1b 0.770 1.760 3.617 22.808 21.516 1.060 possible 9087 262 R TRP CH2 6 C3H1b 0.770 1.760 16.470 -1.000 21.339 -1.000 bad 9088 263 R TRP N 12 N3H1s 0.700 1.640 2.426 12.525 13.791 0.908 [OK] 9089 263 R TRP CA 3 C4H1s 0.770 1.880 3.177 15.385 13.377 1.150 possible 9090 263 R TRP C 1 C3H0s 0.770 1.610 2.779 9.610 8.724 1.102 [OK] 9091 263 R TRP O 16 O1H0u 0.660 1.420 3.180 20.356 15.951 1.276 possible 9092 263 R TRP CB 8 C4H2s 0.770 1.880 3.626 30.557 24.004 1.273 possible 9093 263 R TRP CG 2 C3H0b 0.770 1.610 2.758 9.210 9.965 0.924 [OK] 9094 263 R TRP CD1 5 C3H1s 0.770 1.760 3.032 20.161 20.874 0.966 possible 9095 263 R TRP CD2 2 C3H0b 0.770 1.610 2.441 9.377 10.097 0.929 [OK] 9096 263 R TRP NE1 13 N3H1b 0.700 1.640 2.681 16.591 16.969 0.978 [OK] 9097 263 R TRP CE2 2 C3H0b 0.770 1.610 2.576 9.751 9.889 0.986 [OK] 9098 263 R TRP CE3 6 C3H1b 0.770 1.760 3.818 34.560 20.448 1.690 possible 9099 263 R TRP CZ2 6 C3H1b 0.770 1.760 2.741 19.127 21.012 0.910 [OK] 9100 263 R TRP CZ3 6 C3H1b 0.770 1.760 14.343 -1.000 21.516 -1.000 bad 9101 263 R TRP CH2 6 C3H1b 0.770 1.760 6.150 50.953 21.339 2.388 possible 9102 264 R GLN N 12 N3H1s 0.700 1.640 2.780 14.421 13.616 1.059 [OK] 9103 264 R GLN CA 3 C4H1s 0.770 1.880 2.787 13.065 13.334 0.980 [OK] 9104 264 R GLN C 1 C3H0s 0.770 1.610 3.983 9.566 8.787 1.089 possible 9105 264 R GLN O 16 O1H0u 0.660 1.420 3.391 15.116 15.993 0.945 possible 9106 264 R GLN CB 8 C4H2s 0.770 1.880 14.249 -1.000 23.275 -1.000 bad 9107 264 R GLN CG 8 C4H2s 0.770 1.880 17.671 -1.000 23.465 -1.000 bad 9108 264 R GLN CD 2 C3H0b 0.770 1.610 7.378 19.122 9.659 1.980 possible 9109 264 R GLN OE1 16 O1H0u 0.660 1.420 8.797 -1.000 17.091 -1.000 bad 9110 264 R GLN NE2 15 N3H2u 0.700 1.640 11.799 -1.000 24.150 -1.000 bad 9111 265 R TRP N 12 N3H1s 0.700 1.640 6.571 24.136 13.791 1.750 possible 9112 265 R TRP CA 3 C4H1s 0.770 1.880 7.974 36.847 13.377 2.755 possible 9113 265 R TRP C 1 C3H0s 0.770 1.610 2.057 7.788 8.724 0.893 [OK] 9114 265 R TRP O 16 O1H0u 0.660 1.420 5.192 21.990 15.951 1.379 possible 9115 265 R TRP CB 8 C4H2s 0.770 1.880 30.093 -1.000 24.004 -1.000 bad 9116 265 R TRP CG 2 C3H0b 0.770 1.610 1.190 -1.000 9.965 -1.000 bad 9117 265 R TRP CD1 5 C3H1s 0.770 1.760 4.213 24.290 20.874 1.164 possible 9118 265 R TRP CD2 2 C3H0b 0.770 1.610 1.882 -1.000 10.097 -1.000 bad 9119 265 R TRP NE1 13 N3H1b 0.700 1.640 3.870 20.703 16.969 1.220 possible 9120 265 R TRP CE2 2 C3H0b 0.770 1.610 6.193 15.370 9.889 1.554 possible 9121 265 R TRP CE3 6 C3H1b 0.770 1.760 9.165 -1.000 20.448 -1.000 bad 9122 265 R TRP CZ2 6 C3H1b 0.770 1.760 23.160 -1.000 21.012 -1.000 bad 9123 265 R TRP CZ3 6 C3H1b 0.770 1.760 17.234 -1.000 21.516 -1.000 bad 9124 265 R TRP CH2 6 C3H1b 0.770 1.760 22.455 -1.000 21.339 -1.000 bad 9125 266 R TRP N 12 N3H1s 0.700 1.640 2.584 12.616 13.791 0.915 [OK] 9126 266 R TRP CA 3 C4H1s 0.770 1.880 2.530 13.441 13.377 1.005 [OK] 9127 266 R TRP C 1 C3H0s 0.770 1.610 2.362 8.098 8.724 0.928 [OK] 9128 266 R TRP O 16 O1H0u 0.660 1.420 2.359 15.435 15.951 0.968 [OK] 9129 266 R TRP CB 8 C4H2s 0.770 1.880 3.898 31.750 24.004 1.323 possible 9130 266 R TRP CG 2 C3H0b 0.770 1.610 3.622 12.907 9.965 1.295 possible 9131 266 R TRP CD1 5 C3H1s 0.770 1.760 3.596 28.381 20.874 1.360 possible 9132 266 R TRP CD2 2 C3H0b 0.770 1.610 3.952 14.688 10.097 1.455 possible 9133 266 R TRP NE1 13 N3H1b 0.700 1.640 3.487 21.242 16.969 1.252 possible 9134 266 R TRP CE2 2 C3H0b 0.770 1.610 3.894 13.365 9.889 1.351 possible 9135 266 R TRP CE3 6 C3H1b 0.770 1.760 4.969 27.985 20.448 1.369 possible 9136 266 R TRP CZ2 6 C3H1b 0.770 1.760 4.600 41.657 21.012 1.983 possible 9137 266 R TRP CZ3 6 C3H1b 0.770 1.760 25.551 -1.000 21.516 -1.000 bad 9138 266 R TRP CH2 6 C3H1b 0.770 1.760 28.814 -1.000 21.339 -1.000 bad 9139 267 R VAL N 12 N3H1s 0.700 1.640 2.461 13.056 13.676 0.955 [OK] 9140 267 R VAL CA 3 C4H1s 0.770 1.880 2.815 14.497 13.123 1.105 [OK] 9141 267 R VAL C 1 C3H0s 0.770 1.610 2.418 7.906 8.563 0.923 [OK] 9142 267 R VAL O 16 O1H0u 0.660 1.420 2.489 17.553 16.181 1.085 [OK] 9143 267 R VAL CB 4 C4H1b 0.770 1.880 2.763 13.968 14.598 0.957 [OK] 9144 267 R VAL CG1 10 C4H3u 0.770 1.880 3.346 36.189 36.584 0.989 possible 9145 267 R VAL CG2 10 C4H3u 0.770 1.880 3.177 37.100 36.332 1.021 possible 9146 268 R LYS N 12 N3H1s 0.700 1.640 2.329 12.491 13.675 0.913 [OK] 9147 268 R LYS CA 3 C4H1s 0.770 1.880 2.799 12.420 13.324 0.932 [OK] 9148 268 R LYS C 1 C3H0s 0.770 1.610 3.147 9.964 8.759 1.138 possible 9149 268 R LYS O 16 O1H0u 0.660 1.420 13.269 -1.000 16.049 -1.000 bad 9150 268 R LYS CB 8 C4H2s 0.770 1.880 17.408 -1.000 22.904 -1.000 bad 9151 268 R LYS CG 8 C4H2s 0.770 1.880 15.987 -1.000 23.131 -1.000 bad 9152 268 R LYS CD 8 C4H2s 0.770 1.880 14.443 -1.000 23.837 -1.000 bad 9153 268 R LYS CE 9 C4H2b 0.770 1.880 22.470 -1.000 23.934 -1.000 bad 9154 268 R LYS NZ 14 N4H3u 0.700 1.640 30.528 -1.000 21.213 -1.000 bad 9155 269 R LEU N 12 N3H1s 0.700 1.640 2.624 13.905 13.655 1.018 [OK] 9156 269 R LEU CA 3 C4H1s 0.770 1.880 3.242 12.064 13.122 0.919 possible 9157 269 R LEU C 1 C3H0s 0.770 1.610 2.340 8.658 8.825 0.981 [OK] 9158 269 R LEU O 16 O1H0u 0.660 1.420 2.371 14.472 16.208 0.893 [OK] 9159 269 R LEU CB 8 C4H2s 0.770 1.880 2.754 19.655 22.951 0.856 [OK] 9160 269 R LEU CG 4 C4H1b 0.770 1.880 4.439 16.182 14.764 1.096 possible 9161 269 R LEU CD1 10 C4H3u 0.770 1.880 25.551 -1.000 37.425 -1.000 bad 9162 269 R LEU CD2 10 C4H3u 0.770 1.880 5.338 46.530 37.143 1.253 possible 9163 270 R PRO N 11 N3H0u 0.700 1.640 2.373 8.289 8.823 0.939 [OK] 9164 270 R PRO CA 4 C4H1b 0.770 1.880 5.095 20.505 13.955 1.469 possible 9165 270 R PRO C 1 C3H0s 0.770 1.610 4.538 9.882 8.812 1.121 possible 9166 270 R PRO O 16 O1H0u 0.660 1.420 6.103 -1.000 16.169 -1.000 bad 9167 270 R PRO CB 9 C4H2b 0.770 1.880 34.166 -1.000 25.563 -1.000 bad 9168 270 R PRO CG 9 C4H2b 0.770 1.880 40.933 -1.000 25.832 -1.000 bad 9169 270 R PRO CD 8 C4H2s 0.770 1.880 9.724 -1.000 23.836 -1.000 bad 9170 271 R TRP N 12 N3H1s 0.700 1.640 4.877 18.125 13.791 1.314 possible 9171 271 R TRP CA 3 C4H1s 0.770 1.880 11.551 -1.000 13.377 -1.000 bad 9172 271 R TRP C 1 C3H0s 0.770 1.610 2.789 8.766 8.724 1.005 [OK] 9173 271 R TRP O 16 O1H0u 0.660 1.420 10.026 -1.000 15.951 -1.000 bad 9174 271 R TRP CB 8 C4H2s 0.770 1.880 31.370 -1.000 24.004 -1.000 bad 9175 271 R TRP CG 2 C3H0b 0.770 1.610 0.873 -1.000 9.965 -1.000 bad 9176 271 R TRP CD1 5 C3H1s 0.770 1.760 15.890 -1.000 20.874 -1.000 bad 9177 271 R TRP CD2 2 C3H0b 0.770 1.610 1.709 -1.000 10.097 -1.000 bad 9178 271 R TRP NE1 13 N3H1b 0.700 1.640 7.621 -1.000 16.969 -1.000 bad 9179 271 R TRP CE2 2 C3H0b 0.770 1.610 1.563 -1.000 9.889 -1.000 bad 9180 271 R TRP CE3 6 C3H1b 0.770 1.760 13.871 -1.000 20.448 -1.000 bad 9181 271 R TRP CZ2 6 C3H1b 0.770 1.760 16.922 -1.000 21.012 -1.000 bad 9182 271 R TRP CZ3 6 C3H1b 0.770 1.760 20.839 -1.000 21.516 -1.000 bad 9183 271 R TRP CH2 6 C3H1b 0.770 1.760 21.192 -1.000 21.339 -1.000 bad 9184 272 R TRP N 12 N3H1s 0.700 1.640 2.767 13.015 13.791 0.944 [OK] 9185 272 R TRP CA 3 C4H1s 0.770 1.880 3.074 12.105 13.377 0.905 possible 9186 272 R TRP C 1 C3H0s 0.770 1.610 2.344 8.674 8.724 0.994 [OK] 9187 272 R TRP O 16 O1H0u 0.660 1.420 2.605 14.916 15.951 0.935 [OK] 9188 272 R TRP CB 8 C4H2s 0.770 1.880 3.236 25.711 24.004 1.071 possible 9189 272 R TRP CG 2 C3H0b 0.770 1.610 2.532 9.327 9.965 0.936 [OK] 9190 272 R TRP CD1 5 C3H1s 0.770 1.760 2.697 17.336 20.874 0.831 [OK] 9191 272 R TRP CD2 2 C3H0b 0.770 1.610 2.354 9.127 10.097 0.904 [OK] 9192 272 R TRP NE1 13 N3H1b 0.700 1.640 2.611 14.686 16.969 0.865 [OK] 9193 272 R TRP CE2 2 C3H0b 0.770 1.610 2.542 9.704 9.889 0.981 [OK] 9194 272 R TRP CE3 6 C3H1b 0.770 1.760 4.399 23.173 20.448 1.133 possible 9195 272 R TRP CZ2 6 C3H1b 0.770 1.760 3.190 21.948 21.012 1.045 possible 9196 272 R TRP CZ3 6 C3H1b 0.770 1.760 5.498 32.977 21.516 1.533 possible 9197 272 R TRP CH2 6 C3H1b 0.770 1.760 6.387 38.826 21.339 1.819 possible 9198 273 R ALA N 12 N3H1s 0.700 1.640 2.420 13.362 14.046 0.951 [OK] 9199 273 R ALA CA 4 C4H1b 0.770 1.880 2.914 15.265 14.063 1.085 [OK] 9200 273 R ALA C 1 C3H0s 0.770 1.610 2.530 8.683 8.900 0.976 [OK] 9201 273 R ALA O 16 O1H0u 0.660 1.420 5.515 37.733 16.188 2.331 possible 9202 273 R ALA CB 10 C4H3u 0.770 1.880 5.147 48.051 36.782 1.306 possible 9203 274 R ASN N 12 N3H1s 0.700 1.640 2.240 11.258 13.695 0.822 [OK] 9204 274 R ASN CA 3 C4H1s 0.770 1.880 6.322 25.507 13.167 1.937 possible 9205 274 R ASN C 1 C3H0s 0.770 1.610 3.664 11.822 8.928 1.324 possible 9206 274 R ASN O 16 O1H0u 0.660 1.420 16.410 -1.000 16.199 -1.000 bad 9207 274 R ASN CB 8 C4H2s 0.770 1.880 26.852 -1.000 23.128 -1.000 bad 9208 274 R ASN CG 2 C3H0b 0.770 1.610 2.344 -1.000 9.599 -1.000 bad 9209 274 R ASN OD1 16 O1H0u 0.660 1.420 39.659 -1.000 16.664 -1.000 bad 9210 274 R ASN ND2 15 N3H2u 0.700 1.640 26.706 -1.000 23.083 -1.000 bad 9211 275 R ILE N 12 N3H1s 0.700 1.640 2.708 13.476 13.633 0.988 [OK] 9212 275 R ILE CA 3 C4H1s 0.770 1.880 4.212 14.112 13.007 1.085 possible 9213 275 R ILE C 1 C3H0s 0.770 1.610 2.929 8.474 8.470 1.000 [OK] 9214 275 R ILE O 16 O1H0u 0.660 1.420 3.469 22.646 16.144 1.403 possible 9215 275 R ILE CB 4 C4H1b 0.770 1.880 3.167 14.419 14.227 1.014 possible 9216 275 R ILE CG1 9 C4H2b 0.770 1.880 12.456 -1.000 24.187 -1.000 bad 9217 275 R ILE CG2 10 C4H3u 0.770 1.880 6.776 44.417 35.961 1.235 possible 9218 275 R ILE CD1 10 C4H3u 0.770 1.880 22.727 -1.000 38.377 -1.000 bad 9219 276 R PRO N 11 N3H0u 0.700 1.640 3.311 8.757 8.823 0.992 possible 9220 276 R PRO CA 4 C4H1b 0.770 1.880 4.132 15.699 13.955 1.125 possible 9221 276 R PRO C 1 C3H0s 0.770 1.610 4.006 10.214 8.812 1.159 possible 9222 276 R PRO O 16 O1H0u 0.660 1.420 7.447 56.306 16.169 3.482 possible 9223 276 R PRO CB 9 C4H2b 0.770 1.880 30.586 -1.000 25.563 -1.000 bad 9224 276 R PRO CG 9 C4H2b 0.770 1.880 40.061 -1.000 25.832 -1.000 bad 9225 276 R PRO CD 8 C4H2s 0.770 1.880 21.875 -1.000 23.836 -1.000 bad 9226 277 R GLY N 12 N3H1s 0.700 1.640 6.607 22.971 14.854 1.546 possible 9227 277 R GLY CA 8 C4H2s 0.770 1.880 26.077 -1.000 23.688 -1.000 bad 9228 277 R GLY C 2 C3H0b 0.770 1.610 2.912 10.324 9.840 1.049 [OK] 9229 277 R GLY O 16 O1H0u 0.660 1.420 2.463 16.886 16.391 1.030 [OK] 9230 278 R GLY N 12 N3H1s 0.700 1.640 5.138 30.953 14.854 2.084 possible 9231 278 R GLY CA 8 C4H2s 0.770 1.880 2.951 22.907 23.688 0.967 [OK] 9232 278 R GLY C 2 C3H0b 0.770 1.610 2.770 9.938 9.840 1.010 [OK] 9233 278 R GLY O 16 O1H0u 0.660 1.420 14.106 -1.000 16.391 -1.000 bad 9234 279 R ILE N 12 N3H1s 0.700 1.640 2.677 13.927 13.633 1.022 [OK] 9235 279 R ILE CA 3 C4H1s 0.770 1.880 4.952 15.913 13.007 1.223 possible 9236 279 R ILE C 1 C3H0s 0.770 1.610 2.574 8.826 8.470 1.042 [OK] 9237 279 R ILE O 16 O1H0u 0.660 1.420 24.586 -1.000 16.144 -1.000 bad 9238 279 R ILE CB 4 C4H1b 0.770 1.880 2.777 14.629 14.227 1.028 [OK] 9239 279 R ILE CG1 9 C4H2b 0.770 1.880 2.850 22.348 24.187 0.924 [OK] 9240 279 R ILE CG2 10 C4H3u 0.770 1.880 31.106 -1.000 35.961 -1.000 bad 9241 279 R ILE CD1 10 C4H3u 0.770 1.880 18.406 -1.000 38.377 -1.000 bad 9242 280 R ASN N 12 N3H1s 0.700 1.640 2.388 14.210 13.695 1.038 [OK] 9243 280 R ASN CA 3 C4H1s 0.770 1.880 6.597 20.173 13.167 1.532 possible 9244 280 R ASN C 1 C3H0s 0.770 1.610 1.793 -1.000 8.928 -1.000 bad 9245 280 R ASN O 16 O1H0u 0.660 1.420 8.406 -1.000 16.199 -1.000 bad 9246 280 R ASN CB 8 C4H2s 0.770 1.880 3.856 24.249 23.128 1.048 possible 9247 280 R ASN CG 2 C3H0b 0.770 1.610 2.849 9.708 9.599 1.011 [OK] 9248 280 R ASN OD1 16 O1H0u 0.660 1.420 19.544 -1.000 16.664 -1.000 bad 9249 280 R ASN ND2 15 N3H2u 0.700 1.640 2.602 24.247 23.083 1.050 [OK] 9250 281 R GLY N 12 N3H1s 0.700 1.640 2.855 -1.000 14.854 -1.000 bad 9251 281 R GLY CA 8 C4H2s 0.770 1.880 19.455 -1.000 23.688 -1.000 bad 9252 281 R GLY C 2 C3H0b 0.770 1.610 3.935 -1.000 9.840 -1.000 bad 9253 281 R GLY O 16 O1H0u 0.660 1.420 20.022 -1.000 16.391 -1.000 bad 9254 281 R GLY OXT 16 O1H0u 0.660 1.420 25.563 -1.000 1.420 -1.000 bad 9256 3 S TYR N 12 N3H1s 0.700 1.640 16.787 -1.000 13.691 -1.000 bad 9257 3 S TYR CA 3 C4H1s 0.770 1.880 5.677 25.251 13.330 1.894 possible 9258 3 S TYR C 1 C3H0s 0.770 1.610 4.539 11.835 8.770 1.349 possible 9259 3 S TYR O 16 O1H0u 0.660 1.420 4.811 23.888 16.124 1.482 possible 9260 3 S TYR CB 8 C4H2s 0.770 1.880 2.966 24.155 23.678 1.020 [OK] 9261 3 S TYR CG 2 C3H0b 0.770 1.610 2.423 9.666 9.732 0.993 [OK] 9262 3 S TYR CD1 5 C3H1s 0.770 1.760 5.155 33.547 20.171 1.663 possible 9263 3 S TYR CD2 5 C3H1s 0.770 1.760 2.843 23.159 20.728 1.117 [OK] 9264 3 S TYR CE1 5 C3H1s 0.770 1.760 4.873 23.143 20.675 1.119 possible 9265 3 S TYR CE2 5 C3H1s 0.770 1.760 2.768 19.546 20.810 0.939 [OK] 9266 3 S TYR CZ 2 C3H0b 0.770 1.610 2.497 9.399 9.926 0.947 [OK] 9267 3 S TYR OH 17 O2H1u 0.660 1.460 2.621 17.394 19.173 0.907 [OK] 9268 4 S GLN N 12 N3H1s 0.700 1.640 5.585 24.656 13.616 1.811 possible 9269 4 S GLN CA 3 C4H1s 0.770 1.880 2.852 13.025 13.334 0.977 [OK] 9270 4 S GLN C 1 C3H0s 0.770 1.610 2.637 10.510 8.787 1.196 [OK] 9271 4 S GLN O 16 O1H0u 0.660 1.420 2.727 16.845 15.993 1.053 [OK] 9272 4 S GLN CB 8 C4H2s 0.770 1.880 17.078 -1.000 23.275 -1.000 bad 9273 4 S GLN CG 8 C4H2s 0.770 1.880 33.678 -1.000 23.465 -1.000 bad 9274 4 S GLN CD 2 C3H0b 0.770 1.610 4.128 12.731 9.659 1.318 possible 9275 4 S GLN OE1 16 O1H0u 0.660 1.420 3.758 28.039 17.091 1.641 possible 9276 4 S GLN NE2 15 N3H2u 0.700 1.640 4.943 38.435 24.150 1.592 possible 9277 5 S ASN N 12 N3H1s 0.700 1.640 2.675 14.316 13.695 1.045 [OK] 9278 5 S ASN CA 3 C4H1s 0.770 1.880 2.642 11.761 13.167 0.893 [OK] 9279 5 S ASN C 1 C3H0s 0.770 1.610 2.520 9.766 8.928 1.094 [OK] 9280 5 S ASN O 16 O1H0u 0.660 1.420 2.527 16.094 16.199 0.994 [OK] 9281 5 S ASN CB 8 C4H2s 0.770 1.880 3.034 27.347 23.128 1.182 possible 9282 5 S ASN CG 2 C3H0b 0.770 1.610 2.451 9.575 9.599 0.998 [OK] 9283 5 S ASN OD1 16 O1H0u 0.660 1.420 2.472 18.890 16.664 1.134 [OK] 9284 5 S ASN ND2 15 N3H2u 0.700 1.640 2.776 26.031 23.083 1.128 [OK] 9285 6 S ILE N 12 N3H1s 0.700 1.640 2.465 12.967 13.633 0.951 [OK] 9286 6 S ILE CA 3 C4H1s 0.770 1.880 2.540 12.024 13.007 0.924 [OK] 9287 6 S ILE C 1 C3H0s 0.770 1.610 2.148 8.345 8.470 0.985 [OK] 9288 6 S ILE O 16 O1H0u 0.660 1.420 2.333 16.217 16.144 1.005 [OK] 9289 6 S ILE CB 4 C4H1b 0.770 1.880 4.972 19.552 14.227 1.374 possible 9290 6 S ILE CG1 9 C4H2b 0.770 1.880 6.562 67.536 24.187 2.792 possible 9291 6 S ILE CG2 10 C4H3u 0.770 1.880 5.579 64.646 35.961 1.798 possible 9292 6 S ILE CD1 10 C4H3u 0.770 1.880 4.340 49.710 38.377 1.295 possible 9293 7 S PHE N 12 N3H1s 0.700 1.640 2.608 14.087 13.691 1.029 [OK] 9294 7 S PHE CA 3 C4H1s 0.770 1.880 2.641 12.814 13.449 0.953 [OK] 9295 7 S PHE C 1 C3H0s 0.770 1.610 2.461 8.898 8.753 1.017 [OK] 9296 7 S PHE O 16 O1H0u 0.660 1.420 4.908 23.510 16.151 1.456 possible 9297 7 S PHE CB 8 C4H2s 0.770 1.880 15.132 -1.000 23.777 -1.000 bad 9298 7 S PHE CG 2 C3H0b 0.770 1.610 7.161 20.433 9.721 2.102 possible 9299 7 S PHE CD1 5 C3H1s 0.770 1.760 7.015 31.890 20.405 1.563 possible 9300 7 S PHE CD2 6 C3H1b 0.770 1.760 14.670 -1.000 21.051 -1.000 bad 9301 7 S PHE CE1 6 C3H1b 0.770 1.760 7.213 77.862 21.580 3.608 possible 9302 7 S PHE CE2 6 C3H1b 0.770 1.760 23.893 -1.000 21.680 -1.000 bad 9303 7 S PHE CZ 6 C3H1b 0.770 1.760 25.521 -1.000 21.666 -1.000 bad 9304 8 S SER N 12 N3H1s 0.700 1.640 2.678 13.718 14.103 0.973 [OK] 9305 8 S SER CA 3 C4H1s 0.770 1.880 2.875 13.845 13.476 1.027 [OK] 9306 8 S SER C 1 C3H0s 0.770 1.610 2.824 9.079 8.923 1.017 [OK] 9307 8 S SER O 16 O1H0u 0.660 1.420 7.058 -1.000 16.179 -1.000 bad 9308 8 S SER CB 8 C4H2s 0.770 1.880 3.132 30.596 23.884 1.281 possible 9309 8 S SER OG 17 O2H1u 0.660 1.460 2.751 18.671 18.732 0.997 [OK] 9310 9 S GLN N 12 N3H1s 0.700 1.640 2.710 13.641 13.616 1.002 [OK] 9311 9 S GLN CA 3 C4H1s 0.770 1.880 6.754 21.207 13.334 1.590 possible 9312 9 S GLN C 1 C3H0s 0.770 1.610 2.602 9.108 8.787 1.037 [OK] 9313 9 S GLN O 16 O1H0u 0.660 1.420 7.548 44.364 15.993 2.774 possible 9314 9 S GLN CB 8 C4H2s 0.770 1.880 4.169 26.475 23.275 1.138 possible 9315 9 S GLN CG 8 C4H2s 0.770 1.880 6.685 49.890 23.465 2.126 possible 9316 9 S GLN CD 2 C3H0b 0.770 1.610 2.424 8.875 9.659 0.919 [OK] 9317 9 S GLN OE1 16 O1H0u 0.660 1.420 2.480 20.475 17.091 1.198 [OK] 9318 9 S GLN NE2 15 N3H2u 0.700 1.640 4.417 33.060 24.150 1.369 possible 9319 10 S VAL N 12 N3H1s 0.700 1.640 2.819 13.409 13.676 0.980 [OK] 9320 10 S VAL CA 3 C4H1s 0.770 1.880 2.729 13.295 13.123 1.013 [OK] 9321 10 S VAL C 1 C3H0s 0.770 1.610 2.787 9.623 8.563 1.124 [OK] 9322 10 S VAL O 16 O1H0u 0.660 1.420 2.576 18.583 16.181 1.148 [OK] 9323 10 S VAL CB 4 C4H1b 0.770 1.880 2.956 14.618 14.598 1.001 [OK] 9324 10 S VAL CG1 10 C4H3u 0.770 1.880 3.176 40.289 36.584 1.101 possible 9325 10 S VAL CG2 10 C4H3u 0.770 1.880 2.930 34.417 36.332 0.947 [OK] 9326 11 S GLN N 12 N3H1s 0.700 1.640 2.686 13.830 13.616 1.016 [OK] 9327 11 S GLN CA 3 C4H1s 0.770 1.880 2.928 12.407 13.334 0.930 [OK] 9328 11 S GLN C 1 C3H0s 0.770 1.610 2.607 9.040 8.787 1.029 [OK] 9329 11 S GLN O 16 O1H0u 0.660 1.420 2.330 15.071 15.993 0.942 [OK] 9330 11 S GLN CB 8 C4H2s 0.770 1.880 2.989 22.139 23.275 0.951 [OK] 9331 11 S GLN CG 8 C4H2s 0.770 1.880 3.061 28.205 23.465 1.202 possible 9332 11 S GLN CD 2 C3H0b 0.770 1.610 2.408 8.872 9.659 0.919 [OK] 9333 11 S GLN OE1 16 O1H0u 0.660 1.420 2.726 20.078 17.091 1.175 [OK] 9334 11 S GLN NE2 15 N3H2u 0.700 1.640 2.379 18.895 24.150 0.782 [OK] 9335 12 S VAL N 12 N3H1s 0.700 1.640 2.711 13.807 13.676 1.010 [OK] 9336 12 S VAL CA 3 C4H1s 0.770 1.880 2.474 12.560 13.123 0.957 [OK] 9337 12 S VAL C 1 C3H0s 0.770 1.610 2.508 8.297 8.563 0.969 [OK] 9338 12 S VAL O 16 O1H0u 0.660 1.420 2.534 18.033 16.181 1.114 [OK] 9339 12 S VAL CB 4 C4H1b 0.770 1.880 2.833 16.008 14.598 1.097 [OK] 9340 12 S VAL CG1 10 C4H3u 0.770 1.880 2.997 34.824 36.584 0.952 [OK] 9341 12 S VAL CG2 10 C4H3u 0.770 1.880 3.039 41.492 36.332 1.142 possible 9342 13 S ARG N 12 N3H1s 0.700 1.640 2.540 14.327 13.650 1.050 [OK] 9343 13 S ARG CA 3 C4H1s 0.770 1.880 2.776 13.023 13.422 0.970 [OK] 9344 13 S ARG C 1 C3H0s 0.770 1.610 2.666 8.846 8.838 1.001 [OK] 9345 13 S ARG O 16 O1H0u 0.660 1.420 2.368 14.367 16.084 0.893 [OK] 9346 13 S ARG CB 8 C4H2s 0.770 1.880 2.887 21.411 23.088 0.927 [OK] 9347 13 S ARG CG 8 C4H2s 0.770 1.880 2.956 22.302 23.640 0.943 [OK] 9348 13 S ARG CD 8 C4H2s 0.770 1.880 2.961 22.650 23.300 0.972 [OK] 9349 13 S ARG NE 13 N3H1b 0.700 1.640 2.727 14.975 15.569 0.962 [OK] 9350 13 S ARG CZ 2 C3H0b 0.770 1.610 3.219 9.932 9.747 1.019 possible 9351 13 S ARG NH1 15 N3H2u 0.700 1.640 24.006 -1.000 22.782 -1.000 bad 9352 13 S ARG NH2 15 N3H2u 0.700 1.640 3.788 32.819 23.810 1.378 possible 9353 14 S GLY N 12 N3H1s 0.700 1.640 2.764 13.698 14.854 0.922 [OK] 9354 14 S GLY CA 8 C4H2s 0.770 1.880 3.173 22.880 23.688 0.966 possible 9355 14 S GLY C 2 C3H0b 0.770 1.610 4.017 13.109 9.840 1.332 possible 9356 14 S GLY O 16 O1H0u 0.660 1.420 2.879 17.902 16.391 1.092 [OK] 9357 15 S PRO N 11 N3H0u 0.700 1.640 4.577 12.118 8.823 1.373 possible 9358 15 S PRO CA 4 C4H1b 0.770 1.880 8.305 -1.000 13.955 -1.000 bad 9359 15 S PRO C 1 C3H0s 0.770 1.610 2.645 8.926 8.812 1.013 [OK] 9360 15 S PRO O 16 O1H0u 0.660 1.420 4.485 25.327 16.169 1.566 possible 9361 15 S PRO CB 9 C4H2b 0.770 1.880 33.514 -1.000 25.563 -1.000 bad 9362 15 S PRO CG 9 C4H2b 0.770 1.880 31.693 -1.000 25.832 -1.000 bad 9363 15 S PRO CD 8 C4H2s 0.770 1.880 4.561 31.390 23.836 1.317 possible 9364 16 S ALA N 12 N3H1s 0.700 1.640 5.363 -1.000 14.046 -1.000 bad 9365 16 S ALA CA 4 C4H1b 0.770 1.880 2.738 13.815 14.063 0.982 [OK] 9366 16 S ALA C 1 C3H0s 0.770 1.610 2.605 8.779 8.900 0.986 [OK] 9367 16 S ALA O 16 O1H0u 0.660 1.420 5.942 47.788 16.188 2.952 possible 9368 16 S ALA CB 10 C4H3u 0.770 1.880 18.063 -1.000 36.782 -1.000 bad 9369 17 S ASP N 12 N3H1s 0.700 1.640 2.706 15.212 13.895 1.095 [OK] 9370 17 S ASP CA 3 C4H1s 0.770 1.880 4.832 19.806 13.377 1.481 possible 9371 17 S ASP C 1 C3H0s 0.770 1.610 2.594 8.946 8.816 1.015 [OK] 9372 17 S ASP O 16 O1H0u 0.660 1.420 2.418 16.727 16.091 1.040 [OK] 9373 17 S ASP CB 8 C4H2s 0.770 1.880 2.808 21.685 23.481 0.924 [OK] 9374 17 S ASP CG 2 C3H0b 0.770 1.610 5.000 10.731 9.422 1.139 possible 9375 17 S ASP OD1 16 O1H0u 0.660 1.420 4.602 31.107 15.505 2.006 possible 9376 17 S ASP OD2 16 O1H0u 0.660 1.420 4.792 32.073 16.324 1.965 possible 9377 18 S LEU N 12 N3H1s 0.700 1.640 4.866 22.123 13.655 1.620 possible 9378 18 S LEU CA 3 C4H1s 0.770 1.880 2.967 14.402 13.122 1.098 [OK] 9379 18 S LEU C 1 C3H0s 0.770 1.610 3.016 9.760 8.825 1.106 possible 9380 18 S LEU O 16 O1H0u 0.660 1.420 3.851 25.923 16.208 1.599 possible 9381 18 S LEU CB 8 C4H2s 0.770 1.880 5.038 55.213 22.951 2.406 possible 9382 18 S LEU CG 4 C4H1b 0.770 1.880 5.545 21.655 14.764 1.467 possible 9383 18 S LEU CD1 10 C4H3u 0.770 1.880 67.470 -1.000 37.425 -1.000 bad 9384 18 S LEU CD2 10 C4H3u 0.770 1.880 23.345 -1.000 37.143 -1.000 bad 9385 19 S GLY N 12 N3H1s 0.700 1.640 3.776 19.048 14.854 1.282 possible 9386 19 S GLY CA 8 C4H2s 0.770 1.880 3.082 22.144 23.688 0.935 possible 9387 19 S GLY C 2 C3H0b 0.770 1.610 3.233 11.625 9.840 1.181 possible 9388 19 S GLY O 16 O1H0u 0.660 1.420 4.546 37.846 16.391 2.309 possible 9389 20 S MET N 12 N3H1s 0.700 1.640 3.051 13.545 13.564 0.999 possible 9390 20 S MET CA 3 C4H1s 0.770 1.880 3.231 14.352 13.231 1.085 possible 9391 20 S MET C 1 C3H0s 0.770 1.610 2.608 9.249 8.782 1.053 [OK] 9392 20 S MET O 16 O1H0u 0.660 1.420 2.282 16.434 16.277 1.010 [OK] 9393 20 S MET CB 8 C4H2s 0.770 1.880 3.167 27.281 23.645 1.154 possible 9394 20 S MET CG 9 C4H2b 0.770 1.880 3.384 23.524 24.009 0.980 possible 9395 20 S MET SD 19 S2H0u 1.040 1.770 3.446 30.774 30.093 1.023 possible 9396 20 S MET CE 10 C4H3u 0.770 1.880 4.331 50.089 37.161 1.348 possible 9397 21 S THR N 12 N3H1s 0.700 1.640 3.587 20.887 13.832 1.510 possible 9398 21 S THR CA 3 C4H1s 0.770 1.880 2.887 13.751 13.099 1.050 [OK] 9399 21 S THR C 1 C3H0s 0.770 1.610 2.446 8.628 8.738 0.987 [OK] 9400 21 S THR O 16 O1H0u 0.660 1.420 2.340 16.170 16.020 1.009 [OK] 9401 21 S THR CB 4 C4H1b 0.770 1.880 5.223 25.745 14.829 1.736 possible 9402 21 S THR OG1 17 O2H1u 0.660 1.460 24.961 -1.000 18.123 -1.000 bad 9403 21 S THR CG2 10 C4H3u 0.770 1.880 18.390 -1.000 36.542 -1.000 bad 9404 22 S GLU N 12 N3H1s 0.700 1.640 4.475 25.887 13.615 1.901 possible 9405 22 S GLU CA 3 C4H1s 0.770 1.880 4.127 17.248 13.399 1.287 possible 9406 22 S GLU C 1 C3H0s 0.770 1.610 3.385 10.254 8.675 1.182 possible 9407 22 S GLU O 16 O1H0u 0.660 1.420 4.169 21.941 16.023 1.369 possible 9408 22 S GLU CB 8 C4H2s 0.770 1.880 2.947 24.046 23.529 1.022 [OK] 9409 22 S GLU CG 8 C4H2s 0.770 1.880 2.963 23.808 23.513 1.013 [OK] 9410 22 S GLU CD 2 C3H0b 0.770 1.610 2.948 8.429 9.460 0.891 [OK] 9411 22 S GLU OE1 16 O1H0u 0.660 1.420 5.256 44.756 15.999 2.797 possible 9412 22 S GLU OE2 16 O1H0u 0.660 1.420 26.921 -1.000 17.432 -1.000 bad 9413 23 S ASP N 12 N3H1s 0.700 1.640 2.378 12.314 13.895 0.886 [OK] 9414 23 S ASP CA 3 C4H1s 0.770 1.880 4.978 18.897 13.377 1.413 possible 9415 23 S ASP C 1 C3H0s 0.770 1.610 2.702 9.666 8.816 1.096 [OK] 9416 23 S ASP O 16 O1H0u 0.660 1.420 19.295 -1.000 16.091 -1.000 bad 9417 23 S ASP CB 8 C4H2s 0.770 1.880 16.750 -1.000 23.481 -1.000 bad 9418 23 S ASP CG 2 C3H0b 0.770 1.610 4.523 12.659 9.422 1.344 possible 9419 23 S ASP OD1 16 O1H0u 0.660 1.420 4.112 32.588 15.505 2.102 possible 9420 23 S ASP OD2 16 O1H0u 0.660 1.420 43.685 -1.000 16.324 -1.000 bad 9421 24 S VAL N 12 N3H1s 0.700 1.640 2.303 12.920 13.676 0.945 [OK] 9422 24 S VAL CA 3 C4H1s 0.770 1.880 3.356 13.833 13.123 1.054 possible 9423 24 S VAL C 1 C3H0s 0.770 1.610 2.810 8.039 8.563 0.939 [OK] 9424 24 S VAL O 16 O1H0u 0.660 1.420 3.798 19.695 16.181 1.217 possible 9425 24 S VAL CB 4 C4H1b 0.770 1.880 2.976 16.090 14.598 1.102 [OK] 9426 24 S VAL CG1 10 C4H3u 0.770 1.880 2.782 31.960 36.584 0.874 [OK] 9427 24 S VAL CG2 10 C4H3u 0.770 1.880 2.960 32.732 36.332 0.901 [OK] 9428 25 S ASN N 12 N3H1s 0.700 1.640 4.341 22.541 13.695 1.646 possible 9429 25 S ASN CA 3 C4H1s 0.770 1.880 7.127 34.394 13.167 2.612 possible 9430 25 S ASN C 1 C3H0s 0.770 1.610 2.216 7.937 8.928 0.889 [OK] 9431 25 S ASN O 16 O1H0u 0.660 1.420 2.422 16.776 16.199 1.036 [OK] 9432 25 S ASN CB 8 C4H2s 0.770 1.880 16.570 -1.000 23.128 -1.000 bad 9433 25 S ASN CG 2 C3H0b 0.770 1.610 1.991 -1.000 9.599 -1.000 bad 9434 25 S ASN OD1 16 O1H0u 0.660 1.420 6.575 -1.000 16.664 -1.000 bad 9435 25 S ASN ND2 15 N3H2u 0.700 1.640 44.828 -1.000 23.083 -1.000 bad 9436 26 S LEU N 12 N3H1s 0.700 1.640 6.195 24.405 13.655 1.787 possible 9437 26 S LEU CA 3 C4H1s 0.770 1.880 2.870 14.955 13.122 1.140 [OK] 9438 26 S LEU C 1 C3H0s 0.770 1.610 4.294 9.894 8.825 1.121 possible 9439 26 S LEU O 16 O1H0u 0.660 1.420 12.635 -1.000 16.208 -1.000 bad 9440 26 S LEU CB 8 C4H2s 0.770 1.880 18.152 -1.000 22.951 -1.000 bad 9441 26 S LEU CG 4 C4H1b 0.770 1.880 5.342 33.155 14.764 2.246 possible 9442 26 S LEU CD1 10 C4H3u 0.770 1.880 3.395 34.279 37.425 0.916 possible 9443 26 S LEU CD2 10 C4H3u 0.770 1.880 48.145 -1.000 37.143 -1.000 bad 9444 27 S ALA N 12 N3H1s 0.700 1.640 5.516 23.457 14.046 1.670 possible 9445 27 S ALA CA 4 C4H1b 0.770 1.880 12.528 -1.000 14.063 -1.000 bad 9446 27 S ALA C 1 C3H0s 0.770 1.610 2.569 8.978 8.900 1.009 [OK] 9447 27 S ALA O 16 O1H0u 0.660 1.420 26.404 -1.000 16.188 -1.000 bad 9448 27 S ALA CB 10 C4H3u 0.770 1.880 50.508 -1.000 36.782 -1.000 bad 9449 28 S ASN N 12 N3H1s 0.700 1.640 2.518 13.391 13.695 0.978 [OK] 9450 28 S ASN CA 3 C4H1s 0.770 1.880 4.591 18.539 13.167 1.408 possible 9451 28 S ASN C 1 C3H0s 0.770 1.610 4.588 12.644 8.928 1.416 possible 9452 28 S ASN O 16 O1H0u 0.660 1.420 4.592 21.978 16.199 1.357 possible 9453 28 S ASN CB 8 C4H2s 0.770 1.880 2.759 22.287 23.128 0.964 [OK] 9454 28 S ASN CG 2 C3H0b 0.770 1.610 2.550 10.220 9.599 1.065 [OK] 9455 28 S ASN OD1 16 O1H0u 0.660 1.420 26.370 -1.000 16.664 -1.000 bad 9456 28 S ASN ND2 15 N3H2u 0.700 1.640 6.068 58.416 23.083 2.531 possible 9457 29 S ARG N 12 N3H1s 0.700 1.640 2.726 15.133 13.650 1.109 [OK] 9458 29 S ARG CA 3 C4H1s 0.770 1.880 2.607 12.553 13.422 0.935 [OK] 9459 29 S ARG C 1 C3H0s 0.770 1.610 3.752 9.862 8.838 1.116 possible 9460 29 S ARG O 16 O1H0u 0.660 1.420 19.420 -1.000 16.084 -1.000 bad 9461 29 S ARG CB 8 C4H2s 0.770 1.880 5.186 36.608 23.088 1.586 possible 9462 29 S ARG CG 8 C4H2s 0.770 1.880 4.242 28.046 23.640 1.186 possible 9463 29 S ARG CD 8 C4H2s 0.770 1.880 3.087 22.870 23.300 0.982 possible 9464 29 S ARG NE 13 N3H1b 0.700 1.640 4.327 26.481 15.569 1.701 possible 9465 29 S ARG CZ 2 C3H0b 0.770 1.610 2.459 10.211 9.747 1.048 [OK] 9466 29 S ARG NH1 15 N3H2u 0.700 1.640 2.625 21.120 22.782 0.927 [OK] 9467 29 S ARG NH2 15 N3H2u 0.700 1.640 3.966 34.525 23.810 1.450 possible 9468 30 S SER N 12 N3H1s 0.700 1.640 3.907 15.717 14.103 1.114 possible 9469 30 S SER CA 3 C4H1s 0.770 1.880 11.202 -1.000 13.476 -1.000 bad 9470 30 S SER C 1 C3H0s 0.770 1.610 4.345 11.156 8.923 1.250 possible 9471 30 S SER O 16 O1H0u 0.660 1.420 7.422 50.127 16.179 3.098 possible 9472 30 S SER CB 8 C4H2s 0.770 1.880 26.858 -1.000 23.884 -1.000 bad 9473 30 S SER OG 17 O2H1u 0.660 1.460 5.710 28.038 18.732 1.497 possible 9474 31 S GLY N 12 N3H1s 0.700 1.640 13.226 -1.000 14.854 -1.000 bad 9475 31 S GLY CA 8 C4H2s 0.770 1.880 40.230 -1.000 23.688 -1.000 bad 9476 31 S GLY C 2 C3H0b 0.770 1.610 3.851 11.495 9.840 1.168 possible 9477 31 S GLY O 16 O1H0u 0.660 1.420 5.882 31.614 16.391 1.929 possible 9478 32 S VAL N 12 N3H1s 0.700 1.640 5.266 -1.000 13.676 -1.000 bad 9479 32 S VAL CA 3 C4H1s 0.770 1.880 2.709 13.700 13.123 1.044 [OK] 9480 32 S VAL C 1 C3H0s 0.770 1.610 2.909 8.618 8.563 1.006 [OK] 9481 32 S VAL O 16 O1H0u 0.660 1.420 26.618 -1.000 16.181 -1.000 bad 9482 32 S VAL CB 4 C4H1b 0.770 1.880 10.386 -1.000 14.598 -1.000 bad 9483 32 S VAL CG1 10 C4H3u 0.770 1.880 5.951 43.142 36.584 1.179 possible 9484 32 S VAL CG2 10 C4H3u 0.770 1.880 4.979 42.009 36.332 1.156 possible 9485 33 S GLY N 12 N3H1s 0.700 1.640 3.846 16.897 14.854 1.138 possible 9486 33 S GLY CA 8 C4H2s 0.770 1.880 22.078 -1.000 23.688 -1.000 bad 9487 33 S GLY C 2 C3H0b 0.770 1.610 5.739 15.100 9.840 1.535 possible 9488 33 S GLY O 16 O1H0u 0.660 1.420 9.429 -1.000 16.391 -1.000 bad 9489 34 S PRO N 11 N3H0u 0.700 1.640 5.133 10.537 8.823 1.194 possible 9490 34 S PRO CA 4 C4H1b 0.770 1.880 10.125 -1.000 13.955 -1.000 bad 9491 34 S PRO C 1 C3H0s 0.770 1.610 2.881 9.906 8.812 1.124 [OK] 9492 34 S PRO O 16 O1H0u 0.660 1.420 2.603 17.071 16.169 1.056 [OK] 9493 34 S PRO CB 9 C4H2b 0.770 1.880 24.183 -1.000 25.563 -1.000 bad 9494 34 S PRO CG 9 C4H2b 0.770 1.880 41.819 -1.000 25.832 -1.000 bad 9495 34 S PRO CD 8 C4H2s 0.770 1.880 13.550 -1.000 23.836 -1.000 bad 9496 35 S PHE N 12 N3H1s 0.700 1.640 6.468 29.341 13.691 2.143 possible 9497 35 S PHE CA 3 C4H1s 0.770 1.880 2.595 12.866 13.449 0.957 [OK] 9498 35 S PHE C 1 C3H0s 0.770 1.610 2.774 9.755 8.753 1.114 [OK] 9499 35 S PHE O 16 O1H0u 0.660 1.420 17.557 -1.000 16.151 -1.000 bad 9500 35 S PHE CB 8 C4H2s 0.770 1.880 4.412 24.057 23.777 1.012 possible 9501 35 S PHE CG 2 C3H0b 0.770 1.610 2.639 10.006 9.721 1.029 [OK] 9502 35 S PHE CD1 5 C3H1s 0.770 1.760 6.229 49.323 20.405 2.417 possible 9503 35 S PHE CD2 6 C3H1b 0.770 1.760 2.540 18.094 21.051 0.860 [OK] 9504 35 S PHE CE1 6 C3H1b 0.770 1.760 6.779 37.719 21.580 1.748 possible 9505 35 S PHE CE2 6 C3H1b 0.770 1.760 2.763 21.207 21.680 0.978 [OK] 9506 35 S PHE CZ 6 C3H1b 0.770 1.760 2.728 21.730 21.666 1.003 [OK] 9507 36 S SER N 12 N3H1s 0.700 1.640 2.939 15.482 14.103 1.098 [OK] 9508 36 S SER CA 3 C4H1s 0.770 1.880 6.878 18.638 13.476 1.383 possible 9509 36 S SER C 1 C3H0s 0.770 1.610 2.457 8.922 8.923 1.000 [OK] 9510 36 S SER O 16 O1H0u 0.660 1.420 2.403 14.467 16.179 0.894 [OK] 9511 36 S SER CB 8 C4H2s 0.770 1.880 27.375 -1.000 23.884 -1.000 bad 9512 36 S SER OG 17 O2H1u 0.660 1.460 4.884 26.623 18.732 1.421 possible 9513 37 S THR N 12 N3H1s 0.700 1.640 7.704 28.406 13.832 2.054 possible 9514 37 S THR CA 3 C4H1s 0.770 1.880 2.864 14.591 13.099 1.114 [OK] 9515 37 S THR C 1 C3H0s 0.770 1.610 2.821 8.670 8.738 0.992 [OK] 9516 37 S THR O 16 O1H0u 0.660 1.420 2.289 13.133 16.020 0.820 [OK] 9517 37 S THR CB 4 C4H1b 0.770 1.880 14.155 -1.000 14.829 -1.000 bad 9518 37 S THR OG1 17 O2H1u 0.660 1.460 16.911 -1.000 18.123 -1.000 bad 9519 37 S THR CG2 10 C4H3u 0.770 1.880 16.966 -1.000 36.542 -1.000 bad 9520 38 S LEU N 12 N3H1s 0.700 1.640 5.731 28.254 13.655 2.069 possible 9521 38 S LEU CA 3 C4H1s 0.770 1.880 4.780 16.901 13.122 1.288 possible 9522 38 S LEU C 1 C3H0s 0.770 1.610 2.740 7.825 8.825 0.887 [OK] 9523 38 S LEU O 16 O1H0u 0.660 1.420 4.099 27.019 16.208 1.667 possible 9524 38 S LEU CB 8 C4H2s 0.770 1.880 13.125 -1.000 22.951 -1.000 bad 9525 38 S LEU CG 4 C4H1b 0.770 1.880 6.468 24.710 14.764 1.674 possible 9526 38 S LEU CD1 10 C4H3u 0.770 1.880 55.575 -1.000 37.425 -1.000 bad 9527 38 S LEU CD2 10 C4H3u 0.770 1.880 56.180 -1.000 37.143 -1.000 bad 9528 39 S LEU N 12 N3H1s 0.700 1.640 2.696 13.950 13.655 1.022 [OK] 9529 39 S LEU CA 3 C4H1s 0.770 1.880 4.216 18.520 13.122 1.411 possible 9530 39 S LEU C 1 C3H0s 0.770 1.610 2.250 8.263 8.825 0.936 [OK] 9531 39 S LEU O 16 O1H0u 0.660 1.420 3.307 20.143 16.208 1.243 possible 9532 39 S LEU CB 8 C4H2s 0.770 1.880 3.772 23.350 22.951 1.017 possible 9533 39 S LEU CG 4 C4H1b 0.770 1.880 5.156 17.179 14.764 1.164 possible 9534 39 S LEU CD1 10 C4H3u 0.770 1.880 13.680 -1.000 37.425 -1.000 bad 9535 39 S LEU CD2 10 C4H3u 0.770 1.880 48.313 -1.000 37.143 -1.000 bad 9536 40 S GLY N 12 N3H1s 0.700 1.640 2.322 13.318 14.854 0.897 [OK] 9537 40 S GLY CA 8 C4H2s 0.770 1.880 2.996 23.555 23.688 0.994 [OK] 9538 40 S GLY C 2 C3H0b 0.770 1.610 2.157 8.662 9.840 0.880 [OK] 9539 40 S GLY O 16 O1H0u 0.660 1.420 2.510 15.541 16.391 0.948 [OK] 9540 41 S TRP N 12 N3H1s 0.700 1.640 2.342 12.589 13.791 0.913 [OK] 9541 41 S TRP CA 3 C4H1s 0.770 1.880 2.791 13.652 13.377 1.021 [OK] 9542 41 S TRP C 1 C3H0s 0.770 1.610 2.545 8.817 8.724 1.011 [OK] 9543 41 S TRP O 16 O1H0u 0.660 1.420 2.497 16.015 15.951 1.004 [OK] 9544 41 S TRP CB 8 C4H2s 0.770 1.880 4.460 36.917 24.004 1.538 possible 9545 41 S TRP CG 2 C3H0b 0.770 1.610 6.401 15.956 9.965 1.601 possible 9546 41 S TRP CD1 5 C3H1s 0.770 1.760 10.510 -1.000 20.874 -1.000 bad 9547 41 S TRP CD2 2 C3H0b 0.770 1.610 6.672 17.530 10.097 1.736 possible 9548 41 S TRP NE1 13 N3H1b 0.700 1.640 15.074 -1.000 16.969 -1.000 bad 9549 41 S TRP CE2 2 C3H0b 0.770 1.610 1.651 -1.000 9.889 -1.000 bad 9550 41 S TRP CE3 6 C3H1b 0.770 1.760 6.884 29.802 20.448 1.457 possible 9551 41 S TRP CZ2 6 C3H1b 0.770 1.760 18.938 -1.000 21.012 -1.000 bad 9552 41 S TRP CZ3 6 C3H1b 0.770 1.760 6.194 -1.000 21.516 -1.000 bad 9553 41 S TRP CH2 6 C3H1b 0.770 1.760 7.495 -1.000 21.339 -1.000 bad 9554 42 S PHE N 12 N3H1s 0.700 1.640 2.927 14.015 13.691 1.024 [OK] 9555 42 S PHE CA 3 C4H1s 0.770 1.880 2.753 13.722 13.449 1.020 [OK] 9556 42 S PHE C 1 C3H0s 0.770 1.610 2.497 8.718 8.753 0.996 [OK] 9557 42 S PHE O 16 O1H0u 0.660 1.420 2.653 18.662 16.151 1.155 [OK] 9558 42 S PHE CB 8 C4H2s 0.770 1.880 5.860 47.272 23.777 1.988 possible 9559 42 S PHE CG 2 C3H0b 0.770 1.610 6.081 16.762 9.721 1.724 possible 9560 42 S PHE CD1 5 C3H1s 0.770 1.760 4.669 23.045 20.405 1.129 possible 9561 42 S PHE CD2 6 C3H1b 0.770 1.760 6.158 47.706 21.051 2.266 possible 9562 42 S PHE CE1 6 C3H1b 0.770 1.760 4.055 28.810 21.580 1.335 possible 9563 42 S PHE CE2 6 C3H1b 0.770 1.760 4.905 29.785 21.680 1.374 possible 9564 42 S PHE CZ 6 C3H1b 0.770 1.760 3.977 20.658 21.666 0.953 possible 9565 43 S GLY N 12 N3H1s 0.700 1.640 3.308 15.315 14.854 1.031 possible 9566 43 S GLY CA 8 C4H2s 0.770 1.880 3.160 23.967 23.688 1.012 possible 9567 43 S GLY C 2 C3H0b 0.770 1.610 2.610 9.840 9.840 1.000 [OK] 9568 43 S GLY O 16 O1H0u 0.660 1.420 2.268 14.686 16.391 0.896 [OK] 9569 44 S ASN N 12 N3H1s 0.700 1.640 2.603 14.755 13.695 1.077 [OK] 9570 44 S ASN CA 3 C4H1s 0.770 1.880 2.444 12.258 13.167 0.931 [OK] 9571 44 S ASN C 1 C3H0s 0.770 1.610 2.587 8.914 8.928 0.998 [OK] 9572 44 S ASN O 16 O1H0u 0.660 1.420 2.467 16.798 16.199 1.037 [OK] 9573 44 S ASN CB 8 C4H2s 0.770 1.880 3.062 23.328 23.128 1.009 possible 9574 44 S ASN CG 2 C3H0b 0.770 1.610 3.194 11.260 9.599 1.173 possible 9575 44 S ASN OD1 16 O1H0u 0.660 1.420 3.022 22.679 16.664 1.361 possible 9576 44 S ASN ND2 15 N3H2u 0.700 1.640 3.268 35.272 23.083 1.528 possible 9577 45 S ALA N 12 N3H1s 0.700 1.640 2.449 12.796 14.046 0.911 [OK] 9578 45 S ALA CA 4 C4H1b 0.770 1.880 2.746 13.504 14.063 0.960 [OK] 9579 45 S ALA C 1 C3H0s 0.770 1.610 2.503 9.465 8.900 1.063 [OK] 9580 45 S ALA O 16 O1H0u 0.660 1.420 2.427 16.206 16.188 1.001 [OK] 9581 45 S ALA CB 10 C4H3u 0.770 1.880 2.986 35.382 36.782 0.962 [OK] 9582 46 S GLN N 12 N3H1s 0.700 1.640 2.561 14.377 13.616 1.056 [OK] 9583 46 S GLN CA 3 C4H1s 0.770 1.880 2.971 13.511 13.334 1.013 [OK] 9584 46 S GLN C 1 C3H0s 0.770 1.610 2.275 8.208 8.787 0.934 [OK] 9585 46 S GLN O 16 O1H0u 0.660 1.420 2.429 14.859 15.993 0.929 [OK] 9586 46 S GLN CB 8 C4H2s 0.770 1.880 2.960 22.614 23.275 0.972 [OK] 9587 46 S GLN CG 8 C4H2s 0.770 1.880 3.186 24.584 23.465 1.048 possible 9588 46 S GLN CD 2 C3H0b 0.770 1.610 2.536 10.179 9.659 1.054 [OK] 9589 46 S GLN OE1 16 O1H0u 0.660 1.420 2.351 16.208 17.091 0.948 [OK] 9590 46 S GLN NE2 15 N3H2u 0.700 1.640 2.684 25.413 24.150 1.052 [OK] 9591 47 S LEU N 12 N3H1s 0.700 1.640 2.761 12.871 13.655 0.943 [OK] 9592 47 S LEU CA 3 C4H1s 0.770 1.880 2.924 14.435 13.122 1.100 [OK] 9593 47 S LEU C 1 C3H0s 0.770 1.610 3.314 9.333 8.825 1.058 possible 9594 47 S LEU O 16 O1H0u 0.660 1.420 2.659 16.883 16.208 1.042 [OK] 9595 47 S LEU CB 8 C4H2s 0.770 1.880 5.990 32.151 22.951 1.401 possible 9596 47 S LEU CG 4 C4H1b 0.770 1.880 5.412 30.898 14.764 2.093 possible 9597 47 S LEU CD1 10 C4H3u 0.770 1.880 3.722 38.659 37.425 1.033 possible 9598 47 S LEU CD2 10 C4H3u 0.770 1.880 43.978 -1.000 37.143 -1.000 bad 9599 48 S GLY N 12 N3H1s 0.700 1.640 5.121 17.783 14.854 1.197 possible 9600 48 S GLY CA 8 C4H2s 0.770 1.880 5.506 38.757 23.688 1.636 possible 9601 48 S GLY C 2 C3H0b 0.770 1.610 2.540 10.394 9.840 1.056 [OK] 9602 48 S GLY O 16 O1H0u 0.660 1.420 2.353 15.543 16.391 0.948 [OK] 9603 49 S PRO N 11 N3H0u 0.700 1.640 2.387 8.436 8.823 0.956 [OK] 9604 49 S PRO CA 4 C4H1b 0.770 1.880 2.986 13.978 13.955 1.002 [OK] 9605 49 S PRO C 1 C3H0s 0.770 1.610 2.708 9.277 8.812 1.053 [OK] 9606 49 S PRO O 16 O1H0u 0.660 1.420 2.336 14.700 16.169 0.909 [OK] 9607 49 S PRO CB 9 C4H2b 0.770 1.880 3.092 23.924 25.563 0.936 possible 9608 49 S PRO CG 9 C4H2b 0.770 1.880 4.136 35.579 25.832 1.377 possible 9609 49 S PRO CD 8 C4H2s 0.770 1.880 2.877 25.460 23.836 1.068 [OK] 9610 50 S ILE N 12 N3H1s 0.700 1.640 3.142 13.836 13.633 1.015 possible 9611 50 S ILE CA 3 C4H1s 0.770 1.880 2.565 12.710 13.007 0.977 [OK] 9612 50 S ILE C 1 C3H0s 0.770 1.610 2.570 9.306 8.470 1.099 [OK] 9613 50 S ILE O 16 O1H0u 0.660 1.420 2.965 16.536 16.144 1.024 [OK] 9614 50 S ILE CB 4 C4H1b 0.770 1.880 4.043 16.942 14.227 1.191 possible 9615 50 S ILE CG1 9 C4H2b 0.770 1.880 2.685 21.717 24.187 0.898 [OK] 9616 50 S ILE CG2 10 C4H3u 0.770 1.880 18.682 -1.000 35.961 -1.000 bad 9617 50 S ILE CD1 10 C4H3u 0.770 1.880 23.230 -1.000 38.377 -1.000 bad 9618 51 S TYR N 12 N3H1s 0.700 1.640 2.578 13.108 13.691 0.957 [OK] 9619 51 S TYR CA 3 C4H1s 0.770 1.880 2.588 13.093 13.330 0.982 [OK] 9620 51 S TYR C 1 C3H0s 0.770 1.610 2.410 8.714 8.770 0.994 [OK] 9621 51 S TYR O 16 O1H0u 0.660 1.420 2.372 15.047 16.124 0.933 [OK] 9622 51 S TYR CB 8 C4H2s 0.770 1.880 2.827 21.416 23.678 0.904 [OK] 9623 51 S TYR CG 2 C3H0b 0.770 1.610 2.521 9.643 9.732 0.991 [OK] 9624 51 S TYR CD1 5 C3H1s 0.770 1.760 2.639 19.423 20.171 0.963 [OK] 9625 51 S TYR CD2 5 C3H1s 0.770 1.760 2.885 23.776 20.728 1.147 [OK] 9626 51 S TYR CE1 5 C3H1s 0.770 1.760 4.246 25.293 20.675 1.223 possible 9627 51 S TYR CE2 5 C3H1s 0.770 1.760 2.696 18.946 20.810 0.910 [OK] 9628 51 S TYR CZ 2 C3H0b 0.770 1.610 2.239 9.012 9.926 0.908 [OK] 9629 51 S TYR OH 17 O2H1u 0.660 1.460 6.047 54.282 19.173 2.831 possible 9630 52 S LEU N 12 N3H1s 0.700 1.640 3.290 16.689 13.655 1.222 possible 9631 52 S LEU CA 3 C4H1s 0.770 1.880 2.871 12.620 13.122 0.962 [OK] 9632 52 S LEU C 1 C3H0s 0.770 1.610 2.570 9.196 8.825 1.042 [OK] 9633 52 S LEU O 16 O1H0u 0.660 1.420 13.252 -1.000 16.208 -1.000 bad 9634 52 S LEU CB 8 C4H2s 0.770 1.880 6.617 41.348 22.951 1.802 possible 9635 52 S LEU CG 4 C4H1b 0.770 1.880 3.371 17.468 14.764 1.183 possible 9636 52 S LEU CD1 10 C4H3u 0.770 1.880 43.347 -1.000 37.425 -1.000 bad 9637 52 S LEU CD2 10 C4H3u 0.770 1.880 3.710 45.600 37.143 1.228 possible 9638 53 S GLY N 12 N3H1s 0.700 1.640 2.479 15.916 14.854 1.071 [OK] 9639 53 S GLY CA 8 C4H2s 0.770 1.880 4.450 33.509 23.688 1.415 possible 9640 53 S GLY C 2 C3H0b 0.770 1.610 4.350 13.124 9.840 1.334 possible 9641 53 S GLY O 16 O1H0u 0.660 1.420 2.707 15.440 16.391 0.942 [OK] 9642 54 S SER N 12 N3H1s 0.700 1.640 5.021 32.804 14.103 2.326 possible 9643 54 S SER CA 3 C4H1s 0.770 1.880 4.725 24.297 13.476 1.803 possible 9644 54 S SER C 1 C3H0s 0.770 1.610 3.547 9.362 8.923 1.049 possible 9645 54 S SER O 16 O1H0u 0.660 1.420 5.592 29.093 16.179 1.798 possible 9646 54 S SER CB 8 C4H2s 0.770 1.880 42.348 -1.000 23.884 -1.000 bad 9647 54 S SER OG 17 O2H1u 0.660 1.460 41.084 -1.000 18.732 -1.000 bad 9648 55 S LEU N 12 N3H1s 0.700 1.640 4.121 21.392 13.655 1.567 possible 9649 55 S LEU CA 3 C4H1s 0.770 1.880 3.191 13.533 13.122 1.031 possible 9650 55 S LEU C 1 C3H0s 0.770 1.610 2.685 9.102 8.825 1.031 [OK] 9651 55 S LEU O 16 O1H0u 0.660 1.420 2.618 17.410 16.208 1.074 [OK] 9652 55 S LEU CB 8 C4H2s 0.770 1.880 4.497 28.841 22.951 1.257 possible 9653 55 S LEU CG 4 C4H1b 0.770 1.880 2.985 14.810 14.764 1.003 [OK] 9654 55 S LEU CD1 10 C4H3u 0.770 1.880 32.035 -1.000 37.425 -1.000 bad 9655 55 S LEU CD2 10 C4H3u 0.770 1.880 7.614 54.127 37.143 1.457 possible 9656 56 S GLY N 12 N3H1s 0.700 1.640 2.522 14.223 14.854 0.958 [OK] 9657 56 S GLY CA 8 C4H2s 0.770 1.880 3.134 27.149 23.688 1.146 possible 9658 56 S GLY C 2 C3H0b 0.770 1.610 2.528 9.288 9.840 0.944 [OK] 9659 56 S GLY O 16 O1H0u 0.660 1.420 2.803 18.517 16.391 1.130 [OK] 9660 57 S VAL N 12 N3H1s 0.700 1.640 2.587 13.580 13.676 0.993 [OK] 9661 57 S VAL CA 3 C4H1s 0.770 1.880 3.601 15.995 13.123 1.219 possible 9662 57 S VAL C 1 C3H0s 0.770 1.610 2.877 8.396 8.563 0.981 [OK] 9663 57 S VAL O 16 O1H0u 0.660 1.420 4.111 18.960 16.181 1.172 possible 9664 57 S VAL CB 4 C4H1b 0.770 1.880 4.095 17.564 14.598 1.203 possible 9665 57 S VAL CG1 10 C4H3u 0.770 1.880 53.579 -1.000 36.584 -1.000 bad 9666 57 S VAL CG2 10 C4H3u 0.770 1.880 25.222 -1.000 36.332 -1.000 bad 9667 58 S LEU N 12 N3H1s 0.700 1.640 4.028 16.122 13.655 1.181 possible 9668 58 S LEU CA 3 C4H1s 0.770 1.880 4.709 20.020 13.122 1.526 possible 9669 58 S LEU C 1 C3H0s 0.770 1.610 2.610 8.217 8.825 0.931 [OK] 9670 58 S LEU O 16 O1H0u 0.660 1.420 2.544 14.964 16.208 0.923 [OK] 9671 58 S LEU CB 8 C4H2s 0.770 1.880 5.964 35.548 22.951 1.549 possible 9672 58 S LEU CG 4 C4H1b 0.770 1.880 2.949 15.108 14.764 1.023 [OK] 9673 58 S LEU CD1 10 C4H3u 0.770 1.880 37.419 -1.000 37.425 -1.000 bad 9674 58 S LEU CD2 10 C4H3u 0.770 1.880 35.186 -1.000 37.143 -1.000 bad 9675 59 S SER N 12 N3H1s 0.700 1.640 2.468 13.302 14.103 0.943 [OK] 9676 59 S SER CA 3 C4H1s 0.770 1.880 2.852 13.155 13.476 0.976 [OK] 9677 59 S SER C 1 C3H0s 0.770 1.610 2.135 7.830 8.923 0.877 [OK] 9678 59 S SER O 16 O1H0u 0.660 1.420 2.294 14.722 16.179 0.910 [OK] 9679 59 S SER CB 8 C4H2s 0.770 1.880 3.116 24.872 23.884 1.041 possible 9680 59 S SER OG 17 O2H1u 0.660 1.460 2.430 16.982 18.732 0.907 [OK] 9681 60 S LEU N 12 N3H1s 0.700 1.640 2.895 13.660 13.655 1.000 [OK] 9682 60 S LEU CA 3 C4H1s 0.770 1.880 2.776 13.208 13.122 1.007 [OK] 9683 60 S LEU C 1 C3H0s 0.770 1.610 3.039 8.827 8.825 1.000 possible 9684 60 S LEU O 16 O1H0u 0.660 1.420 2.385 15.900 16.208 0.981 [OK] 9685 60 S LEU CB 8 C4H2s 0.770 1.880 5.143 28.170 22.951 1.227 possible 9686 60 S LEU CG 4 C4H1b 0.770 1.880 5.449 25.814 14.764 1.748 possible 9687 60 S LEU CD1 10 C4H3u 0.770 1.880 28.128 -1.000 37.425 -1.000 bad 9688 60 S LEU CD2 10 C4H3u 0.770 1.880 24.920 -1.000 37.143 -1.000 bad 9689 61 S PHE N 12 N3H1s 0.700 1.640 4.521 15.808 13.691 1.155 possible 9690 61 S PHE CA 3 C4H1s 0.770 1.880 4.673 17.731 13.449 1.318 possible 9691 61 S PHE C 1 C3H0s 0.770 1.610 2.551 8.283 8.753 0.946 [OK] 9692 61 S PHE O 16 O1H0u 0.660 1.420 2.877 15.545 16.151 0.962 [OK] 9693 61 S PHE CB 8 C4H2s 0.770 1.880 5.060 36.763 23.777 1.546 possible 9694 61 S PHE CG 2 C3H0b 0.770 1.610 5.643 15.808 9.721 1.626 possible 9695 61 S PHE CD1 5 C3H1s 0.770 1.760 18.576 -1.000 20.405 -1.000 bad 9696 61 S PHE CD2 6 C3H1b 0.770 1.760 7.470 55.159 21.051 2.620 possible 9697 61 S PHE CE1 6 C3H1b 0.770 1.760 23.789 -1.000 21.580 -1.000 bad 9698 61 S PHE CE2 6 C3H1b 0.770 1.760 28.810 -1.000 21.680 -1.000 bad 9699 61 S PHE CZ 6 C3H1b 0.770 1.760 21.960 -1.000 21.666 -1.000 bad 9700 62 S SER N 12 N3H1s 0.700 1.640 2.757 13.825 14.103 0.980 [OK] 9701 62 S SER CA 3 C4H1s 0.770 1.880 3.582 17.789 13.476 1.320 possible 9702 62 S SER C 1 C3H0s 0.770 1.610 2.427 8.428 8.923 0.944 [OK] 9703 62 S SER O 16 O1H0u 0.660 1.420 2.549 14.456 16.179 0.893 [OK] 9704 62 S SER CB 8 C4H2s 0.770 1.880 3.021 21.186 23.884 0.887 possible 9705 62 S SER OG 17 O2H1u 0.660 1.460 3.867 27.377 18.732 1.462 possible 9706 63 S GLY N 12 N3H1s 0.700 1.640 2.423 12.676 14.854 0.853 [OK] 9707 63 S GLY CA 8 C4H2s 0.770 1.880 3.417 26.307 23.688 1.111 possible 9708 63 S GLY C 2 C3H0b 0.770 1.610 2.446 9.124 9.840 0.927 [OK] 9709 63 S GLY O 16 O1H0u 0.660 1.420 2.499 14.736 16.391 0.899 [OK] 9710 64 S LEU N 12 N3H1s 0.700 1.640 2.484 13.049 13.655 0.956 [OK] 9711 64 S LEU CA 3 C4H1s 0.770 1.880 2.781 13.635 13.122 1.039 [OK] 9712 64 S LEU C 1 C3H0s 0.770 1.610 3.500 9.443 8.825 1.070 possible 9713 64 S LEU O 16 O1H0u 0.660 1.420 4.445 24.767 16.208 1.528 possible 9714 64 S LEU CB 8 C4H2s 0.770 1.880 6.132 46.473 22.951 2.025 possible 9715 64 S LEU CG 4 C4H1b 0.770 1.880 2.838 13.997 14.764 0.948 [OK] 9716 64 S LEU CD1 10 C4H3u 0.770 1.880 40.401 -1.000 37.425 -1.000 bad 9717 64 S LEU CD2 10 C4H3u 0.770 1.880 40.017 -1.000 37.143 -1.000 bad 9718 65 S MET N 12 N3H1s 0.700 1.640 3.111 13.516 13.564 0.996 possible 9719 65 S MET CA 3 C4H1s 0.770 1.880 2.986 12.990 13.231 0.982 [OK] 9720 65 S MET C 1 C3H0s 0.770 1.610 2.131 8.320 8.782 0.947 [OK] 9721 65 S MET O 16 O1H0u 0.660 1.420 2.626 15.176 16.277 0.932 [OK] 9722 65 S MET CB 8 C4H2s 0.770 1.880 2.931 21.482 23.645 0.909 [OK] 9723 65 S MET CG 9 C4H2b 0.770 1.880 3.370 26.174 24.009 1.090 possible 9724 65 S MET SD 19 S2H0u 1.040 1.770 7.041 72.991 30.093 2.426 possible 9725 65 S MET CE 10 C4H3u 0.770 1.880 37.654 -1.000 37.161 -1.000 bad 9726 66 S TRP N 12 N3H1s 0.700 1.640 2.210 11.966 13.791 0.868 [OK] 9727 66 S TRP CA 3 C4H1s 0.770 1.880 2.796 14.826 13.377 1.108 [OK] 9728 66 S TRP C 1 C3H0s 0.770 1.610 2.479 8.343 8.724 0.956 [OK] 9729 66 S TRP O 16 O1H0u 0.660 1.420 2.248 15.266 15.951 0.957 [OK] 9730 66 S TRP CB 8 C4H2s 0.770 1.880 3.251 23.009 24.004 0.959 possible 9731 66 S TRP CG 2 C3H0b 0.770 1.610 2.750 9.584 9.965 0.962 [OK] 9732 66 S TRP CD1 5 C3H1s 0.770 1.760 2.514 17.785 20.874 0.852 [OK] 9733 66 S TRP CD2 2 C3H0b 0.770 1.610 2.858 11.155 10.097 1.105 [OK] 9734 66 S TRP NE1 13 N3H1b 0.700 1.640 2.572 16.248 16.969 0.958 [OK] 9735 66 S TRP CE2 2 C3H0b 0.770 1.610 2.457 9.075 9.889 0.918 [OK] 9736 66 S TRP CE3 6 C3H1b 0.770 1.760 3.329 27.444 20.448 1.342 possible 9737 66 S TRP CZ2 6 C3H1b 0.770 1.760 3.982 26.140 21.012 1.244 possible 9738 66 S TRP CZ3 6 C3H1b 0.770 1.760 3.527 24.906 21.516 1.158 possible 9739 66 S TRP CH2 6 C3H1b 0.770 1.760 3.888 27.934 21.339 1.309 possible 9740 67 S PHE N 12 N3H1s 0.700 1.640 2.674 13.642 13.691 0.996 [OK] 9741 67 S PHE CA 3 C4H1s 0.770 1.880 3.429 17.382 13.449 1.292 possible 9742 67 S PHE C 1 C3H0s 0.770 1.610 4.218 9.105 8.753 1.040 possible 9743 67 S PHE O 16 O1H0u 0.660 1.420 5.436 32.693 16.151 2.024 possible 9744 67 S PHE CB 8 C4H2s 0.770 1.880 11.637 -1.000 23.777 -1.000 bad 9745 67 S PHE CG 2 C3H0b 0.770 1.610 3.642 13.027 9.721 1.340 possible 9746 67 S PHE CD1 5 C3H1s 0.770 1.760 3.676 21.321 20.405 1.045 possible 9747 67 S PHE CD2 6 C3H1b 0.770 1.760 27.166 -1.000 21.051 -1.000 bad 9748 67 S PHE CE1 6 C3H1b 0.770 1.760 3.812 27.297 21.580 1.265 possible 9749 67 S PHE CE2 6 C3H1b 0.770 1.760 30.794 -1.000 21.680 -1.000 bad 9750 67 S PHE CZ 6 C3H1b 0.770 1.760 16.795 -1.000 21.666 -1.000 bad 9751 68 S PHE N 12 N3H1s 0.700 1.640 4.788 15.889 13.691 1.161 possible 9752 68 S PHE CA 3 C4H1s 0.770 1.880 6.533 29.667 13.449 2.206 possible 9753 68 S PHE C 1 C3H0s 0.770 1.610 2.350 8.267 8.753 0.945 [OK] 9754 68 S PHE O 16 O1H0u 0.660 1.420 3.558 18.902 16.151 1.170 possible 9755 68 S PHE CB 8 C4H2s 0.770 1.880 5.222 32.883 23.777 1.383 possible 9756 68 S PHE CG 2 C3H0b 0.770 1.610 3.797 12.181 9.721 1.253 possible 9757 68 S PHE CD1 5 C3H1s 0.770 1.760 23.760 -1.000 20.405 -1.000 bad 9758 68 S PHE CD2 6 C3H1b 0.770 1.760 4.057 29.737 21.051 1.413 possible 9759 68 S PHE CE1 6 C3H1b 0.770 1.760 31.414 -1.000 21.580 -1.000 bad 9760 68 S PHE CE2 6 C3H1b 0.770 1.760 23.832 -1.000 21.680 -1.000 bad 9761 68 S PHE CZ 6 C3H1b 0.770 1.760 25.173 -1.000 21.666 -1.000 bad 9762 69 S THR N 12 N3H1s 0.700 1.640 2.484 12.524 13.832 0.905 [OK] 9763 69 S THR CA 3 C4H1s 0.770 1.880 3.781 16.425 13.099 1.254 possible 9764 69 S THR C 1 C3H0s 0.770 1.610 2.334 8.270 8.738 0.946 [OK] 9765 69 S THR O 16 O1H0u 0.660 1.420 2.539 17.340 16.020 1.082 [OK] 9766 69 S THR CB 4 C4H1b 0.770 1.880 2.654 14.085 14.829 0.950 [OK] 9767 69 S THR OG1 17 O2H1u 0.660 1.460 4.278 29.295 18.123 1.616 possible 9768 69 S THR CG2 10 C4H3u 0.770 1.880 3.925 39.496 36.542 1.081 possible 9769 70 S ILE N 12 N3H1s 0.700 1.640 2.456 13.450 13.633 0.987 [OK] 9770 70 S ILE CA 3 C4H1s 0.770 1.880 2.865 14.002 13.007 1.076 [OK] 9771 70 S ILE C 1 C3H0s 0.770 1.610 2.695 7.976 8.470 0.942 [OK] 9772 70 S ILE O 16 O1H0u 0.660 1.420 2.486 14.955 16.144 0.926 [OK] 9773 70 S ILE CB 4 C4H1b 0.770 1.880 3.522 15.108 14.227 1.062 possible 9774 70 S ILE CG1 9 C4H2b 0.770 1.880 2.725 22.828 24.187 0.944 [OK] 9775 70 S ILE CG2 10 C4H3u 0.770 1.880 5.031 61.724 35.961 1.716 possible 9776 70 S ILE CD1 10 C4H3u 0.770 1.880 4.623 50.744 38.377 1.322 possible 9777 71 S GLY N 12 N3H1s 0.700 1.640 3.805 14.891 14.854 1.002 possible 9778 71 S GLY CA 8 C4H2s 0.770 1.880 5.543 57.512 23.688 2.428 possible 9779 71 S GLY C 2 C3H0b 0.770 1.610 4.025 11.688 9.840 1.188 possible 9780 71 S GLY O 16 O1H0u 0.660 1.420 2.455 14.486 16.391 0.884 [OK] 9781 72 S ILE N 12 N3H1s 0.700 1.640 3.912 16.318 13.633 1.197 possible 9782 72 S ILE CA 3 C4H1s 0.770 1.880 4.320 17.655 13.007 1.357 possible 9783 72 S ILE C 1 C3H0s 0.770 1.610 3.163 8.626 8.470 1.018 possible 9784 72 S ILE O 16 O1H0u 0.660 1.420 3.598 18.512 16.144 1.147 possible 9785 72 S ILE CB 4 C4H1b 0.770 1.880 4.171 17.989 14.227 1.264 possible 9786 72 S ILE CG1 9 C4H2b 0.770 1.880 4.913 39.682 24.187 1.641 possible 9787 72 S ILE CG2 10 C4H3u 0.770 1.880 4.742 53.965 35.961 1.501 possible 9788 72 S ILE CD1 10 C4H3u 0.770 1.880 49.962 -1.000 38.377 -1.000 bad 9789 73 S TRP N 12 N3H1s 0.700 1.640 3.163 13.624 13.791 0.988 possible 9790 73 S TRP CA 3 C4H1s 0.770 1.880 3.655 15.744 13.377 1.177 possible 9791 73 S TRP C 1 C3H0s 0.770 1.610 2.442 8.006 8.724 0.918 [OK] 9792 73 S TRP O 16 O1H0u 0.660 1.420 2.400 14.910 15.951 0.935 [OK] 9793 73 S TRP CB 8 C4H2s 0.770 1.880 3.030 25.419 24.004 1.059 possible 9794 73 S TRP CG 2 C3H0b 0.770 1.610 2.473 9.335 9.965 0.937 [OK] 9795 73 S TRP CD1 5 C3H1s 0.770 1.760 2.775 19.327 20.874 0.926 [OK] 9796 73 S TRP CD2 2 C3H0b 0.770 1.610 3.213 11.448 10.097 1.134 possible 9797 73 S TRP NE1 13 N3H1b 0.700 1.640 2.960 14.262 16.969 0.840 [OK] 9798 73 S TRP CE2 2 C3H0b 0.770 1.610 3.002 9.789 9.889 0.990 possible 9799 73 S TRP CE3 6 C3H1b 0.770 1.760 3.994 25.277 20.448 1.236 possible 9800 73 S TRP CZ2 6 C3H1b 0.770 1.760 5.497 40.208 21.012 1.914 possible 9801 73 S TRP CZ3 6 C3H1b 0.770 1.760 3.595 21.711 21.516 1.009 possible 9802 73 S TRP CH2 6 C3H1b 0.770 1.760 4.018 26.389 21.339 1.237 possible 9803 74 S PHE N 12 N3H1s 0.700 1.640 2.444 12.070 13.691 0.882 [OK] 9804 74 S PHE CA 3 C4H1s 0.770 1.880 2.763 14.440 13.449 1.074 [OK] 9805 74 S PHE C 1 C3H0s 0.770 1.610 2.318 8.297 8.753 0.948 [OK] 9806 74 S PHE O 16 O1H0u 0.660 1.420 2.248 15.495 16.151 0.959 [OK] 9807 74 S PHE CB 8 C4H2s 0.770 1.880 3.114 22.551 23.777 0.948 possible 9808 74 S PHE CG 2 C3H0b 0.770 1.610 2.616 10.044 9.721 1.033 [OK] 9809 74 S PHE CD1 5 C3H1s 0.770 1.760 2.736 17.508 20.405 0.858 [OK] 9810 74 S PHE CD2 6 C3H1b 0.770 1.760 4.509 27.546 21.051 1.309 possible 9811 74 S PHE CE1 6 C3H1b 0.770 1.760 2.774 20.242 21.580 0.938 [OK] 9812 74 S PHE CE2 6 C3H1b 0.770 1.760 5.034 36.313 21.680 1.675 possible 9813 74 S PHE CZ 6 C3H1b 0.770 1.760 4.064 22.252 21.666 1.027 possible 9814 75 S TRP N 12 N3H1s 0.700 1.640 2.272 12.883 13.791 0.934 [OK] 9815 75 S TRP CA 3 C4H1s 0.770 1.880 2.733 13.639 13.377 1.020 [OK] 9816 75 S TRP C 1 C3H0s 0.770 1.610 2.219 8.292 8.724 0.950 [OK] 9817 75 S TRP O 16 O1H0u 0.660 1.420 2.463 15.437 15.951 0.968 [OK] 9818 75 S TRP CB 8 C4H2s 0.770 1.880 3.448 22.574 24.004 0.940 possible 9819 75 S TRP CG 2 C3H0b 0.770 1.610 4.843 12.856 9.965 1.290 possible 9820 75 S TRP CD1 5 C3H1s 0.770 1.760 5.852 40.981 20.874 1.963 possible 9821 75 S TRP CD2 2 C3H0b 0.770 1.610 5.648 14.977 10.097 1.483 possible 9822 75 S TRP NE1 13 N3H1b 0.700 1.640 18.313 -1.000 16.969 -1.000 bad 9823 75 S TRP CE2 2 C3H0b 0.770 1.610 1.601 -1.000 9.889 -1.000 bad 9824 75 S TRP CE3 6 C3H1b 0.770 1.760 5.818 29.457 20.448 1.441 possible 9825 75 S TRP CZ2 6 C3H1b 0.770 1.760 24.139 -1.000 21.012 -1.000 bad 9826 75 S TRP CZ3 6 C3H1b 0.770 1.760 7.916 32.408 21.516 1.506 possible 9827 75 S TRP CH2 6 C3H1b 0.770 1.760 13.007 -1.000 21.339 -1.000 bad 9828 76 S TYR N 12 N3H1s 0.700 1.640 2.283 12.927 13.691 0.944 [OK] 9829 76 S TYR CA 3 C4H1s 0.770 1.880 2.827 14.248 13.330 1.069 [OK] 9830 76 S TYR C 1 C3H0s 0.770 1.610 2.343 7.816 8.770 0.891 [OK] 9831 76 S TYR O 16 O1H0u 0.660 1.420 5.301 33.265 16.124 2.063 possible 9832 76 S TYR CB 8 C4H2s 0.770 1.880 4.973 32.449 23.678 1.370 possible 9833 76 S TYR CG 2 C3H0b 0.770 1.610 4.765 14.809 9.732 1.522 possible 9834 76 S TYR CD1 5 C3H1s 0.770 1.760 6.492 44.607 20.171 2.211 possible 9835 76 S TYR CD2 5 C3H1s 0.770 1.760 3.772 23.973 20.728 1.157 possible 9836 76 S TYR CE1 5 C3H1s 0.770 1.760 30.591 -1.000 20.675 -1.000 bad 9837 76 S TYR CE2 5 C3H1s 0.770 1.760 5.282 42.264 20.810 2.031 possible 9838 76 S TYR CZ 2 C3H0b 0.770 1.610 4.640 15.806 9.926 1.592 possible 9839 76 S TYR OH 17 O2H1u 0.660 1.460 30.678 -1.000 19.173 -1.000 bad 9840 77 S GLN N 12 N3H1s 0.700 1.640 2.544 13.033 13.616 0.957 [OK] 9841 77 S GLN CA 3 C4H1s 0.770 1.880 4.023 20.559 13.334 1.542 possible 9842 77 S GLN C 1 C3H0s 0.770 1.610 2.385 8.322 8.787 0.947 [OK] 9843 77 S GLN O 16 O1H0u 0.660 1.420 3.966 22.456 15.993 1.404 possible 9844 77 S GLN CB 8 C4H2s 0.770 1.880 2.955 23.293 23.275 1.001 [OK] 9845 77 S GLN CG 8 C4H2s 0.770 1.880 4.884 35.571 23.465 1.516 possible 9846 77 S GLN CD 2 C3H0b 0.770 1.610 2.589 9.507 9.659 0.984 [OK] 9847 77 S GLN OE1 16 O1H0u 0.660 1.420 2.369 16.807 17.091 0.983 [OK] 9848 77 S GLN NE2 15 N3H2u 0.700 1.640 21.528 -1.000 24.150 -1.000 bad 9849 78 S ALA N 12 N3H1s 0.700 1.640 2.210 12.119 14.046 0.863 [OK] 9850 78 S ALA CA 4 C4H1b 0.770 1.880 2.711 13.619 14.063 0.968 [OK] 9851 78 S ALA C 1 C3H0s 0.770 1.610 2.931 10.140 8.900 1.139 [OK] 9852 78 S ALA O 16 O1H0u 0.660 1.420 3.612 21.038 16.188 1.300 possible 9853 78 S ALA CB 10 C4H3u 0.770 1.880 2.877 34.477 36.782 0.937 [OK] 9854 79 S GLY N 12 N3H1s 0.700 1.640 4.072 17.580 14.854 1.184 possible 9855 79 S GLY CA 8 C4H2s 0.770 1.880 32.392 -1.000 23.688 -1.000 bad 9856 79 S GLY C 2 C3H0b 0.770 1.610 3.037 9.198 9.840 0.935 possible 9857 79 S GLY O 16 O1H0u 0.660 1.420 20.890 -1.000 16.391 -1.000 bad 9858 80 S TRP N 12 N3H1s 0.700 1.640 2.716 13.324 13.791 0.966 [OK] 9859 80 S TRP CA 3 C4H1s 0.770 1.880 3.025 15.087 13.377 1.128 possible 9860 80 S TRP C 1 C3H0s 0.770 1.610 2.912 9.784 8.724 1.121 [OK] 9861 80 S TRP O 16 O1H0u 0.660 1.420 16.284 -1.000 15.951 -1.000 bad 9862 80 S TRP CB 8 C4H2s 0.770 1.880 22.448 -1.000 24.004 -1.000 bad 9863 80 S TRP CG 2 C3H0b 0.770 1.610 0.988 -1.000 9.965 -1.000 bad 9864 80 S TRP CD1 5 C3H1s 0.770 1.760 25.291 -1.000 20.874 -1.000 bad 9865 80 S TRP CD2 2 C3H0b 0.770 1.610 1.814 -1.000 10.097 -1.000 bad 9866 80 S TRP NE1 13 N3H1b 0.700 1.640 19.167 -1.000 16.969 -1.000 bad 9867 80 S TRP CE2 2 C3H0b 0.770 1.610 1.579 -1.000 9.889 -1.000 bad 9868 80 S TRP CE3 6 C3H1b 0.770 1.760 13.527 -1.000 20.448 -1.000 bad 9869 80 S TRP CZ2 6 C3H1b 0.770 1.760 20.669 -1.000 21.012 -1.000 bad 9870 80 S TRP CZ3 6 C3H1b 0.770 1.760 14.094 -1.000 21.516 -1.000 bad 9871 80 S TRP CH2 6 C3H1b 0.770 1.760 11.914 -1.000 21.339 -1.000 bad 9872 81 S ASN N 12 N3H1s 0.700 1.640 2.936 14.653 13.695 1.070 [OK] 9873 81 S ASN CA 3 C4H1s 0.770 1.880 5.188 16.956 13.167 1.288 possible 9874 81 S ASN C 1 C3H0s 0.770 1.610 2.361 8.528 8.928 0.955 [OK] 9875 81 S ASN O 16 O1H0u 0.660 1.420 2.399 15.038 16.199 0.928 [OK] 9876 81 S ASN CB 8 C4H2s 0.770 1.880 5.661 37.912 23.128 1.639 possible 9877 81 S ASN CG 2 C3H0b 0.770 1.610 4.166 11.800 9.599 1.229 possible 9878 81 S ASN OD1 16 O1H0u 0.660 1.420 7.819 30.809 16.664 1.849 possible 9879 81 S ASN ND2 15 N3H2u 0.700 1.640 32.063 -1.000 23.083 -1.000 bad 9880 82 S PRO N 11 N3H0u 0.700 1.640 2.292 8.088 8.823 0.917 [OK] 9881 82 S PRO CA 4 C4H1b 0.770 1.880 3.150 13.230 13.955 0.948 possible 9882 82 S PRO C 1 C3H0s 0.770 1.610 3.428 9.450 8.812 1.072 possible 9883 82 S PRO O 16 O1H0u 0.660 1.420 3.085 17.866 16.169 1.105 possible 9884 82 S PRO CB 9 C4H2b 0.770 1.880 27.868 -1.000 25.563 -1.000 bad 9885 82 S PRO CG 9 C4H2b 0.770 1.880 31.803 -1.000 25.832 -1.000 bad 9886 82 S PRO CD 8 C4H2s 0.770 1.880 19.850 -1.000 23.836 -1.000 bad 9887 83 S ALA N 12 N3H1s 0.700 1.640 4.853 20.784 14.046 1.480 possible 9888 83 S ALA CA 4 C4H1b 0.770 1.880 4.895 19.836 14.063 1.411 possible 9889 83 S ALA C 1 C3H0s 0.770 1.610 2.854 8.928 8.900 1.003 [OK] 9890 83 S ALA O 16 O1H0u 0.660 1.420 2.600 16.663 16.188 1.029 [OK] 9891 83 S ALA CB 10 C4H3u 0.770 1.880 20.321 -1.000 36.782 -1.000 bad 9892 84 S VAL N 12 N3H1s 0.700 1.640 2.873 13.260 13.676 0.970 [OK] 9893 84 S VAL CA 3 C4H1s 0.770 1.880 2.868 13.878 13.123 1.057 [OK] 9894 84 S VAL C 1 C3H0s 0.770 1.610 2.340 8.274 8.563 0.966 [OK] 9895 84 S VAL O 16 O1H0u 0.660 1.420 2.443 15.799 16.181 0.976 [OK] 9896 84 S VAL CB 4 C4H1b 0.770 1.880 2.536 13.710 14.598 0.939 [OK] 9897 84 S VAL CG1 10 C4H3u 0.770 1.880 2.987 34.589 36.584 0.945 [OK] 9898 84 S VAL CG2 10 C4H3u 0.770 1.880 3.377 36.545 36.332 1.006 possible 9899 85 S PHE N 12 N3H1s 0.700 1.640 2.312 12.686 13.691 0.927 [OK] 9900 85 S PHE CA 3 C4H1s 0.770 1.880 2.559 12.854 13.449 0.956 [OK] 9901 85 S PHE C 1 C3H0s 0.770 1.610 2.195 7.738 8.753 0.884 [OK] 9902 85 S PHE O 16 O1H0u 0.660 1.420 2.543 15.959 16.151 0.988 [OK] 9903 85 S PHE CB 8 C4H2s 0.770 1.880 2.939 22.532 23.777 0.948 [OK] 9904 85 S PHE CG 2 C3H0b 0.770 1.610 2.584 9.704 9.721 0.998 [OK] 9905 85 S PHE CD1 5 C3H1s 0.770 1.760 2.861 21.239 20.405 1.041 [OK] 9906 85 S PHE CD2 6 C3H1b 0.770 1.760 3.687 23.535 21.051 1.118 possible 9907 85 S PHE CE1 6 C3H1b 0.770 1.760 3.048 21.611 21.580 1.001 possible 9908 85 S PHE CE2 6 C3H1b 0.770 1.760 15.455 -1.000 21.680 -1.000 bad 9909 85 S PHE CZ 6 C3H1b 0.770 1.760 14.086 -1.000 21.666 -1.000 bad 9910 86 S LEU N 12 N3H1s 0.700 1.640 2.430 13.088 13.655 0.958 [OK] 9911 86 S LEU CA 3 C4H1s 0.770 1.880 3.102 14.003 13.122 1.067 possible 9912 86 S LEU C 1 C3H0s 0.770 1.610 2.419 8.777 8.825 0.995 [OK] 9913 86 S LEU O 16 O1H0u 0.660 1.420 3.272 22.415 16.208 1.383 possible 9914 86 S LEU CB 8 C4H2s 0.770 1.880 3.845 26.076 22.951 1.136 possible 9915 86 S LEU CG 4 C4H1b 0.770 1.880 3.970 16.287 14.764 1.103 possible 9916 86 S LEU CD1 10 C4H3u 0.770 1.880 46.960 -1.000 37.425 -1.000 bad 9917 86 S LEU CD2 10 C4H3u 0.770 1.880 37.619 -1.000 37.143 -1.000 bad 9918 87 S ARG N 12 N3H1s 0.700 1.640 2.372 14.412 13.650 1.056 [OK] 9919 87 S ARG CA 3 C4H1s 0.770 1.880 2.676 12.886 13.422 0.960 [OK] 9920 87 S ARG C 1 C3H0s 0.770 1.610 2.355 8.302 8.838 0.939 [OK] 9921 87 S ARG O 16 O1H0u 0.660 1.420 2.453 17.353 16.084 1.079 [OK] 9922 87 S ARG CB 8 C4H2s 0.770 1.880 2.812 22.006 23.088 0.953 [OK] 9923 87 S ARG CG 8 C4H2s 0.770 1.880 2.815 22.178 23.640 0.938 [OK] 9924 87 S ARG CD 8 C4H2s 0.770 1.880 2.940 25.175 23.300 1.080 [OK] 9925 87 S ARG NE 13 N3H1b 0.700 1.640 2.715 16.176 15.569 1.039 [OK] 9926 87 S ARG CZ 2 C3H0b 0.770 1.610 3.015 11.740 9.747 1.204 possible 9927 87 S ARG NH1 15 N3H2u 0.700 1.640 2.938 24.638 22.782 1.081 [OK] 9928 87 S ARG NH2 15 N3H2u 0.700 1.640 2.967 24.227 23.810 1.018 [OK] 9929 88 S ASP N 12 N3H1s 0.700 1.640 2.397 12.697 13.895 0.914 [OK] 9930 88 S ASP CA 3 C4H1s 0.770 1.880 2.569 12.309 13.377 0.920 [OK] 9931 88 S ASP C 1 C3H0s 0.770 1.610 2.383 8.795 8.816 0.998 [OK] 9932 88 S ASP O 16 O1H0u 0.660 1.420 2.192 13.066 16.091 0.812 [OK] 9933 88 S ASP CB 8 C4H2s 0.770 1.880 2.657 21.370 23.481 0.910 [OK] 9934 88 S ASP CG 2 C3H0b 0.770 1.610 2.449 9.355 9.422 0.993 [OK] 9935 88 S ASP OD1 16 O1H0u 0.660 1.420 2.455 16.575 15.505 1.069 [OK] 9936 88 S ASP OD2 16 O1H0u 0.660 1.420 2.362 18.070 16.324 1.107 [OK] 9937 89 S LEU N 12 N3H1s 0.700 1.640 2.383 12.813 13.655 0.938 [OK] 9938 89 S LEU CA 3 C4H1s 0.770 1.880 2.908 12.706 13.122 0.968 [OK] 9939 89 S LEU C 1 C3H0s 0.770 1.610 2.465 8.112 8.825 0.919 [OK] 9940 89 S LEU O 16 O1H0u 0.660 1.420 2.866 17.809 16.208 1.099 [OK] 9941 89 S LEU CB 8 C4H2s 0.770 1.880 3.778 23.717 22.951 1.033 possible 9942 89 S LEU CG 4 C4H1b 0.770 1.880 2.913 17.177 14.764 1.163 [OK] 9943 89 S LEU CD1 10 C4H3u 0.770 1.880 37.771 -1.000 37.425 -1.000 bad 9944 89 S LEU CD2 10 C4H3u 0.770 1.880 17.925 -1.000 37.143 -1.000 bad 9945 90 S PHE N 12 N3H1s 0.700 1.640 2.444 11.612 13.691 0.848 [OK] 9946 90 S PHE CA 3 C4H1s 0.770 1.880 2.683 12.529 13.449 0.932 [OK] 9947 90 S PHE C 1 C3H0s 0.770 1.610 2.389 9.292 8.753 1.062 [OK] 9948 90 S PHE O 16 O1H0u 0.660 1.420 2.427 15.208 16.151 0.942 [OK] 9949 90 S PHE CB 8 C4H2s 0.770 1.880 3.378 23.782 23.777 1.000 possible 9950 90 S PHE CG 2 C3H0b 0.770 1.610 3.277 10.884 9.721 1.120 possible 9951 90 S PHE CD1 5 C3H1s 0.770 1.760 3.482 20.652 20.405 1.012 possible 9952 90 S PHE CD2 6 C3H1b 0.770 1.760 3.684 29.592 21.051 1.406 possible 9953 90 S PHE CE1 6 C3H1b 0.770 1.760 12.175 -1.000 21.580 -1.000 bad 9954 90 S PHE CE2 6 C3H1b 0.770 1.760 7.119 67.460 21.680 3.112 possible 9955 90 S PHE CZ 6 C3H1b 0.770 1.760 34.425 -1.000 21.666 -1.000 bad 9956 91 S PHE N 12 N3H1s 0.700 1.640 2.354 11.723 13.691 0.856 [OK] 9957 91 S PHE CA 3 C4H1s 0.770 1.880 3.642 16.551 13.449 1.231 possible 9958 91 S PHE C 1 C3H0s 0.770 1.610 2.320 8.919 8.753 1.019 [OK] 9959 91 S PHE O 16 O1H0u 0.660 1.420 6.352 52.003 16.151 3.220 possible 9960 91 S PHE CB 8 C4H2s 0.770 1.880 3.590 23.372 23.777 0.983 possible 9961 91 S PHE CG 2 C3H0b 0.770 1.610 2.526 10.152 9.721 1.044 [OK] 9962 91 S PHE CD1 5 C3H1s 0.770 1.760 2.761 18.680 20.405 0.915 [OK] 9963 91 S PHE CD2 6 C3H1b 0.770 1.760 5.300 37.584 21.051 1.785 possible 9964 91 S PHE CE1 6 C3H1b 0.770 1.760 3.590 26.549 21.580 1.230 possible 9965 91 S PHE CE2 6 C3H1b 0.770 1.760 5.337 32.570 21.680 1.502 possible 9966 91 S PHE CZ 6 C3H1b 0.770 1.760 2.984 23.321 21.666 1.076 [OK] 9967 92 S PHE N 12 N3H1s 0.700 1.640 2.442 14.278 13.691 1.043 [OK] 9968 92 S PHE CA 3 C4H1s 0.770 1.880 3.043 14.189 13.449 1.055 possible 9969 92 S PHE C 1 C3H0s 0.770 1.610 2.508 8.781 8.753 1.003 [OK] 9970 92 S PHE O 16 O1H0u 0.660 1.420 2.276 15.414 16.151 0.954 [OK] 9971 92 S PHE CB 8 C4H2s 0.770 1.880 2.634 20.334 23.777 0.855 [OK] 9972 92 S PHE CG 2 C3H0b 0.770 1.610 2.517 9.778 9.721 1.006 [OK] 9973 92 S PHE CD1 5 C3H1s 0.770 1.760 2.648 19.083 20.405 0.935 [OK] 9974 92 S PHE CD2 6 C3H1b 0.770 1.760 2.844 19.129 21.051 0.909 [OK] 9975 92 S PHE CE1 6 C3H1b 0.770 1.760 2.937 22.044 21.580 1.022 [OK] 9976 92 S PHE CE2 6 C3H1b 0.770 1.760 2.848 19.981 21.680 0.922 [OK] 9977 92 S PHE CZ 6 C3H1b 0.770 1.760 2.729 19.591 21.666 0.904 [OK] 9978 93 S SER N 12 N3H1s 0.700 1.640 3.360 16.706 14.103 1.185 possible 9979 93 S SER CA 3 C4H1s 0.770 1.880 2.524 12.931 13.476 0.960 [OK] 9980 93 S SER C 1 C3H0s 0.770 1.610 2.411 9.092 8.923 1.019 [OK] 9981 93 S SER O 16 O1H0u 0.660 1.420 3.863 22.685 16.179 1.402 possible 9982 93 S SER CB 8 C4H2s 0.770 1.880 6.004 51.346 23.884 2.150 possible 9983 93 S SER OG 17 O2H1u 0.660 1.460 2.965 18.992 18.732 1.014 [OK] 9984 94 S LEU N 12 N3H1s 0.700 1.640 2.527 13.995 13.655 1.025 [OK] 9985 94 S LEU CA 3 C4H1s 0.770 1.880 2.426 11.615 13.122 0.885 [OK] 9986 94 S LEU C 1 C3H0s 0.770 1.610 2.464 9.159 8.825 1.038 [OK] 9987 94 S LEU O 16 O1H0u 0.660 1.420 2.383 15.191 16.208 0.937 [OK] 9988 94 S LEU CB 8 C4H2s 0.770 1.880 2.863 22.780 22.951 0.993 [OK] 9989 94 S LEU CG 4 C4H1b 0.770 1.880 2.972 15.330 14.764 1.038 [OK] 9990 94 S LEU CD1 10 C4H3u 0.770 1.880 3.074 35.892 37.425 0.959 possible 9991 94 S LEU CD2 10 C4H3u 0.770 1.880 3.228 32.444 37.143 0.873 possible 9992 95 S GLU N 12 N3H1s 0.700 1.640 2.422 13.476 13.615 0.990 [OK] 9993 95 S GLU CA 3 C4H1s 0.770 1.880 2.599 11.618 13.399 0.867 [OK] 9994 95 S GLU C 1 C3H0s 0.770 1.610 2.269 8.632 8.675 0.995 [OK] 9995 95 S GLU O 16 O1H0u 0.660 1.420 2.779 17.291 16.023 1.079 [OK] 9996 95 S GLU CB 8 C4H2s 0.770 1.880 4.938 31.495 23.529 1.339 possible 9997 95 S GLU CG 8 C4H2s 0.770 1.880 20.268 -1.000 23.513 -1.000 bad 9998 95 S GLU CD 2 C3H0b 0.770 1.610 4.839 12.218 9.460 1.292 possible 9999 95 S GLU OE1 16 O1H0u 0.660 1.420 5.881 33.202 15.999 2.075 possible 10000 95 S GLU OE2 16 O1H0u 0.660 1.420 16.554 -1.000 17.432 -1.000 bad 10001 96 S PRO N 11 N3H0u 0.700 1.640 2.554 8.033 8.823 0.910 [OK] 10002 96 S PRO CA 4 C4H1b 0.770 1.880 2.511 11.775 13.955 0.844 [OK] 10003 96 S PRO C 1 C3H0s 0.770 1.610 2.318 8.961 8.812 1.017 [OK] 10004 96 S PRO O 16 O1H0u 0.660 1.420 2.417 14.945 16.169 0.924 [OK] 10005 96 S PRO CB 9 C4H2b 0.770 1.880 2.703 23.406 25.563 0.916 [OK] 10006 96 S PRO CG 9 C4H2b 0.770 1.880 3.503 33.255 25.832 1.287 possible 10007 96 S PRO CD 8 C4H2s 0.770 1.880 3.201 24.581 23.836 1.031 possible 10008 97 S PRO N 11 N3H0u 0.700 1.640 2.503 8.476 8.823 0.961 [OK] 10009 97 S PRO CA 4 C4H1b 0.770 1.880 2.744 13.760 13.955 0.986 [OK] 10010 97 S PRO C 1 C3H0s 0.770 1.610 2.281 8.542 8.812 0.969 [OK] 10011 97 S PRO O 16 O1H0u 0.660 1.420 2.278 14.664 16.169 0.907 [OK] 10012 97 S PRO CB 9 C4H2b 0.770 1.880 3.223 27.946 25.563 1.093 possible 10013 97 S PRO CG 9 C4H2b 0.770 1.880 3.135 26.129 25.832 1.011 possible 10014 97 S PRO CD 8 C4H2s 0.770 1.880 2.710 22.620 23.836 0.949 [OK] 10015 98 S ALA N 12 N3H1s 0.700 1.640 3.060 18.993 14.046 1.352 possible 10016 98 S ALA CA 4 C4H1b 0.770 1.880 3.750 16.062 14.063 1.142 possible 10017 98 S ALA C 1 C3H0s 0.770 1.610 2.352 8.704 8.900 0.978 [OK] 10018 98 S ALA O 16 O1H0u 0.660 1.420 2.372 15.127 16.188 0.934 [OK] 10019 98 S ALA CB 10 C4H3u 0.770 1.880 28.913 -1.000 36.782 -1.000 bad 10020 99 S PRO N 11 N3H0u 0.700 1.640 2.296 8.125 8.823 0.921 [OK] 10021 99 S PRO CA 4 C4H1b 0.770 1.880 2.876 13.791 13.955 0.988 [OK] 10022 99 S PRO C 1 C3H0s 0.770 1.610 4.841 10.134 8.812 1.150 possible 10023 99 S PRO O 16 O1H0u 0.660 1.420 9.882 -1.000 16.169 -1.000 bad 10024 99 S PRO CB 9 C4H2b 0.770 1.880 25.732 -1.000 25.563 -1.000 bad 10025 99 S PRO CG 9 C4H2b 0.770 1.880 25.608 -1.000 25.832 -1.000 bad 10026 99 S PRO CD 8 C4H2s 0.770 1.880 13.841 -1.000 23.836 -1.000 bad 10027 100 S GLU N 12 N3H1s 0.700 1.640 4.235 14.561 13.615 1.069 possible 10028 100 S GLU CA 3 C4H1s 0.770 1.880 11.502 -1.000 13.399 -1.000 bad 10029 100 S GLU C 1 C3H0s 0.770 1.610 3.064 9.152 8.675 1.055 possible 10030 100 S GLU O 16 O1H0u 0.660 1.420 30.030 -1.000 16.023 -1.000 bad 10031 100 S GLU CB 8 C4H2s 0.770 1.880 17.608 -1.000 23.529 -1.000 bad 10032 100 S GLU CG 8 C4H2s 0.770 1.880 39.429 -1.000 23.513 -1.000 bad 10033 100 S GLU CD 2 C3H0b 0.770 1.610 3.400 -1.000 9.460 -1.000 bad 10034 100 S GLU OE1 16 O1H0u 0.660 1.420 17.666 -1.000 15.999 -1.000 bad 10035 100 S GLU OE2 16 O1H0u 0.660 1.420 33.097 -1.000 17.432 -1.000 bad 10036 101 S TYR N 12 N3H1s 0.700 1.640 2.682 13.504 13.691 0.986 [OK] 10037 101 S TYR CA 3 C4H1s 0.770 1.880 4.020 15.824 13.330 1.187 possible 10038 101 S TYR C 1 C3H0s 0.770 1.610 3.476 10.685 8.770 1.218 possible 10039 101 S TYR O 16 O1H0u 0.660 1.420 4.761 23.573 16.124 1.462 possible 10040 101 S TYR CB 8 C4H2s 0.770 1.880 3.220 28.183 23.678 1.190 possible 10041 101 S TYR CG 2 C3H0b 0.770 1.610 2.902 10.357 9.732 1.064 [OK] 10042 101 S TYR CD1 5 C3H1s 0.770 1.760 6.783 37.638 20.171 1.866 possible 10043 101 S TYR CD2 5 C3H1s 0.770 1.760 3.041 23.236 20.728 1.121 possible 10044 101 S TYR CE1 5 C3H1s 0.770 1.760 19.214 -1.000 20.675 -1.000 bad 10045 101 S TYR CE2 5 C3H1s 0.770 1.760 4.818 37.632 20.810 1.808 possible 10046 101 S TYR CZ 2 C3H0b 0.770 1.610 4.446 13.516 9.926 1.362 possible 10047 101 S TYR OH 17 O2H1u 0.660 1.460 22.530 -1.000 19.173 -1.000 bad 10048 102 S GLY N 12 N3H1s 0.700 1.640 3.946 18.257 14.854 1.229 possible 10049 102 S GLY CA 8 C4H2s 0.770 1.880 7.168 42.021 23.688 1.774 possible 10050 102 S GLY C 2 C3H0b 0.770 1.610 2.174 8.590 9.840 0.873 [OK] 10051 102 S GLY O 16 O1H0u 0.660 1.420 2.748 16.885 16.391 1.030 [OK] 10052 103 S LEU N 12 N3H1s 0.700 1.640 2.847 13.548 13.655 0.992 [OK] 10053 103 S LEU CA 3 C4H1s 0.770 1.880 2.462 11.590 13.122 0.883 [OK] 10054 103 S LEU C 1 C3H0s 0.770 1.610 3.963 11.099 8.825 1.258 possible 10055 103 S LEU O 16 O1H0u 0.660 1.420 8.810 -1.000 16.208 -1.000 bad 10056 103 S LEU CB 8 C4H2s 0.770 1.880 11.675 -1.000 22.951 -1.000 bad 10057 103 S LEU CG 4 C4H1b 0.770 1.880 3.438 13.800 14.764 0.935 possible 10058 103 S LEU CD1 10 C4H3u 0.770 1.880 26.210 -1.000 37.425 -1.000 bad 10059 103 S LEU CD2 10 C4H3u 0.770 1.880 3.141 32.150 37.143 0.866 possible 10060 104 S SER N 12 N3H1s 0.700 1.640 3.802 15.797 14.103 1.120 possible 10061 104 S SER CA 3 C4H1s 0.770 1.880 5.360 19.350 13.476 1.436 possible 10062 104 S SER C 1 C3H0s 0.770 1.610 2.401 8.695 8.923 0.974 [OK] 10063 104 S SER O 16 O1H0u 0.660 1.420 2.704 23.132 16.179 1.430 [OK] 10064 104 S SER CB 8 C4H2s 0.770 1.880 22.120 -1.000 23.884 -1.000 bad 10065 104 S SER OG 17 O2H1u 0.660 1.460 5.534 -1.000 18.732 -1.000 bad 10066 105 S PHE N 12 N3H1s 0.700 1.640 2.867 13.333 13.691 0.974 [OK] 10067 105 S PHE CA 3 C4H1s 0.770 1.880 2.561 12.135 13.449 0.902 [OK] 10068 105 S PHE C 1 C3H0s 0.770 1.610 4.667 11.860 8.753 1.355 possible 10069 105 S PHE O 16 O1H0u 0.660 1.420 18.491 -1.000 16.151 -1.000 bad 10070 105 S PHE CB 8 C4H2s 0.770 1.880 23.139 -1.000 23.777 -1.000 bad 10071 105 S PHE CG 2 C3H0b 0.770 1.610 7.452 20.153 9.721 2.073 possible 10072 105 S PHE CD1 5 C3H1s 0.770 1.760 4.927 28.879 20.405 1.415 possible 10073 105 S PHE CD2 6 C3H1b 0.770 1.760 21.862 -1.000 21.051 -1.000 bad 10074 105 S PHE CE1 6 C3H1b 0.770 1.760 4.539 40.439 21.580 1.874 possible 10075 105 S PHE CE2 6 C3H1b 0.770 1.760 34.836 -1.000 21.680 -1.000 bad 10076 105 S PHE CZ 6 C3H1b 0.770 1.760 28.751 -1.000 21.666 -1.000 bad 10077 106 S ALA N 12 N3H1s 0.700 1.640 4.071 16.645 14.046 1.185 possible 10078 106 S ALA CA 4 C4H1b 0.770 1.880 12.430 -1.000 14.063 -1.000 bad 10079 106 S ALA C 1 C3H0s 0.770 1.610 4.363 11.667 8.900 1.311 possible 10080 106 S ALA O 16 O1H0u 0.660 1.420 15.082 -1.000 16.188 -1.000 bad 10081 106 S ALA CB 10 C4H3u 0.770 1.880 46.636 -1.000 36.782 -1.000 bad 10082 107 S ALA N 12 N3H1s 0.700 1.640 2.856 17.082 14.046 1.216 [OK] 10083 107 S ALA CA 4 C4H1b 0.770 1.880 2.578 12.562 14.063 0.893 [OK] 10084 107 S ALA C 1 C3H0s 0.770 1.610 2.906 8.778 8.900 0.986 [OK] 10085 107 S ALA O 16 O1H0u 0.660 1.420 6.823 41.285 16.188 2.550 possible 10086 107 S ALA CB 10 C4H3u 0.770 1.880 3.137 39.164 36.782 1.065 possible 10087 108 S PRO N 11 N3H0u 0.700 1.640 3.346 9.859 8.823 1.117 possible 10088 108 S PRO CA 4 C4H1b 0.770 1.880 11.649 -1.000 13.955 -1.000 bad 10089 108 S PRO C 1 C3H0s 0.770 1.610 2.357 8.568 8.812 0.972 [OK] 10090 108 S PRO O 16 O1H0u 0.660 1.420 2.299 13.668 16.169 0.845 [OK] 10091 108 S PRO CB 9 C4H2b 0.770 1.880 11.393 -1.000 25.563 -1.000 bad 10092 108 S PRO CG 9 C4H2b 0.770 1.880 28.968 -1.000 25.832 -1.000 bad 10093 108 S PRO CD 8 C4H2s 0.770 1.880 3.496 24.622 23.836 1.033 possible 10094 109 S LEU N 12 N3H1s 0.700 1.640 5.498 24.315 13.655 1.781 possible 10095 109 S LEU CA 3 C4H1s 0.770 1.880 2.511 11.882 13.122 0.906 [OK] 10096 109 S LEU C 1 C3H0s 0.770 1.610 2.730 8.515 8.825 0.965 [OK] 10097 109 S LEU O 16 O1H0u 0.660 1.420 2.906 17.401 16.208 1.074 [OK] 10098 109 S LEU CB 8 C4H2s 0.770 1.880 4.391 32.008 22.951 1.395 possible 10099 109 S LEU CG 4 C4H1b 0.770 1.880 11.952 -1.000 14.764 -1.000 bad 10100 109 S LEU CD1 10 C4H3u 0.770 1.880 56.362 -1.000 37.425 -1.000 bad 10101 109 S LEU CD2 10 C4H3u 0.770 1.880 16.998 -1.000 37.143 -1.000 bad 10102 110 S LYS N 12 N3H1s 0.700 1.640 2.786 13.509 13.675 0.988 [OK] 10103 110 S LYS CA 3 C4H1s 0.770 1.880 3.208 14.019 13.324 1.052 possible 10104 110 S LYS C 1 C3H0s 0.770 1.610 2.742 9.788 8.759 1.117 [OK] 10105 110 S LYS O 16 O1H0u 0.660 1.420 4.534 35.856 16.049 2.234 possible 10106 110 S LYS CB 8 C4H2s 0.770 1.880 3.924 27.790 22.904 1.213 possible 10107 110 S LYS CG 8 C4H2s 0.770 1.880 5.762 38.246 23.131 1.653 possible 10108 110 S LYS CD 8 C4H2s 0.770 1.880 5.487 35.629 23.837 1.495 possible 10109 110 S LYS CE 9 C4H2b 0.770 1.880 7.738 82.157 23.934 3.433 possible 10110 110 S LYS NZ 14 N4H3u 0.700 1.640 40.991 -1.000 21.213 -1.000 bad 10111 111 S GLU N 12 N3H1s 0.700 1.640 2.811 12.900 13.615 0.948 [OK] 10112 111 S GLU CA 3 C4H1s 0.770 1.880 3.890 16.642 13.399 1.242 possible 10113 111 S GLU C 1 C3H0s 0.770 1.610 2.494 9.350 8.675 1.078 [OK] 10114 111 S GLU O 16 O1H0u 0.660 1.420 2.863 20.381 16.023 1.272 [OK] 10115 111 S GLU CB 8 C4H2s 0.770 1.880 3.898 27.887 23.529 1.185 possible 10116 111 S GLU CG 8 C4H2s 0.770 1.880 7.011 56.854 23.513 2.418 possible 10117 111 S GLU CD 2 C3H0b 0.770 1.610 5.138 13.582 9.460 1.436 possible 10118 111 S GLU OE1 16 O1H0u 0.660 1.420 24.379 -1.000 15.999 -1.000 bad 10119 111 S GLU OE2 16 O1H0u 0.660 1.420 23.432 -1.000 17.432 -1.000 bad 10120 112 S GLY N 12 N3H1s 0.700 1.640 3.102 16.191 14.854 1.090 possible 10121 112 S GLY CA 8 C4H2s 0.770 1.880 2.593 20.512 23.688 0.866 [OK] 10122 112 S GLY C 2 C3H0b 0.770 1.610 2.382 9.447 9.840 0.960 [OK] 10123 112 S GLY O 16 O1H0u 0.660 1.420 2.222 14.323 16.391 0.874 [OK] 10124 113 S GLY N 12 N3H1s 0.700 1.640 2.397 13.987 14.854 0.942 [OK] 10125 113 S GLY CA 8 C4H2s 0.770 1.880 4.416 31.317 23.688 1.322 possible 10126 113 S GLY C 2 C3H0b 0.770 1.610 2.581 9.065 9.840 0.921 [OK] 10127 113 S GLY O 16 O1H0u 0.660 1.420 3.960 17.948 16.391 1.095 possible 10128 114 S LEU N 12 N3H1s 0.700 1.640 2.357 13.384 13.655 0.980 [OK] 10129 114 S LEU CA 3 C4H1s 0.770 1.880 2.762 13.030 13.122 0.993 [OK] 10130 114 S LEU C 1 C3H0s 0.770 1.610 2.424 8.421 8.825 0.954 [OK] 10131 114 S LEU O 16 O1H0u 0.660 1.420 2.374 14.589 16.208 0.900 [OK] 10132 114 S LEU CB 8 C4H2s 0.770 1.880 3.168 21.301 22.951 0.928 possible 10133 114 S LEU CG 4 C4H1b 0.770 1.880 3.089 18.961 14.764 1.284 possible 10134 114 S LEU CD1 10 C4H3u 0.770 1.880 5.691 65.914 37.425 1.761 possible 10135 114 S LEU CD2 10 C4H3u 0.770 1.880 5.721 62.785 37.143 1.690 possible 10136 115 S TRP N 12 N3H1s 0.700 1.640 2.113 12.347 13.791 0.895 [OK] 10137 115 S TRP CA 3 C4H1s 0.770 1.880 2.715 13.626 13.377 1.019 [OK] 10138 115 S TRP C 1 C3H0s 0.770 1.610 1.982 7.670 8.724 0.879 [OK] 10139 115 S TRP O 16 O1H0u 0.660 1.420 2.308 15.076 15.951 0.945 [OK] 10140 115 S TRP CB 8 C4H2s 0.770 1.880 2.640 20.732 24.004 0.864 [OK] 10141 115 S TRP CG 2 C3H0b 0.770 1.610 2.310 8.686 9.965 0.872 [OK] 10142 115 S TRP CD1 5 C3H1s 0.770 1.760 2.488 18.376 20.874 0.880 [OK] 10143 115 S TRP CD2 2 C3H0b 0.770 1.610 2.349 9.050 10.097 0.896 [OK] 10144 115 S TRP NE1 13 N3H1b 0.700 1.640 2.691 15.882 16.969 0.936 [OK] 10145 115 S TRP CE2 2 C3H0b 0.770 1.610 2.488 9.372 9.889 0.948 [OK] 10146 115 S TRP CE3 6 C3H1b 0.770 1.760 2.563 18.152 20.448 0.888 [OK] 10147 115 S TRP CZ2 6 C3H1b 0.770 1.760 2.743 18.770 21.012 0.893 [OK] 10148 115 S TRP CZ3 6 C3H1b 0.770 1.760 3.530 24.424 21.516 1.135 possible 10149 115 S TRP CH2 6 C3H1b 0.770 1.760 3.281 21.466 21.339 1.006 possible 10150 116 S LEU N 12 N3H1s 0.700 1.640 2.340 12.091 13.655 0.885 [OK] 10151 116 S LEU CA 3 C4H1s 0.770 1.880 3.005 13.660 13.122 1.041 possible 10152 116 S LEU C 1 C3H0s 0.770 1.610 3.848 9.384 8.825 1.063 possible 10153 116 S LEU O 16 O1H0u 0.660 1.420 4.437 29.536 16.208 1.822 possible 10154 116 S LEU CB 8 C4H2s 0.770 1.880 4.965 35.847 22.951 1.562 possible 10155 116 S LEU CG 4 C4H1b 0.770 1.880 2.588 13.348 14.764 0.904 [OK] 10156 116 S LEU CD1 10 C4H3u 0.770 1.880 4.056 43.515 37.425 1.163 possible 10157 116 S LEU CD2 10 C4H3u 0.770 1.880 4.315 44.832 37.143 1.207 possible 10158 117 S ILE N 12 N3H1s 0.700 1.640 3.343 13.020 13.633 0.955 possible 10159 117 S ILE CA 3 C4H1s 0.770 1.880 4.221 17.651 13.007 1.357 possible 10160 117 S ILE C 1 C3H0s 0.770 1.610 2.521 8.218 8.470 0.970 [OK] 10161 117 S ILE O 16 O1H0u 0.660 1.420 2.808 15.657 16.144 0.970 [OK] 10162 117 S ILE CB 4 C4H1b 0.770 1.880 2.916 13.942 14.227 0.980 [OK] 10163 117 S ILE CG1 9 C4H2b 0.770 1.880 19.575 -1.000 24.187 -1.000 bad 10164 117 S ILE CG2 10 C4H3u 0.770 1.880 5.865 70.024 35.961 1.947 possible 10165 117 S ILE CD1 10 C4H3u 0.770 1.880 29.018 -1.000 38.377 -1.000 bad 10166 118 S ALA N 12 N3H1s 0.700 1.640 2.558 13.001 14.046 0.926 [OK] 10167 118 S ALA CA 4 C4H1b 0.770 1.880 2.797 15.219 14.063 1.082 [OK] 10168 118 S ALA C 1 C3H0s 0.770 1.610 2.515 8.567 8.900 0.963 [OK] 10169 118 S ALA O 16 O1H0u 0.660 1.420 2.400 13.970 16.188 0.863 [OK] 10170 118 S ALA CB 10 C4H3u 0.770 1.880 2.756 34.658 36.782 0.942 [OK] 10171 119 S SER N 12 N3H1s 0.700 1.640 2.385 13.345 14.103 0.946 [OK] 10172 119 S SER CA 3 C4H1s 0.770 1.880 3.269 14.452 13.476 1.072 possible 10173 119 S SER C 1 C3H0s 0.770 1.610 3.054 8.993 8.923 1.008 possible 10174 119 S SER O 16 O1H0u 0.660 1.420 2.818 16.736 16.179 1.034 [OK] 10175 119 S SER CB 8 C4H2s 0.770 1.880 4.211 33.851 23.884 1.417 possible 10176 119 S SER OG 17 O2H1u 0.660 1.460 2.562 17.613 18.732 0.940 [OK] 10177 120 S PHE N 12 N3H1s 0.700 1.640 4.199 15.755 13.691 1.151 possible 10178 120 S PHE CA 3 C4H1s 0.770 1.880 4.616 21.251 13.449 1.580 possible 10179 120 S PHE C 1 C3H0s 0.770 1.610 2.247 8.022 8.753 0.917 [OK] 10180 120 S PHE O 16 O1H0u 0.660 1.420 2.690 15.941 16.151 0.987 [OK] 10181 120 S PHE CB 8 C4H2s 0.770 1.880 5.338 39.650 23.777 1.668 possible 10182 120 S PHE CG 2 C3H0b 0.770 1.610 5.947 17.318 9.721 1.781 possible 10183 120 S PHE CD1 5 C3H1s 0.770 1.760 7.179 80.692 20.405 3.955 possible 10184 120 S PHE CD2 6 C3H1b 0.770 1.760 6.242 35.204 21.051 1.672 possible 10185 120 S PHE CE1 6 C3H1b 0.770 1.760 31.367 -1.000 21.580 -1.000 bad 10186 120 S PHE CE2 6 C3H1b 0.770 1.760 20.323 -1.000 21.680 -1.000 bad 10187 120 S PHE CZ 6 C3H1b 0.770 1.760 28.256 -1.000 21.666 -1.000 bad 10188 121 S PHE N 12 N3H1s 0.700 1.640 2.489 12.704 13.691 0.928 [OK] 10189 121 S PHE CA 3 C4H1s 0.770 1.880 3.001 13.981 13.449 1.040 possible 10190 121 S PHE C 1 C3H0s 0.770 1.610 2.393 8.604 8.753 0.983 [OK] 10191 121 S PHE O 16 O1H0u 0.660 1.420 2.558 15.213 16.151 0.942 [OK] 10192 121 S PHE CB 8 C4H2s 0.770 1.880 2.632 20.994 23.777 0.883 [OK] 10193 121 S PHE CG 2 C3H0b 0.770 1.610 2.641 9.735 9.721 1.001 [OK] 10194 121 S PHE CD1 5 C3H1s 0.770 1.760 4.103 27.174 20.405 1.332 possible 10195 121 S PHE CD2 6 C3H1b 0.770 1.760 2.728 19.468 21.051 0.925 [OK] 10196 121 S PHE CE1 6 C3H1b 0.770 1.760 16.315 -1.000 21.580 -1.000 bad 10197 121 S PHE CE2 6 C3H1b 0.770 1.760 4.278 24.853 21.680 1.146 possible 10198 121 S PHE CZ 6 C3H1b 0.770 1.760 16.668 -1.000 21.666 -1.000 bad 10199 122 S MET N 12 N3H1s 0.700 1.640 2.487 12.890 13.564 0.950 [OK] 10200 122 S MET CA 3 C4H1s 0.770 1.880 3.466 16.649 13.231 1.258 possible 10201 122 S MET C 1 C3H0s 0.770 1.610 2.356 8.277 8.782 0.942 [OK] 10202 122 S MET O 16 O1H0u 0.660 1.420 2.764 15.123 16.277 0.929 [OK] 10203 122 S MET CB 8 C4H2s 0.770 1.880 3.313 24.857 23.645 1.051 possible 10204 122 S MET CG 9 C4H2b 0.770 1.880 3.477 26.888 24.009 1.120 possible 10205 122 S MET SD 19 S2H0u 1.040 1.770 3.849 35.538 30.093 1.181 possible 10206 122 S MET CE 10 C4H3u 0.770 1.880 3.776 40.695 37.161 1.095 possible 10207 123 S PHE N 12 N3H1s 0.700 1.640 2.832 13.666 13.691 0.998 [OK] 10208 123 S PHE CA 3 C4H1s 0.770 1.880 2.662 13.573 13.449 1.009 [OK] 10209 123 S PHE C 1 C3H0s 0.770 1.610 2.275 7.795 8.753 0.891 [OK] 10210 123 S PHE O 16 O1H0u 0.660 1.420 2.625 15.937 16.151 0.987 [OK] 10211 123 S PHE CB 8 C4H2s 0.770 1.880 3.790 24.198 23.777 1.018 possible 10212 123 S PHE CG 2 C3H0b 0.770 1.610 4.519 13.743 9.721 1.414 possible 10213 123 S PHE CD1 5 C3H1s 0.770 1.760 4.600 22.297 20.405 1.093 possible 10214 123 S PHE CD2 6 C3H1b 0.770 1.760 5.156 35.762 21.051 1.699 possible 10215 123 S PHE CE1 6 C3H1b 0.770 1.760 4.844 31.649 21.580 1.467 possible 10216 123 S PHE CE2 6 C3H1b 0.770 1.760 28.974 -1.000 21.680 -1.000 bad 10217 123 S PHE CZ 6 C3H1b 0.770 1.760 25.465 -1.000 21.666 -1.000 bad 10218 124 S VAL N 12 N3H1s 0.700 1.640 2.424 12.898 13.676 0.943 [OK] 10219 124 S VAL CA 3 C4H1s 0.770 1.880 4.489 18.105 13.123 1.380 possible 10220 124 S VAL C 1 C3H0s 0.770 1.610 2.601 8.156 8.563 0.952 [OK] 10221 124 S VAL O 16 O1H0u 0.660 1.420 3.508 16.192 16.181 1.001 possible 10222 124 S VAL CB 4 C4H1b 0.770 1.880 3.577 16.048 14.598 1.099 possible 10223 124 S VAL CG1 10 C4H3u 0.770 1.880 7.678 76.639 36.584 2.095 possible 10224 124 S VAL CG2 10 C4H3u 0.770 1.880 16.632 -1.000 36.332 -1.000 bad 10225 125 S ALA N 12 N3H1s 0.700 1.640 2.571 12.558 14.046 0.894 [OK] 10226 125 S ALA CA 4 C4H1b 0.770 1.880 2.857 13.960 14.063 0.993 [OK] 10227 125 S ALA C 1 C3H0s 0.770 1.610 2.277 8.337 8.900 0.937 [OK] 10228 125 S ALA O 16 O1H0u 0.660 1.420 2.122 14.122 16.188 0.872 [OK] 10229 125 S ALA CB 10 C4H3u 0.770 1.880 3.504 37.229 36.782 1.012 possible 10230 126 S VAL N 12 N3H1s 0.700 1.640 2.610 13.200 13.676 0.965 [OK] 10231 126 S VAL CA 3 C4H1s 0.770 1.880 2.571 13.104 13.123 0.999 [OK] 10232 126 S VAL C 1 C3H0s 0.770 1.610 2.661 8.121 8.563 0.948 [OK] 10233 126 S VAL O 16 O1H0u 0.660 1.420 2.548 16.329 16.181 1.009 [OK] 10234 126 S VAL CB 4 C4H1b 0.770 1.880 2.729 14.087 14.598 0.965 [OK] 10235 126 S VAL CG1 10 C4H3u 0.770 1.880 3.108 34.741 36.584 0.950 possible 10236 126 S VAL CG2 10 C4H3u 0.770 1.880 3.211 39.510 36.332 1.087 possible 10237 127 S TRP N 12 N3H1s 0.700 1.640 2.738 13.903 13.791 1.008 [OK] 10238 127 S TRP CA 3 C4H1s 0.770 1.880 2.964 12.778 13.377 0.955 [OK] 10239 127 S TRP C 1 C3H0s 0.770 1.610 4.410 9.541 8.724 1.094 possible 10240 127 S TRP O 16 O1H0u 0.660 1.420 7.379 36.326 15.951 2.277 possible 10241 127 S TRP CB 8 C4H2s 0.770 1.880 17.295 -1.000 24.004 -1.000 bad 10242 127 S TRP CG 2 C3H0b 0.770 1.610 5.654 14.237 9.965 1.429 possible 10243 127 S TRP CD1 5 C3H1s 0.770 1.760 3.185 20.809 20.874 0.997 possible 10244 127 S TRP CD2 2 C3H0b 0.770 1.610 5.918 18.513 10.097 1.833 possible 10245 127 S TRP NE1 13 N3H1b 0.700 1.640 3.341 18.739 16.969 1.104 possible 10246 127 S TRP CE2 2 C3H0b 0.770 1.610 5.671 15.308 9.889 1.548 possible 10247 127 S TRP CE3 6 C3H1b 0.770 1.760 9.537 -1.000 20.448 -1.000 bad 10248 127 S TRP CZ2 6 C3H1b 0.770 1.760 11.329 -1.000 21.012 -1.000 bad 10249 127 S TRP CZ3 6 C3H1b 0.770 1.760 9.356 -1.000 21.516 -1.000 bad 10250 127 S TRP CH2 6 C3H1b 0.770 1.760 17.084 -1.000 21.339 -1.000 bad 10251 128 S SER N 12 N3H1s 0.700 1.640 5.033 17.098 14.103 1.212 possible 10252 128 S SER CA 3 C4H1s 0.770 1.880 6.047 24.083 13.476 1.787 possible 10253 128 S SER C 1 C3H0s 0.770 1.610 2.752 9.121 8.923 1.022 [OK] 10254 128 S SER O 16 O1H0u 0.660 1.420 2.751 15.709 16.179 0.971 [OK] 10255 128 S SER CB 8 C4H2s 0.770 1.880 5.351 32.406 23.884 1.357 possible 10256 128 S SER OG 17 O2H1u 0.660 1.460 2.532 17.961 18.732 0.959 [OK] 10257 129 S TRP N 12 N3H1s 0.700 1.640 2.762 13.244 13.791 0.960 [OK] 10258 129 S TRP CA 3 C4H1s 0.770 1.880 3.178 14.698 13.377 1.099 possible 10259 129 S TRP C 1 C3H0s 0.770 1.610 2.167 8.063 8.724 0.924 [OK] 10260 129 S TRP O 16 O1H0u 0.660 1.420 2.443 14.510 15.951 0.910 [OK] 10261 129 S TRP CB 8 C4H2s 0.770 1.880 2.687 21.068 24.004 0.878 [OK] 10262 129 S TRP CG 2 C3H0b 0.770 1.610 2.590 9.059 9.965 0.909 [OK] 10263 129 S TRP CD1 5 C3H1s 0.770 1.760 2.651 18.594 20.874 0.891 [OK] 10264 129 S TRP CD2 2 C3H0b 0.770 1.610 3.021 10.612 10.097 1.051 possible 10265 129 S TRP NE1 13 N3H1b 0.700 1.640 2.975 15.989 16.969 0.942 [OK] 10266 129 S TRP CE2 2 C3H0b 0.770 1.610 3.025 10.794 9.889 1.092 possible 10267 129 S TRP CE3 6 C3H1b 0.770 1.760 3.308 20.989 20.448 1.026 possible 10268 129 S TRP CZ2 6 C3H1b 0.770 1.760 4.462 29.334 21.012 1.396 possible 10269 129 S TRP CZ3 6 C3H1b 0.770 1.760 4.300 36.555 21.516 1.699 possible 10270 129 S TRP CH2 6 C3H1b 0.770 1.760 5.502 45.757 21.339 2.144 possible 10271 130 S TRP N 12 N3H1s 0.700 1.640 2.358 12.571 13.791 0.912 [OK] 10272 130 S TRP CA 3 C4H1s 0.770 1.880 2.514 12.853 13.377 0.961 [OK] 10273 130 S TRP C 1 C3H0s 0.770 1.610 2.060 7.720 8.724 0.885 [OK] 10274 130 S TRP O 16 O1H0u 0.660 1.420 2.427 15.755 15.951 0.988 [OK] 10275 130 S TRP CB 8 C4H2s 0.770 1.880 2.836 22.178 24.004 0.924 [OK] 10276 130 S TRP CG 2 C3H0b 0.770 1.610 2.473 9.521 9.965 0.955 [OK] 10277 130 S TRP CD1 5 C3H1s 0.770 1.760 2.610 19.065 20.874 0.913 [OK] 10278 130 S TRP CD2 2 C3H0b 0.770 1.610 2.591 10.025 10.097 0.993 [OK] 10279 130 S TRP NE1 13 N3H1b 0.700 1.640 2.562 14.536 16.969 0.857 [OK] 10280 130 S TRP CE2 2 C3H0b 0.770 1.610 2.641 10.374 9.889 1.049 [OK] 10281 130 S TRP CE3 6 C3H1b 0.770 1.760 5.288 27.884 20.448 1.364 possible 10282 130 S TRP CZ2 6 C3H1b 0.770 1.760 3.250 24.777 21.012 1.179 possible 10283 130 S TRP CZ3 6 C3H1b 0.770 1.760 26.233 -1.000 21.516 -1.000 bad 10284 130 S TRP CH2 6 C3H1b 0.770 1.760 19.853 -1.000 21.339 -1.000 bad 10285 131 S GLY N 12 N3H1s 0.700 1.640 2.876 13.534 14.854 0.911 [OK] 10286 131 S GLY CA 8 C4H2s 0.770 1.880 7.766 65.852 23.688 2.780 possible 10287 131 S GLY C 2 C3H0b 0.770 1.610 2.812 8.668 9.840 0.881 [OK] 10288 131 S GLY O 16 O1H0u 0.660 1.420 3.727 17.893 16.391 1.092 possible 10289 132 S ARG N 12 N3H1s 0.700 1.640 2.291 11.722 13.650 0.859 [OK] 10290 132 S ARG CA 3 C4H1s 0.770 1.880 2.641 14.009 13.422 1.044 [OK] 10291 132 S ARG C 1 C3H0s 0.770 1.610 2.322 8.235 8.838 0.932 [OK] 10292 132 S ARG O 16 O1H0u 0.660 1.420 2.421 14.938 16.084 0.929 [OK] 10293 132 S ARG CB 8 C4H2s 0.770 1.880 3.237 22.376 23.088 0.969 possible 10294 132 S ARG CG 8 C4H2s 0.770 1.880 2.967 24.152 23.640 1.022 [OK] 10295 132 S ARG CD 8 C4H2s 0.770 1.880 3.283 24.950 23.300 1.071 possible 10296 132 S ARG NE 13 N3H1b 0.700 1.640 2.659 15.529 15.569 0.997 [OK] 10297 132 S ARG CZ 2 C3H0b 0.770 1.610 2.853 11.397 9.747 1.169 [OK] 10298 132 S ARG NH1 15 N3H2u 0.700 1.640 2.628 22.797 22.782 1.001 [OK] 10299 132 S ARG NH2 15 N3H2u 0.700 1.640 3.186 24.071 23.810 1.011 possible 10300 133 S THR N 12 N3H1s 0.700 1.640 2.560 12.818 13.832 0.927 [OK] 10301 133 S THR CA 3 C4H1s 0.770 1.880 3.011 15.471 13.099 1.181 possible 10302 133 S THR C 1 C3H0s 0.770 1.610 2.376 8.770 8.738 1.004 [OK] 10303 133 S THR O 16 O1H0u 0.660 1.420 2.374 17.492 16.020 1.092 [OK] 10304 133 S THR CB 4 C4H1b 0.770 1.880 2.910 16.551 14.829 1.116 [OK] 10305 133 S THR OG1 17 O2H1u 0.660 1.460 2.599 19.171 18.123 1.058 [OK] 10306 133 S THR CG2 10 C4H3u 0.770 1.880 2.875 35.503 36.542 0.972 [OK] 10307 134 S TYR N 12 N3H1s 0.700 1.640 2.494 13.014 13.691 0.951 [OK] 10308 134 S TYR CA 3 C4H1s 0.770 1.880 2.818 14.403 13.330 1.081 [OK] 10309 134 S TYR C 1 C3H0s 0.770 1.610 2.257 8.211 8.770 0.936 [OK] 10310 134 S TYR O 16 O1H0u 0.660 1.420 2.376 15.071 16.124 0.935 [OK] 10311 134 S TYR CB 8 C4H2s 0.770 1.880 3.840 27.451 23.678 1.159 possible 10312 134 S TYR CG 2 C3H0b 0.770 1.610 3.631 12.447 9.732 1.279 possible 10313 134 S TYR CD1 5 C3H1s 0.770 1.760 6.084 34.568 20.171 1.714 possible 10314 134 S TYR CD2 5 C3H1s 0.770 1.760 3.780 23.839 20.728 1.150 possible 10315 134 S TYR CE1 5 C3H1s 0.770 1.760 11.645 -1.000 20.675 -1.000 bad 10316 134 S TYR CE2 5 C3H1s 0.770 1.760 5.367 28.990 20.810 1.393 possible 10317 134 S TYR CZ 2 C3H0b 0.770 1.610 6.409 17.647 9.926 1.778 possible 10318 134 S TYR OH 17 O2H1u 0.660 1.460 36.835 -1.000 19.173 -1.000 bad 10319 135 S LEU N 12 N3H1s 0.700 1.640 2.507 12.764 13.655 0.935 [OK] 10320 135 S LEU CA 3 C4H1s 0.770 1.880 2.797 12.901 13.122 0.983 [OK] 10321 135 S LEU C 1 C3H0s 0.770 1.610 2.136 7.977 8.825 0.904 [OK] 10322 135 S LEU O 16 O1H0u 0.660 1.420 3.904 19.629 16.208 1.211 possible 10323 135 S LEU CB 8 C4H2s 0.770 1.880 4.240 24.516 22.951 1.068 possible 10324 135 S LEU CG 4 C4H1b 0.770 1.880 4.893 18.691 14.764 1.266 possible 10325 135 S LEU CD1 10 C4H3u 0.770 1.880 33.866 -1.000 37.425 -1.000 bad 10326 135 S LEU CD2 10 C4H3u 0.770 1.880 31.337 -1.000 37.143 -1.000 bad 10327 136 S ARG N 12 N3H1s 0.700 1.640 2.480 12.774 13.650 0.936 [OK] 10328 136 S ARG CA 3 C4H1s 0.770 1.880 2.551 11.964 13.422 0.891 [OK] 10329 136 S ARG C 1 C3H0s 0.770 1.610 2.297 8.517 8.838 0.964 [OK] 10330 136 S ARG O 16 O1H0u 0.660 1.420 2.600 17.605 16.084 1.095 [OK] 10331 136 S ARG CB 8 C4H2s 0.770 1.880 3.057 29.567 23.088 1.281 possible 10332 136 S ARG CG 8 C4H2s 0.770 1.880 2.961 24.058 23.640 1.018 [OK] 10333 136 S ARG CD 8 C4H2s 0.770 1.880 2.951 26.706 23.300 1.146 [OK] 10334 136 S ARG NE 13 N3H1b 0.700 1.640 2.579 14.047 15.569 0.902 [OK] 10335 136 S ARG CZ 2 C3H0b 0.770 1.610 2.280 8.524 9.747 0.874 [OK] 10336 136 S ARG NH1 15 N3H2u 0.700 1.640 5.030 34.943 22.782 1.534 possible 10337 136 S ARG NH2 15 N3H2u 0.700 1.640 5.662 37.652 23.810 1.581 possible 10338 137 S ALA N 12 N3H1s 0.700 1.640 2.407 13.227 14.046 0.942 [OK] 10339 137 S ALA CA 4 C4H1b 0.770 1.880 2.894 15.115 14.063 1.075 [OK] 10340 137 S ALA C 1 C3H0s 0.770 1.610 2.398 8.733 8.900 0.981 [OK] 10341 137 S ALA O 16 O1H0u 0.660 1.420 2.419 14.869 16.188 0.919 [OK] 10342 137 S ALA CB 10 C4H3u 0.770 1.880 3.056 36.263 36.782 0.986 possible 10343 138 S GLN N 12 N3H1s 0.700 1.640 2.482 12.646 13.616 0.929 [OK] 10344 138 S GLN CA 3 C4H1s 0.770 1.880 2.776 13.095 13.334 0.982 [OK] 10345 138 S GLN C 1 C3H0s 0.770 1.610 3.123 8.318 8.787 0.947 possible 10346 138 S GLN O 16 O1H0u 0.660 1.420 3.750 18.039 15.993 1.128 possible 10347 138 S GLN CB 8 C4H2s 0.770 1.880 3.105 22.765 23.275 0.978 possible 10348 138 S GLN CG 8 C4H2s 0.770 1.880 4.458 36.205 23.465 1.543 possible 10349 138 S GLN CD 2 C3H0b 0.770 1.610 7.022 17.475 9.659 1.809 possible 10350 138 S GLN OE1 16 O1H0u 0.660 1.420 23.853 -1.000 17.091 -1.000 bad 10351 138 S GLN NE2 15 N3H2u 0.700 1.640 35.659 -1.000 24.150 -1.000 bad 10352 139 S ALA N 12 N3H1s 0.700 1.640 3.700 16.226 14.046 1.155 possible 10353 139 S ALA CA 4 C4H1b 0.770 1.880 4.996 23.519 14.063 1.672 possible 10354 139 S ALA C 1 C3H0s 0.770 1.610 2.303 8.505 8.900 0.956 [OK] 10355 139 S ALA O 16 O1H0u 0.660 1.420 2.606 17.078 16.188 1.055 [OK] 10356 139 S ALA CB 10 C4H3u 0.770 1.880 5.707 48.876 36.782 1.329 possible 10357 140 S LEU N 12 N3H1s 0.700 1.640 2.554 12.961 13.655 0.949 [OK] 10358 140 S LEU CA 3 C4H1s 0.770 1.880 2.758 12.449 13.122 0.949 [OK] 10359 140 S LEU C 1 C3H0s 0.770 1.610 2.509 9.348 8.825 1.059 [OK] 10360 140 S LEU O 16 O1H0u 0.660 1.420 2.399 15.208 16.208 0.938 [OK] 10361 140 S LEU CB 8 C4H2s 0.770 1.880 2.807 21.657 22.951 0.944 [OK] 10362 140 S LEU CG 4 C4H1b 0.770 1.880 2.740 14.342 14.764 0.971 [OK] 10363 140 S LEU CD1 10 C4H3u 0.770 1.880 3.049 35.180 37.425 0.940 possible 10364 140 S LEU CD2 10 C4H3u 0.770 1.880 2.954 36.738 37.143 0.989 [OK] 10365 141 S GLY N 12 N3H1s 0.700 1.640 2.872 14.996 14.854 1.010 [OK] 10366 141 S GLY CA 8 C4H2s 0.770 1.880 2.736 23.253 23.688 0.982 [OK] 10367 141 S GLY C 2 C3H0b 0.770 1.610 2.497 9.862 9.840 1.002 [OK] 10368 141 S GLY O 16 O1H0u 0.660 1.420 2.352 16.264 16.391 0.992 [OK] 10369 142 S MET N 12 N3H1s 0.700 1.640 2.562 12.714 13.564 0.937 [OK] 10370 142 S MET CA 3 C4H1s 0.770 1.880 2.765 13.492 13.231 1.020 [OK] 10371 142 S MET C 1 C3H0s 0.770 1.610 2.451 9.029 8.782 1.028 [OK] 10372 142 S MET O 16 O1H0u 0.660 1.420 2.360 17.132 16.277 1.053 [OK] 10373 142 S MET CB 8 C4H2s 0.770 1.880 3.101 24.497 23.645 1.036 possible 10374 142 S MET CG 9 C4H2b 0.770 1.880 2.767 21.702 24.009 0.904 [OK] 10375 142 S MET SD 19 S2H0u 1.040 1.770 2.991 29.432 30.093 0.978 [OK] 10376 142 S MET CE 10 C4H3u 0.770 1.880 2.915 36.658 37.161 0.986 [OK] 10377 143 S GLY N 12 N3H1s 0.700 1.640 2.485 14.035 14.854 0.945 [OK] 10378 143 S GLY CA 8 C4H2s 0.770 1.880 6.094 42.571 23.688 1.797 possible 10379 143 S GLY C 2 C3H0b 0.770 1.610 2.442 9.303 9.840 0.945 [OK] 10380 143 S GLY O 16 O1H0u 0.660 1.420 2.402 14.279 16.391 0.871 [OK] 10381 144 S LYS N 12 N3H1s 0.700 1.640 5.788 30.510 13.675 2.231 possible 10382 144 S LYS CA 3 C4H1s 0.770 1.880 2.549 12.693 13.324 0.953 [OK] 10383 144 S LYS C 1 C3H0s 0.770 1.610 3.024 10.028 8.759 1.145 possible 10384 144 S LYS O 16 O1H0u 0.660 1.420 2.413 15.434 16.049 0.962 [OK] 10385 144 S LYS CB 8 C4H2s 0.770 1.880 3.909 26.742 22.904 1.168 possible 10386 144 S LYS CG 8 C4H2s 0.770 1.880 6.583 44.584 23.131 1.927 possible 10387 144 S LYS CD 8 C4H2s 0.770 1.880 2.800 23.388 23.837 0.981 [OK] 10388 144 S LYS CE 9 C4H2b 0.770 1.880 3.664 26.433 23.934 1.104 possible 10389 144 S LYS NZ 14 N4H3u 0.700 1.640 6.105 44.990 21.213 2.121 possible 10390 145 S HIS N 12 N3H1s 0.700 1.640 3.263 14.404 13.715 1.050 possible 10391 145 S HIS CA 3 C4H1s 0.770 1.880 3.491 15.802 13.467 1.173 possible 10392 145 S HIS C 1 C3H0s 0.770 1.610 2.118 8.179 8.882 0.921 [OK] 10393 145 S HIS O 16 O1H0u 0.660 1.420 3.032 17.349 16.082 1.079 possible 10394 145 S HIS CB 8 C4H2s 0.770 1.880 2.967 23.037 23.653 0.974 [OK] 10395 145 S HIS CG 2 C3H0b 0.770 1.610 3.126 10.600 9.952 1.065 possible 10396 145 S HIS ND1 13 N3H1b 0.700 1.640 3.459 17.923 15.506 1.156 possible 10397 145 S HIS CD2 5 C3H1s 0.770 1.760 4.589 38.186 21.085 1.811 possible 10398 145 S HIS CE1 5 C3H1s 0.770 1.760 5.703 36.052 20.636 1.747 possible 10399 145 S HIS NE2 13 N3H1b 0.700 1.640 4.582 27.614 15.337 1.800 possible 10400 146 S THR N 12 N3H1s 0.700 1.640 2.693 13.177 13.832 0.953 [OK] 10401 146 S THR CA 3 C4H1s 0.770 1.880 3.227 14.038 13.099 1.072 possible 10402 146 S THR C 1 C3H0s 0.770 1.610 2.522 8.442 8.738 0.966 [OK] 10403 146 S THR O 16 O1H0u 0.660 1.420 2.654 16.182 16.020 1.010 [OK] 10404 146 S THR CB 4 C4H1b 0.770 1.880 2.848 13.886 14.829 0.936 [OK] 10405 146 S THR OG1 17 O2H1u 0.660 1.460 2.476 17.119 18.123 0.945 [OK] 10406 146 S THR CG2 10 C4H3u 0.770 1.880 3.171 40.271 36.542 1.102 possible 10407 147 S ALA N 12 N3H1s 0.700 1.640 2.513 13.205 14.046 0.940 [OK] 10408 147 S ALA CA 4 C4H1b 0.770 1.880 2.813 14.128 14.063 1.005 [OK] 10409 147 S ALA C 1 C3H0s 0.770 1.610 2.501 8.561 8.900 0.962 [OK] 10410 147 S ALA O 16 O1H0u 0.660 1.420 2.384 14.227 16.188 0.879 [OK] 10411 147 S ALA CB 10 C4H3u 0.770 1.880 2.932 36.639 36.782 0.996 [OK] 10412 148 S TRP N 12 N3H1s 0.700 1.640 2.436 13.448 13.791 0.975 [OK] 10413 148 S TRP CA 3 C4H1s 0.770 1.880 3.406 14.461 13.377 1.081 possible 10414 148 S TRP C 1 C3H0s 0.770 1.610 3.724 9.284 8.724 1.064 possible 10415 148 S TRP O 16 O1H0u 0.660 1.420 5.124 35.045 15.951 2.197 possible 10416 148 S TRP CB 8 C4H2s 0.770 1.880 6.273 57.849 24.004 2.410 possible 10417 148 S TRP CG 2 C3H0b 0.770 1.610 0.941 -1.000 9.965 -1.000 bad 10418 148 S TRP CD1 5 C3H1s 0.770 1.760 6.914 71.426 20.874 3.422 possible 10419 148 S TRP CD2 2 C3H0b 0.770 1.610 1.831 -1.000 10.097 -1.000 bad 10420 148 S TRP NE1 13 N3H1b 0.700 1.640 22.496 -1.000 16.969 -1.000 bad 10421 148 S TRP CE2 2 C3H0b 0.770 1.610 1.568 -1.000 9.889 -1.000 bad 10422 148 S TRP CE3 6 C3H1b 0.770 1.760 6.677 27.597 20.448 1.350 possible 10423 148 S TRP CZ2 6 C3H1b 0.770 1.760 25.462 -1.000 21.012 -1.000 bad 10424 148 S TRP CZ3 6 C3H1b 0.770 1.760 12.329 -1.000 21.516 -1.000 bad 10425 148 S TRP CH2 6 C3H1b 0.770 1.760 21.519 -1.000 21.339 -1.000 bad 10426 149 S ALA N 12 N3H1s 0.700 1.640 3.785 15.641 14.046 1.114 possible 10427 149 S ALA CA 4 C4H1b 0.770 1.880 3.578 15.211 14.063 1.082 possible 10428 149 S ALA C 1 C3H0s 0.770 1.610 2.277 8.055 8.900 0.905 [OK] 10429 149 S ALA O 16 O1H0u 0.660 1.420 2.580 19.325 16.188 1.194 [OK] 10430 149 S ALA CB 10 C4H3u 0.770 1.880 3.213 38.290 36.782 1.041 possible 10431 150 S PHE N 12 N3H1s 0.700 1.640 2.352 12.022 13.691 0.878 [OK] 10432 150 S PHE CA 3 C4H1s 0.770 1.880 2.801 13.133 13.449 0.977 [OK] 10433 150 S PHE C 1 C3H0s 0.770 1.610 2.312 8.432 8.753 0.963 [OK] 10434 150 S PHE O 16 O1H0u 0.660 1.420 2.297 13.584 16.151 0.841 [OK] 10435 150 S PHE CB 8 C4H2s 0.770 1.880 2.947 22.523 23.777 0.947 [OK] 10436 150 S PHE CG 2 C3H0b 0.770 1.610 2.350 9.251 9.721 0.952 [OK] 10437 150 S PHE CD1 5 C3H1s 0.770 1.760 2.701 17.184 20.405 0.842 [OK] 10438 150 S PHE CD2 6 C3H1b 0.770 1.760 2.653 18.286 21.051 0.869 [OK] 10439 150 S PHE CE1 6 C3H1b 0.770 1.760 3.086 21.392 21.580 0.991 possible 10440 150 S PHE CE2 6 C3H1b 0.770 1.760 2.620 19.236 21.680 0.887 [OK] 10441 150 S PHE CZ 6 C3H1b 0.770 1.760 2.876 20.494 21.666 0.946 [OK] 10442 151 S LEU N 12 N3H1s 0.700 1.640 2.393 13.363 13.655 0.979 [OK] 10443 151 S LEU CA 3 C4H1s 0.770 1.880 2.728 13.052 13.122 0.995 [OK] 10444 151 S LEU C 1 C3H0s 0.770 1.610 4.117 8.927 8.825 1.012 possible 10445 151 S LEU O 16 O1H0u 0.660 1.420 4.592 26.422 16.208 1.630 possible 10446 151 S LEU CB 8 C4H2s 0.770 1.880 5.953 41.197 22.951 1.795 possible 10447 151 S LEU CG 4 C4H1b 0.770 1.880 2.836 13.731 14.764 0.930 [OK] 10448 151 S LEU CD1 10 C4H3u 0.770 1.880 39.039 -1.000 37.425 -1.000 bad 10449 151 S LEU CD2 10 C4H3u 0.770 1.880 7.206 66.894 37.143 1.801 possible 10450 152 S SER N 12 N3H1s 0.700 1.640 4.380 17.972 14.103 1.274 possible 10451 152 S SER CA 3 C4H1s 0.770 1.880 5.132 22.058 13.476 1.637 possible 10452 152 S SER C 1 C3H0s 0.770 1.610 2.209 8.113 8.923 0.909 [OK] 10453 152 S SER O 16 O1H0u 0.660 1.420 2.555 16.190 16.179 1.001 [OK] 10454 152 S SER CB 8 C4H2s 0.770 1.880 4.315 29.896 23.884 1.252 possible 10455 152 S SER OG 17 O2H1u 0.660 1.460 2.886 17.671 18.732 0.943 [OK] 10456 153 S ALA N 12 N3H1s 0.700 1.640 2.690 14.755 14.046 1.050 [OK] 10457 153 S ALA CA 4 C4H1b 0.770 1.880 2.783 13.864 14.063 0.986 [OK] 10458 153 S ALA C 1 C3H0s 0.770 1.610 2.333 8.444 8.900 0.949 [OK] 10459 153 S ALA O 16 O1H0u 0.660 1.420 2.273 16.416 16.188 1.014 [OK] 10460 153 S ALA CB 10 C4H3u 0.770 1.880 3.246 37.812 36.782 1.028 possible 10461 154 S ILE N 12 N3H1s 0.700 1.640 2.631 13.006 13.633 0.954 [OK] 10462 154 S ILE CA 3 C4H1s 0.770 1.880 2.617 13.773 13.007 1.059 [OK] 10463 154 S ILE C 1 C3H0s 0.770 1.610 2.665 8.048 8.470 0.950 [OK] 10464 154 S ILE O 16 O1H0u 0.660 1.420 2.364 13.143 16.144 0.814 [OK] 10465 154 S ILE CB 4 C4H1b 0.770 1.880 2.997 14.216 14.227 0.999 [OK] 10466 154 S ILE CG1 9 C4H2b 0.770 1.880 2.820 21.366 24.187 0.883 [OK] 10467 154 S ILE CG2 10 C4H3u 0.770 1.880 4.274 37.629 35.961 1.046 possible 10468 154 S ILE CD1 10 C4H3u 0.770 1.880 3.075 36.499 38.377 0.951 possible 10469 155 S TRP N 12 N3H1s 0.700 1.640 3.980 15.163 13.791 1.099 possible 10470 155 S TRP CA 3 C4H1s 0.770 1.880 4.537 18.842 13.377 1.409 possible 10471 155 S TRP C 1 C3H0s 0.770 1.610 2.446 8.050 8.724 0.923 [OK] 10472 155 S TRP O 16 O1H0u 0.660 1.420 2.318 14.669 15.951 0.920 [OK] 10473 155 S TRP CB 8 C4H2s 0.770 1.880 5.395 34.135 24.004 1.422 possible 10474 155 S TRP CG 2 C3H0b 0.770 1.610 5.461 15.538 9.965 1.559 possible 10475 155 S TRP CD1 5 C3H1s 0.770 1.760 4.063 24.572 20.874 1.177 possible 10476 155 S TRP CD2 2 C3H0b 0.770 1.610 6.332 18.659 10.097 1.848 possible 10477 155 S TRP NE1 13 N3H1b 0.700 1.640 4.040 20.775 16.969 1.224 possible 10478 155 S TRP CE2 2 C3H0b 0.770 1.610 6.300 16.659 9.889 1.685 possible 10479 155 S TRP CE3 6 C3H1b 0.770 1.760 15.221 -1.000 20.448 -1.000 bad 10480 155 S TRP CZ2 6 C3H1b 0.770 1.760 7.048 43.115 21.012 2.052 possible 10481 155 S TRP CZ3 6 C3H1b 0.770 1.760 16.294 -1.000 21.516 -1.000 bad 10482 155 S TRP CH2 6 C3H1b 0.770 1.760 14.089 -1.000 21.339 -1.000 bad 10483 156 S LEU N 12 N3H1s 0.700 1.640 2.580 15.124 13.655 1.108 [OK] 10484 156 S LEU CA 3 C4H1s 0.770 1.880 2.693 13.828 13.122 1.054 [OK] 10485 156 S LEU C 1 C3H0s 0.770 1.610 2.659 8.396 8.825 0.951 [OK] 10486 156 S LEU O 16 O1H0u 0.660 1.420 2.500 14.056 16.208 0.867 [OK] 10487 156 S LEU CB 8 C4H2s 0.770 1.880 2.907 22.358 22.951 0.974 [OK] 10488 156 S LEU CG 4 C4H1b 0.770 1.880 2.921 15.958 14.764 1.081 [OK] 10489 156 S LEU CD1 10 C4H3u 0.770 1.880 3.058 35.355 37.425 0.945 possible 10490 156 S LEU CD2 10 C4H3u 0.770 1.880 2.950 34.704 37.143 0.934 [OK] 10491 157 S TRP N 12 N3H1s 0.700 1.640 2.738 14.516 13.791 1.053 [OK] 10492 157 S TRP CA 3 C4H1s 0.770 1.880 2.881 14.898 13.377 1.114 [OK] 10493 157 S TRP C 1 C3H0s 0.770 1.610 2.427 8.114 8.724 0.930 [OK] 10494 157 S TRP O 16 O1H0u 0.660 1.420 2.990 18.916 15.951 1.186 [OK] 10495 157 S TRP CB 8 C4H2s 0.770 1.880 2.701 22.691 24.004 0.945 [OK] 10496 157 S TRP CG 2 C3H0b 0.770 1.610 2.717 9.551 9.965 0.958 [OK] 10497 157 S TRP CD1 5 C3H1s 0.770 1.760 3.952 27.432 20.874 1.314 possible 10498 157 S TRP CD2 2 C3H0b 0.770 1.610 2.724 11.024 10.097 1.092 [OK] 10499 157 S TRP NE1 13 N3H1b 0.700 1.640 3.692 24.321 16.969 1.433 possible 10500 157 S TRP CE2 2 C3H0b 0.770 1.610 2.729 11.408 9.889 1.154 [OK] 10501 157 S TRP CE3 6 C3H1b 0.770 1.760 2.654 19.307 20.448 0.944 [OK] 10502 157 S TRP CZ2 6 C3H1b 0.770 1.760 3.073 21.605 21.012 1.028 possible 10503 157 S TRP CZ3 6 C3H1b 0.770 1.760 2.896 19.247 21.516 0.895 [OK] 10504 157 S TRP CH2 6 C3H1b 0.770 1.760 2.687 20.832 21.339 0.976 [OK] 10505 158 S MET N 12 N3H1s 0.700 1.640 2.486 12.091 13.564 0.891 [OK] 10506 158 S MET CA 3 C4H1s 0.770 1.880 2.901 14.026 13.231 1.060 [OK] 10507 158 S MET C 1 C3H0s 0.770 1.610 2.057 8.032 8.782 0.915 [OK] 10508 158 S MET O 16 O1H0u 0.660 1.420 2.294 14.161 16.277 0.870 [OK] 10509 158 S MET CB 8 C4H2s 0.770 1.880 3.537 23.616 23.645 0.999 possible 10510 158 S MET CG 9 C4H2b 0.770 1.880 4.850 32.769 24.009 1.365 possible 10511 158 S MET SD 19 S2H0u 1.040 1.770 2.803 28.629 30.093 0.951 [OK] 10512 158 S MET CE 10 C4H3u 0.770 1.880 26.927 -1.000 37.161 -1.000 bad 10513 159 S VAL N 12 N3H1s 0.700 1.640 2.511 12.501 13.676 0.914 [OK] 10514 159 S VAL CA 3 C4H1s 0.770 1.880 2.720 12.801 13.123 0.975 [OK] 10515 159 S VAL C 1 C3H0s 0.770 1.610 2.545 7.868 8.563 0.919 [OK] 10516 159 S VAL O 16 O1H0u 0.660 1.420 2.466 15.244 16.181 0.942 [OK] 10517 159 S VAL CB 4 C4H1b 0.770 1.880 2.894 15.085 14.598 1.033 [OK] 10518 159 S VAL CG1 10 C4H3u 0.770 1.880 2.950 31.996 36.584 0.875 [OK] 10519 159 S VAL CG2 10 C4H3u 0.770 1.880 2.898 33.855 36.332 0.932 [OK] 10520 160 S LEU N 12 N3H1s 0.700 1.640 2.675 13.597 13.655 0.996 [OK] 10521 160 S LEU CA 3 C4H1s 0.770 1.880 3.001 15.440 13.122 1.177 possible 10522 160 S LEU C 1 C3H0s 0.770 1.610 2.470 8.670 8.825 0.982 [OK] 10523 160 S LEU O 16 O1H0u 0.660 1.420 2.415 17.339 16.208 1.070 [OK] 10524 160 S LEU CB 8 C4H2s 0.770 1.880 3.655 24.095 22.951 1.050 possible 10525 160 S LEU CG 4 C4H1b 0.770 1.880 2.950 14.065 14.764 0.953 [OK] 10526 160 S LEU CD1 10 C4H3u 0.770 1.880 3.045 37.314 37.425 0.997 possible 10527 160 S LEU CD2 10 C4H3u 0.770 1.880 3.220 37.487 37.143 1.009 possible 10528 161 S GLY N 12 N3H1s 0.700 1.640 3.425 16.246 14.854 1.094 possible 10529 161 S GLY CA 8 C4H2s 0.770 1.880 3.515 27.098 23.688 1.144 possible 10530 161 S GLY C 2 C3H0b 0.770 1.610 2.326 9.234 9.840 0.938 [OK] 10531 161 S GLY O 16 O1H0u 0.660 1.420 2.910 19.511 16.391 1.190 [OK] 10532 162 S PHE N 12 N3H1s 0.700 1.640 2.493 13.581 13.691 0.992 [OK] 10533 162 S PHE CA 3 C4H1s 0.770 1.880 2.816 13.775 13.449 1.024 [OK] 10534 162 S PHE C 1 C3H0s 0.770 1.610 2.785 9.137 8.753 1.044 [OK] 10535 162 S PHE O 16 O1H0u 0.660 1.420 2.335 14.742 16.151 0.913 [OK] 10536 162 S PHE CB 8 C4H2s 0.770 1.880 4.276 31.554 23.777 1.327 possible 10537 162 S PHE CG 2 C3H0b 0.770 1.610 3.014 10.533 9.721 1.083 possible 10538 162 S PHE CD1 5 C3H1s 0.770 1.760 2.914 21.596 20.405 1.058 [OK] 10539 162 S PHE CD2 6 C3H1b 0.770 1.760 5.462 41.776 21.051 1.985 possible 10540 162 S PHE CE1 6 C3H1b 0.770 1.760 3.288 24.740 21.580 1.146 possible 10541 162 S PHE CE2 6 C3H1b 0.770 1.760 5.282 46.913 21.680 2.164 possible 10542 162 S PHE CZ 6 C3H1b 0.770 1.760 3.280 22.516 21.666 1.039 possible 10543 163 S ILE N 12 N3H1s 0.700 1.640 3.193 13.668 13.633 1.003 possible 10544 163 S ILE CA 3 C4H1s 0.770 1.880 4.259 18.108 13.007 1.392 possible 10545 163 S ILE C 1 C3H0s 0.770 1.610 2.292 7.898 8.470 0.932 [OK] 10546 163 S ILE O 16 O1H0u 0.660 1.420 3.239 16.879 16.144 1.046 possible 10547 163 S ILE CB 4 C4H1b 0.770 1.880 2.701 13.318 14.227 0.936 [OK] 10548 163 S ILE CG1 9 C4H2b 0.770 1.880 9.677 -1.000 24.187 -1.000 bad 10549 163 S ILE CG2 10 C4H3u 0.770 1.880 18.174 -1.000 35.961 -1.000 bad 10550 163 S ILE CD1 10 C4H3u 0.770 1.880 19.028 -1.000 38.377 -1.000 bad 10551 164 S ARG N 12 N3H1s 0.700 1.640 2.500 13.288 13.650 0.973 [OK] 10552 164 S ARG CA 3 C4H1s 0.770 1.880 2.930 14.601 13.422 1.088 [OK] 10553 164 S ARG C 1 C3H0s 0.770 1.610 2.716 8.541 8.838 0.966 [OK] 10554 164 S ARG O 16 O1H0u 0.660 1.420 2.596 15.469 16.084 0.962 [OK] 10555 164 S ARG CB 8 C4H2s 0.770 1.880 2.883 21.435 23.088 0.928 [OK] 10556 164 S ARG CG 8 C4H2s 0.770 1.880 2.959 27.588 23.640 1.167 [OK] 10557 164 S ARG CD 8 C4H2s 0.770 1.880 3.064 23.182 23.300 0.995 possible 10558 164 S ARG NE 13 N3H1b 0.700 1.640 2.655 15.327 15.569 0.984 [OK] 10559 164 S ARG CZ 2 C3H0b 0.770 1.610 2.389 8.706 9.747 0.893 [OK] 10560 164 S ARG NH1 15 N3H2u 0.700 1.640 2.803 21.724 22.782 0.954 [OK] 10561 164 S ARG NH2 15 N3H2u 0.700 1.640 2.828 22.690 23.810 0.953 [OK] 10562 165 S PRO N 11 N3H0u 0.700 1.640 2.719 9.255 8.823 1.049 [OK] 10563 165 S PRO CA 4 C4H1b 0.770 1.880 2.916 13.997 13.955 1.003 [OK] 10564 165 S PRO C 1 C3H0s 0.770 1.610 2.409 8.563 8.812 0.972 [OK] 10565 165 S PRO O 16 O1H0u 0.660 1.420 2.373 14.594 16.169 0.903 [OK] 10566 165 S PRO CB 9 C4H2b 0.770 1.880 2.857 25.688 25.563 1.005 [OK] 10567 165 S PRO CG 9 C4H2b 0.770 1.880 2.791 22.862 25.832 0.885 [OK] 10568 165 S PRO CD 8 C4H2s 0.770 1.880 2.708 20.744 23.836 0.870 [OK] 10569 166 S ILE N 12 N3H1s 0.700 1.640 2.540 13.117 13.633 0.962 [OK] 10570 166 S ILE CA 3 C4H1s 0.770 1.880 2.408 11.479 13.007 0.883 [OK] 10571 166 S ILE C 1 C3H0s 0.770 1.610 2.668 7.769 8.470 0.917 [OK] 10572 166 S ILE O 16 O1H0u 0.660 1.420 7.106 -1.000 16.144 -1.000 bad 10573 166 S ILE CB 4 C4H1b 0.770 1.880 3.435 14.979 14.227 1.053 possible 10574 166 S ILE CG1 9 C4H2b 0.770 1.880 4.344 25.789 24.187 1.066 possible 10575 166 S ILE CG2 10 C4H3u 0.770 1.880 39.538 -1.000 35.961 -1.000 bad 10576 166 S ILE CD1 10 C4H3u 0.770 1.880 39.757 -1.000 38.377 -1.000 bad 10577 167 S LEU N 12 N3H1s 0.700 1.640 2.818 13.574 13.655 0.994 [OK] 10578 167 S LEU CA 3 C4H1s 0.770 1.880 4.888 17.666 13.122 1.346 possible 10579 167 S LEU C 1 C3H0s 0.770 1.610 2.320 8.523 8.825 0.966 [OK] 10580 167 S LEU O 16 O1H0u 0.660 1.420 28.375 -1.000 16.208 -1.000 bad 10581 167 S LEU CB 8 C4H2s 0.770 1.880 4.381 24.328 22.951 1.060 possible 10582 167 S LEU CG 4 C4H1b 0.770 1.880 3.481 16.448 14.764 1.114 possible 10583 167 S LEU CD1 10 C4H3u 0.770 1.880 7.229 91.271 37.425 2.439 possible 10584 167 S LEU CD2 10 C4H3u 0.770 1.880 55.444 -1.000 37.143 -1.000 bad 10585 168 S MET N 12 N3H1s 0.700 1.640 2.423 11.981 13.564 0.883 [OK] 10586 168 S MET CA 3 C4H1s 0.770 1.880 5.587 17.942 13.231 1.356 possible 10587 168 S MET C 1 C3H0s 0.770 1.610 4.362 12.027 8.782 1.369 possible 10588 168 S MET O 16 O1H0u 0.660 1.420 12.983 -1.000 16.277 -1.000 bad 10589 168 S MET CB 8 C4H2s 0.770 1.880 3.096 24.701 23.645 1.045 possible 10590 168 S MET CG 9 C4H2b 0.770 1.880 4.828 28.444 24.009 1.185 possible 10591 168 S MET SD 19 S2H0u 1.040 1.770 2.933 29.494 30.093 0.980 [OK] 10592 168 S MET CE 10 C4H3u 0.770 1.880 6.305 77.675 37.161 2.090 possible 10593 169 S GLY N 12 N3H1s 0.700 1.640 4.055 15.005 14.854 1.010 possible 10594 169 S GLY CA 8 C4H2s 0.770 1.880 23.272 -1.000 23.688 -1.000 bad 10595 169 S GLY C 2 C3H0b 0.770 1.610 2.547 9.056 9.840 0.920 [OK] 10596 169 S GLY O 16 O1H0u 0.660 1.420 11.732 -1.000 16.391 -1.000 bad 10597 170 S SER N 12 N3H1s 0.700 1.640 2.572 13.349 14.103 0.947 [OK] 10598 170 S SER CA 3 C4H1s 0.770 1.880 2.494 12.506 13.476 0.928 [OK] 10599 170 S SER C 1 C3H0s 0.770 1.610 2.272 8.274 8.923 0.927 [OK] 10600 170 S SER O 16 O1H0u 0.660 1.420 2.372 16.061 16.179 0.993 [OK] 10601 170 S SER CB 8 C4H2s 0.770 1.880 3.547 22.324 23.884 0.935 possible 10602 170 S SER OG 17 O2H1u 0.660 1.460 3.554 25.788 18.732 1.377 possible 10603 171 S TRP N 12 N3H1s 0.700 1.640 2.362 12.651 13.791 0.917 [OK] 10604 171 S TRP CA 3 C4H1s 0.770 1.880 2.740 13.102 13.377 0.979 [OK] 10605 171 S TRP C 1 C3H0s 0.770 1.610 2.406 8.643 8.724 0.991 [OK] 10606 171 S TRP O 16 O1H0u 0.660 1.420 2.364 16.205 15.951 1.016 [OK] 10607 171 S TRP CB 8 C4H2s 0.770 1.880 2.828 23.091 24.004 0.962 [OK] 10608 171 S TRP CG 2 C3H0b 0.770 1.610 2.406 9.650 9.965 0.968 [OK] 10609 171 S TRP CD1 5 C3H1s 0.770 1.760 3.019 22.164 20.874 1.062 possible 10610 171 S TRP CD2 2 C3H0b 0.770 1.610 2.785 9.908 10.097 0.981 [OK] 10611 171 S TRP NE1 13 N3H1b 0.700 1.640 2.548 16.152 16.969 0.952 [OK] 10612 171 S TRP CE2 2 C3H0b 0.770 1.610 2.785 9.684 9.889 0.979 [OK] 10613 171 S TRP CE3 6 C3H1b 0.770 1.760 3.067 22.753 20.448 1.113 possible 10614 171 S TRP CZ2 6 C3H1b 0.770 1.760 4.610 35.174 21.012 1.674 possible 10615 171 S TRP CZ3 6 C3H1b 0.770 1.760 3.503 26.505 21.516 1.232 possible 10616 171 S TRP CH2 6 C3H1b 0.770 1.760 5.017 38.387 21.339 1.799 possible 10617 172 S SER N 12 N3H1s 0.700 1.640 2.457 13.227 14.103 0.938 [OK] 10618 172 S SER CA 3 C4H1s 0.770 1.880 2.732 13.760 13.476 1.021 [OK] 10619 172 S SER C 1 C3H0s 0.770 1.610 2.365 8.672 8.923 0.972 [OK] 10620 172 S SER O 16 O1H0u 0.660 1.420 3.140 22.914 16.179 1.416 possible 10621 172 S SER CB 8 C4H2s 0.770 1.880 3.423 24.858 23.884 1.041 possible 10622 172 S SER OG 17 O2H1u 0.660 1.460 2.972 17.859 18.732 0.953 [OK] 10623 173 S GLU N 12 N3H1s 0.700 1.640 2.458 13.880 13.615 1.019 [OK] 10624 173 S GLU CA 3 C4H1s 0.770 1.880 3.523 15.818 13.399 1.181 possible 10625 173 S GLU C 1 C3H0s 0.770 1.610 2.678 9.263 8.675 1.068 [OK] 10626 173 S GLU O 16 O1H0u 0.660 1.420 2.877 15.428 16.023 0.963 [OK] 10627 173 S GLU CB 8 C4H2s 0.770 1.880 3.048 22.588 23.529 0.960 possible 10628 173 S GLU CG 8 C4H2s 0.770 1.880 2.899 25.713 23.513 1.094 [OK] 10629 173 S GLU CD 2 C3H0b 0.770 1.610 3.211 9.455 9.460 1.000 possible 10630 173 S GLU OE1 16 O1H0u 0.660 1.420 3.396 21.365 15.999 1.335 possible 10631 173 S GLU OE2 16 O1H0u 0.660 1.420 7.943 66.433 17.432 3.811 possible 10632 174 S ALA N 12 N3H1s 0.700 1.640 2.537 13.507 14.046 0.962 [OK] 10633 174 S ALA CA 4 C4H1b 0.770 1.880 2.901 13.689 14.063 0.973 [OK] 10634 174 S ALA C 1 C3H0s 0.770 1.610 2.698 10.045 8.900 1.129 [OK] 10635 174 S ALA O 16 O1H0u 0.660 1.420 3.061 20.580 16.188 1.271 possible 10636 174 S ALA CB 10 C4H3u 0.770 1.880 2.844 32.944 36.782 0.896 [OK] 10637 175 S VAL N 12 N3H1s 0.700 1.640 2.714 13.822 13.676 1.011 [OK] 10638 175 S VAL CA 3 C4H1s 0.770 1.880 2.468 12.168 13.123 0.927 [OK] 10639 175 S VAL C 1 C3H0s 0.770 1.610 2.515 9.319 8.563 1.088 [OK] 10640 175 S VAL O 16 O1H0u 0.660 1.420 3.046 19.198 16.181 1.186 possible 10641 175 S VAL CB 4 C4H1b 0.770 1.880 4.152 22.118 14.598 1.515 possible 10642 175 S VAL CG1 10 C4H3u 0.770 1.880 4.101 41.190 36.584 1.126 possible 10643 175 S VAL CG2 10 C4H3u 0.770 1.880 3.647 40.305 36.332 1.109 possible 10644 176 S PRO N 11 N3H0u 0.700 1.640 2.536 8.506 8.823 0.964 [OK] 10645 176 S PRO CA 4 C4H1b 0.770 1.880 2.502 13.122 13.955 0.940 [OK] 10646 176 S PRO C 1 C3H0s 0.770 1.610 2.670 9.906 8.812 1.124 [OK] 10647 176 S PRO O 16 O1H0u 0.660 1.420 3.843 27.427 16.169 1.696 possible 10648 176 S PRO CB 9 C4H2b 0.770 1.880 2.763 23.713 25.563 0.928 [OK] 10649 176 S PRO CG 9 C4H2b 0.770 1.880 4.401 32.733 25.832 1.267 possible 10650 176 S PRO CD 8 C4H2s 0.770 1.880 3.667 27.391 23.836 1.149 possible 10651 177 S TYR N 12 N3H1s 0.700 1.640 2.584 14.470 13.691 1.057 [OK] 10652 177 S TYR CA 3 C4H1s 0.770 1.880 4.519 17.107 13.330 1.283 possible 10653 177 S TYR C 1 C3H0s 0.770 1.610 3.682 10.885 8.770 1.241 possible 10654 177 S TYR O 16 O1H0u 0.660 1.420 2.681 16.601 16.124 1.030 [OK] 10655 177 S TYR CB 8 C4H2s 0.770 1.880 4.308 26.224 23.678 1.108 possible 10656 177 S TYR CG 2 C3H0b 0.770 1.610 2.781 9.352 9.732 0.961 [OK] 10657 177 S TYR CD1 5 C3H1s 0.770 1.760 4.370 36.255 20.171 1.797 possible 10658 177 S TYR CD2 5 C3H1s 0.770 1.760 2.871 19.969 20.728 0.963 [OK] 10659 177 S TYR CE1 5 C3H1s 0.770 1.760 3.962 32.015 20.675 1.548 possible 10660 177 S TYR CE2 5 C3H1s 0.770 1.760 2.856 20.280 20.810 0.975 [OK] 10661 177 S TYR CZ 2 C3H0b 0.770 1.610 2.789 11.653 9.926 1.174 [OK] 10662 177 S TYR OH 17 O2H1u 0.660 1.460 3.167 25.224 19.173 1.316 possible 10663 178 S GLY N 12 N3H1s 0.700 1.640 4.325 27.649 14.854 1.861 possible 10664 178 S GLY CA 8 C4H2s 0.770 1.880 4.299 25.713 23.688 1.085 possible 10665 178 S GLY C 2 C3H0b 0.770 1.610 3.691 11.653 9.840 1.184 possible 10666 178 S GLY O 16 O1H0u 0.660 1.420 3.867 22.205 16.391 1.355 possible 10667 179 S ILE N 12 N3H1s 0.700 1.640 3.466 15.015 13.633 1.101 possible 10668 179 S ILE CA 3 C4H1s 0.770 1.880 3.337 14.601 13.007 1.123 possible 10669 179 S ILE C 1 C3H0s 0.770 1.610 2.540 8.139 8.470 0.961 [OK] 10670 179 S ILE O 16 O1H0u 0.660 1.420 2.488 16.279 16.144 1.008 [OK] 10671 179 S ILE CB 4 C4H1b 0.770 1.880 2.601 13.338 14.227 0.938 [OK] 10672 179 S ILE CG1 9 C4H2b 0.770 1.880 4.177 32.728 24.187 1.353 possible 10673 179 S ILE CG2 10 C4H3u 0.770 1.880 3.885 40.292 35.961 1.120 possible 10674 179 S ILE CD1 10 C4H3u 0.770 1.880 5.617 109.638 38.377 2.857 possible 10675 180 S PHE N 12 N3H1s 0.700 1.640 2.384 13.322 13.691 0.973 [OK] 10676 180 S PHE CA 3 C4H1s 0.770 1.880 2.957 13.411 13.449 0.997 [OK] 10677 180 S PHE C 1 C3H0s 0.770 1.610 2.651 8.799 8.753 1.005 [OK] 10678 180 S PHE O 16 O1H0u 0.660 1.420 2.539 15.642 16.151 0.969 [OK] 10679 180 S PHE CB 8 C4H2s 0.770 1.880 3.683 25.737 23.777 1.082 possible 10680 180 S PHE CG 2 C3H0b 0.770 1.610 2.412 9.514 9.721 0.979 [OK] 10681 180 S PHE CD1 5 C3H1s 0.770 1.760 2.820 20.632 20.405 1.011 [OK] 10682 180 S PHE CD2 6 C3H1b 0.770 1.760 3.107 21.755 21.051 1.033 possible 10683 180 S PHE CE1 6 C3H1b 0.770 1.760 3.287 24.577 21.580 1.139 possible 10684 180 S PHE CE2 6 C3H1b 0.770 1.760 3.193 24.085 21.680 1.111 possible 10685 180 S PHE CZ 6 C3H1b 0.770 1.760 3.568 23.064 21.666 1.065 possible 10686 181 S SER N 12 N3H1s 0.700 1.640 3.375 14.440 14.103 1.024 possible 10687 181 S SER CA 3 C4H1s 0.770 1.880 3.573 16.319 13.476 1.211 possible 10688 181 S SER C 1 C3H0s 0.770 1.610 2.098 8.093 8.923 0.907 [OK] 10689 181 S SER O 16 O1H0u 0.660 1.420 4.324 20.139 16.179 1.245 possible 10690 181 S SER CB 8 C4H2s 0.770 1.880 5.326 42.351 23.884 1.773 possible 10691 181 S SER OG 17 O2H1u 0.660 1.460 2.456 18.045 18.732 0.963 [OK] 10692 182 S HIS N 12 N3H1s 0.700 1.640 2.662 14.249 13.715 1.039 [OK] 10693 182 S HIS CA 3 C4H1s 0.770 1.880 2.654 14.392 13.467 1.069 [OK] 10694 182 S HIS C 1 C3H0s 0.770 1.610 2.653 8.665 8.882 0.976 [OK] 10695 182 S HIS O 16 O1H0u 0.660 1.420 2.513 17.199 16.082 1.069 [OK] 10696 182 S HIS CB 8 C4H2s 0.770 1.880 4.016 27.769 23.653 1.174 possible 10697 182 S HIS CG 2 C3H0b 0.770 1.610 4.181 13.609 9.952 1.367 possible 10698 182 S HIS ND1 13 N3H1b 0.700 1.640 4.031 18.449 15.506 1.190 possible 10699 182 S HIS CD2 5 C3H1s 0.770 1.760 4.195 27.775 21.085 1.317 possible 10700 182 S HIS CE1 5 C3H1s 0.770 1.760 3.939 26.478 20.636 1.283 possible 10701 182 S HIS NE2 13 N3H1b 0.700 1.640 3.486 11.958 15.337 0.780 possible 10702 183 S LEU N 12 N3H1s 0.700 1.640 2.542 12.725 13.655 0.932 [OK] 10703 183 S LEU CA 3 C4H1s 0.770 1.880 2.935 13.897 13.122 1.059 [OK] 10704 183 S LEU C 1 C3H0s 0.770 1.610 2.562 8.727 8.825 0.989 [OK] 10705 183 S LEU O 16 O1H0u 0.660 1.420 2.191 14.450 16.208 0.892 [OK] 10706 183 S LEU CB 8 C4H2s 0.770 1.880 3.019 23.265 22.951 1.014 possible 10707 183 S LEU CG 4 C4H1b 0.770 1.880 2.797 13.696 14.764 0.928 [OK] 10708 183 S LEU CD1 10 C4H3u 0.770 1.880 3.131 41.260 37.425 1.102 possible 10709 183 S LEU CD2 10 C4H3u 0.770 1.880 3.079 34.379 37.143 0.926 possible 10710 184 S ASP N 12 N3H1s 0.700 1.640 2.739 13.148 13.895 0.946 [OK] 10711 184 S ASP CA 3 C4H1s 0.770 1.880 2.619 13.787 13.377 1.031 [OK] 10712 184 S ASP C 1 C3H0s 0.770 1.610 4.008 9.050 8.816 1.027 possible 10713 184 S ASP O 16 O1H0u 0.660 1.420 3.672 16.978 16.091 1.055 possible 10714 184 S ASP CB 8 C4H2s 0.770 1.880 7.888 65.178 23.481 2.776 possible 10715 184 S ASP CG 2 C3H0b 0.770 1.610 4.286 12.493 9.422 1.326 possible 10716 184 S ASP OD1 16 O1H0u 0.660 1.420 3.900 21.552 15.505 1.390 possible 10717 184 S ASP OD2 16 O1H0u 0.660 1.420 21.036 -1.000 16.324 -1.000 bad 10718 185 S TRP N 12 N3H1s 0.700 1.640 5.198 17.464 13.791 1.266 possible 10719 185 S TRP CA 3 C4H1s 0.770 1.880 5.824 22.168 13.377 1.657 possible 10720 185 S TRP C 1 C3H0s 0.770 1.610 1.991 7.710 8.724 0.884 [OK] 10721 185 S TRP O 16 O1H0u 0.660 1.420 2.318 13.592 15.951 0.852 [OK] 10722 185 S TRP CB 8 C4H2s 0.770 1.880 4.841 25.618 24.004 1.067 possible 10723 185 S TRP CG 2 C3H0b 0.770 1.610 2.252 9.471 9.965 0.950 [OK] 10724 185 S TRP CD1 5 C3H1s 0.770 1.760 5.199 39.347 20.874 1.885 possible 10725 185 S TRP CD2 2 C3H0b 0.770 1.610 2.488 10.014 10.097 0.992 [OK] 10726 185 S TRP NE1 13 N3H1b 0.700 1.640 3.233 21.840 16.969 1.287 possible 10727 185 S TRP CE2 2 C3H0b 0.770 1.610 2.581 10.461 9.889 1.058 [OK] 10728 185 S TRP CE3 6 C3H1b 0.770 1.760 2.865 21.113 20.448 1.032 [OK] 10729 185 S TRP CZ2 6 C3H1b 0.770 1.760 2.802 20.714 21.012 0.986 [OK] 10730 185 S TRP CZ3 6 C3H1b 0.770 1.760 3.112 23.717 21.516 1.102 possible 10731 185 S TRP CH2 6 C3H1b 0.770 1.760 3.110 22.798 21.339 1.068 possible 10732 186 S THR N 12 N3H1s 0.700 1.640 2.327 12.317 13.832 0.890 [OK] 10733 186 S THR CA 3 C4H1s 0.770 1.880 2.773 13.502 13.099 1.031 [OK] 10734 186 S THR C 1 C3H0s 0.770 1.610 2.304 8.106 8.738 0.928 [OK] 10735 186 S THR O 16 O1H0u 0.660 1.420 2.387 15.749 16.020 0.983 [OK] 10736 186 S THR CB 4 C4H1b 0.770 1.880 2.954 13.535 14.829 0.913 [OK] 10737 186 S THR OG1 17 O2H1u 0.660 1.460 2.635 20.078 18.123 1.108 [OK] 10738 186 S THR CG2 10 C4H3u 0.770 1.880 2.818 32.198 36.542 0.881 [OK] 10739 187 S ASN N 12 N3H1s 0.700 1.640 2.330 13.312 13.695 0.972 [OK] 10740 187 S ASN CA 3 C4H1s 0.770 1.880 2.605 12.416 13.167 0.943 [OK] 10741 187 S ASN C 1 C3H0s 0.770 1.610 2.344 8.156 8.928 0.914 [OK] 10742 187 S ASN O 16 O1H0u 0.660 1.420 2.406 15.806 16.199 0.976 [OK] 10743 187 S ASN CB 8 C4H2s 0.770 1.880 2.789 22.753 23.128 0.984 [OK] 10744 187 S ASN CG 2 C3H0b 0.770 1.610 2.444 9.657 9.599 1.006 [OK] 10745 187 S ASN OD1 16 O1H0u 0.660 1.420 2.647 17.858 16.664 1.072 [OK] 10746 187 S ASN ND2 15 N3H2u 0.700 1.640 3.289 28.106 23.083 1.218 possible 10747 188 S ASN N 12 N3H1s 0.700 1.640 2.725 13.268 13.695 0.969 [OK] 10748 188 S ASN CA 3 C4H1s 0.770 1.880 3.168 14.287 13.167 1.085 possible 10749 188 S ASN C 1 C3H0s 0.770 1.610 2.459 8.250 8.928 0.924 [OK] 10750 188 S ASN O 16 O1H0u 0.660 1.420 2.689 14.758 16.199 0.911 [OK] 10751 188 S ASN CB 8 C4H2s 0.770 1.880 4.806 30.139 23.128 1.303 possible 10752 188 S ASN CG 2 C3H0b 0.770 1.610 6.497 16.505 9.599 1.719 possible 10753 188 S ASN OD1 16 O1H0u 0.660 1.420 31.777 -1.000 16.664 -1.000 bad 10754 188 S ASN ND2 15 N3H2u 0.700 1.640 22.319 -1.000 23.083 -1.000 bad 10755 189 S PHE N 12 N3H1s 0.700 1.640 2.441 12.093 13.691 0.883 [OK] 10756 189 S PHE CA 3 C4H1s 0.770 1.880 3.069 16.290 13.449 1.211 possible 10757 189 S PHE C 1 C3H0s 0.770 1.610 2.375 8.270 8.753 0.945 [OK] 10758 189 S PHE O 16 O1H0u 0.660 1.420 2.436 15.269 16.151 0.945 [OK] 10759 189 S PHE CB 8 C4H2s 0.770 1.880 2.853 22.721 23.777 0.956 [OK] 10760 189 S PHE CG 2 C3H0b 0.770 1.610 2.996 10.124 9.721 1.041 [OK] 10761 189 S PHE CD1 5 C3H1s 0.770 1.760 3.155 19.195 20.405 0.941 possible 10762 189 S PHE CD2 6 C3H1b 0.770 1.760 3.107 20.394 21.051 0.969 possible 10763 189 S PHE CE1 6 C3H1b 0.770 1.760 3.167 20.818 21.580 0.965 possible 10764 189 S PHE CE2 6 C3H1b 0.770 1.760 3.122 20.143 21.680 0.929 possible 10765 189 S PHE CZ 6 C3H1b 0.770 1.760 3.157 19.749 21.666 0.912 possible 10766 190 S SER N 12 N3H1s 0.700 1.640 2.555 14.497 14.103 1.028 [OK] 10767 190 S SER CA 3 C4H1s 0.770 1.880 2.876 14.340 13.476 1.064 [OK] 10768 190 S SER C 1 C3H0s 0.770 1.610 2.525 8.857 8.923 0.993 [OK] 10769 190 S SER O 16 O1H0u 0.660 1.420 2.657 15.920 16.179 0.984 [OK] 10770 190 S SER CB 8 C4H2s 0.770 1.880 2.851 23.265 23.884 0.974 [OK] 10771 190 S SER OG 17 O2H1u 0.660 1.460 2.376 17.258 18.732 0.921 [OK] 10772 191 S LEU N 12 N3H1s 0.700 1.640 2.507 13.463 13.655 0.986 [OK] 10773 191 S LEU CA 3 C4H1s 0.770 1.880 3.381 13.665 13.122 1.041 possible 10774 191 S LEU C 1 C3H0s 0.770 1.610 4.519 10.103 8.825 1.145 possible 10775 191 S LEU O 16 O1H0u 0.660 1.420 13.609 -1.000 16.208 -1.000 bad 10776 191 S LEU CB 8 C4H2s 0.770 1.880 8.925 -1.000 22.951 -1.000 bad 10777 191 S LEU CG 4 C4H1b 0.770 1.880 15.332 -1.000 14.764 -1.000 bad 10778 191 S LEU CD1 10 C4H3u 0.770 1.880 11.193 -1.000 37.425 -1.000 bad 10779 191 S LEU CD2 10 C4H3u 0.770 1.880 19.494 -1.000 37.143 -1.000 bad 10780 192 S VAL N 12 N3H1s 0.700 1.640 3.697 14.037 13.676 1.026 possible 10781 192 S VAL CA 3 C4H1s 0.770 1.880 7.894 -1.000 13.123 -1.000 bad 10782 192 S VAL C 1 C3H0s 0.770 1.610 2.417 8.707 8.563 1.017 [OK] 10783 192 S VAL O 16 O1H0u 0.660 1.420 9.389 -1.000 16.181 -1.000 bad 10784 192 S VAL CB 4 C4H1b 0.770 1.880 3.123 16.480 14.598 1.129 possible 10785 192 S VAL CG1 10 C4H3u 0.770 1.880 21.529 -1.000 36.584 -1.000 bad 10786 192 S VAL CG2 10 C4H3u 0.770 1.880 28.982 -1.000 36.332 -1.000 bad 10787 193 S HIS N 12 N3H1s 0.700 1.640 2.200 12.214 13.715 0.891 [OK] 10788 193 S HIS CA 3 C4H1s 0.770 1.880 2.490 11.661 13.467 0.866 [OK] 10789 193 S HIS C 1 C3H0s 0.770 1.610 2.765 9.804 8.882 1.104 [OK] 10790 193 S HIS O 16 O1H0u 0.660 1.420 2.689 16.713 16.082 1.039 [OK] 10791 193 S HIS CB 8 C4H2s 0.770 1.880 3.146 28.029 23.653 1.185 possible 10792 193 S HIS CG 2 C3H0b 0.770 1.610 2.575 9.923 9.952 0.997 [OK] 10793 193 S HIS ND1 13 N3H1b 0.700 1.640 2.744 15.211 15.506 0.981 [OK] 10794 193 S HIS CD2 5 C3H1s 0.770 1.760 2.822 21.571 21.085 1.023 [OK] 10795 193 S HIS CE1 5 C3H1s 0.770 1.760 2.723 17.752 20.636 0.860 [OK] 10796 193 S HIS NE2 13 N3H1b 0.700 1.640 2.476 14.365 15.337 0.937 [OK] 10797 194 S GLY N 12 N3H1s 0.700 1.640 3.618 18.666 14.854 1.257 possible 10798 194 S GLY CA 8 C4H2s 0.770 1.880 3.993 28.336 23.688 1.196 possible 10799 194 S GLY C 2 C3H0b 0.770 1.610 2.503 9.390 9.840 0.954 [OK] 10800 194 S GLY O 16 O1H0u 0.660 1.420 2.413 15.839 16.391 0.966 [OK] 10801 195 S ASN N 12 N3H1s 0.700 1.640 2.807 13.747 13.695 1.004 [OK] 10802 195 S ASN CA 3 C4H1s 0.770 1.880 2.732 13.723 13.167 1.042 [OK] 10803 195 S ASN C 1 C3H0s 0.770 1.610 2.834 9.212 8.928 1.032 [OK] 10804 195 S ASN O 16 O1H0u 0.660 1.420 2.495 16.320 16.199 1.007 [OK] 10805 195 S ASN CB 8 C4H2s 0.770 1.880 2.665 19.059 23.128 0.824 [OK] 10806 195 S ASN CG 2 C3H0b 0.770 1.610 2.594 10.277 9.599 1.071 [OK] 10807 195 S ASN OD1 16 O1H0u 0.660 1.420 2.303 15.361 16.664 0.922 [OK] 10808 195 S ASN ND2 15 N3H2u 0.700 1.640 3.289 27.230 23.083 1.180 possible 10809 196 S LEU N 12 N3H1s 0.700 1.640 2.890 15.511 13.655 1.136 [OK] 10810 196 S LEU CA 3 C4H1s 0.770 1.880 2.924 13.840 13.122 1.055 [OK] 10811 196 S LEU C 1 C3H0s 0.770 1.610 2.634 9.139 8.825 1.036 [OK] 10812 196 S LEU O 16 O1H0u 0.660 1.420 2.408 15.148 16.208 0.935 [OK] 10813 196 S LEU CB 8 C4H2s 0.770 1.880 2.878 23.915 22.951 1.042 [OK] 10814 196 S LEU CG 4 C4H1b 0.770 1.880 3.047 16.426 14.764 1.113 possible 10815 196 S LEU CD1 10 C4H3u 0.770 1.880 3.050 32.802 37.425 0.876 possible 10816 196 S LEU CD2 10 C4H3u 0.770 1.880 3.152 38.100 37.143 1.026 possible 10817 197 S PHE N 12 N3H1s 0.700 1.640 2.666 14.439 13.691 1.055 [OK] 10818 197 S PHE CA 3 C4H1s 0.770 1.880 2.534 11.530 13.449 0.857 [OK] 10819 197 S PHE C 1 C3H0s 0.770 1.610 2.946 9.116 8.753 1.042 [OK] 10820 197 S PHE O 16 O1H0u 0.660 1.420 2.934 22.947 16.151 1.421 [OK] 10821 197 S PHE CB 8 C4H2s 0.770 1.880 3.681 29.319 23.777 1.233 possible 10822 197 S PHE CG 2 C3H0b 0.770 1.610 2.493 10.369 9.721 1.067 [OK] 10823 197 S PHE CD1 5 C3H1s 0.770 1.760 2.785 20.098 20.405 0.985 [OK] 10824 197 S PHE CD2 6 C3H1b 0.770 1.760 2.659 19.426 21.051 0.923 [OK] 10825 197 S PHE CE1 6 C3H1b 0.770 1.760 2.643 18.850 21.580 0.873 [OK] 10826 197 S PHE CE2 6 C3H1b 0.770 1.760 2.735 21.241 21.680 0.980 [OK] 10827 197 S PHE CZ 6 C3H1b 0.770 1.760 2.865 19.177 21.666 0.885 [OK] 10828 198 S TYR N 12 N3H1s 0.700 1.640 2.683 13.820 13.691 1.009 [OK] 10829 198 S TYR CA 3 C4H1s 0.770 1.880 3.509 15.268 13.330 1.145 possible 10830 198 S TYR C 1 C3H0s 0.770 1.610 3.068 10.343 8.770 1.179 possible 10831 198 S TYR O 16 O1H0u 0.660 1.420 3.736 30.341 16.124 1.882 possible 10832 198 S TYR CB 8 C4H2s 0.770 1.880 3.721 24.796 23.678 1.047 possible 10833 198 S TYR CG 2 C3H0b 0.770 1.610 2.717 9.930 9.732 1.020 [OK] 10834 198 S TYR CD1 5 C3H1s 0.770 1.760 4.107 32.709 20.171 1.622 possible 10835 198 S TYR CD2 5 C3H1s 0.770 1.760 2.846 18.611 20.728 0.898 [OK] 10836 198 S TYR CE1 5 C3H1s 0.770 1.760 5.503 49.308 20.675 2.385 possible 10837 198 S TYR CE2 5 C3H1s 0.770 1.760 3.171 21.324 20.810 1.025 possible 10838 198 S TYR CZ 2 C3H0b 0.770 1.610 3.248 11.867 9.926 1.196 possible 10839 198 S TYR OH 17 O2H1u 0.660 1.460 7.379 90.208 19.173 4.705 possible 10840 199 S ASN N 12 N3H1s 0.700 1.640 2.630 14.435 13.695 1.054 [OK] 10841 199 S ASN CA 3 C4H1s 0.770 1.880 2.422 12.097 13.167 0.919 [OK] 10842 199 S ASN C 1 C3H0s 0.770 1.610 3.082 9.143 8.928 1.024 possible 10843 199 S ASN O 16 O1H0u 0.660 1.420 2.937 18.908 16.199 1.167 [OK] 10844 199 S ASN CB 8 C4H2s 0.770 1.880 2.779 20.807 23.128 0.900 [OK] 10845 199 S ASN CG 2 C3H0b 0.770 1.610 2.514 9.770 9.599 1.018 [OK] 10846 199 S ASN OD1 16 O1H0u 0.660 1.420 2.601 16.936 16.664 1.016 [OK] 10847 199 S ASN ND2 15 N3H2u 0.700 1.640 2.905 25.670 23.083 1.112 [OK] 10848 200 S PRO N 11 N3H0u 0.700 1.640 3.512 10.084 8.823 1.143 possible 10849 200 S PRO CA 4 C4H1b 0.770 1.880 4.422 25.732 13.955 1.844 possible 10850 200 S PRO C 1 C3H0s 0.770 1.610 2.410 8.878 8.812 1.007 [OK] 10851 200 S PRO O 16 O1H0u 0.660 1.420 3.951 22.794 16.169 1.410 possible 10852 200 S PRO CB 9 C4H2b 0.770 1.880 5.422 55.008 25.563 2.152 possible 10853 200 S PRO CG 9 C4H2b 0.770 1.880 3.383 30.407 25.832 1.177 possible 10854 200 S PRO CD 8 C4H2s 0.770 1.880 3.836 23.996 23.836 1.007 possible 10855 201 S PHE N 12 N3H1s 0.700 1.640 2.503 12.628 13.691 0.922 [OK] 10856 201 S PHE CA 3 C4H1s 0.770 1.880 2.653 13.183 13.449 0.980 [OK] 10857 201 S PHE C 1 C3H0s 0.770 1.610 2.727 9.054 8.753 1.034 [OK] 10858 201 S PHE O 16 O1H0u 0.660 1.420 2.477 15.925 16.151 0.986 [OK] 10859 201 S PHE CB 8 C4H2s 0.770 1.880 2.981 21.568 23.777 0.907 [OK] 10860 201 S PHE CG 2 C3H0b 0.770 1.610 2.475 10.071 9.721 1.036 [OK] 10861 201 S PHE CD1 5 C3H1s 0.770 1.760 2.599 19.741 20.405 0.967 [OK] 10862 201 S PHE CD2 6 C3H1b 0.770 1.760 3.249 23.599 21.051 1.121 possible 10863 201 S PHE CE1 6 C3H1b 0.770 1.760 3.418 23.968 21.580 1.111 possible 10864 201 S PHE CE2 6 C3H1b 0.770 1.760 3.246 22.579 21.680 1.041 possible 10865 201 S PHE CZ 6 C3H1b 0.770 1.760 3.353 21.085 21.666 0.973 possible 10866 202 S HIS N 12 N3H1s 0.700 1.640 2.827 14.989 13.715 1.093 [OK] 10867 202 S HIS CA 3 C4H1s 0.770 1.880 2.835 13.227 13.467 0.982 [OK] 10868 202 S HIS C 1 C3H0s 0.770 1.610 2.324 8.294 8.882 0.934 [OK] 10869 202 S HIS O 16 O1H0u 0.660 1.420 2.570 15.167 16.082 0.943 [OK] 10870 202 S HIS CB 8 C4H2s 0.770 1.880 3.134 24.149 23.653 1.021 possible 10871 202 S HIS CG 2 C3H0b 0.770 1.610 2.398 9.852 9.952 0.990 [OK] 10872 202 S HIS ND1 13 N3H1b 0.700 1.640 2.499 15.663 15.506 1.010 [OK] 10873 202 S HIS CD2 5 C3H1s 0.770 1.760 2.877 20.988 21.085 0.995 [OK] 10874 202 S HIS CE1 5 C3H1s 0.770 1.760 2.804 18.785 20.636 0.910 [OK] 10875 202 S HIS NE2 13 N3H1b 0.700 1.640 2.509 11.634 15.337 0.759 [OK] 10876 203 S GLY N 12 N3H1s 0.700 1.640 2.767 14.358 14.854 0.967 [OK] 10877 203 S GLY CA 8 C4H2s 0.770 1.880 3.289 24.535 23.688 1.036 possible 10878 203 S GLY C 2 C3H0b 0.770 1.610 3.598 10.545 9.840 1.072 possible 10879 203 S GLY O 16 O1H0u 0.660 1.420 3.563 19.809 16.391 1.209 possible 10880 204 S LEU N 12 N3H1s 0.700 1.640 3.594 15.512 13.655 1.136 possible 10881 204 S LEU CA 3 C4H1s 0.770 1.880 3.707 14.791 13.122 1.127 possible 10882 204 S LEU C 1 C3H0s 0.770 1.610 2.403 8.449 8.825 0.957 [OK] 10883 204 S LEU O 16 O1H0u 0.660 1.420 2.520 13.287 16.208 0.820 [OK] 10884 204 S LEU CB 8 C4H2s 0.770 1.880 2.715 20.302 22.951 0.885 [OK] 10885 204 S LEU CG 4 C4H1b 0.770 1.880 4.230 19.475 14.764 1.319 possible 10886 204 S LEU CD1 10 C4H3u 0.770 1.880 3.042 35.735 37.425 0.955 possible 10887 204 S LEU CD2 10 C4H3u 0.770 1.880 4.677 59.433 37.143 1.600 possible 10888 205 S SER N 12 N3H1s 0.700 1.640 2.297 12.592 14.103 0.893 [OK] 10889 205 S SER CA 3 C4H1s 0.770 1.880 2.767 14.356 13.476 1.065 [OK] 10890 205 S SER C 1 C3H0s 0.770 1.610 1.998 7.715 8.923 0.865 [OK] 10891 205 S SER O 16 O1H0u 0.660 1.420 2.211 14.861 16.179 0.919 [OK] 10892 205 S SER CB 8 C4H2s 0.770 1.880 3.023 22.660 23.884 0.949 possible 10893 205 S SER OG 17 O2H1u 0.660 1.460 2.605 19.167 18.732 1.023 [OK] 10894 206 S ILE N 12 N3H1s 0.700 1.640 2.420 12.107 13.633 0.888 [OK] 10895 206 S ILE CA 3 C4H1s 0.770 1.880 3.016 13.440 13.007 1.033 possible 10896 206 S ILE C 1 C3H0s 0.770 1.610 2.663 7.949 8.470 0.938 [OK] 10897 206 S ILE O 16 O1H0u 0.660 1.420 2.550 14.818 16.144 0.918 [OK] 10898 206 S ILE CB 4 C4H1b 0.770 1.880 2.707 13.518 14.227 0.950 [OK] 10899 206 S ILE CG1 9 C4H2b 0.770 1.880 2.938 20.052 24.187 0.829 [OK] 10900 206 S ILE CG2 10 C4H3u 0.770 1.880 3.052 30.769 35.961 0.856 possible 10901 206 S ILE CD1 10 C4H3u 0.770 1.880 2.732 29.240 38.377 0.762 [OK] 10902 207 S ALA N 12 N3H1s 0.700 1.640 2.817 14.048 14.046 1.000 [OK] 10903 207 S ALA CA 4 C4H1b 0.770 1.880 2.976 15.228 14.063 1.083 [OK] 10904 207 S ALA C 1 C3H0s 0.770 1.610 2.935 8.656 8.900 0.973 [OK] 10905 207 S ALA O 16 O1H0u 0.660 1.420 3.109 17.709 16.188 1.094 possible 10906 207 S ALA CB 10 C4H3u 0.770 1.880 4.984 67.464 36.782 1.834 possible 10907 208 S PHE N 12 N3H1s 0.700 1.640 2.507 12.309 13.691 0.899 [OK] 10908 208 S PHE CA 3 C4H1s 0.770 1.880 2.580 11.352 13.449 0.844 [OK] 10909 208 S PHE C 1 C3H0s 0.770 1.610 2.147 8.458 8.753 0.966 [OK] 10910 208 S PHE O 16 O1H0u 0.660 1.420 2.309 14.266 16.151 0.883 [OK] 10911 208 S PHE CB 8 C4H2s 0.770 1.880 2.705 22.061 23.777 0.928 [OK] 10912 208 S PHE CG 2 C3H0b 0.770 1.610 2.571 9.589 9.721 0.986 [OK] 10913 208 S PHE CD1 5 C3H1s 0.770 1.760 3.405 20.794 20.405 1.019 possible 10914 208 S PHE CD2 6 C3H1b 0.770 1.760 2.693 19.381 21.051 0.921 [OK] 10915 208 S PHE CE1 6 C3H1b 0.770 1.760 4.725 51.750 21.580 2.398 possible 10916 208 S PHE CE2 6 C3H1b 0.770 1.760 2.975 21.230 21.680 0.979 [OK] 10917 208 S PHE CZ 6 C3H1b 0.770 1.760 4.289 27.060 21.666 1.249 possible 10918 209 S LEU N 12 N3H1s 0.700 1.640 2.281 12.097 13.655 0.886 [OK] 10919 209 S LEU CA 3 C4H1s 0.770 1.880 2.854 13.607 13.122 1.037 [OK] 10920 209 S LEU C 1 C3H0s 0.770 1.610 2.488 8.316 8.825 0.942 [OK] 10921 209 S LEU O 16 O1H0u 0.660 1.420 2.427 15.971 16.208 0.985 [OK] 10922 209 S LEU CB 8 C4H2s 0.770 1.880 2.994 21.043 22.951 0.917 [OK] 10923 209 S LEU CG 4 C4H1b 0.770 1.880 2.947 16.036 14.764 1.086 [OK] 10924 209 S LEU CD1 10 C4H3u 0.770 1.880 3.258 43.648 37.425 1.166 possible 10925 209 S LEU CD2 10 C4H3u 0.770 1.880 3.019 38.495 37.143 1.036 possible 10926 210 S TYR N 12 N3H1s 0.700 1.640 2.544 12.750 13.691 0.931 [OK] 10927 210 S TYR CA 3 C4H1s 0.770 1.880 3.011 15.295 13.330 1.147 possible 10928 210 S TYR C 1 C3H0s 0.770 1.610 2.822 8.892 8.770 1.014 [OK] 10929 210 S TYR O 16 O1H0u 0.660 1.420 2.657 16.319 16.124 1.012 [OK] 10930 210 S TYR CB 8 C4H2s 0.770 1.880 3.089 22.523 23.678 0.951 possible 10931 210 S TYR CG 2 C3H0b 0.770 1.610 2.560 9.595 9.732 0.986 [OK] 10932 210 S TYR CD1 5 C3H1s 0.770 1.760 3.068 22.916 20.171 1.136 possible 10933 210 S TYR CD2 5 C3H1s 0.770 1.760 2.917 21.823 20.728 1.053 [OK] 10934 210 S TYR CE1 5 C3H1s 0.770 1.760 3.034 20.771 20.675 1.005 possible 10935 210 S TYR CE2 5 C3H1s 0.770 1.760 2.914 20.518 20.810 0.986 [OK] 10936 210 S TYR CZ 2 C3H0b 0.770 1.610 2.572 9.581 9.926 0.965 [OK] 10937 210 S TYR OH 17 O2H1u 0.660 1.460 2.449 17.301 19.173 0.902 [OK] 10938 211 S GLY N 12 N3H1s 0.700 1.640 2.621 13.133 14.854 0.884 [OK] 10939 211 S GLY CA 8 C4H2s 0.770 1.880 3.161 23.890 23.688 1.009 possible 10940 211 S GLY C 2 C3H0b 0.770 1.610 2.078 8.469 9.840 0.861 [OK] 10941 211 S GLY O 16 O1H0u 0.660 1.420 2.712 16.281 16.391 0.993 [OK] 10942 212 S SER N 12 N3H1s 0.700 1.640 2.137 11.855 14.103 0.841 [OK] 10943 212 S SER CA 3 C4H1s 0.770 1.880 2.628 12.097 13.476 0.898 [OK] 10944 212 S SER C 1 C3H0s 0.770 1.610 2.131 8.132 8.923 0.911 [OK] 10945 212 S SER O 16 O1H0u 0.660 1.420 2.348 15.217 16.179 0.941 [OK] 10946 212 S SER CB 8 C4H2s 0.770 1.880 2.842 23.187 23.884 0.971 [OK] 10947 212 S SER OG 17 O2H1u 0.660 1.460 2.483 19.279 18.732 1.029 [OK] 10948 213 S ALA N 12 N3H1s 0.700 1.640 2.223 12.208 14.046 0.869 [OK] 10949 213 S ALA CA 4 C4H1b 0.770 1.880 2.553 12.024 14.063 0.855 [OK] 10950 213 S ALA C 1 C3H0s 0.770 1.610 2.265 8.573 8.900 0.963 [OK] 10951 213 S ALA O 16 O1H0u 0.660 1.420 2.439 15.559 16.188 0.961 [OK] 10952 213 S ALA CB 10 C4H3u 0.770 1.880 3.190 38.088 36.782 1.036 possible 10953 214 S LEU N 12 N3H1s 0.700 1.640 2.310 12.668 13.655 0.928 [OK] 10954 214 S LEU CA 3 C4H1s 0.770 1.880 2.534 13.099 13.122 0.998 [OK] 10955 214 S LEU C 1 C3H0s 0.770 1.610 2.238 8.031 8.825 0.910 [OK] 10956 214 S LEU O 16 O1H0u 0.660 1.420 2.226 14.977 16.208 0.924 [OK] 10957 214 S LEU CB 8 C4H2s 0.770 1.880 3.194 23.581 22.951 1.027 possible 10958 214 S LEU CG 4 C4H1b 0.770 1.880 3.049 14.516 14.764 0.983 possible 10959 214 S LEU CD1 10 C4H3u 0.770 1.880 3.116 31.865 37.425 0.851 possible 10960 214 S LEU CD2 10 C4H3u 0.770 1.880 3.284 37.928 37.143 1.021 possible 10961 215 S LEU N 12 N3H1s 0.700 1.640 2.771 13.679 13.655 1.002 [OK] 10962 215 S LEU CA 3 C4H1s 0.770 1.880 3.018 13.445 13.122 1.025 possible 10963 215 S LEU C 1 C3H0s 0.770 1.610 2.552 8.473 8.825 0.960 [OK] 10964 215 S LEU O 16 O1H0u 0.660 1.420 2.668 15.065 16.208 0.929 [OK] 10965 215 S LEU CB 8 C4H2s 0.770 1.880 3.153 24.156 22.951 1.052 possible 10966 215 S LEU CG 4 C4H1b 0.770 1.880 3.401 18.708 14.764 1.267 possible 10967 215 S LEU CD1 10 C4H3u 0.770 1.880 2.986 35.536 37.425 0.950 [OK] 10968 215 S LEU CD2 10 C4H3u 0.770 1.880 3.353 36.485 37.143 0.982 possible 10969 216 S PHE N 12 N3H1s 0.700 1.640 2.520 14.383 13.691 1.051 [OK] 10970 216 S PHE CA 3 C4H1s 0.770 1.880 2.940 12.818 13.449 0.953 [OK] 10971 216 S PHE C 1 C3H0s 0.770 1.610 2.523 8.668 8.753 0.990 [OK] 10972 216 S PHE O 16 O1H0u 0.660 1.420 2.411 16.648 16.151 1.031 [OK] 10973 216 S PHE CB 8 C4H2s 0.770 1.880 2.791 22.644 23.777 0.952 [OK] 10974 216 S PHE CG 2 C3H0b 0.770 1.610 2.381 9.465 9.721 0.974 [OK] 10975 216 S PHE CD1 5 C3H1s 0.770 1.760 2.868 20.428 20.405 1.001 [OK] 10976 216 S PHE CD2 6 C3H1b 0.770 1.760 2.876 19.720 21.051 0.937 [OK] 10977 216 S PHE CE1 6 C3H1b 0.770 1.760 2.977 25.372 21.580 1.176 [OK] 10978 216 S PHE CE2 6 C3H1b 0.770 1.760 2.983 20.447 21.680 0.943 [OK] 10979 216 S PHE CZ 6 C3H1b 0.770 1.760 2.844 20.684 21.666 0.955 [OK] 10980 217 S ALA N 12 N3H1s 0.700 1.640 2.553 13.573 14.046 0.966 [OK] 10981 217 S ALA CA 4 C4H1b 0.770 1.880 2.799 15.061 14.063 1.071 [OK] 10982 217 S ALA C 1 C3H0s 0.770 1.610 2.355 8.304 8.900 0.933 [OK] 10983 217 S ALA O 16 O1H0u 0.660 1.420 2.727 17.142 16.188 1.059 [OK] 10984 217 S ALA CB 10 C4H3u 0.770 1.880 2.982 33.754 36.782 0.918 [OK] 10985 218 S MET N 12 N3H1s 0.700 1.640 2.429 12.857 13.564 0.948 [OK] 10986 218 S MET CA 3 C4H1s 0.770 1.880 3.179 16.403 13.231 1.240 possible 10987 218 S MET C 1 C3H0s 0.770 1.610 2.377 8.458 8.782 0.963 [OK] 10988 218 S MET O 16 O1H0u 0.660 1.420 2.520 15.413 16.277 0.947 [OK] 10989 218 S MET CB 8 C4H2s 0.770 1.880 2.632 19.607 23.645 0.829 [OK] 10990 218 S MET CG 9 C4H2b 0.770 1.880 2.971 23.728 24.009 0.988 [OK] 10991 218 S MET SD 19 S2H0u 1.040 1.770 2.907 28.496 30.093 0.947 [OK] 10992 218 S MET CE 10 C4H3u 0.770 1.880 2.875 34.034 37.161 0.916 [OK] 10993 219 S HIS N 12 N3H1s 0.700 1.640 2.488 12.491 13.715 0.911 [OK] 10994 219 S HIS CA 3 C4H1s 0.770 1.880 2.444 11.739 13.467 0.872 [OK] 10995 219 S HIS C 1 C3H0s 0.770 1.610 2.371 8.330 8.882 0.938 [OK] 10996 219 S HIS O 16 O1H0u 0.660 1.420 2.437 15.171 16.082 0.943 [OK] 10997 219 S HIS CB 8 C4H2s 0.770 1.880 3.401 29.282 23.653 1.238 possible 10998 219 S HIS CG 2 C3H0b 0.770 1.610 3.079 10.542 9.952 1.059 possible 10999 219 S HIS ND1 13 N3H1b 0.700 1.640 2.527 14.415 15.506 0.930 [OK] 11000 219 S HIS CD2 5 C3H1s 0.770 1.760 3.212 27.921 21.085 1.324 possible 11001 219 S HIS CE1 5 C3H1s 0.770 1.760 2.851 17.787 20.636 0.862 [OK] 11002 219 S HIS NE2 13 N3H1b 0.700 1.640 3.030 12.225 15.337 0.797 possible 11003 220 S GLY N 12 N3H1s 0.700 1.640 2.624 14.891 14.854 1.002 [OK] 11004 220 S GLY CA 8 C4H2s 0.770 1.880 2.891 26.584 23.688 1.122 [OK] 11005 220 S GLY C 2 C3H0b 0.770 1.610 2.595 9.525 9.840 0.968 [OK] 11006 220 S GLY O 16 O1H0u 0.660 1.420 2.476 16.708 16.391 1.019 [OK] 11007 221 S ALA N 12 N3H1s 0.700 1.640 2.672 14.124 14.046 1.006 [OK] 11008 221 S ALA CA 4 C4H1b 0.770 1.880 2.805 14.501 14.063 1.031 [OK] 11009 221 S ALA C 1 C3H0s 0.770 1.610 2.259 8.319 8.900 0.935 [OK] 11010 221 S ALA O 16 O1H0u 0.660 1.420 2.395 14.396 16.188 0.889 [OK] 11011 221 S ALA CB 10 C4H3u 0.770 1.880 3.179 33.061 36.782 0.899 possible 11012 222 S THR N 12 N3H1s 0.700 1.640 2.268 12.337 13.832 0.892 [OK] 11013 222 S THR CA 3 C4H1s 0.770 1.880 3.071 13.648 13.099 1.042 possible 11014 222 S THR C 1 C3H0s 0.770 1.610 2.580 8.153 8.738 0.933 [OK] 11015 222 S THR O 16 O1H0u 0.660 1.420 2.753 14.397 16.020 0.899 [OK] 11016 222 S THR CB 4 C4H1b 0.770 1.880 2.830 13.236 14.829 0.893 [OK] 11017 222 S THR OG1 17 O2H1u 0.660 1.460 2.395 16.069 18.123 0.887 [OK] 11018 222 S THR CG2 10 C4H3u 0.770 1.880 3.243 38.557 36.542 1.055 possible 11019 223 S ILE N 12 N3H1s 0.700 1.640 2.544 12.987 13.633 0.953 [OK] 11020 223 S ILE CA 3 C4H1s 0.770 1.880 2.716 11.973 13.007 0.921 [OK] 11021 223 S ILE C 1 C3H0s 0.770 1.610 2.498 7.976 8.470 0.942 [OK] 11022 223 S ILE O 16 O1H0u 0.660 1.420 2.728 16.117 16.144 0.998 [OK] 11023 223 S ILE CB 4 C4H1b 0.770 1.880 2.704 14.285 14.227 1.004 [OK] 11024 223 S ILE CG1 9 C4H2b 0.770 1.880 2.924 21.532 24.187 0.890 [OK] 11025 223 S ILE CG2 10 C4H3u 0.770 1.880 3.216 35.075 35.961 0.975 possible 11026 223 S ILE CD1 10 C4H3u 0.770 1.880 3.065 38.505 38.377 1.003 possible 11027 224 S LEU N 12 N3H1s 0.700 1.640 2.514 13.242 13.655 0.970 [OK] 11028 224 S LEU CA 3 C4H1s 0.770 1.880 2.788 12.704 13.122 0.968 [OK] 11029 224 S LEU C 1 C3H0s 0.770 1.610 2.173 8.343 8.825 0.945 [OK] 11030 224 S LEU O 16 O1H0u 0.660 1.420 2.572 16.324 16.208 1.007 [OK] 11031 224 S LEU CB 8 C4H2s 0.770 1.880 2.967 22.779 22.951 0.993 [OK] 11032 224 S LEU CG 4 C4H1b 0.770 1.880 2.881 14.934 14.764 1.012 [OK] 11033 224 S LEU CD1 10 C4H3u 0.770 1.880 3.188 34.874 37.425 0.932 possible 11034 224 S LEU CD2 10 C4H3u 0.770 1.880 3.208 39.579 37.143 1.066 possible 11035 225 S ALA N 12 N3H1s 0.700 1.640 2.255 11.802 14.046 0.840 [OK] 11036 225 S ALA CA 4 C4H1b 0.770 1.880 2.871 13.462 14.063 0.957 [OK] 11037 225 S ALA C 1 C3H0s 0.770 1.610 2.371 8.477 8.900 0.953 [OK] 11038 225 S ALA O 16 O1H0u 0.660 1.420 2.574 17.520 16.188 1.082 [OK] 11039 225 S ALA CB 10 C4H3u 0.770 1.880 3.213 36.006 36.782 0.979 possible 11040 226 S VAL N 12 N3H1s 0.700 1.640 2.286 11.735 13.676 0.858 [OK] 11041 226 S VAL CA 3 C4H1s 0.770 1.880 2.701 13.179 13.123 1.004 [OK] 11042 226 S VAL C 1 C3H0s 0.770 1.610 2.361 9.190 8.563 1.073 [OK] 11043 226 S VAL O 16 O1H0u 0.660 1.420 2.272 14.135 16.181 0.874 [OK] 11044 226 S VAL CB 4 C4H1b 0.770 1.880 2.505 13.020 14.598 0.892 [OK] 11045 226 S VAL CG1 10 C4H3u 0.770 1.880 3.217 37.386 36.584 1.022 possible 11046 226 S VAL CG2 10 C4H3u 0.770 1.880 3.065 35.833 36.332 0.986 possible 11047 227 S SER N 12 N3H1s 0.700 1.640 2.362 12.500 14.103 0.886 [OK] 11048 227 S SER CA 3 C4H1s 0.770 1.880 2.882 13.999 13.476 1.039 [OK] 11049 227 S SER C 1 C3H0s 0.770 1.610 2.169 8.080 8.923 0.906 [OK] 11050 227 S SER O 16 O1H0u 0.660 1.420 2.608 15.846 16.179 0.979 [OK] 11051 227 S SER CB 8 C4H2s 0.770 1.880 3.180 28.027 23.884 1.173 possible 11052 227 S SER OG 17 O2H1u 0.660 1.460 2.501 18.310 18.732 0.977 [OK] 11053 228 S ARG N 12 N3H1s 0.700 1.640 2.351 12.172 13.650 0.892 [OK] 11054 228 S ARG CA 3 C4H1s 0.770 1.880 2.898 11.915 13.422 0.888 [OK] 11055 228 S ARG C 1 C3H0s 0.770 1.610 2.433 8.698 8.838 0.984 [OK] 11056 228 S ARG O 16 O1H0u 0.660 1.420 2.482 17.248 16.084 1.072 [OK] 11057 228 S ARG CB 8 C4H2s 0.770 1.880 2.909 23.513 23.088 1.018 [OK] 11058 228 S ARG CG 8 C4H2s 0.770 1.880 2.771 21.278 23.640 0.900 [OK] 11059 228 S ARG CD 8 C4H2s 0.770 1.880 2.893 23.833 23.300 1.023 [OK] 11060 228 S ARG NE 13 N3H1b 0.700 1.640 2.730 15.908 15.569 1.022 [OK] 11061 228 S ARG CZ 2 C3H0b 0.770 1.610 2.313 8.919 9.747 0.915 [OK] 11062 228 S ARG NH1 15 N3H2u 0.700 1.640 2.852 21.336 22.782 0.937 [OK] 11063 228 S ARG NH2 15 N3H2u 0.700 1.640 3.479 29.952 23.810 1.258 possible 11064 229 S PHE N 12 N3H1s 0.700 1.640 2.336 12.057 13.691 0.881 [OK] 11065 229 S PHE CA 3 C4H1s 0.770 1.880 3.223 14.355 13.449 1.067 possible 11066 229 S PHE C 1 C3H0s 0.770 1.610 2.791 10.502 8.753 1.200 [OK] 11067 229 S PHE O 16 O1H0u 0.660 1.420 2.858 17.761 16.151 1.100 [OK] 11068 229 S PHE CB 8 C4H2s 0.770 1.880 3.344 22.576 23.777 0.949 possible 11069 229 S PHE CG 2 C3H0b 0.770 1.610 2.504 9.281 9.721 0.955 [OK] 11070 229 S PHE CD1 5 C3H1s 0.770 1.760 2.727 19.947 20.405 0.978 [OK] 11071 229 S PHE CD2 6 C3H1b 0.770 1.760 2.739 19.602 21.051 0.931 [OK] 11072 229 S PHE CE1 6 C3H1b 0.770 1.760 2.689 20.192 21.580 0.936 [OK] 11073 229 S PHE CE2 6 C3H1b 0.770 1.760 2.741 19.789 21.680 0.913 [OK] 11074 229 S PHE CZ 6 C3H1b 0.770 1.760 2.698 18.321 21.666 0.846 [OK] 11075 230 S GLY N 12 N3H1s 0.700 1.640 2.706 14.041 14.854 0.945 [OK] 11076 230 S GLY CA 8 C4H2s 0.770 1.880 3.055 27.257 23.688 1.151 possible 11077 230 S GLY C 2 C3H0b 0.770 1.610 2.547 9.087 9.840 0.924 [OK] 11078 230 S GLY O 16 O1H0u 0.660 1.420 2.454 17.654 16.391 1.077 [OK] 11079 231 S GLY N 12 N3H1s 0.700 1.640 2.417 13.898 14.854 0.936 [OK] 11080 231 S GLY CA 8 C4H2s 0.770 1.880 2.821 25.072 23.688 1.058 [OK] 11081 231 S GLY C 2 C3H0b 0.770 1.610 2.511 9.322 9.840 0.947 [OK] 11082 231 S GLY O 16 O1H0u 0.660 1.420 2.378 17.544 16.391 1.070 [OK] 11083 232 S GLU N 12 N3H1s 0.700 1.640 2.777 14.210 13.615 1.044 [OK] 11084 232 S GLU CA 3 C4H1s 0.770 1.880 2.751 13.602 13.399 1.015 [OK] 11085 232 S GLU C 1 C3H0s 0.770 1.610 2.651 8.228 8.675 0.948 [OK] 11086 232 S GLU O 16 O1H0u 0.660 1.420 2.473 16.162 16.023 1.009 [OK] 11087 232 S GLU CB 8 C4H2s 0.770 1.880 3.180 25.982 23.529 1.104 possible 11088 232 S GLU CG 8 C4H2s 0.770 1.880 2.878 22.618 23.513 0.962 [OK] 11089 232 S GLU CD 2 C3H0b 0.770 1.610 2.843 9.879 9.460 1.044 [OK] 11090 232 S GLU OE1 16 O1H0u 0.660 1.420 2.652 18.745 15.999 1.172 [OK] 11091 232 S GLU OE2 16 O1H0u 0.660 1.420 2.258 17.043 17.432 0.978 [OK] 11092 233 S ARG N 12 N3H1s 0.700 1.640 2.654 13.658 13.650 1.001 [OK] 11093 233 S ARG CA 3 C4H1s 0.770 1.880 3.309 15.878 13.422 1.183 possible 11094 233 S ARG C 1 C3H0s 0.770 1.610 2.548 9.157 8.838 1.036 [OK] 11095 233 S ARG O 16 O1H0u 0.660 1.420 2.449 16.359 16.084 1.017 [OK] 11096 233 S ARG CB 8 C4H2s 0.770 1.880 2.823 23.710 23.088 1.027 [OK] 11097 233 S ARG CG 8 C4H2s 0.770 1.880 3.234 26.202 23.640 1.108 possible 11098 233 S ARG CD 8 C4H2s 0.770 1.880 2.916 23.771 23.300 1.020 [OK] 11099 233 S ARG NE 13 N3H1b 0.700 1.640 2.627 15.910 15.569 1.022 [OK] 11100 233 S ARG CZ 2 C3H0b 0.770 1.610 2.708 10.922 9.747 1.121 [OK] 11101 233 S ARG NH1 15 N3H2u 0.700 1.640 2.690 23.445 22.782 1.029 [OK] 11102 233 S ARG NH2 15 N3H2u 0.700 1.640 2.886 25.174 23.810 1.057 [OK] 11103 234 S GLU N 12 N3H1s 0.700 1.640 2.365 12.284 13.615 0.902 [OK] 11104 234 S GLU CA 3 C4H1s 0.770 1.880 2.693 13.491 13.399 1.007 [OK] 11105 234 S GLU C 1 C3H0s 0.770 1.610 2.493 8.682 8.675 1.001 [OK] 11106 234 S GLU O 16 O1H0u 0.660 1.420 2.447 13.387 16.023 0.835 [OK] 11107 234 S GLU CB 8 C4H2s 0.770 1.880 3.085 26.264 23.529 1.116 possible 11108 234 S GLU CG 8 C4H2s 0.770 1.880 2.718 22.173 23.513 0.943 [OK] 11109 234 S GLU CD 2 C3H0b 0.770 1.610 2.529 8.784 9.460 0.929 [OK] 11110 234 S GLU OE1 16 O1H0u 0.660 1.420 2.277 12.412 15.999 0.776 [OK] 11111 234 S GLU OE2 16 O1H0u 0.660 1.420 2.495 14.552 17.432 0.835 [OK] 11112 235 S LEU N 12 N3H1s 0.700 1.640 2.649 14.562 13.655 1.066 [OK] 11113 235 S LEU CA 3 C4H1s 0.770 1.880 2.675 13.050 13.122 0.994 [OK] 11114 235 S LEU C 1 C3H0s 0.770 1.610 2.594 8.816 8.825 0.999 [OK] 11115 235 S LEU O 16 O1H0u 0.660 1.420 2.672 15.302 16.208 0.944 [OK] 11116 235 S LEU CB 8 C4H2s 0.770 1.880 3.049 24.137 22.951 1.052 possible 11117 235 S LEU CG 4 C4H1b 0.770 1.880 3.004 15.998 14.764 1.084 possible 11118 235 S LEU CD1 10 C4H3u 0.770 1.880 2.762 31.464 37.425 0.841 [OK] 11119 235 S LEU CD2 10 C4H3u 0.770 1.880 2.990 35.101 37.143 0.945 [OK] 11120 236 S GLU N 12 N3H1s 0.700 1.640 3.060 14.648 13.615 1.076 possible 11121 236 S GLU CA 3 C4H1s 0.770 1.880 3.086 13.879 13.399 1.036 possible 11122 236 S GLU C 1 C3H0s 0.770 1.610 2.384 8.394 8.675 0.968 [OK] 11123 236 S GLU O 16 O1H0u 0.660 1.420 2.423 14.809 16.023 0.924 [OK] 11124 236 S GLU CB 8 C4H2s 0.770 1.880 3.302 23.668 23.529 1.006 possible 11125 236 S GLU CG 8 C4H2s 0.770 1.880 2.854 22.655 23.513 0.964 [OK] 11126 236 S GLU CD 2 C3H0b 0.770 1.610 2.603 10.109 9.460 1.069 [OK] 11127 236 S GLU OE1 16 O1H0u 0.660 1.420 2.930 25.088 15.999 1.568 [OK] 11128 236 S GLU OE2 16 O1H0u 0.660 1.420 3.001 28.654 17.432 1.644 possible 11129 237 S GLN N 12 N3H1s 0.700 1.640 2.578 13.395 13.616 0.984 [OK] 11130 237 S GLN CA 3 C4H1s 0.770 1.880 2.679 13.762 13.334 1.032 [OK] 11131 237 S GLN C 1 C3H0s 0.770 1.610 2.208 8.605 8.787 0.979 [OK] 11132 237 S GLN O 16 O1H0u 0.660 1.420 2.729 21.477 15.993 1.343 [OK] 11133 237 S GLN CB 8 C4H2s 0.770 1.880 2.765 20.191 23.275 0.867 [OK] 11134 237 S GLN CG 8 C4H2s 0.770 1.880 2.876 25.031 23.465 1.067 [OK] 11135 237 S GLN CD 2 C3H0b 0.770 1.610 2.526 10.269 9.659 1.063 [OK] 11136 237 S GLN OE1 16 O1H0u 0.660 1.420 2.429 16.063 17.091 0.940 [OK] 11137 237 S GLN NE2 15 N3H2u 0.700 1.640 2.504 23.064 24.150 0.955 [OK] 11138 238 S ILE N 12 N3H1s 0.700 1.640 2.258 11.969 13.633 0.878 [OK] 11139 238 S ILE CA 3 C4H1s 0.770 1.880 2.871 14.255 13.007 1.096 [OK] 11140 238 S ILE C 1 C3H0s 0.770 1.610 2.667 7.974 8.470 0.941 [OK] 11141 238 S ILE O 16 O1H0u 0.660 1.420 2.910 23.763 16.144 1.472 [OK] 11142 238 S ILE CB 4 C4H1b 0.770 1.880 2.626 12.721 14.227 0.894 [OK] 11143 238 S ILE CG1 9 C4H2b 0.770 1.880 2.769 20.402 24.187 0.844 [OK] 11144 238 S ILE CG2 10 C4H3u 0.770 1.880 3.161 39.193 35.961 1.090 possible 11145 238 S ILE CD1 10 C4H3u 0.770 1.880 3.091 38.977 38.377 1.016 possible 11146 239 S ALA N 12 N3H1s 0.700 1.640 2.772 13.149 14.046 0.936 [OK] 11147 239 S ALA CA 4 C4H1b 0.770 1.880 3.166 18.353 14.063 1.305 possible 11148 239 S ALA C 1 C3H0s 0.770 1.610 2.761 8.668 8.900 0.974 [OK] 11149 239 S ALA O 16 O1H0u 0.660 1.420 4.078 30.025 16.188 1.855 possible 11150 239 S ALA CB 10 C4H3u 0.770 1.880 3.525 48.224 36.782 1.311 possible 11151 240 S ASP N 12 N3H1s 0.700 1.640 2.579 12.848 13.895 0.925 [OK] 11152 240 S ASP CA 3 C4H1s 0.770 1.880 3.773 15.195 13.377 1.136 possible 11153 240 S ASP C 1 C3H0s 0.770 1.610 2.526 9.215 8.816 1.045 [OK] 11154 240 S ASP O 16 O1H0u 0.660 1.420 2.398 15.089 16.091 0.938 [OK] 11155 240 S ASP CB 8 C4H2s 0.770 1.880 3.799 33.190 23.481 1.413 possible 11156 240 S ASP CG 2 C3H0b 0.770 1.610 3.545 12.340 9.422 1.310 possible 11157 240 S ASP OD1 16 O1H0u 0.660 1.420 5.469 65.179 15.505 4.204 possible 11158 240 S ASP OD2 16 O1H0u 0.660 1.420 2.813 20.609 16.324 1.263 [OK] 11159 241 S ARG N 12 N3H1s 0.700 1.640 4.350 17.998 13.650 1.319 possible 11160 241 S ARG CA 3 C4H1s 0.770 1.880 2.792 13.723 13.422 1.022 [OK] 11161 241 S ARG C 1 C3H0s 0.770 1.610 2.589 8.398 8.838 0.950 [OK] 11162 241 S ARG O 16 O1H0u 0.660 1.420 3.836 24.113 16.084 1.499 possible 11163 241 S ARG CB 8 C4H2s 0.770 1.880 4.305 27.932 23.088 1.210 possible 11164 241 S ARG CG 8 C4H2s 0.770 1.880 3.172 26.348 23.640 1.115 possible 11165 241 S ARG CD 8 C4H2s 0.770 1.880 3.660 28.216 23.300 1.211 possible 11166 241 S ARG NE 13 N3H1b 0.700 1.640 2.882 15.228 15.569 0.978 [OK] 11167 241 S ARG CZ 2 C3H0b 0.770 1.610 4.360 11.800 9.747 1.211 possible 11168 241 S ARG NH1 15 N3H2u 0.700 1.640 4.408 47.141 22.782 2.069 possible 11169 241 S ARG NH2 15 N3H2u 0.700 1.640 4.359 37.067 23.810 1.557 possible 11170 242 S GLY N 12 N3H1s 0.700 1.640 2.464 14.606 14.854 0.983 [OK] 11171 242 S GLY CA 8 C4H2s 0.770 1.880 2.695 21.768 23.688 0.919 [OK] 11172 242 S GLY C 2 C3H0b 0.770 1.610 2.599 9.598 9.840 0.975 [OK] 11173 242 S GLY O 16 O1H0u 0.660 1.420 2.610 15.064 16.391 0.919 [OK] 11174 243 S THR N 12 N3H1s 0.700 1.640 2.228 12.788 13.832 0.925 [OK] 11175 243 S THR CA 3 C4H1s 0.770 1.880 2.618 13.382 13.099 1.022 [OK] 11176 243 S THR C 1 C3H0s 0.770 1.610 2.543 8.545 8.738 0.978 [OK] 11177 243 S THR O 16 O1H0u 0.660 1.420 2.427 14.735 16.020 0.920 [OK] 11178 243 S THR CB 4 C4H1b 0.770 1.880 2.755 13.995 14.829 0.944 [OK] 11179 243 S THR OG1 17 O2H1u 0.660 1.460 2.618 17.814 18.123 0.983 [OK] 11180 243 S THR CG2 10 C4H3u 0.770 1.880 3.150 38.930 36.542 1.065 possible 11181 244 S ALA N 12 N3H1s 0.700 1.640 2.428 13.297 14.046 0.947 [OK] 11182 244 S ALA CA 4 C4H1b 0.770 1.880 2.823 14.113 14.063 1.004 [OK] 11183 244 S ALA C 1 C3H0s 0.770 1.610 2.630 8.700 8.900 0.977 [OK] 11184 244 S ALA O 16 O1H0u 0.660 1.420 2.571 15.484 16.188 0.956 [OK] 11185 244 S ALA CB 10 C4H3u 0.770 1.880 2.847 32.836 36.782 0.893 [OK] 11186 245 S ALA N 12 N3H1s 0.700 1.640 2.459 13.589 14.046 0.967 [OK] 11187 245 S ALA CA 4 C4H1b 0.770 1.880 3.221 16.041 14.063 1.141 possible 11188 245 S ALA C 1 C3H0s 0.770 1.610 2.954 9.134 8.900 1.026 [OK] 11189 245 S ALA O 16 O1H0u 0.660 1.420 2.999 21.368 16.188 1.320 [OK] 11190 245 S ALA CB 10 C4H3u 0.770 1.880 3.293 39.224 36.782 1.066 possible 11191 246 S GLU N 12 N3H1s 0.700 1.640 2.931 13.404 13.615 0.985 [OK] 11192 246 S GLU CA 3 C4H1s 0.770 1.880 3.250 13.941 13.399 1.040 possible 11193 246 S GLU C 1 C3H0s 0.770 1.610 2.863 8.975 8.675 1.035 [OK] 11194 246 S GLU O 16 O1H0u 0.660 1.420 2.680 16.415 16.023 1.024 [OK] 11195 246 S GLU CB 8 C4H2s 0.770 1.880 2.849 21.951 23.529 0.933 [OK] 11196 246 S GLU CG 8 C4H2s 0.770 1.880 3.003 22.160 23.513 0.942 possible 11197 246 S GLU CD 2 C3H0b 0.770 1.610 2.498 8.595 9.460 0.909 [OK] 11198 246 S GLU OE1 16 O1H0u 0.660 1.420 2.169 14.267 15.999 0.892 [OK] 11199 246 S GLU OE2 16 O1H0u 0.660 1.420 2.544 14.984 17.432 0.860 [OK] 11200 247 S ARG N 12 N3H1s 0.700 1.640 2.843 12.526 13.650 0.918 [OK] 11201 247 S ARG CA 3 C4H1s 0.770 1.880 3.106 14.219 13.422 1.059 possible 11202 247 S ARG C 1 C3H0s 0.770 1.610 2.699 8.890 8.838 1.006 [OK] 11203 247 S ARG O 16 O1H0u 0.660 1.420 2.515 17.917 16.084 1.114 [OK] 11204 247 S ARG CB 8 C4H2s 0.770 1.880 2.901 23.738 23.088 1.028 [OK] 11205 247 S ARG CG 8 C4H2s 0.770 1.880 2.964 21.786 23.640 0.922 [OK] 11206 247 S ARG CD 8 C4H2s 0.770 1.880 2.956 21.636 23.300 0.929 [OK] 11207 247 S ARG NE 13 N3H1b 0.700 1.640 2.813 15.300 15.569 0.983 [OK] 11208 247 S ARG CZ 2 C3H0b 0.770 1.610 2.796 10.288 9.747 1.055 [OK] 11209 247 S ARG NH1 15 N3H2u 0.700 1.640 2.894 21.694 22.782 0.952 [OK] 11210 247 S ARG NH2 15 N3H2u 0.700 1.640 2.550 22.909 23.810 0.962 [OK] 11211 248 S ALA N 12 N3H1s 0.700 1.640 2.725 13.279 14.046 0.945 [OK] 11212 248 S ALA CA 4 C4H1b 0.770 1.880 3.243 17.287 14.063 1.229 possible 11213 248 S ALA C 1 C3H0s 0.770 1.610 2.290 8.634 8.900 0.970 [OK] 11214 248 S ALA O 16 O1H0u 0.660 1.420 2.612 17.222 16.188 1.064 [OK] 11215 248 S ALA CB 10 C4H3u 0.770 1.880 3.169 37.283 36.782 1.014 possible 11216 249 S ALA N 12 N3H1s 0.700 1.640 2.402 13.508 14.046 0.962 [OK] 11217 249 S ALA CA 4 C4H1b 0.770 1.880 2.774 14.258 14.063 1.014 [OK] 11218 249 S ALA C 1 C3H0s 0.770 1.610 2.650 8.816 8.900 0.991 [OK] 11219 249 S ALA O 16 O1H0u 0.660 1.420 2.464 14.516 16.188 0.897 [OK] 11220 249 S ALA CB 10 C4H3u 0.770 1.880 3.158 37.462 36.782 1.018 possible 11221 250 S LEU N 12 N3H1s 0.700 1.640 2.616 13.644 13.655 0.999 [OK] 11222 250 S LEU CA 3 C4H1s 0.770 1.880 2.902 12.735 13.122 0.971 [OK] 11223 250 S LEU C 1 C3H0s 0.770 1.610 2.339 8.434 8.825 0.956 [OK] 11224 250 S LEU O 16 O1H0u 0.660 1.420 2.363 15.641 16.208 0.965 [OK] 11225 250 S LEU CB 8 C4H2s 0.770 1.880 2.812 23.327 22.951 1.016 [OK] 11226 250 S LEU CG 4 C4H1b 0.770 1.880 2.815 13.960 14.764 0.946 [OK] 11227 250 S LEU CD1 10 C4H3u 0.770 1.880 3.094 34.123 37.425 0.912 possible 11228 250 S LEU CD2 10 C4H3u 0.770 1.880 2.895 32.962 37.143 0.887 [OK] 11229 251 S PHE N 12 N3H1s 0.700 1.640 2.361 12.884 13.691 0.941 [OK] 11230 251 S PHE CA 3 C4H1s 0.770 1.880 2.613 13.156 13.449 0.978 [OK] 11231 251 S PHE C 1 C3H0s 0.770 1.610 2.148 7.676 8.753 0.877 [OK] 11232 251 S PHE O 16 O1H0u 0.660 1.420 2.347 15.196 16.151 0.941 [OK] 11233 251 S PHE CB 8 C4H2s 0.770 1.880 3.243 26.068 23.777 1.096 possible 11234 251 S PHE CG 2 C3H0b 0.770 1.610 2.671 10.226 9.721 1.052 [OK] 11235 251 S PHE CD1 5 C3H1s 0.770 1.760 2.768 19.220 20.405 0.942 [OK] 11236 251 S PHE CD2 6 C3H1b 0.770 1.760 2.761 19.285 21.051 0.916 [OK] 11237 251 S PHE CE1 6 C3H1b 0.770 1.760 2.693 20.605 21.580 0.955 [OK] 11238 251 S PHE CE2 6 C3H1b 0.770 1.760 2.718 17.904 21.680 0.826 [OK] 11239 251 S PHE CZ 6 C3H1b 0.770 1.760 2.732 20.955 21.666 0.967 [OK] 11240 252 S TRP N 12 N3H1s 0.700 1.640 2.248 12.853 13.791 0.932 [OK] 11241 252 S TRP CA 3 C4H1s 0.770 1.880 2.711 12.791 13.377 0.956 [OK] 11242 252 S TRP C 1 C3H0s 0.770 1.610 2.252 8.538 8.724 0.979 [OK] 11243 252 S TRP O 16 O1H0u 0.660 1.420 2.290 14.485 15.951 0.908 [OK] 11244 252 S TRP CB 8 C4H2s 0.770 1.880 2.777 24.009 24.004 1.000 [OK] 11245 252 S TRP CG 2 C3H0b 0.770 1.610 2.197 8.605 9.965 0.864 [OK] 11246 252 S TRP CD1 5 C3H1s 0.770 1.760 2.903 18.091 20.874 0.867 [OK] 11247 252 S TRP CD2 2 C3H0b 0.770 1.610 2.365 9.899 10.097 0.980 [OK] 11248 252 S TRP NE1 13 N3H1b 0.700 1.640 2.837 15.263 16.969 0.899 [OK] 11249 252 S TRP CE2 2 C3H0b 0.770 1.610 2.286 9.784 9.889 0.989 [OK] 11250 252 S TRP CE3 6 C3H1b 0.770 1.760 2.835 21.425 20.448 1.048 [OK] 11251 252 S TRP CZ2 6 C3H1b 0.770 1.760 2.791 20.242 21.012 0.963 [OK] 11252 252 S TRP CZ3 6 C3H1b 0.770 1.760 2.924 22.022 21.516 1.023 [OK] 11253 252 S TRP CH2 6 C3H1b 0.770 1.760 2.793 19.849 21.339 0.930 [OK] 11254 253 S ARG N 12 N3H1s 0.700 1.640 2.229 13.128 13.650 0.962 [OK] 11255 253 S ARG CA 3 C4H1s 0.770 1.880 2.633 13.975 13.422 1.041 [OK] 11256 253 S ARG C 1 C3H0s 0.770 1.610 2.350 7.768 8.838 0.879 [OK] 11257 253 S ARG O 16 O1H0u 0.660 1.420 2.475 16.417 16.084 1.021 [OK] 11258 253 S ARG CB 8 C4H2s 0.770 1.880 2.956 22.546 23.088 0.977 [OK] 11259 253 S ARG CG 8 C4H2s 0.770 1.880 3.080 24.114 23.640 1.020 possible 11260 253 S ARG CD 8 C4H2s 0.770 1.880 2.968 23.576 23.300 1.012 [OK] 11261 253 S ARG NE 13 N3H1b 0.700 1.640 2.543 13.511 15.569 0.868 [OK] 11262 253 S ARG CZ 2 C3H0b 0.770 1.610 2.502 10.237 9.747 1.050 [OK] 11263 253 S ARG NH1 15 N3H2u 0.700 1.640 3.717 31.547 22.782 1.385 possible 11264 253 S ARG NH2 15 N3H2u 0.700 1.640 3.133 31.346 23.810 1.317 possible 11265 254 S TRP N 12 N3H1s 0.700 1.640 2.306 12.390 13.791 0.898 [OK] 11266 254 S TRP CA 3 C4H1s 0.770 1.880 2.556 12.180 13.377 0.911 [OK] 11267 254 S TRP C 1 C3H0s 0.770 1.610 2.364 8.637 8.724 0.990 [OK] 11268 254 S TRP O 16 O1H0u 0.660 1.420 2.485 15.799 15.951 0.990 [OK] 11269 254 S TRP CB 8 C4H2s 0.770 1.880 2.766 23.250 24.004 0.969 [OK] 11270 254 S TRP CG 2 C3H0b 0.770 1.610 2.436 9.509 9.965 0.954 [OK] 11271 254 S TRP CD1 5 C3H1s 0.770 1.760 2.980 20.089 20.874 0.962 [OK] 11272 254 S TRP CD2 2 C3H0b 0.770 1.610 2.525 10.219 10.097 1.012 [OK] 11273 254 S TRP NE1 13 N3H1b 0.700 1.640 2.477 16.513 16.969 0.973 [OK] 11274 254 S TRP CE2 2 C3H0b 0.770 1.610 2.523 9.554 9.889 0.966 [OK] 11275 254 S TRP CE3 6 C3H1b 0.770 1.760 3.318 24.186 20.448 1.183 possible 11276 254 S TRP CZ2 6 C3H1b 0.770 1.760 2.789 20.055 21.012 0.954 [OK] 11277 254 S TRP CZ3 6 C3H1b 0.770 1.760 2.981 21.045 21.516 0.978 [OK] 11278 254 S TRP CH2 6 C3H1b 0.770 1.760 2.931 21.054 21.339 0.987 [OK] 11279 255 S THR N 12 N3H1s 0.700 1.640 2.425 12.809 13.832 0.926 [OK] 11280 255 S THR CA 3 C4H1s 0.770 1.880 2.689 12.544 13.099 0.958 [OK] 11281 255 S THR C 1 C3H0s 0.770 1.610 2.632 8.797 8.738 1.007 [OK] 11282 255 S THR O 16 O1H0u 0.660 1.420 2.774 16.778 16.020 1.047 [OK] 11283 255 S THR CB 4 C4H1b 0.770 1.880 2.739 14.932 14.829 1.007 [OK] 11284 255 S THR OG1 17 O2H1u 0.660 1.460 2.499 19.564 18.123 1.080 [OK] 11285 255 S THR CG2 10 C4H3u 0.770 1.880 3.060 36.169 36.542 0.990 possible 11286 256 S MET N 12 N3H1s 0.700 1.640 2.645 12.952 13.564 0.955 [OK] 11287 256 S MET CA 3 C4H1s 0.770 1.880 3.356 15.931 13.231 1.204 possible 11288 256 S MET C 1 C3H0s 0.770 1.610 2.497 8.944 8.782 1.018 [OK] 11289 256 S MET O 16 O1H0u 0.660 1.420 6.507 37.605 16.277 2.310 possible 11290 256 S MET CB 8 C4H2s 0.770 1.880 3.076 25.769 23.645 1.090 possible 11291 256 S MET CG 9 C4H2b 0.770 1.880 2.996 22.607 24.009 0.942 [OK] 11292 256 S MET SD 19 S2H0u 1.040 1.770 2.951 28.510 30.093 0.947 [OK] 11293 256 S MET CE 10 C4H3u 0.770 1.880 2.777 32.832 37.161 0.884 [OK] 11294 257 S GLY N 12 N3H1s 0.700 1.640 2.743 15.298 14.854 1.030 [OK] 11295 257 S GLY CA 8 C4H2s 0.770 1.880 5.178 29.126 23.688 1.230 possible 11296 257 S GLY C 2 C3H0b 0.770 1.610 5.479 13.101 9.840 1.331 possible 11297 257 S GLY O 16 O1H0u 0.660 1.420 6.227 42.186 16.391 2.574 possible 11298 258 S PHE N 12 N3H1s 0.700 1.640 2.896 13.579 13.691 0.992 [OK] 11299 258 S PHE CA 3 C4H1s 0.770 1.880 3.305 16.117 13.449 1.198 possible 11300 258 S PHE C 1 C3H0s 0.770 1.610 2.530 9.224 8.753 1.054 [OK] 11301 258 S PHE O 16 O1H0u 0.660 1.420 2.389 16.099 16.151 0.997 [OK] 11302 258 S PHE CB 8 C4H2s 0.770 1.880 6.722 56.886 23.777 2.392 possible 11303 258 S PHE CG 2 C3H0b 0.770 1.610 5.096 16.542 9.721 1.702 possible 11304 258 S PHE CD1 5 C3H1s 0.770 1.760 8.236 -1.000 20.405 -1.000 bad 11305 258 S PHE CD2 6 C3H1b 0.770 1.760 5.226 29.030 21.051 1.379 possible 11306 258 S PHE CE1 6 C3H1b 0.770 1.760 5.628 -1.000 21.580 -1.000 bad 11307 258 S PHE CE2 6 C3H1b 0.770 1.760 5.234 33.183 21.680 1.531 possible 11308 258 S PHE CZ 6 C3H1b 0.770 1.760 5.741 28.655 21.666 1.323 possible 11309 259 S ASN N 12 N3H1s 0.700 1.640 3.355 17.823 13.695 1.301 possible 11310 259 S ASN CA 3 C4H1s 0.770 1.880 2.777 13.382 13.167 1.016 [OK] 11311 259 S ASN C 1 C3H0s 0.770 1.610 2.420 8.456 8.928 0.947 [OK] 11312 259 S ASN O 16 O1H0u 0.660 1.420 3.092 27.039 16.199 1.669 possible 11313 259 S ASN CB 8 C4H2s 0.770 1.880 2.719 21.003 23.128 0.908 [OK] 11314 259 S ASN CG 2 C3H0b 0.770 1.610 2.834 9.542 9.599 0.994 [OK] 11315 259 S ASN OD1 16 O1H0u 0.660 1.420 2.983 18.844 16.664 1.131 [OK] 11316 259 S ASN ND2 15 N3H2u 0.700 1.640 3.271 30.945 23.083 1.341 possible 11317 260 S ALA N 12 N3H1s 0.700 1.640 2.488 12.084 14.046 0.860 [OK] 11318 260 S ALA CA 4 C4H1b 0.770 1.880 2.766 12.872 14.063 0.915 [OK] 11319 260 S ALA C 1 C3H0s 0.770 1.610 2.755 9.644 8.900 1.084 [OK] 11320 260 S ALA O 16 O1H0u 0.660 1.420 2.692 15.944 16.188 0.985 [OK] 11321 260 S ALA CB 10 C4H3u 0.770 1.880 2.646 31.555 36.782 0.858 [OK] 11322 261 S THR N 12 N3H1s 0.700 1.640 2.374 11.514 13.832 0.832 [OK] 11323 261 S THR CA 3 C4H1s 0.770 1.880 3.061 13.721 13.099 1.047 possible 11324 261 S THR C 1 C3H0s 0.770 1.610 2.305 8.334 8.738 0.954 [OK] 11325 261 S THR O 16 O1H0u 0.660 1.420 2.197 14.129 16.020 0.882 [OK] 11326 261 S THR CB 4 C4H1b 0.770 1.880 3.089 14.363 14.829 0.969 possible 11327 261 S THR OG1 17 O2H1u 0.660 1.460 2.436 15.769 18.123 0.870 [OK] 11328 261 S THR CG2 10 C4H3u 0.770 1.880 3.114 35.981 36.542 0.985 possible 11329 262 S MET N 12 N3H1s 0.700 1.640 2.896 13.973 13.564 1.030 [OK] 11330 262 S MET CA 3 C4H1s 0.770 1.880 3.066 14.602 13.231 1.104 possible 11331 262 S MET C 1 C3H0s 0.770 1.610 2.255 8.472 8.782 0.965 [OK] 11332 262 S MET O 16 O1H0u 0.660 1.420 2.511 16.878 16.277 1.037 [OK] 11333 262 S MET CB 8 C4H2s 0.770 1.880 3.202 25.242 23.645 1.068 possible 11334 262 S MET CG 9 C4H2b 0.770 1.880 2.963 22.687 24.009 0.945 [OK] 11335 262 S MET SD 19 S2H0u 1.040 1.770 3.103 30.573 30.093 1.016 possible 11336 262 S MET CE 10 C4H3u 0.770 1.880 3.180 39.780 37.161 1.070 possible 11337 263 S GLU N 12 N3H1s 0.700 1.640 2.507 12.833 13.615 0.943 [OK] 11338 263 S GLU CA 3 C4H1s 0.770 1.880 3.121 13.168 13.399 0.983 possible 11339 263 S GLU C 1 C3H0s 0.770 1.610 2.632 8.541 8.675 0.985 [OK] 11340 263 S GLU O 16 O1H0u 0.660 1.420 2.716 16.877 16.023 1.053 [OK] 11341 263 S GLU CB 8 C4H2s 0.770 1.880 2.781 22.555 23.529 0.959 [OK] 11342 263 S GLU CG 8 C4H2s 0.770 1.880 3.179 25.783 23.513 1.097 possible 11343 263 S GLU CD 2 C3H0b 0.770 1.610 2.586 10.300 9.460 1.089 [OK] 11344 263 S GLU OE1 16 O1H0u 0.660 1.420 2.451 16.208 15.999 1.013 [OK] 11345 263 S GLU OE2 16 O1H0u 0.660 1.420 2.443 17.375 17.432 0.997 [OK] 11346 264 S GLY N 12 N3H1s 0.700 1.640 2.563 13.832 14.854 0.931 [OK] 11347 264 S GLY CA 8 C4H2s 0.770 1.880 3.106 25.358 23.688 1.071 possible 11348 264 S GLY C 2 C3H0b 0.770 1.610 2.364 8.661 9.840 0.880 [OK] 11349 264 S GLY O 16 O1H0u 0.660 1.420 2.558 14.956 16.391 0.912 [OK] 11350 265 S ILE N 12 N3H1s 0.700 1.640 2.380 13.161 13.633 0.965 [OK] 11351 265 S ILE CA 3 C4H1s 0.770 1.880 2.526 12.371 13.007 0.951 [OK] 11352 265 S ILE C 1 C3H0s 0.770 1.610 2.838 8.388 8.470 0.990 [OK] 11353 265 S ILE O 16 O1H0u 0.660 1.420 2.920 17.386 16.144 1.077 [OK] 11354 265 S ILE CB 4 C4H1b 0.770 1.880 2.581 13.903 14.227 0.977 [OK] 11355 265 S ILE CG1 9 C4H2b 0.770 1.880 3.401 24.649 24.187 1.019 possible 11356 265 S ILE CG2 10 C4H3u 0.770 1.880 3.157 29.927 35.961 0.832 possible 11357 265 S ILE CD1 10 C4H3u 0.770 1.880 3.185 33.196 38.377 0.865 possible 11358 266 S HIS N 12 N3H1s 0.700 1.640 2.554 11.875 13.715 0.866 [OK] 11359 266 S HIS CA 3 C4H1s 0.770 1.880 3.005 13.538 13.467 1.005 possible 11360 266 S HIS C 1 C3H0s 0.770 1.610 2.240 8.771 8.882 0.988 [OK] 11361 266 S HIS O 16 O1H0u 0.660 1.420 2.303 14.813 16.082 0.921 [OK] 11362 266 S HIS CB 8 C4H2s 0.770 1.880 3.172 25.038 23.653 1.059 possible 11363 266 S HIS CG 2 C3H0b 0.770 1.610 2.441 9.126 9.952 0.917 [OK] 11364 266 S HIS ND1 13 N3H1b 0.700 1.640 2.940 15.604 15.506 1.006 [OK] 11365 266 S HIS CD2 5 C3H1s 0.770 1.760 3.226 23.975 21.085 1.137 possible 11366 266 S HIS CE1 5 C3H1s 0.770 1.760 2.856 20.799 20.636 1.008 [OK] 11367 266 S HIS NE2 13 N3H1b 0.700 1.640 2.574 11.204 15.337 0.731 [OK] 11368 267 S ARG N 12 N3H1s 0.700 1.640 2.387 12.955 13.650 0.949 [OK] 11369 267 S ARG CA 3 C4H1s 0.770 1.880 2.918 13.352 13.422 0.995 [OK] 11370 267 S ARG C 1 C3H0s 0.770 1.610 2.098 8.284 8.838 0.937 [OK] 11371 267 S ARG O 16 O1H0u 0.660 1.420 2.392 15.094 16.084 0.938 [OK] 11372 267 S ARG CB 8 C4H2s 0.770 1.880 3.241 25.733 23.088 1.115 possible 11373 267 S ARG CG 8 C4H2s 0.770 1.880 2.899 21.971 23.640 0.929 [OK] 11374 267 S ARG CD 8 C4H2s 0.770 1.880 3.200 25.750 23.300 1.105 possible 11375 267 S ARG NE 13 N3H1b 0.700 1.640 2.697 16.895 15.569 1.085 [OK] 11376 267 S ARG CZ 2 C3H0b 0.770 1.610 3.326 10.885 9.747 1.117 possible 11377 267 S ARG NH1 15 N3H2u 0.700 1.640 3.547 28.900 22.782 1.269 possible 11378 267 S ARG NH2 15 N3H2u 0.700 1.640 5.136 34.391 23.810 1.444 possible 11379 268 S TRP N 12 N3H1s 0.700 1.640 2.772 14.246 13.791 1.033 [OK] 11380 268 S TRP CA 3 C4H1s 0.770 1.880 2.951 15.035 13.377 1.124 [OK] 11381 268 S TRP C 1 C3H0s 0.770 1.610 2.174 7.893 8.724 0.905 [OK] 11382 268 S TRP O 16 O1H0u 0.660 1.420 3.311 19.746 15.951 1.238 possible 11383 268 S TRP CB 8 C4H2s 0.770 1.880 3.061 23.665 24.004 0.986 possible 11384 268 S TRP CG 2 C3H0b 0.770 1.610 2.518 9.498 9.965 0.953 [OK] 11385 268 S TRP CD1 5 C3H1s 0.770 1.760 2.855 20.294 20.874 0.972 [OK] 11386 268 S TRP CD2 2 C3H0b 0.770 1.610 2.507 9.688 10.097 0.959 [OK] 11387 268 S TRP NE1 13 N3H1b 0.700 1.640 2.659 15.646 16.969 0.922 [OK] 11388 268 S TRP CE2 2 C3H0b 0.770 1.610 2.503 9.616 9.889 0.972 [OK] 11389 268 S TRP CE3 6 C3H1b 0.770 1.760 4.211 30.767 20.448 1.505 possible 11390 268 S TRP CZ2 6 C3H1b 0.770 1.760 3.019 24.864 21.012 1.183 possible 11391 268 S TRP CZ3 6 C3H1b 0.770 1.760 4.721 42.181 21.516 1.960 possible 11392 268 S TRP CH2 6 C3H1b 0.770 1.760 3.828 32.564 21.339 1.526 possible 11393 269 S ALA N 12 N3H1s 0.700 1.640 2.682 13.149 14.046 0.936 [OK] 11394 269 S ALA CA 4 C4H1b 0.770 1.880 2.633 13.526 14.063 0.962 [OK] 11395 269 S ALA C 1 C3H0s 0.770 1.610 2.471 8.904 8.900 1.000 [OK] 11396 269 S ALA O 16 O1H0u 0.660 1.420 2.317 15.979 16.188 0.987 [OK] 11397 269 S ALA CB 10 C4H3u 0.770 1.880 3.401 42.390 36.782 1.152 possible 11398 270 S ILE N 12 N3H1s 0.700 1.640 2.587 13.902 13.633 1.020 [OK] 11399 270 S ILE CA 3 C4H1s 0.770 1.880 2.848 15.009 13.007 1.154 [OK] 11400 270 S ILE C 1 C3H0s 0.770 1.610 3.270 8.642 8.470 1.020 possible 11401 270 S ILE O 16 O1H0u 0.660 1.420 3.034 15.871 16.144 0.983 possible 11402 270 S ILE CB 4 C4H1b 0.770 1.880 2.744 14.812 14.227 1.041 [OK] 11403 270 S ILE CG1 9 C4H2b 0.770 1.880 4.071 29.891 24.187 1.236 possible 11404 270 S ILE CG2 10 C4H3u 0.770 1.880 3.798 37.643 35.961 1.047 possible 11405 270 S ILE CD1 10 C4H3u 0.770 1.880 4.533 54.889 38.377 1.430 possible 11406 271 S TRP N 12 N3H1s 0.700 1.640 3.175 13.381 13.791 0.970 possible 11407 271 S TRP CA 3 C4H1s 0.770 1.880 3.300 13.679 13.377 1.023 possible 11408 271 S TRP C 1 C3H0s 0.770 1.610 3.202 9.034 8.724 1.036 possible 11409 271 S TRP O 16 O1H0u 0.660 1.420 2.613 15.339 15.951 0.962 [OK] 11410 271 S TRP CB 8 C4H2s 0.770 1.880 4.097 28.920 24.004 1.205 possible 11411 271 S TRP CG 2 C3H0b 0.770 1.610 2.821 9.749 9.965 0.978 [OK] 11412 271 S TRP CD1 5 C3H1s 0.770 1.760 2.717 20.346 20.874 0.975 [OK] 11413 271 S TRP CD2 2 C3H0b 0.770 1.610 3.399 11.222 10.097 1.111 possible 11414 271 S TRP NE1 13 N3H1b 0.700 1.640 3.698 20.459 16.969 1.206 possible 11415 271 S TRP CE2 2 C3H0b 0.770 1.610 3.694 12.609 9.889 1.275 possible 11416 271 S TRP CE3 6 C3H1b 0.770 1.760 3.246 21.837 20.448 1.068 possible 11417 271 S TRP CZ2 6 C3H1b 0.770 1.760 26.115 -1.000 21.012 -1.000 bad 11418 271 S TRP CZ3 6 C3H1b 0.770 1.760 3.906 28.134 21.516 1.308 possible 11419 271 S TRP CH2 6 C3H1b 0.770 1.760 26.596 -1.000 21.339 -1.000 bad 11420 272 S MET N 12 N3H1s 0.700 1.640 4.027 16.118 13.564 1.188 possible 11421 272 S MET CA 3 C4H1s 0.770 1.880 4.370 18.963 13.231 1.433 possible 11422 272 S MET C 1 C3H0s 0.770 1.610 2.216 8.082 8.782 0.920 [OK] 11423 272 S MET O 16 O1H0u 0.660 1.420 2.349 17.397 16.277 1.069 [OK] 11424 272 S MET CB 8 C4H2s 0.770 1.880 3.788 23.383 23.645 0.989 possible 11425 272 S MET CG 9 C4H2b 0.770 1.880 2.628 21.197 24.009 0.883 [OK] 11426 272 S MET SD 19 S2H0u 1.040 1.770 4.595 46.770 30.093 1.554 possible 11427 272 S MET CE 10 C4H3u 0.770 1.880 4.648 38.021 37.161 1.023 possible 11428 273 S ALA N 12 N3H1s 0.700 1.640 2.353 13.843 14.046 0.986 [OK] 11429 273 S ALA CA 4 C4H1b 0.770 1.880 2.800 13.858 14.063 0.985 [OK] 11430 273 S ALA C 1 C3H0s 0.770 1.610 2.216 8.276 8.900 0.930 [OK] 11431 273 S ALA O 16 O1H0u 0.660 1.420 2.536 14.454 16.188 0.893 [OK] 11432 273 S ALA CB 10 C4H3u 0.770 1.880 2.844 33.936 36.782 0.923 [OK] 11433 274 S VAL N 12 N3H1s 0.700 1.640 2.553 13.570 13.676 0.992 [OK] 11434 274 S VAL CA 3 C4H1s 0.770 1.880 2.706 12.767 13.123 0.973 [OK] 11435 274 S VAL C 1 C3H0s 0.770 1.610 2.281 7.546 8.563 0.881 [OK] 11436 274 S VAL O 16 O1H0u 0.660 1.420 2.264 13.868 16.181 0.857 [OK] 11437 274 S VAL CB 4 C4H1b 0.770 1.880 3.568 14.312 14.598 0.980 possible 11438 274 S VAL CG1 10 C4H3u 0.770 1.880 4.881 52.641 36.584 1.439 possible 11439 274 S VAL CG2 10 C4H3u 0.770 1.880 4.270 42.638 36.332 1.174 possible 11440 275 S LEU N 12 N3H1s 0.700 1.640 2.506 13.525 13.655 0.990 [OK] 11441 275 S LEU CA 3 C4H1s 0.770 1.880 2.588 11.884 13.122 0.906 [OK] 11442 275 S LEU C 1 C3H0s 0.770 1.610 2.273 8.832 8.825 1.001 [OK] 11443 275 S LEU O 16 O1H0u 0.660 1.420 2.350 14.978 16.208 0.924 [OK] 11444 275 S LEU CB 8 C4H2s 0.770 1.880 2.773 21.434 22.951 0.934 [OK] 11445 275 S LEU CG 4 C4H1b 0.770 1.880 2.778 13.849 14.764 0.938 [OK] 11446 275 S LEU CD1 10 C4H3u 0.770 1.880 4.398 43.310 37.425 1.157 possible 11447 275 S LEU CD2 10 C4H3u 0.770 1.880 3.040 37.780 37.143 1.017 possible 11448 276 S VAL N 12 N3H1s 0.700 1.640 2.407 12.963 13.676 0.948 [OK] 11449 276 S VAL CA 3 C4H1s 0.770 1.880 2.754 14.061 13.123 1.072 [OK] 11450 276 S VAL C 1 C3H0s 0.770 1.610 2.530 8.068 8.563 0.942 [OK] 11451 276 S VAL O 16 O1H0u 0.660 1.420 2.652 16.889 16.181 1.044 [OK] 11452 276 S VAL CB 4 C4H1b 0.770 1.880 3.004 15.731 14.598 1.078 possible 11453 276 S VAL CG1 10 C4H3u 0.770 1.880 3.003 36.685 36.584 1.003 possible 11454 276 S VAL CG2 10 C4H3u 0.770 1.880 2.940 32.380 36.332 0.891 [OK] 11455 277 S THR N 12 N3H1s 0.700 1.640 2.550 13.310 13.832 0.962 [OK] 11456 277 S THR CA 3 C4H1s 0.770 1.880 3.132 14.665 13.099 1.120 possible 11457 277 S THR C 1 C3H0s 0.770 1.610 2.508 8.996 8.738 1.030 [OK] 11458 277 S THR O 16 O1H0u 0.660 1.420 2.342 16.031 16.020 1.001 [OK] 11459 277 S THR CB 4 C4H1b 0.770 1.880 2.715 13.754 14.829 0.927 [OK] 11460 277 S THR OG1 17 O2H1u 0.660 1.460 2.368 16.242 18.123 0.896 [OK] 11461 277 S THR CG2 10 C4H3u 0.770 1.880 2.974 36.539 36.542 1.000 [OK] 11462 278 S LEU N 12 N3H1s 0.700 1.640 2.631 13.189 13.655 0.966 [OK] 11463 278 S LEU CA 3 C4H1s 0.770 1.880 3.200 14.632 13.122 1.115 possible 11464 278 S LEU C 1 C3H0s 0.770 1.610 2.403 8.122 8.825 0.920 [OK] 11465 278 S LEU O 16 O1H0u 0.660 1.420 2.942 16.616 16.208 1.025 [OK] 11466 278 S LEU CB 8 C4H2s 0.770 1.880 3.018 18.882 22.951 0.823 possible 11467 278 S LEU CG 4 C4H1b 0.770 1.880 8.521 -1.000 14.764 -1.000 bad 11468 278 S LEU CD1 10 C4H3u 0.770 1.880 19.862 -1.000 37.425 -1.000 bad 11469 278 S LEU CD2 10 C4H3u 0.770 1.880 17.320 -1.000 37.143 -1.000 bad 11470 279 S THR N 12 N3H1s 0.700 1.640 2.519 13.467 13.832 0.974 [OK] 11471 279 S THR CA 3 C4H1s 0.770 1.880 2.962 14.474 13.099 1.105 [OK] 11472 279 S THR C 1 C3H0s 0.770 1.610 2.524 8.842 8.738 1.012 [OK] 11473 279 S THR O 16 O1H0u 0.660 1.420 2.531 15.693 16.020 0.980 [OK] 11474 279 S THR CB 4 C4H1b 0.770 1.880 2.656 14.896 14.829 1.005 [OK] 11475 279 S THR OG1 17 O2H1u 0.660 1.460 2.392 16.865 18.123 0.931 [OK] 11476 279 S THR CG2 10 C4H3u 0.770 1.880 3.084 36.194 36.542 0.990 possible 11477 280 S GLY N 12 N3H1s 0.700 1.640 2.560 13.576 14.854 0.914 [OK] 11478 280 S GLY CA 8 C4H2s 0.770 1.880 2.967 23.133 23.688 0.977 [OK] 11479 280 S GLY C 2 C3H0b 0.770 1.610 2.355 9.000 9.840 0.915 [OK] 11480 280 S GLY O 16 O1H0u 0.660 1.420 2.554 16.032 16.391 0.978 [OK] 11481 281 S GLY N 12 N3H1s 0.700 1.640 2.449 13.446 14.854 0.905 [OK] 11482 281 S GLY CA 8 C4H2s 0.770 1.880 2.869 24.405 23.688 1.030 [OK] 11483 281 S GLY C 2 C3H0b 0.770 1.610 2.309 9.198 9.840 0.935 [OK] 11484 281 S GLY O 16 O1H0u 0.660 1.420 2.352 15.143 16.391 0.924 [OK] 11485 282 S ILE N 12 N3H1s 0.700 1.640 2.344 13.229 13.633 0.970 [OK] 11486 282 S ILE CA 3 C4H1s 0.770 1.880 3.232 15.637 13.007 1.202 possible 11487 282 S ILE C 1 C3H0s 0.770 1.610 2.490 8.216 8.470 0.970 [OK] 11488 282 S ILE O 16 O1H0u 0.660 1.420 2.904 15.123 16.144 0.937 [OK] 11489 282 S ILE CB 4 C4H1b 0.770 1.880 2.576 13.255 14.227 0.932 [OK] 11490 282 S ILE CG1 9 C4H2b 0.770 1.880 6.934 39.074 24.187 1.616 possible 11491 282 S ILE CG2 10 C4H3u 0.770 1.880 6.310 59.353 35.961 1.650 possible 11492 282 S ILE CD1 10 C4H3u 0.770 1.880 26.108 -1.000 38.377 -1.000 bad 11493 283 S GLY N 12 N3H1s 0.700 1.640 2.579 14.099 14.854 0.949 [OK] 11494 283 S GLY CA 8 C4H2s 0.770 1.880 3.111 27.295 23.688 1.152 possible 11495 283 S GLY C 2 C3H0b 0.770 1.610 2.855 10.018 9.840 1.018 [OK] 11496 283 S GLY O 16 O1H0u 0.660 1.420 2.521 16.301 16.391 0.994 [OK] 11497 284 S ILE N 12 N3H1s 0.700 1.640 2.674 13.544 13.633 0.993 [OK] 11498 284 S ILE CA 3 C4H1s 0.770 1.880 2.719 12.689 13.007 0.976 [OK] 11499 284 S ILE C 1 C3H0s 0.770 1.610 2.388 8.211 8.470 0.969 [OK] 11500 284 S ILE O 16 O1H0u 0.660 1.420 2.404 15.252 16.144 0.945 [OK] 11501 284 S ILE CB 4 C4H1b 0.770 1.880 2.915 15.300 14.227 1.075 [OK] 11502 284 S ILE CG1 9 C4H2b 0.770 1.880 2.725 21.464 24.187 0.887 [OK] 11503 284 S ILE CG2 10 C4H3u 0.770 1.880 3.256 36.165 35.961 1.006 possible 11504 284 S ILE CD1 10 C4H3u 0.770 1.880 3.301 37.640 38.377 0.981 possible 11505 285 S LEU N 12 N3H1s 0.700 1.640 2.412 12.160 13.655 0.890 [OK] 11506 285 S LEU CA 3 C4H1s 0.770 1.880 2.650 13.433 13.122 1.024 [OK] 11507 285 S LEU C 1 C3H0s 0.770 1.610 2.936 8.508 8.825 0.964 [OK] 11508 285 S LEU O 16 O1H0u 0.660 1.420 3.510 20.827 16.208 1.285 possible 11509 285 S LEU CB 8 C4H2s 0.770 1.880 3.339 22.000 22.951 0.959 possible 11510 285 S LEU CG 4 C4H1b 0.770 1.880 4.447 23.708 14.764 1.606 possible 11511 285 S LEU CD1 10 C4H3u 0.770 1.880 3.199 34.897 37.425 0.932 possible 11512 285 S LEU CD2 10 C4H3u 0.770 1.880 29.429 -1.000 37.143 -1.000 bad 11513 286 S LEU N 12 N3H1s 0.700 1.640 2.842 13.576 13.655 0.994 [OK] 11514 286 S LEU CA 3 C4H1s 0.770 1.880 3.195 14.057 13.122 1.071 possible 11515 286 S LEU C 1 C3H0s 0.770 1.610 2.432 9.005 8.825 1.020 [OK] 11516 286 S LEU O 16 O1H0u 0.660 1.420 2.399 16.038 16.208 0.990 [OK] 11517 286 S LEU CB 8 C4H2s 0.770 1.880 2.907 23.575 22.951 1.027 [OK] 11518 286 S LEU CG 4 C4H1b 0.770 1.880 3.442 15.123 14.764 1.024 possible 11519 286 S LEU CD1 10 C4H3u 0.770 1.880 3.376 37.623 37.425 1.005 possible 11520 286 S LEU CD2 10 C4H3u 0.770 1.880 4.822 62.533 37.143 1.684 possible 11521 287 S SER N 12 N3H1s 0.700 1.640 2.382 13.357 14.103 0.947 [OK] 11522 287 S SER CA 3 C4H1s 0.770 1.880 2.753 13.812 13.476 1.025 [OK] 11523 287 S SER C 1 C3H0s 0.770 1.610 2.411 8.610 8.923 0.965 [OK] 11524 287 S SER O 16 O1H0u 0.660 1.420 2.428 18.609 16.179 1.150 [OK] 11525 287 S SER CB 8 C4H2s 0.770 1.880 2.854 22.181 23.884 0.929 [OK] 11526 287 S SER OG 17 O2H1u 0.660 1.460 2.521 19.227 18.732 1.026 [OK] 11527 288 S GLY N 12 N3H1s 0.700 1.640 2.477 13.666 14.854 0.920 [OK] 11528 288 S GLY CA 8 C4H2s 0.770 1.880 2.798 23.469 23.688 0.991 [OK] 11529 288 S GLY C 2 C3H0b 0.770 1.610 2.753 10.483 9.840 1.065 [OK] 11530 288 S GLY O 16 O1H0u 0.660 1.420 7.901 -1.000 16.391 -1.000 bad 11531 289 S THR N 12 N3H1s 0.700 1.640 2.582 14.205 13.832 1.027 [OK] 11532 289 S THR CA 3 C4H1s 0.770 1.880 4.842 21.685 13.099 1.655 possible 11533 289 S THR C 1 C3H0s 0.770 1.610 2.929 9.647 8.738 1.104 [OK] 11534 289 S THR O 16 O1H0u 0.660 1.420 32.162 -1.000 16.020 -1.000 bad 11535 289 S THR CB 4 C4H1b 0.770 1.880 5.892 35.557 14.829 2.398 possible 11536 289 S THR OG1 17 O2H1u 0.660 1.460 3.753 21.632 18.123 1.194 possible 11537 289 S THR CG2 10 C4H3u 0.770 1.880 3.673 42.386 36.542 1.160 possible 11538 290 S VAL N 12 N3H1s 0.700 1.640 2.686 12.314 13.676 0.900 [OK] 11539 290 S VAL CA 3 C4H1s 0.770 1.880 5.237 17.411 13.123 1.327 possible 11540 290 S VAL C 1 C3H0s 0.770 1.610 3.069 9.979 8.563 1.165 possible 11541 290 S VAL O 16 O1H0u 0.660 1.420 25.611 -1.000 16.181 -1.000 bad 11542 290 S VAL CB 4 C4H1b 0.770 1.880 2.904 15.053 14.598 1.031 [OK] 11543 290 S VAL CG1 10 C4H3u 0.770 1.880 7.935 66.449 36.584 1.816 possible 11544 290 S VAL CG2 10 C4H3u 0.770 1.880 7.290 76.617 36.332 2.109 possible 11545 291 S VAL N 12 N3H1s 0.700 1.640 2.877 14.169 13.676 1.036 [OK] 11546 291 S VAL CA 3 C4H1s 0.770 1.880 4.481 14.567 13.123 1.110 possible 11547 291 S VAL C 1 C3H0s 0.770 1.610 2.744 8.859 8.563 1.035 [OK] 11548 291 S VAL O 16 O1H0u 0.660 1.420 2.548 17.826 16.181 1.102 [OK] 11549 291 S VAL CB 4 C4H1b 0.770 1.880 2.756 13.910 14.598 0.953 [OK] 11550 291 S VAL CG1 10 C4H3u 0.770 1.880 4.915 37.659 36.584 1.029 possible 11551 291 S VAL CG2 10 C4H3u 0.770 1.880 4.072 38.390 36.332 1.057 possible 11552 292 S ASP N 12 N3H1s 0.700 1.640 4.646 23.984 13.895 1.726 possible 11553 292 S ASP CA 3 C4H1s 0.770 1.880 2.847 14.753 13.377 1.103 [OK] 11554 292 S ASP C 1 C3H0s 0.770 1.610 2.744 9.711 8.816 1.101 [OK] 11555 292 S ASP O 16 O1H0u 0.660 1.420 3.847 20.750 16.091 1.290 possible 11556 292 S ASP CB 8 C4H2s 0.770 1.880 18.063 -1.000 23.481 -1.000 bad 11557 292 S ASP CG 2 C3H0b 0.770 1.610 5.288 14.611 9.422 1.551 possible 11558 292 S ASP OD1 16 O1H0u 0.660 1.420 10.670 -1.000 15.505 -1.000 bad 11559 292 S ASP OD2 16 O1H0u 0.660 1.420 44.866 -1.000 16.324 -1.000 bad 11560 293 S ASN N 12 N3H1s 0.700 1.640 3.913 18.798 13.695 1.373 possible 11561 293 S ASN CA 3 C4H1s 0.770 1.880 2.700 12.442 13.167 0.945 [OK] 11562 293 S ASN C 1 C3H0s 0.770 1.610 2.384 7.985 8.928 0.894 [OK] 11563 293 S ASN O 16 O1H0u 0.660 1.420 3.840 19.191 16.199 1.185 possible 11564 293 S ASN CB 8 C4H2s 0.770 1.880 6.556 46.839 23.128 2.025 possible 11565 293 S ASN CG 2 C3H0b 0.770 1.610 2.645 8.794 9.599 0.916 [OK] 11566 293 S ASN OD1 16 O1H0u 0.660 1.420 2.771 15.378 16.664 0.923 [OK] 11567 293 S ASN ND2 15 N3H2u 0.700 1.640 35.012 -1.000 23.083 -1.000 bad 11568 294 S TRP N 12 N3H1s 0.700 1.640 2.600 13.499 13.791 0.979 [OK] 11569 294 S TRP CA 3 C4H1s 0.770 1.880 2.566 12.678 13.377 0.948 [OK] 11570 294 S TRP C 1 C3H0s 0.770 1.610 2.143 8.440 8.724 0.967 [OK] 11571 294 S TRP O 16 O1H0u 0.660 1.420 2.660 17.863 15.951 1.120 [OK] 11572 294 S TRP CB 8 C4H2s 0.770 1.880 2.901 25.220 24.004 1.051 [OK] 11573 294 S TRP CG 2 C3H0b 0.770 1.610 2.563 9.232 9.965 0.926 [OK] 11574 294 S TRP CD1 5 C3H1s 0.770 1.760 2.994 22.295 20.874 1.068 [OK] 11575 294 S TRP CD2 2 C3H0b 0.770 1.610 2.157 8.999 10.097 0.891 [OK] 11576 294 S TRP NE1 13 N3H1b 0.700 1.640 2.794 17.518 16.969 1.032 [OK] 11577 294 S TRP CE2 2 C3H0b 0.770 1.610 2.491 8.992 9.889 0.909 [OK] 11578 294 S TRP CE3 6 C3H1b 0.770 1.760 2.836 20.118 20.448 0.984 [OK] 11579 294 S TRP CZ2 6 C3H1b 0.770 1.760 2.749 20.122 21.012 0.958 [OK] 11580 294 S TRP CZ3 6 C3H1b 0.770 1.760 3.268 23.149 21.516 1.076 possible 11581 294 S TRP CH2 6 C3H1b 0.770 1.760 3.213 23.737 21.339 1.112 possible 11582 295 S TYR N 12 N3H1s 0.700 1.640 2.422 13.402 13.691 0.979 [OK] 11583 295 S TYR CA 3 C4H1s 0.770 1.880 2.874 14.050 13.330 1.054 [OK] 11584 295 S TYR C 1 C3H0s 0.770 1.610 2.241 7.773 8.770 0.886 [OK] 11585 295 S TYR O 16 O1H0u 0.660 1.420 2.387 14.825 16.124 0.919 [OK] 11586 295 S TYR CB 8 C4H2s 0.770 1.880 3.487 23.395 23.678 0.988 possible 11587 295 S TYR CG 2 C3H0b 0.770 1.610 4.064 11.925 9.732 1.225 possible 11588 295 S TYR CD1 5 C3H1s 0.770 1.760 4.296 24.067 20.171 1.193 possible 11589 295 S TYR CD2 5 C3H1s 0.770 1.760 7.451 47.988 20.728 2.315 possible 11590 295 S TYR CE1 5 C3H1s 0.770 1.760 7.165 58.154 20.675 2.813 possible 11591 295 S TYR CE2 5 C3H1s 0.770 1.760 26.732 -1.000 20.810 -1.000 bad 11592 295 S TYR CZ 2 C3H0b 0.770 1.610 6.821 19.644 9.926 1.979 possible 11593 295 S TYR OH 17 O2H1u 0.660 1.460 39.451 -1.000 19.173 -1.000 bad 11594 296 S VAL N 12 N3H1s 0.700 1.640 2.432 12.618 13.676 0.923 [OK] 11595 296 S VAL CA 3 C4H1s 0.770 1.880 4.027 16.470 13.123 1.255 possible 11596 296 S VAL C 1 C3H0s 0.770 1.610 2.701 7.776 8.563 0.908 [OK] 11597 296 S VAL O 16 O1H0u 0.660 1.420 3.309 16.056 16.181 0.992 possible 11598 296 S VAL CB 4 C4H1b 0.770 1.880 3.056 14.045 14.598 0.962 possible 11599 296 S VAL CG1 10 C4H3u 0.770 1.880 46.783 -1.000 36.584 -1.000 bad 11600 296 S VAL CG2 10 C4H3u 0.770 1.880 32.088 -1.000 36.332 -1.000 bad 11601 297 S TRP N 12 N3H1s 0.700 1.640 3.781 15.408 13.791 1.117 possible 11602 297 S TRP CA 3 C4H1s 0.770 1.880 4.588 18.905 13.377 1.413 possible 11603 297 S TRP C 1 C3H0s 0.770 1.610 2.090 7.681 8.724 0.880 [OK] 11604 297 S TRP O 16 O1H0u 0.660 1.420 2.722 17.915 15.951 1.123 [OK] 11605 297 S TRP CB 8 C4H2s 0.770 1.880 4.567 23.662 24.004 0.986 possible 11606 297 S TRP CG 2 C3H0b 0.770 1.610 2.524 9.726 9.965 0.976 [OK] 11607 297 S TRP CD1 5 C3H1s 0.770 1.760 5.361 40.399 20.874 1.935 possible 11608 297 S TRP CD2 2 C3H0b 0.770 1.610 2.531 9.977 10.097 0.988 [OK] 11609 297 S TRP NE1 13 N3H1b 0.700 1.640 3.298 21.618 16.969 1.274 possible 11610 297 S TRP CE2 2 C3H0b 0.770 1.610 3.264 11.664 9.889 1.179 possible 11611 297 S TRP CE3 6 C3H1b 0.770 1.760 3.224 22.814 20.448 1.116 possible 11612 297 S TRP CZ2 6 C3H1b 0.770 1.760 3.384 25.257 21.012 1.202 possible 11613 297 S TRP CZ3 6 C3H1b 0.770 1.760 4.154 27.102 21.516 1.260 possible 11614 297 S TRP CH2 6 C3H1b 0.770 1.760 3.133 23.549 21.339 1.104 possible 11615 298 S GLY N 12 N3H1s 0.700 1.640 2.542 12.521 14.854 0.843 [OK] 11616 298 S GLY CA 8 C4H2s 0.770 1.880 4.408 41.574 23.688 1.755 possible 11617 298 S GLY C 2 C3H0b 0.770 1.610 2.694 9.259 9.840 0.941 [OK] 11618 298 S GLY O 16 O1H0u 0.660 1.420 7.909 70.194 16.391 4.282 possible 11619 299 S GLN N 12 N3H1s 0.700 1.640 2.573 12.304 13.616 0.904 [OK] 11620 299 S GLN CA 3 C4H1s 0.770 1.880 4.815 17.812 13.334 1.336 possible 11621 299 S GLN C 1 C3H0s 0.770 1.610 2.695 9.201 8.787 1.047 [OK] 11622 299 S GLN O 16 O1H0u 0.660 1.420 30.656 -1.000 15.993 -1.000 bad 11623 299 S GLN CB 8 C4H2s 0.770 1.880 14.461 -1.000 23.275 -1.000 bad 11624 299 S GLN CG 8 C4H2s 0.770 1.880 8.884 -1.000 23.465 -1.000 bad 11625 299 S GLN CD 2 C3H0b 0.770 1.610 3.235 10.585 9.659 1.096 possible 11626 299 S GLN OE1 16 O1H0u 0.660 1.420 37.055 -1.000 17.091 -1.000 bad 11627 299 S GLN NE2 15 N3H2u 0.700 1.640 23.797 -1.000 24.150 -1.000 bad 11628 300 S ASN N 12 N3H1s 0.700 1.640 2.222 12.014 13.695 0.877 [OK] 11629 300 S ASN CA 3 C4H1s 0.770 1.880 9.129 -1.000 13.167 -1.000 bad 11630 300 S ASN C 1 C3H0s 0.770 1.610 1.824 -1.000 8.928 -1.000 bad 11631 300 S ASN O 16 O1H0u 0.660 1.420 22.174 -1.000 16.199 -1.000 bad 11632 300 S ASN CB 8 C4H2s 0.770 1.880 34.081 -1.000 23.128 -1.000 bad 11633 300 S ASN CG 2 C3H0b 0.770 1.610 2.117 -1.000 9.599 -1.000 bad 11634 300 S ASN OD1 16 O1H0u 0.660 1.420 20.165 -1.000 16.664 -1.000 bad 11635 300 S ASN ND2 15 N3H2u 0.700 1.640 23.537 -1.000 23.083 -1.000 bad 11636 301 S HIS N 12 N3H1s 0.700 1.640 4.969 19.735 13.715 1.439 possible 11637 301 S HIS CA 3 C4H1s 0.770 1.880 3.890 17.503 13.467 1.300 possible 11638 301 S HIS C 1 C3H0s 0.770 1.610 6.020 12.186 8.882 1.372 possible 11639 301 S HIS O 16 O1H0u 0.660 1.420 32.556 -1.000 16.082 -1.000 bad 11640 301 S HIS CB 8 C4H2s 0.770 1.880 3.410 27.960 23.653 1.182 possible 11641 301 S HIS CG 2 C3H0b 0.770 1.610 3.035 10.399 9.952 1.045 possible 11642 301 S HIS ND1 13 N3H1b 0.700 1.640 4.956 27.621 15.506 1.781 possible 11643 301 S HIS CD2 5 C3H1s 0.770 1.760 5.238 59.920 21.085 2.842 possible 11644 301 S HIS CE1 5 C3H1s 0.770 1.760 25.661 -1.000 20.636 -1.000 bad 11645 301 S HIS NE2 13 N3H1b 0.700 1.640 18.661 -1.000 15.337 -1.000 bad 11646 301 S HIS OXT 16 O1H0u 0.660 1.420 37.243 -1.000 1.420 -1.000 bad 11648 11 T ASP N 12 N3H1s 0.700 1.640 29.420 -1.000 13.895 -1.000 bad 11649 11 T ASP CA 3 C4H1s 0.770 1.880 20.721 -1.000 13.377 -1.000 bad 11650 11 T ASP C 1 C3H0s 0.770 1.610 5.285 14.903 8.816 1.690 possible 11651 11 T ASP O 16 O1H0u 0.660 1.420 4.161 18.859 16.091 1.172 possible 11652 11 T ASP CB 8 C4H2s 0.770 1.880 33.066 -1.000 23.481 -1.000 bad 11653 11 T ASP CG 2 C3H0b 0.770 1.610 5.049 13.627 9.422 1.446 possible 11654 11 T ASP OD1 16 O1H0u 0.660 1.420 3.558 20.853 15.505 1.345 possible 11655 11 T ASP OD2 16 O1H0u 0.660 1.420 7.382 81.299 16.324 4.980 possible 11656 12 T LEU N 12 N3H1s 0.700 1.640 6.682 -1.000 13.655 -1.000 bad 11657 12 T LEU CA 3 C4H1s 0.770 1.880 3.843 15.251 13.122 1.162 possible 11658 12 T LEU C 1 C3H0s 0.770 1.610 2.512 8.425 8.825 0.955 [OK] 11659 12 T LEU O 16 O1H0u 0.660 1.420 2.659 15.793 16.208 0.974 [OK] 11660 12 T LEU CB 8 C4H2s 0.770 1.880 5.970 29.145 22.951 1.270 possible 11661 12 T LEU CG 4 C4H1b 0.770 1.880 13.471 -1.000 14.764 -1.000 bad 11662 12 T LEU CD1 10 C4H3u 0.770 1.880 48.840 -1.000 37.425 -1.000 bad 11663 12 T LEU CD2 10 C4H3u 0.770 1.880 32.171 -1.000 37.143 -1.000 bad 11664 13 T ALA N 12 N3H1s 0.700 1.640 2.490 14.435 14.046 1.028 [OK] 11665 13 T ALA CA 4 C4H1b 0.770 1.880 2.702 13.543 14.063 0.963 [OK] 11666 13 T ALA C 1 C3H0s 0.770 1.610 2.322 8.259 8.900 0.928 [OK] 11667 13 T ALA O 16 O1H0u 0.660 1.420 2.904 18.701 16.188 1.155 [OK] 11668 13 T ALA CB 10 C4H3u 0.770 1.880 3.385 37.200 36.782 1.011 possible 11669 14 T SER N 12 N3H1s 0.700 1.640 2.382 13.027 14.103 0.924 [OK] 11670 14 T SER CA 3 C4H1s 0.770 1.880 3.246 15.582 13.476 1.156 possible 11671 14 T SER C 1 C3H0s 0.770 1.610 4.385 9.514 8.923 1.066 possible 11672 14 T SER O 16 O1H0u 0.660 1.420 4.558 24.345 16.179 1.505 possible 11673 14 T SER CB 8 C4H2s 0.770 1.880 25.686 -1.000 23.884 -1.000 bad 11674 14 T SER OG 17 O2H1u 0.660 1.460 5.342 31.210 18.732 1.666 possible 11675 15 T LEU N 12 N3H1s 0.700 1.640 4.841 16.211 13.655 1.187 possible 11676 15 T LEU CA 3 C4H1s 0.770 1.880 5.677 20.558 13.122 1.567 possible 11677 15 T LEU C 1 C3H0s 0.770 1.610 2.900 8.326 8.825 0.944 [OK] 11678 15 T LEU O 16 O1H0u 0.660 1.420 2.953 15.071 16.208 0.930 [OK] 11679 15 T LEU CB 8 C4H2s 0.770 1.880 5.273 33.892 22.951 1.477 possible 11680 15 T LEU CG 4 C4H1b 0.770 1.880 4.568 20.931 14.764 1.418 possible 11681 15 T LEU CD1 10 C4H3u 0.770 1.880 40.256 -1.000 37.425 -1.000 bad 11682 15 T LEU CD2 10 C4H3u 0.770 1.880 51.876 -1.000 37.143 -1.000 bad 11683 16 T ALA N 12 N3H1s 0.700 1.640 3.420 14.492 14.046 1.032 possible 11684 16 T ALA CA 4 C4H1b 0.770 1.880 6.657 31.899 14.063 2.268 possible 11685 16 T ALA C 1 C3H0s 0.770 1.610 2.231 8.095 8.900 0.910 [OK] 11686 16 T ALA O 16 O1H0u 0.660 1.420 4.203 23.414 16.188 1.446 possible 11687 16 T ALA CB 10 C4H3u 0.770 1.880 6.751 60.941 36.782 1.657 possible 11688 17 T ILE N 12 N3H1s 0.700 1.640 2.379 12.980 13.633 0.952 [OK] 11689 17 T ILE CA 3 C4H1s 0.770 1.880 2.585 12.214 13.007 0.939 [OK] 11690 17 T ILE C 1 C3H0s 0.770 1.610 2.987 8.754 8.470 1.034 [OK] 11691 17 T ILE O 16 O1H0u 0.660 1.420 2.491 14.670 16.144 0.909 [OK] 11692 17 T ILE CB 4 C4H1b 0.770 1.880 3.070 15.585 14.227 1.095 possible 11693 17 T ILE CG1 9 C4H2b 0.770 1.880 4.451 33.186 24.187 1.372 possible 11694 17 T ILE CG2 10 C4H3u 0.770 1.880 4.225 44.319 35.961 1.232 possible 11695 17 T ILE CD1 10 C4H3u 0.770 1.880 3.853 41.304 38.377 1.076 possible 11696 18 T TYR N 12 N3H1s 0.700 1.640 3.348 14.277 13.691 1.043 possible 11697 18 T TYR CA 3 C4H1s 0.770 1.880 4.811 21.871 13.330 1.641 possible 11698 18 T TYR C 1 C3H0s 0.770 1.610 2.287 7.883 8.770 0.899 [OK] 11699 18 T TYR O 16 O1H0u 0.660 1.420 2.365 15.072 16.124 0.935 [OK] 11700 18 T TYR CB 8 C4H2s 0.770 1.880 5.321 42.121 23.678 1.779 possible 11701 18 T TYR CG 2 C3H0b 0.770 1.610 6.834 18.696 9.732 1.921 possible 11702 18 T TYR CD1 5 C3H1s 0.770 1.760 17.770 -1.000 20.171 -1.000 bad 11703 18 T TYR CD2 5 C3H1s 0.770 1.760 6.952 32.171 20.728 1.552 possible 11704 18 T TYR CE1 5 C3H1s 0.770 1.760 24.857 -1.000 20.675 -1.000 bad 11705 18 T TYR CE2 5 C3H1s 0.770 1.760 26.273 -1.000 20.810 -1.000 bad 11706 18 T TYR CZ 2 C3H0b 0.770 1.610 1.701 -1.000 9.926 -1.000 bad 11707 18 T TYR OH 17 O2H1u 0.660 1.460 42.143 -1.000 19.173 -1.000 bad 11708 19 T SER N 12 N3H1s 0.700 1.640 2.329 12.336 14.103 0.875 [OK] 11709 19 T SER CA 3 C4H1s 0.770 1.880 3.663 15.977 13.476 1.186 possible 11710 19 T SER C 1 C3H0s 0.770 1.610 4.376 9.549 8.923 1.070 possible 11711 19 T SER O 16 O1H0u 0.660 1.420 5.683 27.400 16.179 1.694 possible 11712 19 T SER CB 8 C4H2s 0.770 1.880 33.183 -1.000 23.884 -1.000 bad 11713 19 T SER OG 17 O2H1u 0.660 1.460 13.705 -1.000 18.732 -1.000 bad 11714 20 T PHE N 12 N3H1s 0.700 1.640 4.648 16.518 13.691 1.206 possible 11715 20 T PHE CA 3 C4H1s 0.770 1.880 5.125 20.329 13.449 1.512 possible 11716 20 T PHE C 1 C3H0s 0.770 1.610 2.231 7.639 8.753 0.873 [OK] 11717 20 T PHE O 16 O1H0u 0.660 1.420 2.436 14.113 16.151 0.874 [OK] 11718 20 T PHE CB 8 C4H2s 0.770 1.880 3.882 27.577 23.777 1.160 possible 11719 20 T PHE CG 2 C3H0b 0.770 1.610 2.589 10.250 9.721 1.054 [OK] 11720 20 T PHE CD1 5 C3H1s 0.770 1.760 4.673 34.060 20.405 1.669 possible 11721 20 T PHE CD2 6 C3H1b 0.770 1.760 2.877 22.952 21.051 1.090 [OK] 11722 20 T PHE CE1 6 C3H1b 0.770 1.760 3.130 22.188 21.580 1.028 possible 11723 20 T PHE CE2 6 C3H1b 0.770 1.760 2.764 20.689 21.680 0.954 [OK] 11724 20 T PHE CZ 6 C3H1b 0.770 1.760 2.941 21.516 21.666 0.993 [OK] 11725 21 T TRP N 12 N3H1s 0.700 1.640 2.587 13.830 13.791 1.003 [OK] 11726 21 T TRP CA 3 C4H1s 0.770 1.880 2.785 13.232 13.377 0.989 [OK] 11727 21 T TRP C 1 C3H0s 0.770 1.610 3.412 9.140 8.724 1.048 possible 11728 21 T TRP O 16 O1H0u 0.660 1.420 4.503 25.448 15.951 1.595 possible 11729 21 T TRP CB 8 C4H2s 0.770 1.880 6.988 44.075 24.004 1.836 possible 11730 21 T TRP CG 2 C3H0b 0.770 1.610 7.877 19.720 9.965 1.979 possible 11731 21 T TRP CD1 5 C3H1s 0.770 1.760 11.829 -1.000 20.874 -1.000 bad 11732 21 T TRP CD2 2 C3H0b 0.770 1.610 1.818 -1.000 10.097 -1.000 bad 11733 21 T TRP NE1 13 N3H1b 0.700 1.640 10.944 -1.000 16.969 -1.000 bad 11734 21 T TRP CE2 2 C3H0b 0.770 1.610 1.580 -1.000 9.889 -1.000 bad 11735 21 T TRP CE3 6 C3H1b 0.770 1.760 14.707 -1.000 20.448 -1.000 bad 11736 21 T TRP CZ2 6 C3H1b 0.770 1.760 22.396 -1.000 21.012 -1.000 bad 11737 21 T TRP CZ3 6 C3H1b 0.770 1.760 18.675 -1.000 21.516 -1.000 bad 11738 21 T TRP CH2 6 C3H1b 0.770 1.760 22.380 -1.000 21.339 -1.000 bad 11739 22 T ILE N 12 N3H1s 0.700 1.640 2.777 13.336 13.633 0.978 [OK] 11740 22 T ILE CA 3 C4H1s 0.770 1.880 3.936 16.780 13.007 1.290 possible 11741 22 T ILE C 1 C3H0s 0.770 1.610 3.222 8.498 8.470 1.003 possible 11742 22 T ILE O 16 O1H0u 0.660 1.420 5.456 30.717 16.144 1.903 possible 11743 22 T ILE CB 4 C4H1b 0.770 1.880 5.017 21.333 14.227 1.499 possible 11744 22 T ILE CG1 9 C4H2b 0.770 1.880 5.577 35.594 24.187 1.472 possible 11745 22 T ILE CG2 10 C4H3u 0.770 1.880 54.460 -1.000 35.961 -1.000 bad 11746 22 T ILE CD1 10 C4H3u 0.770 1.880 27.710 -1.000 38.377 -1.000 bad 11747 23 T PHE N 12 N3H1s 0.700 1.640 4.608 16.236 13.691 1.186 possible 11748 23 T PHE CA 3 C4H1s 0.770 1.880 6.636 32.400 13.449 2.409 possible 11749 23 T PHE C 1 C3H0s 0.770 1.610 2.193 7.949 8.753 0.908 [OK] 11750 23 T PHE O 16 O1H0u 0.660 1.420 4.016 20.966 16.151 1.298 possible 11751 23 T PHE CB 8 C4H2s 0.770 1.880 6.912 51.008 23.777 2.145 possible 11752 23 T PHE CG 2 C3H0b 0.770 1.610 5.856 17.213 9.721 1.771 possible 11753 23 T PHE CD1 5 C3H1s 0.770 1.760 24.559 -1.000 20.405 -1.000 bad 11754 23 T PHE CD2 6 C3H1b 0.770 1.760 4.426 26.930 21.051 1.279 possible 11755 23 T PHE CE1 6 C3H1b 0.770 1.760 29.016 -1.000 21.580 -1.000 bad 11756 23 T PHE CE2 6 C3H1b 0.770 1.760 4.133 28.391 21.680 1.310 possible 11757 23 T PHE CZ 6 C3H1b 0.770 1.760 4.883 33.280 21.666 1.536 possible 11758 24 T LEU N 12 N3H1s 0.700 1.640 2.655 12.808 13.655 0.938 [OK] 11759 24 T LEU CA 3 C4H1s 0.770 1.880 2.948 13.778 13.122 1.050 [OK] 11760 24 T LEU C 1 C3H0s 0.770 1.610 2.632 8.250 8.825 0.935 [OK] 11761 24 T LEU O 16 O1H0u 0.660 1.420 2.526 14.154 16.208 0.873 [OK] 11762 24 T LEU CB 8 C4H2s 0.770 1.880 3.414 24.153 22.951 1.052 possible 11763 24 T LEU CG 4 C4H1b 0.770 1.880 3.679 15.516 14.764 1.051 possible 11764 24 T LEU CD1 10 C4H3u 0.770 1.880 4.392 50.307 37.425 1.344 possible 11765 24 T LEU CD2 10 C4H3u 0.770 1.880 6.771 72.524 37.143 1.953 possible 11766 25 T ALA N 12 N3H1s 0.700 1.640 3.854 16.920 14.046 1.205 possible 11767 25 T ALA CA 4 C4H1b 0.770 1.880 4.632 22.881 14.063 1.627 possible 11768 25 T ALA C 1 C3H0s 0.770 1.610 4.448 9.242 8.900 1.038 possible 11769 25 T ALA O 16 O1H0u 0.660 1.420 4.870 34.465 16.188 2.129 possible 11770 25 T ALA CB 10 C4H3u 0.770 1.880 52.122 -1.000 36.782 -1.000 bad 11771 26 T GLY N 12 N3H1s 0.700 1.640 5.237 19.010 14.854 1.280 possible 11772 26 T GLY CA 8 C4H2s 0.770 1.880 31.155 -1.000 23.688 -1.000 bad 11773 26 T GLY C 2 C3H0b 0.770 1.610 6.197 16.596 9.840 1.687 possible 11774 26 T GLY O 16 O1H0u 0.660 1.420 4.287 -1.000 16.391 -1.000 bad 11775 27 T LEU N 12 N3H1s 0.700 1.640 4.591 16.038 13.655 1.174 possible 11776 27 T LEU CA 3 C4H1s 0.770 1.880 5.025 17.690 13.122 1.348 possible 11777 27 T LEU C 1 C3H0s 0.770 1.610 2.421 8.030 8.825 0.910 [OK] 11778 27 T LEU O 16 O1H0u 0.660 1.420 2.181 13.286 16.208 0.820 [OK] 11779 27 T LEU CB 8 C4H2s 0.770 1.880 3.360 24.445 22.951 1.065 possible 11780 27 T LEU CG 4 C4H1b 0.770 1.880 3.060 13.958 14.764 0.945 possible 11781 27 T LEU CD1 10 C4H3u 0.770 1.880 5.679 53.026 37.425 1.417 possible 11782 27 T LEU CD2 10 C4H3u 0.770 1.880 4.248 42.983 37.143 1.157 possible 11783 28 T ILE N 12 N3H1s 0.700 1.640 2.823 13.363 13.633 0.980 [OK] 11784 28 T ILE CA 3 C4H1s 0.770 1.880 2.779 14.385 13.007 1.106 [OK] 11785 28 T ILE C 1 C3H0s 0.770 1.610 2.727 8.150 8.470 0.962 [OK] 11786 28 T ILE O 16 O1H0u 0.660 1.420 2.527 16.804 16.144 1.041 [OK] 11787 28 T ILE CB 4 C4H1b 0.770 1.880 3.670 15.831 14.227 1.113 possible 11788 28 T ILE CG1 9 C4H2b 0.770 1.880 4.416 33.880 24.187 1.401 possible 11789 28 T ILE CG2 10 C4H3u 0.770 1.880 26.285 -1.000 35.961 -1.000 bad 11790 28 T ILE CD1 10 C4H3u 0.770 1.880 40.657 -1.000 38.377 -1.000 bad 11791 29 T TYR N 12 N3H1s 0.700 1.640 3.547 15.226 13.691 1.112 possible 11792 29 T TYR CA 3 C4H1s 0.770 1.880 3.579 15.518 13.330 1.164 possible 11793 29 T TYR C 1 C3H0s 0.770 1.610 2.322 7.953 8.770 0.907 [OK] 11794 29 T TYR O 16 O1H0u 0.660 1.420 2.408 15.506 16.124 0.962 [OK] 11795 29 T TYR CB 8 C4H2s 0.770 1.880 4.560 30.738 23.678 1.298 possible 11796 29 T TYR CG 2 C3H0b 0.770 1.610 6.187 16.021 9.732 1.646 possible 11797 29 T TYR CD1 5 C3H1s 0.770 1.760 15.873 -1.000 20.171 -1.000 bad 11798 29 T TYR CD2 5 C3H1s 0.770 1.760 14.302 -1.000 20.728 -1.000 bad 11799 29 T TYR CE1 5 C3H1s 0.770 1.760 19.631 -1.000 20.675 -1.000 bad 11800 29 T TYR CE2 5 C3H1s 0.770 1.760 25.007 -1.000 20.810 -1.000 bad 11801 29 T TYR CZ 2 C3H0b 0.770 1.610 1.719 -1.000 9.926 -1.000 bad 11802 29 T TYR OH 17 O2H1u 0.660 1.460 23.070 -1.000 19.173 -1.000 bad 11803 30 T TYR N 12 N3H1s 0.700 1.640 3.061 13.511 13.691 0.987 possible 11804 30 T TYR CA 3 C4H1s 0.770 1.880 4.595 18.679 13.330 1.401 possible 11805 30 T TYR C 1 C3H0s 0.770 1.610 2.267 7.937 8.770 0.905 [OK] 11806 30 T TYR O 16 O1H0u 0.660 1.420 2.902 15.596 16.124 0.967 [OK] 11807 30 T TYR CB 8 C4H2s 0.770 1.880 14.388 -1.000 23.678 -1.000 bad 11808 30 T TYR CG 2 C3H0b 0.770 1.610 7.612 18.100 9.732 1.860 possible 11809 30 T TYR CD1 5 C3H1s 0.770 1.760 21.238 -1.000 20.171 -1.000 bad 11810 30 T TYR CD2 5 C3H1s 0.770 1.760 5.104 23.006 20.728 1.110 possible 11811 30 T TYR CE1 5 C3H1s 0.770 1.760 21.391 -1.000 20.675 -1.000 bad 11812 30 T TYR CE2 5 C3H1s 0.770 1.760 5.059 28.450 20.810 1.367 possible 11813 30 T TYR CZ 2 C3H0b 0.770 1.610 5.965 17.565 9.926 1.770 possible 11814 30 T TYR OH 17 O2H1u 0.660 1.460 12.756 -1.000 19.173 -1.000 bad 11815 31 T LEU N 12 N3H1s 0.700 1.640 2.301 11.791 13.655 0.863 [OK] 11816 31 T LEU CA 3 C4H1s 0.770 1.880 3.159 14.649 13.122 1.116 possible 11817 31 T LEU C 1 C3H0s 0.770 1.610 2.596 8.840 8.825 1.002 [OK] 11818 31 T LEU O 16 O1H0u 0.660 1.420 2.703 14.978 16.208 0.924 [OK] 11819 31 T LEU CB 8 C4H2s 0.770 1.880 2.904 23.097 22.951 1.006 [OK] 11820 31 T LEU CG 4 C4H1b 0.770 1.880 2.682 13.331 14.764 0.903 [OK] 11821 31 T LEU CD1 10 C4H3u 0.770 1.880 4.293 44.891 37.425 1.199 possible 11822 31 T LEU CD2 10 C4H3u 0.770 1.880 3.221 37.690 37.143 1.015 possible 11823 32 T GLN N 12 N3H1s 0.700 1.640 2.622 13.838 13.616 1.016 [OK] 11824 32 T GLN CA 3 C4H1s 0.770 1.880 2.948 13.612 13.334 1.021 [OK] 11825 32 T GLN C 1 C3H0s 0.770 1.610 2.620 8.593 8.787 0.978 [OK] 11826 32 T GLN O 16 O1H0u 0.660 1.420 2.855 15.665 15.993 0.979 [OK] 11827 32 T GLN CB 8 C4H2s 0.770 1.880 2.885 22.855 23.275 0.982 [OK] 11828 32 T GLN CG 8 C4H2s 0.770 1.880 4.744 38.166 23.465 1.627 possible 11829 32 T GLN CD 2 C3H0b 0.770 1.610 3.707 11.710 9.659 1.212 possible 11830 32 T GLN OE1 16 O1H0u 0.660 1.420 3.075 23.484 17.091 1.374 possible 11831 32 T GLN NE2 15 N3H2u 0.700 1.640 3.559 37.736 24.150 1.563 possible 11832 33 T THR N 12 N3H1s 0.700 1.640 2.532 13.187 13.832 0.953 [OK] 11833 33 T THR CA 3 C4H1s 0.770 1.880 2.816 14.126 13.099 1.078 [OK] 11834 33 T THR C 1 C3H0s 0.770 1.610 2.630 8.614 8.738 0.986 [OK] 11835 33 T THR O 16 O1H0u 0.660 1.420 2.351 14.045 16.020 0.877 [OK] 11836 33 T THR CB 4 C4H1b 0.770 1.880 4.510 18.700 14.829 1.261 possible 11837 33 T THR OG1 17 O2H1u 0.660 1.460 5.712 36.155 18.123 1.995 possible 11838 33 T THR CG2 10 C4H3u 0.770 1.880 4.776 46.701 36.542 1.278 possible 11839 34 T GLU N 12 N3H1s 0.700 1.640 3.000 13.394 13.615 0.984 possible 11840 34 T GLU CA 3 C4H1s 0.770 1.880 2.749 13.889 13.399 1.037 [OK] 11841 34 T GLU C 1 C3H0s 0.770 1.610 2.683 8.945 8.675 1.031 [OK] 11842 34 T GLU O 16 O1H0u 0.660 1.420 2.439 16.887 16.023 1.054 [OK] 11843 34 T GLU CB 8 C4H2s 0.770 1.880 3.231 25.774 23.529 1.095 possible 11844 34 T GLU CG 8 C4H2s 0.770 1.880 2.981 22.321 23.513 0.949 [OK] 11845 34 T GLU CD 2 C3H0b 0.770 1.610 3.357 10.640 9.460 1.125 possible 11846 34 T GLU OE1 16 O1H0u 0.660 1.420 7.111 60.965 15.999 3.811 possible 11847 34 T GLU OE2 16 O1H0u 0.660 1.420 5.765 33.101 17.432 1.899 possible 11848 35 T ASN N 12 N3H1s 0.700 1.640 2.524 11.896 13.695 0.869 [OK] 11849 35 T ASN CA 3 C4H1s 0.770 1.880 2.637 12.665 13.167 0.962 [OK] 11850 35 T ASN C 1 C3H0s 0.770 1.610 2.986 9.919 8.928 1.111 [OK] 11851 35 T ASN O 16 O1H0u 0.660 1.420 3.184 26.321 16.199 1.625 possible 11852 35 T ASN CB 8 C4H2s 0.770 1.880 3.426 24.020 23.128 1.039 possible 11853 35 T ASN CG 2 C3H0b 0.770 1.610 2.530 8.857 9.599 0.923 [OK] 11854 35 T ASN OD1 16 O1H0u 0.660 1.420 2.203 13.147 16.664 0.789 [OK] 11855 35 T ASN ND2 15 N3H2u 0.700 1.640 2.956 25.896 23.083 1.122 [OK] 11856 36 T MET N 12 N3H1s 0.700 1.640 2.313 12.073 13.564 0.890 [OK] 11857 36 T MET CA 3 C4H1s 0.770 1.880 2.870 13.529 13.231 1.023 [OK] 11858 36 T MET C 1 C3H0s 0.770 1.610 2.627 10.079 8.782 1.148 [OK] 11859 36 T MET O 16 O1H0u 0.660 1.420 2.950 21.552 16.277 1.324 [OK] 11860 36 T MET CB 8 C4H2s 0.770 1.880 2.857 23.761 23.645 1.005 [OK] 11861 36 T MET CG 9 C4H2b 0.770 1.880 3.682 25.188 24.009 1.049 possible 11862 36 T MET SD 19 S2H0u 1.040 1.770 3.319 33.186 30.093 1.103 possible 11863 36 T MET CE 10 C4H3u 0.770 1.880 3.432 40.884 37.161 1.100 possible 11864 37 T ARG N 12 N3H1s 0.700 1.640 2.648 15.104 13.650 1.107 [OK] 11865 37 T ARG CA 3 C4H1s 0.770 1.880 2.649 13.151 13.422 0.980 [OK] 11866 37 T ARG C 1 C3H0s 0.770 1.610 3.162 10.707 8.838 1.212 possible 11867 37 T ARG O 16 O1H0u 0.660 1.420 2.790 17.824 16.084 1.108 [OK] 11868 37 T ARG CB 8 C4H2s 0.770 1.880 3.146 25.157 23.088 1.090 possible 11869 37 T ARG CG 8 C4H2s 0.770 1.880 2.611 20.462 23.640 0.866 [OK] 11870 37 T ARG CD 8 C4H2s 0.770 1.880 2.966 25.123 23.300 1.078 [OK] 11871 37 T ARG NE 13 N3H1b 0.700 1.640 2.550 15.348 15.569 0.986 [OK] 11872 37 T ARG CZ 2 C3H0b 0.770 1.610 2.910 9.769 9.747 1.002 [OK] 11873 37 T ARG NH1 15 N3H2u 0.700 1.640 4.582 28.556 22.782 1.253 possible 11874 37 T ARG NH2 15 N3H2u 0.700 1.640 7.155 36.408 23.810 1.529 possible 11875 38 T GLU N 12 N3H1s 0.700 1.640 3.129 15.265 13.615 1.121 possible 11876 38 T GLU CA 3 C4H1s 0.770 1.880 3.188 15.605 13.399 1.165 possible 11877 38 T GLU C 1 C3H0s 0.770 1.610 2.954 9.302 8.675 1.072 [OK] 11878 38 T GLU O 16 O1H0u 0.660 1.420 2.944 23.244 16.023 1.451 [OK] 11879 38 T GLU CB 8 C4H2s 0.770 1.880 3.097 25.297 23.529 1.075 possible 11880 38 T GLU CG 8 C4H2s 0.770 1.880 3.188 27.114 23.513 1.153 possible 11881 38 T GLU CD 2 C3H0b 0.770 1.610 2.572 10.206 9.460 1.079 [OK] 11882 38 T GLU OE1 16 O1H0u 0.660 1.420 4.118 29.115 15.999 1.820 possible 11883 38 T GLU OE2 16 O1H0u 0.660 1.420 2.961 27.290 17.432 1.566 [OK] 11884 39 T GLY N 12 N3H1s 0.700 1.640 3.419 24.623 14.854 1.658 possible 11885 39 T GLY CA 8 C4H2s 0.770 1.880 2.940 22.793 23.688 0.962 [OK] 11886 39 T GLY C 2 C3H0b 0.770 1.610 2.406 9.158 9.840 0.931 [OK] 11887 39 T GLY O 16 O1H0u 0.660 1.420 2.315 16.045 16.391 0.979 [OK] 11888 40 T TYR N 12 N3H1s 0.700 1.640 2.920 15.200 13.691 1.110 [OK] 11889 40 T TYR CA 3 C4H1s 0.770 1.880 2.658 12.467 13.330 0.935 [OK] 11890 40 T TYR C 1 C3H0s 0.770 1.610 2.861 9.973 8.770 1.137 [OK] 11891 40 T TYR O 16 O1H0u 0.660 1.420 3.124 34.148 16.124 2.118 possible 11892 40 T TYR CB 8 C4H2s 0.770 1.880 3.180 23.225 23.678 0.981 possible 11893 40 T TYR CG 2 C3H0b 0.770 1.610 2.535 10.405 9.732 1.069 [OK] 11894 40 T TYR CD1 5 C3H1s 0.770 1.760 2.912 19.402 20.171 0.962 [OK] 11895 40 T TYR CD2 5 C3H1s 0.770 1.760 3.520 26.840 20.728 1.295 possible 11896 40 T TYR CE1 5 C3H1s 0.770 1.760 3.588 28.712 20.675 1.389 possible 11897 40 T TYR CE2 5 C3H1s 0.770 1.760 3.078 22.848 20.810 1.098 possible 11898 40 T TYR CZ 2 C3H0b 0.770 1.610 2.364 9.807 9.926 0.988 [OK] 11899 40 T TYR OH 17 O2H1u 0.660 1.460 3.274 26.291 19.173 1.371 possible 11900 41 T PRO N 11 N3H0u 0.700 1.640 3.194 9.759 8.823 1.106 possible 11901 41 T PRO CA 4 C4H1b 0.770 1.880 2.850 12.974 13.955 0.930 [OK] 11902 41 T PRO C 1 C3H0s 0.770 1.610 2.633 8.652 8.812 0.982 [OK] 11903 41 T PRO O 16 O1H0u 0.660 1.420 4.044 26.633 16.169 1.647 possible 11904 41 T PRO CB 9 C4H2b 0.770 1.880 4.988 44.868 25.563 1.755 possible 11905 41 T PRO CG 9 C4H2b 0.770 1.880 25.030 -1.000 25.832 -1.000 bad 11906 41 T PRO CD 8 C4H2s 0.770 1.880 5.976 80.051 23.836 3.358 possible 11907 42 T LEU N 12 N3H1s 0.700 1.640 2.508 13.673 13.655 1.001 [OK] 11908 42 T LEU CA 3 C4H1s 0.770 1.880 2.768 12.684 13.122 0.967 [OK] 11909 42 T LEU C 1 C3H0s 0.770 1.610 2.454 8.709 8.825 0.987 [OK] 11910 42 T LEU O 16 O1H0u 0.660 1.420 3.206 18.854 16.208 1.163 possible 11911 42 T LEU CB 8 C4H2s 0.770 1.880 2.881 22.897 22.951 0.998 [OK] 11912 42 T LEU CG 4 C4H1b 0.770 1.880 3.132 14.673 14.764 0.994 possible 11913 42 T LEU CD1 10 C4H3u 0.770 1.880 4.413 53.521 37.425 1.430 possible 11914 42 T LEU CD2 10 C4H3u 0.770 1.880 2.800 33.130 37.143 0.892 [OK] 11915 43 T GLU N 12 N3H1s 0.700 1.640 2.620 12.961 13.615 0.952 [OK] 11916 43 T GLU CA 3 C4H1s 0.770 1.880 2.852 13.132 13.399 0.980 [OK] 11917 43 T GLU C 1 C3H0s 0.770 1.610 2.473 9.456 8.675 1.090 [OK] 11918 43 T GLU O 16 O1H0u 0.660 1.420 2.530 15.204 16.023 0.949 [OK] 11919 43 T GLU CB 8 C4H2s 0.770 1.880 3.127 24.807 23.529 1.054 possible 11920 43 T GLU CG 8 C4H2s 0.770 1.880 4.310 35.177 23.513 1.496 possible 11921 43 T GLU CD 2 C3H0b 0.770 1.610 2.484 9.723 9.460 1.028 [OK] 11922 43 T GLU OE1 16 O1H0u 0.660 1.420 4.120 33.123 15.999 2.070 possible 11923 43 T GLU OE2 16 O1H0u 0.660 1.420 5.764 73.117 17.432 4.194 possible 11924 44 T ASN N 12 N3H1s 0.700 1.640 2.517 12.804 13.695 0.935 [OK] 11925 44 T ASN CA 3 C4H1s 0.770 1.880 3.363 17.517 13.167 1.330 possible 11926 44 T ASN C 1 C3H0s 0.770 1.610 2.800 9.633 8.928 1.079 [OK] 11927 44 T ASN O 16 O1H0u 0.660 1.420 3.130 18.925 16.199 1.168 possible 11928 44 T ASN CB 8 C4H2s 0.770 1.880 4.365 31.649 23.128 1.368 possible 11929 44 T ASN CG 2 C3H0b 0.770 1.610 5.562 15.548 9.599 1.620 possible 11930 44 T ASN OD1 16 O1H0u 0.660 1.420 6.633 56.919 16.664 3.416 possible 11931 44 T ASN ND2 15 N3H2u 0.700 1.640 17.102 -1.000 23.083 -1.000 bad 11932 45 T GLU N 12 N3H1s 0.700 1.640 3.239 17.705 13.615 1.300 possible 11933 45 T GLU CA 3 C4H1s 0.770 1.880 3.077 15.598 13.399 1.164 possible 11934 45 T GLU C 1 C3H0s 0.770 1.610 3.190 11.375 8.675 1.311 possible 11935 45 T GLU O 16 O1H0u 0.660 1.420 3.780 27.273 16.023 1.702 possible 11936 45 T GLU CB 8 C4H2s 0.770 1.880 3.168 21.377 23.529 0.909 possible 11937 45 T GLU CG 8 C4H2s 0.770 1.880 4.115 33.650 23.513 1.431 possible 11938 45 T GLU CD 2 C3H0b 0.770 1.610 2.732 9.463 9.460 1.000 [OK] 11939 45 T GLU OE1 16 O1H0u 0.660 1.420 2.927 22.263 15.999 1.392 [OK] 11940 45 T GLU OE2 16 O1H0u 0.660 1.420 3.049 22.566 17.432 1.295 possible 11941 46 T ASP N 12 N3H1s 0.700 1.640 2.631 12.651 13.895 0.910 [OK] 11942 46 T ASP CA 3 C4H1s 0.770 1.880 5.923 27.164 13.377 2.031 possible 11943 46 T ASP C 1 C3H0s 0.770 1.610 4.728 14.480 8.816 1.642 possible 11944 46 T ASP O 16 O1H0u 0.660 1.420 15.706 -1.000 16.091 -1.000 bad 11945 46 T ASP CB 8 C4H2s 0.770 1.880 28.410 -1.000 23.481 -1.000 bad 11946 46 T ASP CG 2 C3H0b 0.770 1.610 7.363 18.606 9.422 1.975 possible 11947 46 T ASP OD1 16 O1H0u 0.660 1.420 7.338 55.406 15.505 3.573 possible 11948 46 T ASP OD2 16 O1H0u 0.660 1.420 20.540 -1.000 16.324 -1.000 bad 11949 47 T GLY N 12 N3H1s 0.700 1.640 3.355 22.198 14.854 1.494 possible 11950 47 T GLY CA 8 C4H2s 0.770 1.880 19.988 -1.000 23.688 -1.000 bad 11951 47 T GLY C 2 C3H0b 0.770 1.610 5.393 14.576 9.840 1.481 possible 11952 47 T GLY O 16 O1H0u 0.660 1.420 18.318 -1.000 16.391 -1.000 bad 11953 48 T THR N 12 N3H1s 0.700 1.640 4.111 15.672 13.832 1.133 possible 11954 48 T THR CA 3 C4H1s 0.770 1.880 4.123 14.602 13.099 1.115 possible 11955 48 T THR C 1 C3H0s 0.770 1.610 2.706 9.076 8.738 1.039 [OK] 11956 48 T THR O 16 O1H0u 0.660 1.420 2.441 15.866 16.020 0.990 [OK] 11957 48 T THR CB 4 C4H1b 0.770 1.880 4.517 18.217 14.829 1.228 possible 11958 48 T THR OG1 17 O2H1u 0.660 1.460 6.373 37.992 18.123 2.096 possible 11959 48 T THR CG2 10 C4H3u 0.770 1.880 61.926 -1.000 36.542 -1.000 bad 11960 49 T PRO N 11 N3H0u 0.700 1.640 3.260 10.581 8.823 1.199 possible 11961 49 T PRO CA 4 C4H1b 0.770 1.880 3.740 18.598 13.955 1.333 possible 11962 49 T PRO C 1 C3H0s 0.770 1.610 2.770 9.000 8.812 1.021 [OK] 11963 49 T PRO O 16 O1H0u 0.660 1.420 13.084 -1.000 16.169 -1.000 bad 11964 49 T PRO CB 9 C4H2b 0.770 1.880 28.741 -1.000 25.563 -1.000 bad 11965 49 T PRO CG 9 C4H2b 0.770 1.880 43.610 -1.000 25.832 -1.000 bad 11966 49 T PRO CD 8 C4H2s 0.770 1.880 20.955 -1.000 23.836 -1.000 bad 11967 50 T ALA N 12 N3H1s 0.700 1.640 2.738 15.341 14.046 1.092 [OK] 11968 50 T ALA CA 4 C4H1b 0.770 1.880 2.712 12.510 14.063 0.890 [OK] 11969 50 T ALA C 1 C3H0s 0.770 1.610 3.382 9.588 8.900 1.077 possible 11970 50 T ALA O 16 O1H0u 0.660 1.420 10.303 -1.000 16.188 -1.000 bad 11971 50 T ALA CB 10 C4H3u 0.770 1.880 3.337 36.664 36.782 0.997 possible 11972 51 T ALA N 12 N3H1s 0.700 1.640 4.109 26.809 14.046 1.909 possible 11973 51 T ALA CA 4 C4H1b 0.770 1.880 12.175 -1.000 14.063 -1.000 bad 11974 51 T ALA C 1 C3H0s 0.770 1.610 4.386 9.823 8.900 1.104 possible 11975 51 T ALA O 16 O1H0u 0.660 1.420 23.362 -1.000 16.188 -1.000 bad 11976 51 T ALA CB 10 C4H3u 0.770 1.880 66.730 -1.000 36.782 -1.000 bad 11977 52 T ASN N 12 N3H1s 0.700 1.640 4.639 19.484 13.695 1.423 possible 11978 52 T ASN CA 3 C4H1s 0.770 1.880 10.023 -1.000 13.167 -1.000 bad 11979 52 T ASN C 1 C3H0s 0.770 1.610 2.673 9.397 8.928 1.053 [OK] 11980 52 T ASN O 16 O1H0u 0.660 1.420 2.727 20.198 16.199 1.247 [OK] 11981 52 T ASN CB 8 C4H2s 0.770 1.880 34.384 -1.000 23.128 -1.000 bad 11982 52 T ASN CG 2 C3H0b 0.770 1.610 2.150 -1.000 9.599 -1.000 bad 11983 52 T ASN OD1 16 O1H0u 0.660 1.420 13.116 -1.000 16.664 -1.000 bad 11984 52 T ASN ND2 15 N3H2u 0.700 1.640 36.858 -1.000 23.083 -1.000 bad 11985 53 T GLN N 12 N3H1s 0.700 1.640 4.625 23.451 13.616 1.722 possible 11986 53 T GLN CA 3 C4H1s 0.770 1.880 2.762 13.863 13.334 1.040 [OK] 11987 53 T GLN C 1 C3H0s 0.770 1.610 2.675 10.370 8.787 1.180 [OK] 11988 53 T GLN O 16 O1H0u 0.660 1.420 4.226 31.528 15.993 1.971 possible 11989 53 T GLN CB 8 C4H2s 0.770 1.880 19.699 -1.000 23.275 -1.000 bad 11990 53 T GLN CG 8 C4H2s 0.770 1.880 28.360 -1.000 23.465 -1.000 bad 11991 53 T GLN CD 2 C3H0b 0.770 1.610 3.788 10.535 9.659 1.091 possible 11992 53 T GLN OE1 16 O1H0u 0.660 1.420 2.943 20.839 17.091 1.219 [OK] 11993 53 T GLN NE2 15 N3H2u 0.700 1.640 4.666 35.463 24.150 1.468 possible 11994 54 T GLY N 12 N3H1s 0.700 1.640 3.571 22.820 14.854 1.536 possible 11995 54 T GLY CA 8 C4H2s 0.770 1.880 4.973 42.736 23.688 1.804 possible 11996 54 T GLY C 2 C3H0b 0.770 1.610 4.064 12.434 9.840 1.264 possible 11997 54 T GLY O 16 O1H0u 0.660 1.420 22.348 -1.000 16.391 -1.000 bad 11998 55 T PRO N 11 N3H0u 0.700 1.640 2.674 8.158 8.823 0.925 [OK] 11999 55 T PRO CA 4 C4H1b 0.770 1.880 9.609 -1.000 13.955 -1.000 bad 12000 55 T PRO C 1 C3H0s 0.770 1.610 4.066 12.271 8.812 1.392 possible 12001 55 T PRO O 16 O1H0u 0.660 1.420 23.289 -1.000 16.169 -1.000 bad 12002 55 T PRO CB 9 C4H2b 0.770 1.880 31.104 -1.000 25.563 -1.000 bad 12003 55 T PRO CG 9 C4H2b 0.770 1.880 39.562 -1.000 25.832 -1.000 bad 12004 55 T PRO CD 8 C4H2s 0.770 1.880 7.603 59.475 23.836 2.495 possible 12005 56 T PHE N 12 N3H1s 0.700 1.640 2.985 15.588 13.691 1.139 [OK] 12006 56 T PHE CA 3 C4H1s 0.770 1.880 2.930 12.696 13.449 0.944 [OK] 12007 56 T PHE C 1 C3H0s 0.770 1.610 4.113 10.205 8.753 1.166 possible 12008 56 T PHE O 16 O1H0u 0.660 1.420 4.648 34.131 16.151 2.113 possible 12009 56 T PHE CB 8 C4H2s 0.770 1.880 2.872 22.394 23.777 0.942 [OK] 12010 56 T PHE CG 2 C3H0b 0.770 1.610 2.636 10.355 9.721 1.065 [OK] 12011 56 T PHE CD1 5 C3H1s 0.770 1.760 3.736 25.064 20.405 1.228 possible 12012 56 T PHE CD2 6 C3H1b 0.770 1.760 3.090 21.616 21.051 1.027 possible 12013 56 T PHE CE1 6 C3H1b 0.770 1.760 11.444 -1.000 21.580 -1.000 bad 12014 56 T PHE CE2 6 C3H1b 0.770 1.760 7.829 61.754 21.680 2.848 possible 12015 56 T PHE CZ 6 C3H1b 0.770 1.760 22.177 -1.000 21.666 -1.000 bad 12016 57 T PRO N 11 N3H0u 0.700 1.640 4.422 9.978 8.823 1.131 possible 12017 57 T PRO CA 4 C4H1b 0.770 1.880 6.397 35.561 13.955 2.548 possible 12018 57 T PRO C 1 C3H0s 0.770 1.610 2.756 9.442 8.812 1.071 [OK] 12019 57 T PRO O 16 O1H0u 0.660 1.420 3.193 19.091 16.169 1.181 possible 12020 57 T PRO CB 9 C4H2b 0.770 1.880 29.504 -1.000 25.563 -1.000 bad 12021 57 T PRO CG 9 C4H2b 0.770 1.880 35.162 -1.000 25.832 -1.000 bad 12022 57 T PRO CD 8 C4H2s 0.770 1.880 4.262 28.391 23.836 1.191 possible 12023 58 T LEU N 12 N3H1s 0.700 1.640 6.783 35.064 13.655 2.568 possible 12024 58 T LEU CA 3 C4H1s 0.770 1.880 2.852 12.958 13.122 0.988 [OK] 12025 58 T LEU C 1 C3H0s 0.770 1.610 2.694 8.643 8.825 0.979 [OK] 12026 58 T LEU O 16 O1H0u 0.660 1.420 17.145 -1.000 16.208 -1.000 bad 12027 58 T LEU CB 8 C4H2s 0.770 1.880 7.451 43.859 22.951 1.911 possible 12028 58 T LEU CG 4 C4H1b 0.770 1.880 7.392 35.467 14.764 2.402 possible 12029 58 T LEU CD1 10 C4H3u 0.770 1.880 32.294 -1.000 37.425 -1.000 bad 12030 58 T LEU CD2 10 C4H3u 0.770 1.880 3.741 50.750 37.143 1.366 possible 12031 59 T PRO N 11 N3H0u 0.700 1.640 2.873 9.285 8.823 1.052 [OK] 12032 59 T PRO CA 4 C4H1b 0.770 1.880 5.628 26.839 13.955 1.923 possible 12033 59 T PRO C 1 C3H0s 0.770 1.610 3.006 9.320 8.812 1.058 possible 12034 59 T PRO O 16 O1H0u 0.660 1.420 4.699 26.302 16.169 1.627 possible 12035 59 T PRO CB 9 C4H2b 0.770 1.880 5.632 39.147 25.563 1.531 possible 12036 59 T PRO CG 9 C4H2b 0.770 1.880 2.705 22.217 25.832 0.860 [OK] 12037 59 T PRO CD 8 C4H2s 0.770 1.880 2.947 24.911 23.836 1.045 [OK] 12038 60 T LYS N 12 N3H1s 0.700 1.640 5.805 29.159 13.675 2.132 possible 12039 60 T LYS CA 3 C4H1s 0.770 1.880 5.355 17.514 13.324 1.314 possible 12040 60 T LYS C 1 C3H0s 0.770 1.610 2.647 8.845 8.759 1.010 [OK] 12041 60 T LYS O 16 O1H0u 0.660 1.420 7.016 30.323 16.049 1.889 possible 12042 60 T LYS CB 8 C4H2s 0.770 1.880 21.321 -1.000 22.904 -1.000 bad 12043 60 T LYS CG 8 C4H2s 0.770 1.880 19.558 -1.000 23.131 -1.000 bad 12044 60 T LYS CD 8 C4H2s 0.770 1.880 31.695 -1.000 23.837 -1.000 bad 12045 60 T LYS CE 9 C4H2b 0.770 1.880 41.234 -1.000 23.934 -1.000 bad 12046 60 T LYS NZ 14 N4H3u 0.700 1.640 56.426 -1.000 21.213 -1.000 bad 12047 61 T PRO N 11 N3H0u 0.700 1.640 3.434 9.975 8.823 1.131 possible 12048 61 T PRO CA 4 C4H1b 0.770 1.880 2.639 12.836 13.955 0.920 [OK] 12049 61 T PRO C 1 C3H0s 0.770 1.610 2.950 9.280 8.812 1.053 [OK] 12050 61 T PRO O 16 O1H0u 0.660 1.420 27.798 -1.000 16.169 -1.000 bad 12051 61 T PRO CB 9 C4H2b 0.770 1.880 13.828 -1.000 25.563 -1.000 bad 12052 61 T PRO CG 9 C4H2b 0.770 1.880 29.116 -1.000 25.832 -1.000 bad 12053 61 T PRO CD 8 C4H2s 0.770 1.880 26.672 -1.000 23.836 -1.000 bad 12054 62 T LYS N 12 N3H1s 0.700 1.640 2.696 12.582 13.675 0.920 [OK] 12055 62 T LYS CA 3 C4H1s 0.770 1.880 5.738 21.294 13.324 1.598 possible 12056 62 T LYS C 1 C3H0s 0.770 1.610 2.812 9.573 8.759 1.093 [OK] 12057 62 T LYS O 16 O1H0u 0.660 1.420 2.472 15.773 16.049 0.983 [OK] 12058 62 T LYS CB 8 C4H2s 0.770 1.880 4.257 20.624 22.904 0.900 possible 12059 62 T LYS CG 8 C4H2s 0.770 1.880 15.376 -1.000 23.131 -1.000 bad 12060 62 T LYS CD 8 C4H2s 0.770 1.880 4.156 27.727 23.837 1.163 possible 12061 62 T LYS CE 9 C4H2b 0.770 1.880 15.057 -1.000 23.934 -1.000 bad 12062 62 T LYS NZ 14 N4H3u 0.700 1.640 3.155 23.999 21.213 1.131 possible 12063 63 T THR N 12 N3H1s 0.700 1.640 7.460 35.300 13.832 2.552 possible 12064 63 T THR CA 3 C4H1s 0.770 1.880 2.793 12.373 13.099 0.945 [OK] 12065 63 T THR C 1 C3H0s 0.770 1.610 2.834 9.559 8.738 1.094 [OK] 12066 63 T THR O 16 O1H0u 0.660 1.420 6.836 66.176 16.020 4.131 possible 12067 63 T THR CB 4 C4H1b 0.770 1.880 14.717 -1.000 14.829 -1.000 bad 12068 63 T THR OG1 17 O2H1u 0.660 1.460 13.837 -1.000 18.123 -1.000 bad 12069 63 T THR CG2 10 C4H3u 0.770 1.880 22.443 -1.000 36.542 -1.000 bad 12070 64 T PHE N 12 N3H1s 0.700 1.640 2.712 14.287 13.691 1.044 [OK] 12071 64 T PHE CA 3 C4H1s 0.770 1.880 3.343 16.150 13.449 1.201 possible 12072 64 T PHE C 1 C3H0s 0.770 1.610 2.567 9.438 8.753 1.078 [OK] 12073 64 T PHE O 16 O1H0u 0.660 1.420 2.323 15.080 16.151 0.934 [OK] 12074 64 T PHE CB 8 C4H2s 0.770 1.880 3.242 25.611 23.777 1.077 possible 12075 64 T PHE CG 2 C3H0b 0.770 1.610 2.916 11.520 9.721 1.185 [OK] 12076 64 T PHE CD1 5 C3H1s 0.770 1.760 3.129 21.978 20.405 1.077 possible 12077 64 T PHE CD2 6 C3H1b 0.770 1.760 3.013 23.285 21.051 1.106 possible 12078 64 T PHE CE1 6 C3H1b 0.770 1.760 2.749 22.708 21.580 1.052 [OK] 12079 64 T PHE CE2 6 C3H1b 0.770 1.760 3.315 24.378 21.680 1.124 possible 12080 64 T PHE CZ 6 C3H1b 0.770 1.760 2.746 19.482 21.666 0.899 [OK] 12081 65 T ILE N 12 N3H1s 0.700 1.640 3.739 22.843 13.633 1.676 possible 12082 65 T ILE CA 3 C4H1s 0.770 1.880 2.618 12.015 13.007 0.924 [OK] 12083 65 T ILE C 1 C3H0s 0.770 1.610 2.454 8.353 8.470 0.986 [OK] 12084 65 T ILE O 16 O1H0u 0.660 1.420 2.758 16.736 16.144 1.037 [OK] 12085 65 T ILE CB 4 C4H1b 0.770 1.880 3.125 14.584 14.227 1.025 possible 12086 65 T ILE CG1 9 C4H2b 0.770 1.880 4.364 35.463 24.187 1.466 possible 12087 65 T ILE CG2 10 C4H3u 0.770 1.880 22.868 -1.000 35.961 -1.000 bad 12088 65 T ILE CD1 10 C4H3u 0.770 1.880 40.931 -1.000 38.377 -1.000 bad 12089 66 T LEU N 12 N3H1s 0.700 1.640 2.568 13.317 13.655 0.975 [OK] 12090 66 T LEU CA 3 C4H1s 0.770 1.880 2.713 11.590 13.122 0.883 [OK] 12091 66 T LEU C 1 C3H0s 0.770 1.610 2.412 8.955 8.825 1.015 [OK] 12092 66 T LEU O 16 O1H0u 0.660 1.420 3.822 25.769 16.208 1.590 possible 12093 66 T LEU CB 8 C4H2s 0.770 1.880 3.154 24.277 22.951 1.058 possible 12094 66 T LEU CG 4 C4H1b 0.770 1.880 2.518 13.595 14.764 0.921 [OK] 12095 66 T LEU CD1 10 C4H3u 0.770 1.880 3.900 50.519 37.425 1.350 possible 12096 66 T LEU CD2 10 C4H3u 0.770 1.880 3.386 39.753 37.143 1.070 possible 12097 67 T PRO N 11 N3H0u 0.700 1.640 2.544 8.809 8.823 0.998 [OK] 12098 67 T PRO CA 4 C4H1b 0.770 1.880 2.715 12.730 13.955 0.912 [OK] 12099 67 T PRO C 1 C3H0s 0.770 1.610 2.356 8.580 8.812 0.974 [OK] 12100 67 T PRO O 16 O1H0u 0.660 1.420 2.359 16.486 16.169 1.020 [OK] 12101 67 T PRO CB 9 C4H2b 0.770 1.880 4.134 31.423 25.563 1.229 possible 12102 67 T PRO CG 9 C4H2b 0.770 1.880 3.201 27.854 25.832 1.078 possible 12103 67 T PRO CD 8 C4H2s 0.770 1.880 3.471 29.212 23.836 1.226 possible 12104 68 T HIS N 12 N3H1s 0.700 1.640 4.005 21.764 13.715 1.587 possible 12105 68 T HIS CA 3 C4H1s 0.770 1.880 6.556 30.586 13.467 2.271 possible 12106 68 T HIS C 1 C3H0s 0.770 1.610 2.064 -1.000 8.882 -1.000 bad 12107 68 T HIS O 16 O1H0u 0.660 1.420 19.406 -1.000 16.082 -1.000 bad 12108 68 T HIS CB 8 C4H2s 0.770 1.880 4.695 27.509 23.653 1.163 possible 12109 68 T HIS CG 2 C3H0b 0.770 1.610 2.538 9.070 9.952 0.911 [OK] 12110 68 T HIS ND1 13 N3H1b 0.700 1.640 3.809 19.493 15.506 1.257 possible 12111 68 T HIS CD2 5 C3H1s 0.770 1.760 2.678 20.002 21.085 0.949 [OK] 12112 68 T HIS CE1 5 C3H1s 0.770 1.760 3.611 21.622 20.636 1.048 possible 12113 68 T HIS NE2 13 N3H1b 0.700 1.640 2.413 14.344 15.337 0.935 [OK] 12114 69 T GLY N 12 N3H1s 0.700 1.640 3.679 -1.000 14.854 -1.000 bad 12115 69 T GLY CA 8 C4H2s 0.770 1.880 39.262 -1.000 23.688 -1.000 bad 12116 69 T GLY C 2 C3H0b 0.770 1.610 3.535 11.927 9.840 1.212 possible 12117 69 T GLY O 16 O1H0u 0.660 1.420 28.652 -1.000 16.391 -1.000 bad 12118 70 T ARG N 12 N3H1s 0.700 1.640 2.715 14.816 13.650 1.085 [OK] 12119 70 T ARG CA 3 C4H1s 0.770 1.880 4.728 19.630 13.422 1.463 possible 12120 70 T ARG C 1 C3H0s 0.770 1.610 5.888 14.552 8.838 1.647 possible 12121 70 T ARG O 16 O1H0u 0.660 1.420 6.628 37.939 16.084 2.359 possible 12122 70 T ARG CB 8 C4H2s 0.770 1.880 3.013 23.521 23.088 1.019 possible 12123 70 T ARG CG 8 C4H2s 0.770 1.880 5.254 36.247 23.640 1.533 possible 12124 70 T ARG CD 8 C4H2s 0.770 1.880 2.978 24.091 23.300 1.034 [OK] 12125 70 T ARG NE 13 N3H1b 0.700 1.640 5.220 26.090 15.569 1.676 possible 12126 70 T ARG CZ 2 C3H0b 0.770 1.610 2.497 10.087 9.747 1.035 [OK] 12127 70 T ARG NH1 15 N3H2u 0.700 1.640 2.993 28.413 22.782 1.247 [OK] 12128 70 T ARG NH2 15 N3H2u 0.700 1.640 6.234 40.508 23.810 1.701 possible 12129 71 T GLY N 12 N3H1s 0.700 1.640 5.125 25.409 14.854 1.711 possible 12130 71 T GLY CA 8 C4H2s 0.770 1.880 35.473 -1.000 23.688 -1.000 bad 12131 71 T GLY C 2 C3H0b 0.770 1.610 3.562 10.667 9.840 1.084 possible 12132 71 T GLY O 16 O1H0u 0.660 1.420 5.409 24.936 16.391 1.521 possible 12133 72 T THR N 12 N3H1s 0.700 1.640 4.544 20.305 13.832 1.468 possible 12134 72 T THR CA 3 C4H1s 0.770 1.880 2.393 12.131 13.099 0.926 [OK] 12135 72 T THR C 1 C3H0s 0.770 1.610 2.916 9.898 8.738 1.133 [OK] 12136 72 T THR O 16 O1H0u 0.660 1.420 25.413 -1.000 16.020 -1.000 bad 12137 72 T THR CB 4 C4H1b 0.770 1.880 3.125 15.442 14.829 1.041 possible 12138 72 T THR OG1 17 O2H1u 0.660 1.460 30.416 -1.000 18.123 -1.000 bad 12139 72 T THR CG2 10 C4H3u 0.770 1.880 24.205 -1.000 36.542 -1.000 bad 12140 73 T LEU N 12 N3H1s 0.700 1.640 2.786 15.270 13.655 1.118 [OK] 12141 73 T LEU CA 3 C4H1s 0.770 1.880 3.792 15.146 13.122 1.154 possible 12142 73 T LEU C 1 C3H0s 0.770 1.610 2.712 9.038 8.825 1.024 [OK] 12143 73 T LEU O 16 O1H0u 0.660 1.420 2.486 16.405 16.208 1.012 [OK] 12144 73 T LEU CB 8 C4H2s 0.770 1.880 4.480 31.011 22.951 1.351 possible 12145 73 T LEU CG 4 C4H1b 0.770 1.880 3.850 16.403 14.764 1.111 possible 12146 73 T LEU CD1 10 C4H3u 0.770 1.880 3.428 39.299 37.425 1.050 possible 12147 73 T LEU CD2 10 C4H3u 0.770 1.880 6.666 131.240 37.143 3.533 possible 12148 74 T THR N 12 N3H1s 0.700 1.640 5.675 25.842 13.832 1.868 possible 12149 74 T THR CA 3 C4H1s 0.770 1.880 2.500 11.510 13.099 0.879 [OK] 12150 74 T THR C 1 C3H0s 0.770 1.610 2.407 8.688 8.738 0.994 [OK] 12151 74 T THR O 16 O1H0u 0.660 1.420 5.291 34.809 16.020 2.173 possible 12152 74 T THR CB 4 C4H1b 0.770 1.880 7.724 49.232 14.829 3.320 possible 12153 74 T THR OG1 17 O2H1u 0.660 1.460 12.990 -1.000 18.123 -1.000 bad 12154 74 T THR CG2 10 C4H3u 0.770 1.880 23.284 -1.000 36.542 -1.000 bad 12155 75 T VAL N 12 N3H1s 0.700 1.640 2.628 13.238 13.676 0.968 [OK] 12156 75 T VAL CA 3 C4H1s 0.770 1.880 2.580 11.604 13.123 0.884 [OK] 12157 75 T VAL C 1 C3H0s 0.770 1.610 2.501 9.406 8.563 1.098 [OK] 12158 75 T VAL O 16 O1H0u 0.660 1.420 2.288 14.563 16.181 0.900 [OK] 12159 75 T VAL CB 4 C4H1b 0.770 1.880 3.145 13.562 14.598 0.929 possible 12160 75 T VAL CG1 10 C4H3u 0.770 1.880 4.263 46.105 36.584 1.260 possible 12161 75 T VAL CG2 10 C4H3u 0.770 1.880 3.489 38.089 36.332 1.048 possible 12162 76 T PRO N 11 N3H0u 0.700 1.640 2.381 8.807 8.823 0.998 [OK] 12163 76 T PRO CA 4 C4H1b 0.770 1.880 2.800 13.950 13.955 1.000 [OK] 12164 76 T PRO C 1 C3H0s 0.770 1.610 4.237 9.636 8.812 1.094 possible 12165 76 T PRO O 16 O1H0u 0.660 1.420 5.769 45.200 16.169 2.795 possible 12166 76 T PRO CB 9 C4H2b 0.770 1.880 4.540 48.044 25.563 1.879 possible 12167 76 T PRO CG 9 C4H2b 0.770 1.880 3.434 27.437 25.832 1.062 possible 12168 76 T PRO CD 8 C4H2s 0.770 1.880 3.456 25.669 23.836 1.077 possible 12169 77 T GLY N 12 N3H1s 0.700 1.640 4.172 17.330 14.854 1.167 possible 12170 77 T GLY CA 8 C4H2s 0.770 1.880 5.158 42.595 23.688 1.798 possible 12171 77 T GLY C 2 C3H0b 0.770 1.610 4.855 16.635 9.840 1.691 possible 12172 77 T GLY O 16 O1H0u 0.660 1.420 3.691 29.112 16.391 1.776 possible 12173 78 T PRO N 11 N3H0u 0.700 1.640 4.908 12.392 8.823 1.404 possible 12174 78 T PRO CA 4 C4H1b 0.770 1.880 5.965 29.760 13.955 2.133 possible 12175 78 T PRO C 1 C3H0s 0.770 1.610 2.908 9.219 8.812 1.046 [OK] 12176 78 T PRO O 16 O1H0u 0.660 1.420 5.570 48.377 16.169 2.992 possible 12177 78 T PRO CB 9 C4H2b 0.770 1.880 35.101 -1.000 25.563 -1.000 bad 12178 78 T PRO CG 9 C4H2b 0.770 1.880 44.847 -1.000 25.832 -1.000 bad 12179 78 T PRO CD 8 C4H2s 0.770 1.880 31.477 -1.000 23.836 -1.000 bad 12180 79 T GLU N 12 N3H1s 0.700 1.640 6.053 37.863 13.615 2.781 possible 12181 79 T GLU CA 3 C4H1s 0.770 1.880 3.907 21.542 13.399 1.608 possible 12182 79 T GLU C 1 C3H0s 0.770 1.610 3.037 8.578 8.675 0.989 possible 12183 79 T GLU O 16 O1H0u 0.660 1.420 20.963 -1.000 16.023 -1.000 bad 12184 79 T GLU CB 8 C4H2s 0.770 1.880 4.980 42.826 23.529 1.820 possible 12185 79 T GLU CG 8 C4H2s 0.770 1.880 4.498 31.188 23.513 1.326 possible 12186 79 T GLU CD 2 C3H0b 0.770 1.610 2.974 10.287 9.460 1.087 [OK] 12187 79 T GLU OE1 16 O1H0u 0.660 1.420 3.250 20.669 15.999 1.292 possible 12188 79 T GLU OE2 16 O1H0u 0.660 1.420 3.435 24.402 17.432 1.400 possible 12189 80 T SER N 12 N3H1s 0.700 1.640 3.450 16.964 14.103 1.203 possible 12190 80 T SER CA 3 C4H1s 0.770 1.880 5.462 28.466 13.476 2.112 possible 12191 80 T SER C 1 C3H0s 0.770 1.610 3.480 12.222 8.923 1.370 possible 12192 80 T SER O 16 O1H0u 0.660 1.420 4.050 28.668 16.179 1.772 possible 12193 80 T SER CB 8 C4H2s 0.770 1.880 35.690 -1.000 23.884 -1.000 bad 12194 80 T SER OG 17 O2H1u 0.660 1.460 7.614 99.917 18.732 5.334 possible 12195 81 T GLU N 12 N3H1s 0.700 1.640 3.241 16.709 13.615 1.227 possible 12196 81 T GLU CA 3 C4H1s 0.770 1.880 3.770 17.832 13.399 1.331 possible 12197 81 T GLU C 1 C3H0s 0.770 1.610 3.741 9.995 8.675 1.152 possible 12198 81 T GLU O 16 O1H0u 0.660 1.420 21.794 -1.000 16.023 -1.000 bad 12199 81 T GLU CB 8 C4H2s 0.770 1.880 4.409 29.436 23.529 1.251 possible 12200 81 T GLU CG 8 C4H2s 0.770 1.880 3.603 33.447 23.513 1.422 possible 12201 81 T GLU CD 2 C3H0b 0.770 1.610 2.918 10.648 9.460 1.126 [OK] 12202 81 T GLU OE1 16 O1H0u 0.660 1.420 4.174 32.940 15.999 2.059 possible 12203 81 T GLU OE2 16 O1H0u 0.660 1.420 2.885 18.085 17.432 1.037 [OK] 12204 82 T ASP N 12 N3H1s 0.700 1.640 3.903 16.485 13.895 1.186 possible 12205 82 T ASP CA 3 C4H1s 0.770 1.880 13.203 -1.000 13.377 -1.000 bad 12206 82 T ASP C 1 C3H0s 0.770 1.610 6.301 17.212 8.816 1.952 possible 12207 82 T ASP O 16 O1H0u 0.660 1.420 20.721 -1.000 16.091 -1.000 bad 12208 82 T ASP CB 8 C4H2s 0.770 1.880 35.699 -1.000 23.481 -1.000 bad 12209 82 T ASP CG 2 C3H0b 0.770 1.610 3.653 -1.000 9.422 -1.000 bad 12210 82 T ASP OD1 16 O1H0u 0.660 1.420 25.198 -1.000 15.505 -1.000 bad 12211 82 T ASP OD2 16 O1H0u 0.660 1.420 24.971 -1.000 16.324 -1.000 bad 12212 83 T ARG N 12 N3H1s 0.700 1.640 5.065 19.034 13.650 1.394 possible 12213 83 T ARG CA 3 C4H1s 0.770 1.880 3.825 13.376 13.422 0.997 possible 12214 83 T ARG C 1 C3H0s 0.770 1.610 4.884 10.962 8.838 1.240 possible 12215 83 T ARG O 16 O1H0u 0.660 1.420 9.226 -1.000 16.084 -1.000 bad 12216 83 T ARG CB 8 C4H2s 0.770 1.880 4.489 33.754 23.088 1.462 possible 12217 83 T ARG CG 8 C4H2s 0.770 1.880 5.206 43.114 23.640 1.824 possible 12218 83 T ARG CD 8 C4H2s 0.770 1.880 3.571 30.622 23.300 1.314 possible 12219 83 T ARG NE 13 N3H1b 0.700 1.640 4.283 21.318 15.569 1.369 possible 12220 83 T ARG CZ 2 C3H0b 0.770 1.610 2.910 10.923 9.747 1.121 [OK] 12221 83 T ARG NH1 15 N3H2u 0.700 1.640 3.303 26.820 22.782 1.177 possible 12222 83 T ARG NH2 15 N3H2u 0.700 1.640 2.913 22.076 23.810 0.927 [OK] 12223 84 T PRO N 11 N3H0u 0.700 1.640 4.697 10.386 8.823 1.177 possible 12224 84 T PRO CA 4 C4H1b 0.770 1.880 10.642 -1.000 13.955 -1.000 bad 12225 84 T PRO C 1 C3H0s 0.770 1.610 3.034 9.757 8.812 1.107 possible 12226 84 T PRO O 16 O1H0u 0.660 1.420 5.002 29.872 16.169 1.848 possible 12227 84 T PRO CB 9 C4H2b 0.770 1.880 35.702 -1.000 25.563 -1.000 bad 12228 84 T PRO CG 9 C4H2b 0.770 1.880 44.481 -1.000 25.832 -1.000 bad 12229 84 T PRO CD 8 C4H2s 0.770 1.880 23.870 -1.000 23.836 -1.000 bad 12230 85 T ILE N 12 N3H1s 0.700 1.640 5.430 25.252 13.633 1.852 possible 12231 85 T ILE CA 3 C4H1s 0.770 1.880 2.865 12.748 13.007 0.980 [OK] 12232 85 T ILE C 1 C3H0s 0.770 1.610 3.151 8.877 8.470 1.048 possible 12233 85 T ILE O 16 O1H0u 0.660 1.420 13.937 -1.000 16.144 -1.000 bad 12234 85 T ILE CB 4 C4H1b 0.770 1.880 3.344 13.716 14.227 0.964 possible 12235 85 T ILE CG1 9 C4H2b 0.770 1.880 4.137 35.120 24.187 1.452 possible 12236 85 T ILE CG2 10 C4H3u 0.770 1.880 2.979 34.688 35.961 0.965 [OK] 12237 85 T ILE CD1 10 C4H3u 0.770 1.880 3.215 41.716 38.377 1.087 possible 12238 86 T ALA N 12 N3H1s 0.700 1.640 3.206 15.547 14.046 1.107 possible 12239 86 T ALA CA 4 C4H1b 0.770 1.880 5.660 25.128 14.063 1.787 possible 12240 86 T ALA C 1 C3H0s 0.770 1.610 2.562 9.426 8.900 1.059 [OK] 12241 86 T ALA O 16 O1H0u 0.660 1.420 2.742 15.836 16.188 0.978 [OK] 12242 86 T ALA CB 10 C4H3u 0.770 1.880 7.340 67.099 36.782 1.824 possible 12243 87 T LEU N 12 N3H1s 0.700 1.640 3.667 15.924 13.655 1.166 possible 12244 87 T LEU CA 3 C4H1s 0.770 1.880 2.519 12.030 13.122 0.917 [OK] 12245 87 T LEU C 1 C3H0s 0.770 1.610 2.447 9.130 8.825 1.035 [OK] 12246 87 T LEU O 16 O1H0u 0.660 1.420 13.479 -1.000 16.208 -1.000 bad 12247 87 T LEU CB 8 C4H2s 0.770 1.880 2.928 22.901 22.951 0.998 [OK] 12248 87 T LEU CG 4 C4H1b 0.770 1.880 2.618 12.946 14.764 0.877 [OK] 12249 87 T LEU CD1 10 C4H3u 0.770 1.880 2.728 29.482 37.425 0.788 [OK] 12250 87 T LEU CD2 10 C4H3u 0.770 1.880 2.902 34.385 37.143 0.926 [OK] 12251 88 T ALA N 12 N3H1s 0.700 1.640 2.488 13.410 14.046 0.955 [OK] 12252 88 T ALA CA 4 C4H1b 0.770 1.880 6.779 -1.000 14.063 -1.000 bad 12253 88 T ALA C 1 C3H0s 0.770 1.610 2.601 9.510 8.900 1.069 [OK] 12254 88 T ALA O 16 O1H0u 0.660 1.420 3.208 17.612 16.188 1.088 possible 12255 88 T ALA CB 10 C4H3u 0.770 1.880 38.772 -1.000 36.782 -1.000 bad 12256 89 T ARG N 12 N3H1s 0.700 1.640 5.303 -1.000 13.650 -1.000 bad 12257 89 T ARG CA 3 C4H1s 0.770 1.880 2.630 13.572 13.422 1.011 [OK] 12258 89 T ARG C 1 C3H0s 0.770 1.610 2.625 9.025 8.838 1.021 [OK] 12259 89 T ARG O 16 O1H0u 0.660 1.420 23.588 -1.000 16.084 -1.000 bad 12260 89 T ARG CB 8 C4H2s 0.770 1.880 16.705 -1.000 23.088 -1.000 bad 12261 89 T ARG CG 8 C4H2s 0.770 1.880 3.976 27.367 23.640 1.158 possible 12262 89 T ARG CD 8 C4H2s 0.770 1.880 26.768 -1.000 23.300 -1.000 bad 12263 89 T ARG NE 13 N3H1b 0.700 1.640 6.371 24.469 15.569 1.572 possible 12264 89 T ARG CZ 2 C3H0b 0.770 1.610 6.114 17.455 9.747 1.791 possible 12265 89 T ARG NH1 15 N3H2u 0.700 1.640 5.716 37.005 22.782 1.624 possible 12266 89 T ARG NH2 15 N3H2u 0.700 1.640 6.162 44.086 23.810 1.852 possible 12267 90 T THR N 12 N3H1s 0.700 1.640 3.114 15.489 13.832 1.120 possible 12268 90 T THR CA 3 C4H1s 0.770 1.880 6.618 20.035 13.099 1.530 possible 12269 90 T THR C 1 C3H0s 0.770 1.610 3.747 10.417 8.738 1.192 possible 12270 90 T THR O 16 O1H0u 0.660 1.420 25.166 -1.000 16.020 -1.000 bad 12271 90 T THR CB 4 C4H1b 0.770 1.880 2.779 14.625 14.829 0.986 [OK] 12272 90 T THR OG1 17 O2H1u 0.660 1.460 5.611 32.796 18.123 1.810 possible 12273 90 T THR CG2 10 C4H3u 0.770 1.880 45.246 -1.000 36.542 -1.000 bad 12274 91 T ALA N 12 N3H1s 0.700 1.640 3.943 18.555 14.046 1.321 possible 12275 91 T ALA CA 4 C4H1b 0.770 1.880 6.458 27.600 14.063 1.963 possible 12276 91 T ALA C 1 C3H0s 0.770 1.610 4.424 12.612 8.900 1.417 possible 12277 91 T ALA O 16 O1H0u 0.660 1.420 3.519 19.625 16.188 1.212 possible 12278 91 T ALA CB 10 C4H3u 0.770 1.880 19.895 -1.000 36.782 -1.000 bad 12279 92 T VAL N 12 N3H1s 0.700 1.640 5.221 23.653 13.676 1.730 possible 12280 92 T VAL CA 3 C4H1s 0.770 1.880 3.548 15.557 13.123 1.185 possible 12281 92 T VAL C 1 C3H0s 0.770 1.610 3.626 9.483 8.563 1.107 possible 12282 92 T VAL O 16 O1H0u 0.660 1.420 8.796 -1.000 16.181 -1.000 bad 12283 92 T VAL CB 4 C4H1b 0.770 1.880 9.819 -1.000 14.598 -1.000 bad 12284 92 T VAL CG1 10 C4H3u 0.770 1.880 56.908 -1.000 36.584 -1.000 bad 12285 92 T VAL CG2 10 C4H3u 0.770 1.880 60.257 -1.000 36.332 -1.000 bad 12286 93 T SER N 12 N3H1s 0.700 1.640 3.898 14.848 14.103 1.053 possible 12287 93 T SER CA 3 C4H1s 0.770 1.880 9.793 -1.000 13.476 -1.000 bad 12288 93 T SER C 1 C3H0s 0.770 1.610 2.362 8.849 8.923 0.992 [OK] 12289 93 T SER O 16 O1H0u 0.660 1.420 2.944 20.564 16.179 1.271 [OK] 12290 93 T SER CB 8 C4H2s 0.770 1.880 18.698 -1.000 23.884 -1.000 bad 12291 93 T SER OG 17 O2H1u 0.660 1.460 35.325 -1.000 18.732 -1.000 bad 12292 94 T GLU N 12 N3H1s 0.700 1.640 4.369 -1.000 13.615 -1.000 bad 12293 94 T GLU CA 3 C4H1s 0.770 1.880 2.661 13.550 13.399 1.011 [OK] 12294 94 T GLU C 1 C3H0s 0.770 1.610 3.603 9.306 8.675 1.073 possible 12295 94 T GLU O 16 O1H0u 0.660 1.420 18.107 -1.000 16.023 -1.000 bad 12296 94 T GLU CB 8 C4H2s 0.770 1.880 25.170 -1.000 23.529 -1.000 bad 12297 94 T GLU CG 8 C4H2s 0.770 1.880 31.556 -1.000 23.513 -1.000 bad 12298 94 T GLU CD 2 C3H0b 0.770 1.610 5.277 14.162 9.460 1.497 possible 12299 94 T GLU OE1 16 O1H0u 0.660 1.420 4.693 39.727 15.999 2.483 possible 12300 94 T GLU OE2 16 O1H0u 0.660 1.420 4.432 20.238 17.432 1.161 possible 12301 95 T GLY N 12 N3H1s 0.700 1.640 4.045 19.916 14.854 1.341 possible 12302 95 T GLY CA 8 C4H2s 0.770 1.880 3.791 31.999 23.688 1.351 possible 12303 95 T GLY C 2 C3H0b 0.770 1.610 3.115 11.333 9.840 1.152 possible 12304 95 T GLY O 16 O1H0u 0.660 1.420 2.872 16.669 16.391 1.017 [OK] 12305 96 T PHE N 12 N3H1s 0.700 1.640 2.869 14.971 13.691 1.093 [OK] 12306 96 T PHE CA 3 C4H1s 0.770 1.880 2.578 11.890 13.449 0.884 [OK] 12307 96 T PHE C 1 C3H0s 0.770 1.610 2.455 9.567 8.753 1.093 [OK] 12308 96 T PHE O 16 O1H0u 0.660 1.420 2.947 22.329 16.151 1.383 [OK] 12309 96 T PHE CB 8 C4H2s 0.770 1.880 3.480 29.041 23.777 1.221 possible 12310 96 T PHE CG 2 C3H0b 0.770 1.610 2.621 9.677 9.721 0.995 [OK] 12311 96 T PHE CD1 5 C3H1s 0.770 1.760 2.995 20.990 20.405 1.029 [OK] 12312 96 T PHE CD2 6 C3H1b 0.770 1.760 4.215 33.305 21.051 1.582 possible 12313 96 T PHE CE1 6 C3H1b 0.770 1.760 15.713 -1.000 21.580 -1.000 bad 12314 96 T PHE CE2 6 C3H1b 0.770 1.760 20.984 -1.000 21.680 -1.000 bad 12315 96 T PHE CZ 6 C3H1b 0.770 1.760 24.463 -1.000 21.666 -1.000 bad 12316 97 T PRO N 11 N3H0u 0.700 1.640 2.472 9.013 8.823 1.022 [OK] 12317 97 T PRO CA 4 C4H1b 0.770 1.880 2.877 14.337 13.955 1.027 [OK] 12318 97 T PRO C 1 C3H0s 0.770 1.610 2.596 8.947 8.812 1.015 [OK] 12319 97 T PRO O 16 O1H0u 0.660 1.420 2.956 16.688 16.169 1.032 [OK] 12320 97 T PRO CB 9 C4H2b 0.770 1.880 3.746 28.392 25.563 1.111 possible 12321 97 T PRO CG 9 C4H2b 0.770 1.880 3.988 31.763 25.832 1.230 possible 12322 97 T PRO CD 8 C4H2s 0.770 1.880 4.163 28.894 23.836 1.212 possible 12323 98 T HIS N 12 N3H1s 0.700 1.640 2.766 13.388 13.715 0.976 [OK] 12324 98 T HIS CA 3 C4H1s 0.770 1.880 2.513 12.510 13.467 0.929 [OK] 12325 98 T HIS C 1 C3H0s 0.770 1.610 2.402 8.840 8.882 0.995 [OK] 12326 98 T HIS O 16 O1H0u 0.660 1.420 2.289 15.377 16.082 0.956 [OK] 12327 98 T HIS CB 8 C4H2s 0.770 1.880 3.058 24.384 23.653 1.031 possible 12328 98 T HIS CG 2 C3H0b 0.770 1.610 2.912 11.591 9.952 1.165 [OK] 12329 98 T HIS ND1 13 N3H1b 0.700 1.640 2.635 15.356 15.506 0.990 [OK] 12330 98 T HIS CD2 5 C3H1s 0.770 1.760 3.406 24.070 21.085 1.142 possible 12331 98 T HIS CE1 5 C3H1s 0.770 1.760 3.681 24.842 20.636 1.204 possible 12332 98 T HIS NE2 13 N3H1b 0.700 1.640 3.336 19.390 15.337 1.264 possible 12333 99 T ALA N 12 N3H1s 0.700 1.640 2.872 15.525 14.046 1.105 [OK] 12334 99 T ALA CA 4 C4H1b 0.770 1.880 2.632 12.219 14.063 0.869 [OK] 12335 99 T ALA C 1 C3H0s 0.770 1.610 2.532 8.902 8.900 1.000 [OK] 12336 99 T ALA O 16 O1H0u 0.660 1.420 3.024 16.682 16.188 1.031 possible 12337 99 T ALA CB 10 C4H3u 0.770 1.880 32.660 -1.000 36.782 -1.000 bad 12338 100 T PRO N 11 N3H0u 0.700 1.640 2.529 8.186 8.823 0.928 [OK] 12339 100 T PRO CA 4 C4H1b 0.770 1.880 2.474 11.773 13.955 0.844 [OK] 12340 100 T PRO C 1 C3H0s 0.770 1.610 2.647 8.981 8.812 1.019 [OK] 12341 100 T PRO O 16 O1H0u 0.660 1.420 7.121 -1.000 16.169 -1.000 bad 12342 100 T PRO CB 9 C4H2b 0.770 1.880 3.260 26.774 25.563 1.047 possible 12343 100 T PRO CG 9 C4H2b 0.770 1.880 3.275 26.584 25.832 1.029 possible 12344 100 T PRO CD 8 C4H2s 0.770 1.880 3.839 31.129 23.836 1.306 possible 12345 101 T THR N 12 N3H1s 0.700 1.640 2.701 13.471 13.832 0.974 [OK] 12346 101 T THR CA 3 C4H1s 0.770 1.880 6.020 21.933 13.099 1.674 possible 12347 101 T THR C 1 C3H0s 0.770 1.610 3.779 10.093 8.738 1.155 possible 12348 101 T THR O 16 O1H0u 0.660 1.420 34.722 -1.000 16.020 -1.000 bad 12349 101 T THR CB 4 C4H1b 0.770 1.880 16.638 -1.000 14.829 -1.000 bad 12350 101 T THR OG1 17 O2H1u 0.660 1.460 10.443 -1.000 18.123 -1.000 bad 12351 101 T THR CG2 10 C4H3u 0.770 1.880 27.131 -1.000 36.542 -1.000 bad 12352 102 T GLY N 12 N3H1s 0.700 1.640 4.008 18.852 14.854 1.269 possible 12353 102 T GLY CA 8 C4H2s 0.770 1.880 28.114 -1.000 23.688 -1.000 bad 12354 102 T GLY C 2 C3H0b 0.770 1.610 2.058 -1.000 9.840 -1.000 bad 12355 102 T GLY O 16 O1H0u 0.660 1.420 7.675 -1.000 16.391 -1.000 bad 12356 103 T ASP N 12 N3H1s 0.700 1.640 7.698 -1.000 13.895 -1.000 bad 12357 103 T ASP CA 3 C4H1s 0.770 1.880 7.665 23.353 13.377 1.746 possible 12358 103 T ASP C 1 C3H0s 0.770 1.610 2.854 8.861 8.816 1.005 [OK] 12359 103 T ASP O 16 O1H0u 0.660 1.420 2.857 16.114 16.091 1.001 [OK] 12360 103 T ASP CB 8 C4H2s 0.770 1.880 21.651 -1.000 23.481 -1.000 bad 12361 103 T ASP CG 2 C3H0b 0.770 1.610 5.497 14.492 9.422 1.538 possible 12362 103 T ASP OD1 16 O1H0u 0.660 1.420 25.738 -1.000 15.505 -1.000 bad 12363 103 T ASP OD2 16 O1H0u 0.660 1.420 4.803 28.513 16.324 1.747 possible 12364 104 T PRO N 11 N3H0u 0.700 1.640 2.949 8.477 8.823 0.961 [OK] 12365 104 T PRO CA 4 C4H1b 0.770 1.880 3.187 14.362 13.955 1.029 possible 12366 104 T PRO C 1 C3H0s 0.770 1.610 2.549 8.980 8.812 1.019 [OK] 12367 104 T PRO O 16 O1H0u 0.660 1.420 2.365 15.209 16.169 0.941 [OK] 12368 104 T PRO CB 9 C4H2b 0.770 1.880 2.801 22.271 25.563 0.871 [OK] 12369 104 T PRO CG 9 C4H2b 0.770 1.880 5.210 35.877 25.832 1.389 possible 12370 104 T PRO CD 8 C4H2s 0.770 1.880 7.365 57.557 23.836 2.415 possible 12371 105 T MET N 12 N3H1s 0.700 1.640 2.718 15.467 13.564 1.140 [OK] 12372 105 T MET CA 3 C4H1s 0.770 1.880 2.828 13.034 13.231 0.985 [OK] 12373 105 T MET C 1 C3H0s 0.770 1.610 2.509 8.657 8.782 0.986 [OK] 12374 105 T MET O 16 O1H0u 0.660 1.420 3.225 25.913 16.277 1.592 possible 12375 105 T MET CB 8 C4H2s 0.770 1.880 3.631 27.250 23.645 1.152 possible 12376 105 T MET CG 9 C4H2b 0.770 1.880 4.204 34.559 24.009 1.439 possible 12377 105 T MET SD 19 S2H0u 1.040 1.770 2.914 29.259 30.093 0.972 [OK] 12378 105 T MET CE 10 C4H3u 0.770 1.880 3.289 37.203 37.161 1.001 possible 12379 106 T LYS N 12 N3H1s 0.700 1.640 2.761 14.040 13.675 1.027 [OK] 12380 106 T LYS CA 3 C4H1s 0.770 1.880 3.419 16.503 13.324 1.239 possible 12381 106 T LYS C 1 C3H0s 0.770 1.610 2.926 8.802 8.759 1.005 [OK] 12382 106 T LYS O 16 O1H0u 0.660 1.420 25.877 -1.000 16.049 -1.000 bad 12383 106 T LYS CB 8 C4H2s 0.770 1.880 10.766 -1.000 22.904 -1.000 bad 12384 106 T LYS CG 8 C4H2s 0.770 1.880 5.290 32.169 23.131 1.391 possible 12385 106 T LYS CD 8 C4H2s 0.770 1.880 20.992 -1.000 23.837 -1.000 bad 12386 106 T LYS CE 9 C4H2b 0.770 1.880 32.776 -1.000 23.934 -1.000 bad 12387 106 T LYS NZ 14 N4H3u 0.700 1.640 53.006 -1.000 21.213 -1.000 bad 12388 107 T ASP N 12 N3H1s 0.700 1.640 2.375 12.821 13.895 0.923 [OK] 12389 107 T ASP CA 3 C4H1s 0.770 1.880 5.837 21.380 13.377 1.598 possible 12390 107 T ASP C 1 C3H0s 0.770 1.610 2.757 9.814 8.816 1.113 [OK] 12391 107 T ASP O 16 O1H0u 0.660 1.420 5.113 29.780 16.091 1.851 possible 12392 107 T ASP CB 8 C4H2s 0.770 1.880 3.541 24.552 23.481 1.046 possible 12393 107 T ASP CG 2 C3H0b 0.770 1.610 3.354 10.401 9.422 1.104 possible 12394 107 T ASP OD1 16 O1H0u 0.660 1.420 28.093 -1.000 15.505 -1.000 bad 12395 107 T ASP OD2 16 O1H0u 0.660 1.420 5.243 27.340 16.324 1.675 possible 12396 108 T GLY N 12 N3H1s 0.700 1.640 3.154 14.771 14.854 0.994 possible 12397 108 T GLY CA 8 C4H2s 0.770 1.880 3.382 24.380 23.688 1.029 possible 12398 108 T GLY C 2 C3H0b 0.770 1.610 2.178 8.872 9.840 0.902 [OK] 12399 108 T GLY O 16 O1H0u 0.660 1.420 2.656 17.007 16.391 1.038 [OK] 12400 109 T VAL N 12 N3H1s 0.700 1.640 2.314 13.157 13.676 0.962 [OK] 12401 109 T VAL CA 3 C4H1s 0.770 1.880 2.643 12.617 13.123 0.961 [OK] 12402 109 T VAL C 1 C3H0s 0.770 1.610 2.772 9.319 8.563 1.088 [OK] 12403 109 T VAL O 16 O1H0u 0.660 1.420 2.567 17.448 16.181 1.078 [OK] 12404 109 T VAL CB 4 C4H1b 0.770 1.880 2.732 14.430 14.598 0.989 [OK] 12405 109 T VAL CG1 10 C4H3u 0.770 1.880 3.171 37.829 36.584 1.034 possible 12406 109 T VAL CG2 10 C4H3u 0.770 1.880 3.226 34.533 36.332 0.950 possible 12407 110 T GLY N 12 N3H1s 0.700 1.640 2.654 13.445 14.854 0.905 [OK] 12408 110 T GLY CA 8 C4H2s 0.770 1.880 2.789 21.400 23.688 0.903 [OK] 12409 110 T GLY C 2 C3H0b 0.770 1.610 2.318 8.362 9.840 0.850 [OK] 12410 110 T GLY O 16 O1H0u 0.660 1.420 2.725 15.861 16.391 0.968 [OK] 12411 111 T PRO N 11 N3H0u 0.700 1.640 2.443 8.082 8.823 0.916 [OK] 12412 111 T PRO CA 4 C4H1b 0.770 1.880 3.182 15.586 13.955 1.117 possible 12413 111 T PRO C 1 C3H0s 0.770 1.610 2.356 8.553 8.812 0.971 [OK] 12414 111 T PRO O 16 O1H0u 0.660 1.420 2.473 15.271 16.169 0.944 [OK] 12415 111 T PRO CB 9 C4H2b 0.770 1.880 2.934 23.550 25.563 0.921 [OK] 12416 111 T PRO CG 9 C4H2b 0.770 1.880 2.885 22.696 25.832 0.879 [OK] 12417 111 T PRO CD 8 C4H2s 0.770 1.880 3.224 24.605 23.836 1.032 possible 12418 112 T ALA N 12 N3H1s 0.700 1.640 2.530 13.752 14.046 0.979 [OK] 12419 112 T ALA CA 4 C4H1b 0.770 1.880 2.529 12.373 14.063 0.880 [OK] 12420 112 T ALA C 1 C3H0s 0.770 1.610 2.358 9.542 8.900 1.072 [OK] 12421 112 T ALA O 16 O1H0u 0.660 1.420 2.825 20.654 16.188 1.276 [OK] 12422 112 T ALA CB 10 C4H3u 0.770 1.880 3.088 38.418 36.782 1.044 possible 12423 113 T SER N 12 N3H1s 0.700 1.640 2.289 13.001 14.103 0.922 [OK] 12424 113 T SER CA 3 C4H1s 0.770 1.880 2.691 12.080 13.476 0.896 [OK] 12425 113 T SER C 1 C3H0s 0.770 1.610 2.802 9.058 8.923 1.015 [OK] 12426 113 T SER O 16 O1H0u 0.660 1.420 2.468 16.426 16.179 1.015 [OK] 12427 113 T SER CB 8 C4H2s 0.770 1.880 2.944 22.466 23.884 0.941 [OK] 12428 113 T SER OG 17 O2H1u 0.660 1.460 2.350 18.073 18.732 0.965 [OK] 12429 114 T TRP N 12 N3H1s 0.700 1.640 2.886 15.360 13.791 1.114 [OK] 12430 114 T TRP CA 3 C4H1s 0.770 1.880 2.842 14.850 13.377 1.110 [OK] 12431 114 T TRP C 1 C3H0s 0.770 1.610 2.866 9.274 8.724 1.063 [OK] 12432 114 T TRP O 16 O1H0u 0.660 1.420 3.050 18.187 15.951 1.140 possible 12433 114 T TRP CB 8 C4H2s 0.770 1.880 3.209 24.672 24.004 1.028 possible 12434 114 T TRP CG 2 C3H0b 0.770 1.610 2.239 9.181 9.965 0.921 [OK] 12435 114 T TRP CD1 5 C3H1s 0.770 1.760 3.053 22.333 20.874 1.070 possible 12436 114 T TRP CD2 2 C3H0b 0.770 1.610 2.334 9.503 10.097 0.941 [OK] 12437 114 T TRP NE1 13 N3H1b 0.700 1.640 4.477 30.735 16.969 1.811 possible 12438 114 T TRP CE2 2 C3H0b 0.770 1.610 2.873 9.363 9.889 0.947 [OK] 12439 114 T TRP CE3 6 C3H1b 0.770 1.760 2.961 20.037 20.448 0.980 [OK] 12440 114 T TRP CZ2 6 C3H1b 0.770 1.760 18.233 -1.000 21.012 -1.000 bad 12441 114 T TRP CZ3 6 C3H1b 0.770 1.760 4.147 23.821 21.516 1.107 possible 12442 114 T TRP CH2 6 C3H1b 0.770 1.760 7.904 80.683 21.339 3.781 possible 12443 115 T VAL N 12 N3H1s 0.700 1.640 2.500 13.129 13.676 0.960 [OK] 12444 115 T VAL CA 3 C4H1s 0.770 1.880 3.539 15.197 13.123 1.158 possible 12445 115 T VAL C 1 C3H0s 0.770 1.610 2.364 8.044 8.563 0.939 [OK] 12446 115 T VAL O 16 O1H0u 0.660 1.420 2.599 16.589 16.181 1.025 [OK] 12447 115 T VAL CB 4 C4H1b 0.770 1.880 2.604 13.996 14.598 0.959 [OK] 12448 115 T VAL CG1 10 C4H3u 0.770 1.880 4.370 46.065 36.584 1.259 possible 12449 115 T VAL CG2 10 C4H3u 0.770 1.880 3.003 32.753 36.332 0.901 possible 12450 116 T ALA N 12 N3H1s 0.700 1.640 3.668 21.959 14.046 1.563 possible 12451 116 T ALA CA 4 C4H1b 0.770 1.880 3.201 13.568 14.063 0.965 possible 12452 116 T ALA C 1 C3H0s 0.770 1.610 3.245 10.073 8.900 1.132 possible 12453 116 T ALA O 16 O1H0u 0.660 1.420 6.299 64.704 16.188 3.997 possible 12454 116 T ALA CB 10 C4H3u 0.770 1.880 6.773 125.376 36.782 3.409 possible 12455 117 T ARG N 12 N3H1s 0.700 1.640 2.474 12.797 13.650 0.938 [OK] 12456 117 T ARG CA 3 C4H1s 0.770 1.880 3.141 14.803 13.422 1.103 possible 12457 117 T ARG C 1 C3H0s 0.770 1.610 4.277 11.606 8.838 1.313 possible 12458 117 T ARG O 16 O1H0u 0.660 1.420 7.388 40.334 16.084 2.508 possible 12459 117 T ARG CB 8 C4H2s 0.770 1.880 2.844 22.491 23.088 0.974 [OK] 12460 117 T ARG CG 8 C4H2s 0.770 1.880 3.220 25.488 23.640 1.078 possible 12461 117 T ARG CD 8 C4H2s 0.770 1.880 2.739 21.505 23.300 0.923 [OK] 12462 117 T ARG NE 13 N3H1b 0.700 1.640 2.547 16.001 15.569 1.028 [OK] 12463 117 T ARG CZ 2 C3H0b 0.770 1.610 2.550 10.095 9.747 1.036 [OK] 12464 117 T ARG NH1 15 N3H2u 0.700 1.640 2.780 22.967 22.782 1.008 [OK] 12465 117 T ARG NH2 15 N3H2u 0.700 1.640 2.629 24.144 23.810 1.014 [OK] 12466 118 T ARG N 12 N3H1s 0.700 1.640 5.560 22.072 13.650 1.617 possible 12467 118 T ARG CA 3 C4H1s 0.770 1.880 10.587 -1.000 13.422 -1.000 bad 12468 118 T ARG C 1 C3H0s 0.770 1.610 2.236 7.906 8.838 0.895 [OK] 12469 118 T ARG O 16 O1H0u 0.660 1.420 2.435 16.127 16.084 1.003 [OK] 12470 118 T ARG CB 8 C4H2s 0.770 1.880 5.405 30.215 23.088 1.309 possible 12471 118 T ARG CG 8 C4H2s 0.770 1.880 7.032 44.892 23.640 1.899 possible 12472 118 T ARG CD 8 C4H2s 0.770 1.880 3.118 23.411 23.300 1.005 possible 12473 118 T ARG NE 13 N3H1b 0.700 1.640 3.467 26.223 15.569 1.684 possible 12474 118 T ARG CZ 2 C3H0b 0.770 1.610 5.639 13.418 9.747 1.377 possible 12475 118 T ARG NH1 15 N3H2u 0.700 1.640 25.145 -1.000 22.782 -1.000 bad 12476 118 T ARG NH2 15 N3H2u 0.700 1.640 19.145 -1.000 23.810 -1.000 bad 12477 119 T ASP N 12 N3H1s 0.700 1.640 6.497 29.514 13.895 2.124 possible 12478 119 T ASP CA 3 C4H1s 0.770 1.880 2.563 12.371 13.377 0.925 [OK] 12479 119 T ASP C 1 C3H0s 0.770 1.610 2.700 9.163 8.816 1.039 [OK] 12480 119 T ASP O 16 O1H0u 0.660 1.420 4.483 26.389 16.091 1.640 possible 12481 119 T ASP CB 8 C4H2s 0.770 1.880 12.984 -1.000 23.481 -1.000 bad 12482 119 T ASP CG 2 C3H0b 0.770 1.610 3.124 9.772 9.422 1.037 possible 12483 119 T ASP OD1 16 O1H0u 0.660 1.420 3.882 19.174 15.505 1.237 possible 12484 119 T ASP OD2 16 O1H0u 0.660 1.420 22.401 -1.000 16.324 -1.000 bad 12485 120 T LEU N 12 N3H1s 0.700 1.640 2.463 12.448 13.655 0.912 [OK] 12486 120 T LEU CA 3 C4H1s 0.770 1.880 3.645 13.838 13.122 1.055 possible 12487 120 T LEU C 1 C3H0s 0.770 1.610 2.423 8.831 8.825 1.001 [OK] 12488 120 T LEU O 16 O1H0u 0.660 1.420 2.542 16.648 16.208 1.027 [OK] 12489 120 T LEU CB 8 C4H2s 0.770 1.880 2.889 21.283 22.951 0.927 [OK] 12490 120 T LEU CG 4 C4H1b 0.770 1.880 3.569 17.343 14.764 1.175 possible 12491 120 T LEU CD1 10 C4H3u 0.770 1.880 27.625 -1.000 37.425 -1.000 bad 12492 120 T LEU CD2 10 C4H3u 0.770 1.880 46.113 -1.000 37.143 -1.000 bad 12493 121 T PRO N 11 N3H0u 0.700 1.640 2.280 8.122 8.823 0.921 [OK] 12494 121 T PRO CA 4 C4H1b 0.770 1.880 2.615 12.524 13.955 0.897 [OK] 12495 121 T PRO C 1 C3H0s 0.770 1.610 2.492 9.208 8.812 1.045 [OK] 12496 121 T PRO O 16 O1H0u 0.660 1.420 2.489 15.621 16.169 0.966 [OK] 12497 121 T PRO CB 9 C4H2b 0.770 1.880 2.692 23.277 25.563 0.911 [OK] 12498 121 T PRO CG 9 C4H2b 0.770 1.880 2.976 25.454 25.832 0.985 [OK] 12499 121 T PRO CD 8 C4H2s 0.770 1.880 4.205 36.369 23.836 1.526 possible 12500 122 T GLU N 12 N3H1s 0.700 1.640 2.510 13.565 13.615 0.996 [OK] 12501 122 T GLU CA 3 C4H1s 0.770 1.880 3.064 14.815 13.399 1.106 possible 12502 122 T GLU C 1 C3H0s 0.770 1.610 2.538 8.311 8.675 0.958 [OK] 12503 122 T GLU O 16 O1H0u 0.660 1.420 2.281 14.614 16.023 0.912 [OK] 12504 122 T GLU CB 8 C4H2s 0.770 1.880 3.049 22.672 23.529 0.964 possible 12505 122 T GLU CG 8 C4H2s 0.770 1.880 3.048 26.166 23.513 1.113 possible 12506 122 T GLU CD 2 C3H0b 0.770 1.610 2.470 8.706 9.460 0.920 [OK] 12507 122 T GLU OE1 16 O1H0u 0.660 1.420 2.304 14.663 15.999 0.917 [OK] 12508 122 T GLU OE2 16 O1H0u 0.660 1.420 3.040 20.575 17.432 1.180 possible 12509 123 T LEU N 12 N3H1s 0.700 1.640 2.496 13.412 13.655 0.982 [OK] 12510 123 T LEU CA 3 C4H1s 0.770 1.880 2.426 12.195 13.122 0.929 [OK] 12511 123 T LEU C 1 C3H0s 0.770 1.610 2.467 9.324 8.825 1.057 [OK] 12512 123 T LEU O 16 O1H0u 0.660 1.420 2.423 18.224 16.208 1.124 [OK] 12513 123 T LEU CB 8 C4H2s 0.770 1.880 2.783 21.089 22.951 0.919 [OK] 12514 123 T LEU CG 4 C4H1b 0.770 1.880 2.932 13.643 14.764 0.924 [OK] 12515 123 T LEU CD1 10 C4H3u 0.770 1.880 2.983 32.557 37.425 0.870 [OK] 12516 123 T LEU CD2 10 C4H3u 0.770 1.880 7.093 69.314 37.143 1.866 possible 12517 124 T ASP N 12 N3H1s 0.700 1.640 2.547 14.423 13.895 1.038 [OK] 12518 124 T ASP CA 3 C4H1s 0.770 1.880 2.900 14.618 13.377 1.093 [OK] 12519 124 T ASP C 1 C3H0s 0.770 1.610 2.688 9.376 8.816 1.063 [OK] 12520 124 T ASP O 16 O1H0u 0.660 1.420 2.454 14.859 16.091 0.923 [OK] 12521 124 T ASP CB 8 C4H2s 0.770 1.880 2.935 22.567 23.481 0.961 [OK] 12522 124 T ASP CG 2 C3H0b 0.770 1.610 2.876 10.582 9.422 1.123 [OK] 12523 124 T ASP OD1 16 O1H0u 0.660 1.420 2.668 16.279 15.505 1.050 [OK] 12524 124 T ASP OD2 16 O1H0u 0.660 1.420 3.771 29.501 16.324 1.807 possible 12525 125 T GLY N 12 N3H1s 0.700 1.640 2.807 16.918 14.854 1.139 [OK] 12526 125 T GLY CA 8 C4H2s 0.770 1.880 3.280 25.175 23.688 1.063 possible 12527 125 T GLY C 2 C3H0b 0.770 1.610 2.497 9.773 9.840 0.993 [OK] 12528 125 T GLY O 16 O1H0u 0.660 1.420 4.925 39.066 16.391 2.383 possible 12529 126 T HIS N 12 N3H1s 0.700 1.640 2.615 13.103 13.715 0.955 [OK] 12530 126 T HIS CA 3 C4H1s 0.770 1.880 3.923 16.051 13.467 1.192 possible 12531 126 T HIS C 1 C3H0s 0.770 1.610 5.264 15.634 8.882 1.760 possible 12532 126 T HIS O 16 O1H0u 0.660 1.420 7.602 -1.000 16.082 -1.000 bad 12533 126 T HIS CB 8 C4H2s 0.770 1.880 6.303 42.375 23.653 1.792 possible 12534 126 T HIS CG 2 C3H0b 0.770 1.610 5.546 15.624 9.952 1.570 possible 12535 126 T HIS ND1 13 N3H1b 0.700 1.640 10.949 -1.000 15.506 -1.000 bad 12536 126 T HIS CD2 5 C3H1s 0.770 1.760 6.772 61.582 21.085 2.921 possible 12537 126 T HIS CE1 5 C3H1s 0.770 1.760 7.339 56.816 20.636 2.753 possible 12538 126 T HIS NE2 13 N3H1b 0.700 1.640 6.220 48.213 15.337 3.144 possible 12539 127 T GLY N 12 N3H1s 0.700 1.640 3.297 16.323 14.854 1.099 possible 12540 127 T GLY CA 8 C4H2s 0.770 1.880 13.476 -1.000 23.688 -1.000 bad 12541 127 T GLY C 2 C3H0b 0.770 1.610 3.948 11.183 9.840 1.137 possible 12542 127 T GLY O 16 O1H0u 0.660 1.420 13.855 -1.000 16.391 -1.000 bad 12543 128 T HIS N 12 N3H1s 0.700 1.640 2.455 12.314 13.715 0.898 [OK] 12544 128 T HIS CA 3 C4H1s 0.770 1.880 5.824 23.520 13.467 1.746 possible 12545 128 T HIS C 1 C3H0s 0.770 1.610 2.629 9.250 8.882 1.041 [OK] 12546 128 T HIS O 16 O1H0u 0.660 1.420 2.336 14.867 16.082 0.924 [OK] 12547 128 T HIS CB 8 C4H2s 0.770 1.880 5.209 28.002 23.653 1.184 possible 12548 128 T HIS CG 2 C3H0b 0.770 1.610 4.062 13.724 9.952 1.379 possible 12549 128 T HIS ND1 13 N3H1b 0.700 1.640 4.453 25.437 15.506 1.640 possible 12550 128 T HIS CD2 5 C3H1s 0.770 1.760 20.410 -1.000 21.085 -1.000 bad 12551 128 T HIS CE1 5 C3H1s 0.770 1.760 36.548 -1.000 20.636 -1.000 bad 12552 128 T HIS NE2 13 N3H1b 0.700 1.640 24.754 -1.000 15.337 -1.000 bad 12553 129 T ASN N 12 N3H1s 0.700 1.640 4.787 23.423 13.695 1.710 possible 12554 129 T ASN CA 3 C4H1s 0.770 1.880 2.661 13.294 13.167 1.010 [OK] 12555 129 T ASN C 1 C3H0s 0.770 1.610 2.450 8.677 8.928 0.972 [OK] 12556 129 T ASN O 16 O1H0u 0.660 1.420 2.567 19.215 16.199 1.186 [OK] 12557 129 T ASN CB 8 C4H2s 0.770 1.880 3.121 24.191 23.128 1.046 possible 12558 129 T ASN CG 2 C3H0b 0.770 1.610 3.514 10.874 9.599 1.133 possible 12559 129 T ASN OD1 16 O1H0u 0.660 1.420 2.883 16.805 16.664 1.008 [OK] 12560 129 T ASN ND2 15 N3H2u 0.700 1.640 5.867 45.120 23.083 1.955 possible 12561 130 T LYS N 12 N3H1s 0.700 1.640 2.429 13.474 13.675 0.985 [OK] 12562 130 T LYS CA 3 C4H1s 0.770 1.880 2.947 14.934 13.324 1.121 [OK] 12563 130 T LYS C 1 C3H0s 0.770 1.610 2.624 8.927 8.759 1.019 [OK] 12564 130 T LYS O 16 O1H0u 0.660 1.420 2.534 17.494 16.049 1.090 [OK] 12565 130 T LYS CB 8 C4H2s 0.770 1.880 3.088 23.185 22.904 1.012 possible 12566 130 T LYS CG 8 C4H2s 0.770 1.880 2.870 23.390 23.131 1.011 [OK] 12567 130 T LYS CD 8 C4H2s 0.770 1.880 2.989 26.027 23.837 1.092 [OK] 12568 130 T LYS CE 9 C4H2b 0.770 1.880 3.087 25.126 23.934 1.050 possible 12569 130 T LYS NZ 14 N4H3u 0.700 1.640 2.545 20.909 21.213 0.986 [OK] 12570 131 T ILE N 12 N3H1s 0.700 1.640 2.519 12.689 13.633 0.931 [OK] 12571 131 T ILE CA 3 C4H1s 0.770 1.880 2.478 11.996 13.007 0.922 [OK] 12572 131 T ILE C 1 C3H0s 0.770 1.610 2.748 9.446 8.470 1.115 [OK] 12573 131 T ILE O 16 O1H0u 0.660 1.420 2.521 17.730 16.144 1.098 [OK] 12574 131 T ILE CB 4 C4H1b 0.770 1.880 2.907 14.608 14.227 1.027 [OK] 12575 131 T ILE CG1 9 C4H2b 0.770 1.880 3.074 25.965 24.187 1.073 possible 12576 131 T ILE CG2 10 C4H3u 0.770 1.880 2.853 35.852 35.961 0.997 [OK] 12577 131 T ILE CD1 10 C4H3u 0.770 1.880 3.050 35.080 38.377 0.914 possible 12578 132 T LYS N 12 N3H1s 0.700 1.640 2.732 15.294 13.675 1.118 [OK] 12579 132 T LYS CA 3 C4H1s 0.770 1.880 2.933 13.649 13.324 1.024 [OK] 12580 132 T LYS C 1 C3H0s 0.770 1.610 2.375 9.050 8.759 1.033 [OK] 12581 132 T LYS O 16 O1H0u 0.660 1.420 2.336 16.009 16.049 0.997 [OK] 12582 132 T LYS CB 8 C4H2s 0.770 1.880 3.084 25.620 22.904 1.119 possible 12583 132 T LYS CG 8 C4H2s 0.770 1.880 3.165 24.649 23.131 1.066 possible 12584 132 T LYS CD 8 C4H2s 0.770 1.880 3.927 30.199 23.837 1.267 possible 12585 132 T LYS CE 9 C4H2b 0.770 1.880 4.433 30.157 23.934 1.260 possible 12586 132 T LYS NZ 14 N4H3u 0.700 1.640 25.933 -1.000 21.213 -1.000 bad 12587 133 T PRO N 11 N3H0u 0.700 1.640 2.316 8.517 8.823 0.965 [OK] 12588 133 T PRO CA 4 C4H1b 0.770 1.880 2.780 14.423 13.955 1.034 [OK] 12589 133 T PRO C 1 C3H0s 0.770 1.610 2.435 8.593 8.812 0.975 [OK] 12590 133 T PRO O 16 O1H0u 0.660 1.420 2.352 14.660 16.169 0.907 [OK] 12591 133 T PRO CB 9 C4H2b 0.770 1.880 3.566 29.495 25.563 1.154 possible 12592 133 T PRO CG 9 C4H2b 0.770 1.880 3.828 31.051 25.832 1.202 possible 12593 133 T PRO CD 8 C4H2s 0.770 1.880 3.340 26.291 23.836 1.103 possible 12594 134 T MET N 12 N3H1s 0.700 1.640 2.452 14.452 13.564 1.065 [OK] 12595 134 T MET CA 3 C4H1s 0.770 1.880 2.665 13.252 13.231 1.002 [OK] 12596 134 T MET C 1 C3H0s 0.770 1.610 3.553 8.841 8.782 1.007 possible 12597 134 T MET O 16 O1H0u 0.660 1.420 3.335 16.253 16.277 0.999 possible 12598 134 T MET CB 8 C4H2s 0.770 1.880 3.331 24.107 23.645 1.020 possible 12599 134 T MET CG 9 C4H2b 0.770 1.880 3.711 24.782 24.009 1.032 possible 12600 134 T MET SD 19 S2H0u 1.040 1.770 2.683 30.700 30.093 1.020 [OK] 12601 134 T MET CE 10 C4H3u 0.770 1.880 6.801 68.964 37.161 1.856 possible 12602 135 T LYS N 12 N3H1s 0.700 1.640 4.024 17.352 13.675 1.269 possible 12603 135 T LYS CA 3 C4H1s 0.770 1.880 11.958 -1.000 13.324 -1.000 bad 12604 135 T LYS C 1 C3H0s 0.770 1.610 2.790 8.801 8.759 1.005 [OK] 12605 135 T LYS O 16 O1H0u 0.660 1.420 27.114 -1.000 16.049 -1.000 bad 12606 135 T LYS CB 8 C4H2s 0.770 1.880 6.753 29.359 22.904 1.282 possible 12607 135 T LYS CG 8 C4H2s 0.770 1.880 27.741 -1.000 23.131 -1.000 bad 12608 135 T LYS CD 8 C4H2s 0.770 1.880 30.566 -1.000 23.837 -1.000 bad 12609 135 T LYS CE 9 C4H2b 0.770 1.880 26.682 -1.000 23.934 -1.000 bad 12610 135 T LYS NZ 14 N4H3u 0.700 1.640 4.460 48.345 21.213 2.279 possible 12611 136 T ALA N 12 N3H1s 0.700 1.640 2.856 13.135 14.046 0.935 [OK] 12612 136 T ALA CA 4 C4H1b 0.770 1.880 10.396 -1.000 14.063 -1.000 bad 12613 136 T ALA C 1 C3H0s 0.770 1.610 4.198 12.477 8.900 1.402 possible 12614 136 T ALA O 16 O1H0u 0.660 1.420 16.932 -1.000 16.188 -1.000 bad 12615 136 T ALA CB 10 C4H3u 0.770 1.880 23.909 -1.000 36.782 -1.000 bad 12616 137 T ALA N 12 N3H1s 0.700 1.640 3.218 13.963 14.046 0.994 possible 12617 137 T ALA CA 4 C4H1b 0.770 1.880 3.646 16.607 14.063 1.181 possible 12618 137 T ALA C 1 C3H0s 0.770 1.610 3.438 9.890 8.900 1.111 possible 12619 137 T ALA O 16 O1H0u 0.660 1.420 3.163 15.188 16.188 0.938 possible 12620 137 T ALA CB 10 C4H3u 0.770 1.880 3.009 33.940 36.782 0.923 possible 12621 138 T ALA N 12 N3H1s 0.700 1.640 4.121 28.711 14.046 2.044 possible 12622 138 T ALA CA 4 C4H1b 0.770 1.880 11.026 -1.000 14.063 -1.000 bad 12623 138 T ALA C 1 C3H0s 0.770 1.610 4.544 10.525 8.900 1.183 possible 12624 138 T ALA O 16 O1H0u 0.660 1.420 4.576 28.755 16.188 1.776 possible 12625 138 T ALA CB 10 C4H3u 0.770 1.880 68.015 -1.000 36.782 -1.000 bad 12626 139 T GLY N 12 N3H1s 0.700 1.640 8.394 -1.000 14.854 -1.000 bad 12627 139 T GLY CA 8 C4H2s 0.770 1.880 32.542 -1.000 23.688 -1.000 bad 12628 139 T GLY C 2 C3H0b 0.770 1.610 4.025 11.570 9.840 1.176 possible 12629 139 T GLY O 16 O1H0u 0.660 1.420 7.769 -1.000 16.391 -1.000 bad 12630 140 T PHE N 12 N3H1s 0.700 1.640 2.538 13.470 13.691 0.984 [OK] 12631 140 T PHE CA 3 C4H1s 0.770 1.880 2.541 11.620 13.449 0.864 [OK] 12632 140 T PHE C 1 C3H0s 0.770 1.610 2.388 8.455 8.753 0.966 [OK] 12633 140 T PHE O 16 O1H0u 0.660 1.420 6.099 36.786 16.151 2.278 possible 12634 140 T PHE CB 8 C4H2s 0.770 1.880 2.773 23.052 23.777 0.970 [OK] 12635 140 T PHE CG 2 C3H0b 0.770 1.610 2.437 9.455 9.721 0.973 [OK] 12636 140 T PHE CD1 5 C3H1s 0.770 1.760 3.152 20.442 20.405 1.002 possible 12637 140 T PHE CD2 6 C3H1b 0.770 1.760 2.688 18.493 21.051 0.878 [OK] 12638 140 T PHE CE1 6 C3H1b 0.770 1.760 4.453 31.037 21.580 1.438 possible 12639 140 T PHE CE2 6 C3H1b 0.770 1.760 2.909 22.348 21.680 1.031 [OK] 12640 140 T PHE CZ 6 C3H1b 0.770 1.760 3.287 22.652 21.666 1.046 possible 12641 141 T HIS N 12 N3H1s 0.700 1.640 2.511 13.376 13.715 0.975 [OK] 12642 141 T HIS CA 3 C4H1s 0.770 1.880 3.075 13.663 13.467 1.015 possible 12643 141 T HIS C 1 C3H0s 0.770 1.610 2.455 9.114 8.882 1.026 [OK] 12644 141 T HIS O 16 O1H0u 0.660 1.420 2.373 16.386 16.082 1.019 [OK] 12645 141 T HIS CB 8 C4H2s 0.770 1.880 19.492 -1.000 23.653 -1.000 bad 12646 141 T HIS CG 2 C3H0b 0.770 1.610 0.860 -1.000 9.952 -1.000 bad 12647 141 T HIS ND1 13 N3H1b 0.700 1.640 2.720 -1.000 15.506 -1.000 bad 12648 141 T HIS CD2 5 C3H1s 0.770 1.760 19.042 -1.000 21.085 -1.000 bad 12649 141 T HIS CE1 5 C3H1s 0.770 1.760 10.538 -1.000 20.636 -1.000 bad 12650 141 T HIS NE2 13 N3H1b 0.700 1.640 4.243 -1.000 15.337 -1.000 bad 12651 142 T VAL N 12 N3H1s 0.700 1.640 2.505 13.861 13.676 1.014 [OK] 12652 142 T VAL CA 3 C4H1s 0.770 1.880 2.597 12.573 13.123 0.958 [OK] 12653 142 T VAL C 1 C3H0s 0.770 1.610 2.489 8.205 8.563 0.958 [OK] 12654 142 T VAL O 16 O1H0u 0.660 1.420 19.196 -1.000 16.181 -1.000 bad 12655 142 T VAL CB 4 C4H1b 0.770 1.880 4.183 17.717 14.598 1.214 possible 12656 142 T VAL CG1 10 C4H3u 0.770 1.880 5.558 48.166 36.584 1.317 possible 12657 142 T VAL CG2 10 C4H3u 0.770 1.880 2.884 34.141 36.332 0.940 [OK] 12658 143 T SER N 12 N3H1s 0.700 1.640 2.546 12.707 14.103 0.901 [OK] 12659 143 T SER CA 3 C4H1s 0.770 1.880 4.292 18.604 13.476 1.381 possible 12660 143 T SER C 1 C3H0s 0.770 1.610 3.825 10.949 8.923 1.227 possible 12661 143 T SER O 16 O1H0u 0.660 1.420 25.603 -1.000 16.179 -1.000 bad 12662 143 T SER CB 8 C4H2s 0.770 1.880 3.928 33.608 23.884 1.407 possible 12663 143 T SER OG 17 O2H1u 0.660 1.460 2.655 17.007 18.732 0.908 [OK] 12664 144 T ALA N 12 N3H1s 0.700 1.640 4.080 15.619 14.046 1.112 possible 12665 144 T ALA CA 4 C4H1b 0.770 1.880 9.726 -1.000 14.063 -1.000 bad 12666 144 T ALA C 1 C3H0s 0.770 1.610 2.855 9.389 8.900 1.055 [OK] 12667 144 T ALA O 16 O1H0u 0.660 1.420 2.314 15.785 16.188 0.975 [OK] 12668 144 T ALA CB 10 C4H3u 0.770 1.880 5.669 -1.000 36.782 -1.000 bad 12669 145 T GLY N 12 N3H1s 0.700 1.640 8.316 -1.000 14.854 -1.000 bad 12670 145 T GLY CA 8 C4H2s 0.770 1.880 12.581 -1.000 23.688 -1.000 bad 12671 145 T GLY C 2 C3H0b 0.770 1.610 1.606 -1.000 9.840 -1.000 bad 12672 145 T GLY O 16 O1H0u 0.660 1.420 17.456 -1.000 16.391 -1.000 bad 12673 146 T LYS N 12 N3H1s 0.700 1.640 4.912 -1.000 13.675 -1.000 bad 12674 146 T LYS CA 3 C4H1s 0.770 1.880 7.127 24.084 13.324 1.808 possible 12675 146 T LYS C 1 C3H0s 0.770 1.610 2.474 8.398 8.759 0.959 [OK] 12676 146 T LYS O 16 O1H0u 0.660 1.420 2.516 15.131 16.049 0.943 [OK] 12677 146 T LYS CB 8 C4H2s 0.770 1.880 18.011 -1.000 22.904 -1.000 bad 12678 146 T LYS CG 8 C4H2s 0.770 1.880 3.110 24.227 23.131 1.047 possible 12679 146 T LYS CD 8 C4H2s 0.770 1.880 18.438 -1.000 23.837 -1.000 bad 12680 146 T LYS CE 9 C4H2b 0.770 1.880 3.293 24.420 23.934 1.020 possible 12681 146 T LYS NZ 14 N4H3u 0.700 1.640 36.135 -1.000 21.213 -1.000 bad 12682 147 T ASN N 12 N3H1s 0.700 1.640 6.410 26.937 13.695 1.967 possible 12683 147 T ASN CA 3 C4H1s 0.770 1.880 2.555 12.761 13.167 0.969 [OK] 12684 147 T ASN C 1 C3H0s 0.770 1.610 2.427 8.347 8.928 0.935 [OK] 12685 147 T ASN O 16 O1H0u 0.660 1.420 3.233 19.849 16.199 1.225 possible 12686 147 T ASN CB 8 C4H2s 0.770 1.880 17.396 -1.000 23.128 -1.000 bad 12687 147 T ASN CG 2 C3H0b 0.770 1.610 3.210 11.119 9.599 1.158 possible 12688 147 T ASN OD1 16 O1H0u 0.660 1.420 20.476 -1.000 16.664 -1.000 bad 12689 147 T ASN ND2 15 N3H2u 0.700 1.640 2.879 22.693 23.083 0.983 [OK] 12690 148 T PRO N 11 N3H0u 0.700 1.640 2.485 8.263 8.823 0.937 [OK] 12691 148 T PRO CA 4 C4H1b 0.770 1.880 2.708 13.629 13.955 0.977 [OK] 12692 148 T PRO C 1 C3H0s 0.770 1.610 2.682 9.651 8.812 1.095 [OK] 12693 148 T PRO O 16 O1H0u 0.660 1.420 2.493 14.737 16.169 0.911 [OK] 12694 148 T PRO CB 9 C4H2b 0.770 1.880 2.739 24.862 25.563 0.973 [OK] 12695 148 T PRO CG 9 C4H2b 0.770 1.880 3.095 27.120 25.832 1.050 possible 12696 148 T PRO CD 8 C4H2s 0.770 1.880 2.960 22.556 23.836 0.946 [OK] 12697 149 T ILE N 12 N3H1s 0.700 1.640 2.597 13.829 13.633 1.014 [OK] 12698 149 T ILE CA 3 C4H1s 0.770 1.880 2.752 12.488 13.007 0.960 [OK] 12699 149 T ILE C 1 C3H0s 0.770 1.610 3.003 8.152 8.470 0.962 possible 12700 149 T ILE O 16 O1H0u 0.660 1.420 6.063 -1.000 16.144 -1.000 bad 12701 149 T ILE CB 4 C4H1b 0.770 1.880 4.472 17.956 14.227 1.262 possible 12702 149 T ILE CG1 9 C4H2b 0.770 1.880 2.821 21.566 24.187 0.892 [OK] 12703 149 T ILE CG2 10 C4H3u 0.770 1.880 29.662 -1.000 35.961 -1.000 bad 12704 149 T ILE CD1 10 C4H3u 0.770 1.880 7.115 64.223 38.377 1.673 possible 12705 150 T GLY N 12 N3H1s 0.700 1.640 3.629 14.962 14.854 1.007 possible 12706 150 T GLY CA 8 C4H2s 0.770 1.880 31.501 -1.000 23.688 -1.000 bad 12707 150 T GLY C 2 C3H0b 0.770 1.610 3.731 13.492 9.840 1.371 possible 12708 150 T GLY O 16 O1H0u 0.660 1.420 24.138 -1.000 16.391 -1.000 bad 12709 151 T LEU N 12 N3H1s 0.700 1.640 3.148 14.934 13.655 1.094 possible 12710 151 T LEU CA 3 C4H1s 0.770 1.880 2.955 11.576 13.122 0.882 [OK] 12711 151 T LEU C 1 C3H0s 0.770 1.610 2.723 9.064 8.825 1.027 [OK] 12712 151 T LEU O 16 O1H0u 0.660 1.420 2.422 16.374 16.208 1.010 [OK] 12713 151 T LEU CB 8 C4H2s 0.770 1.880 2.830 21.691 22.951 0.945 [OK] 12714 151 T LEU CG 4 C4H1b 0.770 1.880 3.345 17.831 14.764 1.208 possible 12715 151 T LEU CD1 10 C4H3u 0.770 1.880 2.708 32.991 37.425 0.882 [OK] 12716 151 T LEU CD2 10 C4H3u 0.770 1.880 16.362 -1.000 37.143 -1.000 bad 12717 152 T PRO N 11 N3H0u 0.700 1.640 3.424 9.975 8.823 1.131 possible 12718 152 T PRO CA 4 C4H1b 0.770 1.880 3.432 15.166 13.955 1.087 possible 12719 152 T PRO C 1 C3H0s 0.770 1.610 3.032 9.702 8.812 1.101 possible 12720 152 T PRO O 16 O1H0u 0.660 1.420 2.905 17.232 16.169 1.066 [OK] 12721 152 T PRO CB 9 C4H2b 0.770 1.880 15.928 -1.000 25.563 -1.000 bad 12722 152 T PRO CG 9 C4H2b 0.770 1.880 14.399 -1.000 25.832 -1.000 bad 12723 152 T PRO CD 8 C4H2s 0.770 1.880 16.850 -1.000 23.836 -1.000 bad 12724 153 T VAL N 12 N3H1s 0.700 1.640 2.761 13.644 13.676 0.998 [OK] 12725 153 T VAL CA 3 C4H1s 0.770 1.880 2.454 12.052 13.123 0.918 [OK] 12726 153 T VAL C 1 C3H0s 0.770 1.610 2.998 9.578 8.563 1.119 [OK] 12727 153 T VAL O 16 O1H0u 0.660 1.420 2.567 16.773 16.181 1.037 [OK] 12728 153 T VAL CB 4 C4H1b 0.770 1.880 2.967 14.953 14.598 1.024 [OK] 12729 153 T VAL CG1 10 C4H3u 0.770 1.880 3.464 39.109 36.584 1.069 possible 12730 153 T VAL CG2 10 C4H3u 0.770 1.880 3.246 32.747 36.332 0.901 possible 12731 154 T ARG N 12 N3H1s 0.700 1.640 3.062 15.164 13.650 1.111 possible 12732 154 T ARG CA 3 C4H1s 0.770 1.880 2.757 13.263 13.422 0.988 [OK] 12733 154 T ARG C 1 C3H0s 0.770 1.610 2.678 9.663 8.838 1.093 [OK] 12734 154 T ARG O 16 O1H0u 0.660 1.420 2.411 17.748 16.084 1.103 [OK] 12735 154 T ARG CB 8 C4H2s 0.770 1.880 3.597 27.925 23.088 1.210 possible 12736 154 T ARG CG 8 C4H2s 0.770 1.880 2.751 23.355 23.640 0.988 [OK] 12737 154 T ARG CD 8 C4H2s 0.770 1.880 3.231 22.741 23.300 0.976 possible 12738 154 T ARG NE 13 N3H1b 0.700 1.640 2.646 14.086 15.569 0.905 [OK] 12739 154 T ARG CZ 2 C3H0b 0.770 1.610 2.319 8.733 9.747 0.896 [OK] 12740 154 T ARG NH1 15 N3H2u 0.700 1.640 4.481 46.313 22.782 2.033 possible 12741 154 T ARG NH2 15 N3H2u 0.700 1.640 4.449 43.015 23.810 1.807 possible 12742 155 T GLY N 12 N3H1s 0.700 1.640 2.652 16.558 14.854 1.115 [OK] 12743 155 T GLY CA 8 C4H2s 0.770 1.880 2.821 24.494 23.688 1.034 [OK] 12744 155 T GLY C 2 C3H0b 0.770 1.610 2.609 10.393 9.840 1.056 [OK] 12745 155 T GLY O 16 O1H0u 0.660 1.420 2.347 16.493 16.391 1.006 [OK] 12746 156 T CYS N 12 N3H1s 0.700 1.640 2.473 13.697 13.981 0.980 [OK] 12747 156 T CYS CA 3 C4H1s 0.770 1.880 2.854 14.533 13.656 1.064 [OK] 12748 156 T CYS C 1 C3H0s 0.770 1.610 2.413 8.454 8.897 0.950 [OK] 12749 156 T CYS O 16 O1H0u 0.660 1.420 2.682 18.557 16.543 1.122 [OK] 12750 156 T CYS CB 9 C4H2b 0.770 1.880 2.653 19.851 23.536 0.843 [OK] 12751 156 T CYS SG 20 S2H1u 1.040 1.770 2.799 35.781 34.603 1.034 [OK] 12752 157 T ASP N 12 N3H1s 0.700 1.640 2.497 13.156 13.895 0.947 [OK] 12753 157 T ASP CA 3 C4H1s 0.770 1.880 3.121 14.132 13.377 1.056 possible 12754 157 T ASP C 1 C3H0s 0.770 1.610 2.302 9.051 8.816 1.027 [OK] 12755 157 T ASP O 16 O1H0u 0.660 1.420 3.981 20.821 16.091 1.294 possible 12756 157 T ASP CB 8 C4H2s 0.770 1.880 6.442 44.688 23.481 1.903 possible 12757 157 T ASP CG 2 C3H0b 0.770 1.610 2.451 9.026 9.422 0.958 [OK] 12758 157 T ASP OD1 16 O1H0u 0.660 1.420 2.230 14.962 15.505 0.965 [OK] 12759 157 T ASP OD2 16 O1H0u 0.660 1.420 7.633 55.839 16.324 3.421 possible 12760 158 T LEU N 12 N3H1s 0.700 1.640 2.309 11.830 13.655 0.866 [OK] 12761 158 T LEU CA 3 C4H1s 0.770 1.880 2.680 12.418 13.122 0.946 [OK] 12762 158 T LEU C 1 C3H0s 0.770 1.610 2.509 8.953 8.825 1.014 [OK] 12763 158 T LEU O 16 O1H0u 0.660 1.420 5.369 35.134 16.208 2.168 possible 12764 158 T LEU CB 8 C4H2s 0.770 1.880 4.348 30.310 22.951 1.321 possible 12765 158 T LEU CG 4 C4H1b 0.770 1.880 2.805 13.427 14.764 0.909 [OK] 12766 158 T LEU CD1 10 C4H3u 0.770 1.880 4.510 43.112 37.425 1.152 possible 12767 158 T LEU CD2 10 C4H3u 0.770 1.880 3.381 42.152 37.143 1.135 possible 12768 159 T GLU N 12 N3H1s 0.700 1.640 2.394 13.696 13.615 1.006 [OK] 12769 159 T GLU CA 3 C4H1s 0.770 1.880 3.214 15.057 13.399 1.124 possible 12770 159 T GLU C 1 C3H0s 0.770 1.610 2.586 9.288 8.675 1.071 [OK] 12771 159 T GLU O 16 O1H0u 0.660 1.420 2.446 16.203 16.023 1.011 [OK] 12772 159 T GLU CB 8 C4H2s 0.770 1.880 4.283 30.497 23.529 1.296 possible 12773 159 T GLU CG 8 C4H2s 0.770 1.880 6.700 48.705 23.513 2.071 possible 12774 159 T GLU CD 2 C3H0b 0.770 1.610 4.401 14.204 9.460 1.501 possible 12775 159 T GLU OE1 16 O1H0u 0.660 1.420 36.945 -1.000 15.999 -1.000 bad 12776 159 T GLU OE2 16 O1H0u 0.660 1.420 44.560 -1.000 17.432 -1.000 bad 12777 160 T ILE N 12 N3H1s 0.700 1.640 4.598 21.873 13.633 1.604 possible 12778 160 T ILE CA 3 C4H1s 0.770 1.880 2.612 12.697 13.007 0.976 [OK] 12779 160 T ILE C 1 C3H0s 0.770 1.610 2.589 8.271 8.470 0.976 [OK] 12780 160 T ILE O 16 O1H0u 0.660 1.420 6.194 68.412 16.144 4.238 possible 12781 160 T ILE CB 4 C4H1b 0.770 1.880 10.002 -1.000 14.227 -1.000 bad 12782 160 T ILE CG1 9 C4H2b 0.770 1.880 8.962 -1.000 24.187 -1.000 bad 12783 160 T ILE CG2 10 C4H3u 0.770 1.880 28.458 -1.000 35.961 -1.000 bad 12784 160 T ILE CD1 10 C4H3u 0.770 1.880 27.602 -1.000 38.377 -1.000 bad 12785 161 T ALA N 12 N3H1s 0.700 1.640 2.502 12.838 14.046 0.914 [OK] 12786 161 T ALA CA 4 C4H1b 0.770 1.880 4.439 18.468 14.063 1.313 possible 12787 161 T ALA C 1 C3H0s 0.770 1.610 3.519 12.214 8.900 1.372 possible 12788 161 T ALA O 16 O1H0u 0.660 1.420 4.169 32.326 16.188 1.997 possible 12789 161 T ALA CB 10 C4H3u 0.770 1.880 3.190 37.326 36.782 1.015 possible 12790 162 T GLY N 12 N3H1s 0.700 1.640 3.502 16.766 14.854 1.129 possible 12791 162 T GLY CA 8 C4H2s 0.770 1.880 4.273 31.663 23.688 1.337 possible 12792 162 T GLY C 2 C3H0b 0.770 1.610 4.051 12.512 9.840 1.272 possible 12793 162 T GLY O 16 O1H0u 0.660 1.420 3.723 19.935 16.391 1.216 possible 12794 163 T LYS N 12 N3H1s 0.700 1.640 2.755 13.324 13.675 0.974 [OK] 12795 163 T LYS CA 3 C4H1s 0.770 1.880 2.491 13.088 13.324 0.982 [OK] 12796 163 T LYS C 1 C3H0s 0.770 1.610 2.532 9.206 8.759 1.051 [OK] 12797 163 T LYS O 16 O1H0u 0.660 1.420 2.336 14.613 16.049 0.911 [OK] 12798 163 T LYS CB 8 C4H2s 0.770 1.880 4.703 43.709 22.904 1.908 possible 12799 163 T LYS CG 8 C4H2s 0.770 1.880 3.928 27.211 23.131 1.176 possible 12800 163 T LYS CD 8 C4H2s 0.770 1.880 7.625 101.052 23.837 4.239 possible 12801 163 T LYS CE 9 C4H2b 0.770 1.880 4.248 39.321 23.934 1.643 possible 12802 163 T LYS NZ 14 N4H3u 0.700 1.640 50.330 -1.000 21.213 -1.000 bad 12803 164 T VAL N 12 N3H1s 0.700 1.640 2.638 13.794 13.676 1.009 [OK] 12804 164 T VAL CA 3 C4H1s 0.770 1.880 2.635 12.617 13.123 0.961 [OK] 12805 164 T VAL C 1 C3H0s 0.770 1.610 2.491 8.239 8.563 0.962 [OK] 12806 164 T VAL O 16 O1H0u 0.660 1.420 4.241 22.942 16.181 1.418 possible 12807 164 T VAL CB 4 C4H1b 0.770 1.880 2.533 13.053 14.598 0.894 [OK] 12808 164 T VAL CG1 10 C4H3u 0.770 1.880 2.821 35.111 36.584 0.960 [OK] 12809 164 T VAL CG2 10 C4H3u 0.770 1.880 3.076 33.925 36.332 0.934 possible 12810 165 T VAL N 12 N3H1s 0.700 1.640 2.443 12.104 13.676 0.885 [OK] 12811 165 T VAL CA 3 C4H1s 0.770 1.880 5.123 17.541 13.123 1.337 possible 12812 165 T VAL C 1 C3H0s 0.770 1.610 2.473 8.959 8.563 1.046 [OK] 12813 165 T VAL O 16 O1H0u 0.660 1.420 7.773 59.465 16.181 3.675 possible 12814 165 T VAL CB 4 C4H1b 0.770 1.880 4.551 23.897 14.598 1.637 possible 12815 165 T VAL CG1 10 C4H3u 0.770 1.880 5.451 54.089 36.584 1.478 possible 12816 165 T VAL CG2 10 C4H3u 0.770 1.880 3.056 36.722 36.332 1.011 possible 12817 166 T ASP N 12 N3H1s 0.700 1.640 2.493 14.448 13.895 1.040 [OK] 12818 166 T ASP CA 3 C4H1s 0.770 1.880 2.942 13.214 13.377 0.988 [OK] 12819 166 T ASP C 1 C3H0s 0.770 1.610 2.387 9.550 8.816 1.083 [OK] 12820 166 T ASP O 16 O1H0u 0.660 1.420 2.401 16.193 16.091 1.006 [OK] 12821 166 T ASP CB 8 C4H2s 0.770 1.880 2.882 23.229 23.481 0.989 [OK] 12822 166 T ASP CG 2 C3H0b 0.770 1.610 2.946 10.521 9.422 1.117 [OK] 12823 166 T ASP OD1 16 O1H0u 0.660 1.420 4.534 26.839 15.505 1.731 possible 12824 166 T ASP OD2 16 O1H0u 0.660 1.420 2.506 16.896 16.324 1.035 [OK] 12825 167 T ILE N 12 N3H1s 0.700 1.640 2.615 13.769 13.633 1.010 [OK] 12826 167 T ILE CA 3 C4H1s 0.770 1.880 2.742 13.517 13.007 1.039 [OK] 12827 167 T ILE C 1 C3H0s 0.770 1.610 2.508 8.435 8.470 0.996 [OK] 12828 167 T ILE O 16 O1H0u 0.660 1.420 2.363 15.609 16.144 0.967 [OK] 12829 167 T ILE CB 4 C4H1b 0.770 1.880 2.826 14.944 14.227 1.050 [OK] 12830 167 T ILE CG1 9 C4H2b 0.770 1.880 3.122 22.109 24.187 0.914 possible 12831 167 T ILE CG2 10 C4H3u 0.770 1.880 3.176 34.667 35.961 0.964 possible 12832 167 T ILE CD1 10 C4H3u 0.770 1.880 3.165 37.176 38.377 0.969 possible 12833 168 T TRP N 12 N3H1s 0.700 1.640 2.638 12.913 13.791 0.936 [OK] 12834 168 T TRP CA 3 C4H1s 0.770 1.880 2.465 12.128 13.377 0.907 [OK] 12835 168 T TRP C 1 C3H0s 0.770 1.610 2.347 8.788 8.724 1.007 [OK] 12836 168 T TRP O 16 O1H0u 0.660 1.420 2.436 16.469 15.951 1.032 [OK] 12837 168 T TRP CB 8 C4H2s 0.770 1.880 2.773 22.631 24.004 0.943 [OK] 12838 168 T TRP CG 2 C3H0b 0.770 1.610 2.537 9.913 9.965 0.995 [OK] 12839 168 T TRP CD1 5 C3H1s 0.770 1.760 2.806 22.165 20.874 1.062 [OK] 12840 168 T TRP CD2 2 C3H0b 0.770 1.610 2.531 9.725 10.097 0.963 [OK] 12841 168 T TRP NE1 13 N3H1b 0.700 1.640 2.602 15.460 16.969 0.911 [OK] 12842 168 T TRP CE2 2 C3H0b 0.770 1.610 2.267 8.728 9.889 0.883 [OK] 12843 168 T TRP CE3 6 C3H1b 0.770 1.760 2.825 21.820 20.448 1.067 [OK] 12844 168 T TRP CZ2 6 C3H1b 0.770 1.760 3.149 23.252 21.012 1.107 possible 12845 168 T TRP CZ3 6 C3H1b 0.770 1.760 2.917 21.239 21.516 0.987 [OK] 12846 168 T TRP CH2 6 C3H1b 0.770 1.760 2.628 18.809 21.339 0.881 [OK] 12847 169 T VAL N 12 N3H1s 0.700 1.640 2.489 13.412 13.676 0.981 [OK] 12848 169 T VAL CA 3 C4H1s 0.770 1.880 2.576 12.523 13.123 0.954 [OK] 12849 169 T VAL C 1 C3H0s 0.770 1.610 2.537 9.356 8.563 1.093 [OK] 12850 169 T VAL O 16 O1H0u 0.660 1.420 2.379 15.435 16.181 0.954 [OK] 12851 169 T VAL CB 4 C4H1b 0.770 1.880 3.021 17.132 14.598 1.174 possible 12852 169 T VAL CG1 10 C4H3u 0.770 1.880 2.781 33.653 36.584 0.920 [OK] 12853 169 T VAL CG2 10 C4H3u 0.770 1.880 2.936 36.473 36.332 1.004 [OK] 12854 170 T ASP N 12 N3H1s 0.700 1.640 2.559 14.289 13.895 1.028 [OK] 12855 170 T ASP CA 3 C4H1s 0.770 1.880 2.761 14.382 13.377 1.075 [OK] 12856 170 T ASP C 1 C3H0s 0.770 1.610 2.451 8.337 8.816 0.946 [OK] 12857 170 T ASP O 16 O1H0u 0.660 1.420 2.566 16.413 16.091 1.020 [OK] 12858 170 T ASP CB 8 C4H2s 0.770 1.880 2.641 20.826 23.481 0.887 [OK] 12859 170 T ASP CG 2 C3H0b 0.770 1.610 2.544 9.468 9.422 1.005 [OK] 12860 170 T ASP OD1 16 O1H0u 0.660 1.420 2.316 14.851 15.505 0.958 [OK] 12861 170 T ASP OD2 16 O1H0u 0.660 1.420 2.487 16.879 16.324 1.034 [OK] 12862 171 T ILE N 12 N3H1s 0.700 1.640 2.470 12.609 13.633 0.925 [OK] 12863 171 T ILE CA 3 C4H1s 0.770 1.880 2.843 12.995 13.007 0.999 [OK] 12864 171 T ILE C 1 C3H0s 0.770 1.610 2.713 8.116 8.470 0.958 [OK] 12865 171 T ILE O 16 O1H0u 0.660 1.420 2.704 15.425 16.144 0.955 [OK] 12866 171 T ILE CB 4 C4H1b 0.770 1.880 2.862 13.951 14.227 0.981 [OK] 12867 171 T ILE CG1 9 C4H2b 0.770 1.880 2.927 24.476 24.187 1.012 [OK] 12868 171 T ILE CG2 10 C4H3u 0.770 1.880 5.627 73.671 35.961 2.049 possible 12869 171 T ILE CD1 10 C4H3u 0.770 1.880 4.327 45.298 38.377 1.180 possible 12870 172 T PRO N 11 N3H0u 0.700 1.640 3.138 9.068 8.823 1.028 possible 12871 172 T PRO CA 4 C4H1b 0.770 1.880 3.648 16.533 13.955 1.185 possible 12872 172 T PRO C 1 C3H0s 0.770 1.610 2.579 9.523 8.812 1.081 [OK] 12873 172 T PRO O 16 O1H0u 0.660 1.420 3.014 26.338 16.169 1.629 possible 12874 172 T PRO CB 9 C4H2b 0.770 1.880 3.048 24.171 25.563 0.946 possible 12875 172 T PRO CG 9 C4H2b 0.770 1.880 4.045 26.805 25.832 1.038 possible 12876 172 T PRO CD 8 C4H2s 0.770 1.880 2.963 23.163 23.836 0.972 [OK] 12877 173 T GLU N 12 N3H1s 0.700 1.640 2.539 13.459 13.615 0.989 [OK] 12878 173 T GLU CA 3 C4H1s 0.770 1.880 3.370 16.475 13.399 1.230 possible 12879 173 T GLU C 1 C3H0s 0.770 1.610 3.216 10.498 8.675 1.210 possible 12880 173 T GLU O 16 O1H0u 0.660 1.420 3.049 19.930 16.023 1.244 possible 12881 173 T GLU CB 8 C4H2s 0.770 1.880 3.137 22.584 23.529 0.960 possible 12882 173 T GLU CG 8 C4H2s 0.770 1.880 2.995 22.365 23.513 0.951 [OK] 12883 173 T GLU CD 2 C3H0b 0.770 1.610 2.732 9.482 9.460 1.002 [OK] 12884 173 T GLU OE1 16 O1H0u 0.660 1.420 2.743 20.915 15.999 1.307 [OK] 12885 173 T GLU OE2 16 O1H0u 0.660 1.420 2.895 22.738 17.432 1.304 [OK] 12886 174 T GLN N 12 N3H1s 0.700 1.640 2.530 12.421 13.616 0.912 [OK] 12887 174 T GLN CA 3 C4H1s 0.770 1.880 2.996 15.052 13.334 1.129 [OK] 12888 174 T GLN C 1 C3H0s 0.770 1.610 2.462 9.260 8.787 1.054 [OK] 12889 174 T GLN O 16 O1H0u 0.660 1.420 2.423 16.362 15.993 1.023 [OK] 12890 174 T GLN CB 8 C4H2s 0.770 1.880 3.122 24.703 23.275 1.061 possible 12891 174 T GLN CG 8 C4H2s 0.770 1.880 3.153 23.503 23.465 1.002 possible 12892 174 T GLN CD 2 C3H0b 0.770 1.610 2.580 10.527 9.659 1.090 [OK] 12893 174 T GLN OE1 16 O1H0u 0.660 1.420 2.317 16.662 17.091 0.975 [OK] 12894 174 T GLN NE2 15 N3H2u 0.700 1.640 2.731 25.110 24.150 1.040 [OK] 12895 175 T MET N 12 N3H1s 0.700 1.640 2.776 15.622 13.564 1.152 [OK] 12896 175 T MET CA 3 C4H1s 0.770 1.880 2.593 12.786 13.231 0.966 [OK] 12897 175 T MET C 1 C3H0s 0.770 1.610 2.462 9.171 8.782 1.044 [OK] 12898 175 T MET O 16 O1H0u 0.660 1.420 2.382 15.475 16.277 0.951 [OK] 12899 175 T MET CB 8 C4H2s 0.770 1.880 3.281 25.156 23.645 1.064 possible 12900 175 T MET CG 9 C4H2b 0.770 1.880 2.911 20.842 24.009 0.868 [OK] 12901 175 T MET SD 19 S2H0u 1.040 1.770 3.212 32.021 30.093 1.064 possible 12902 175 T MET CE 10 C4H3u 0.770 1.880 3.043 33.686 37.161 0.906 possible 12903 176 T ALA N 12 N3H1s 0.700 1.640 2.573 14.629 14.046 1.042 [OK] 12904 176 T ALA CA 4 C4H1b 0.770 1.880 2.670 14.755 14.063 1.049 [OK] 12905 176 T ALA C 1 C3H0s 0.770 1.610 2.431 8.621 8.900 0.969 [OK] 12906 176 T ALA O 16 O1H0u 0.660 1.420 2.637 16.380 16.188 1.012 [OK] 12907 176 T ALA CB 10 C4H3u 0.770 1.880 3.176 39.202 36.782 1.066 possible 12908 177 T ARG N 12 N3H1s 0.700 1.640 2.709 13.971 13.650 1.023 [OK] 12909 177 T ARG CA 3 C4H1s 0.770 1.880 3.054 14.174 13.422 1.056 possible 12910 177 T ARG C 1 C3H0s 0.770 1.610 2.096 8.149 8.838 0.922 [OK] 12911 177 T ARG O 16 O1H0u 0.660 1.420 2.906 20.563 16.084 1.278 [OK] 12912 177 T ARG CB 8 C4H2s 0.770 1.880 3.318 24.819 23.088 1.075 possible 12913 177 T ARG CG 8 C4H2s 0.770 1.880 2.810 22.754 23.640 0.963 [OK] 12914 177 T ARG CD 8 C4H2s 0.770 1.880 3.385 24.610 23.300 1.056 possible 12915 177 T ARG NE 13 N3H1b 0.700 1.640 2.697 15.623 15.569 1.003 [OK] 12916 177 T ARG CZ 2 C3H0b 0.770 1.610 2.470 9.358 9.747 0.960 [OK] 12917 177 T ARG NH1 15 N3H2u 0.700 1.640 3.176 30.593 22.782 1.343 possible 12918 177 T ARG NH2 15 N3H2u 0.700 1.640 2.651 21.166 23.810 0.889 [OK] 12919 178 T PHE N 12 N3H1s 0.700 1.640 2.583 13.989 13.691 1.022 [OK] 12920 178 T PHE CA 3 C4H1s 0.770 1.880 2.628 12.507 13.449 0.930 [OK] 12921 178 T PHE C 1 C3H0s 0.770 1.610 2.660 9.147 8.753 1.045 [OK] 12922 178 T PHE O 16 O1H0u 0.660 1.420 2.452 17.253 16.151 1.068 [OK] 12923 178 T PHE CB 8 C4H2s 0.770 1.880 2.912 22.821 23.777 0.960 [OK] 12924 178 T PHE CG 2 C3H0b 0.770 1.610 2.334 9.338 9.721 0.961 [OK] 12925 178 T PHE CD1 5 C3H1s 0.770 1.760 2.761 20.017 20.405 0.981 [OK] 12926 178 T PHE CD2 6 C3H1b 0.770 1.760 2.766 20.938 21.051 0.995 [OK] 12927 178 T PHE CE1 6 C3H1b 0.770 1.760 3.186 27.276 21.580 1.264 possible 12928 178 T PHE CE2 6 C3H1b 0.770 1.760 3.106 23.564 21.680 1.087 possible 12929 178 T PHE CZ 6 C3H1b 0.770 1.760 3.156 25.151 21.666 1.161 possible 12930 179 T LEU N 12 N3H1s 0.700 1.640 2.668 13.374 13.655 0.979 [OK] 12931 179 T LEU CA 3 C4H1s 0.770 1.880 2.586 12.436 13.122 0.948 [OK] 12932 179 T LEU C 1 C3H0s 0.770 1.610 2.618 9.675 8.825 1.096 [OK] 12933 179 T LEU O 16 O1H0u 0.660 1.420 2.338 16.300 16.208 1.006 [OK] 12934 179 T LEU CB 8 C4H2s 0.770 1.880 3.386 26.218 22.951 1.142 possible 12935 179 T LEU CG 4 C4H1b 0.770 1.880 3.099 15.779 14.764 1.069 possible 12936 179 T LEU CD1 10 C4H3u 0.770 1.880 3.427 36.260 37.425 0.969 possible 12937 179 T LEU CD2 10 C4H3u 0.770 1.880 3.176 35.003 37.143 0.942 possible 12938 180 T GLU N 12 N3H1s 0.700 1.640 2.618 15.061 13.615 1.106 [OK] 12939 180 T GLU CA 3 C4H1s 0.770 1.880 2.537 12.791 13.399 0.955 [OK] 12940 180 T GLU C 1 C3H0s 0.770 1.610 2.476 8.741 8.675 1.008 [OK] 12941 180 T GLU O 16 O1H0u 0.660 1.420 2.353 14.817 16.023 0.925 [OK] 12942 180 T GLU CB 8 C4H2s 0.770 1.880 2.646 21.328 23.529 0.906 [OK] 12943 180 T GLU CG 8 C4H2s 0.770 1.880 2.902 24.267 23.513 1.032 [OK] 12944 180 T GLU CD 2 C3H0b 0.770 1.610 2.736 10.391 9.460 1.098 [OK] 12945 180 T GLU OE1 16 O1H0u 0.660 1.420 3.243 22.435 15.999 1.402 possible 12946 180 T GLU OE2 16 O1H0u 0.660 1.420 3.361 29.409 17.432 1.687 possible 12947 181 T VAL N 12 N3H1s 0.700 1.640 2.564 13.753 13.676 1.006 [OK] 12948 181 T VAL CA 3 C4H1s 0.770 1.880 2.529 12.151 13.123 0.926 [OK] 12949 181 T VAL C 1 C3H0s 0.770 1.610 2.513 9.006 8.563 1.052 [OK] 12950 181 T VAL O 16 O1H0u 0.660 1.420 2.532 16.468 16.181 1.018 [OK] 12951 181 T VAL CB 4 C4H1b 0.770 1.880 3.209 16.702 14.598 1.144 possible 12952 181 T VAL CG1 10 C4H3u 0.770 1.880 3.125 37.793 36.584 1.033 possible 12953 181 T VAL CG2 10 C4H3u 0.770 1.880 3.464 40.394 36.332 1.112 possible 12954 182 T GLU N 12 N3H1s 0.700 1.640 2.456 13.862 13.615 1.018 [OK] 12955 182 T GLU CA 3 C4H1s 0.770 1.880 2.434 11.830 13.399 0.883 [OK] 12956 182 T GLU C 1 C3H0s 0.770 1.610 2.421 8.606 8.675 0.992 [OK] 12957 182 T GLU O 16 O1H0u 0.660 1.420 3.390 19.582 16.023 1.222 possible 12958 182 T GLU CB 8 C4H2s 0.770 1.880 2.857 22.437 23.529 0.954 [OK] 12959 182 T GLU CG 8 C4H2s 0.770 1.880 3.051 23.151 23.513 0.985 possible 12960 182 T GLU CD 2 C3H0b 0.770 1.610 3.141 9.952 9.460 1.052 possible 12961 182 T GLU OE1 16 O1H0u 0.660 1.420 5.450 25.178 15.999 1.574 possible 12962 182 T GLU OE2 16 O1H0u 0.660 1.420 17.231 -1.000 17.432 -1.000 bad 12963 183 T LEU N 12 N3H1s 0.700 1.640 2.482 12.973 13.655 0.950 [OK] 12964 183 T LEU CA 3 C4H1s 0.770 1.880 2.730 13.391 13.122 1.020 [OK] 12965 183 T LEU C 1 C3H0s 0.770 1.610 3.500 10.158 8.825 1.151 possible 12966 183 T LEU O 16 O1H0u 0.660 1.420 3.429 21.571 16.208 1.331 possible 12967 183 T LEU CB 8 C4H2s 0.770 1.880 4.386 28.519 22.951 1.243 possible 12968 183 T LEU CG 4 C4H1b 0.770 1.880 2.820 16.208 14.764 1.098 [OK] 12969 183 T LEU CD1 10 C4H3u 0.770 1.880 3.954 39.358 37.425 1.052 possible 12970 183 T LEU CD2 10 C4H3u 0.770 1.880 3.718 41.187 37.143 1.109 possible 12971 184 T LYS N 12 N3H1s 0.700 1.640 4.354 26.888 13.675 1.966 possible 12972 184 T LYS CA 3 C4H1s 0.770 1.880 3.973 17.388 13.324 1.305 possible 12973 184 T LYS C 1 C3H0s 0.770 1.610 4.094 9.746 8.759 1.113 possible 12974 184 T LYS O 16 O1H0u 0.660 1.420 21.956 -1.000 16.049 -1.000 bad 12975 184 T LYS CB 8 C4H2s 0.770 1.880 30.020 -1.000 22.904 -1.000 bad 12976 184 T LYS CG 8 C4H2s 0.770 1.880 23.046 -1.000 23.131 -1.000 bad 12977 184 T LYS CD 8 C4H2s 0.770 1.880 5.263 63.355 23.837 2.658 possible 12978 184 T LYS CE 9 C4H2b 0.770 1.880 44.862 -1.000 23.934 -1.000 bad 12979 184 T LYS NZ 14 N4H3u 0.700 1.640 50.630 -1.000 21.213 -1.000 bad 12980 185 T ASP N 12 N3H1s 0.700 1.640 4.088 18.679 13.895 1.344 possible 12981 185 T ASP CA 3 C4H1s 0.770 1.880 10.719 -1.000 13.377 -1.000 bad 12982 185 T ASP C 1 C3H0s 0.770 1.610 5.120 13.304 8.816 1.509 possible 12983 185 T ASP O 16 O1H0u 0.660 1.420 24.305 -1.000 16.091 -1.000 bad 12984 185 T ASP CB 8 C4H2s 0.770 1.880 36.081 -1.000 23.481 -1.000 bad 12985 185 T ASP CG 2 C3H0b 0.770 1.610 6.944 16.687 9.422 1.771 possible 12986 185 T ASP OD1 16 O1H0u 0.660 1.420 5.589 40.532 15.505 2.614 possible 12987 185 T ASP OD2 16 O1H0u 0.660 1.420 22.909 -1.000 16.324 -1.000 bad 12988 186 T GLY N 12 N3H1s 0.700 1.640 4.704 19.547 14.854 1.316 possible 12989 186 T GLY CA 8 C4H2s 0.770 1.880 25.140 -1.000 23.688 -1.000 bad 12990 186 T GLY C 2 C3H0b 0.770 1.610 5.014 13.015 9.840 1.323 possible 12991 186 T GLY O 16 O1H0u 0.660 1.420 7.778 -1.000 16.391 -1.000 bad 12992 187 T SER N 12 N3H1s 0.700 1.640 5.344 18.032 14.103 1.279 possible 12993 187 T SER CA 3 C4H1s 0.770 1.880 6.785 22.330 13.476 1.657 possible 12994 187 T SER C 1 C3H0s 0.770 1.610 2.797 9.544 8.923 1.070 [OK] 12995 187 T SER O 16 O1H0u 0.660 1.420 2.352 15.270 16.179 0.944 [OK] 12996 187 T SER CB 8 C4H2s 0.770 1.880 22.063 -1.000 23.884 -1.000 bad 12997 187 T SER OG 17 O2H1u 0.660 1.460 4.254 22.038 18.732 1.177 possible 12998 188 T THR N 12 N3H1s 0.700 1.640 2.928 12.792 13.832 0.925 [OK] 12999 188 T THR CA 3 C4H1s 0.770 1.880 2.668 11.804 13.099 0.901 [OK] 13000 188 T THR C 1 C3H0s 0.770 1.610 2.491 9.312 8.738 1.066 [OK] 13001 188 T THR O 16 O1H0u 0.660 1.420 2.474 15.601 16.020 0.974 [OK] 13002 188 T THR CB 4 C4H1b 0.770 1.880 2.805 14.416 14.829 0.972 [OK] 13003 188 T THR OG1 17 O2H1u 0.660 1.460 3.873 26.976 18.123 1.488 possible 13004 188 T THR CG2 10 C4H3u 0.770 1.880 3.723 40.066 36.542 1.096 possible 13005 189 T ARG N 12 N3H1s 0.700 1.640 2.594 14.121 13.650 1.034 [OK] 13006 189 T ARG CA 3 C4H1s 0.770 1.880 2.563 12.480 13.422 0.930 [OK] 13007 189 T ARG C 1 C3H0s 0.770 1.610 2.467 9.466 8.838 1.071 [OK] 13008 189 T ARG O 16 O1H0u 0.660 1.420 2.399 17.057 16.084 1.060 [OK] 13009 189 T ARG CB 8 C4H2s 0.770 1.880 3.214 26.057 23.088 1.129 possible 13010 189 T ARG CG 8 C4H2s 0.770 1.880 3.002 22.456 23.640 0.950 possible 13011 189 T ARG CD 8 C4H2s 0.770 1.880 2.640 22.353 23.300 0.959 [OK] 13012 189 T ARG NE 13 N3H1b 0.700 1.640 3.061 17.314 15.569 1.112 possible 13013 189 T ARG CZ 2 C3H0b 0.770 1.610 2.739 9.141 9.747 0.938 [OK] 13014 189 T ARG NH1 15 N3H2u 0.700 1.640 3.401 23.374 22.782 1.026 possible 13015 189 T ARG NH2 15 N3H2u 0.700 1.640 21.802 -1.000 23.810 -1.000 bad 13016 190 T LEU N 12 N3H1s 0.700 1.640 2.437 13.733 13.655 1.006 [OK] 13017 190 T LEU CA 3 C4H1s 0.770 1.880 2.483 11.835 13.122 0.902 [OK] 13018 190 T LEU C 1 C3H0s 0.770 1.610 2.499 8.811 8.825 0.998 [OK] 13019 190 T LEU O 16 O1H0u 0.660 1.420 2.459 19.082 16.208 1.177 [OK] 13020 190 T LEU CB 8 C4H2s 0.770 1.880 2.835 21.675 22.951 0.944 [OK] 13021 190 T LEU CG 4 C4H1b 0.770 1.880 2.898 16.114 14.764 1.091 [OK] 13022 190 T LEU CD1 10 C4H3u 0.770 1.880 3.040 37.764 37.425 1.009 possible 13023 190 T LEU CD2 10 C4H3u 0.770 1.880 2.966 33.457 37.143 0.901 [OK] 13024 191 T LEU N 12 N3H1s 0.700 1.640 2.531 13.574 13.655 0.994 [OK] 13025 191 T LEU CA 3 C4H1s 0.770 1.880 2.723 12.084 13.122 0.921 [OK] 13026 191 T LEU C 1 C3H0s 0.770 1.610 2.638 9.209 8.825 1.044 [OK] 13027 191 T LEU O 16 O1H0u 0.660 1.420 2.538 15.940 16.208 0.983 [OK] 13028 191 T LEU CB 8 C4H2s 0.770 1.880 3.377 24.881 22.951 1.084 possible 13029 191 T LEU CG 4 C4H1b 0.770 1.880 3.452 17.971 14.764 1.217 possible 13030 191 T LEU CD1 10 C4H3u 0.770 1.880 3.300 39.843 37.425 1.065 possible 13031 191 T LEU CD2 10 C4H3u 0.770 1.880 3.180 35.466 37.143 0.955 possible 13032 192 T PRO N 11 N3H0u 0.700 1.640 2.711 8.813 8.823 0.999 [OK] 13033 192 T PRO CA 4 C4H1b 0.770 1.880 3.043 14.032 13.955 1.006 possible 13034 192 T PRO C 1 C3H0s 0.770 1.610 2.606 8.693 8.812 0.987 [OK] 13035 192 T PRO O 16 O1H0u 0.660 1.420 2.726 15.695 16.169 0.971 [OK] 13036 192 T PRO CB 9 C4H2b 0.770 1.880 3.116 26.292 25.563 1.029 possible 13037 192 T PRO CG 9 C4H2b 0.770 1.880 2.785 27.128 25.832 1.050 [OK] 13038 192 T PRO CD 8 C4H2s 0.770 1.880 3.205 25.296 23.836 1.061 possible 13039 193 T MET N 12 N3H1s 0.700 1.640 2.672 14.720 13.564 1.085 [OK] 13040 193 T MET CA 3 C4H1s 0.770 1.880 3.078 13.725 13.231 1.037 possible 13041 193 T MET C 1 C3H0s 0.770 1.610 2.462 8.355 8.782 0.951 [OK] 13042 193 T MET O 16 O1H0u 0.660 1.420 2.479 17.622 16.277 1.083 [OK] 13043 193 T MET CB 8 C4H2s 0.770 1.880 2.841 21.311 23.645 0.901 [OK] 13044 193 T MET CG 9 C4H2b 0.770 1.880 2.910 23.429 24.009 0.976 [OK] 13045 193 T MET SD 19 S2H0u 1.040 1.770 3.079 30.460 30.093 1.012 possible 13046 193 T MET CE 10 C4H3u 0.770 1.880 3.022 36.226 37.161 0.975 possible 13047 194 T GLN N 12 N3H1s 0.700 1.640 2.559 13.656 13.616 1.003 [OK] 13048 194 T GLN CA 3 C4H1s 0.770 1.880 2.780 13.356 13.334 1.002 [OK] 13049 194 T GLN C 1 C3H0s 0.770 1.610 2.646 9.798 8.787 1.115 [OK] 13050 194 T GLN O 16 O1H0u 0.660 1.420 2.474 17.981 15.993 1.124 [OK] 13051 194 T GLN CB 8 C4H2s 0.770 1.880 2.925 25.952 23.275 1.115 [OK] 13052 194 T GLN CG 8 C4H2s 0.770 1.880 2.898 22.150 23.465 0.944 [OK] 13053 194 T GLN CD 2 C3H0b 0.770 1.610 2.531 9.495 9.659 0.983 [OK] 13054 194 T GLN OE1 16 O1H0u 0.660 1.420 2.812 20.195 17.091 1.182 [OK] 13055 194 T GLN NE2 15 N3H2u 0.700 1.640 3.081 30.905 24.150 1.280 possible 13056 195 T MET N 12 N3H1s 0.700 1.640 2.688 12.341 13.564 0.910 [OK] 13057 195 T MET CA 3 C4H1s 0.770 1.880 2.859 13.344 13.231 1.009 [OK] 13058 195 T MET C 1 C3H0s 0.770 1.610 2.674 10.739 8.782 1.223 [OK] 13059 195 T MET O 16 O1H0u 0.660 1.420 2.762 20.498 16.277 1.259 [OK] 13060 195 T MET CB 8 C4H2s 0.770 1.880 3.244 24.220 23.645 1.024 possible 13061 195 T MET CG 9 C4H2b 0.770 1.880 3.045 23.847 24.009 0.993 possible 13062 195 T MET SD 19 S2H0u 1.040 1.770 2.875 29.689 30.093 0.987 [OK] 13063 195 T MET CE 10 C4H3u 0.770 1.880 3.326 40.714 37.161 1.096 possible 13064 196 T VAL N 12 N3H1s 0.700 1.640 2.690 13.954 13.676 1.020 [OK] 13065 196 T VAL CA 3 C4H1s 0.770 1.880 2.782 13.982 13.123 1.065 [OK] 13066 196 T VAL C 1 C3H0s 0.770 1.610 2.738 9.875 8.563 1.153 [OK] 13067 196 T VAL O 16 O1H0u 0.660 1.420 2.546 18.790 16.181 1.161 [OK] 13068 196 T VAL CB 4 C4H1b 0.770 1.880 2.732 13.730 14.598 0.941 [OK] 13069 196 T VAL CG1 10 C4H3u 0.770 1.880 3.464 40.763 36.584 1.114 possible 13070 196 T VAL CG2 10 C4H3u 0.770 1.880 3.032 35.343 36.332 0.973 possible 13071 197 T LYS N 12 N3H1s 0.700 1.640 2.501 13.820 13.675 1.011 [OK] 13072 197 T LYS CA 3 C4H1s 0.770 1.880 2.633 12.314 13.324 0.924 [OK] 13073 197 T LYS C 1 C3H0s 0.770 1.610 2.483 9.124 8.759 1.042 [OK] 13074 197 T LYS O 16 O1H0u 0.660 1.420 2.374 15.616 16.049 0.973 [OK] 13075 197 T LYS CB 8 C4H2s 0.770 1.880 3.291 24.397 22.904 1.065 possible 13076 197 T LYS CG 8 C4H2s 0.770 1.880 5.926 44.837 23.131 1.938 possible 13077 197 T LYS CD 8 C4H2s 0.770 1.880 4.672 26.922 23.837 1.129 possible 13078 197 T LYS CE 9 C4H2b 0.770 1.880 34.059 -1.000 23.934 -1.000 bad 13079 197 T LYS NZ 14 N4H3u 0.700 1.640 39.547 -1.000 21.213 -1.000 bad 13080 198 T VAL N 12 N3H1s 0.700 1.640 2.603 13.946 13.676 1.020 [OK] 13081 198 T VAL CA 3 C4H1s 0.770 1.880 2.675 13.050 13.123 0.994 [OK] 13082 198 T VAL C 1 C3H0s 0.770 1.610 2.870 8.442 8.563 0.986 [OK] 13083 198 T VAL O 16 O1H0u 0.660 1.420 14.780 -1.000 16.181 -1.000 bad 13084 198 T VAL CB 4 C4H1b 0.770 1.880 3.261 15.913 14.598 1.090 possible 13085 198 T VAL CG1 10 C4H3u 0.770 1.880 3.312 35.776 36.584 0.978 possible 13086 198 T VAL CG2 10 C4H3u 0.770 1.880 3.046 41.627 36.332 1.146 possible 13087 199 T GLN N 12 N3H1s 0.700 1.640 2.503 12.295 13.616 0.903 [OK] 13088 199 T GLN CA 3 C4H1s 0.770 1.880 6.462 27.291 13.334 2.047 possible 13089 199 T GLN C 1 C3H0s 0.770 1.610 4.230 12.285 8.787 1.398 possible 13090 199 T GLN O 16 O1H0u 0.660 1.420 2.783 16.438 15.993 1.028 [OK] 13091 199 T GLN CB 8 C4H2s 0.770 1.880 5.077 28.815 23.275 1.238 possible 13092 199 T GLN CG 8 C4H2s 0.770 1.880 6.358 40.241 23.465 1.715 possible 13093 199 T GLN CD 2 C3H0b 0.770 1.610 4.393 13.139 9.659 1.360 possible 13094 199 T GLN OE1 16 O1H0u 0.660 1.420 5.510 39.088 17.091 2.287 possible 13095 199 T GLN NE2 15 N3H2u 0.700 1.640 29.086 -1.000 24.150 -1.000 bad 13096 200 T SER N 12 N3H1s 0.700 1.640 7.175 32.302 14.103 2.290 possible 13097 200 T SER CA 3 C4H1s 0.770 1.880 4.072 17.440 13.476 1.294 possible 13098 200 T SER C 1 C3H0s 0.770 1.610 3.043 9.436 8.923 1.058 possible 13099 200 T SER O 16 O1H0u 0.660 1.420 11.629 -1.000 16.179 -1.000 bad 13100 200 T SER CB 8 C4H2s 0.770 1.880 44.067 -1.000 23.884 -1.000 bad 13101 200 T SER OG 17 O2H1u 0.660 1.460 31.191 -1.000 18.732 -1.000 bad 13102 201 T ASN N 12 N3H1s 0.700 1.640 2.592 13.205 13.695 0.964 [OK] 13103 201 T ASN CA 3 C4H1s 0.770 1.880 6.977 22.168 13.167 1.684 possible 13104 201 T ASN C 1 C3H0s 0.770 1.610 2.257 8.364 8.928 0.937 [OK] 13105 201 T ASN O 16 O1H0u 0.660 1.420 5.487 -1.000 16.199 -1.000 bad 13106 201 T ASN CB 8 C4H2s 0.770 1.880 32.228 -1.000 23.128 -1.000 bad 13107 201 T ASN CG 2 C3H0b 0.770 1.610 2.823 -1.000 9.599 -1.000 bad 13108 201 T ASN OD1 16 O1H0u 0.660 1.420 7.764 -1.000 16.664 -1.000 bad 13109 201 T ASN ND2 15 N3H2u 0.700 1.640 16.621 -1.000 23.083 -1.000 bad 13110 202 T ARG N 12 N3H1s 0.700 1.640 2.368 14.244 13.650 1.043 [OK] 13111 202 T ARG CA 3 C4H1s 0.770 1.880 2.516 13.189 13.422 0.983 [OK] 13112 202 T ARG C 1 C3H0s 0.770 1.610 2.385 8.324 8.838 0.942 [OK] 13113 202 T ARG O 16 O1H0u 0.660 1.420 2.435 14.982 16.084 0.931 [OK] 13114 202 T ARG CB 8 C4H2s 0.770 1.880 3.543 27.153 23.088 1.176 possible 13115 202 T ARG CG 8 C4H2s 0.770 1.880 2.856 23.694 23.640 1.002 [OK] 13116 202 T ARG CD 8 C4H2s 0.770 1.880 2.914 23.860 23.300 1.024 [OK] 13117 202 T ARG NE 13 N3H1b 0.700 1.640 3.022 16.066 15.569 1.032 possible 13118 202 T ARG CZ 2 C3H0b 0.770 1.610 2.339 8.764 9.747 0.899 [OK] 13119 202 T ARG NH1 15 N3H2u 0.700 1.640 7.123 56.436 22.782 2.477 possible 13120 202 T ARG NH2 15 N3H2u 0.700 1.640 22.793 -1.000 23.810 -1.000 bad 13121 203 T VAL N 12 N3H1s 0.700 1.640 2.406 12.440 13.676 0.910 [OK] 13122 203 T VAL CA 3 C4H1s 0.770 1.880 2.568 12.557 13.123 0.957 [OK] 13123 203 T VAL C 1 C3H0s 0.770 1.610 2.418 8.441 8.563 0.986 [OK] 13124 203 T VAL O 16 O1H0u 0.660 1.420 2.407 16.635 16.181 1.028 [OK] 13125 203 T VAL CB 4 C4H1b 0.770 1.880 2.974 14.583 14.598 0.999 [OK] 13126 203 T VAL CG1 10 C4H3u 0.770 1.880 3.464 38.562 36.584 1.054 possible 13127 203 T VAL CG2 10 C4H3u 0.770 1.880 3.038 33.568 36.332 0.924 possible 13128 204 T HIS N 12 N3H1s 0.700 1.640 2.635 14.863 13.715 1.084 [OK] 13129 204 T HIS CA 3 C4H1s 0.770 1.880 2.636 13.325 13.467 0.989 [OK] 13130 204 T HIS C 1 C3H0s 0.770 1.610 2.469 9.047 8.882 1.019 [OK] 13131 204 T HIS O 16 O1H0u 0.660 1.420 2.394 14.595 16.082 0.908 [OK] 13132 204 T HIS CB 8 C4H2s 0.770 1.880 3.298 23.689 23.653 1.002 possible 13133 204 T HIS CG 2 C3H0b 0.770 1.610 4.072 12.454 9.952 1.251 possible 13134 204 T HIS ND1 13 N3H1b 0.700 1.640 5.710 32.441 15.506 2.092 possible 13135 204 T HIS CD2 5 C3H1s 0.770 1.760 3.904 20.517 21.085 0.973 possible 13136 204 T HIS CE1 5 C3H1s 0.770 1.760 6.546 35.629 20.636 1.727 possible 13137 204 T HIS NE2 13 N3H1b 0.700 1.640 3.918 24.310 15.337 1.585 possible 13138 205 T VAL N 12 N3H1s 0.700 1.640 2.555 13.688 13.676 1.001 [OK] 13139 205 T VAL CA 3 C4H1s 0.770 1.880 2.785 13.595 13.123 1.036 [OK] 13140 205 T VAL C 1 C3H0s 0.770 1.610 2.328 8.247 8.563 0.963 [OK] 13141 205 T VAL O 16 O1H0u 0.660 1.420 2.440 16.988 16.181 1.050 [OK] 13142 205 T VAL CB 4 C4H1b 0.770 1.880 2.861 14.771 14.598 1.012 [OK] 13143 205 T VAL CG1 10 C4H3u 0.770 1.880 3.292 41.240 36.584 1.127 possible 13144 205 T VAL CG2 10 C4H3u 0.770 1.880 3.423 36.762 36.332 1.012 possible 13145 206 T ASN N 12 N3H1s 0.700 1.640 2.295 12.108 13.695 0.884 [OK] 13146 206 T ASN CA 3 C4H1s 0.770 1.880 2.605 13.434 13.167 1.020 [OK] 13147 206 T ASN C 1 C3H0s 0.770 1.610 2.349 8.128 8.928 0.910 [OK] 13148 206 T ASN O 16 O1H0u 0.660 1.420 2.302 13.698 16.199 0.846 [OK] 13149 206 T ASN CB 8 C4H2s 0.770 1.880 5.731 34.459 23.128 1.490 possible 13150 206 T ASN CG 2 C3H0b 0.770 1.610 5.729 15.718 9.599 1.637 possible 13151 206 T ASN OD1 16 O1H0u 0.660 1.420 6.496 58.697 16.664 3.522 possible 13152 206 T ASN ND2 15 N3H2u 0.700 1.640 6.616 69.018 23.083 2.990 possible 13153 207 T ALA N 12 N3H1s 0.700 1.640 2.603 13.569 14.046 0.966 [OK] 13154 207 T ALA CA 4 C4H1b 0.770 1.880 2.750 13.785 14.063 0.980 [OK] 13155 207 T ALA C 1 C3H0s 0.770 1.610 2.381 8.581 8.900 0.964 [OK] 13156 207 T ALA O 16 O1H0u 0.660 1.420 2.278 15.016 16.188 0.928 [OK] 13157 207 T ALA CB 10 C4H3u 0.770 1.880 2.992 37.979 36.782 1.033 [OK] 13158 208 T LEU N 12 N3H1s 0.700 1.640 2.629 14.950 13.655 1.095 [OK] 13159 208 T LEU CA 3 C4H1s 0.770 1.880 2.651 12.731 13.122 0.970 [OK] 13160 208 T LEU C 1 C3H0s 0.770 1.610 2.425 8.706 8.825 0.986 [OK] 13161 208 T LEU O 16 O1H0u 0.660 1.420 2.331 15.125 16.208 0.933 [OK] 13162 208 T LEU CB 8 C4H2s 0.770 1.880 2.972 22.336 22.951 0.973 [OK] 13163 208 T LEU CG 4 C4H1b 0.770 1.880 2.820 15.841 14.764 1.073 [OK] 13164 208 T LEU CD1 10 C4H3u 0.770 1.880 2.822 34.300 37.425 0.916 [OK] 13165 208 T LEU CD2 10 C4H3u 0.770 1.880 2.976 39.179 37.143 1.055 [OK] 13166 209 T SER N 12 N3H1s 0.700 1.640 2.479 14.472 14.103 1.026 [OK] 13167 209 T SER CA 3 C4H1s 0.770 1.880 2.496 13.692 13.476 1.016 [OK] 13168 209 T SER C 1 C3H0s 0.770 1.610 2.367 9.431 8.923 1.057 [OK] 13169 209 T SER O 16 O1H0u 0.660 1.420 2.331 14.444 16.179 0.893 [OK] 13170 209 T SER CB 8 C4H2s 0.770 1.880 3.153 24.854 23.884 1.041 possible 13171 209 T SER OG 17 O2H1u 0.660 1.460 2.547 19.197 18.732 1.025 [OK] 13172 210 T SER N 12 N3H1s 0.700 1.640 2.645 14.735 14.103 1.045 [OK] 13173 210 T SER CA 3 C4H1s 0.770 1.880 2.872 13.665 13.476 1.014 [OK] 13174 210 T SER C 1 C3H0s 0.770 1.610 4.433 9.436 8.923 1.057 possible 13175 210 T SER O 16 O1H0u 0.660 1.420 4.436 21.645 16.179 1.338 possible 13176 210 T SER CB 8 C4H2s 0.770 1.880 18.689 -1.000 23.884 -1.000 bad 13177 210 T SER OG 17 O2H1u 0.660 1.460 2.955 17.832 18.732 0.952 [OK] 13178 211 T ASP N 12 N3H1s 0.700 1.640 4.501 18.584 13.895 1.337 possible 13179 211 T ASP CA 3 C4H1s 0.770 1.880 9.503 -1.000 13.377 -1.000 bad 13180 211 T ASP C 1 C3H0s 0.770 1.610 2.513 8.488 8.816 0.963 [OK] 13181 211 T ASP O 16 O1H0u 0.660 1.420 8.211 -1.000 16.091 -1.000 bad 13182 211 T ASP CB 8 C4H2s 0.770 1.880 36.209 -1.000 23.481 -1.000 bad 13183 211 T ASP CG 2 C3H0b 0.770 1.610 7.199 16.419 9.422 1.743 possible 13184 211 T ASP OD1 16 O1H0u 0.660 1.420 10.813 -1.000 15.505 -1.000 bad 13185 211 T ASP OD2 16 O1H0u 0.660 1.420 5.890 -1.000 16.324 -1.000 bad 13186 212 T LEU N 12 N3H1s 0.700 1.640 2.429 12.650 13.655 0.926 [OK] 13187 212 T LEU CA 3 C4H1s 0.770 1.880 2.676 12.404 13.122 0.945 [OK] 13188 212 T LEU C 1 C3H0s 0.770 1.610 2.464 9.410 8.825 1.066 [OK] 13189 212 T LEU O 16 O1H0u 0.660 1.420 2.250 14.985 16.208 0.925 [OK] 13190 212 T LEU CB 8 C4H2s 0.770 1.880 2.758 22.165 22.951 0.966 [OK] 13191 212 T LEU CG 4 C4H1b 0.770 1.880 2.661 14.043 14.764 0.951 [OK] 13192 212 T LEU CD1 10 C4H3u 0.770 1.880 3.832 40.535 37.425 1.083 possible 13193 212 T LEU CD2 10 C4H3u 0.770 1.880 5.593 79.445 37.143 2.139 possible 13194 213 T PHE N 12 N3H1s 0.700 1.640 2.551 13.336 13.691 0.974 [OK] 13195 213 T PHE CA 3 C4H1s 0.770 1.880 2.675 13.106 13.449 0.974 [OK] 13196 213 T PHE C 1 C3H0s 0.770 1.610 2.302 8.268 8.753 0.945 [OK] 13197 213 T PHE O 16 O1H0u 0.660 1.420 2.556 15.122 16.151 0.936 [OK] 13198 213 T PHE CB 8 C4H2s 0.770 1.880 3.426 24.928 23.777 1.048 possible 13199 213 T PHE CG 2 C3H0b 0.770 1.610 2.525 9.746 9.721 1.003 [OK] 13200 213 T PHE CD1 5 C3H1s 0.770 1.760 2.648 17.559 20.405 0.861 [OK] 13201 213 T PHE CD2 6 C3H1b 0.770 1.760 3.058 23.971 21.051 1.139 possible 13202 213 T PHE CE1 6 C3H1b 0.770 1.760 2.724 20.708 21.580 0.960 [OK] 13203 213 T PHE CE2 6 C3H1b 0.770 1.760 2.871 22.650 21.680 1.045 [OK] 13204 213 T PHE CZ 6 C3H1b 0.770 1.760 2.903 22.678 21.666 1.047 [OK] 13205 214 T ALA N 12 N3H1s 0.700 1.640 2.636 13.085 14.046 0.932 [OK] 13206 214 T ALA CA 4 C4H1b 0.770 1.880 2.781 13.734 14.063 0.977 [OK] 13207 214 T ALA C 1 C3H0s 0.770 1.610 4.021 9.080 8.900 1.020 possible 13208 214 T ALA O 16 O1H0u 0.660 1.420 12.373 -1.000 16.188 -1.000 bad 13209 214 T ALA CB 10 C4H3u 0.770 1.880 40.015 -1.000 36.782 -1.000 bad 13210 215 T GLY N 12 N3H1s 0.700 1.640 3.829 13.250 14.854 0.892 possible 13211 215 T GLY CA 8 C4H2s 0.770 1.880 5.738 44.665 23.688 1.886 possible 13212 215 T GLY C 2 C3H0b 0.770 1.610 2.812 9.713 9.840 0.987 [OK] 13213 215 T GLY O 16 O1H0u 0.660 1.420 4.481 22.892 16.391 1.397 possible 13214 216 T ILE N 12 N3H1s 0.700 1.640 2.329 13.368 13.633 0.981 [OK] 13215 216 T ILE CA 3 C4H1s 0.770 1.880 2.584 11.841 13.007 0.910 [OK] 13216 216 T ILE C 1 C3H0s 0.770 1.610 2.468 7.920 8.470 0.935 [OK] 13217 216 T ILE O 16 O1H0u 0.660 1.420 4.266 23.743 16.144 1.471 possible 13218 216 T ILE CB 4 C4H1b 0.770 1.880 2.463 12.396 14.227 0.871 [OK] 13219 216 T ILE CG1 9 C4H2b 0.770 1.880 2.761 21.442 24.187 0.887 [OK] 13220 216 T ILE CG2 10 C4H3u 0.770 1.880 2.970 38.008 35.961 1.057 [OK] 13221 216 T ILE CD1 10 C4H3u 0.770 1.880 3.033 35.402 38.377 0.922 possible 13222 217 T PRO N 11 N3H0u 0.700 1.640 3.034 9.245 8.823 1.048 possible 13223 217 T PRO CA 4 C4H1b 0.770 1.880 6.868 33.777 13.955 2.420 possible 13224 217 T PRO C 1 C3H0s 0.770 1.610 2.899 9.049 8.812 1.027 [OK] 13225 217 T PRO O 16 O1H0u 0.660 1.420 2.759 17.123 16.169 1.059 [OK] 13226 217 T PRO CB 9 C4H2b 0.770 1.880 6.340 43.502 25.563 1.702 possible 13227 217 T PRO CG 9 C4H2b 0.770 1.880 6.268 46.509 25.832 1.800 possible 13228 217 T PRO CD 8 C4H2s 0.770 1.880 3.101 24.033 23.836 1.008 possible 13229 218 T THR N 12 N3H1s 0.700 1.640 5.293 21.161 13.832 1.530 possible 13230 218 T THR CA 3 C4H1s 0.770 1.880 2.604 12.555 13.099 0.959 [OK] 13231 218 T THR C 1 C3H0s 0.770 1.610 3.245 10.394 8.738 1.189 possible 13232 218 T THR O 16 O1H0u 0.660 1.420 5.784 48.528 16.020 3.029 possible 13233 218 T THR CB 4 C4H1b 0.770 1.880 7.046 29.530 14.829 1.991 possible 13234 218 T THR OG1 17 O2H1u 0.660 1.460 29.254 -1.000 18.123 -1.000 bad 13235 218 T THR CG2 10 C4H3u 0.770 1.880 16.529 -1.000 36.542 -1.000 bad 13236 219 T ILE N 12 N3H1s 0.700 1.640 2.653 13.302 13.633 0.976 [OK] 13237 219 T ILE CA 3 C4H1s 0.770 1.880 2.511 11.958 13.007 0.919 [OK] 13238 219 T ILE C 1 C3H0s 0.770 1.610 4.047 10.770 8.470 1.272 possible 13239 219 T ILE O 16 O1H0u 0.660 1.420 6.755 56.006 16.144 3.469 possible 13240 219 T ILE CB 4 C4H1b 0.770 1.880 2.589 14.023 14.227 0.986 [OK] 13241 219 T ILE CG1 9 C4H2b 0.770 1.880 3.908 26.627 24.187 1.101 possible 13242 219 T ILE CG2 10 C4H3u 0.770 1.880 3.060 35.231 35.961 0.980 possible 13243 219 T ILE CD1 10 C4H3u 0.770 1.880 3.306 36.056 38.377 0.940 possible 13244 220 T LYS N 12 N3H1s 0.700 1.640 4.095 15.251 13.675 1.115 possible 13245 220 T LYS CA 3 C4H1s 0.770 1.880 9.771 -1.000 13.324 -1.000 bad 13246 220 T LYS C 1 C3H0s 0.770 1.610 3.526 9.026 8.759 1.031 possible 13247 220 T LYS O 16 O1H0u 0.660 1.420 27.208 -1.000 16.049 -1.000 bad 13248 220 T LYS CB 8 C4H2s 0.770 1.880 13.019 -1.000 22.904 -1.000 bad 13249 220 T LYS CG 8 C4H2s 0.770 1.880 24.403 -1.000 23.131 -1.000 bad 13250 220 T LYS CD 8 C4H2s 0.770 1.880 35.470 -1.000 23.837 -1.000 bad 13251 220 T LYS CE 9 C4H2b 0.770 1.880 23.411 -1.000 23.934 -1.000 bad 13252 220 T LYS NZ 14 N4H3u 0.700 1.640 4.472 30.085 21.213 1.418 possible 13253 221 T SER N 12 N3H1s 0.700 1.640 3.466 13.672 14.103 0.969 possible 13254 221 T SER CA 3 C4H1s 0.770 1.880 4.867 16.471 13.476 1.222 possible 13255 221 T SER C 1 C3H0s 0.770 1.610 2.810 9.291 8.923 1.041 [OK] 13256 221 T SER O 16 O1H0u 0.660 1.420 2.507 15.410 16.179 0.952 [OK] 13257 221 T SER CB 8 C4H2s 0.770 1.880 16.857 -1.000 23.884 -1.000 bad 13258 221 T SER OG 17 O2H1u 0.660 1.460 15.610 -1.000 18.732 -1.000 bad 13259 222 T PRO N 11 N3H0u 0.700 1.640 3.616 10.298 8.823 1.167 possible 13260 222 T PRO CA 4 C4H1b 0.770 1.880 3.928 18.913 13.955 1.355 possible 13261 222 T PRO C 1 C3H0s 0.770 1.610 2.846 9.860 8.812 1.119 [OK] 13262 222 T PRO O 16 O1H0u 0.660 1.420 3.952 33.027 16.169 2.043 possible 13263 222 T PRO CB 9 C4H2b 0.770 1.880 6.714 105.122 25.563 4.112 possible 13264 222 T PRO CG 9 C4H2b 0.770 1.880 35.332 -1.000 25.832 -1.000 bad 13265 222 T PRO CD 8 C4H2s 0.770 1.880 22.760 -1.000 23.836 -1.000 bad 13266 223 T THR N 12 N3H1s 0.700 1.640 2.493 13.207 13.832 0.955 [OK] 13267 223 T THR CA 3 C4H1s 0.770 1.880 2.641 12.492 13.099 0.954 [OK] 13268 223 T THR C 1 C3H0s 0.770 1.610 2.867 9.589 8.738 1.097 [OK] 13269 223 T THR O 16 O1H0u 0.660 1.420 2.849 18.313 16.020 1.143 [OK] 13270 223 T THR CB 4 C4H1b 0.770 1.880 4.110 18.910 14.829 1.275 possible 13271 223 T THR OG1 17 O2H1u 0.660 1.460 16.721 -1.000 18.123 -1.000 bad 13272 223 T THR CG2 10 C4H3u 0.770 1.880 41.630 -1.000 36.542 -1.000 bad 13273 224 T GLU N 12 N3H1s 0.700 1.640 2.615 14.662 13.615 1.077 [OK] 13274 224 T GLU CA 3 C4H1s 0.770 1.880 2.982 13.322 13.399 0.994 [OK] 13275 224 T GLU C 1 C3H0s 0.770 1.610 2.725 8.547 8.675 0.985 [OK] 13276 224 T GLU O 16 O1H0u 0.660 1.420 2.541 15.670 16.023 0.978 [OK] 13277 224 T GLU CB 8 C4H2s 0.770 1.880 3.477 22.849 23.529 0.971 possible 13278 224 T GLU CG 8 C4H2s 0.770 1.880 3.372 25.624 23.513 1.090 possible 13279 224 T GLU CD 2 C3H0b 0.770 1.610 4.229 11.096 9.460 1.173 possible 13280 224 T GLU OE1 16 O1H0u 0.660 1.420 19.333 -1.000 15.999 -1.000 bad 13281 224 T GLU OE2 16 O1H0u 0.660 1.420 19.851 -1.000 17.432 -1.000 bad 13282 225 T VAL N 12 N3H1s 0.700 1.640 2.654 13.623 13.676 0.996 [OK] 13283 225 T VAL CA 3 C4H1s 0.770 1.880 2.740 13.166 13.123 1.003 [OK] 13284 225 T VAL C 1 C3H0s 0.770 1.610 2.748 9.594 8.563 1.120 [OK] 13285 225 T VAL O 16 O1H0u 0.660 1.420 2.345 14.878 16.181 0.919 [OK] 13286 225 T VAL CB 4 C4H1b 0.770 1.880 2.733 14.644 14.598 1.003 [OK] 13287 225 T VAL CG1 10 C4H3u 0.770 1.880 2.932 37.388 36.584 1.022 [OK] 13288 225 T VAL CG2 10 C4H3u 0.770 1.880 3.064 33.371 36.332 0.919 possible 13289 226 T THR N 12 N3H1s 0.700 1.640 2.753 12.841 13.832 0.928 [OK] 13290 226 T THR CA 3 C4H1s 0.770 1.880 2.469 12.248 13.099 0.935 [OK] 13291 226 T THR C 1 C3H0s 0.770 1.610 2.419 9.295 8.738 1.064 [OK] 13292 226 T THR O 16 O1H0u 0.660 1.420 2.371 13.621 16.020 0.850 [OK] 13293 226 T THR CB 4 C4H1b 0.770 1.880 2.632 13.198 14.829 0.890 [OK] 13294 226 T THR OG1 17 O2H1u 0.660 1.460 2.370 15.971 18.123 0.881 [OK] 13295 226 T THR CG2 10 C4H3u 0.770 1.880 3.978 43.727 36.542 1.197 possible 13296 227 T LEU N 12 N3H1s 0.700 1.640 2.458 14.354 13.655 1.051 [OK] 13297 227 T LEU CA 3 C4H1s 0.770 1.880 3.008 14.497 13.122 1.105 possible 13298 227 T LEU C 1 C3H0s 0.770 1.610 2.173 8.363 8.825 0.948 [OK] 13299 227 T LEU O 16 O1H0u 0.660 1.420 2.337 14.891 16.208 0.919 [OK] 13300 227 T LEU CB 8 C4H2s 0.770 1.880 2.756 21.513 22.951 0.937 [OK] 13301 227 T LEU CG 4 C4H1b 0.770 1.880 2.808 14.800 14.764 1.002 [OK] 13302 227 T LEU CD1 10 C4H3u 0.770 1.880 3.148 44.117 37.425 1.179 possible 13303 227 T LEU CD2 10 C4H3u 0.770 1.880 3.125 34.391 37.143 0.926 possible 13304 228 T LEU N 12 N3H1s 0.700 1.640 2.369 13.673 13.655 1.001 [OK] 13305 228 T LEU CA 3 C4H1s 0.770 1.880 2.911 14.199 13.122 1.082 [OK] 13306 228 T LEU C 1 C3H0s 0.770 1.610 2.596 8.445 8.825 0.957 [OK] 13307 228 T LEU O 16 O1H0u 0.660 1.420 2.659 15.360 16.208 0.948 [OK] 13308 228 T LEU CB 8 C4H2s 0.770 1.880 2.767 20.472 22.951 0.892 [OK] 13309 228 T LEU CG 4 C4H1b 0.770 1.880 5.050 19.842 14.764 1.344 possible 13310 228 T LEU CD1 10 C4H3u 0.770 1.880 19.680 -1.000 37.425 -1.000 bad 13311 228 T LEU CD2 10 C4H3u 0.770 1.880 4.104 36.533 37.143 0.984 possible 13312 229 T GLU N 12 N3H1s 0.700 1.640 2.758 13.303 13.615 0.977 [OK] 13313 229 T GLU CA 3 C4H1s 0.770 1.880 3.339 16.150 13.399 1.205 possible 13314 229 T GLU C 1 C3H0s 0.770 1.610 2.367 8.424 8.675 0.971 [OK] 13315 229 T GLU O 16 O1H0u 0.660 1.420 2.813 15.245 16.023 0.951 [OK] 13316 229 T GLU CB 8 C4H2s 0.770 1.880 3.303 23.432 23.529 0.996 possible 13317 229 T GLU CG 8 C4H2s 0.770 1.880 4.225 35.292 23.513 1.501 possible 13318 229 T GLU CD 2 C3H0b 0.770 1.610 2.385 9.142 9.460 0.966 [OK] 13319 229 T GLU OE1 16 O1H0u 0.660 1.420 2.290 15.307 15.999 0.957 [OK] 13320 229 T GLU OE2 16 O1H0u 0.660 1.420 4.281 24.129 17.432 1.384 possible 13321 230 T GLU N 12 N3H1s 0.700 1.640 2.431 12.420 13.615 0.912 [OK] 13322 230 T GLU CA 3 C4H1s 0.770 1.880 3.058 16.090 13.399 1.201 possible 13323 230 T GLU C 1 C3H0s 0.770 1.610 2.819 8.531 8.675 0.983 [OK] 13324 230 T GLU O 16 O1H0u 0.660 1.420 2.875 15.917 16.023 0.993 [OK] 13325 230 T GLU CB 8 C4H2s 0.770 1.880 3.064 23.627 23.529 1.004 possible 13326 230 T GLU CG 8 C4H2s 0.770 1.880 2.959 21.614 23.513 0.919 [OK] 13327 230 T GLU CD 2 C3H0b 0.770 1.610 2.733 9.575 9.460 1.012 [OK] 13328 230 T GLU OE1 16 O1H0u 0.660 1.420 2.497 16.545 15.999 1.034 [OK] 13329 230 T GLU OE2 16 O1H0u 0.660 1.420 2.640 18.105 17.432 1.039 [OK] 13330 231 T ASP N 12 N3H1s 0.700 1.640 2.534 12.037 13.895 0.866 [OK] 13331 231 T ASP CA 3 C4H1s 0.770 1.880 3.216 14.905 13.377 1.114 possible 13332 231 T ASP C 1 C3H0s 0.770 1.610 2.244 8.236 8.816 0.934 [OK] 13333 231 T ASP O 16 O1H0u 0.660 1.420 2.535 17.944 16.091 1.115 [OK] 13334 231 T ASP CB 8 C4H2s 0.770 1.880 3.109 25.727 23.481 1.096 possible 13335 231 T ASP CG 2 C3H0b 0.770 1.610 2.463 8.991 9.422 0.954 [OK] 13336 231 T ASP OD1 16 O1H0u 0.660 1.420 2.788 16.765 15.505 1.081 [OK] 13337 231 T ASP OD2 16 O1H0u 0.660 1.420 2.442 15.850 16.324 0.971 [OK] 13338 232 T LYS N 12 N3H1s 0.700 1.640 2.827 13.008 13.675 0.951 [OK] 13339 232 T LYS CA 3 C4H1s 0.770 1.880 2.759 12.703 13.324 0.953 [OK] 13340 232 T LYS C 1 C3H0s 0.770 1.610 2.123 8.255 8.759 0.942 [OK] 13341 232 T LYS O 16 O1H0u 0.660 1.420 2.776 15.086 16.049 0.940 [OK] 13342 232 T LYS CB 8 C4H2s 0.770 1.880 3.145 21.904 22.904 0.956 possible 13343 232 T LYS CG 8 C4H2s 0.770 1.880 3.159 23.711 23.131 1.025 possible 13344 232 T LYS CD 8 C4H2s 0.770 1.880 5.438 46.698 23.837 1.959 possible 13345 232 T LYS CE 9 C4H2b 0.770 1.880 4.663 24.930 23.934 1.042 possible 13346 232 T LYS NZ 14 N4H3u 0.700 1.640 41.129 -1.000 21.213 -1.000 bad 13347 233 T ILE N 12 N3H1s 0.700 1.640 2.460 12.656 13.633 0.928 [OK] 13348 233 T ILE CA 3 C4H1s 0.770 1.880 2.822 14.043 13.007 1.080 [OK] 13349 233 T ILE C 1 C3H0s 0.770 1.610 2.441 7.787 8.470 0.919 [OK] 13350 233 T ILE O 16 O1H0u 0.660 1.420 2.476 14.937 16.144 0.925 [OK] 13351 233 T ILE CB 4 C4H1b 0.770 1.880 3.010 14.965 14.227 1.052 possible 13352 233 T ILE CG1 9 C4H2b 0.770 1.880 3.361 23.267 24.187 0.962 possible 13353 233 T ILE CG2 10 C4H3u 0.770 1.880 2.864 36.116 35.961 1.004 [OK] 13354 233 T ILE CD1 10 C4H3u 0.770 1.880 3.294 40.808 38.377 1.063 possible 13355 234 T CYS N 12 N3H1s 0.700 1.640 2.455 12.848 13.981 0.919 [OK] 13356 234 T CYS CA 3 C4H1s 0.770 1.880 2.685 13.925 13.656 1.020 [OK] 13357 234 T CYS C 1 C3H0s 0.770 1.610 2.189 8.357 8.897 0.939 [OK] 13358 234 T CYS O 16 O1H0u 0.660 1.420 2.223 15.085 16.543 0.912 [OK] 13359 234 T CYS CB 9 C4H2b 0.770 1.880 3.480 25.222 23.536 1.072 possible 13360 234 T CYS SG 20 S2H1u 1.040 1.770 3.376 41.273 34.603 1.193 possible 13361 235 T GLY N 12 N3H1s 0.700 1.640 2.654 14.620 14.854 0.984 [OK] 13362 235 T GLY CA 8 C4H2s 0.770 1.880 3.166 27.301 23.688 1.153 possible 13363 235 T GLY C 2 C3H0b 0.770 1.610 2.580 9.395 9.840 0.955 [OK] 13364 235 T GLY O 16 O1H0u 0.660 1.420 2.419 15.190 16.391 0.927 [OK] 13365 236 T TYR N 12 N3H1s 0.700 1.640 2.965 15.207 13.691 1.111 [OK] 13366 236 T TYR CA 3 C4H1s 0.770 1.880 3.356 17.210 13.330 1.291 possible 13367 236 T TYR C 1 C3H0s 0.770 1.610 2.227 7.797 8.770 0.889 [OK] 13368 236 T TYR O 16 O1H0u 0.660 1.420 2.303 16.284 16.124 1.010 [OK] 13369 236 T TYR CB 8 C4H2s 0.770 1.880 3.116 22.490 23.678 0.950 possible 13370 236 T TYR CG 2 C3H0b 0.770 1.610 2.391 9.545 9.732 0.981 [OK] 13371 236 T TYR CD1 5 C3H1s 0.770 1.760 2.828 20.440 20.171 1.013 [OK] 13372 236 T TYR CD2 5 C3H1s 0.770 1.760 3.423 26.281 20.728 1.268 possible 13373 236 T TYR CE1 5 C3H1s 0.770 1.760 2.627 19.165 20.675 0.927 [OK] 13374 236 T TYR CE2 5 C3H1s 0.770 1.760 3.249 23.223 20.810 1.116 possible 13375 236 T TYR CZ 2 C3H0b 0.770 1.610 2.382 9.334 9.926 0.940 [OK] 13376 236 T TYR OH 17 O2H1u 0.660 1.460 3.305 24.854 19.173 1.296 possible 13377 237 T VAL N 12 N3H1s 0.700 1.640 2.518 13.004 13.676 0.951 [OK] 13378 237 T VAL CA 3 C4H1s 0.770 1.880 2.641 13.524 13.123 1.031 [OK] 13379 237 T VAL C 1 C3H0s 0.770 1.610 2.570 8.104 8.563 0.946 [OK] 13380 237 T VAL O 16 O1H0u 0.660 1.420 2.436 16.735 16.181 1.034 [OK] 13381 237 T VAL CB 4 C4H1b 0.770 1.880 2.634 14.656 14.598 1.004 [OK] 13382 237 T VAL CG1 10 C4H3u 0.770 1.880 3.282 38.084 36.584 1.041 possible 13383 237 T VAL CG2 10 C4H3u 0.770 1.880 3.048 36.764 36.332 1.012 possible 13384 238 T ALA N 12 N3H1s 0.700 1.640 2.590 14.217 14.046 1.012 [OK] 13385 238 T ALA CA 4 C4H1b 0.770 1.880 2.951 16.862 14.063 1.199 [OK] 13386 238 T ALA C 1 C3H0s 0.770 1.610 2.654 8.553 8.900 0.961 [OK] 13387 238 T ALA O 16 O1H0u 0.660 1.420 2.441 15.585 16.188 0.963 [OK] 13388 238 T ALA CB 10 C4H3u 0.770 1.880 2.965 37.625 36.782 1.023 [OK] 13389 239 T GLY N 12 N3H1s 0.700 1.640 2.349 12.997 14.854 0.875 [OK] 13390 239 T GLY CA 8 C4H2s 0.770 1.880 2.750 23.318 23.688 0.984 [OK] 13391 239 T GLY C 2 C3H0b 0.770 1.610 2.334 8.801 9.840 0.894 [OK] 13392 239 T GLY O 16 O1H0u 0.660 1.420 2.390 16.090 16.391 0.982 [OK] 13393 240 T GLY N 12 N3H1s 0.700 1.640 2.337 13.433 14.854 0.904 [OK] 13394 240 T GLY CA 8 C4H2s 0.770 1.880 2.935 22.995 23.688 0.971 [OK] 13395 240 T GLY C 2 C3H0b 0.770 1.610 2.369 9.026 9.840 0.917 [OK] 13396 240 T GLY O 16 O1H0u 0.660 1.420 2.184 14.133 16.391 0.862 [OK] 13397 241 T LEU N 12 N3H1s 0.700 1.640 2.504 13.502 13.655 0.989 [OK] 13398 241 T LEU CA 3 C4H1s 0.770 1.880 2.734 12.608 13.122 0.961 [OK] 13399 241 T LEU C 1 C3H0s 0.770 1.610 3.019 9.260 8.825 1.049 possible 13400 241 T LEU O 16 O1H0u 0.660 1.420 4.109 34.827 16.208 2.149 possible 13401 241 T LEU CB 8 C4H2s 0.770 1.880 4.326 27.262 22.951 1.188 possible 13402 241 T LEU CG 4 C4H1b 0.770 1.880 2.856 14.771 14.764 1.000 [OK] 13403 241 T LEU CD1 10 C4H3u 0.770 1.880 3.451 43.498 37.425 1.162 possible 13404 241 T LEU CD2 10 C4H3u 0.770 1.880 4.905 59.839 37.143 1.611 possible 13405 242 T MET N 12 N3H1s 0.700 1.640 3.131 13.272 13.564 0.978 possible 13406 242 T MET CA 3 C4H1s 0.770 1.880 4.202 21.915 13.231 1.656 possible 13407 242 T MET C 1 C3H0s 0.770 1.610 2.560 8.888 8.782 1.012 [OK] 13408 242 T MET O 16 O1H0u 0.660 1.420 4.165 30.947 16.277 1.901 possible 13409 242 T MET CB 8 C4H2s 0.770 1.880 3.823 25.107 23.645 1.062 possible 13410 242 T MET CG 9 C4H2b 0.770 1.880 3.891 28.069 24.009 1.169 possible 13411 242 T MET SD 19 S2H0u 1.040 1.770 2.866 27.294 30.093 0.907 [OK] 13412 242 T MET CE 10 C4H3u 0.770 1.880 3.647 38.802 37.161 1.044 possible 13413 243 T TYR N 12 N3H1s 0.700 1.640 2.321 12.915 13.691 0.943 [OK] 13414 243 T TYR CA 3 C4H1s 0.770 1.880 4.326 16.270 13.330 1.221 possible 13415 243 T TYR C 1 C3H0s 0.770 1.610 3.071 9.616 8.770 1.096 possible 13416 243 T TYR O 16 O1H0u 0.660 1.420 5.884 60.355 16.124 3.743 possible 13417 243 T TYR CB 8 C4H2s 0.770 1.880 4.269 33.606 23.678 1.419 possible 13418 243 T TYR CG 2 C3H0b 0.770 1.610 2.878 10.459 9.732 1.075 [OK] 13419 243 T TYR CD1 5 C3H1s 0.770 1.760 6.269 54.459 20.171 2.700 possible 13420 243 T TYR CD2 5 C3H1s 0.770 1.760 2.753 21.116 20.728 1.019 [OK] 13421 243 T TYR CE1 5 C3H1s 0.770 1.760 4.932 26.805 20.675 1.296 possible 13422 243 T TYR CE2 5 C3H1s 0.770 1.760 2.693 21.101 20.810 1.014 [OK] 13423 243 T TYR CZ 2 C3H0b 0.770 1.610 2.325 9.023 9.926 0.909 [OK] 13424 243 T TYR OH 17 O2H1u 0.660 1.460 2.544 20.351 19.173 1.061 [OK] 13425 244 T ALA N 12 N3H1s 0.700 1.640 2.976 14.524 14.046 1.034 [OK] 13426 244 T ALA CA 4 C4H1b 0.770 1.880 3.236 16.752 14.063 1.191 possible 13427 244 T ALA C 1 C3H0s 0.770 1.610 2.919 9.506 8.900 1.068 [OK] 13428 244 T ALA O 16 O1H0u 0.660 1.420 2.723 17.491 16.188 1.081 [OK] 13429 244 T ALA CB 10 C4H3u 0.770 1.880 2.947 35.874 36.782 0.975 [OK] 13430 245 T ALA N 12 N3H1s 0.700 1.640 2.417 14.071 14.046 1.002 [OK] 13431 245 T ALA CA 4 C4H1b 0.770 1.880 3.383 14.664 14.063 1.043 possible 13432 245 T ALA C 1 C3H0s 0.770 1.610 4.371 9.107 8.900 1.023 possible 13433 245 T ALA O 16 O1H0u 0.660 1.420 13.100 -1.000 16.188 -1.000 bad 13434 245 T ALA CB 10 C4H3u 0.770 1.880 36.029 -1.000 36.782 -1.000 bad 13435 246 T PRO N 11 N3H0u 0.700 1.640 5.138 10.651 8.823 1.207 possible 13436 246 T PRO CA 4 C4H1b 0.770 1.880 11.168 -1.000 13.955 -1.000 bad 13437 246 T PRO C 1 C3H0s 0.770 1.610 2.758 9.333 8.812 1.059 [OK] 13438 246 T PRO O 16 O1H0u 0.660 1.420 33.333 -1.000 16.169 -1.000 bad 13439 246 T PRO CB 9 C4H2b 0.770 1.880 30.115 -1.000 25.563 -1.000 bad 13440 246 T PRO CG 9 C4H2b 0.770 1.880 44.739 -1.000 25.832 -1.000 bad 13441 246 T PRO CD 8 C4H2s 0.770 1.880 4.836 37.196 23.836 1.560 possible 13442 247 T LYS N 12 N3H1s 0.700 1.640 2.862 12.874 13.675 0.941 [OK] 13443 247 T LYS CA 3 C4H1s 0.770 1.880 5.501 22.763 13.324 1.708 possible 13444 247 T LYS C 1 C3H0s 0.770 1.610 3.666 12.194 8.759 1.392 possible 13445 247 T LYS O 16 O1H0u 0.660 1.420 3.934 22.757 16.049 1.418 possible 13446 247 T LYS CB 8 C4H2s 0.770 1.880 4.604 26.844 22.904 1.172 possible 13447 247 T LYS CG 8 C4H2s 0.770 1.880 20.012 -1.000 23.131 -1.000 bad 13448 247 T LYS CD 8 C4H2s 0.770 1.880 3.593 28.077 23.837 1.178 possible 13449 247 T LYS CE 9 C4H2b 0.770 1.880 34.395 -1.000 23.934 -1.000 bad 13450 247 T LYS NZ 14 N4H3u 0.700 1.640 24.603 -1.000 21.213 -1.000 bad 13451 248 T ARG N 12 N3H1s 0.700 1.640 3.033 15.607 13.650 1.143 possible 13452 248 T ARG CA 3 C4H1s 0.770 1.880 2.603 12.471 13.422 0.929 [OK] 13453 248 T ARG C 1 C3H0s 0.770 1.610 3.309 9.116 8.838 1.031 possible 13454 248 T ARG O 16 O1H0u 0.660 1.420 21.356 -1.000 16.084 -1.000 bad 13455 248 T ARG CB 8 C4H2s 0.770 1.880 4.796 26.375 23.088 1.142 possible 13456 248 T ARG CG 8 C4H2s 0.770 1.880 14.689 -1.000 23.640 -1.000 bad 13457 248 T ARG CD 8 C4H2s 0.770 1.880 5.080 21.143 23.300 0.907 possible 13458 248 T ARG NE 13 N3H1b 0.700 1.640 11.470 -1.000 15.569 -1.000 bad 13459 248 T ARG CZ 2 C3H0b 0.770 1.610 2.844 10.753 9.747 1.103 [OK] 13460 248 T ARG NH1 15 N3H2u 0.700 1.640 2.609 23.263 22.782 1.021 [OK] 13461 248 T ARG NH2 15 N3H2u 0.700 1.640 4.762 34.344 23.810 1.442 possible 13462 249 T LYS N 12 N3H1s 0.700 1.640 2.952 14.486 13.675 1.059 [OK] 13463 249 T LYS CA 3 C4H1s 0.770 1.880 6.652 21.723 13.324 1.630 possible 13464 249 T LYS C 1 C3H0s 0.770 1.610 2.918 9.260 8.759 1.057 [OK] 13465 249 T LYS O 16 O1H0u 0.660 1.420 3.882 30.993 16.049 1.931 possible 13466 249 T LYS CB 8 C4H2s 0.770 1.880 3.988 23.943 22.904 1.045 possible 13467 249 T LYS CG 8 C4H2s 0.770 1.880 13.901 -1.000 23.131 -1.000 bad 13468 249 T LYS CD 8 C4H2s 0.770 1.880 5.767 32.273 23.837 1.354 possible 13469 249 T LYS CE 9 C4H2b 0.770 1.880 32.108 -1.000 23.934 -1.000 bad 13470 249 T LYS NZ 14 N4H3u 0.700 1.640 38.611 -1.000 21.213 -1.000 bad 13471 250 T SER N 12 N3H1s 0.700 1.640 5.302 24.115 14.103 1.710 possible 13472 250 T SER CA 3 C4H1s 0.770 1.880 7.539 35.402 13.476 2.627 possible 13473 250 T SER C 1 C3H0s 0.770 1.610 3.303 9.782 8.923 1.096 possible 13474 250 T SER O 16 O1H0u 0.660 1.420 2.981 15.491 16.179 0.957 [OK] 13475 250 T SER CB 8 C4H2s 0.770 1.880 36.141 -1.000 23.884 -1.000 bad 13476 250 T SER OG 17 O2H1u 0.660 1.460 11.216 -1.000 18.732 -1.000 bad 13477 251 T VAL N 12 N3H1s 0.700 1.640 5.187 24.470 13.676 1.789 possible 13478 251 T VAL CA 3 C4H1s 0.770 1.880 3.977 16.730 13.123 1.275 possible 13479 251 T VAL C 1 C3H0s 0.770 1.610 3.308 9.022 8.563 1.054 possible 13480 251 T VAL O 16 O1H0u 0.660 1.420 4.675 21.483 16.181 1.328 possible 13481 251 T VAL CB 4 C4H1b 0.770 1.880 12.355 -1.000 14.598 -1.000 bad 13482 251 T VAL CG1 10 C4H3u 0.770 1.880 63.695 -1.000 36.584 -1.000 bad 13483 251 T VAL CG2 10 C4H3u 0.770 1.880 49.112 -1.000 36.332 -1.000 bad 13484 252 T VAL N 12 N3H1s 0.700 1.640 3.498 15.280 13.676 1.117 possible 13485 252 T VAL CA 3 C4H1s 0.770 1.880 3.877 14.167 13.123 1.080 possible 13486 252 T VAL C 1 C3H0s 0.770 1.610 3.450 8.689 8.563 1.015 possible 13487 252 T VAL O 16 O1H0u 0.660 1.420 3.331 19.110 16.181 1.181 possible 13488 252 T VAL CB 4 C4H1b 0.770 1.880 10.643 -1.000 14.598 -1.000 bad 13489 252 T VAL CG1 10 C4H3u 0.770 1.880 35.513 -1.000 36.584 -1.000 bad 13490 252 T VAL CG2 10 C4H3u 0.770 1.880 40.989 -1.000 36.332 -1.000 bad 13491 253 T ALA N 12 N3H1s 0.700 1.640 3.568 13.649 14.046 0.972 possible 13492 253 T ALA CA 4 C4H1b 0.770 1.880 5.091 22.783 14.063 1.620 possible 13493 253 T ALA C 1 C3H0s 0.770 1.610 2.156 8.126 8.900 0.913 [OK] 13494 253 T ALA O 16 O1H0u 0.660 1.420 2.872 17.094 16.188 1.056 [OK] 13495 253 T ALA CB 10 C4H3u 0.770 1.880 16.122 -1.000 36.782 -1.000 bad 13496 254 T ALA N 12 N3H1s 0.700 1.640 2.810 12.763 14.046 0.909 [OK] 13497 254 T ALA CA 4 C4H1b 0.770 1.880 2.934 13.908 14.063 0.989 [OK] 13498 254 T ALA C 1 C3H0s 0.770 1.610 3.912 9.204 8.900 1.034 possible 13499 254 T ALA O 16 O1H0u 0.660 1.420 5.105 52.417 16.188 3.238 possible 13500 254 T ALA CB 10 C4H3u 0.770 1.880 6.340 87.448 36.782 2.377 possible 13501 255 T MET N 12 N3H1s 0.700 1.640 4.052 14.212 13.564 1.048 possible 13502 255 T MET CA 3 C4H1s 0.770 1.880 7.584 38.438 13.231 2.905 possible 13503 255 T MET C 1 C3H0s 0.770 1.610 4.888 13.110 8.782 1.493 possible 13504 255 T MET O 16 O1H0u 0.660 1.420 21.585 -1.000 16.277 -1.000 bad 13505 255 T MET CB 8 C4H2s 0.770 1.880 27.747 -1.000 23.645 -1.000 bad 13506 255 T MET CG 9 C4H2b 0.770 1.880 3.976 21.775 24.009 0.907 possible 13507 255 T MET SD 19 S2H0u 1.040 1.770 35.223 -1.000 30.093 -1.000 bad 13508 255 T MET CE 10 C4H3u 0.770 1.880 45.795 -1.000 37.161 -1.000 bad 13509 256 T LEU N 12 N3H1s 0.700 1.640 3.772 15.036 13.655 1.101 possible 13510 256 T LEU CA 3 C4H1s 0.770 1.880 3.987 15.481 13.122 1.180 possible 13511 256 T LEU C 1 C3H0s 0.770 1.610 5.115 12.641 8.825 1.432 possible 13512 256 T LEU O 16 O1H0u 0.660 1.420 40.271 -1.000 16.208 -1.000 bad 13513 256 T LEU CB 8 C4H2s 0.770 1.880 3.135 23.702 22.951 1.033 possible 13514 256 T LEU CG 4 C4H1b 0.770 1.880 8.634 -1.000 14.764 -1.000 bad 13515 256 T LEU CD1 10 C4H3u 0.770 1.880 49.071 -1.000 37.425 -1.000 bad 13516 256 T LEU CD2 10 C4H3u 0.770 1.880 49.885 -1.000 37.143 -1.000 bad 13517 256 T LEU OXT 16 O1H0u 0.660 1.420 6.833 70.224 1.420 49.454 possible 13519 1 d BCL MG d 25 DEFAULT 0.770 1.800 3.015 15.834 1.800 8.797 possible 13520 1 d BCL CHA 9 C4H2b 0.770 1.880 2.990 11.815 1.880 6.285 [OK] 13521 1 d BCL CHB 9 C4H2b 0.770 1.880 4.488 24.961 1.880 13.277 possible 13522 1 d BCL CHC 9 C4H2b 0.770 1.880 3.542 20.545 1.880 10.928 possible 13523 1 d BCL CHD 9 C4H2b 0.770 1.880 3.052 22.929 1.880 12.196 possible 13524 1 d BCL N A 14 N4H3u 0.700 1.640 2.665 11.285 1.640 6.881 [OK] 13525 1 d BCL C1A 9 C4H2b 0.770 1.880 2.907 11.037 1.880 5.871 [OK] 13526 1 d BCL C2A 9 C4H2b 0.770 1.880 4.936 17.460 1.880 9.287 possible 13527 1 d BCL C3A 9 C4H2b 0.770 1.880 3.802 17.471 1.880 9.293 possible 13528 1 d BCL C4A 9 C4H2b 0.770 1.880 3.020 10.748 1.880 5.717 possible 13529 1 d BCL CMA 9 C4H2b 0.770 1.880 6.928 70.075 1.880 37.274 possible 13530 1 d BCL CAA 9 C4H2b 0.770 1.880 7.462 58.901 1.880 31.330 possible 13531 1 d BCL CBA 9 C4H2b 0.770 1.880 3.049 22.444 1.880 11.938 possible 13532 1 d BCL CGA 9 C4H2b 0.770 1.880 3.836 11.361 1.880 6.043 possible 13533 1 d BCL O1A 17 O2H1u 0.660 1.460 3.593 20.251 1.460 13.871 possible 13534 1 d BCL O2A 17 O2H1u 0.660 1.460 3.601 15.399 1.460 10.547 possible 13535 1 d BCL N B 14 N4H3u 0.700 1.640 2.908 10.996 1.640 6.705 [OK] 13536 1 d BCL C1B 9 C4H2b 0.770 1.880 4.700 13.713 1.880 7.294 possible 13537 1 d BCL C2B 9 C4H2b 0.770 1.880 4.676 17.852 1.880 9.496 possible 13538 1 d BCL C3B 9 C4H2b 0.770 1.880 4.294 16.999 1.880 9.042 possible 13539 1 d BCL C4B 9 C4H2b 0.770 1.880 3.741 12.371 1.880 6.581 possible 13540 1 d BCL CMB 9 C4H2b 0.770 1.880 4.300 42.595 1.880 22.657 possible 13541 1 d BCL CAB 9 C4H2b 0.770 1.880 4.194 15.950 1.880 8.484 possible 13542 1 d BCL OBB 17 O2H1u 0.660 1.460 3.651 24.196 1.460 16.573 possible 13543 1 d BCL CBB 9 C4H2b 0.770 1.880 4.127 42.384 1.880 22.544 possible 13544 1 d BCL N C 14 N4H3u 0.700 1.640 2.886 11.524 1.640 7.027 [OK] 13545 1 d BCL C1C 9 C4H2b 0.770 1.880 2.665 10.577 1.880 5.626 [OK] 13546 1 d BCL C2C 9 C4H2b 0.770 1.880 2.901 14.438 1.880 7.680 [OK] 13547 1 d BCL C3C 9 C4H2b 0.770 1.880 3.035 13.671 1.880 7.272 possible 13548 1 d BCL C4C 9 C4H2b 0.770 1.880 2.944 11.327 1.880 6.025 [OK] 13549 1 d BCL CMC 9 C4H2b 0.770 1.880 3.190 39.710 1.880 21.122 possible 13550 1 d BCL CAC 9 C4H2b 0.770 1.880 3.045 22.145 1.880 11.779 possible 13551 1 d BCL CBC 9 C4H2b 0.770 1.880 3.093 35.909 1.880 19.101 possible 13552 1 d BCL N D 14 N4H3u 0.700 1.640 2.595 11.343 1.640 6.917 [OK] 13553 1 d BCL C1D 9 C4H2b 0.770 1.880 2.758 11.130 1.880 5.920 [OK] 13554 1 d BCL C2D 9 C4H2b 0.770 1.880 2.860 11.131 1.880 5.921 [OK] 13555 1 d BCL C3D 9 C4H2b 0.770 1.880 2.575 11.211 1.880 5.963 [OK] 13556 1 d BCL C4D 9 C4H2b 0.770 1.880 2.720 11.210 1.880 5.963 [OK] 13557 1 d BCL CMD 9 C4H2b 0.770 1.880 2.954 32.754 1.880 17.422 [OK] 13558 1 d BCL CAD 9 C4H2b 0.770 1.880 2.590 9.766 1.880 5.195 [OK] 13559 1 d BCL OBD 17 O2H1u 0.660 1.460 2.538 17.638 1.460 12.081 [OK] 13560 1 d BCL CBD 9 C4H2b 0.770 1.880 3.049 16.545 1.880 8.801 possible 13561 1 d BCL CGD 9 C4H2b 0.770 1.880 2.631 9.144 1.880 4.864 [OK] 13562 1 d BCL O1D 17 O2H1u 0.660 1.460 5.987 50.424 1.460 34.537 possible 13563 1 d BCL O2D 17 O2H1u 0.660 1.460 2.635 14.567 1.460 9.978 [OK] 13564 1 d BCL CED 9 C4H2b 0.770 1.880 5.021 55.643 1.880 29.598 possible 13565 1 d BCL C1 9 C4H2b 0.770 1.880 3.190 24.707 1.880 13.142 possible 13566 1 d BCL C2 9 C4H2b 0.770 1.880 5.685 40.892 1.880 21.751 possible 13567 1 d BCL C3 9 C4H2b 0.770 1.880 4.025 16.636 1.880 8.849 possible 13568 1 d BCL C4 9 C4H2b 0.770 1.880 4.392 40.033 1.880 21.294 possible 13569 1 d BCL C5 9 C4H2b 0.770 1.880 46.937 -1.000 1.880 -1.000 bad 13570 2 d BCL MG d 25 DEFAULT 0.770 1.800 2.280 12.848 1.800 7.138 [OK] 13571 2 d BCL CHA 9 C4H2b 0.770 1.880 3.056 12.066 1.880 6.418 possible 13572 2 d BCL CHB 9 C4H2b 0.770 1.880 3.261 20.294 1.880 10.794 possible 13573 2 d BCL CHC 9 C4H2b 0.770 1.880 2.547 16.850 1.880 8.963 [OK] 13574 2 d BCL CHD 9 C4H2b 0.770 1.880 2.740 18.368 1.880 9.770 [OK] 13575 2 d BCL N A 14 N4H3u 0.700 1.640 2.437 10.685 1.640 6.515 [OK] 13576 2 d BCL C1A 9 C4H2b 0.770 1.880 3.042 12.062 1.880 6.416 possible 13577 2 d BCL C2A 9 C4H2b 0.770 1.880 2.965 13.501 1.880 7.182 [OK] 13578 2 d BCL C3A 9 C4H2b 0.770 1.880 3.157 16.386 1.880 8.716 possible 13579 2 d BCL C4A 9 C4H2b 0.770 1.880 2.778 10.942 1.880 5.820 [OK] 13580 2 d BCL CMA 9 C4H2b 0.770 1.880 3.247 35.498 1.880 18.882 possible 13581 2 d BCL CAA 9 C4H2b 0.770 1.880 2.871 18.786 1.880 9.993 [OK] 13582 2 d BCL CBA 9 C4H2b 0.770 1.880 2.944 22.043 1.880 11.725 [OK] 13583 2 d BCL CGA 9 C4H2b 0.770 1.880 2.821 10.026 1.880 5.333 [OK] 13584 2 d BCL O1A 17 O2H1u 0.660 1.460 2.596 16.706 1.460 11.443 [OK] 13585 2 d BCL O2A 17 O2H1u 0.660 1.460 2.768 16.417 1.460 11.245 [OK] 13586 2 d BCL N B 14 N4H3u 0.700 1.640 2.072 9.128 1.640 5.566 [OK] 13587 2 d BCL C1B 9 C4H2b 0.770 1.880 2.348 9.382 1.880 4.990 [OK] 13588 2 d BCL C2B 9 C4H2b 0.770 1.880 2.502 9.913 1.880 5.273 [OK] 13589 2 d BCL C3B 9 C4H2b 0.770 1.880 2.656 10.610 1.880 5.644 [OK] 13590 2 d BCL C4B 9 C4H2b 0.770 1.880 2.668 10.134 1.880 5.390 [OK] 13591 2 d BCL CMB 9 C4H2b 0.770 1.880 3.261 36.763 1.880 19.555 possible 13592 2 d BCL CAB 9 C4H2b 0.770 1.880 2.444 9.855 1.880 5.242 [OK] 13593 2 d BCL OBB 17 O2H1u 0.660 1.460 2.306 15.242 1.460 10.440 [OK] 13594 2 d BCL CBB 9 C4H2b 0.770 1.880 2.863 33.827 1.880 17.993 [OK] 13595 2 d BCL N C 14 N4H3u 0.700 1.640 2.518 10.076 1.640 6.144 [OK] 13596 2 d BCL C1C 9 C4H2b 0.770 1.880 2.710 10.514 1.880 5.593 [OK] 13597 2 d BCL C2C 9 C4H2b 0.770 1.880 2.626 12.517 1.880 6.658 [OK] 13598 2 d BCL C3C 9 C4H2b 0.770 1.880 2.464 12.418 1.880 6.605 [OK] 13599 2 d BCL C4C 9 C4H2b 0.770 1.880 2.451 10.178 1.880 5.414 [OK] 13600 2 d BCL CMC 9 C4H2b 0.770 1.880 3.206 31.556 1.880 16.785 possible 13601 2 d BCL CAC 9 C4H2b 0.770 1.880 2.812 23.256 1.880 12.370 [OK] 13602 2 d BCL CBC 9 C4H2b 0.770 1.880 2.993 36.044 1.880 19.172 [OK] 13603 2 d BCL N D 14 N4H3u 0.700 1.640 2.572 11.328 1.640 6.907 [OK] 13604 2 d BCL C1D 9 C4H2b 0.770 1.880 2.432 9.996 1.880 5.317 [OK] 13605 2 d BCL C2D 9 C4H2b 0.770 1.880 2.569 11.308 1.880 6.015 [OK] 13606 2 d BCL C3D 9 C4H2b 0.770 1.880 2.949 13.340 1.880 7.096 [OK] 13607 2 d BCL C4D 9 C4H2b 0.770 1.880 3.135 13.016 1.880 6.923 possible 13608 2 d BCL CMD 9 C4H2b 0.770 1.880 3.107 36.245 1.880 19.279 possible 13609 2 d BCL CAD 9 C4H2b 0.770 1.880 2.810 10.754 1.880 5.720 [OK] 13610 2 d BCL OBD 17 O2H1u 0.660 1.460 2.446 19.047 1.460 13.046 [OK] 13611 2 d BCL CBD 9 C4H2b 0.770 1.880 2.639 12.217 1.880 6.498 [OK] 13612 2 d BCL CGD 9 C4H2b 0.770 1.880 2.323 8.748 1.880 4.653 [OK] 13613 2 d BCL O1D 17 O2H1u 0.660 1.460 2.708 17.708 1.460 12.129 [OK] 13614 2 d BCL O2D 17 O2H1u 0.660 1.460 2.563 12.523 1.460 8.577 [OK] 13615 2 d BCL CED 9 C4H2b 0.770 1.880 3.049 38.183 1.880 20.310 possible 13616 2 d BCL C1 9 C4H2b 0.770 1.880 2.999 24.648 1.880 13.111 [OK] 13617 2 d BCL C2 9 C4H2b 0.770 1.880 3.042 23.705 1.880 12.609 possible 13618 2 d BCL C3 9 C4H2b 0.770 1.880 2.961 13.073 1.880 6.954 [OK] 13619 2 d BCL C4 9 C4H2b 0.770 1.880 3.177 38.550 1.880 20.505 possible 13620 2 d BCL C5 9 C4H2b 0.770 1.880 2.838 21.046 1.880 11.195 [OK] 13621 2 d BCL C6 9 C4H2b 0.770 1.880 2.797 21.964 1.880 11.683 [OK] 13622 2 d BCL C7 9 C4H2b 0.770 1.880 3.206 21.947 1.880 11.674 possible 13623 2 d BCL C8 9 C4H2b 0.770 1.880 2.847 13.653 1.880 7.262 [OK] 13624 2 d BCL C9 9 C4H2b 0.770 1.880 3.107 34.104 1.880 18.140 possible 13625 2 d BCL C10 9 C4H2b 0.770 1.880 3.183 24.446 1.880 13.003 possible 13626 2 d BCL C11 9 C4H2b 0.770 1.880 2.821 20.652 1.880 10.985 [OK] 13627 2 d BCL C12 9 C4H2b 0.770 1.880 2.797 20.406 1.880 10.854 [OK] 13628 2 d BCL C13 9 C4H2b 0.770 1.880 2.971 15.264 1.880 8.119 [OK] 13629 2 d BCL C14 9 C4H2b 0.770 1.880 2.888 35.566 1.880 18.918 [OK] 13630 2 d BCL C15 9 C4H2b 0.770 1.880 2.825 22.568 1.880 12.004 [OK] 13631 2 d BCL C16 9 C4H2b 0.770 1.880 2.970 24.417 1.880 12.988 [OK] 13632 2 d BCL C17 9 C4H2b 0.770 1.880 3.670 29.070 1.880 15.463 possible 13633 2 d BCL C18 9 C4H2b 0.770 1.880 5.030 21.429 1.880 11.398 possible 13634 2 d BCL C19 9 C4H2b 0.770 1.880 7.693 72.834 1.880 38.742 possible 13635 2 d BCL C20 9 C4H2b 0.770 1.880 51.825 -1.000 1.880 -1.000 bad 13636 3 d BCL MG d 25 DEFAULT 0.770 1.800 2.255 12.898 1.800 7.166 [OK] 13637 3 d BCL CHA 9 C4H2b 0.770 1.880 2.524 10.379 1.880 5.521 [OK] 13638 3 d BCL CHB 9 C4H2b 0.770 1.880 3.016 19.027 1.880 10.121 possible 13639 3 d BCL CHC 9 C4H2b 0.770 1.880 2.687 16.541 1.880 8.798 [OK] 13640 3 d BCL CHD 9 C4H2b 0.770 1.880 2.881 19.701 1.880 10.479 [OK] 13641 3 d BCL N A 14 N4H3u 0.700 1.640 2.675 10.759 1.640 6.560 [OK] 13642 3 d BCL C1A 9 C4H2b 0.770 1.880 2.984 11.964 1.880 6.364 [OK] 13643 3 d BCL C2A 9 C4H2b 0.770 1.880 2.839 13.443 1.880 7.151 [OK] 13644 3 d BCL C3A 9 C4H2b 0.770 1.880 2.947 14.956 1.880 7.955 [OK] 13645 3 d BCL C4A 9 C4H2b 0.770 1.880 2.903 11.450 1.880 6.090 [OK] 13646 3 d BCL CMA 9 C4H2b 0.770 1.880 3.060 30.494 1.880 16.220 possible 13647 3 d BCL CAA 9 C4H2b 0.770 1.880 2.776 20.909 1.880 11.122 [OK] 13648 3 d BCL CBA 9 C4H2b 0.770 1.880 3.137 25.919 1.880 13.787 possible 13649 3 d BCL CGA 9 C4H2b 0.770 1.880 2.609 10.031 1.880 5.336 [OK] 13650 3 d BCL O1A 17 O2H1u 0.660 1.460 2.570 20.890 1.460 14.308 [OK] 13651 3 d BCL O2A 17 O2H1u 0.660 1.460 2.319 11.681 1.460 8.001 [OK] 13652 3 d BCL N B 14 N4H3u 0.700 1.640 2.268 9.700 1.640 5.915 [OK] 13653 3 d BCL C1B 9 C4H2b 0.770 1.880 2.513 9.302 1.880 4.948 [OK] 13654 3 d BCL C2B 9 C4H2b 0.770 1.880 2.445 10.086 1.880 5.365 [OK] 13655 3 d BCL C3B 9 C4H2b 0.770 1.880 2.510 10.476 1.880 5.572 [OK] 13656 3 d BCL C4B 9 C4H2b 0.770 1.880 2.495 10.108 1.880 5.377 [OK] 13657 3 d BCL CMB 9 C4H2b 0.770 1.880 3.036 34.516 1.880 18.360 possible 13658 3 d BCL CAB 9 C4H2b 0.770 1.880 2.379 9.819 1.880 5.223 [OK] 13659 3 d BCL OBB 17 O2H1u 0.660 1.460 2.659 19.059 1.460 13.054 [OK] 13660 3 d BCL CBB 9 C4H2b 0.770 1.880 2.685 26.377 1.880 14.030 [OK] 13661 3 d BCL N C 14 N4H3u 0.700 1.640 2.567 10.287 1.640 6.273 [OK] 13662 3 d BCL C1C 9 C4H2b 0.770 1.880 2.601 10.326 1.880 5.492 [OK] 13663 3 d BCL C2C 9 C4H2b 0.770 1.880 2.575 12.321 1.880 6.554 [OK] 13664 3 d BCL C3C 9 C4H2b 0.770 1.880 2.656 12.870 1.880 6.846 [OK] 13665 3 d BCL C4C 9 C4H2b 0.770 1.880 2.720 11.455 1.880 6.093 [OK] 13666 3 d BCL CMC 9 C4H2b 0.770 1.880 2.930 35.941 1.880 19.118 [OK] 13667 3 d BCL CAC 9 C4H2b 0.770 1.880 2.577 22.645 1.880 12.045 [OK] 13668 3 d BCL CBC 9 C4H2b 0.770 1.880 3.046 34.294 1.880 18.241 possible 13669 3 d BCL N D 14 N4H3u 0.700 1.640 2.484 10.907 1.640 6.650 [OK] 13670 3 d BCL C1D 9 C4H2b 0.770 1.880 2.596 9.970 1.880 5.303 [OK] 13671 3 d BCL C2D 9 C4H2b 0.770 1.880 2.641 10.577 1.880 5.626 [OK] 13672 3 d BCL C3D 9 C4H2b 0.770 1.880 2.819 12.018 1.880 6.393 [OK] 13673 3 d BCL C4D 9 C4H2b 0.770 1.880 2.773 10.759 1.880 5.723 [OK] 13674 3 d BCL CMD 9 C4H2b 0.770 1.880 3.244 37.769 1.880 20.090 possible 13675 3 d BCL CAD 9 C4H2b 0.770 1.880 2.301 8.818 1.880 4.691 [OK] 13676 3 d BCL OBD 17 O2H1u 0.660 1.460 2.772 21.060 1.460 14.424 [OK] 13677 3 d BCL CBD 9 C4H2b 0.770 1.880 2.779 13.641 1.880 7.256 [OK] 13678 3 d BCL CGD 9 C4H2b 0.770 1.880 2.487 9.128 1.880 4.855 [OK] 13679 3 d BCL O1D 17 O2H1u 0.660 1.460 2.658 19.141 1.460 13.110 [OK] 13680 3 d BCL O2D 17 O2H1u 0.660 1.460 2.447 11.448 1.460 7.841 [OK] 13681 3 d BCL CED 9 C4H2b 0.770 1.880 3.216 39.315 1.880 20.912 possible 13682 3 d BCL C1 9 C4H2b 0.770 1.880 3.126 23.588 1.880 12.547 possible 13683 3 d BCL C2 9 C4H2b 0.770 1.880 2.867 19.134 1.880 10.178 [OK] 13684 3 d BCL C3 9 C4H2b 0.770 1.880 2.643 10.502 1.880 5.586 [OK] 13685 3 d BCL C4 9 C4H2b 0.770 1.880 3.185 32.443 1.880 17.257 possible 13686 3 d BCL C5 9 C4H2b 0.770 1.880 2.986 26.091 1.880 13.878 [OK] 13687 3 d BCL C6 9 C4H2b 0.770 1.880 2.914 22.603 1.880 12.023 [OK] 13688 3 d BCL C7 9 C4H2b 0.770 1.880 3.251 24.125 1.880 12.833 possible 13689 3 d BCL C8 9 C4H2b 0.770 1.880 3.052 15.130 1.880 8.048 possible 13690 3 d BCL C9 9 C4H2b 0.770 1.880 3.182 39.144 1.880 20.821 possible 13691 3 d BCL C10 9 C4H2b 0.770 1.880 2.961 22.689 1.880 12.069 [OK] 13692 3 d BCL C11 9 C4H2b 0.770 1.880 3.131 26.180 1.880 13.926 possible 13693 3 d BCL C12 9 C4H2b 0.770 1.880 2.907 22.137 1.880 11.775 [OK] 13694 3 d BCL C13 9 C4H2b 0.770 1.880 2.813 13.585 1.880 7.226 [OK] 13695 3 d BCL C14 9 C4H2b 0.770 1.880 3.477 43.205 1.880 22.981 possible 13696 3 d BCL C15 9 C4H2b 0.770 1.880 5.253 41.807 1.880 22.238 possible 13697 3 d BCL C16 9 C4H2b 0.770 1.880 4.396 27.787 1.880 14.780 possible 13698 3 d BCL C17 9 C4H2b 0.770 1.880 6.890 54.967 1.880 29.238 possible 13699 3 d BCL C18 9 C4H2b 0.770 1.880 3.908 19.730 1.880 10.495 possible 13700 3 d BCL C19 9 C4H2b 0.770 1.880 44.554 -1.000 1.880 -1.000 bad 13701 3 d BCL C20 9 C4H2b 0.770 1.880 4.857 73.818 1.880 39.265 possible 13702 4 d BCL MG d 25 DEFAULT 0.770 1.800 2.932 16.288 1.800 9.049 [OK] 13703 4 d BCL CHA 9 C4H2b 0.770 1.880 2.996 11.778 1.880 6.265 [OK] 13704 4 d BCL CHB 9 C4H2b 0.770 1.880 2.791 19.891 1.880 10.580 [OK] 13705 4 d BCL CHC 9 C4H2b 0.770 1.880 3.051 21.609 1.880 11.494 possible 13706 4 d BCL CHD 9 C4H2b 0.770 1.880 3.124 21.512 1.880 11.443 possible 13707 4 d BCL N A 14 N4H3u 0.700 1.640 2.815 11.770 1.640 7.177 [OK] 13708 4 d BCL C1A 9 C4H2b 0.770 1.880 2.978 10.988 1.880 5.845 [OK] 13709 4 d BCL C2A 9 C4H2b 0.770 1.880 5.203 19.030 1.880 10.122 possible 13710 4 d BCL C3A 9 C4H2b 0.770 1.880 3.011 13.697 1.880 7.286 possible 13711 4 d BCL C4A 9 C4H2b 0.770 1.880 2.806 10.898 1.880 5.797 [OK] 13712 4 d BCL CMA 9 C4H2b 0.770 1.880 6.973 66.886 1.880 35.578 possible 13713 4 d BCL CAA 9 C4H2b 0.770 1.880 6.700 48.682 1.880 25.895 possible 13714 4 d BCL CBA 9 C4H2b 0.770 1.880 3.054 25.035 1.880 13.317 possible 13715 4 d BCL CGA 9 C4H2b 0.770 1.880 2.785 11.418 1.880 6.074 [OK] 13716 4 d BCL O1A 17 O2H1u 0.660 1.460 4.491 24.902 1.460 17.056 possible 13717 4 d BCL O2A 17 O2H1u 0.660 1.460 2.472 13.636 1.460 9.340 [OK] 13718 4 d BCL N B 14 N4H3u 0.700 1.640 2.503 11.559 1.640 7.048 [OK] 13719 4 d BCL C1B 9 C4H2b 0.770 1.880 2.577 10.550 1.880 5.612 [OK] 13720 4 d BCL C2B 9 C4H2b 0.770 1.880 2.821 11.790 1.880 6.272 [OK] 13721 4 d BCL C3B 9 C4H2b 0.770 1.880 2.858 12.147 1.880 6.461 [OK] 13722 4 d BCL C4B 9 C4H2b 0.770 1.880 2.639 11.400 1.880 6.064 [OK] 13723 4 d BCL CMB 9 C4H2b 0.770 1.880 2.789 31.169 1.880 16.579 [OK] 13724 4 d BCL CAB 9 C4H2b 0.770 1.880 2.900 12.332 1.880 6.560 [OK] 13725 4 d BCL OBB 17 O2H1u 0.660 1.460 2.722 18.750 1.460 12.842 [OK] 13726 4 d BCL CBB 9 C4H2b 0.770 1.880 2.980 34.549 1.880 18.377 [OK] 13727 4 d BCL N C 14 N4H3u 0.700 1.640 2.810 10.901 1.640 6.647 [OK] 13728 4 d BCL C1C 9 C4H2b 0.770 1.880 2.940 10.722 1.880 5.703 [OK] 13729 4 d BCL C2C 9 C4H2b 0.770 1.880 2.988 13.841 1.880 7.362 [OK] 13730 4 d BCL C3C 9 C4H2b 0.770 1.880 2.917 14.373 1.880 7.645 [OK] 13731 4 d BCL C4C 9 C4H2b 0.770 1.880 2.798 10.635 1.880 5.657 [OK] 13732 4 d BCL CMC 9 C4H2b 0.770 1.880 3.184 35.725 1.880 19.003 possible 13733 4 d BCL CAC 9 C4H2b 0.770 1.880 3.175 25.380 1.880 13.500 possible 13734 4 d BCL CBC 9 C4H2b 0.770 1.880 3.045 32.985 1.880 17.545 possible 13735 4 d BCL N D 14 N4H3u 0.700 1.640 2.587 10.686 1.640 6.516 [OK] 13736 4 d BCL C1D 9 C4H2b 0.770 1.880 2.515 9.927 1.880 5.280 [OK] 13737 4 d BCL C2D 9 C4H2b 0.770 1.880 2.506 10.424 1.880 5.545 [OK] 13738 4 d BCL C3D 9 C4H2b 0.770 1.880 2.667 11.045 1.880 5.875 [OK] 13739 4 d BCL C4D 9 C4H2b 0.770 1.880 2.717 10.826 1.880 5.758 [OK] 13740 4 d BCL CMD 9 C4H2b 0.770 1.880 2.987 34.903 1.880 18.565 [OK] 13741 4 d BCL CAD 9 C4H2b 0.770 1.880 2.557 9.849 1.880 5.239 [OK] 13742 4 d BCL OBD 17 O2H1u 0.660 1.460 2.448 17.793 1.460 12.187 [OK] 13743 4 d BCL CBD 9 C4H2b 0.770 1.880 3.054 17.003 1.880 9.044 possible 13744 4 d BCL CGD 9 C4H2b 0.770 1.880 2.775 8.990 1.880 4.782 [OK] 13745 4 d BCL O1D 17 O2H1u 0.660 1.460 3.240 26.019 1.460 17.821 possible 13746 4 d BCL O2D 17 O2H1u 0.660 1.460 6.090 32.973 1.460 22.584 possible 13747 4 d BCL CED 9 C4H2b 0.770 1.880 5.798 86.541 1.880 46.032 possible 13748 4 d BCL C1 9 C4H2b 0.770 1.880 3.224 22.386 1.880 11.907 possible 13749 4 d BCL C2 9 C4H2b 0.770 1.880 3.184 21.300 1.880 11.330 possible 13750 4 d BCL C3 9 C4H2b 0.770 1.880 2.521 10.501 1.880 5.586 [OK] 13751 4 d BCL C4 9 C4H2b 0.770 1.880 6.230 76.768 1.880 40.834 possible 13752 4 d BCL C5 9 C4H2b 0.770 1.880 2.946 22.309 1.880 11.867 [OK] 13753 4 d BCL C6 9 C4H2b 0.770 1.880 4.623 36.561 1.880 19.447 possible 13754 4 d BCL C7 9 C4H2b 0.770 1.880 2.971 22.274 1.880 11.848 [OK] 13755 4 d BCL C8 9 C4H2b 0.770 1.880 4.530 20.064 1.880 10.672 possible 13756 4 d BCL C9 9 C4H2b 0.770 1.880 35.190 -1.000 1.880 -1.000 bad 13757 4 d BCL C10 9 C4H2b 0.770 1.880 2.971 23.525 1.880 12.513 [OK] 13758 4 d BCL C11 9 C4H2b 0.770 1.880 9.348 -1.000 1.880 -1.000 bad 13759 4 d BCL C12 9 C4H2b 0.770 1.880 2.791 20.802 1.880 11.065 [OK] 13760 4 d BCL C13 9 C4H2b 0.770 1.880 4.528 16.926 1.880 9.003 possible 13761 4 d BCL C14 9 C4H2b 0.770 1.880 24.488 -1.000 1.880 -1.000 bad 13762 4 d BCL C15 9 C4H2b 0.770 1.880 3.061 22.126 1.880 11.769 possible 13763 4 d BCL C16 9 C4H2b 0.770 1.880 5.174 37.948 1.880 20.185 possible 13764 4 d BCL C17 9 C4H2b 0.770 1.880 3.267 24.997 1.880 13.296 possible 13765 4 d BCL C18 9 C4H2b 0.770 1.880 3.700 19.121 1.880 10.171 possible 13766 4 d BCL C19 9 C4H2b 0.770 1.880 4.234 44.114 1.880 23.465 possible 13767 4 d BCL C20 9 C4H2b 0.770 1.880 48.335 -1.000 1.880 -1.000 bad 13768 5 d BPH CHA 9 C4H2b 0.770 1.880 2.668 10.201 1.880 5.426 [OK] 13769 5 d BPH CHB 9 C4H2b 0.770 1.880 3.237 18.048 1.880 9.600 possible 13770 5 d BPH CHC 9 C4H2b 0.770 1.880 3.184 19.825 1.880 10.545 possible 13771 5 d BPH CHD 9 C4H2b 0.770 1.880 3.064 21.993 1.880 11.698 possible 13772 5 d BPH N A 14 N4H3u 0.700 1.640 2.929 17.448 1.640 10.639 [OK] 13773 5 d BPH C1A 9 C4H2b 0.770 1.880 3.154 11.842 1.880 6.299 possible 13774 5 d BPH C2A 9 C4H2b 0.770 1.880 3.585 14.186 1.880 7.546 possible 13775 5 d BPH C3A 9 C4H2b 0.770 1.880 3.106 14.360 1.880 7.638 possible 13776 5 d BPH C4A 9 C4H2b 0.770 1.880 2.854 11.578 1.880 6.159 [OK] 13777 5 d BPH CMA 9 C4H2b 0.770 1.880 6.986 104.509 1.880 55.590 possible 13778 5 d BPH CAA 9 C4H2b 0.770 1.880 2.990 21.799 1.880 11.595 [OK] 13779 5 d BPH CBA 9 C4H2b 0.770 1.880 4.949 34.750 1.880 18.484 possible 13780 5 d BPH CGA 9 C4H2b 0.770 1.880 2.795 10.859 1.880 5.776 [OK] 13781 5 d BPH O1A 17 O2H1u 0.660 1.460 2.573 19.507 1.460 13.361 [OK] 13782 5 d BPH O2A 17 O2H1u 0.660 1.460 3.922 19.880 1.460 13.617 possible 13783 5 d BPH N B 14 N4H3u 0.700 1.640 2.858 16.141 1.640 9.842 [OK] 13784 5 d BPH C1B 9 C4H2b 0.770 1.880 2.612 10.228 1.880 5.440 [OK] 13785 5 d BPH C2B 9 C4H2b 0.770 1.880 2.914 11.513 1.880 6.124 [OK] 13786 5 d BPH C3B 9 C4H2b 0.770 1.880 2.617 10.237 1.880 5.445 [OK] 13787 5 d BPH C4B 9 C4H2b 0.770 1.880 3.050 11.161 1.880 5.937 possible 13788 5 d BPH CMB 9 C4H2b 0.770 1.880 3.684 42.252 1.880 22.474 possible 13789 5 d BPH CAB 9 C4H2b 0.770 1.880 2.296 10.001 1.880 5.320 [OK] 13790 5 d BPH OBB 17 O2H1u 0.660 1.460 2.753 16.790 1.460 11.500 [OK] 13791 5 d BPH CBB 9 C4H2b 0.770 1.880 3.154 33.110 1.880 17.612 possible 13792 5 d BPH N C 14 N4H3u 0.700 1.640 2.818 14.763 1.640 9.002 [OK] 13793 5 d BPH C1C 9 C4H2b 0.770 1.880 2.921 12.045 1.880 6.407 [OK] 13794 5 d BPH C2C 9 C4H2b 0.770 1.880 2.974 14.896 1.880 7.924 [OK] 13795 5 d BPH C3C 9 C4H2b 0.770 1.880 2.746 13.831 1.880 7.357 [OK] 13796 5 d BPH C4C 9 C4H2b 0.770 1.880 2.365 10.033 1.880 5.337 [OK] 13797 5 d BPH CMC 9 C4H2b 0.770 1.880 3.004 35.845 1.880 19.067 possible 13798 5 d BPH CAC 9 C4H2b 0.770 1.880 3.030 21.782 1.880 11.586 possible 13799 5 d BPH CBC 9 C4H2b 0.770 1.880 3.222 41.083 1.880 21.853 possible 13800 5 d BPH N D 14 N4H3u 0.700 1.640 2.951 14.497 1.640 8.840 [OK] 13801 5 d BPH C1D 9 C4H2b 0.770 1.880 2.795 10.709 1.880 5.696 [OK] 13802 5 d BPH C2D 9 C4H2b 0.770 1.880 2.836 11.407 1.880 6.068 [OK] 13803 5 d BPH C3D 9 C4H2b 0.770 1.880 2.652 10.996 1.880 5.849 [OK] 13804 5 d BPH C4D 9 C4H2b 0.770 1.880 2.649 10.122 1.880 5.384 [OK] 13805 5 d BPH CMD 9 C4H2b 0.770 1.880 3.227 36.025 1.880 19.162 possible 13806 5 d BPH CAD 9 C4H2b 0.770 1.880 2.322 9.236 1.880 4.913 [OK] 13807 5 d BPH OBD 17 O2H1u 0.660 1.460 2.719 21.144 1.460 14.482 [OK] 13808 5 d BPH CBD 9 C4H2b 0.770 1.880 2.665 13.741 1.880 7.309 [OK] 13809 5 d BPH CGD 9 C4H2b 0.770 1.880 2.845 9.336 1.880 4.966 [OK] 13810 5 d BPH O1D 17 O2H1u 0.660 1.460 3.242 21.119 1.460 14.465 possible 13811 5 d BPH O2D 17 O2H1u 0.660 1.460 2.728 14.632 1.460 10.022 [OK] 13812 5 d BPH CED 9 C4H2b 0.770 1.880 4.172 60.509 1.880 32.185 possible 13813 5 d BPH C1 9 C4H2b 0.770 1.880 3.003 24.388 1.880 12.972 possible 13814 5 d BPH C2 9 C4H2b 0.770 1.880 4.140 27.775 1.880 14.774 possible 13815 5 d BPH C3 9 C4H2b 0.770 1.880 4.248 13.492 1.880 7.176 possible 13816 5 d BPH C4 9 C4H2b 0.770 1.880 4.348 41.417 1.880 22.030 possible 13817 5 d BPH C5 9 C4H2b 0.770 1.880 3.625 28.971 1.880 15.410 possible 13818 5 d BPH C6 9 C4H2b 0.770 1.880 23.918 -1.000 1.880 -1.000 bad 13819 5 d BPH C7 9 C4H2b 0.770 1.880 18.340 -1.000 1.880 -1.000 bad 13820 6 d BPH CHA 9 C4H2b 0.770 1.880 2.443 10.050 1.880 5.346 [OK] 13821 6 d BPH CHB 9 C4H2b 0.770 1.880 2.971 19.775 1.880 10.519 [OK] 13822 6 d BPH CHC 9 C4H2b 0.770 1.880 3.263 19.944 1.880 10.608 possible 13823 6 d BPH CHD 9 C4H2b 0.770 1.880 2.998 22.175 1.880 11.795 [OK] 13824 6 d BPH N A 14 N4H3u 0.700 1.640 2.900 16.014 1.640 9.765 [OK] 13825 6 d BPH C1A 9 C4H2b 0.770 1.880 2.950 11.285 1.880 6.003 [OK] 13826 6 d BPH C2A 9 C4H2b 0.770 1.880 2.643 13.035 1.880 6.934 [OK] 13827 6 d BPH C3A 9 C4H2b 0.770 1.880 2.682 12.885 1.880 6.854 [OK] 13828 6 d BPH C4A 9 C4H2b 0.770 1.880 2.819 11.445 1.880 6.088 [OK] 13829 6 d BPH CMA 9 C4H2b 0.770 1.880 3.134 40.009 1.880 21.281 possible 13830 6 d BPH CAA 9 C4H2b 0.770 1.880 2.721 20.814 1.880 11.071 [OK] 13831 6 d BPH CBA 9 C4H2b 0.770 1.880 3.207 25.398 1.880 13.510 possible 13832 6 d BPH CGA 9 C4H2b 0.770 1.880 2.677 10.599 1.880 5.638 [OK] 13833 6 d BPH O1A 17 O2H1u 0.660 1.460 2.410 18.435 1.460 12.627 [OK] 13834 6 d BPH O2A 17 O2H1u 0.660 1.460 3.093 16.044 1.460 10.989 possible 13835 6 d BPH N B 14 N4H3u 0.700 1.640 2.911 16.868 1.640 10.285 [OK] 13836 6 d BPH C1B 9 C4H2b 0.770 1.880 2.632 10.768 1.880 5.728 [OK] 13837 6 d BPH C2B 9 C4H2b 0.770 1.880 2.759 11.196 1.880 5.956 [OK] 13838 6 d BPH C3B 9 C4H2b 0.770 1.880 2.932 10.731 1.880 5.708 [OK] 13839 6 d BPH C4B 9 C4H2b 0.770 1.880 3.234 11.769 1.880 6.260 possible 13840 6 d BPH CMB 9 C4H2b 0.770 1.880 2.961 34.318 1.880 18.254 [OK] 13841 6 d BPH CAB 9 C4H2b 0.770 1.880 2.636 10.280 1.880 5.468 [OK] 13842 6 d BPH OBB 17 O2H1u 0.660 1.460 2.567 22.064 1.460 15.112 [OK] 13843 6 d BPH CBB 9 C4H2b 0.770 1.880 3.217 35.200 1.880 18.724 possible 13844 6 d BPH N C 14 N4H3u 0.700 1.640 2.765 14.280 1.640 8.707 [OK] 13845 6 d BPH C1C 9 C4H2b 0.770 1.880 2.762 10.845 1.880 5.769 [OK] 13846 6 d BPH C2C 9 C4H2b 0.770 1.880 3.042 15.128 1.880 8.047 possible 13847 6 d BPH C3C 9 C4H2b 0.770 1.880 2.820 14.332 1.880 7.623 [OK] 13848 6 d BPH C4C 9 C4H2b 0.770 1.880 2.523 10.293 1.880 5.475 [OK] 13849 6 d BPH CMC 9 C4H2b 0.770 1.880 3.207 37.732 1.880 20.070 possible 13850 6 d BPH CAC 9 C4H2b 0.770 1.880 2.909 22.710 1.880 12.080 [OK] 13851 6 d BPH CBC 9 C4H2b 0.770 1.880 2.991 36.200 1.880 19.255 [OK] 13852 6 d BPH N D 14 N4H3u 0.700 1.640 2.832 13.883 1.640 8.465 [OK] 13853 6 d BPH C1D 9 C4H2b 0.770 1.880 2.777 11.313 1.880 6.018 [OK] 13854 6 d BPH C2D 9 C4H2b 0.770 1.880 2.810 11.063 1.880 5.885 [OK] 13855 6 d BPH C3D 9 C4H2b 0.770 1.880 2.662 11.707 1.880 6.227 [OK] 13856 6 d BPH C4D 9 C4H2b 0.770 1.880 2.662 9.677 1.880 5.147 [OK] 13857 6 d BPH CMD 9 C4H2b 0.770 1.880 3.179 37.714 1.880 20.061 possible 13858 6 d BPH CAD 9 C4H2b 0.770 1.880 2.612 10.195 1.880 5.423 [OK] 13859 6 d BPH OBD 17 O2H1u 0.660 1.460 2.527 18.895 1.460 12.942 [OK] 13860 6 d BPH CBD 9 C4H2b 0.770 1.880 2.778 14.669 1.880 7.803 [OK] 13861 6 d BPH CGD 9 C4H2b 0.770 1.880 2.423 8.999 1.880 4.787 [OK] 13862 6 d BPH O1D 17 O2H1u 0.660 1.460 2.585 19.220 1.460 13.164 [OK] 13863 6 d BPH O2D 17 O2H1u 0.660 1.460 2.586 13.034 1.460 8.927 [OK] 13864 6 d BPH CED 9 C4H2b 0.770 1.880 3.134 38.985 1.880 20.737 possible 13865 6 d BPH C1 9 C4H2b 0.770 1.880 2.915 25.627 1.880 13.632 [OK] 13866 6 d BPH C2 9 C4H2b 0.770 1.880 2.937 21.698 1.880 11.541 [OK] 13867 6 d BPH C3 9 C4H2b 0.770 1.880 2.970 12.179 1.880 6.478 [OK] 13868 6 d BPH C4 9 C4H2b 0.770 1.880 6.889 105.028 1.880 55.866 possible 13869 6 d BPH C5 9 C4H2b 0.770 1.880 3.803 30.363 1.880 16.150 possible 13870 6 d BPH C6 9 C4H2b 0.770 1.880 3.037 22.853 1.880 12.156 possible 13871 6 d BPH C7 9 C4H2b 0.770 1.880 2.821 22.564 1.880 12.002 [OK] 13872 6 d BPH C8 9 C4H2b 0.770 1.880 3.026 14.077 1.880 7.488 possible 13873 6 d BPH C9 9 C4H2b 0.770 1.880 2.954 36.009 1.880 19.154 [OK] 13874 6 d BPH C10 9 C4H2b 0.770 1.880 2.995 25.719 1.880 13.680 [OK] 13875 6 d BPH C11 9 C4H2b 0.770 1.880 2.906 23.880 1.880 12.702 [OK] 13876 6 d BPH C12 9 C4H2b 0.770 1.880 3.248 26.872 1.880 14.294 possible 13877 6 d BPH C13 9 C4H2b 0.770 1.880 2.739 14.105 1.880 7.503 [OK] 13878 6 d BPH C14 9 C4H2b 0.770 1.880 3.094 38.064 1.880 20.247 possible 13879 6 d BPH C15 9 C4H2b 0.770 1.880 2.992 22.675 1.880 12.061 [OK] 13880 6 d BPH C16 9 C4H2b 0.770 1.880 4.108 26.475 1.880 14.082 possible 13881 6 d BPH C17 9 C4H2b 0.770 1.880 4.827 36.984 1.880 19.673 possible 13882 6 d BPH C18 9 C4H2b 0.770 1.880 2.789 13.530 1.880 7.197 [OK] 13883 6 d BPH C19 9 C4H2b 0.770 1.880 2.858 33.998 1.880 18.084 [OK] 13884 6 d BPH C20 9 C4H2b 0.770 1.880 3.244 37.171 1.880 19.772 possible 13885 7 d FE2 FE d 25 DEFAULT 0.770 1.800 2.348 13.875 1.800 7.709 [OK] 13886 8 d U10 C1 9 C4H2b 0.770 1.880 2.429 10.056 1.880 5.349 [OK] 13887 8 d U10 C2 9 C4H2b 0.770 1.880 2.434 9.878 1.880 5.254 [OK] 13888 8 d U10 C3 9 C4H2b 0.770 1.880 2.765 10.982 1.880 5.841 [OK] 13889 8 d U10 C4 9 C4H2b 0.770 1.880 2.678 11.394 1.880 6.061 [OK] 13890 8 d U10 C5 9 C4H2b 0.770 1.880 2.537 9.462 1.880 5.033 [OK] 13891 8 d U10 C6 9 C4H2b 0.770 1.880 2.466 9.818 1.880 5.222 [OK] 13892 8 d U10 C1M 9 C4H2b 0.770 1.880 2.803 30.782 1.880 16.374 [OK] 13893 8 d U10 C3M 9 C4H2b 0.770 1.880 3.192 35.430 1.880 18.846 possible 13894 8 d U10 C4M 9 C4H2b 0.770 1.880 3.413 38.585 1.880 20.524 possible 13895 8 d U10 C7 9 C4H2b 0.770 1.880 2.777 19.848 1.880 10.558 [OK] 13896 8 d U10 C8 9 C4H2b 0.770 1.880 2.558 17.707 1.880 9.419 [OK] 13897 8 d U10 C9 9 C4H2b 0.770 1.880 2.648 11.390 1.880 6.058 [OK] 13898 8 d U10 C10 9 C4H2b 0.770 1.880 2.806 32.714 1.880 17.401 [OK] 13899 8 d U10 C11 9 C4H2b 0.770 1.880 2.814 21.775 1.880 11.583 [OK] 13900 8 d U10 C12 9 C4H2b 0.770 1.880 3.182 22.812 1.880 12.134 possible 13901 8 d U10 C13 9 C4H2b 0.770 1.880 3.029 21.962 1.880 11.682 possible 13902 8 d U10 C14 9 C4H2b 0.770 1.880 3.009 11.922 1.880 6.341 possible 13903 8 d U10 C15 9 C4H2b 0.770 1.880 5.071 55.963 1.880 29.767 possible 13904 8 d U10 C16 9 C4H2b 0.770 1.880 3.069 26.267 1.880 13.972 possible 13905 8 d U10 C17 9 C4H2b 0.770 1.880 4.097 26.537 1.880 14.115 possible 13906 8 d U10 C18 9 C4H2b 0.770 1.880 3.134 23.982 1.880 12.757 possible 13907 8 d U10 C19 9 C4H2b 0.770 1.880 3.522 13.611 1.880 7.240 possible 13908 8 d U10 C20 9 C4H2b 0.770 1.880 39.798 -1.000 1.880 -1.000 bad 13909 8 d U10 C21 9 C4H2b 0.770 1.880 12.421 -1.000 1.880 -1.000 bad 13910 8 d U10 C22 9 C4H2b 0.770 1.880 2.797 22.674 1.880 12.060 [OK] 13911 8 d U10 C23 9 C4H2b 0.770 1.880 12.715 -1.000 1.880 -1.000 bad 13912 8 d U10 C24 9 C4H2b 0.770 1.880 5.625 56.104 1.880 29.843 possible 13913 8 d U10 C25 9 C4H2b 0.770 1.880 3.740 42.600 1.880 22.659 possible 13914 8 d U10 O2 17 O2H1u 0.660 1.460 2.412 14.951 1.460 10.241 [OK] 13915 8 d U10 O3 17 O2H1u 0.660 1.460 2.638 12.562 1.460 8.604 [OK] 13916 8 d U10 O4 17 O2H1u 0.660 1.460 2.356 13.152 1.460 9.008 [OK] 13917 8 d U10 O5 17 O2H1u 0.660 1.460 2.424 15.388 1.460 10.539 [OK] 13918 9 d U10 C1 9 C4H2b 0.770 1.880 2.954 12.542 1.880 6.671 [OK] 13919 9 d U10 C2 9 C4H2b 0.770 1.880 2.809 9.961 1.880 5.299 [OK] 13920 9 d U10 C3 9 C4H2b 0.770 1.880 2.789 10.204 1.880 5.428 [OK] 13921 9 d U10 C4 9 C4H2b 0.770 1.880 2.853 10.954 1.880 5.827 [OK] 13922 9 d U10 C5 9 C4H2b 0.770 1.880 2.848 10.737 1.880 5.711 [OK] 13923 9 d U10 C6 9 C4H2b 0.770 1.880 2.841 11.290 1.880 6.005 [OK] 13924 9 d U10 C1M 9 C4H2b 0.770 1.880 7.337 95.926 1.880 51.025 possible 13925 9 d U10 C3M 9 C4H2b 0.770 1.880 3.301 33.238 1.880 17.680 possible 13926 9 d U10 C4M 9 C4H2b 0.770 1.880 2.844 32.567 1.880 17.323 [OK] 13927 9 d U10 C7 9 C4H2b 0.770 1.880 3.730 26.634 1.880 14.167 possible 13928 9 d U10 C8 9 C4H2b 0.770 1.880 3.199 20.423 1.880 10.863 possible 13929 9 d U10 C9 9 C4H2b 0.770 1.880 4.203 15.191 1.880 8.080 possible 13930 9 d U10 C10 9 C4H2b 0.770 1.880 6.053 72.180 1.880 38.394 possible 13931 9 d U10 C11 9 C4H2b 0.770 1.880 22.816 -1.000 1.880 -1.000 bad 13932 9 d U10 O2 17 O2H1u 0.660 1.460 2.660 17.611 1.460 12.062 [OK] 13933 9 d U10 O3 17 O2H1u 0.660 1.460 2.402 12.984 1.460 8.893 [OK] 13934 9 d U10 O4 17 O2H1u 0.660 1.460 2.390 12.319 1.460 8.438 [OK] 13935 9 d U10 O5 17 O2H1u 0.660 1.460 2.407 17.793 1.460 12.187 [OK] 13936 1 . HOH O 18 O2H2u 0.660 1.460 2.470 22.604 1.460 15.482 [OK] 13937 2 . HOH O 18 O2H2u 0.660 1.460 2.463 28.255 1.460 19.353 [OK] 13938 3 . HOH O 18 O2H2u 0.660 1.460 2.413 23.737 1.460 16.258 [OK] 13939 4 . HOH O 18 O2H2u 0.660 1.460 2.686 31.620 1.460 21.658 [OK] 13940 5 . HOH O 18 O2H2u 0.660 1.460 2.420 24.940 1.460 17.082 [OK] 13941 6 . HOH O 18 O2H2u 0.660 1.460 3.055 30.230 1.460 20.705 possible 13942 7 . HOH O 18 O2H2u 0.660 1.460 2.726 26.122 1.460 17.892 [OK] 13943 8 . HOH O 18 O2H2u 0.660 1.460 2.390 23.222 1.460 15.906 [OK] 13944 9 . HOH O 18 O2H2u 0.660 1.460 2.616 22.593 1.460 15.475 [OK] 13945 10 . HOH O 18 O2H2u 0.660 1.460 5.398 46.817 1.460 32.066 possible 13946 11 . HOH O 18 O2H2u 0.660 1.460 2.928 25.899 1.460 17.739 [OK] 13947 12 . HOH O 18 O2H2u 0.660 1.460 32.283 -1.000 1.460 -1.000 bad 13948 13 . HOH O 18 O2H2u 0.660 1.460 40.116 -1.000 1.460 -1.000 bad 13949 14 . HOH O 18 O2H2u 0.660 1.460 3.265 27.711 1.460 18.980 possible 13950 15 . HOH O 18 O2H2u 0.660 1.460 4.168 44.323 1.460 30.358 possible 13951 16 . HOH O 18 O2H2u 0.660 1.460 2.533 24.244 1.460 16.606 [OK] 13952 17 . HOH O 18 O2H2u 0.660 1.460 2.995 23.724 1.460 16.249 [OK] 13953 18 . HOH O 18 O2H2u 0.660 1.460 2.445 24.124 1.460 16.523 [OK] 13954 19 . HOH O 18 O2H2u 0.660 1.460 2.834 25.267 1.460 17.306 [OK] 13955 20 . HOH O 18 O2H2u 0.660 1.460 9.865 -1.000 1.460 -1.000 bad 13956 21 . HOH O 18 O2H2u 0.660 1.460 3.165 34.136 1.460 23.381 possible 13957 22 . HOH O 18 O2H2u 0.660 1.460 4.812 64.400 1.460 44.109 possible 13958 23 . HOH O 18 O2H2u 0.660 1.460 2.445 23.028 1.460 15.773 [OK] 13959 24 . HOH O 18 O2H2u 0.660 1.460 5.059 53.962 1.460 36.960 possible 13960 25 . HOH O 18 O2H2u 0.660 1.460 24.345 -1.000 1.460 -1.000 bad 13961 26 . HOH O 18 O2H2u 0.660 1.460 22.099 -1.000 1.460 -1.000 bad 13962 27 . HOH O 18 O2H2u 0.660 1.460 41.538 -1.000 1.460 -1.000 bad 13963 28 . HOH O 18 O2H2u 0.660 1.460 2.777 24.193 1.460 16.570 [OK] 13964 29 . HOH O 18 O2H2u 0.660 1.460 2.549 23.609 1.460 16.170 [OK] 13965 30 . HOH O 18 O2H2u 0.660 1.460 2.540 24.098 1.460 16.506 [OK] 13966 31 . HOH O 18 O2H2u 0.660 1.460 2.730 24.032 1.460 16.460 [OK] 13967 32 . HOH O 18 O2H2u 0.660 1.460 6.148 66.671 1.460 45.665 possible 13968 33 . HOH O 18 O2H2u 0.660 1.460 2.952 34.419 1.460 23.574 [OK] 13969 34 . HOH O 18 O2H2u 0.660 1.460 2.543 22.047 1.460 15.101 [OK] 13970 35 . HOH O 18 O2H2u 0.660 1.460 2.604 21.518 1.460 14.739 [OK] 13971 36 . HOH O 18 O2H2u 0.660 1.460 20.004 -1.000 1.460 -1.000 bad 13972 37 . HOH O 18 O2H2u 0.660 1.460 5.078 42.721 1.460 29.261 possible 13973 38 . HOH O 18 O2H2u 0.660 1.460 6.329 48.809 1.460 33.431 possible 13974 39 . HOH O 18 O2H2u 0.660 1.460 2.425 24.532 1.460 16.803 [OK] 13975 40 . HOH O 18 O2H2u 0.660 1.460 2.481 24.676 1.460 16.901 [OK] 13976 41 . HOH O 18 O2H2u 0.660 1.460 2.855 27.783 1.460 19.029 [OK] 13977 42 . HOH O 18 O2H2u 0.660 1.460 2.811 26.299 1.460 18.013 [OK] 13978 43 . HOH O 18 O2H2u 0.660 1.460 2.916 33.925 1.460 23.236 [OK] 13979 44 . HOH O 18 O2H2u 0.660 1.460 2.532 24.212 1.460 16.583 [OK] 13980 45 . HOH O 18 O2H2u 0.660 1.460 2.992 24.519 1.460 16.794 [OK] 13981 46 . HOH O 18 O2H2u 0.660 1.460 2.535 23.058 1.460 15.793 [OK] 13982 47 . HOH O 18 O2H2u 0.660 1.460 36.425 -1.000 1.460 -1.000 bad 13983 48 . HOH O 18 O2H2u 0.660 1.460 2.688 26.886 1.460 18.415 [OK] 13984 49 . HOH O 18 O2H2u 0.660 1.460 4.257 49.676 1.460 34.024 possible 13985 50 . HOH O 18 O2H2u 0.660 1.460 20.696 -1.000 1.460 -1.000 bad 13986 51 . HOH O 18 O2H2u 0.660 1.460 3.838 28.695 1.460 19.654 possible 13987 52 . HOH O 18 O2H2u 0.660 1.460 23.021 -1.000 1.460 -1.000 bad 13988 53 . HOH O 18 O2H2u 0.660 1.460 7.015 49.752 1.460 34.077 possible 13989 54 . HOH O 18 O2H2u 0.660 1.460 17.581 -1.000 1.460 -1.000 bad 13990 55 . HOH O 18 O2H2u 0.660 1.460 3.165 29.396 1.460 20.134 possible 13991 56 . HOH O 18 O2H2u 0.660 1.460 2.563 24.746 1.460 16.950 [OK] 13992 57 . HOH O 18 O2H2u 0.660 1.460 2.508 23.846 1.460 16.333 [OK] 13993 58 . HOH O 18 O2H2u 0.660 1.460 2.423 21.859 1.460 14.972 [OK] 13994 59 . HOH O 18 O2H2u 0.660 1.460 2.502 22.758 1.460 15.588 [OK] 13995 60 . HOH O 18 O2H2u 0.660 1.460 2.558 23.659 1.460 16.205 [OK] 13996 61 . HOH O 18 O2H2u 0.660 1.460 2.762 23.627 1.460 16.183 [OK] 13997 62 . HOH O 18 O2H2u 0.660 1.460 3.602 32.695 1.460 22.394 possible 13998 63 . HOH O 18 O2H2u 0.660 1.460 2.449 23.789 1.460 16.294 [OK] 13999 64 . HOH O 18 O2H2u 0.660 1.460 2.717 24.005 1.460 16.442 [OK] 14000 65 . HOH O 18 O2H2u 0.660 1.460 2.669 23.617 1.460 16.176 [OK] 14001 66 . HOH O 18 O2H2u 0.660 1.460 3.744 32.397 1.460 22.190 possible 14002 67 . HOH O 18 O2H2u 0.660 1.460 3.199 35.437 1.460 24.272 possible 14003 68 . HOH O 18 O2H2u 0.660 1.460 5.893 64.803 1.460 44.385 possible 14004 69 . HOH O 18 O2H2u 0.660 1.460 3.678 37.359 1.460 25.588 possible 14005 70 . HOH O 18 O2H2u 0.660 1.460 3.237 29.084 1.460 19.920 possible 14006 71 . HOH O 18 O2H2u 0.660 1.460 2.441 24.728 1.460 16.937 [OK] 14007 72 . HOH O 18 O2H2u 0.660 1.460 5.201 51.121 1.460 35.014 possible 14008 73 . HOH O 18 O2H2u 0.660 1.460 26.129 -1.000 1.460 -1.000 bad 14009 74 . HOH O 18 O2H2u 0.660 1.460 30.603 -1.000 1.460 -1.000 bad 14010 75 . HOH O 18 O2H2u 0.660 1.460 5.436 32.668 1.460 22.375 possible 14011 76 . HOH O 18 O2H2u 0.660 1.460 36.382 -1.000 1.460 -1.000 bad 14012 77 . HOH O 18 O2H2u 0.660 1.460 2.486 21.970 1.460 15.048 [OK] 14013 78 . HOH O 18 O2H2u 0.660 1.460 2.411 25.667 1.460 17.580 [OK] 14014 79 . HOH O 18 O2H2u 0.660 1.460 2.500 21.198 1.460 14.519 [OK] 14015 80 . HOH O 18 O2H2u 0.660 1.460 3.917 34.680 1.460 23.754 possible 14016 81 . HOH O 18 O2H2u 0.660 1.460 61.220 -1.000 1.460 -1.000 bad 14017 82 . HOH O 18 O2H2u 0.660 1.460 2.629 27.345 1.460 18.729 [OK] 14018 83 . HOH O 18 O2H2u 0.660 1.460 5.102 37.345 1.460 25.579 possible 14019 84 . HOH O 18 O2H2u 0.660 1.460 2.377 23.001 1.460 15.754 [OK] 14020 85 . HOH O 18 O2H2u 0.660 1.460 2.741 27.682 1.460 18.960 [OK] 14021 86 . HOH O 18 O2H2u 0.660 1.460 2.603 24.907 1.460 17.059 [OK] 14022 87 . HOH O 18 O2H2u 0.660 1.460 2.661 23.805 1.460 16.305 [OK] 14023 88 . HOH O 18 O2H2u 0.660 1.460 2.456 24.619 1.460 16.862 [OK] 14024 89 . HOH O 18 O2H2u 0.660 1.460 3.928 43.882 1.460 30.056 possible 14025 90 . HOH O 18 O2H2u 0.660 1.460 5.422 34.022 1.460 23.303 possible 14026 91 . HOH O 18 O2H2u 0.660 1.460 37.403 -1.000 1.460 -1.000 bad 14027 92 . HOH O 18 O2H2u 0.660 1.460 23.741 -1.000 1.460 -1.000 bad 14028 93 . HOH O 18 O2H2u 0.660 1.460 4.922 35.979 1.460 24.643 possible 14029 94 . HOH O 18 O2H2u 0.660 1.460 27.404 -1.000 1.460 -1.000 bad 14030 95 . HOH O 18 O2H2u 0.660 1.460 2.939 26.632 1.460 18.241 [OK] 14031 96 . HOH O 18 O2H2u 0.660 1.460 2.968 24.999 1.460 17.123 [OK] 14032 97 . HOH O 18 O2H2u 0.660 1.460 2.449 24.722 1.460 16.933 [OK] 14033 98 . HOH O 18 O2H2u 0.660 1.460 2.854 35.074 1.460 24.023 [OK] 14034 99 . HOH O 18 O2H2u 0.660 1.460 3.877 43.172 1.460 29.570 possible 14035 100 . HOH O 18 O2H2u 0.660 1.460 28.136 -1.000 1.460 -1.000 bad 14036 101 . HOH O 18 O2H2u 0.660 1.460 5.264 33.681 1.460 23.069 possible 14037 102 . HOH O 18 O2H2u 0.660 1.460 2.611 22.851 1.460 15.651 [OK] 14038 103 . HOH O 18 O2H2u 0.660 1.460 3.541 32.727 1.460 22.416 possible 14039 104 . HOH O 18 O2H2u 0.660 1.460 3.207 27.925 1.460 19.127 possible 14040 105 . HOH O 18 O2H2u 0.660 1.460 2.818 27.132 1.460 18.583 [OK] 14041 106 . HOH O 18 O2H2u 0.660 1.460 5.829 48.691 1.460 33.350 possible 14042 107 . HOH O 18 O2H2u 0.660 1.460 22.699 -1.000 1.460 -1.000 bad 14043 108 . HOH O 18 O2H2u 0.660 1.460 7.084 86.512 1.460 59.255 possible 14044 109 . HOH O 18 O2H2u 0.660 1.460 25.887 -1.000 1.460 -1.000 bad 14045 110 . HOH O 18 O2H2u 0.660 1.460 6.515 54.884 1.460 37.592 possible 14046 111 . HOH O 18 O2H2u 0.660 1.460 57.125 -1.000 1.460 -1.000 bad 14047 112 . HOH O 18 O2H2u 0.660 1.460 25.062 -1.000 1.460 -1.000 bad 14048 113 . HOH O 18 O2H2u 0.660 1.460 30.451 -1.000 1.460 -1.000 bad 14049 114 . HOH O 18 O2H2u 0.660 1.460 2.456 22.493 1.460 15.406 [OK] 14050 115 . HOH O 18 O2H2u 0.660 1.460 3.805 36.586 1.460 25.059 possible 14051 116 . HOH O 18 O2H2u 0.660 1.460 4.290 43.785 1.460 29.990 possible 14052 117 . HOH O 18 O2H2u 0.660 1.460 2.429 21.699 1.460 14.862 [OK] 14053 118 . HOH O 18 O2H2u 0.660 1.460 2.429 24.290 1.460 16.637 [OK] 14054 119 . HOH O 18 O2H2u 0.660 1.460 2.620 26.357 1.460 18.053 [OK] 14055 120 . HOH O 18 O2H2u 0.660 1.460 2.725 23.651 1.460 16.199 [OK] 14056 121 . HOH O 18 O2H2u 0.660 1.460 2.469 23.398 1.460 16.026 [OK] 14057 122 . HOH O 18 O2H2u 0.660 1.460 2.795 23.622 1.460 16.179 [OK] 14058 123 . HOH O 18 O2H2u 0.660 1.460 5.064 35.277 1.460 24.162 possible 14059 124 . HOH O 18 O2H2u 0.660 1.460 34.229 -1.000 1.460 -1.000 bad 14060 125 . HOH O 18 O2H2u 0.660 1.460 2.766 23.993 1.460 16.433 [OK] 14061 126 . HOH O 18 O2H2u 0.660 1.460 3.745 29.461 1.460 20.179 possible 14062 127 . HOH O 18 O2H2u 0.660 1.460 2.507 22.135 1.460 15.161 [OK] 14063 128 . HOH O 18 O2H2u 0.660 1.460 3.051 28.531 1.460 19.542 possible 14064 129 . HOH O 18 O2H2u 0.660 1.460 2.639 26.014 1.460 17.818 [OK] 14065 130 . HOH O 18 O2H2u 0.660 1.460 2.369 21.468 1.460 14.704 [OK] 14066 131 . HOH O 18 O2H2u 0.660 1.460 13.806 -1.000 1.460 -1.000 bad 14067 132 . HOH O 18 O2H2u 0.660 1.460 11.767 -1.000 1.460 -1.000 bad 14068 133 . HOH O 18 O2H2u 0.660 1.460 2.579 22.087 1.460 15.128 [OK] 14069 134 . HOH O 18 O2H2u 0.660 1.460 23.821 -1.000 1.460 -1.000 bad 14070 135 . HOH O 18 O2H2u 0.660 1.460 2.774 26.953 1.460 18.461 [OK] 14071 136 . HOH O 18 O2H2u 0.660 1.460 2.992 28.230 1.460 19.336 [OK] 14072 137 . HOH O 18 O2H2u 0.660 1.460 2.948 27.402 1.460 18.768 [OK] 14073 138 . HOH O 18 O2H2u 0.660 1.460 4.798 38.908 1.460 26.650 possible 14074 139 . HOH O 18 O2H2u 0.660 1.460 23.861 -1.000 1.460 -1.000 bad 14075 140 . HOH O 18 O2H2u 0.660 1.460 57.138 -1.000 1.460 -1.000 bad 14076 141 . HOH O 18 O2H2u 0.660 1.460 3.412 26.312 1.460 18.022 possible 14077 142 . HOH O 18 O2H2u 0.660 1.460 3.944 29.941 1.460 20.508 possible 14078 143 . HOH O 18 O2H2u 0.660 1.460 5.048 46.777 1.460 32.039 possible 14079 144 . HOH O 18 O2H2u 0.660 1.460 2.904 26.981 1.460 18.480 [OK] 14080 145 . HOH O 18 O2H2u 0.660 1.460 2.452 24.106 1.460 16.511 [OK] 14081 146 . HOH O 18 O2H2u 0.660 1.460 46.992 -1.000 1.460 -1.000 bad 14082 147 . HOH O 18 O2H2u 0.660 1.460 42.570 -1.000 1.460 -1.000 bad 14083 148 . HOH O 18 O2H2u 0.660 1.460 24.902 -1.000 1.460 -1.000 bad 14084 149 . HOH O 18 O2H2u 0.660 1.460 30.663 -1.000 1.460 -1.000 bad 14085 150 . HOH O 18 O2H2u 0.660 1.460 44.590 -1.000 1.460 -1.000 bad 14086 151 . HOH O 18 O2H2u 0.660 1.460 16.124 -1.000 1.460 -1.000 bad 14087 152 . HOH O 18 O2H2u 0.660 1.460 2.632 26.495 1.460 18.147 [OK] 14088 153 . HOH O 18 O2H2u 0.660 1.460 3.477 36.352 1.460 24.899 possible 14089 154 . HOH O 18 O2H2u 0.660 1.460 27.409 -1.000 1.460 -1.000 bad 14090 155 . HOH O 18 O2H2u 0.660 1.460 17.727 -1.000 1.460 -1.000 bad 14091 156 . HOH O 18 O2H2u 0.660 1.460 10.261 -1.000 1.460 -1.000 bad 14092 157 . HOH O 18 O2H2u 0.660 1.460 2.792 27.433 1.460 18.790 [OK] 14093 158 . HOH O 18 O2H2u 0.660 1.460 2.468 27.377 1.460 18.751 [OK] 14094 159 . HOH O 18 O2H2u 0.660 1.460 2.831 24.112 1.460 16.515 [OK] 14095 160 . HOH O 18 O2H2u 0.660 1.460 4.213 38.830 1.460 26.596 possible 14096 161 . HOH O 18 O2H2u 0.660 1.460 3.622 34.935 1.460 23.928 possible 14097 162 . HOH O 18 O2H2u 0.660 1.460 2.635 25.368 1.460 17.375 [OK] 14098 163 . HOH O 18 O2H2u 0.660 1.460 3.046 37.234 1.460 25.503 possible 14099 164 . HOH O 18 O2H2u 0.660 1.460 2.599 24.026 1.460 16.456 [OK] 14100 165 . HOH O 18 O2H2u 0.660 1.460 3.124 34.536 1.460 23.655 possible 14101 166 . HOH O 18 O2H2u 0.660 1.460 5.611 54.428 1.460 37.280 possible 14102 167 . HOH O 18 O2H2u 0.660 1.460 22.407 -1.000 1.460 -1.000 bad 14103 168 . HOH O 18 O2H2u 0.660 1.460 4.072 48.578 1.460 33.273 possible 14104 169 . HOH O 18 O2H2u 0.660 1.460 5.170 68.340 1.460 46.808 possible 14105 170 . HOH O 18 O2H2u 0.660 1.460 30.480 -1.000 1.460 -1.000 bad 14106 171 . HOH O 18 O2H2u 0.660 1.460 4.953 37.562 1.460 25.728 possible 14107 172 . HOH O 18 O2H2u 0.660 1.460 7.418 65.904 1.460 45.140 possible 14108 173 . HOH O 18 O2H2u 0.660 1.460 46.323 -1.000 1.460 -1.000 bad 14109 174 . HOH O 18 O2H2u 0.660 1.460 2.809 25.021 1.460 17.138 [OK] 14110 175 . HOH O 18 O2H2u 0.660 1.460 2.599 25.145 1.460 17.223 [OK] 14111 176 . HOH O 18 O2H2u 0.660 1.460 2.488 24.927 1.460 17.073 [OK] 14112 177 . HOH O 18 O2H2u 0.660 1.460 2.918 23.710 1.460 16.240 [OK] 14113 178 . HOH O 18 O2H2u 0.660 1.460 26.751 -1.000 1.460 -1.000 bad 14114 179 . HOH O 18 O2H2u 0.660 1.460 34.220 -1.000 1.460 -1.000 bad 14115 180 . HOH O 18 O2H2u 0.660 1.460 3.213 24.643 1.460 16.879 possible 14116 181 . HOH O 18 O2H2u 0.660 1.460 2.441 25.141 1.460 17.220 [OK] 14117 182 . HOH O 18 O2H2u 0.660 1.460 27.793 -1.000 1.460 -1.000 bad 14118 183 . HOH O 18 O2H2u 0.660 1.460 18.693 -1.000 1.460 -1.000 bad 14119 184 . HOH O 18 O2H2u 0.660 1.460 24.688 -1.000 1.460 -1.000 bad 14120 185 . HOH O 18 O2H2u 0.660 1.460 38.351 -1.000 1.460 -1.000 bad 14121 186 . HOH O 18 O2H2u 0.660 1.460 3.159 27.655 1.460 18.942 possible 14122 187 . HOH O 18 O2H2u 0.660 1.460 2.716 28.030 1.460 19.199 [OK] 14123 188 . HOH O 18 O2H2u 0.660 1.460 2.687 26.017 1.460 17.820 [OK] 14124 189 . HOH O 18 O2H2u 0.660 1.460 3.025 38.250 1.460 26.199 possible 14125 190 . HOH O 18 O2H2u 0.660 1.460 2.518 23.378 1.460 16.012 [OK] 14126 191 . HOH O 18 O2H2u 0.660 1.460 2.708 25.514 1.460 17.475 [OK] 14127 192 . HOH O 18 O2H2u 0.660 1.460 2.387 23.939 1.460 16.396 [OK] 14128 193 . HOH O 18 O2H2u 0.660 1.460 2.853 34.270 1.460 23.473 [OK] 14129 194 . HOH O 18 O2H2u 0.660 1.460 2.606 24.218 1.460 16.588 [OK] 14130 195 . HOH O 18 O2H2u 0.660 1.460 2.894 29.308 1.460 20.074 [OK] 14131 196 . HOH O 18 O2H2u 0.660 1.460 2.851 24.219 1.460 16.588 [OK] 14132 197 . HOH O 18 O2H2u 0.660 1.460 2.929 30.763 1.460 21.070 [OK] 14133 198 . HOH O 18 O2H2u 0.660 1.460 2.680 25.547 1.460 17.498 [OK] 14134 199 . HOH O 18 O2H2u 0.660 1.460 2.371 22.012 1.460 15.077 [OK] 14135 200 . HOH O 18 O2H2u 0.660 1.460 2.830 29.112 1.460 19.940 [OK] 14136 201 . HOH O 18 O2H2u 0.660 1.460 2.817 26.463 1.460 18.125 [OK] 14137 202 . HOH O 18 O2H2u 0.660 1.460 2.529 26.447 1.460 18.114 [OK] 14138 203 . HOH O 18 O2H2u 0.660 1.460 2.911 23.411 1.460 16.035 [OK] 14139 204 . HOH O 18 O2H2u 0.660 1.460 3.337 33.668 1.460 23.060 possible 14140 205 . HOH O 18 O2H2u 0.660 1.460 3.305 33.717 1.460 23.094 possible 14141 206 . HOH O 18 O2H2u 0.660 1.460 2.919 30.522 1.460 20.906 [OK] 14142 207 . HOH O 18 O2H2u 0.660 1.460 3.306 35.659 1.460 24.424 possible 14143 208 . HOH O 18 O2H2u 0.660 1.460 2.980 28.494 1.460 19.516 [OK] 14144 209 . HOH O 18 O2H2u 0.660 1.460 4.321 34.212 1.460 23.433 possible 14145 210 . HOH O 18 O2H2u 0.660 1.460 7.267 98.645 1.460 67.565 possible 14146 211 . HOH O 18 O2H2u 0.660 1.460 2.613 23.055 1.460 15.791 [OK] 14147 212 . HOH O 18 O2H2u 0.660 1.460 3.146 32.073 1.460 21.968 possible 14148 213 . HOH O 18 O2H2u 0.660 1.460 11.955 -1.000 1.460 -1.000 bad 14149 214 . HOH O 18 O2H2u 0.660 1.460 20.638 -1.000 1.460 -1.000 bad 14150 215 . HOH O 18 O2H2u 0.660 1.460 32.547 -1.000 1.460 -1.000 bad 14151 216 . HOH O 18 O2H2u 0.660 1.460 26.179 -1.000 1.460 -1.000 bad 14152 217 . HOH O 18 O2H2u 0.660 1.460 2.513 22.965 1.460 15.730 [OK] 14153 218 . HOH O 18 O2H2u 0.660 1.460 2.674 24.093 1.460 16.502 [OK] 14154 219 . HOH O 18 O2H2u 0.660 1.460 2.725 28.775 1.460 19.709 [OK] 14155 220 . HOH O 18 O2H2u 0.660 1.460 2.840 32.303 1.460 22.125 [OK] 14156 221 . HOH O 18 O2H2u 0.660 1.460 2.645 31.667 1.460 21.689 [OK] 14157 222 . HOH O 18 O2H2u 0.660 1.460 2.503 24.751 1.460 16.953 [OK] 14158 223 . HOH O 18 O2H2u 0.660 1.460 2.763 25.686 1.460 17.593 [OK] 14159 224 . HOH O 18 O2H2u 0.660 1.460 2.602 29.529 1.460 20.225 [OK] 14160 225 . HOH O 18 O2H2u 0.660 1.460 2.459 25.202 1.460 17.262 [OK] 14161 226 . HOH O 18 O2H2u 0.660 1.460 3.106 28.954 1.460 19.831 possible 14162 227 . HOH O 18 O2H2u 0.660 1.460 2.570 25.272 1.460 17.309 [OK] 14163 228 . HOH O 18 O2H2u 0.660 1.460 2.633 23.704 1.460 16.235 [OK] 14164 229 . HOH O 18 O2H2u 0.660 1.460 3.047 38.262 1.460 26.207 possible 14165 230 . HOH O 18 O2H2u 0.660 1.460 2.763 27.488 1.460 18.827 [OK] 14166 231 . HOH O 18 O2H2u 0.660 1.460 2.894 36.363 1.460 24.906 [OK] 14167 232 . HOH O 18 O2H2u 0.660 1.460 2.835 29.791 1.460 20.405 [OK] 14168 233 . HOH O 18 O2H2u 0.660 1.460 2.646 22.455 1.460 15.380 [OK] 14169 234 . HOH O 18 O2H2u 0.660 1.460 2.561 26.870 1.460 18.404 [OK] 14170 235 . HOH O 18 O2H2u 0.660 1.460 2.697 21.600 1.460 14.795 [OK] 14171 236 . HOH O 18 O2H2u 0.660 1.460 2.602 23.746 1.460 16.265 [OK] 14172 237 . HOH O 18 O2H2u 0.660 1.460 2.648 27.439 1.460 18.794 [OK] 14173 238 . HOH O 18 O2H2u 0.660 1.460 2.783 24.698 1.460 16.917 [OK] 14174 239 . HOH O 18 O2H2u 0.660 1.460 2.582 28.151 1.460 19.282 [OK] 14175 240 . HOH O 18 O2H2u 0.660 1.460 2.990 30.288 1.460 20.745 [OK] 14176 241 . HOH O 18 O2H2u 0.660 1.460 2.679 27.157 1.460 18.600 [OK] 14177 242 . HOH O 18 O2H2u 0.660 1.460 2.638 25.327 1.460 17.347 [OK] 14178 243 . HOH O 18 O2H2u 0.660 1.460 2.963 30.013 1.460 20.557 [OK] 14179 244 . HOH O 18 O2H2u 0.660 1.460 2.377 22.982 1.460 15.741 [OK] 14180 245 . HOH O 18 O2H2u 0.660 1.460 2.516 25.291 1.460 17.323 [OK] 14181 246 . HOH O 18 O2H2u 0.660 1.460 3.009 35.195 1.460 24.106 possible 14182 247 . HOH O 18 O2H2u 0.660 1.460 2.632 24.732 1.460 16.940 [OK] 14183 248 . HOH O 18 O2H2u 0.660 1.460 2.655 23.650 1.460 16.199 [OK] 14184 249 . HOH O 18 O2H2u 0.660 1.460 3.107 25.601 1.460 17.535 possible 14185 250 . HOH O 18 O2H2u 0.660 1.460 7.747 91.987 1.460 63.005 possible 14186 251 . HOH O 18 O2H2u 0.660 1.460 2.634 24.677 1.460 16.902 [OK] 14187 252 . HOH O 18 O2H2u 0.660 1.460 30.332 -1.000 1.460 -1.000 bad 14188 253 . HOH O 18 O2H2u 0.660 1.460 3.258 31.008 1.460 21.238 possible 14189 254 . HOH O 18 O2H2u 0.660 1.460 3.248 30.662 1.460 21.002 possible 14190 255 . HOH O 18 O2H2u 0.660 1.460 4.389 34.873 1.460 23.886 possible 14191 256 . HOH O 18 O2H2u 0.660 1.460 3.892 35.484 1.460 24.304 possible 14192 257 . HOH O 18 O2H2u 0.660 1.460 4.634 33.463 1.460 22.920 possible 14193 258 . HOH O 18 O2H2u 0.660 1.460 2.525 23.642 1.460 16.193 [OK] 14194 259 . HOH O 18 O2H2u 0.660 1.460 2.728 24.861 1.460 17.028 [OK] 14195 260 . HOH O 18 O2H2u 0.660 1.460 29.750 -1.000 1.460 -1.000 bad 14196 261 . HOH O 18 O2H2u 0.660 1.460 4.775 56.616 1.460 38.778 possible 14197 262 . HOH O 18 O2H2u 0.660 1.460 3.035 29.284 1.460 20.058 possible 14198 263 . HOH O 18 O2H2u 0.660 1.460 3.091 33.816 1.460 23.162 possible 14199 264 . HOH O 18 O2H2u 0.660 1.460 2.968 27.739 1.460 18.999 [OK] 14200 265 . HOH O 18 O2H2u 0.660 1.460 5.530 54.142 1.460 37.084 possible 14201 266 . HOH O 18 O2H2u 0.660 1.460 26.485 -1.000 1.460 -1.000 bad 14202 267 . HOH O 18 O2H2u 0.660 1.460 34.703 -1.000 1.460 -1.000 bad 14203 268 . HOH O 18 O2H2u 0.660 1.460 2.458 22.424 1.460 15.359 [OK] 14204 269 . HOH O 18 O2H2u 0.660 1.460 6.416 49.579 1.460 33.958 possible 14205 270 . HOH O 18 O2H2u 0.660 1.460 17.139 -1.000 1.460 -1.000 bad 14206 271 . HOH O 18 O2H2u 0.660 1.460 28.031 -1.000 1.460 -1.000 bad 14207 272 . HOH O 18 O2H2u 0.660 1.460 2.575 26.324 1.460 18.030 [OK] 14208 273 . HOH O 18 O2H2u 0.660 1.460 2.630 26.292 1.460 18.008 [OK] 14209 274 . HOH O 18 O2H2u 0.660 1.460 2.520 20.650 1.460 14.144 [OK] 14210 275 . HOH O 18 O2H2u 0.660 1.460 2.502 24.159 1.460 16.547 [OK] 14211 276 . HOH O 18 O2H2u 0.660 1.460 2.886 25.769 1.460 17.650 [OK] 14212 277 . HOH O 18 O2H2u 0.660 1.460 5.774 64.707 1.460 44.320 possible 14213 278 . HOH O 18 O2H2u 0.660 1.460 6.282 71.897 1.460 49.245 possible 14214 279 . HOH O 18 O2H2u 0.660 1.460 2.812 26.965 1.460 18.470 [OK] 14215 280 . HOH O 18 O2H2u 0.660 1.460 5.438 55.804 1.460 38.222 possible 14216 281 . HOH O 18 O2H2u 0.660 1.460 2.454 23.065 1.460 15.798 [OK] 14217 282 . HOH O 18 O2H2u 0.660 1.460 2.544 26.120 1.460 17.890 [OK] 14218 283 . HOH O 18 O2H2u 0.660 1.460 23.443 -1.000 1.460 -1.000 bad 14219 284 . HOH O 18 O2H2u 0.660 1.460 19.917 -1.000 1.460 -1.000 bad 14220 285 . HOH O 18 O2H2u 0.660 1.460 2.814 28.812 1.460 19.735 [OK] 14221 286 . HOH O 18 O2H2u 0.660 1.460 6.368 68.633 1.460 47.009 possible 14222 287 . HOH O 18 O2H2u 0.660 1.460 2.521 26.329 1.460 18.034 [OK] 14223 288 . HOH O 18 O2H2u 0.660 1.460 2.548 24.238 1.460 16.602 [OK] 14224 289 . HOH O 18 O2H2u 0.660 1.460 2.658 25.725 1.460 17.620 [OK] 14225 290 . HOH O 18 O2H2u 0.660 1.460 23.453 -1.000 1.460 -1.000 bad 14226 291 . HOH O 18 O2H2u 0.660 1.460 2.626 25.440 1.460 17.425 [OK] 14227 292 . HOH O 18 O2H2u 0.660 1.460 2.554 23.154 1.460 15.859 [OK] 14228 293 . HOH O 18 O2H2u 0.660 1.460 3.555 37.668 1.460 25.800 possible 14229 294 . HOH O 18 O2H2u 0.660 1.460 22.020 -1.000 1.460 -1.000 bad 14230 295 . HOH O 18 O2H2u 0.660 1.460 11.209 -1.000 1.460 -1.000 bad 14231 296 . HOH O 18 O2H2u 0.660 1.460 23.249 -1.000 1.460 -1.000 bad 14232 297 . HOH O 18 O2H2u 0.660 1.460 26.867 -1.000 1.460 -1.000 bad 14233 298 . HOH O 18 O2H2u 0.660 1.460 14.327 -1.000 1.460 -1.000 bad 14234 299 . HOH O 18 O2H2u 0.660 1.460 30.573 -1.000 1.460 -1.000 bad 14235 300 . HOH O 18 O2H2u 0.660 1.460 32.184 -1.000 1.460 -1.000 bad 14236 301 . HOH O 18 O2H2u 0.660 1.460 2.888 26.567 1.460 18.197 [OK] 14237 302 . HOH O 18 O2H2u 0.660 1.460 41.917 -1.000 1.460 -1.000 bad 14238 303 . HOH O 18 O2H2u 0.660 1.460 34.887 -1.000 1.460 -1.000 bad 14239 304 . HOH O 18 O2H2u 0.660 1.460 12.852 -1.000 1.460 -1.000 bad 14240 305 . HOH O 18 O2H2u 0.660 1.460 4.566 49.507 1.460 33.909 possible 14241 306 . HOH O 18 O2H2u 0.660 1.460 2.700 31.860 1.460 21.822 [OK] 14242 307 . HOH O 18 O2H2u 0.660 1.460 12.487 -1.000 1.460 -1.000 bad 14243 308 . HOH O 18 O2H2u 0.660 1.460 7.081 49.106 1.460 33.634 possible 14244 309 . HOH O 18 O2H2u 0.660 1.460 4.452 31.112 1.460 21.309 possible 14245 310 . HOH O 18 O2H2u 0.660 1.460 2.726 30.540 1.460 20.918 [OK] 14246 311 . HOH O 18 O2H2u 0.660 1.460 2.631 21.257 1.460 14.560 [OK] 14247 312 . HOH O 18 O2H2u 0.660 1.460 7.024 54.383 1.460 37.249 possible 14248 313 . HOH O 18 O2H2u 0.660 1.460 2.477 20.666 1.460 14.155 [OK] 14249 314 . HOH O 18 O2H2u 0.660 1.460 2.502 21.822 1.460 14.946 [OK] 14250 315 . HOH O 18 O2H2u 0.660 1.460 4.697 29.277 1.460 20.052 possible 14251 316 . HOH O 18 O2H2u 0.660 1.460 24.861 -1.000 1.460 -1.000 bad 14252 317 . HOH O 18 O2H2u 0.660 1.460 2.538 23.706 1.460 16.237 [OK] 14253 318 . HOH O 18 O2H2u 0.660 1.460 2.681 28.005 1.460 19.181 [OK] 14254 319 . HOH O 18 O2H2u 0.660 1.460 2.575 25.504 1.460 17.468 [OK] 14255 320 . HOH O 18 O2H2u 0.660 1.460 2.566 21.047 1.460 14.415 [OK] 14256 321 . HOH O 18 O2H2u 0.660 1.460 2.417 23.456 1.460 16.065 [OK] 14257 322 . HOH O 18 O2H2u 0.660 1.460 4.308 41.465 1.460 28.401 possible 14258 323 . HOH O 18 O2H2u 0.660 1.460 2.734 25.455 1.460 17.435 [OK] 14259 324 . HOH O 18 O2H2u 0.660 1.460 2.593 25.593 1.460 17.529 [OK] 14260 325 . HOH O 18 O2H2u 0.660 1.460 2.801 30.355 1.460 20.791 [OK] 14261 326 . HOH O 18 O2H2u 0.660 1.460 4.246 42.072 1.460 28.816 possible 14262 327 . HOH O 18 O2H2u 0.660 1.460 6.886 89.673 1.460 61.420 possible 14263 328 . HOH O 18 O2H2u 0.660 1.460 3.517 27.994 1.460 19.174 possible 14264 329 . HOH O 18 O2H2u 0.660 1.460 4.573 37.312 1.460 25.556 possible 14265 330 . HOH O 18 O2H2u 0.660 1.460 37.279 -1.000 1.460 -1.000 bad 14266 331 . HOH O 18 O2H2u 0.660 1.460 27.356 -1.000 1.460 -1.000 bad 14267 332 . HOH O 18 O2H2u 0.660 1.460 28.287 -1.000 1.460 -1.000 bad 14268 333 . HOH O 18 O2H2u 0.660 1.460 4.959 64.502 1.460 44.179 possible 14269 334 . HOH O 18 O2H2u 0.660 1.460 30.634 -1.000 1.460 -1.000 bad 14270 335 . HOH O 18 O2H2u 0.660 1.460 9.804 -1.000 1.460 -1.000 bad 14271 336 . HOH O 18 O2H2u 0.660 1.460 5.122 37.081 1.460 25.398 possible 14272 337 . HOH O 18 O2H2u 0.660 1.460 34.640 -1.000 1.460 -1.000 bad 14273 338 . HOH O 18 O2H2u 0.660 1.460 2.569 27.127 1.460 18.580 [OK] 14274 339 . HOH O 18 O2H2u 0.660 1.460 7.432 62.592 1.460 42.871 possible 14275 340 . HOH O 18 O2H2u 0.660 1.460 36.814 -1.000 1.460 -1.000 bad 14276 341 . HOH O 18 O2H2u 0.660 1.460 3.262 26.306 1.460 18.018 possible 14277 342 . HOH O 18 O2H2u 0.660 1.460 4.528 35.059 1.460 24.013 possible 14278 343 . HOH O 18 O2H2u 0.660 1.460 3.055 30.100 1.460 20.616 possible 14279 344 . HOH O 18 O2H2u 0.660 1.460 33.004 -1.000 1.460 -1.000 bad 14280 345 . HOH O 18 O2H2u 0.660 1.460 2.931 22.832 1.460 15.638 [OK] 14281 346 . HOH O 18 O2H2u 0.660 1.460 4.057 29.652 1.460 20.310 possible 14282 347 . HOH O 18 O2H2u 0.660 1.460 4.440 47.395 1.460 32.463 possible 14283 348 . HOH O 18 O2H2u 0.660 1.460 14.951 -1.000 1.460 -1.000 bad 14284 349 . HOH O 18 O2H2u 0.660 1.460 35.577 -1.000 1.460 -1.000 bad 14285 350 . HOH O 18 O2H2u 0.660 1.460 4.049 42.940 1.460 29.411 possible 14286 351 . HOH O 18 O2H2u 0.660 1.460 2.522 25.440 1.460 17.425 [OK] 14287 352 . HOH O 18 O2H2u 0.660 1.460 3.006 35.264 1.460 24.153 possible 14288 353 . HOH O 18 O2H2u 0.660 1.460 2.891 30.712 1.460 21.035 [OK] 14289 354 . HOH O 18 O2H2u 0.660 1.460 23.762 -1.000 1.460 -1.000 bad 14290 355 . HOH O 18 O2H2u 0.660 1.460 6.111 42.416 1.460 29.052 possible 14291 356 . HOH O 18 O2H2u 0.660 1.460 19.633 -1.000 1.460 -1.000 bad 14292 357 . HOH O 18 O2H2u 0.660 1.460 5.042 54.709 1.460 37.472 possible 14293 358 . HOH O 18 O2H2u 0.660 1.460 47.528 -1.000 1.460 -1.000 bad 14294 359 . HOH O 18 O2H2u 0.660 1.460 35.508 -1.000 1.460 -1.000 bad 14295 360 . HOH O 18 O2H2u 0.660 1.460 32.494 -1.000 1.460 -1.000 bad 14296 361 . HOH O 18 O2H2u 0.660 1.460 39.347 -1.000 1.460 -1.000 bad 14297 362 . HOH O 18 O2H2u 0.660 1.460 2.697 22.307 1.460 15.279 [OK] 14298 363 . HOH O 18 O2H2u 0.660 1.460 51.630 -1.000 1.460 -1.000 bad 14299 364 . HOH O 18 O2H2u 0.660 1.460 15.451 -1.000 1.460 -1.000 bad 14300 365 . HOH O 18 O2H2u 0.660 1.460 31.620 -1.000 1.460 -1.000 bad 14301 366 . HOH O 18 O2H2u 0.660 1.460 21.177 -1.000 1.460 -1.000 bad 14302 367 . HOH O 18 O2H2u 0.660 1.460 2.582 24.521 1.460 16.795 [OK] 14303 368 . HOH O 18 O2H2u 0.660 1.460 4.824 36.264 1.460 24.839 possible 14304 369 . HOH O 18 O2H2u 0.660 1.460 3.068 30.209 1.460 20.691 possible 14305 370 . HOH O 18 O2H2u 0.660 1.460 5.276 51.228 1.460 35.088 possible 14306 371 . HOH O 18 O2H2u 0.660 1.460 4.338 36.117 1.460 24.738 possible 14307 372 . HOH O 18 O2H2u 0.660 1.460 4.267 42.700 1.460 29.247 possible 14308 373 . HOH O 18 O2H2u 0.660 1.460 34.717 -1.000 1.460 -1.000 bad 14309 374 . HOH O 18 O2H2u 0.660 1.460 2.512 22.327 1.460 15.292 [OK] 14310 375 . HOH O 18 O2H2u 0.660 1.460 2.476 23.621 1.460 16.179 [OK] 14311 376 . HOH O 18 O2H2u 0.660 1.460 4.229 34.791 1.460 23.829 possible 14312 377 . HOH O 18 O2H2u 0.660 1.460 22.740 -1.000 1.460 -1.000 bad 14313 378 . HOH O 18 O2H2u 0.660 1.460 4.148 25.229 1.460 17.280 possible 14314 379 . HOH O 18 O2H2u 0.660 1.460 49.168 -1.000 1.460 -1.000 bad 14315 380 . HOH O 18 O2H2u 0.660 1.460 2.403 22.900 1.460 15.685 [OK] 14316 381 . HOH O 18 O2H2u 0.660 1.460 2.717 26.948 1.460 18.457 [OK] 14317 382 . HOH O 18 O2H2u 0.660 1.460 5.422 50.350 1.460 34.486 possible 14318 383 . HOH O 18 O2H2u 0.660 1.460 5.667 40.495 1.460 27.736 possible 14319 384 . HOH O 18 O2H2u 0.660 1.460 21.836 -1.000 1.460 -1.000 bad 14320 385 . HOH O 18 O2H2u 0.660 1.460 5.555 40.147 1.460 27.498 possible 14321 386 . HOH O 18 O2H2u 0.660 1.460 3.477 29.111 1.460 19.939 possible 14322 387 . HOH O 18 O2H2u 0.660 1.460 32.214 -1.000 1.460 -1.000 bad 14323 388 . HOH O 18 O2H2u 0.660 1.460 35.740 -1.000 1.460 -1.000 bad 14324 389 . HOH O 18 O2H2u 0.660 1.460 3.582 32.136 1.460 22.011 possible 14325 390 . HOH O 18 O2H2u 0.660 1.460 3.213 31.220 1.460 21.384 possible 14326 391 . HOH O 18 O2H2u 0.660 1.460 3.074 23.983 1.460 16.427 possible 14327 392 . HOH O 18 O2H2u 0.660 1.460 2.704 29.503 1.460 20.208 [OK] 14328 393 . HOH O 18 O2H2u 0.660 1.460 41.793 -1.000 1.460 -1.000 bad 14329 394 . HOH O 18 O2H2u 0.660 1.460 47.780 -1.000 1.460 -1.000 bad 14330 395 . HOH O 18 O2H2u 0.660 1.460 2.986 24.301 1.460 16.644 [OK] 14331 396 . HOH O 18 O2H2u 0.660 1.460 2.656 27.083 1.460 18.550 [OK] 14332 397 . HOH O 18 O2H2u 0.660 1.460 5.179 46.226 1.460 31.662 possible 14333 398 . HOH O 18 O2H2u 0.660 1.460 27.681 -1.000 1.460 -1.000 bad 14334 399 . HOH O 18 O2H2u 0.660 1.460 2.862 27.473 1.460 18.817 [OK] 14335 400 . HOH O 18 O2H2u 0.660 1.460 32.226 -1.000 1.460 -1.000 bad 14336 401 . HOH O 18 O2H2u 0.660 1.460 6.496 42.746 1.460 29.278 possible 14337 402 . HOH O 18 O2H2u 0.660 1.460 2.431 23.805 1.460 16.305 [OK] 14338 403 . HOH O 18 O2H2u 0.660 1.460 2.275 19.914 1.460 13.640 [OK] 14339 404 . HOH O 18 O2H2u 0.660 1.460 16.581 -1.000 1.460 -1.000 bad 14340 405 . HOH O 18 O2H2u 0.660 1.460 2.824 23.172 1.460 15.871 [OK] 14341 406 . HOH O 18 O2H2u 0.660 1.460 7.119 65.807 1.460 45.073 possible 14342 407 . HOH O 18 O2H2u 0.660 1.460 3.058 24.482 1.460 16.769 possible 14343 408 . HOH O 18 O2H2u 0.660 1.460 20.863 -1.000 1.460 -1.000 bad 14344 409 . HOH O 18 O2H2u 0.660 1.460 2.622 26.981 1.460 18.480 [OK] 14345 410 . HOH O 18 O2H2u 0.660 1.460 2.613 25.795 1.460 17.668 [OK] 14346 411 . HOH O 18 O2H2u 0.660 1.460 2.614 21.754 1.460 14.900 [OK] 14347 412 . HOH O 18 O2H2u 0.660 1.460 38.193 -1.000 1.460 -1.000 bad 14348 413 . HOH O 18 O2H2u 0.660 1.460 39.972 -1.000 1.460 -1.000 bad 14349 414 . HOH O 18 O2H2u 0.660 1.460 45.472 -1.000 1.460 -1.000 bad 14350 415 . HOH O 18 O2H2u 0.660 1.460 2.816 29.665 1.460 20.319 [OK] 14351 416 . HOH O 18 O2H2u 0.660 1.460 2.439 22.678 1.460 15.533 [OK] 14352 417 . HOH O 18 O2H2u 0.660 1.460 5.978 78.630 1.460 53.856 possible 14353 418 . HOH O 18 O2H2u 0.660 1.460 3.470 25.935 1.460 17.764 possible 14354 419 . HOH O 18 O2H2u 0.660 1.460 35.004 -1.000 1.460 -1.000 bad 14355 420 . HOH O 18 O2H2u 0.660 1.460 7.387 98.404 1.460 67.400 possible 14356 421 . HOH O 18 O2H2u 0.660 1.460 36.645 -1.000 1.460 -1.000 bad 14357 422 . HOH O 18 O2H2u 0.660 1.460 24.744 -1.000 1.460 -1.000 bad 14358 423 . HOH O 18 O2H2u 0.660 1.460 28.045 -1.000 1.460 -1.000 bad 14359 424 . HOH O 18 O2H2u 0.660 1.460 19.092 -1.000 1.460 -1.000 bad 14360 425 . HOH O 18 O2H2u 0.660 1.460 14.420 -1.000 1.460 -1.000 bad 14361 426 . HOH O 18 O2H2u 0.660 1.460 3.325 30.324 1.460 20.770 possible 14362 427 . HOH O 18 O2H2u 0.660 1.460 2.599 24.434 1.460 16.736 [OK] 14363 428 . HOH O 18 O2H2u 0.660 1.460 35.921 -1.000 1.460 -1.000 bad 14364 429 . HOH O 18 O2H2u 0.660 1.460 2.627 24.498 1.460 16.779 [OK] 14365 430 . HOH O 18 O2H2u 0.660 1.460 2.911 34.562 1.460 23.673 [OK] 14366 431 . HOH O 18 O2H2u 0.660 1.460 26.699 -1.000 1.460 -1.000 bad 14367 432 . HOH O 18 O2H2u 0.660 1.460 8.482 -1.000 1.460 -1.000 bad 14368 433 . HOH O 18 O2H2u 0.660 1.460 13.736 -1.000 1.460 -1.000 bad 14369 434 . HOH O 18 O2H2u 0.660 1.460 12.646 -1.000 1.460 -1.000 bad 14370 435 . HOH O 18 O2H2u 0.660 1.460 5.373 37.365 1.460 25.593 possible 14371 436 . HOH O 18 O2H2u 0.660 1.460 2.682 27.712 1.460 18.981 [OK] 14372 437 . HOH O 18 O2H2u 0.660 1.460 5.483 63.447 1.460 43.457 possible 14373 438 . HOH O 18 O2H2u 0.660 1.460 21.132 -1.000 1.460 -1.000 bad 14374 439 . HOH O 18 O2H2u 0.660 1.460 31.489 -1.000 1.460 -1.000 bad 14375 440 . HOH O 18 O2H2u 0.660 1.460 43.695 -1.000 1.460 -1.000 bad 14376 441 . HOH O 18 O2H2u 0.660 1.460 35.941 -1.000 1.460 -1.000 bad 14377 442 . HOH O 18 O2H2u 0.660 1.460 2.961 26.535 1.460 18.174 [OK] 14378 443 . HOH O 18 O2H2u 0.660 1.460 4.360 48.271 1.460 33.062 possible 14379 444 . HOH O 18 O2H2u 0.660 1.460 4.952 36.780 1.460 25.192 possible 14380 445 . HOH O 18 O2H2u 0.660 1.460 3.686 45.334 1.460 31.050 possible 14381 446 . HOH O 18 O2H2u 0.660 1.460 2.842 28.696 1.460 19.655 [OK] 14382 447 . HOH O 18 O2H2u 0.660 1.460 2.526 23.649 1.460 16.198 [OK] 14383 448 . HOH O 18 O2H2u 0.660 1.460 6.075 111.306 1.460 76.237 possible 14384 449 . HOH O 18 O2H2u 0.660 1.460 2.531 24.435 1.460 16.736 [OK] 14385 450 . HOH O 18 O2H2u 0.660 1.460 15.457 -1.000 1.460 -1.000 bad 14386 451 . HOH O 18 O2H2u 0.660 1.460 7.983 98.719 1.460 67.616 possible 14387 452 . HOH O 18 O2H2u 0.660 1.460 24.143 -1.000 1.460 -1.000 bad 14388 453 . HOH O 18 O2H2u 0.660 1.460 3.237 32.830 1.460 22.486 possible 14389 454 . HOH O 18 O2H2u 0.660 1.460 3.512 27.869 1.460 19.088 possible 14390 455 . HOH O 18 O2H2u 0.660 1.460 6.299 52.040 1.460 35.644 possible 14391 456 . HOH O 18 O2H2u 0.660 1.460 6.844 73.210 1.460 50.144 possible 14392 457 . HOH O 18 O2H2u 0.660 1.460 7.745 52.530 1.460 35.979 possible 14393 458 . HOH O 18 O2H2u 0.660 1.460 26.350 -1.000 1.460 -1.000 bad 14394 459 . HOH O 18 O2H2u 0.660 1.460 28.474 -1.000 1.460 -1.000 bad 14395 460 . HOH O 18 O2H2u 0.660 1.460 4.334 40.077 1.460 27.450 possible 14396 461 . HOH O 18 O2H2u 0.660 1.460 37.251 -1.000 1.460 -1.000 bad 14397 462 . HOH O 18 O2H2u 0.660 1.460 7.457 80.584 1.460 55.194 possible 14398 463 . HOH O 18 O2H2u 0.660 1.460 4.222 34.590 1.460 23.692 possible 14399 464 . HOH O 18 O2H2u 0.660 1.460 7.800 101.891 1.460 69.788 possible 14400 465 . HOH O 18 O2H2u 0.660 1.460 5.553 35.698 1.460 24.450 possible 14401 466 . HOH O 18 O2H2u 0.660 1.460 23.940 -1.000 1.460 -1.000 bad 14402 467 . HOH O 18 O2H2u 0.660 1.460 27.637 -1.000 1.460 -1.000 bad 14403 468 . HOH O 18 O2H2u 0.660 1.460 4.225 42.883 1.460 29.372 possible