number_ resnum chain resname atname typenum typenam covrad vdwrad surface volume refvol packeff goodbad 1 2 . ALA N 12 N3H1s 0.700 1.640 50.490 -1.000 13.872 -1.000 bad 2 2 . ALA CA 4 C4H1b 0.770 1.880 7.146 55.278 13.959 3.960 possible 3 2 . ALA C 1 C3H0s 0.770 1.610 4.121 12.164 8.858 1.373 possible 4 2 . ALA O 16 O1H0u 0.660 1.420 17.933 -1.000 16.026 -1.000 bad 5 2 . ALA CB 10 C4H3u 0.770 1.880 53.994 -1.000 36.551 -1.000 bad 6 3 . GLN N 12 N3H1s 0.700 1.640 5.093 27.925 13.449 2.076 possible 7 3 . GLN CA 3 C4H1s 0.770 1.880 3.508 13.460 13.231 1.017 possible 8 3 . GLN C 1 C3H0s 0.770 1.610 3.449 10.791 8.744 1.234 possible 9 3 . GLN O 16 O1H0u 0.660 1.420 3.181 24.445 15.767 1.550 possible 10 3 . GLN CB 8 C4H2s 0.770 1.880 23.480 -1.000 23.059 -1.000 bad 11 3 . GLN CG 8 C4H2s 0.770 1.880 18.892 -1.000 23.218 -1.000 bad 12 3 . GLN CD 2 C3H0b 0.770 1.610 2.171 -1.000 9.618 -1.000 bad 13 3 . GLN OE1 16 O1H0u 0.660 1.420 38.085 -1.000 16.571 -1.000 bad 14 3 . GLN NE2 15 N3H2u 0.700 1.640 27.659 -1.000 23.255 -1.000 bad 15 4 . ILE N 12 N3H1s 0.700 1.640 4.556 21.548 13.493 1.597 possible 16 4 . ILE CA 3 C4H1s 0.770 1.880 3.574 17.679 12.946 1.366 possible 17 4 . ILE C 1 C3H0s 0.770 1.610 3.304 10.799 8.445 1.279 possible 18 4 . ILE O 16 O1H0u 0.660 1.420 11.546 -1.000 15.930 -1.000 bad 19 4 . ILE CB 4 C4H1b 0.770 1.880 6.671 25.736 14.146 1.819 possible 20 4 . ILE CG1 9 C4H2b 0.770 1.880 3.583 25.629 24.071 1.065 possible 21 4 . ILE CG2 10 C4H3u 0.770 1.880 7.390 58.897 35.763 1.647 possible 22 4 . ILE CD1 10 C4H3u 0.770 1.880 33.396 -1.000 38.219 -1.000 bad 23 5 . THR N 12 N3H1s 0.700 1.640 3.378 14.325 13.544 1.058 possible 24 5 . THR CA 3 C4H1s 0.770 1.880 3.470 17.908 13.025 1.375 possible 25 5 . THR C 1 C3H0s 0.770 1.610 3.749 11.342 8.685 1.306 possible 26 5 . THR O 16 O1H0u 0.660 1.420 3.721 21.768 15.795 1.378 possible 27 5 . THR CB 4 C4H1b 0.770 1.880 17.012 -1.000 14.687 -1.000 bad 28 5 . THR OG1 17 O2H1u 0.660 1.460 30.964 -1.000 17.610 -1.000 bad 29 5 . THR CG2 10 C4H3u 0.770 1.880 27.991 -1.000 36.265 -1.000 bad 30 6 . GLY N 12 N3H1s 0.700 1.640 4.417 18.995 14.480 1.312 possible 31 6 . GLY CA 8 C4H2s 0.770 1.880 35.085 -1.000 23.470 -1.000 bad 32 6 . GLY C 2 C3H0b 0.770 1.610 1.675 -1.000 9.652 -1.000 bad 33 6 . GLY O 16 O1H0u 0.660 1.420 14.169 -1.000 16.154 -1.000 bad 34 7 . ARG N 12 N3H1s 0.700 1.640 2.403 -1.000 13.486 -1.000 bad 35 7 . ARG CA 3 C4H1s 0.770 1.880 7.191 23.419 13.310 1.759 possible 36 7 . ARG C 1 C3H0s 0.770 1.610 2.510 8.008 8.779 0.912 [OK] 37 7 . ARG O 16 O1H0u 0.660 1.420 3.044 18.122 15.916 1.139 possible 38 7 . ARG CB 8 C4H2s 0.770 1.880 4.724 27.043 22.833 1.184 possible 39 7 . ARG CG 8 C4H2s 0.770 1.880 20.886 -1.000 23.273 -1.000 bad 40 7 . ARG CD 8 C4H2s 0.770 1.880 11.528 -1.000 22.849 -1.000 bad 41 7 . ARG NE 13 N3H1b 0.700 1.640 3.361 25.806 15.019 1.718 possible 42 7 . ARG CZ 2 C3H0b 0.770 1.610 3.260 13.274 9.678 1.372 possible 43 7 . ARG NH1 15 N3H2u 0.700 1.640 7.928 101.272 22.056 4.592 possible 44 7 . ARG NH2 15 N3H2u 0.700 1.640 3.318 32.959 23.132 1.425 possible 45 8 . PRO N 11 N3H0u 0.700 1.640 2.581 8.154 8.650 0.943 [OK] 46 8 . PRO CA 4 C4H1b 0.770 1.880 6.791 33.723 13.828 2.439 possible 47 8 . PRO C 1 C3H0s 0.770 1.610 2.826 8.826 8.768 1.007 [OK] 48 8 . PRO O 16 O1H0u 0.660 1.420 4.871 26.512 15.856 1.672 possible 49 8 . PRO CB 9 C4H2b 0.770 1.880 14.714 -1.000 25.314 -1.000 bad 50 8 . PRO CG 9 C4H2b 0.770 1.880 34.439 -1.000 25.480 -1.000 bad 51 8 . PRO CD 8 C4H2s 0.770 1.880 17.806 -1.000 23.390 -1.000 bad 52 9 . GLU N 12 N3H1s 0.700 1.640 2.893 15.005 13.461 1.115 [OK] 53 9 . GLU CA 3 C4H1s 0.770 1.880 2.916 13.584 13.284 1.023 [OK] 54 9 . GLU C 1 C3H0s 0.770 1.610 2.216 8.043 8.631 0.932 [OK] 55 9 . GLU O 16 O1H0u 0.660 1.420 2.227 12.742 15.765 0.808 [OK] 56 9 . GLU CB 8 C4H2s 0.770 1.880 3.197 23.921 23.214 1.030 possible 57 9 . GLU CG 8 C4H2s 0.770 1.880 3.186 24.752 23.304 1.062 possible 58 9 . GLU CD 2 C3H0b 0.770 1.610 2.856 10.973 9.437 1.163 [OK] 59 9 . GLU OE1 16 O1H0u 0.660 1.420 3.051 18.130 15.497 1.170 possible 60 9 . GLU OE2 16 O1H0u 0.660 1.420 6.306 52.166 16.213 3.218 possible 61 10 . TRP N 12 N3H1s 0.700 1.640 3.488 15.913 13.639 1.167 possible 62 10 . TRP CA 3 C4H1s 0.770 1.880 3.804 17.798 13.323 1.336 possible 63 10 . TRP C 1 C3H0s 0.770 1.610 2.185 6.970 8.687 0.802 [OK] 64 10 . TRP O 16 O1H0u 0.660 1.420 2.338 13.368 15.797 0.846 [OK] 65 10 . TRP CB 8 C4H2s 0.770 1.880 3.681 32.456 23.826 1.362 possible 66 10 . TRP CG 2 C3H0b 0.770 1.610 2.459 9.681 9.915 0.976 [OK] 67 10 . TRP CD1 5 C3H1s 0.770 1.760 2.685 18.259 20.597 0.886 [OK] 68 10 . TRP CD2 2 C3H0b 0.770 1.610 3.011 10.274 10.068 1.020 possible 69 10 . TRP NE1 13 N3H1b 0.700 1.640 7.477 -1.000 16.723 -1.000 bad 70 10 . TRP CE2 2 C3H0b 0.770 1.610 3.451 12.308 9.848 1.250 possible 71 10 . TRP CE3 6 C3H1b 0.770 1.760 5.060 37.588 20.383 1.844 possible 72 10 . TRP CZ2 6 C3H1b 0.770 1.760 29.934 -1.000 20.931 -1.000 bad 73 10 . TRP CZ3 6 C3H1b 0.770 1.760 26.370 -1.000 21.429 -1.000 bad 74 10 . TRP CH2 6 C3H1b 0.770 1.760 30.025 -1.000 21.219 -1.000 bad 75 11 . ILE N 12 N3H1s 0.700 1.640 2.568 12.490 13.493 0.926 [OK] 76 11 . ILE CA 3 C4H1s 0.770 1.880 3.529 15.481 12.946 1.196 possible 77 11 . ILE C 1 C3H0s 0.770 1.610 2.614 7.808 8.445 0.925 [OK] 78 11 . ILE O 16 O1H0u 0.660 1.420 4.361 19.696 15.930 1.236 possible 79 11 . ILE CB 4 C4H1b 0.770 1.880 4.530 17.085 14.146 1.208 possible 80 11 . ILE CG1 9 C4H2b 0.770 1.880 9.698 -1.000 24.071 -1.000 bad 81 11 . ILE CG2 10 C4H3u 0.770 1.880 6.137 49.517 35.763 1.385 possible 82 11 . ILE CD1 10 C4H3u 0.770 1.880 60.254 -1.000 38.219 -1.000 bad 83 12 . TRP N 12 N3H1s 0.700 1.640 2.614 10.767 13.639 0.789 [OK] 84 12 . TRP CA 3 C4H1s 0.770 1.880 3.145 14.633 13.323 1.098 possible 85 12 . TRP C 1 C3H0s 0.770 1.610 2.804 8.983 8.687 1.034 [OK] 86 12 . TRP O 16 O1H0u 0.660 1.420 2.575 14.409 15.797 0.912 [OK] 87 12 . TRP CB 8 C4H2s 0.770 1.880 3.199 25.857 23.826 1.085 possible 88 12 . TRP CG 2 C3H0b 0.770 1.610 2.511 9.829 9.915 0.991 [OK] 89 12 . TRP CD1 5 C3H1s 0.770 1.760 2.795 19.865 20.597 0.964 [OK] 90 12 . TRP CD2 2 C3H0b 0.770 1.610 2.534 10.054 10.068 0.999 [OK] 91 12 . TRP NE1 13 N3H1b 0.700 1.640 4.537 29.696 16.723 1.776 possible 92 12 . TRP CE2 2 C3H0b 0.770 1.610 2.867 10.728 9.848 1.089 [OK] 93 12 . TRP CE3 6 C3H1b 0.770 1.760 4.289 30.174 20.383 1.480 possible 94 12 . TRP CZ2 6 C3H1b 0.770 1.760 23.323 -1.000 20.931 -1.000 bad 95 12 . TRP CZ3 6 C3H1b 0.770 1.760 16.551 -1.000 21.429 -1.000 bad 96 12 . TRP CH2 6 C3H1b 0.770 1.760 22.560 -1.000 21.219 -1.000 bad 97 13 . LEU N 12 N3H1s 0.700 1.640 2.830 13.192 13.517 0.976 [OK] 98 13 . LEU CA 3 C4H1s 0.770 1.880 2.940 12.895 13.055 0.988 [OK] 99 13 . LEU C 1 C3H0s 0.770 1.610 2.886 8.659 8.781 0.986 [OK] 100 13 . LEU O 16 O1H0u 0.660 1.420 2.651 13.972 15.957 0.876 [OK] 101 13 . LEU CB 8 C4H2s 0.770 1.880 3.171 24.791 22.818 1.086 possible 102 13 . LEU CG 4 C4H1b 0.770 1.880 2.966 17.826 14.704 1.212 [OK] 103 13 . LEU CD1 10 C4H3u 0.770 1.880 3.328 34.079 37.235 0.915 possible 104 13 . LEU CD2 10 C4H3u 0.770 1.880 3.784 39.870 37.020 1.077 possible 105 14 . ALA N 12 N3H1s 0.700 1.640 2.685 14.234 13.872 1.026 [OK] 106 14 . ALA CA 4 C4H1b 0.770 1.880 3.780 14.737 13.959 1.056 possible 107 14 . ALA C 1 C3H0s 0.770 1.610 4.161 8.831 8.858 0.997 possible 108 14 . ALA O 16 O1H0u 0.660 1.420 5.595 29.787 16.026 1.859 possible 109 14 . ALA CB 10 C4H3u 0.770 1.880 23.711 -1.000 36.551 -1.000 bad 110 15 . LEU N 12 N3H1s 0.700 1.640 4.232 14.357 13.517 1.062 possible 111 15 . LEU CA 3 C4H1s 0.770 1.880 4.903 18.978 13.055 1.454 possible 112 15 . LEU C 1 C3H0s 0.770 1.610 2.248 7.885 8.781 0.898 [OK] 113 15 . LEU O 16 O1H0u 0.660 1.420 2.944 14.661 15.957 0.919 [OK] 114 15 . LEU CB 8 C4H2s 0.770 1.880 3.080 19.802 22.818 0.868 possible 115 15 . LEU CG 4 C4H1b 0.770 1.880 9.808 -1.000 14.704 -1.000 bad 116 15 . LEU CD1 10 C4H3u 0.770 1.880 23.242 -1.000 37.235 -1.000 bad 117 15 . LEU CD2 10 C4H3u 0.770 1.880 41.889 -1.000 37.020 -1.000 bad 118 16 . GLY N 12 N3H1s 0.700 1.640 2.537 11.526 14.480 0.796 [OK] 119 16 . GLY CA 8 C4H2s 0.770 1.880 3.074 23.382 23.470 0.996 possible 120 16 . GLY C 2 C3H0b 0.770 1.610 2.385 8.904 9.652 0.923 [OK] 121 16 . GLY O 16 O1H0u 0.660 1.420 2.543 15.390 16.154 0.953 [OK] 122 17 . THR N 12 N3H1s 0.700 1.640 2.401 12.487 13.544 0.922 [OK] 123 17 . THR CA 3 C4H1s 0.770 1.880 2.955 14.522 13.025 1.115 [OK] 124 17 . THR C 1 C3H0s 0.770 1.610 3.562 8.935 8.685 1.029 possible 125 17 . THR O 16 O1H0u 0.660 1.420 3.879 20.447 15.795 1.295 possible 126 17 . THR CB 4 C4H1b 0.770 1.880 6.190 21.790 14.687 1.484 possible 127 17 . THR OG1 17 O2H1u 0.660 1.460 3.091 20.382 17.610 1.157 possible 128 17 . THR CG2 10 C4H3u 0.770 1.880 5.923 58.033 36.265 1.600 possible 129 18 . ALA N 12 N3H1s 0.700 1.640 5.118 18.002 13.872 1.298 possible 130 18 . ALA CA 4 C4H1b 0.770 1.880 7.508 42.233 13.959 3.025 possible 131 18 . ALA C 1 C3H0s 0.770 1.610 3.595 8.931 8.858 1.008 possible 132 18 . ALA O 16 O1H0u 0.660 1.420 3.363 19.221 16.026 1.199 possible 133 18 . ALA CB 10 C4H3u 0.770 1.880 48.078 -1.000 36.551 -1.000 bad 134 19 . LEU N 12 N3H1s 0.700 1.640 3.212 13.618 13.517 1.007 possible 135 19 . LEU CA 3 C4H1s 0.770 1.880 4.394 19.828 13.055 1.519 possible 136 19 . LEU C 1 C3H0s 0.770 1.610 2.647 8.973 8.781 1.022 [OK] 137 19 . LEU O 16 O1H0u 0.660 1.420 4.887 28.173 15.957 1.766 possible 138 19 . LEU CB 8 C4H2s 0.770 1.880 4.264 25.623 22.818 1.123 possible 139 19 . LEU CG 4 C4H1b 0.770 1.880 3.379 13.372 14.704 0.909 possible 140 19 . LEU CD1 10 C4H3u 0.770 1.880 5.693 38.136 37.235 1.024 possible 141 19 . LEU CD2 10 C4H3u 0.770 1.880 48.184 -1.000 37.020 -1.000 bad 142 20 . MET N 12 N3H1s 0.700 1.640 2.532 12.667 13.405 0.945 [OK] 143 20 . MET CA 3 C4H1s 0.770 1.880 3.096 15.438 13.194 1.170 possible 144 20 . MET C 1 C3H0s 0.770 1.610 2.620 8.718 8.756 0.996 [OK] 145 20 . MET O 16 O1H0u 0.660 1.420 2.746 15.841 16.002 0.990 [OK] 146 20 . MET CB 8 C4H2s 0.770 1.880 2.955 23.934 23.418 1.022 [OK] 147 20 . MET CG 9 C4H2b 0.770 1.880 2.899 22.364 23.830 0.938 [OK] 148 20 . MET SD 19 S2H0u 1.040 1.770 3.141 32.481 30.207 1.075 possible 149 20 . MET CE 10 C4H3u 0.770 1.880 2.996 33.833 37.003 0.914 [OK] 150 21 . GLY N 12 N3H1s 0.700 1.640 2.766 15.531 14.480 1.073 [OK] 151 21 . GLY CA 8 C4H2s 0.770 1.880 5.285 46.528 23.470 1.982 possible 152 21 . GLY C 2 C3H0b 0.770 1.610 3.562 9.567 9.652 0.991 possible 153 21 . GLY O 16 O1H0u 0.660 1.420 3.628 14.678 16.154 0.909 possible 154 22 . LEU N 12 N3H1s 0.700 1.640 3.568 15.620 13.517 1.156 possible 155 22 . LEU CA 3 C4H1s 0.770 1.880 3.306 13.382 13.055 1.025 possible 156 22 . LEU C 1 C3H0s 0.770 1.610 4.173 9.113 8.781 1.038 possible 157 22 . LEU O 16 O1H0u 0.660 1.420 4.971 28.201 15.957 1.767 possible 158 22 . LEU CB 8 C4H2s 0.770 1.880 5.832 38.293 22.818 1.678 possible 159 22 . LEU CG 4 C4H1b 0.770 1.880 9.660 -1.000 14.704 -1.000 bad 160 22 . LEU CD1 10 C4H3u 0.770 1.880 35.543 -1.000 37.235 -1.000 bad 161 22 . LEU CD2 10 C4H3u 0.770 1.880 65.740 -1.000 37.020 -1.000 bad 162 23 . GLY N 12 N3H1s 0.700 1.640 4.733 16.482 14.480 1.138 possible 163 23 . GLY CA 8 C4H2s 0.770 1.880 5.771 41.671 23.470 1.776 possible 164 23 . GLY C 2 C3H0b 0.770 1.610 2.322 7.704 9.652 0.798 [OK] 165 23 . GLY O 16 O1H0u 0.660 1.420 2.737 13.549 16.154 0.839 [OK] 166 24 . THR N 12 N3H1s 0.700 1.640 2.628 12.709 13.544 0.938 [OK] 167 24 . THR CA 3 C4H1s 0.770 1.880 2.795 14.438 13.025 1.109 [OK] 168 24 . THR C 1 C3H0s 0.770 1.610 2.117 7.591 8.685 0.874 [OK] 169 24 . THR O 16 O1H0u 0.660 1.420 2.640 15.426 15.795 0.977 [OK] 170 24 . THR CB 4 C4H1b 0.770 1.880 2.705 14.197 14.687 0.967 [OK] 171 24 . THR OG1 17 O2H1u 0.660 1.460 4.868 39.038 17.610 2.217 possible 172 24 . THR CG2 10 C4H3u 0.770 1.880 4.292 36.083 36.265 0.995 possible 173 25 . LEU N 12 N3H1s 0.700 1.640 2.609 12.558 13.517 0.929 [OK] 174 25 . LEU CA 3 C4H1s 0.770 1.880 2.848 12.100 13.055 0.927 [OK] 175 25 . LEU C 1 C3H0s 0.770 1.610 3.729 9.438 8.781 1.075 possible 176 25 . LEU O 16 O1H0u 0.660 1.420 3.815 18.453 15.957 1.156 possible 177 25 . LEU CB 8 C4H2s 0.770 1.880 10.979 -1.000 22.818 -1.000 bad 178 25 . LEU CG 4 C4H1b 0.770 1.880 4.771 21.523 14.704 1.464 possible 179 25 . LEU CD1 10 C4H3u 0.770 1.880 33.236 -1.000 37.235 -1.000 bad 180 25 . LEU CD2 10 C4H3u 0.770 1.880 53.997 -1.000 37.020 -1.000 bad 181 26 . TYR N 12 N3H1s 0.700 1.640 4.905 16.502 13.473 1.225 possible 182 26 . TYR CA 3 C4H1s 0.770 1.880 6.474 19.301 13.249 1.457 possible 183 26 . TYR C 1 C3H0s 0.770 1.610 2.721 7.964 8.714 0.914 [OK] 184 26 . TYR O 16 O1H0u 0.660 1.420 2.440 13.011 15.901 0.818 [OK] 185 26 . TYR CB 8 C4H2s 0.770 1.880 6.883 55.729 23.426 2.379 possible 186 26 . TYR CG 2 C3H0b 0.770 1.610 0.567 -1.000 9.695 -1.000 bad 187 26 . TYR CD1 5 C3H1s 0.770 1.760 8.777 -1.000 20.057 -1.000 bad 188 26 . TYR CD2 5 C3H1s 0.770 1.760 16.565 -1.000 20.578 -1.000 bad 189 26 . TYR CE1 5 C3H1s 0.770 1.760 12.318 -1.000 20.534 -1.000 bad 190 26 . TYR CE2 5 C3H1s 0.770 1.760 11.105 -1.000 20.577 -1.000 bad 191 26 . TYR CZ 2 C3H0b 0.770 1.610 1.787 -1.000 9.888 -1.000 bad 192 26 . TYR OH 17 O2H1u 0.660 1.460 12.302 -1.000 18.541 -1.000 bad 193 27 . PHE N 12 N3H1s 0.700 1.640 2.957 13.794 13.524 1.020 [OK] 194 27 . PHE CA 3 C4H1s 0.770 1.880 3.295 16.659 13.371 1.246 possible 195 27 . PHE C 1 C3H0s 0.770 1.610 2.181 7.582 8.697 0.872 [OK] 196 27 . PHE O 16 O1H0u 0.660 1.420 2.921 17.006 15.961 1.065 [OK] 197 27 . PHE CB 8 C4H2s 0.770 1.880 3.123 25.672 23.623 1.087 possible 198 27 . PHE CG 2 C3H0b 0.770 1.610 2.860 10.338 9.684 1.068 [OK] 199 27 . PHE CD1 5 C3H1s 0.770 1.760 3.724 29.219 20.325 1.438 possible 200 27 . PHE CD2 6 C3H1b 0.770 1.760 2.996 20.203 20.948 0.964 [OK] 201 27 . PHE CE1 6 C3H1b 0.770 1.760 3.930 31.791 21.532 1.476 possible 202 27 . PHE CE2 6 C3H1b 0.770 1.760 3.378 21.415 21.625 0.990 possible 203 27 . PHE CZ 6 C3H1b 0.770 1.760 3.875 24.346 21.555 1.129 possible 204 28 . LEU N 12 N3H1s 0.700 1.640 2.326 11.962 13.517 0.885 [OK] 205 28 . LEU CA 3 C4H1s 0.770 1.880 3.604 15.156 13.055 1.161 possible 206 28 . LEU C 1 C3H0s 0.770 1.610 3.859 8.875 8.781 1.011 possible 207 28 . LEU O 16 O1H0u 0.660 1.420 5.826 40.059 15.957 2.510 possible 208 28 . LEU CB 8 C4H2s 0.770 1.880 4.678 23.023 22.818 1.009 possible 209 28 . LEU CG 4 C4H1b 0.770 1.880 4.633 20.588 14.704 1.400 possible 210 28 . LEU CD1 10 C4H3u 0.770 1.880 22.320 -1.000 37.235 -1.000 bad 211 28 . LEU CD2 10 C4H3u 0.770 1.880 60.430 -1.000 37.020 -1.000 bad 212 29 . VAL N 12 N3H1s 0.700 1.640 4.000 12.526 13.553 0.924 possible 213 29 . VAL CA 3 C4H1s 0.770 1.880 4.571 17.416 13.078 1.332 possible 214 29 . VAL C 1 C3H0s 0.770 1.610 2.912 8.323 8.528 0.976 [OK] 215 29 . VAL O 16 O1H0u 0.660 1.420 5.221 23.188 15.998 1.449 possible 216 29 . VAL CB 4 C4H1b 0.770 1.880 3.486 15.093 14.514 1.040 possible 217 29 . VAL CG1 10 C4H3u 0.770 1.880 32.835 -1.000 36.320 -1.000 bad 218 29 . VAL CG2 10 C4H3u 0.770 1.880 35.001 -1.000 36.173 -1.000 bad 219 30 . LYS N 12 N3H1s 0.700 1.640 2.843 13.666 13.429 1.018 [OK] 220 30 . LYS CA 3 C4H1s 0.770 1.880 4.104 15.096 13.217 1.142 possible 221 30 . LYS C 1 C3H0s 0.770 1.610 2.271 7.722 8.696 0.888 [OK] 222 30 . LYS O 16 O1H0u 0.660 1.420 6.008 47.081 15.818 2.976 possible 223 30 . LYS CB 8 C4H2s 0.770 1.880 3.333 21.574 22.578 0.956 possible 224 30 . LYS CG 8 C4H2s 0.770 1.880 3.898 37.730 22.847 1.651 possible 225 30 . LYS CD 8 C4H2s 0.770 1.880 6.603 67.332 23.365 2.882 possible 226 30 . LYS CE 9 C4H2b 0.770 1.880 5.613 36.817 23.720 1.552 possible 227 30 . LYS NZ 14 N4H3u 0.700 1.640 46.936 -1.000 21.413 -1.000 bad 228 31 . GLY N 12 N3H1s 0.700 1.640 2.558 12.900 14.480 0.891 [OK] 229 31 . GLY CA 8 C4H2s 0.770 1.880 5.156 34.736 23.470 1.480 possible 230 31 . GLY C 2 C3H0b 0.770 1.610 5.210 15.555 9.652 1.612 possible 231 31 . GLY O 16 O1H0u 0.660 1.420 4.318 22.997 16.154 1.424 possible 232 32 . MET N 12 N3H1s 0.700 1.640 6.091 24.781 13.405 1.849 possible 233 32 . MET CA 3 C4H1s 0.770 1.880 7.539 33.011 13.194 2.502 possible 234 32 . MET C 1 C3H0s 0.770 1.610 3.897 9.044 8.756 1.033 possible 235 32 . MET O 16 O1H0u 0.660 1.420 10.278 -1.000 16.002 -1.000 bad 236 32 . MET CB 8 C4H2s 0.770 1.880 4.837 30.295 23.418 1.294 possible 237 32 . MET CG 9 C4H2b 0.770 1.880 28.427 -1.000 23.830 -1.000 bad 238 32 . MET SD 19 S2H0u 1.040 1.770 40.110 -1.000 30.207 -1.000 bad 239 32 . MET CE 10 C4H3u 0.770 1.880 44.924 -1.000 37.003 -1.000 bad 240 33 . GLY N 12 N3H1s 0.700 1.640 14.027 -1.000 14.480 -1.000 bad 241 33 . GLY CA 8 C4H2s 0.770 1.880 44.119 -1.000 23.470 -1.000 bad 242 33 . GLY C 2 C3H0b 0.770 1.610 1.650 -1.000 9.652 -1.000 bad 243 33 . GLY O 16 O1H0u 0.660 1.420 17.826 -1.000 16.154 -1.000 bad 244 34 . VAL N 12 N3H1s 0.700 1.640 7.165 -1.000 13.553 -1.000 bad 245 34 . VAL CA 3 C4H1s 0.770 1.880 5.215 20.645 13.078 1.579 possible 246 34 . VAL C 1 C3H0s 0.770 1.610 6.501 11.523 8.528 1.351 possible 247 34 . VAL O 16 O1H0u 0.660 1.420 4.864 -1.000 15.998 -1.000 bad 248 34 . VAL CB 4 C4H1b 0.770 1.880 3.274 11.752 14.514 0.810 possible 249 34 . VAL CG1 10 C4H3u 0.770 1.880 4.781 47.743 36.320 1.315 possible 250 34 . VAL CG2 10 C4H3u 0.770 1.880 3.793 37.060 36.173 1.025 possible 251 35 . SER N 12 N3H1s 0.700 1.640 7.701 53.582 13.808 3.881 possible 252 35 . SER CA 3 C4H1s 0.770 1.880 11.705 -1.000 13.351 -1.000 bad 253 35 . SER C 1 C3H0s 0.770 1.610 2.718 8.121 8.858 0.917 [OK] 254 35 . SER O 16 O1H0u 0.660 1.420 23.812 -1.000 15.860 -1.000 bad 255 35 . SER CB 8 C4H2s 0.770 1.880 45.401 -1.000 23.599 -1.000 bad 256 35 . SER OG 17 O2H1u 0.660 1.460 32.794 -1.000 18.021 -1.000 bad 257 36 . ASP N 12 N3H1s 0.700 1.640 2.507 11.134 13.654 0.815 [OK] 258 36 . ASP CA 3 C4H1s 0.770 1.880 3.508 16.276 13.254 1.228 possible 259 36 . ASP C 1 C3H0s 0.770 1.610 3.173 9.998 8.750 1.143 possible 260 36 . ASP O 16 O1H0u 0.660 1.420 2.941 12.714 15.757 0.807 [OK] 261 36 . ASP CB 8 C4H2s 0.770 1.880 2.938 19.670 23.022 0.854 [OK] 262 36 . ASP CG 2 C3H0b 0.770 1.610 2.876 9.255 9.336 0.991 [OK] 263 36 . ASP OD1 16 O1H0u 0.660 1.420 4.317 31.135 15.078 2.065 possible 264 36 . ASP OD2 16 O1H0u 0.660 1.420 3.727 19.416 15.582 1.246 possible 265 37 . PRO N 11 N3H0u 0.700 1.640 2.960 8.518 8.650 0.985 [OK] 266 37 . PRO CA 4 C4H1b 0.770 1.880 3.709 13.348 13.828 0.965 possible 267 37 . PRO C 1 C3H0s 0.770 1.610 3.609 9.142 8.768 1.043 possible 268 37 . PRO O 16 O1H0u 0.660 1.420 5.350 35.756 15.856 2.255 possible 269 37 . PRO CB 9 C4H2b 0.770 1.880 30.458 -1.000 25.314 -1.000 bad 270 37 . PRO CG 9 C4H2b 0.770 1.880 24.190 -1.000 25.480 -1.000 bad 271 37 . PRO CD 8 C4H2s 0.770 1.880 3.256 17.737 23.390 0.758 possible 272 38 . ASP N 12 N3H1s 0.700 1.640 3.275 14.149 13.654 1.036 possible 273 38 . ASP CA 3 C4H1s 0.770 1.880 4.429 23.952 13.254 1.807 possible 274 38 . ASP C 1 C3H0s 0.770 1.610 2.736 8.816 8.750 1.008 [OK] 275 38 . ASP O 16 O1H0u 0.660 1.420 3.004 16.583 15.757 1.052 possible 276 38 . ASP CB 8 C4H2s 0.770 1.880 6.530 49.558 23.022 2.153 possible 277 38 . ASP CG 2 C3H0b 0.770 1.610 4.257 -1.000 9.336 -1.000 bad 278 38 . ASP OD1 16 O1H0u 0.660 1.420 35.357 -1.000 15.078 -1.000 bad 279 38 . ASP OD2 16 O1H0u 0.660 1.420 25.003 -1.000 15.582 -1.000 bad 280 39 . ALA N 12 N3H1s 0.700 1.640 3.124 14.392 13.872 1.038 possible 281 39 . ALA CA 4 C4H1b 0.770 1.880 3.194 14.098 13.959 1.010 possible 282 39 . ALA C 1 C3H0s 0.770 1.610 2.463 8.287 8.858 0.936 [OK] 283 39 . ALA O 16 O1H0u 0.660 1.420 2.439 13.140 16.026 0.820 [OK] 284 39 . ALA CB 10 C4H3u 0.770 1.880 3.221 34.495 36.551 0.944 possible 285 40 . LYS N 12 N3H1s 0.700 1.640 2.713 13.014 13.429 0.969 [OK] 286 40 . LYS CA 3 C4H1s 0.770 1.880 3.240 15.769 13.217 1.193 possible 287 40 . LYS C 1 C3H0s 0.770 1.610 3.247 8.267 8.696 0.951 possible 288 40 . LYS O 16 O1H0u 0.660 1.420 3.526 19.769 15.818 1.250 possible 289 40 . LYS CB 8 C4H2s 0.770 1.880 3.262 19.026 22.578 0.843 possible 290 40 . LYS CG 8 C4H2s 0.770 1.880 6.670 55.508 22.847 2.430 possible 291 40 . LYS CD 8 C4H2s 0.770 1.880 33.295 -1.000 23.365 -1.000 bad 292 40 . LYS CE 9 C4H2b 0.770 1.880 15.857 -1.000 23.720 -1.000 bad 293 40 . LYS NZ 14 N4H3u 0.700 1.640 32.785 -1.000 21.413 -1.000 bad 294 41 . LYS N 12 N3H1s 0.700 1.640 3.711 14.205 13.429 1.058 possible 295 41 . LYS CA 3 C4H1s 0.770 1.880 5.721 26.816 13.217 2.029 possible 296 41 . LYS C 1 C3H0s 0.770 1.610 2.745 8.427 8.696 0.969 [OK] 297 41 . LYS O 16 O1H0u 0.660 1.420 3.660 18.081 15.818 1.143 possible 298 41 . LYS CB 8 C4H2s 0.770 1.880 4.152 22.916 22.578 1.015 possible 299 41 . LYS CG 8 C4H2s 0.770 1.880 6.515 55.123 22.847 2.413 possible 300 41 . LYS CD 8 C4H2s 0.770 1.880 5.831 49.768 23.365 2.130 possible 301 41 . LYS CE 9 C4H2b 0.770 1.880 29.740 -1.000 23.720 -1.000 bad 302 41 . LYS NZ 14 N4H3u 0.700 1.640 55.004 -1.000 21.413 -1.000 bad 303 42 . PHE N 12 N3H1s 0.700 1.640 3.181 13.299 13.524 0.983 possible 304 42 . PHE CA 3 C4H1s 0.770 1.880 3.403 16.597 13.371 1.241 possible 305 42 . PHE C 1 C3H0s 0.770 1.610 2.677 8.360 8.697 0.961 [OK] 306 42 . PHE O 16 O1H0u 0.660 1.420 2.715 15.733 15.961 0.986 [OK] 307 42 . PHE CB 8 C4H2s 0.770 1.880 3.257 24.482 23.623 1.036 possible 308 42 . PHE CG 2 C3H0b 0.770 1.610 3.128 9.409 9.684 0.972 possible 309 42 . PHE CD1 5 C3H1s 0.770 1.760 3.245 18.924 20.325 0.931 possible 310 42 . PHE CD2 6 C3H1b 0.770 1.760 3.251 20.728 20.948 0.989 possible 311 42 . PHE CE1 6 C3H1b 0.770 1.760 4.863 41.824 21.532 1.942 possible 312 42 . PHE CE2 6 C3H1b 0.770 1.760 3.098 19.338 21.625 0.894 possible 313 42 . PHE CZ 6 C3H1b 0.770 1.760 4.728 31.750 21.555 1.473 possible 314 43 . TYR N 12 N3H1s 0.700 1.640 2.657 13.305 13.473 0.988 [OK] 315 43 . TYR CA 3 C4H1s 0.770 1.880 2.800 12.537 13.249 0.946 [OK] 316 43 . TYR C 1 C3H0s 0.770 1.610 3.121 8.821 8.714 1.012 possible 317 43 . TYR O 16 O1H0u 0.660 1.420 2.659 14.297 15.901 0.899 [OK] 318 43 . TYR CB 8 C4H2s 0.770 1.880 4.713 31.938 23.426 1.363 possible 319 43 . TYR CG 2 C3H0b 0.770 1.610 2.739 9.415 9.695 0.971 [OK] 320 43 . TYR CD1 5 C3H1s 0.770 1.760 3.263 22.421 20.057 1.118 possible 321 43 . TYR CD2 5 C3H1s 0.770 1.760 3.173 25.236 20.578 1.226 possible 322 43 . TYR CE1 5 C3H1s 0.770 1.760 3.059 19.034 20.534 0.927 possible 323 43 . TYR CE2 5 C3H1s 0.770 1.760 3.233 25.411 20.577 1.235 possible 324 43 . TYR CZ 2 C3H0b 0.770 1.610 2.312 9.305 9.888 0.941 [OK] 325 43 . TYR OH 17 O2H1u 0.660 1.460 4.572 39.403 18.541 2.125 possible 326 44 . ALA N 12 N3H1s 0.700 1.640 4.591 17.664 13.872 1.273 possible 327 44 . ALA CA 4 C4H1b 0.770 1.880 6.707 28.445 13.959 2.038 possible 328 44 . ALA C 1 C3H0s 0.770 1.610 3.687 8.867 8.858 1.001 possible 329 44 . ALA O 16 O1H0u 0.660 1.420 4.182 20.347 16.026 1.270 possible 330 44 . ALA CB 10 C4H3u 0.770 1.880 50.198 -1.000 36.551 -1.000 bad 331 45 . ILE N 12 N3H1s 0.700 1.640 3.967 14.375 13.493 1.065 possible 332 45 . ILE CA 3 C4H1s 0.770 1.880 4.134 18.800 12.946 1.452 possible 333 45 . ILE C 1 C3H0s 0.770 1.610 2.289 7.538 8.445 0.893 [OK] 334 45 . ILE O 16 O1H0u 0.660 1.420 2.564 14.277 15.930 0.896 [OK] 335 45 . ILE CB 4 C4H1b 0.770 1.880 2.904 13.270 14.146 0.938 [OK] 336 45 . ILE CG1 9 C4H2b 0.770 1.880 6.964 60.633 24.071 2.519 possible 337 45 . ILE CG2 10 C4H3u 0.770 1.880 3.259 40.625 35.763 1.136 possible 338 45 . ILE CD1 10 C4H3u 0.770 1.880 4.735 58.650 38.219 1.535 possible 339 46 . THR N 12 N3H1s 0.700 1.640 2.728 13.119 13.544 0.969 [OK] 340 46 . THR CA 3 C4H1s 0.770 1.880 3.344 14.276 13.025 1.096 possible 341 46 . THR C 1 C3H0s 0.770 1.610 2.849 8.835 8.685 1.017 [OK] 342 46 . THR O 16 O1H0u 0.660 1.420 2.792 11.579 15.795 0.733 [OK] 343 46 . THR CB 4 C4H1b 0.770 1.880 3.108 15.776 14.687 1.074 possible 344 46 . THR OG1 17 O2H1u 0.660 1.460 2.746 19.178 17.610 1.089 [OK] 345 46 . THR CG2 10 C4H3u 0.770 1.880 3.552 50.253 36.265 1.386 possible 346 47 . THR N 12 N3H1s 0.700 1.640 2.920 14.110 13.544 1.042 [OK] 347 47 . THR CA 3 C4H1s 0.770 1.880 3.009 15.763 13.025 1.210 possible 348 47 . THR C 1 C3H0s 0.770 1.610 3.801 8.707 8.685 1.003 possible 349 47 . THR O 16 O1H0u 0.660 1.420 3.620 18.733 15.795 1.186 possible 350 47 . THR CB 4 C4H1b 0.770 1.880 4.945 28.267 14.687 1.925 possible 351 47 . THR OG1 17 O2H1u 0.660 1.460 5.625 35.591 17.610 2.021 possible 352 47 . THR CG2 10 C4H3u 0.770 1.880 5.263 51.661 36.265 1.425 possible 353 48 . LEU N 12 N3H1s 0.700 1.640 3.615 14.610 13.517 1.081 possible 354 48 . LEU CA 3 C4H1s 0.770 1.880 3.674 12.915 13.055 0.989 possible 355 48 . LEU C 1 C3H0s 0.770 1.610 2.681 8.701 8.781 0.991 [OK] 356 48 . LEU O 16 O1H0u 0.660 1.420 2.509 14.512 15.957 0.909 [OK] 357 48 . LEU CB 8 C4H2s 0.770 1.880 3.033 22.508 22.818 0.986 possible 358 48 . LEU CG 4 C4H1b 0.770 1.880 7.943 38.230 14.704 2.600 possible 359 48 . LEU CD1 10 C4H3u 0.770 1.880 46.202 -1.000 37.235 -1.000 bad 360 48 . LEU CD2 10 C4H3u 0.770 1.880 40.578 -1.000 37.020 -1.000 bad 361 49 . VAL N 12 N3H1s 0.700 1.640 2.707 11.947 13.553 0.881 [OK] 362 49 . VAL CA 3 C4H1s 0.770 1.880 3.101 15.830 13.078 1.210 possible 363 49 . VAL C 1 C3H0s 0.770 1.610 2.608 7.893 8.528 0.925 [OK] 364 49 . VAL O 16 O1H0u 0.660 1.420 2.431 16.660 15.998 1.041 [OK] 365 49 . VAL CB 4 C4H1b 0.770 1.880 3.581 15.361 14.514 1.058 possible 366 49 . VAL CG1 10 C4H3u 0.770 1.880 3.577 40.662 36.320 1.120 possible 367 49 . VAL CG2 10 C4H3u 0.770 1.880 3.401 38.556 36.173 1.066 possible 368 50 . PRO N 11 N3H0u 0.700 1.640 2.649 8.609 8.650 0.995 [OK] 369 50 . PRO CA 4 C4H1b 0.770 1.880 2.998 16.338 13.828 1.181 [OK] 370 50 . PRO C 1 C3H0s 0.770 1.610 2.332 8.183 8.768 0.933 [OK] 371 50 . PRO O 16 O1H0u 0.660 1.420 2.383 15.120 15.856 0.954 [OK] 372 50 . PRO CB 9 C4H2b 0.770 1.880 3.244 29.939 25.314 1.183 possible 373 50 . PRO CG 9 C4H2b 0.770 1.880 3.468 32.622 25.480 1.280 possible 374 50 . PRO CD 8 C4H2s 0.770 1.880 3.526 18.770 23.390 0.802 possible 375 51 . ALA N 12 N3H1s 0.700 1.640 2.285 12.636 13.872 0.911 [OK] 376 51 . ALA CA 4 C4H1b 0.770 1.880 3.720 17.243 13.959 1.235 possible 377 51 . ALA C 1 C3H0s 0.770 1.610 3.219 8.841 8.858 0.998 possible 378 51 . ALA O 16 O1H0u 0.660 1.420 3.363 14.776 16.026 0.922 possible 379 51 . ALA CB 10 C4H3u 0.770 1.880 27.566 -1.000 36.551 -1.000 bad 380 52 . ILE N 12 N3H1s 0.700 1.640 3.941 14.451 13.493 1.071 possible 381 52 . ILE CA 3 C4H1s 0.770 1.880 3.815 14.916 12.946 1.152 possible 382 52 . ILE C 1 C3H0s 0.770 1.610 2.417 7.513 8.445 0.890 [OK] 383 52 . ILE O 16 O1H0u 0.660 1.420 2.510 12.900 15.930 0.810 [OK] 384 52 . ILE CB 4 C4H1b 0.770 1.880 2.764 13.289 14.146 0.939 [OK] 385 52 . ILE CG1 9 C4H2b 0.770 1.880 9.564 -1.000 24.071 -1.000 bad 386 52 . ILE CG2 10 C4H3u 0.770 1.880 6.931 57.704 35.763 1.614 possible 387 52 . ILE CD1 10 C4H3u 0.770 1.880 16.039 -1.000 38.219 -1.000 bad 388 53 . ALA N 12 N3H1s 0.700 1.640 2.608 13.996 13.872 1.009 [OK] 389 53 . ALA CA 4 C4H1b 0.770 1.880 3.366 16.879 13.959 1.209 possible 390 53 . ALA C 1 C3H0s 0.770 1.610 2.176 8.206 8.858 0.926 [OK] 391 53 . ALA O 16 O1H0u 0.660 1.420 3.044 18.355 16.026 1.145 possible 392 53 . ALA CB 10 C4H3u 0.770 1.880 3.624 39.517 36.551 1.081 possible 393 54 . PHE N 12 N3H1s 0.700 1.640 2.298 11.739 13.524 0.868 [OK] 394 54 . PHE CA 3 C4H1s 0.770 1.880 3.084 15.210 13.371 1.138 possible 395 54 . PHE C 1 C3H0s 0.770 1.610 2.167 7.640 8.697 0.878 [OK] 396 54 . PHE O 16 O1H0u 0.660 1.420 2.445 15.473 15.961 0.969 [OK] 397 54 . PHE CB 8 C4H2s 0.770 1.880 3.027 23.468 23.623 0.993 possible 398 54 . PHE CG 2 C3H0b 0.770 1.610 2.914 9.503 9.684 0.981 [OK] 399 54 . PHE CD1 5 C3H1s 0.770 1.760 3.853 25.169 20.325 1.238 possible 400 54 . PHE CD2 6 C3H1b 0.770 1.760 4.484 32.767 20.948 1.564 possible 401 54 . PHE CE1 6 C3H1b 0.770 1.760 12.721 -1.000 21.532 -1.000 bad 402 54 . PHE CE2 6 C3H1b 0.770 1.760 30.453 -1.000 21.625 -1.000 bad 403 54 . PHE CZ 6 C3H1b 0.770 1.760 32.549 -1.000 21.555 -1.000 bad 404 55 . THR N 12 N3H1s 0.700 1.640 2.288 11.038 13.544 0.815 [OK] 405 55 . THR CA 3 C4H1s 0.770 1.880 4.857 21.422 13.025 1.645 possible 406 55 . THR C 1 C3H0s 0.770 1.610 2.528 7.665 8.685 0.883 [OK] 407 55 . THR O 16 O1H0u 0.660 1.420 6.325 27.648 15.795 1.750 possible 408 55 . THR CB 4 C4H1b 0.770 1.880 19.319 -1.000 14.687 -1.000 bad 409 55 . THR OG1 17 O2H1u 0.660 1.460 13.454 -1.000 17.610 -1.000 bad 410 55 . THR CG2 10 C4H3u 0.770 1.880 23.654 -1.000 36.265 -1.000 bad 411 56 . MET N 12 N3H1s 0.700 1.640 2.546 11.911 13.405 0.889 [OK] 412 56 . MET CA 3 C4H1s 0.770 1.880 3.328 15.947 13.194 1.209 possible 413 56 . MET C 1 C3H0s 0.770 1.610 2.787 8.522 8.756 0.973 [OK] 414 56 . MET O 16 O1H0u 0.660 1.420 2.798 15.944 16.002 0.996 [OK] 415 56 . MET CB 8 C4H2s 0.770 1.880 3.483 28.871 23.418 1.233 possible 416 56 . MET CG 9 C4H2b 0.770 1.880 3.048 20.028 23.830 0.840 possible 417 56 . MET SD 19 S2H0u 1.040 1.770 3.501 33.780 30.207 1.118 possible 418 56 . MET CE 10 C4H3u 0.770 1.880 44.522 -1.000 37.003 -1.000 bad 419 57 . TYR N 12 N3H1s 0.700 1.640 3.338 14.705 13.473 1.091 possible 420 57 . TYR CA 3 C4H1s 0.770 1.880 2.768 12.718 13.249 0.960 [OK] 421 57 . TYR C 1 C3H0s 0.770 1.610 2.347 8.342 8.714 0.957 [OK] 422 57 . TYR O 16 O1H0u 0.660 1.420 2.633 18.723 15.901 1.177 [OK] 423 57 . TYR CB 8 C4H2s 0.770 1.880 2.955 23.126 23.426 0.987 [OK] 424 57 . TYR CG 2 C3H0b 0.770 1.610 3.008 11.047 9.695 1.139 possible 425 57 . TYR CD1 5 C3H1s 0.770 1.760 2.986 20.714 20.057 1.033 [OK] 426 57 . TYR CD2 5 C3H1s 0.770 1.760 3.444 25.026 20.578 1.216 possible 427 57 . TYR CE1 5 C3H1s 0.770 1.760 2.916 19.604 20.534 0.955 [OK] 428 57 . TYR CE2 5 C3H1s 0.770 1.760 3.489 29.785 20.577 1.447 possible 429 57 . TYR CZ 2 C3H0b 0.770 1.610 3.346 11.738 9.888 1.187 possible 430 57 . TYR OH 17 O2H1u 0.660 1.460 2.970 25.948 18.541 1.399 [OK] 431 58 . LEU N 12 N3H1s 0.700 1.640 2.429 12.490 13.517 0.924 [OK] 432 58 . LEU CA 3 C4H1s 0.770 1.880 2.970 14.216 13.055 1.089 [OK] 433 58 . LEU C 1 C3H0s 0.770 1.610 2.485 8.007 8.781 0.912 [OK] 434 58 . LEU O 16 O1H0u 0.660 1.420 2.210 11.659 15.957 0.731 [OK] 435 58 . LEU CB 8 C4H2s 0.770 1.880 5.981 31.450 22.818 1.378 possible 436 58 . LEU CG 4 C4H1b 0.770 1.880 14.982 -1.000 14.704 -1.000 bad 437 58 . LEU CD1 10 C4H3u 0.770 1.880 14.503 -1.000 37.235 -1.000 bad 438 58 . LEU CD2 10 C4H3u 0.770 1.880 28.597 -1.000 37.020 -1.000 bad 439 59 . SER N 12 N3H1s 0.700 1.640 5.149 18.452 13.808 1.336 possible 440 59 . SER CA 3 C4H1s 0.770 1.880 6.426 25.927 13.351 1.942 possible 441 59 . SER C 1 C3H0s 0.770 1.610 2.125 7.218 8.858 0.815 [OK] 442 59 . SER O 16 O1H0u 0.660 1.420 2.713 14.643 15.860 0.923 [OK] 443 59 . SER CB 8 C4H2s 0.770 1.880 19.502 -1.000 23.599 -1.000 bad 444 59 . SER OG 17 O2H1u 0.660 1.460 3.310 24.374 18.021 1.353 possible 445 60 . MET N 12 N3H1s 0.700 1.640 2.431 11.774 13.405 0.878 [OK] 446 60 . MET CA 3 C4H1s 0.770 1.880 2.875 12.195 13.194 0.924 [OK] 447 60 . MET C 1 C3H0s 0.770 1.610 2.435 8.417 8.756 0.961 [OK] 448 60 . MET O 16 O1H0u 0.660 1.420 3.132 27.716 16.002 1.732 possible 449 60 . MET CB 8 C4H2s 0.770 1.880 2.937 21.742 23.418 0.928 [OK] 450 60 . MET CG 9 C4H2b 0.770 1.880 3.136 22.563 23.830 0.947 possible 451 60 . MET SD 19 S2H0u 1.040 1.770 2.933 28.696 30.207 0.950 [OK] 452 60 . MET CE 10 C4H3u 0.770 1.880 3.596 46.166 37.003 1.248 possible 453 61 . LEU N 12 N3H1s 0.700 1.640 2.579 12.246 13.517 0.906 [OK] 454 61 . LEU CA 3 C4H1s 0.770 1.880 3.058 14.649 13.055 1.122 possible 455 61 . LEU C 1 C3H0s 0.770 1.610 2.506 7.862 8.781 0.895 [OK] 456 61 . LEU O 16 O1H0u 0.660 1.420 3.116 22.073 15.957 1.383 possible 457 61 . LEU CB 8 C4H2s 0.770 1.880 3.125 22.743 22.818 0.997 possible 458 61 . LEU CG 4 C4H1b 0.770 1.880 2.981 14.182 14.704 0.965 [OK] 459 61 . LEU CD1 10 C4H3u 0.770 1.880 3.503 35.909 37.235 0.964 possible 460 61 . LEU CD2 10 C4H3u 0.770 1.880 16.845 -1.000 37.020 -1.000 bad 461 62 . LEU N 12 N3H1s 0.700 1.640 2.334 11.729 13.517 0.868 [OK] 462 62 . LEU CA 3 C4H1s 0.770 1.880 3.586 15.299 13.055 1.172 possible 463 62 . LEU C 1 C3H0s 0.770 1.610 4.427 11.743 8.781 1.337 possible 464 62 . LEU O 16 O1H0u 0.660 1.420 5.076 36.630 15.957 2.296 possible 465 62 . LEU CB 8 C4H2s 0.770 1.880 6.609 43.567 22.818 1.909 possible 466 62 . LEU CG 4 C4H1b 0.770 1.880 2.831 13.459 14.704 0.915 [OK] 467 62 . LEU CD1 10 C4H3u 0.770 1.880 16.027 -1.000 37.235 -1.000 bad 468 62 . LEU CD2 10 C4H3u 0.770 1.880 36.895 -1.000 37.020 -1.000 bad 469 63 . GLY N 12 N3H1s 0.700 1.640 5.500 24.627 14.480 1.701 possible 470 63 . GLY CA 8 C4H2s 0.770 1.880 35.808 -1.000 23.470 -1.000 bad 471 63 . GLY C 2 C3H0b 0.770 1.610 4.689 12.893 9.652 1.336 possible 472 63 . GLY O 16 O1H0u 0.660 1.420 16.188 -1.000 16.154 -1.000 bad 473 64 . TYR N 12 N3H1s 0.700 1.640 5.082 22.113 13.473 1.641 possible 474 64 . TYR CA 3 C4H1s 0.770 1.880 4.066 15.519 13.249 1.171 possible 475 64 . TYR C 1 C3H0s 0.770 1.610 2.499 8.990 8.714 1.032 [OK] 476 64 . TYR O 16 O1H0u 0.660 1.420 3.006 16.630 15.901 1.046 possible 477 64 . TYR CB 8 C4H2s 0.770 1.880 5.592 26.586 23.426 1.135 possible 478 64 . TYR CG 2 C3H0b 0.770 1.610 0.517 -1.000 9.695 -1.000 bad 479 64 . TYR CD1 5 C3H1s 0.770 1.760 18.397 -1.000 20.057 -1.000 bad 480 64 . TYR CD2 5 C3H1s 0.770 1.760 13.598 -1.000 20.578 -1.000 bad 481 64 . TYR CE1 5 C3H1s 0.770 1.760 35.340 -1.000 20.534 -1.000 bad 482 64 . TYR CE2 5 C3H1s 0.770 1.760 28.158 -1.000 20.577 -1.000 bad 483 64 . TYR CZ 2 C3H0b 0.770 1.610 3.520 -1.000 9.888 -1.000 bad 484 64 . TYR OH 17 O2H1u 0.660 1.460 48.464 -1.000 18.541 -1.000 bad 485 65 . GLY N 12 N3H1s 0.700 1.640 3.725 17.215 14.480 1.189 possible 486 65 . GLY CA 8 C4H2s 0.770 1.880 2.865 20.612 23.470 0.878 [OK] 487 65 . GLY C 2 C3H0b 0.770 1.610 3.066 10.374 9.652 1.075 possible 488 65 . GLY O 16 O1H0u 0.660 1.420 2.373 14.108 16.154 0.873 [OK] 489 66 . LEU N 12 N3H1s 0.700 1.640 3.091 19.509 13.517 1.443 possible 490 66 . LEU CA 3 C4H1s 0.770 1.880 2.561 12.440 13.055 0.953 [OK] 491 66 . LEU C 1 C3H0s 0.770 1.610 2.246 8.099 8.781 0.922 [OK] 492 66 . LEU O 16 O1H0u 0.660 1.420 7.339 76.334 15.957 4.784 possible 493 66 . LEU CB 8 C4H2s 0.770 1.880 3.780 31.664 22.818 1.388 possible 494 66 . LEU CG 4 C4H1b 0.770 1.880 2.996 13.539 14.704 0.921 [OK] 495 66 . LEU CD1 10 C4H3u 0.770 1.880 5.859 64.962 37.235 1.745 possible 496 66 . LEU CD2 10 C4H3u 0.770 1.880 32.014 -1.000 37.020 -1.000 bad 497 67 . THR N 12 N3H1s 0.700 1.640 2.781 14.643 13.544 1.081 [OK] 498 67 . THR CA 3 C4H1s 0.770 1.880 4.761 18.833 13.025 1.446 possible 499 67 . THR C 1 C3H0s 0.770 1.610 3.562 12.409 8.685 1.429 possible 500 67 . THR O 16 O1H0u 0.660 1.420 3.270 20.890 15.795 1.323 possible 501 67 . THR CB 4 C4H1b 0.770 1.880 3.238 16.186 14.687 1.102 possible 502 67 . THR OG1 17 O2H1u 0.660 1.460 5.496 35.996 17.610 2.044 possible 503 67 . THR CG2 10 C4H3u 0.770 1.880 58.930 -1.000 36.265 -1.000 bad 504 68 . MET N 12 N3H1s 0.700 1.640 3.488 16.980 13.405 1.267 possible 505 68 . MET CA 3 C4H1s 0.770 1.880 2.868 12.352 13.194 0.936 [OK] 506 68 . MET C 1 C3H0s 0.770 1.610 3.530 10.908 8.756 1.246 possible 507 68 . MET O 16 O1H0u 0.660 1.420 7.037 35.472 16.002 2.217 possible 508 68 . MET CB 8 C4H2s 0.770 1.880 6.314 34.928 23.418 1.492 possible 509 68 . MET CG 9 C4H2b 0.770 1.880 4.196 36.115 23.830 1.516 possible 510 68 . MET SD 19 S2H0u 1.040 1.770 17.436 -1.000 30.207 -1.000 bad 511 68 . MET CE 10 C4H3u 0.770 1.880 71.736 -1.000 37.003 -1.000 bad 512 69 . VAL N 12 N3H1s 0.700 1.640 3.600 15.886 13.553 1.172 possible 513 69 . VAL CA 3 C4H1s 0.770 1.880 4.771 17.502 13.078 1.338 possible 514 69 . VAL C 1 C3H0s 0.770 1.610 2.478 8.335 8.528 0.977 [OK] 515 69 . VAL O 16 O1H0u 0.660 1.420 2.229 13.286 15.998 0.830 [OK] 516 69 . VAL CB 4 C4H1b 0.770 1.880 2.836 13.202 14.514 0.910 [OK] 517 69 . VAL CG1 10 C4H3u 0.770 1.880 4.129 31.246 36.320 0.860 possible 518 69 . VAL CG2 10 C4H3u 0.770 1.880 4.869 48.150 36.173 1.331 possible 519 70 . PRO N 11 N3H0u 0.700 1.640 2.504 8.665 8.650 1.002 [OK] 520 70 . PRO CA 4 C4H1b 0.770 1.880 2.620 12.286 13.828 0.888 [OK] 521 70 . PRO C 1 C3H0s 0.770 1.610 3.692 10.126 8.768 1.155 possible 522 70 . PRO O 16 O1H0u 0.660 1.420 7.965 46.398 15.856 2.926 possible 523 70 . PRO CB 9 C4H2b 0.770 1.880 14.375 -1.000 25.314 -1.000 bad 524 70 . PRO CG 9 C4H2b 0.770 1.880 28.562 -1.000 25.480 -1.000 bad 525 70 . PRO CD 8 C4H2s 0.770 1.880 6.985 42.234 23.390 1.806 possible 526 71 . PHE N 12 N3H1s 0.700 1.640 3.455 14.456 13.524 1.069 possible 527 71 . PHE CA 3 C4H1s 0.770 1.880 4.571 19.188 13.371 1.435 possible 528 71 . PHE C 1 C3H0s 0.770 1.610 3.347 9.828 8.697 1.130 possible 529 71 . PHE O 16 O1H0u 0.660 1.420 5.963 33.264 15.961 2.084 possible 530 71 . PHE CB 8 C4H2s 0.770 1.880 2.558 19.496 23.623 0.825 [OK] 531 71 . PHE CG 2 C3H0b 0.770 1.610 2.162 8.302 9.684 0.857 [OK] 532 71 . PHE CD1 5 C3H1s 0.770 1.760 4.444 27.424 20.325 1.349 possible 533 71 . PHE CD2 6 C3H1b 0.770 1.760 2.703 17.558 20.948 0.838 [OK] 534 71 . PHE CE1 6 C3H1b 0.770 1.760 3.968 20.354 21.532 0.945 possible 535 71 . PHE CE2 6 C3H1b 0.770 1.760 2.740 16.172 21.625 0.748 [OK] 536 71 . PHE CZ 6 C3H1b 0.770 1.760 2.702 15.195 21.555 0.705 [OK] 537 72 . GLY N 12 N3H1s 0.700 1.640 5.394 34.355 14.480 2.373 possible 538 72 . GLY CA 8 C4H2s 0.770 1.880 7.504 65.939 23.470 2.810 possible 539 72 . GLY C 2 C3H0b 0.770 1.610 7.093 22.597 9.652 2.341 possible 540 72 . GLY O 16 O1H0u 0.660 1.420 36.743 -1.000 16.154 -1.000 bad 541 73 . GLY N 12 N3H1s 0.700 1.640 6.282 25.212 14.480 1.741 possible 542 73 . GLY CA 8 C4H2s 0.770 1.880 37.244 -1.000 23.470 -1.000 bad 543 73 . GLY C 2 C3H0b 0.770 1.610 2.180 -1.000 9.652 -1.000 bad 544 73 . GLY O 16 O1H0u 0.660 1.420 26.253 -1.000 16.154 -1.000 bad 545 74 . GLU N 12 N3H1s 0.700 1.640 5.326 -1.000 13.461 -1.000 bad 546 74 . GLU CA 3 C4H1s 0.770 1.880 12.620 -1.000 13.284 -1.000 bad 547 74 . GLU C 1 C3H0s 0.770 1.610 5.050 12.917 8.631 1.497 possible 548 74 . GLU O 16 O1H0u 0.660 1.420 5.115 20.615 15.765 1.308 possible 549 74 . GLU CB 8 C4H2s 0.770 1.880 5.382 41.036 23.214 1.768 possible 550 74 . GLU CG 8 C4H2s 0.770 1.880 5.528 51.820 23.304 2.224 possible 551 74 . GLU CD 2 C3H0b 0.770 1.610 3.633 -1.000 9.437 -1.000 bad 552 74 . GLU OE1 16 O1H0u 0.660 1.420 41.530 -1.000 15.497 -1.000 bad 553 74 . GLU OE2 16 O1H0u 0.660 1.420 44.613 -1.000 16.213 -1.000 bad 554 75 . GLN N 12 N3H1s 0.700 1.640 4.716 19.171 13.449 1.425 possible 555 75 . GLN CA 3 C4H1s 0.770 1.880 2.895 13.571 13.231 1.026 [OK] 556 75 . GLN C 1 C3H0s 0.770 1.610 2.929 10.464 8.744 1.197 [OK] 557 75 . GLN O 16 O1H0u 0.660 1.420 19.083 -1.000 15.767 -1.000 bad 558 75 . GLN CB 8 C4H2s 0.770 1.880 16.790 -1.000 23.059 -1.000 bad 559 75 . GLN CG 8 C4H2s 0.770 1.880 24.607 -1.000 23.218 -1.000 bad 560 75 . GLN CD 2 C3H0b 0.770 1.610 2.029 -1.000 9.618 -1.000 bad 561 75 . GLN OE1 16 O1H0u 0.660 1.420 23.823 -1.000 16.571 -1.000 bad 562 75 . GLN NE2 15 N3H2u 0.700 1.640 18.247 -1.000 23.255 -1.000 bad 563 76 . ASN N 12 N3H1s 0.700 1.640 2.680 14.574 13.525 1.078 [OK] 564 76 . ASN CA 3 C4H1s 0.770 1.880 3.639 13.176 13.052 1.010 possible 565 76 . ASN C 1 C3H0s 0.770 1.610 3.129 9.774 8.853 1.104 possible 566 76 . ASN O 16 O1H0u 0.660 1.420 2.645 17.288 15.857 1.090 [OK] 567 76 . ASN CB 8 C4H2s 0.770 1.880 2.481 16.684 22.756 0.733 [OK] 568 76 . ASN CG 2 C3H0b 0.770 1.610 2.985 8.795 9.537 0.922 [OK] 569 76 . ASN OD1 16 O1H0u 0.660 1.420 5.025 50.350 16.247 3.099 possible 570 76 . ASN ND2 15 N3H2u 0.700 1.640 3.055 23.490 22.525 1.043 possible 571 77 . PRO N 11 N3H0u 0.700 1.640 3.285 9.662 8.650 1.117 possible 572 77 . PRO CA 4 C4H1b 0.770 1.880 3.005 15.674 13.828 1.133 possible 573 77 . PRO C 1 C3H0s 0.770 1.610 2.654 9.832 8.768 1.121 [OK] 574 77 . PRO O 16 O1H0u 0.660 1.420 3.614 26.363 15.856 1.663 possible 575 77 . PRO CB 9 C4H2b 0.770 1.880 6.847 60.630 25.314 2.395 possible 576 77 . PRO CG 9 C4H2b 0.770 1.880 21.972 -1.000 25.480 -1.000 bad 577 77 . PRO CD 8 C4H2s 0.770 1.880 6.514 39.155 23.390 1.674 possible 578 78 . ILE N 12 N3H1s 0.700 1.640 2.854 16.149 13.493 1.197 [OK] 579 78 . ILE CA 3 C4H1s 0.770 1.880 3.923 13.982 12.946 1.080 possible 580 78 . ILE C 1 C3H0s 0.770 1.610 2.562 9.050 8.445 1.072 [OK] 581 78 . ILE O 16 O1H0u 0.660 1.420 2.998 19.927 15.930 1.251 [OK] 582 78 . ILE CB 4 C4H1b 0.770 1.880 3.568 20.775 14.146 1.469 possible 583 78 . ILE CG1 9 C4H2b 0.770 1.880 3.112 26.216 24.071 1.089 possible 584 78 . ILE CG2 10 C4H3u 0.770 1.880 4.070 57.676 35.763 1.613 possible 585 78 . ILE CD1 10 C4H3u 0.770 1.880 3.360 34.138 38.219 0.893 possible 586 79 . TYR N 12 N3H1s 0.700 1.640 3.899 23.613 13.473 1.753 possible 587 79 . TYR CA 3 C4H1s 0.770 1.880 2.469 10.960 13.249 0.827 [OK] 588 79 . TYR C 1 C3H0s 0.770 1.610 2.829 9.406 8.714 1.079 [OK] 589 79 . TYR O 16 O1H0u 0.660 1.420 2.743 14.734 15.901 0.927 [OK] 590 79 . TYR CB 8 C4H2s 0.770 1.880 4.112 28.156 23.426 1.202 possible 591 79 . TYR CG 2 C3H0b 0.770 1.610 3.719 14.415 9.695 1.487 possible 592 79 . TYR CD1 5 C3H1s 0.770 1.760 3.815 24.025 20.057 1.198 possible 593 79 . TYR CD2 5 C3H1s 0.770 1.760 3.650 22.538 20.578 1.095 possible 594 79 . TYR CE1 5 C3H1s 0.770 1.760 3.638 26.098 20.534 1.271 possible 595 79 . TYR CE2 5 C3H1s 0.770 1.760 3.282 23.895 20.577 1.161 possible 596 79 . TYR CZ 2 C3H0b 0.770 1.610 3.129 13.038 9.888 1.319 possible 597 79 . TYR OH 17 O2H1u 0.660 1.460 3.401 33.803 18.541 1.823 possible 598 80 . TRP N 12 N3H1s 0.700 1.640 3.154 16.406 13.639 1.203 possible 599 80 . TRP CA 3 C4H1s 0.770 1.880 3.280 12.003 13.323 0.901 possible 600 80 . TRP C 1 C3H0s 0.770 1.610 2.126 7.802 8.687 0.898 [OK] 601 80 . TRP O 16 O1H0u 0.660 1.420 3.287 15.829 15.797 1.002 possible 602 80 . TRP CB 8 C4H2s 0.770 1.880 4.146 37.163 23.826 1.560 possible 603 80 . TRP CG 2 C3H0b 0.770 1.610 4.614 13.797 9.915 1.391 possible 604 80 . TRP CD1 5 C3H1s 0.770 1.760 4.840 21.522 20.597 1.045 possible 605 80 . TRP CD2 2 C3H0b 0.770 1.610 5.955 16.428 10.068 1.632 possible 606 80 . TRP NE1 13 N3H1b 0.700 1.640 5.287 32.760 16.723 1.959 possible 607 80 . TRP CE2 2 C3H0b 0.770 1.610 6.580 18.751 9.848 1.904 possible 608 80 . TRP CE3 6 C3H1b 0.770 1.760 6.224 44.990 20.383 2.207 possible 609 80 . TRP CZ2 6 C3H1b 0.770 1.760 13.454 -1.000 20.931 -1.000 bad 610 80 . TRP CZ3 6 C3H1b 0.770 1.760 20.541 -1.000 21.429 -1.000 bad 611 80 . TRP CH2 6 C3H1b 0.770 1.760 10.891 -1.000 21.219 -1.000 bad 612 81 . ALA N 12 N3H1s 0.700 1.640 2.448 12.202 13.872 0.880 [OK] 613 81 . ALA CA 4 C4H1b 0.770 1.880 3.408 16.083 13.959 1.152 possible 614 81 . ALA C 1 C3H0s 0.770 1.610 2.918 8.552 8.858 0.966 [OK] 615 81 . ALA O 16 O1H0u 0.660 1.420 2.817 17.345 16.026 1.082 [OK] 616 81 . ALA CB 10 C4H3u 0.770 1.880 3.585 40.901 36.551 1.119 possible 617 82 . ARG N 12 N3H1s 0.700 1.640 2.934 14.117 13.486 1.047 [OK] 618 82 . ARG CA 3 C4H1s 0.770 1.880 3.075 13.452 13.310 1.011 possible 619 82 . ARG C 1 C3H0s 0.770 1.610 2.479 8.194 8.779 0.933 [OK] 620 82 . ARG O 16 O1H0u 0.660 1.420 2.275 13.482 15.916 0.847 [OK] 621 82 . ARG CB 8 C4H2s 0.770 1.880 2.990 19.646 22.833 0.860 [OK] 622 82 . ARG CG 8 C4H2s 0.770 1.880 2.998 20.435 23.273 0.878 [OK] 623 82 . ARG CD 8 C4H2s 0.770 1.880 3.743 31.639 22.849 1.385 possible 624 82 . ARG NE 13 N3H1b 0.700 1.640 3.776 26.234 15.019 1.747 possible 625 82 . ARG CZ 2 C3H0b 0.770 1.610 2.607 10.005 9.678 1.034 [OK] 626 82 . ARG NH1 15 N3H2u 0.700 1.640 3.343 28.751 22.056 1.304 possible 627 82 . ARG NH2 15 N3H2u 0.700 1.640 3.738 42.674 23.132 1.845 possible 628 83 . TYR N 12 N3H1s 0.700 1.640 2.748 11.936 13.473 0.886 [OK] 629 83 . TYR CA 3 C4H1s 0.770 1.880 2.849 14.000 13.249 1.057 [OK] 630 83 . TYR C 1 C3H0s 0.770 1.610 3.330 8.961 8.714 1.028 possible 631 83 . TYR O 16 O1H0u 0.660 1.420 3.207 18.377 15.901 1.156 possible 632 83 . TYR CB 8 C4H2s 0.770 1.880 3.731 25.968 23.426 1.109 possible 633 83 . TYR CG 2 C3H0b 0.770 1.610 2.702 9.391 9.695 0.969 [OK] 634 83 . TYR CD1 5 C3H1s 0.770 1.760 2.846 20.132 20.057 1.004 [OK] 635 83 . TYR CD2 5 C3H1s 0.770 1.760 2.776 16.613 20.578 0.807 [OK] 636 83 . TYR CE1 5 C3H1s 0.770 1.760 3.222 26.192 20.534 1.276 possible 637 83 . TYR CE2 5 C3H1s 0.770 1.760 3.185 26.427 20.577 1.284 possible 638 83 . TYR CZ 2 C3H0b 0.770 1.610 3.003 11.193 9.888 1.132 possible 639 83 . TYR OH 17 O2H1u 0.660 1.460 2.944 21.124 18.541 1.139 [OK] 640 84 . ALA N 12 N3H1s 0.700 1.640 3.598 16.805 13.872 1.211 possible 641 84 . ALA CA 4 C4H1b 0.770 1.880 4.235 19.496 13.959 1.397 possible 642 84 . ALA C 1 C3H0s 0.770 1.610 2.849 9.228 8.858 1.042 [OK] 643 84 . ALA O 16 O1H0u 0.660 1.420 2.647 15.109 16.026 0.943 [OK] 644 84 . ALA CB 10 C4H3u 0.770 1.880 7.512 95.833 36.551 2.622 possible 645 85 . ASP N 12 N3H1s 0.700 1.640 2.683 12.827 13.654 0.939 [OK] 646 85 . ASP CA 3 C4H1s 0.770 1.880 3.107 15.029 13.254 1.134 possible 647 85 . ASP C 1 C3H0s 0.770 1.610 2.080 7.423 8.750 0.848 [OK] 648 85 . ASP O 16 O1H0u 0.660 1.420 2.502 14.637 15.757 0.929 [OK] 649 85 . ASP CB 8 C4H2s 0.770 1.880 2.924 22.293 23.022 0.968 [OK] 650 85 . ASP CG 2 C3H0b 0.770 1.610 3.142 10.021 9.336 1.073 possible 651 85 . ASP OD1 16 O1H0u 0.660 1.420 2.995 18.739 15.078 1.243 [OK] 652 85 . ASP OD2 16 O1H0u 0.660 1.420 3.032 24.241 15.582 1.556 possible 653 86 . TRP N 12 N3H1s 0.700 1.640 2.283 11.146 13.639 0.817 [OK] 654 86 . TRP CA 3 C4H1s 0.770 1.880 2.540 12.066 13.323 0.906 [OK] 655 86 . TRP C 1 C3H0s 0.770 1.610 2.801 8.519 8.687 0.981 [OK] 656 86 . TRP O 16 O1H0u 0.660 1.420 2.785 13.117 15.797 0.830 [OK] 657 86 . TRP CB 8 C4H2s 0.770 1.880 3.277 26.146 23.826 1.097 possible 658 86 . TRP CG 2 C3H0b 0.770 1.610 2.452 8.902 9.915 0.898 [OK] 659 86 . TRP CD1 5 C3H1s 0.770 1.760 2.594 14.843 20.597 0.721 [OK] 660 86 . TRP CD2 2 C3H0b 0.770 1.610 2.588 10.536 10.068 1.046 [OK] 661 86 . TRP NE1 13 N3H1b 0.700 1.640 3.062 19.064 16.723 1.140 possible 662 86 . TRP CE2 2 C3H0b 0.770 1.610 2.740 10.537 9.848 1.070 [OK] 663 86 . TRP CE3 6 C3H1b 0.770 1.760 3.146 22.814 20.383 1.119 possible 664 86 . TRP CZ2 6 C3H1b 0.770 1.760 3.079 18.780 20.931 0.897 possible 665 86 . TRP CZ3 6 C3H1b 0.770 1.760 3.263 24.825 21.429 1.158 possible 666 86 . TRP CH2 6 C3H1b 0.770 1.760 3.272 19.886 21.219 0.937 possible 667 87 . LEU N 12 N3H1s 0.700 1.640 2.611 13.364 13.517 0.989 [OK] 668 87 . LEU CA 3 C4H1s 0.770 1.880 2.866 13.878 13.055 1.063 [OK] 669 87 . LEU C 1 C3H0s 0.770 1.610 2.347 7.444 8.781 0.848 [OK] 670 87 . LEU O 16 O1H0u 0.660 1.420 2.752 13.724 15.957 0.860 [OK] 671 87 . LEU CB 8 C4H2s 0.770 1.880 3.255 19.927 22.818 0.873 possible 672 87 . LEU CG 4 C4H1b 0.770 1.880 3.194 14.204 14.704 0.966 possible 673 87 . LEU CD1 10 C4H3u 0.770 1.880 20.758 -1.000 37.235 -1.000 bad 674 87 . LEU CD2 10 C4H3u 0.770 1.880 40.543 -1.000 37.020 -1.000 bad 675 88 . PHE N 12 N3H1s 0.700 1.640 2.568 13.196 13.524 0.976 [OK] 676 88 . PHE CA 3 C4H1s 0.770 1.880 3.979 17.811 13.371 1.332 possible 677 88 . PHE C 1 C3H0s 0.770 1.610 2.667 8.720 8.697 1.003 [OK] 678 88 . PHE O 16 O1H0u 0.660 1.420 3.655 19.095 15.961 1.196 possible 679 88 . PHE CB 8 C4H2s 0.770 1.880 4.212 29.959 23.623 1.268 possible 680 88 . PHE CG 2 C3H0b 0.770 1.610 4.334 11.975 9.684 1.237 possible 681 88 . PHE CD1 5 C3H1s 0.770 1.760 23.081 -1.000 20.325 -1.000 bad 682 88 . PHE CD2 6 C3H1b 0.770 1.760 4.540 27.776 20.948 1.326 possible 683 88 . PHE CE1 6 C3H1b 0.770 1.760 33.572 -1.000 21.532 -1.000 bad 684 88 . PHE CE2 6 C3H1b 0.770 1.760 6.620 60.714 21.625 2.808 possible 685 88 . PHE CZ 6 C3H1b 0.770 1.760 30.140 -1.000 21.555 -1.000 bad 686 89 . THR N 12 N3H1s 0.700 1.640 2.694 13.882 13.544 1.025 [OK] 687 89 . THR CA 3 C4H1s 0.770 1.880 3.101 16.396 13.025 1.259 possible 688 89 . THR C 1 C3H0s 0.770 1.610 2.941 8.759 8.685 1.008 [OK] 689 89 . THR O 16 O1H0u 0.660 1.420 2.702 17.337 15.795 1.098 [OK] 690 89 . THR CB 4 C4H1b 0.770 1.880 3.257 15.719 14.687 1.070 possible 691 89 . THR OG1 17 O2H1u 0.660 1.460 2.761 15.574 17.610 0.884 [OK] 692 89 . THR CG2 10 C4H3u 0.770 1.880 2.969 36.068 36.265 0.995 [OK] 693 90 . THR N 12 N3H1s 0.700 1.640 2.858 12.259 13.544 0.905 [OK] 694 90 . THR CA 3 C4H1s 0.770 1.880 3.032 14.897 13.025 1.144 possible 695 90 . THR C 1 C3H0s 0.770 1.610 2.795 8.827 8.685 1.016 [OK] 696 90 . THR O 16 O1H0u 0.660 1.420 2.635 15.975 15.795 1.011 [OK] 697 90 . THR CB 4 C4H1b 0.770 1.880 3.670 21.067 14.687 1.434 possible 698 90 . THR OG1 17 O2H1u 0.660 1.460 2.954 21.149 17.610 1.201 [OK] 699 90 . THR CG2 10 C4H3u 0.770 1.880 3.367 34.635 36.265 0.955 possible 700 91 . PRO N 11 N3H0u 0.700 1.640 2.634 8.858 8.650 1.024 [OK] 701 91 . PRO CA 4 C4H1b 0.770 1.880 3.234 17.874 13.828 1.293 possible 702 91 . PRO C 1 C3H0s 0.770 1.610 3.298 8.705 8.768 0.993 possible 703 91 . PRO O 16 O1H0u 0.660 1.420 3.236 22.284 15.856 1.405 possible 704 91 . PRO CB 9 C4H2b 0.770 1.880 6.438 55.921 25.314 2.209 possible 705 91 . PRO CG 9 C4H2b 0.770 1.880 5.960 55.227 25.480 2.167 possible 706 91 . PRO CD 8 C4H2s 0.770 1.880 2.742 14.965 23.390 0.640 [OK] 707 92 . LEU N 12 N3H1s 0.700 1.640 2.659 13.491 13.517 0.998 [OK] 708 92 . LEU CA 3 C4H1s 0.770 1.880 3.246 13.891 13.055 1.064 possible 709 92 . LEU C 1 C3H0s 0.770 1.610 2.606 8.626 8.781 0.982 [OK] 710 92 . LEU O 16 O1H0u 0.660 1.420 2.790 14.777 15.957 0.926 [OK] 711 92 . LEU CB 8 C4H2s 0.770 1.880 2.976 23.050 22.818 1.010 [OK] 712 92 . LEU CG 4 C4H1b 0.770 1.880 3.731 15.844 14.704 1.078 possible 713 92 . LEU CD1 10 C4H3u 0.770 1.880 4.766 53.645 37.235 1.441 possible 714 92 . LEU CD2 10 C4H3u 0.770 1.880 38.470 -1.000 37.020 -1.000 bad 715 93 . LEU N 12 N3H1s 0.700 1.640 2.803 14.158 13.517 1.047 [OK] 716 93 . LEU CA 3 C4H1s 0.770 1.880 3.106 14.234 13.055 1.090 possible 717 93 . LEU C 1 C3H0s 0.770 1.610 2.632 8.172 8.781 0.931 [OK] 718 93 . LEU O 16 O1H0u 0.660 1.420 2.555 13.850 15.957 0.868 [OK] 719 93 . LEU CB 8 C4H2s 0.770 1.880 3.140 23.965 22.818 1.050 possible 720 93 . LEU CG 4 C4H1b 0.770 1.880 3.187 17.831 14.704 1.213 possible 721 93 . LEU CD1 10 C4H3u 0.770 1.880 3.869 52.006 37.235 1.397 possible 722 93 . LEU CD2 10 C4H3u 0.770 1.880 3.569 49.576 37.020 1.339 possible 723 94 . LEU N 12 N3H1s 0.700 1.640 2.709 13.301 13.517 0.984 [OK] 724 94 . LEU CA 3 C4H1s 0.770 1.880 2.417 10.810 13.055 0.828 [OK] 725 94 . LEU C 1 C3H0s 0.770 1.610 3.418 8.782 8.781 1.000 possible 726 94 . LEU O 16 O1H0u 0.660 1.420 3.187 20.432 15.957 1.280 possible 727 94 . LEU CB 8 C4H2s 0.770 1.880 3.732 30.523 22.818 1.338 possible 728 94 . LEU CG 4 C4H1b 0.770 1.880 2.556 12.650 14.704 0.860 [OK] 729 94 . LEU CD1 10 C4H3u 0.770 1.880 3.177 33.544 37.235 0.901 possible 730 94 . LEU CD2 10 C4H3u 0.770 1.880 3.668 40.505 37.020 1.094 possible 731 95 . LEU N 12 N3H1s 0.700 1.640 3.338 13.741 13.517 1.017 possible 732 95 . LEU CA 3 C4H1s 0.770 1.880 3.524 16.078 13.055 1.232 possible 733 95 . LEU C 1 C3H0s 0.770 1.610 2.462 8.507 8.781 0.969 [OK] 734 95 . LEU O 16 O1H0u 0.660 1.420 2.615 15.794 15.957 0.990 [OK] 735 95 . LEU CB 8 C4H2s 0.770 1.880 3.186 21.471 22.818 0.941 possible 736 95 . LEU CG 4 C4H1b 0.770 1.880 3.431 21.139 14.704 1.438 possible 737 95 . LEU CD1 10 C4H3u 0.770 1.880 43.719 -1.000 37.235 -1.000 bad 738 95 . LEU CD2 10 C4H3u 0.770 1.880 6.235 67.823 37.020 1.832 possible 739 96 . ASP N 12 N3H1s 0.700 1.640 2.468 12.414 13.654 0.909 [OK] 740 96 . ASP CA 3 C4H1s 0.770 1.880 3.275 15.127 13.254 1.141 possible 741 96 . ASP C 1 C3H0s 0.770 1.610 3.029 8.646 8.750 0.988 possible 742 96 . ASP O 16 O1H0u 0.660 1.420 2.869 17.017 15.757 1.080 [OK] 743 96 . ASP CB 8 C4H2s 0.770 1.880 3.106 24.675 23.022 1.072 possible 744 96 . ASP CG 2 C3H0b 0.770 1.610 2.872 9.953 9.336 1.066 [OK] 745 96 . ASP OD1 16 O1H0u 0.660 1.420 2.811 19.417 15.078 1.288 [OK] 746 96 . ASP OD2 16 O1H0u 0.660 1.420 2.751 24.334 15.582 1.562 [OK] 747 97 . LEU N 12 N3H1s 0.700 1.640 3.076 13.813 13.517 1.022 possible 748 97 . LEU CA 3 C4H1s 0.770 1.880 3.385 17.884 13.055 1.370 possible 749 97 . LEU C 1 C3H0s 0.770 1.610 3.005 9.110 8.781 1.037 possible 750 97 . LEU O 16 O1H0u 0.660 1.420 2.802 15.859 15.957 0.994 [OK] 751 97 . LEU CB 8 C4H2s 0.770 1.880 3.140 26.660 22.818 1.168 possible 752 97 . LEU CG 4 C4H1b 0.770 1.880 2.772 13.300 14.704 0.905 [OK] 753 97 . LEU CD1 10 C4H3u 0.770 1.880 3.232 39.053 37.235 1.049 possible 754 97 . LEU CD2 10 C4H3u 0.770 1.880 3.197 42.466 37.020 1.147 possible 755 98 . ALA N 12 N3H1s 0.700 1.640 3.017 15.040 13.872 1.084 possible 756 98 . ALA CA 4 C4H1b 0.770 1.880 3.249 16.259 13.959 1.165 possible 757 98 . ALA C 1 C3H0s 0.770 1.610 3.639 9.036 8.858 1.020 possible 758 98 . ALA O 16 O1H0u 0.660 1.420 2.949 14.337 16.026 0.895 [OK] 759 98 . ALA CB 10 C4H3u 0.770 1.880 3.998 49.700 36.551 1.360 possible 760 99 . LEU N 12 N3H1s 0.700 1.640 3.855 16.481 13.517 1.219 possible 761 99 . LEU CA 3 C4H1s 0.770 1.880 4.263 18.184 13.055 1.393 possible 762 99 . LEU C 1 C3H0s 0.770 1.610 2.322 8.120 8.781 0.925 [OK] 763 99 . LEU O 16 O1H0u 0.660 1.420 4.086 23.335 15.957 1.462 possible 764 99 . LEU CB 8 C4H2s 0.770 1.880 3.354 24.858 22.818 1.089 possible 765 99 . LEU CG 4 C4H1b 0.770 1.880 7.160 43.306 14.704 2.945 possible 766 99 . LEU CD1 10 C4H3u 0.770 1.880 6.496 72.969 37.235 1.960 possible 767 99 . LEU CD2 10 C4H3u 0.770 1.880 6.919 119.755 37.020 3.235 possible 768 100 . LEU N 12 N3H1s 0.700 1.640 2.257 11.849 13.517 0.877 [OK] 769 100 . LEU CA 3 C4H1s 0.770 1.880 3.375 13.695 13.055 1.049 possible 770 100 . LEU C 1 C3H0s 0.770 1.610 2.962 7.792 8.781 0.887 [OK] 771 100 . LEU O 16 O1H0u 0.660 1.420 4.412 44.059 15.957 2.761 possible 772 100 . LEU CB 8 C4H2s 0.770 1.880 3.385 20.627 22.818 0.904 possible 773 100 . LEU CG 4 C4H1b 0.770 1.880 3.407 18.857 14.704 1.282 possible 774 100 . LEU CD1 10 C4H3u 0.770 1.880 3.824 36.417 37.235 0.978 possible 775 100 . LEU CD2 10 C4H3u 0.770 1.880 3.359 41.625 37.020 1.124 possible 776 101 . VAL N 12 N3H1s 0.700 1.640 3.008 13.702 13.553 1.011 possible 777 101 . VAL CA 3 C4H1s 0.770 1.880 3.301 16.858 13.078 1.289 possible 778 101 . VAL C 1 C3H0s 0.770 1.610 2.400 7.912 8.528 0.928 [OK] 779 101 . VAL O 16 O1H0u 0.660 1.420 3.761 28.783 15.998 1.799 possible 780 101 . VAL CB 4 C4H1b 0.770 1.880 3.016 14.465 14.514 0.997 possible 781 101 . VAL CG1 10 C4H3u 0.770 1.880 3.271 36.610 36.320 1.008 possible 782 101 . VAL CG2 10 C4H3u 0.770 1.880 3.406 39.756 36.173 1.099 possible 783 102 . ASP N 12 N3H1s 0.700 1.640 2.341 10.489 13.654 0.768 [OK] 784 102 . ASP CA 3 C4H1s 0.770 1.880 3.557 14.992 13.254 1.131 possible 785 102 . ASP C 1 C3H0s 0.770 1.610 2.391 9.056 8.750 1.035 [OK] 786 102 . ASP O 16 O1H0u 0.660 1.420 4.882 30.375 15.757 1.928 possible 787 102 . ASP CB 8 C4H2s 0.770 1.880 4.953 36.164 23.022 1.571 possible 788 102 . ASP CG 2 C3H0b 0.770 1.610 6.143 16.818 9.336 1.801 possible 789 102 . ASP OD1 16 O1H0u 0.660 1.420 29.940 -1.000 15.078 -1.000 bad 790 102 . ASP OD2 16 O1H0u 0.660 1.420 44.812 -1.000 15.582 -1.000 bad 791 103 . ALA N 12 N3H1s 0.700 1.640 4.161 22.951 13.872 1.654 possible 792 103 . ALA CA 4 C4H1b 0.770 1.880 4.509 21.825 13.959 1.564 possible 793 103 . ALA C 1 C3H0s 0.770 1.610 4.328 12.584 8.858 1.421 possible 794 103 . ALA O 16 O1H0u 0.660 1.420 4.590 41.605 16.026 2.596 possible 795 103 . ALA CB 10 C4H3u 0.770 1.880 4.260 48.522 36.551 1.328 possible 796 104 . ASP N 12 N3H1s 0.700 1.640 4.176 17.151 13.654 1.256 possible 797 104 . ASP CA 3 C4H1s 0.770 1.880 4.258 16.739 13.254 1.263 possible 798 104 . ASP C 1 C3H0s 0.770 1.610 3.067 9.036 8.750 1.033 possible 799 104 . ASP O 16 O1H0u 0.660 1.420 2.588 11.389 15.757 0.723 [OK] 800 104 . ASP CB 8 C4H2s 0.770 1.880 20.431 -1.000 23.022 -1.000 bad 801 104 . ASP CG 2 C3H0b 0.770 1.610 3.520 -1.000 9.336 -1.000 bad 802 104 . ASP OD1 16 O1H0u 0.660 1.420 30.116 -1.000 15.078 -1.000 bad 803 104 . ASP OD2 16 O1H0u 0.660 1.420 39.201 -1.000 15.582 -1.000 bad 804 105 . GLN N 12 N3H1s 0.700 1.640 6.398 25.804 13.449 1.919 possible 805 105 . GLN CA 3 C4H1s 0.770 1.880 4.698 18.117 13.231 1.369 possible 806 105 . GLN C 1 C3H0s 0.770 1.610 2.891 8.595 8.744 0.983 [OK] 807 105 . GLN O 16 O1H0u 0.660 1.420 3.262 13.394 15.767 0.849 possible 808 105 . GLN CB 8 C4H2s 0.770 1.880 23.070 -1.000 23.059 -1.000 bad 809 105 . GLN CG 8 C4H2s 0.770 1.880 36.684 -1.000 23.218 -1.000 bad 810 105 . GLN CD 2 C3H0b 0.770 1.610 2.326 -1.000 9.618 -1.000 bad 811 105 . GLN OE1 16 O1H0u 0.660 1.420 16.177 -1.000 16.571 -1.000 bad 812 105 . GLN NE2 15 N3H2u 0.700 1.640 55.620 -1.000 23.255 -1.000 bad 813 106 . GLY N 12 N3H1s 0.700 1.640 6.121 37.963 14.480 2.622 possible 814 106 . GLY CA 8 C4H2s 0.770 1.880 34.718 -1.000 23.470 -1.000 bad 815 106 . GLY C 2 C3H0b 0.770 1.610 1.797 -1.000 9.652 -1.000 bad 816 106 . GLY O 16 O1H0u 0.660 1.420 6.155 29.315 16.154 1.815 possible 817 107 . THR N 12 N3H1s 0.700 1.640 7.392 32.128 13.544 2.372 possible 818 107 . THR CA 3 C4H1s 0.770 1.880 5.464 20.973 13.025 1.610 possible 819 107 . THR C 1 C3H0s 0.770 1.610 3.040 8.907 8.685 1.026 possible 820 107 . THR O 16 O1H0u 0.660 1.420 3.473 22.895 15.795 1.449 possible 821 107 . THR CB 4 C4H1b 0.770 1.880 3.407 19.222 14.687 1.309 possible 822 107 . THR OG1 17 O2H1u 0.660 1.460 4.249 24.988 17.610 1.419 possible 823 107 . THR CG2 10 C4H3u 0.770 1.880 53.455 -1.000 36.265 -1.000 bad 824 108 . ILE N 12 N3H1s 0.700 1.640 2.998 14.473 13.493 1.073 [OK] 825 108 . ILE CA 3 C4H1s 0.770 1.880 3.777 19.287 12.946 1.490 possible 826 108 . ILE C 1 C3H0s 0.770 1.610 2.074 7.128 8.445 0.844 [OK] 827 108 . ILE O 16 O1H0u 0.660 1.420 3.250 14.271 15.930 0.896 possible 828 108 . ILE CB 4 C4H1b 0.770 1.880 3.777 18.775 14.146 1.327 possible 829 108 . ILE CG1 9 C4H2b 0.770 1.880 3.769 31.681 24.071 1.316 possible 830 108 . ILE CG2 10 C4H3u 0.770 1.880 5.110 47.386 35.763 1.325 possible 831 108 . ILE CD1 10 C4H3u 0.770 1.880 31.104 -1.000 38.219 -1.000 bad 832 109 . LEU N 12 N3H1s 0.700 1.640 2.111 10.254 13.517 0.759 [OK] 833 109 . LEU CA 3 C4H1s 0.770 1.880 3.523 14.762 13.055 1.131 possible 834 109 . LEU C 1 C3H0s 0.770 1.610 2.637 7.638 8.781 0.870 [OK] 835 109 . LEU O 16 O1H0u 0.660 1.420 3.705 17.810 15.957 1.116 possible 836 109 . LEU CB 8 C4H2s 0.770 1.880 3.793 22.997 22.818 1.008 possible 837 109 . LEU CG 4 C4H1b 0.770 1.880 9.616 -1.000 14.704 -1.000 bad 838 109 . LEU CD1 10 C4H3u 0.770 1.880 44.292 -1.000 37.235 -1.000 bad 839 109 . LEU CD2 10 C4H3u 0.770 1.880 58.316 -1.000 37.020 -1.000 bad 840 110 . ALA N 12 N3H1s 0.700 1.640 3.427 14.623 13.872 1.054 possible 841 110 . ALA CA 4 C4H1b 0.770 1.880 10.790 -1.000 13.959 -1.000 bad 842 110 . ALA C 1 C3H0s 0.770 1.610 3.098 8.788 8.858 0.992 possible 843 110 . ALA O 16 O1H0u 0.660 1.420 5.187 32.950 16.026 2.056 possible 844 110 . ALA CB 10 C4H3u 0.770 1.880 49.019 -1.000 36.551 -1.000 bad 845 111 . LEU N 12 N3H1s 0.700 1.640 3.395 15.437 13.517 1.142 possible 846 111 . LEU CA 3 C4H1s 0.770 1.880 3.459 16.675 13.055 1.277 possible 847 111 . LEU C 1 C3H0s 0.770 1.610 2.836 8.515 8.781 0.970 [OK] 848 111 . LEU O 16 O1H0u 0.660 1.420 2.304 12.696 15.957 0.796 [OK] 849 111 . LEU CB 8 C4H2s 0.770 1.880 3.769 26.338 22.818 1.154 possible 850 111 . LEU CG 4 C4H1b 0.770 1.880 3.438 20.333 14.704 1.383 possible 851 111 . LEU CD1 10 C4H3u 0.770 1.880 3.771 45.549 37.235 1.223 possible 852 111 . LEU CD2 10 C4H3u 0.770 1.880 3.175 29.617 37.020 0.800 possible 853 112 . VAL N 12 N3H1s 0.700 1.640 3.043 12.914 13.553 0.953 possible 854 112 . VAL CA 3 C4H1s 0.770 1.880 3.246 15.830 13.078 1.210 possible 855 112 . VAL C 1 C3H0s 0.770 1.610 2.667 7.645 8.528 0.896 [OK] 856 112 . VAL O 16 O1H0u 0.660 1.420 3.694 20.204 15.998 1.263 possible 857 112 . VAL CB 4 C4H1b 0.770 1.880 3.777 15.800 14.514 1.089 possible 858 112 . VAL CG1 10 C4H3u 0.770 1.880 38.483 -1.000 36.320 -1.000 bad 859 112 . VAL CG2 10 C4H3u 0.770 1.880 5.394 59.073 36.173 1.633 possible 860 113 . GLY N 12 N3H1s 0.700 1.640 3.961 18.327 14.480 1.266 possible 861 113 . GLY CA 8 C4H2s 0.770 1.880 35.308 -1.000 23.470 -1.000 bad 862 113 . GLY C 2 C3H0b 0.770 1.610 4.243 10.831 9.652 1.122 possible 863 113 . GLY O 16 O1H0u 0.660 1.420 5.173 19.698 16.154 1.219 possible 864 114 . ALA N 12 N3H1s 0.700 1.640 4.110 16.130 13.872 1.163 possible 865 114 . ALA CA 4 C4H1b 0.770 1.880 4.676 21.592 13.959 1.547 possible 866 114 . ALA C 1 C3H0s 0.770 1.610 2.770 8.862 8.858 1.000 [OK] 867 114 . ALA O 16 O1H0u 0.660 1.420 3.030 19.463 16.026 1.214 possible 868 114 . ALA CB 10 C4H3u 0.770 1.880 5.576 62.957 36.551 1.722 possible 869 115 . ASP N 12 N3H1s 0.700 1.640 2.765 11.862 13.654 0.869 [OK] 870 115 . ASP CA 3 C4H1s 0.770 1.880 3.066 14.465 13.254 1.091 possible 871 115 . ASP C 1 C3H0s 0.770 1.610 2.978 8.721 8.750 0.997 [OK] 872 115 . ASP O 16 O1H0u 0.660 1.420 2.806 12.525 15.757 0.795 [OK] 873 115 . ASP CB 8 C4H2s 0.770 1.880 3.637 34.625 23.022 1.504 possible 874 115 . ASP CG 2 C3H0b 0.770 1.610 3.373 10.624 9.336 1.138 possible 875 115 . ASP OD1 16 O1H0u 0.660 1.420 2.653 17.133 15.078 1.136 [OK] 876 115 . ASP OD2 16 O1H0u 0.660 1.420 2.794 22.236 15.582 1.427 [OK] 877 116 . GLY N 12 N3H1s 0.700 1.640 3.016 16.270 14.480 1.124 possible 878 116 . GLY CA 8 C4H2s 0.770 1.880 19.556 -1.000 23.470 -1.000 bad 879 116 . GLY C 2 C3H0b 0.770 1.610 1.962 -1.000 9.652 -1.000 bad 880 116 . GLY O 16 O1H0u 0.660 1.420 5.951 -1.000 16.154 -1.000 bad 881 117 . ILE N 12 N3H1s 0.700 1.640 4.296 15.004 13.493 1.112 possible 882 117 . ILE CA 3 C4H1s 0.770 1.880 7.216 24.475 12.946 1.891 possible 883 117 . ILE C 1 C3H0s 0.770 1.610 2.879 8.804 8.445 1.042 [OK] 884 117 . ILE O 16 O1H0u 0.660 1.420 2.966 14.364 15.930 0.902 [OK] 885 117 . ILE CB 4 C4H1b 0.770 1.880 3.490 16.121 14.146 1.140 possible 886 117 . ILE CG1 9 C4H2b 0.770 1.880 16.827 -1.000 24.071 -1.000 bad 887 117 . ILE CG2 10 C4H3u 0.770 1.880 31.830 -1.000 35.763 -1.000 bad 888 117 . ILE CD1 10 C4H3u 0.770 1.880 49.163 -1.000 38.219 -1.000 bad 889 118 . MET N 12 N3H1s 0.700 1.640 2.724 12.675 13.405 0.946 [OK] 890 118 . MET CA 3 C4H1s 0.770 1.880 3.165 15.683 13.194 1.189 possible 891 118 . MET C 1 C3H0s 0.770 1.610 2.483 7.838 8.756 0.895 [OK] 892 118 . MET O 16 O1H0u 0.660 1.420 2.581 17.333 16.002 1.083 [OK] 893 118 . MET CB 8 C4H2s 0.770 1.880 3.165 23.509 23.418 1.004 possible 894 118 . MET CG 9 C4H2b 0.770 1.880 3.453 24.716 23.830 1.037 possible 895 118 . MET SD 19 S2H0u 1.040 1.770 2.911 26.428 30.207 0.875 [OK] 896 118 . MET CE 10 C4H3u 0.770 1.880 3.679 43.953 37.003 1.188 possible 897 119 . ILE N 12 N3H1s 0.700 1.640 2.468 11.130 13.493 0.825 [OK] 898 119 . ILE CA 3 C4H1s 0.770 1.880 2.811 15.072 12.946 1.164 [OK] 899 119 . ILE C 1 C3H0s 0.770 1.610 2.323 7.475 8.445 0.885 [OK] 900 119 . ILE O 16 O1H0u 0.660 1.420 2.518 14.497 15.930 0.910 [OK] 901 119 . ILE CB 4 C4H1b 0.770 1.880 3.277 20.288 14.146 1.434 possible 902 119 . ILE CG1 9 C4H2b 0.770 1.880 3.771 27.122 24.071 1.127 possible 903 119 . ILE CG2 10 C4H3u 0.770 1.880 3.453 40.201 35.763 1.124 possible 904 119 . ILE CD1 10 C4H3u 0.770 1.880 3.427 37.739 38.219 0.987 possible 905 120 . GLY N 12 N3H1s 0.700 1.640 3.064 14.786 14.480 1.021 possible 906 120 . GLY CA 8 C4H2s 0.770 1.880 26.804 -1.000 23.470 -1.000 bad 907 120 . GLY C 2 C3H0b 0.770 1.610 5.551 12.309 9.652 1.275 possible 908 120 . GLY O 16 O1H0u 0.660 1.420 4.512 17.587 16.154 1.089 possible 909 121 . THR N 12 N3H1s 0.700 1.640 5.596 18.688 13.544 1.380 possible 910 121 . THR CA 3 C4H1s 0.770 1.880 3.263 13.847 13.025 1.063 possible 911 121 . THR C 1 C3H0s 0.770 1.610 2.872 8.488 8.685 0.977 [OK] 912 121 . THR O 16 O1H0u 0.660 1.420 2.750 17.011 15.795 1.077 [OK] 913 121 . THR CB 4 C4H1b 0.770 1.880 3.061 18.958 14.687 1.291 possible 914 121 . THR OG1 17 O2H1u 0.660 1.460 3.009 17.325 17.610 0.984 possible 915 121 . THR CG2 10 C4H3u 0.770 1.880 22.650 -1.000 36.265 -1.000 bad 916 122 . GLY N 12 N3H1s 0.700 1.640 2.812 12.639 14.480 0.873 [OK] 917 122 . GLY CA 8 C4H2s 0.770 1.880 3.314 30.400 23.470 1.295 possible 918 122 . GLY C 2 C3H0b 0.770 1.610 2.719 9.333 9.652 0.967 [OK] 919 122 . GLY O 16 O1H0u 0.660 1.420 2.908 20.286 16.154 1.256 [OK] 920 123 . LEU N 12 N3H1s 0.700 1.640 2.630 13.676 13.517 1.012 [OK] 921 123 . LEU CA 3 C4H1s 0.770 1.880 2.602 12.221 13.055 0.936 [OK] 922 123 . LEU C 1 C3H0s 0.770 1.610 2.417 7.370 8.781 0.839 [OK] 923 123 . LEU O 16 O1H0u 0.660 1.420 2.313 12.321 15.957 0.772 [OK] 924 123 . LEU CB 8 C4H2s 0.770 1.880 3.353 23.042 22.818 1.010 possible 925 123 . LEU CG 4 C4H1b 0.770 1.880 3.305 14.294 14.704 0.972 possible 926 123 . LEU CD1 10 C4H3u 0.770 1.880 51.143 -1.000 37.235 -1.000 bad 927 123 . LEU CD2 10 C4H3u 0.770 1.880 3.719 32.943 37.020 0.890 possible 928 124 . VAL N 12 N3H1s 0.700 1.640 3.144 13.487 13.553 0.995 possible 929 124 . VAL CA 3 C4H1s 0.770 1.880 4.161 19.436 13.078 1.486 possible 930 124 . VAL C 1 C3H0s 0.770 1.610 2.637 8.205 8.528 0.962 [OK] 931 124 . VAL O 16 O1H0u 0.660 1.420 4.196 20.373 15.998 1.273 possible 932 124 . VAL CB 4 C4H1b 0.770 1.880 3.130 15.851 14.514 1.092 possible 933 124 . VAL CG1 10 C4H3u 0.770 1.880 45.113 -1.000 36.320 -1.000 bad 934 124 . VAL CG2 10 C4H3u 0.770 1.880 23.730 -1.000 36.173 -1.000 bad 935 125 . GLY N 12 N3H1s 0.700 1.640 2.575 13.479 14.480 0.931 [OK] 936 125 . GLY CA 8 C4H2s 0.770 1.880 3.414 27.631 23.470 1.177 possible 937 125 . GLY C 2 C3H0b 0.770 1.610 3.050 10.478 9.652 1.086 possible 938 125 . GLY O 16 O1H0u 0.660 1.420 2.619 14.996 16.154 0.928 [OK] 939 126 . ALA N 12 N3H1s 0.700 1.640 2.695 13.317 13.872 0.960 [OK] 940 126 . ALA CA 4 C4H1b 0.770 1.880 3.015 14.033 13.959 1.005 possible 941 126 . ALA C 1 C3H0s 0.770 1.610 2.828 8.560 8.858 0.966 [OK] 942 126 . ALA O 16 O1H0u 0.660 1.420 2.576 16.640 16.026 1.038 [OK] 943 126 . ALA CB 10 C4H3u 0.770 1.880 3.233 35.639 36.551 0.975 possible 944 127 . LEU N 12 N3H1s 0.700 1.640 2.406 11.962 13.517 0.885 [OK] 945 127 . LEU CA 3 C4H1s 0.770 1.880 2.899 12.293 13.055 0.942 [OK] 946 127 . LEU C 1 C3H0s 0.770 1.610 4.140 9.572 8.781 1.090 possible 947 127 . LEU O 16 O1H0u 0.660 1.420 4.336 27.266 15.957 1.709 possible 948 127 . LEU CB 8 C4H2s 0.770 1.880 6.506 67.690 22.818 2.967 possible 949 127 . LEU CG 4 C4H1b 0.770 1.880 2.995 12.857 14.704 0.874 [OK] 950 127 . LEU CD1 10 C4H3u 0.770 1.880 45.782 -1.000 37.235 -1.000 bad 951 127 . LEU CD2 10 C4H3u 0.770 1.880 3.867 48.695 37.020 1.315 possible 952 128 . THR N 12 N3H1s 0.700 1.640 4.371 15.276 13.544 1.128 possible 953 128 . THR CA 3 C4H1s 0.770 1.880 5.585 29.615 13.025 2.274 possible 954 128 . THR C 1 C3H0s 0.770 1.610 2.615 7.586 8.685 0.873 [OK] 955 128 . THR O 16 O1H0u 0.660 1.420 5.395 38.461 15.795 2.435 possible 956 128 . THR CB 4 C4H1b 0.770 1.880 2.549 12.575 14.687 0.856 [OK] 957 128 . THR OG1 17 O2H1u 0.660 1.460 4.164 20.085 17.610 1.141 possible 958 128 . THR CG2 10 C4H3u 0.770 1.880 4.474 37.413 36.265 1.032 possible 959 129 . LYS N 12 N3H1s 0.700 1.640 2.600 15.022 13.429 1.119 [OK] 960 129 . LYS CA 3 C4H1s 0.770 1.880 2.698 14.209 13.217 1.075 [OK] 961 129 . LYS C 1 C3H0s 0.770 1.610 2.367 8.804 8.696 1.012 [OK] 962 129 . LYS O 16 O1H0u 0.660 1.420 2.855 13.405 15.818 0.847 [OK] 963 129 . LYS CB 8 C4H2s 0.770 1.880 4.323 27.496 22.578 1.218 possible 964 129 . LYS CG 8 C4H2s 0.770 1.880 3.618 21.748 22.847 0.952 possible 965 129 . LYS CD 8 C4H2s 0.770 1.880 16.577 -1.000 23.365 -1.000 bad 966 129 . LYS CE 9 C4H2b 0.770 1.880 45.179 -1.000 23.720 -1.000 bad 967 129 . LYS NZ 14 N4H3u 0.700 1.640 39.483 -1.000 21.413 -1.000 bad 968 130 . VAL N 12 N3H1s 0.700 1.640 4.071 18.187 13.553 1.342 possible 969 130 . VAL CA 3 C4H1s 0.770 1.880 4.891 23.332 13.078 1.784 possible 970 130 . VAL C 1 C3H0s 0.770 1.610 2.867 8.514 8.528 0.998 [OK] 971 130 . VAL O 16 O1H0u 0.660 1.420 2.272 12.967 15.998 0.811 [OK] 972 130 . VAL CB 4 C4H1b 0.770 1.880 3.421 15.091 14.514 1.040 possible 973 130 . VAL CG1 10 C4H3u 0.770 1.880 28.497 -1.000 36.320 -1.000 bad 974 130 . VAL CG2 10 C4H3u 0.770 1.880 49.146 -1.000 36.173 -1.000 bad 975 131 . TYR N 12 N3H1s 0.700 1.640 3.274 15.654 13.473 1.162 possible 976 131 . TYR CA 3 C4H1s 0.770 1.880 2.677 10.715 13.249 0.809 [OK] 977 131 . TYR C 1 C3H0s 0.770 1.610 2.569 8.162 8.714 0.937 [OK] 978 131 . TYR O 16 O1H0u 0.660 1.420 2.636 13.980 15.901 0.879 [OK] 979 131 . TYR CB 8 C4H2s 0.770 1.880 3.698 29.224 23.426 1.248 possible 980 131 . TYR CG 2 C3H0b 0.770 1.610 2.930 10.749 9.695 1.109 [OK] 981 131 . TYR CD1 5 C3H1s 0.770 1.760 4.561 25.070 20.057 1.250 possible 982 131 . TYR CD2 5 C3H1s 0.770 1.760 5.299 28.952 20.578 1.407 possible 983 131 . TYR CE1 5 C3H1s 0.770 1.760 20.689 -1.000 20.534 -1.000 bad 984 131 . TYR CE2 5 C3H1s 0.770 1.760 7.682 88.036 20.577 4.278 possible 985 131 . TYR CZ 2 C3H0b 0.770 1.610 4.606 17.068 9.888 1.726 possible 986 131 . TYR OH 17 O2H1u 0.660 1.460 48.802 -1.000 18.541 -1.000 bad 987 132 . SER N 12 N3H1s 0.700 1.640 2.969 13.181 13.808 0.955 [OK] 988 132 . SER CA 3 C4H1s 0.770 1.880 3.786 17.505 13.351 1.311 possible 989 132 . SER C 1 C3H0s 0.770 1.610 2.895 8.689 8.858 0.981 [OK] 990 132 . SER O 16 O1H0u 0.660 1.420 4.671 22.053 15.860 1.390 possible 991 132 . SER CB 8 C4H2s 0.770 1.880 15.142 -1.000 23.599 -1.000 bad 992 132 . SER OG 17 O2H1u 0.660 1.460 40.600 -1.000 18.021 -1.000 bad 993 133 . TYR N 12 N3H1s 0.700 1.640 2.724 13.214 13.473 0.981 [OK] 994 133 . TYR CA 3 C4H1s 0.770 1.880 3.117 12.793 13.249 0.966 possible 995 133 . TYR C 1 C3H0s 0.770 1.610 2.353 8.498 8.714 0.975 [OK] 996 133 . TYR O 16 O1H0u 0.660 1.420 3.041 14.778 15.901 0.929 possible 997 133 . TYR CB 8 C4H2s 0.770 1.880 4.033 26.777 23.426 1.143 possible 998 133 . TYR CG 2 C3H0b 0.770 1.610 4.788 15.172 9.695 1.565 possible 999 133 . TYR CD1 5 C3H1s 0.770 1.760 5.037 29.950 20.057 1.493 possible 1000 133 . TYR CD2 5 C3H1s 0.770 1.760 6.667 54.208 20.578 2.634 possible 1001 133 . TYR CE1 5 C3H1s 0.770 1.760 30.424 -1.000 20.534 -1.000 bad 1002 133 . TYR CE2 5 C3H1s 0.770 1.760 31.232 -1.000 20.577 -1.000 bad 1003 133 . TYR CZ 2 C3H0b 0.770 1.610 7.712 22.739 9.888 2.300 possible 1004 133 . TYR OH 17 O2H1u 0.660 1.460 48.273 -1.000 18.541 -1.000 bad 1005 134 . ARG N 12 N3H1s 0.700 1.640 2.397 13.161 13.486 0.976 [OK] 1006 134 . ARG CA 3 C4H1s 0.770 1.880 2.929 15.552 13.310 1.168 [OK] 1007 134 . ARG C 1 C3H0s 0.770 1.610 3.316 9.071 8.779 1.033 possible 1008 134 . ARG O 16 O1H0u 0.660 1.420 2.979 19.698 15.916 1.238 [OK] 1009 134 . ARG CB 8 C4H2s 0.770 1.880 3.617 25.473 22.833 1.116 possible 1010 134 . ARG CG 8 C4H2s 0.770 1.880 2.730 20.347 23.273 0.874 [OK] 1011 134 . ARG CD 8 C4H2s 0.770 1.880 2.829 20.783 22.849 0.910 [OK] 1012 134 . ARG NE 13 N3H1b 0.700 1.640 3.138 18.703 15.019 1.245 possible 1013 134 . ARG CZ 2 C3H0b 0.770 1.610 2.843 10.216 9.678 1.056 [OK] 1014 134 . ARG NH1 15 N3H2u 0.700 1.640 2.858 21.497 22.056 0.975 [OK] 1015 134 . ARG NH2 15 N3H2u 0.700 1.640 3.401 32.822 23.132 1.419 possible 1016 135 . PHE N 12 N3H1s 0.700 1.640 3.345 14.021 13.524 1.037 possible 1017 135 . PHE CA 3 C4H1s 0.770 1.880 3.449 13.667 13.371 1.022 possible 1018 135 . PHE C 1 C3H0s 0.770 1.610 4.101 8.936 8.697 1.027 possible 1019 135 . PHE O 16 O1H0u 0.660 1.420 5.101 24.494 15.961 1.535 possible 1020 135 . PHE CB 8 C4H2s 0.770 1.880 22.171 -1.000 23.623 -1.000 bad 1021 135 . PHE CG 2 C3H0b 0.770 1.610 0.542 -1.000 9.684 -1.000 bad 1022 135 . PHE CD1 5 C3H1s 0.770 1.760 6.656 31.027 20.325 1.527 possible 1023 135 . PHE CD2 6 C3H1b 0.770 1.760 10.499 -1.000 20.948 -1.000 bad 1024 135 . PHE CE1 6 C3H1b 0.770 1.760 6.646 36.953 21.532 1.716 possible 1025 135 . PHE CE2 6 C3H1b 0.770 1.760 6.157 -1.000 21.625 -1.000 bad 1026 135 . PHE CZ 6 C3H1b 0.770 1.760 5.724 -1.000 21.555 -1.000 bad 1027 136 . VAL N 12 N3H1s 0.700 1.640 4.411 14.360 13.553 1.060 possible 1028 136 . VAL CA 3 C4H1s 0.770 1.880 6.175 24.564 13.078 1.878 possible 1029 136 . VAL C 1 C3H0s 0.770 1.610 2.218 7.524 8.528 0.882 [OK] 1030 136 . VAL O 16 O1H0u 0.660 1.420 3.511 16.400 15.998 1.025 possible 1031 136 . VAL CB 4 C4H1b 0.770 1.880 3.791 15.173 14.514 1.045 possible 1032 136 . VAL CG1 10 C4H3u 0.770 1.880 47.255 -1.000 36.320 -1.000 bad 1033 136 . VAL CG2 10 C4H3u 0.770 1.880 30.487 -1.000 36.173 -1.000 bad 1034 137 . TRP N 12 N3H1s 0.700 1.640 2.982 14.442 13.639 1.059 [OK] 1035 137 . TRP CA 3 C4H1s 0.770 1.880 2.780 11.711 13.323 0.879 [OK] 1036 137 . TRP C 1 C3H0s 0.770 1.610 3.004 8.709 8.687 1.003 possible 1037 137 . TRP O 16 O1H0u 0.660 1.420 2.641 17.476 15.797 1.106 [OK] 1038 137 . TRP CB 8 C4H2s 0.770 1.880 3.308 25.876 23.826 1.086 possible 1039 137 . TRP CG 2 C3H0b 0.770 1.610 2.978 11.251 9.915 1.135 [OK] 1040 137 . TRP CD1 5 C3H1s 0.770 1.760 3.679 28.362 20.597 1.377 possible 1041 137 . TRP CD2 2 C3H0b 0.770 1.610 3.452 13.205 10.068 1.312 possible 1042 137 . TRP NE1 13 N3H1b 0.700 1.640 22.812 -1.000 16.723 -1.000 bad 1043 137 . TRP CE2 2 C3H0b 0.770 1.610 4.570 14.787 9.848 1.502 possible 1044 137 . TRP CE3 6 C3H1b 0.770 1.760 3.590 22.357 20.383 1.097 possible 1045 137 . TRP CZ2 6 C3H1b 0.770 1.760 29.637 -1.000 20.931 -1.000 bad 1046 137 . TRP CZ3 6 C3H1b 0.770 1.760 4.076 25.005 21.429 1.167 possible 1047 137 . TRP CH2 6 C3H1b 0.770 1.760 32.349 -1.000 21.219 -1.000 bad 1048 138 . TRP N 12 N3H1s 0.700 1.640 3.280 14.407 13.639 1.056 possible 1049 138 . TRP CA 3 C4H1s 0.770 1.880 3.520 17.313 13.323 1.299 possible 1050 138 . TRP C 1 C3H0s 0.770 1.610 1.987 7.628 8.687 0.878 [OK] 1051 138 . TRP O 16 O1H0u 0.660 1.420 2.522 14.275 15.797 0.904 [OK] 1052 138 . TRP CB 8 C4H2s 0.770 1.880 3.439 23.698 23.826 0.995 possible 1053 138 . TRP CG 2 C3H0b 0.770 1.610 2.655 9.430 9.915 0.951 [OK] 1054 138 . TRP CD1 5 C3H1s 0.770 1.760 3.173 19.381 20.597 0.941 possible 1055 138 . TRP CD2 2 C3H0b 0.770 1.610 2.656 9.562 10.068 0.950 [OK] 1056 138 . TRP NE1 13 N3H1b 0.700 1.640 2.649 18.550 16.723 1.109 [OK] 1057 138 . TRP CE2 2 C3H0b 0.770 1.610 2.734 10.280 9.848 1.044 [OK] 1058 138 . TRP CE3 6 C3H1b 0.770 1.760 5.570 30.405 20.383 1.492 possible 1059 138 . TRP CZ2 6 C3H1b 0.770 1.760 3.204 22.969 20.931 1.097 possible 1060 138 . TRP CZ3 6 C3H1b 0.770 1.760 19.313 -1.000 21.429 -1.000 bad 1061 138 . TRP CH2 6 C3H1b 0.770 1.760 18.981 -1.000 21.219 -1.000 bad 1062 139 . ALA N 12 N3H1s 0.700 1.640 2.719 12.100 13.872 0.872 [OK] 1063 139 . ALA CA 4 C4H1b 0.770 1.880 3.909 15.767 13.959 1.130 possible 1064 139 . ALA C 1 C3H0s 0.770 1.610 4.310 9.255 8.858 1.045 possible 1065 139 . ALA O 16 O1H0u 0.660 1.420 5.243 26.929 16.026 1.680 possible 1066 139 . ALA CB 10 C4H3u 0.770 1.880 48.460 -1.000 36.551 -1.000 bad 1067 140 . ILE N 12 N3H1s 0.700 1.640 4.466 15.730 13.493 1.166 possible 1068 140 . ILE CA 3 C4H1s 0.770 1.880 5.667 23.698 12.946 1.831 possible 1069 140 . ILE C 1 C3H0s 0.770 1.610 2.527 7.547 8.445 0.894 [OK] 1070 140 . ILE O 16 O1H0u 0.660 1.420 4.568 21.224 15.930 1.332 possible 1071 140 . ILE CB 4 C4H1b 0.770 1.880 2.993 13.877 14.146 0.981 [OK] 1072 140 . ILE CG1 9 C4H2b 0.770 1.880 25.529 -1.000 24.071 -1.000 bad 1073 140 . ILE CG2 10 C4H3u 0.770 1.880 30.944 -1.000 35.763 -1.000 bad 1074 140 . ILE CD1 10 C4H3u 0.770 1.880 18.814 -1.000 38.219 -1.000 bad 1075 141 . SER N 12 N3H1s 0.700 1.640 2.617 13.922 13.808 1.008 [OK] 1076 141 . SER CA 3 C4H1s 0.770 1.880 3.470 16.338 13.351 1.224 possible 1077 141 . SER C 1 C3H0s 0.770 1.610 2.623 8.320 8.858 0.939 [OK] 1078 141 . SER O 16 O1H0u 0.660 1.420 2.542 15.567 15.860 0.982 [OK] 1079 141 . SER CB 8 C4H2s 0.770 1.880 2.978 22.805 23.599 0.966 [OK] 1080 141 . SER OG 17 O2H1u 0.660 1.460 2.831 18.783 18.021 1.042 [OK] 1081 142 . THR N 12 N3H1s 0.700 1.640 2.492 12.963 13.544 0.957 [OK] 1082 142 . THR CA 3 C4H1s 0.770 1.880 3.014 13.658 13.025 1.049 possible 1083 142 . THR C 1 C3H0s 0.770 1.610 2.429 7.693 8.685 0.886 [OK] 1084 142 . THR O 16 O1H0u 0.660 1.420 2.687 14.213 15.795 0.900 [OK] 1085 142 . THR CB 4 C4H1b 0.770 1.880 2.997 18.443 14.687 1.256 [OK] 1086 142 . THR OG1 17 O2H1u 0.660 1.460 6.255 60.759 17.610 3.450 possible 1087 142 . THR CG2 10 C4H3u 0.770 1.880 6.334 43.364 36.265 1.196 possible 1088 143 . ALA N 12 N3H1s 0.700 1.640 3.619 13.923 13.872 1.004 possible 1089 143 . ALA CA 4 C4H1b 0.770 1.880 4.251 17.523 13.959 1.255 possible 1090 143 . ALA C 1 C3H0s 0.770 1.610 4.413 9.177 8.858 1.036 possible 1091 143 . ALA O 16 O1H0u 0.660 1.420 5.889 29.961 16.026 1.870 possible 1092 143 . ALA CB 10 C4H3u 0.770 1.880 47.173 -1.000 36.551 -1.000 bad 1093 144 . ALA N 12 N3H1s 0.700 1.640 5.294 18.167 13.872 1.310 possible 1094 144 . ALA CA 4 C4H1b 0.770 1.880 7.095 34.069 13.959 2.441 possible 1095 144 . ALA C 1 C3H0s 0.770 1.610 2.827 8.529 8.858 0.963 [OK] 1096 144 . ALA O 16 O1H0u 0.660 1.420 3.028 17.243 16.026 1.076 possible 1097 144 . ALA CB 10 C4H3u 0.770 1.880 6.508 68.071 36.551 1.862 possible 1098 145 . MET N 12 N3H1s 0.700 1.640 2.595 13.443 13.405 1.003 [OK] 1099 145 . MET CA 3 C4H1s 0.770 1.880 2.843 11.942 13.194 0.905 [OK] 1100 145 . MET C 1 C3H0s 0.770 1.610 2.113 7.195 8.756 0.822 [OK] 1101 145 . MET O 16 O1H0u 0.660 1.420 2.750 13.888 16.002 0.868 [OK] 1102 145 . MET CB 8 C4H2s 0.770 1.880 2.847 20.307 23.418 0.867 [OK] 1103 145 . MET CG 9 C4H2b 0.770 1.880 3.725 26.708 23.830 1.121 possible 1104 145 . MET SD 19 S2H0u 1.040 1.770 3.394 36.972 30.207 1.224 possible 1105 145 . MET CE 10 C4H3u 0.770 1.880 4.803 41.708 37.003 1.127 possible 1106 146 . LEU N 12 N3H1s 0.700 1.640 2.472 11.836 13.517 0.876 [OK] 1107 146 . LEU CA 3 C4H1s 0.770 1.880 3.135 13.680 13.055 1.048 possible 1108 146 . LEU C 1 C3H0s 0.770 1.610 4.062 8.949 8.781 1.019 possible 1109 146 . LEU O 16 O1H0u 0.660 1.420 4.843 30.791 15.957 1.930 possible 1110 146 . LEU CB 8 C4H2s 0.770 1.880 14.154 -1.000 22.818 -1.000 bad 1111 146 . LEU CG 4 C4H1b 0.770 1.880 3.338 15.639 14.704 1.064 possible 1112 146 . LEU CD1 10 C4H3u 0.770 1.880 44.527 -1.000 37.235 -1.000 bad 1113 146 . LEU CD2 10 C4H3u 0.770 1.880 49.000 -1.000 37.020 -1.000 bad 1114 147 . TYR N 12 N3H1s 0.700 1.640 4.562 16.214 13.473 1.203 possible 1115 147 . TYR CA 3 C4H1s 0.770 1.880 5.581 21.711 13.249 1.639 possible 1116 147 . TYR C 1 C3H0s 0.770 1.610 2.167 7.706 8.714 0.884 [OK] 1117 147 . TYR O 16 O1H0u 0.660 1.420 2.297 13.423 15.901 0.844 [OK] 1118 147 . TYR CB 8 C4H2s 0.770 1.880 4.593 37.503 23.426 1.601 possible 1119 147 . TYR CG 2 C3H0b 0.770 1.610 4.972 15.602 9.695 1.609 possible 1120 147 . TYR CD1 5 C3H1s 0.770 1.760 4.720 26.767 20.057 1.335 possible 1121 147 . TYR CD2 5 C3H1s 0.770 1.760 26.827 -1.000 20.578 -1.000 bad 1122 147 . TYR CE1 5 C3H1s 0.770 1.760 4.897 35.367 20.534 1.722 possible 1123 147 . TYR CE2 5 C3H1s 0.770 1.760 30.242 -1.000 20.577 -1.000 bad 1124 147 . TYR CZ 2 C3H0b 0.770 1.610 6.752 18.839 9.888 1.905 possible 1125 147 . TYR OH 17 O2H1u 0.660 1.460 42.764 -1.000 18.541 -1.000 bad 1126 148 . ILE N 12 N3H1s 0.700 1.640 2.777 13.602 13.493 1.008 [OK] 1127 148 . ILE CA 3 C4H1s 0.770 1.880 3.389 17.750 12.946 1.371 possible 1128 148 . ILE C 1 C3H0s 0.770 1.610 1.958 7.139 8.445 0.845 [OK] 1129 148 . ILE O 16 O1H0u 0.660 1.420 2.459 15.468 15.930 0.971 [OK] 1130 148 . ILE CB 4 C4H1b 0.770 1.880 3.073 15.717 14.146 1.111 possible 1131 148 . ILE CG1 9 C4H2b 0.770 1.880 2.951 20.917 24.071 0.869 [OK] 1132 148 . ILE CG2 10 C4H3u 0.770 1.880 3.301 30.652 35.763 0.857 possible 1133 148 . ILE CD1 10 C4H3u 0.770 1.880 3.643 47.165 38.219 1.234 possible 1134 149 . LEU N 12 N3H1s 0.700 1.640 2.527 12.885 13.517 0.953 [OK] 1135 149 . LEU CA 3 C4H1s 0.770 1.880 2.797 12.667 13.055 0.970 [OK] 1136 149 . LEU C 1 C3H0s 0.770 1.610 1.982 7.515 8.781 0.856 [OK] 1137 149 . LEU O 16 O1H0u 0.660 1.420 2.350 11.978 15.957 0.751 [OK] 1138 149 . LEU CB 8 C4H2s 0.770 1.880 3.880 23.336 22.818 1.023 possible 1139 149 . LEU CG 4 C4H1b 0.770 1.880 3.409 16.710 14.704 1.136 possible 1140 149 . LEU CD1 10 C4H3u 0.770 1.880 5.017 57.798 37.235 1.552 possible 1141 149 . LEU CD2 10 C4H3u 0.770 1.880 3.514 41.921 37.020 1.132 possible 1142 150 . TYR N 12 N3H1s 0.700 1.640 3.459 14.126 13.473 1.048 possible 1143 150 . TYR CA 3 C4H1s 0.770 1.880 3.595 14.650 13.249 1.106 possible 1144 150 . TYR C 1 C3H0s 0.770 1.610 2.467 7.524 8.714 0.863 [OK] 1145 150 . TYR O 16 O1H0u 0.660 1.420 2.697 14.980 15.901 0.942 [OK] 1146 150 . TYR CB 8 C4H2s 0.770 1.880 7.102 57.983 23.426 2.475 possible 1147 150 . TYR CG 2 C3H0b 0.770 1.610 6.520 16.825 9.695 1.735 possible 1148 150 . TYR CD1 5 C3H1s 0.770 1.760 10.274 -1.000 20.057 -1.000 bad 1149 150 . TYR CD2 5 C3H1s 0.770 1.760 5.395 23.643 20.578 1.149 possible 1150 150 . TYR CE1 5 C3H1s 0.770 1.760 19.896 -1.000 20.534 -1.000 bad 1151 150 . TYR CE2 5 C3H1s 0.770 1.760 5.391 38.794 20.577 1.885 possible 1152 150 . TYR CZ 2 C3H0b 0.770 1.610 3.248 -1.000 9.888 -1.000 bad 1153 150 . TYR OH 17 O2H1u 0.660 1.460 48.857 -1.000 18.541 -1.000 bad 1154 151 . VAL N 12 N3H1s 0.700 1.640 2.463 11.331 13.553 0.836 [OK] 1155 151 . VAL CA 3 C4H1s 0.770 1.880 3.554 16.137 13.078 1.234 possible 1156 151 . VAL C 1 C3H0s 0.770 1.610 2.632 8.447 8.528 0.991 [OK] 1157 151 . VAL O 16 O1H0u 0.660 1.420 2.776 15.294 15.998 0.956 [OK] 1158 151 . VAL CB 4 C4H1b 0.770 1.880 2.912 16.246 14.514 1.119 [OK] 1159 151 . VAL CG1 10 C4H3u 0.770 1.880 5.322 78.774 36.320 2.169 possible 1160 151 . VAL CG2 10 C4H3u 0.770 1.880 4.092 41.612 36.173 1.150 possible 1161 152 . LEU N 12 N3H1s 0.700 1.640 2.652 13.011 13.517 0.963 [OK] 1162 152 . LEU CA 3 C4H1s 0.770 1.880 2.681 11.595 13.055 0.888 [OK] 1163 152 . LEU C 1 C3H0s 0.770 1.610 2.707 9.290 8.781 1.058 [OK] 1164 152 . LEU O 16 O1H0u 0.660 1.420 2.580 15.858 15.957 0.994 [OK] 1165 152 . LEU CB 8 C4H2s 0.770 1.880 3.249 23.720 22.818 1.040 possible 1166 152 . LEU CG 4 C4H1b 0.770 1.880 2.872 15.168 14.704 1.032 [OK] 1167 152 . LEU CD1 10 C4H3u 0.770 1.880 3.245 36.856 37.235 0.990 possible 1168 152 . LEU CD2 10 C4H3u 0.770 1.880 3.193 40.862 37.020 1.104 possible 1169 153 . PHE N 12 N3H1s 0.700 1.640 2.703 13.703 13.524 1.013 [OK] 1170 153 . PHE CA 3 C4H1s 0.770 1.880 2.731 13.272 13.371 0.993 [OK] 1171 153 . PHE C 1 C3H0s 0.770 1.610 4.290 9.803 8.697 1.127 possible 1172 153 . PHE O 16 O1H0u 0.660 1.420 4.302 17.634 15.961 1.105 possible 1173 153 . PHE CB 8 C4H2s 0.770 1.880 4.622 29.534 23.623 1.250 possible 1174 153 . PHE CG 2 C3H0b 0.770 1.610 5.062 12.423 9.684 1.283 possible 1175 153 . PHE CD1 5 C3H1s 0.770 1.760 5.332 27.496 20.325 1.353 possible 1176 153 . PHE CD2 6 C3H1b 0.770 1.760 7.183 36.228 20.948 1.729 possible 1177 153 . PHE CE1 6 C3H1b 0.770 1.760 5.496 22.670 21.532 1.053 possible 1178 153 . PHE CE2 6 C3H1b 0.770 1.760 13.977 -1.000 21.625 -1.000 bad 1179 153 . PHE CZ 6 C3H1b 0.770 1.760 14.612 -1.000 21.555 -1.000 bad 1180 154 . PHE N 12 N3H1s 0.700 1.640 4.375 15.440 13.524 1.142 possible 1181 154 . PHE CA 3 C4H1s 0.770 1.880 4.954 22.416 13.371 1.676 possible 1182 154 . PHE C 1 C3H0s 0.770 1.610 4.548 9.737 8.697 1.120 possible 1183 154 . PHE O 16 O1H0u 0.660 1.420 5.383 34.882 15.961 2.185 possible 1184 154 . PHE CB 8 C4H2s 0.770 1.880 5.588 32.217 23.623 1.364 possible 1185 154 . PHE CG 2 C3H0b 0.770 1.610 3.763 11.155 9.684 1.152 possible 1186 154 . PHE CD1 5 C3H1s 0.770 1.760 23.455 -1.000 20.325 -1.000 bad 1187 154 . PHE CD2 6 C3H1b 0.770 1.760 3.953 20.912 20.948 0.998 possible 1188 154 . PHE CE1 6 C3H1b 0.770 1.760 36.242 -1.000 21.532 -1.000 bad 1189 154 . PHE CE2 6 C3H1b 0.770 1.760 23.587 -1.000 21.625 -1.000 bad 1190 154 . PHE CZ 6 C3H1b 0.770 1.760 36.548 -1.000 21.555 -1.000 bad 1191 155 . GLY N 12 N3H1s 0.700 1.640 4.389 19.232 14.480 1.328 possible 1192 155 . GLY CA 8 C4H2s 0.770 1.880 25.742 -1.000 23.470 -1.000 bad 1193 155 . GLY C 2 C3H0b 0.770 1.610 3.507 12.398 9.652 1.284 possible 1194 155 . GLY O 16 O1H0u 0.660 1.420 6.938 42.991 16.154 2.661 possible 1195 156 . PHE N 12 N3H1s 0.700 1.640 3.082 14.148 13.524 1.046 possible 1196 156 . PHE CA 3 C4H1s 0.770 1.880 3.148 14.004 13.371 1.047 possible 1197 156 . PHE C 1 C3H0s 0.770 1.610 2.414 8.518 8.697 0.979 [OK] 1198 156 . PHE O 16 O1H0u 0.660 1.420 2.439 12.141 15.961 0.761 [OK] 1199 156 . PHE CB 8 C4H2s 0.770 1.880 2.635 18.697 23.623 0.791 [OK] 1200 156 . PHE CG 2 C3H0b 0.770 1.610 2.981 11.157 9.684 1.152 [OK] 1201 156 . PHE CD1 5 C3H1s 0.770 1.760 4.004 28.975 20.325 1.426 possible 1202 156 . PHE CD2 6 C3H1b 0.770 1.760 3.130 20.366 20.948 0.972 possible 1203 156 . PHE CE1 6 C3H1b 0.770 1.760 3.524 28.641 21.532 1.330 possible 1204 156 . PHE CE2 6 C3H1b 0.770 1.760 3.066 24.268 21.625 1.122 possible 1205 156 . PHE CZ 6 C3H1b 0.770 1.760 3.285 27.360 21.555 1.269 possible 1206 157 . THR N 12 N3H1s 0.700 1.640 2.516 13.712 13.544 1.012 [OK] 1207 157 . THR CA 3 C4H1s 0.770 1.880 3.098 12.596 13.025 0.967 possible 1208 157 . THR C 1 C3H0s 0.770 1.610 2.882 7.640 8.685 0.880 [OK] 1209 157 . THR O 16 O1H0u 0.660 1.420 7.205 39.508 15.795 2.501 possible 1210 157 . THR CB 4 C4H1b 0.770 1.880 4.262 15.545 14.687 1.058 possible 1211 157 . THR OG1 17 O2H1u 0.660 1.460 3.286 19.243 17.610 1.093 possible 1212 157 . THR CG2 10 C4H3u 0.770 1.880 33.914 -1.000 36.265 -1.000 bad 1213 158 . SER N 12 N3H1s 0.700 1.640 3.852 16.642 13.808 1.205 possible 1214 158 . SER CA 3 C4H1s 0.770 1.880 7.521 28.926 13.351 2.167 possible 1215 158 . SER C 1 C3H0s 0.770 1.610 3.708 9.782 8.858 1.104 possible 1216 158 . SER O 16 O1H0u 0.660 1.420 28.462 -1.000 15.860 -1.000 bad 1217 158 . SER CB 8 C4H2s 0.770 1.880 17.992 -1.000 23.599 -1.000 bad 1218 158 . SER OG 17 O2H1u 0.660 1.460 42.800 -1.000 18.021 -1.000 bad 1219 159 . LYS N 12 N3H1s 0.700 1.640 3.320 11.713 13.429 0.872 possible 1220 159 . LYS CA 3 C4H1s 0.770 1.880 3.794 15.679 13.217 1.186 possible 1221 159 . LYS C 1 C3H0s 0.770 1.610 2.409 7.579 8.696 0.872 [OK] 1222 159 . LYS O 16 O1H0u 0.660 1.420 2.791 14.795 15.818 0.935 [OK] 1223 159 . LYS CB 8 C4H2s 0.770 1.880 7.846 55.317 22.578 2.450 possible 1224 159 . LYS CG 8 C4H2s 0.770 1.880 5.236 37.736 22.847 1.652 possible 1225 159 . LYS CD 8 C4H2s 0.770 1.880 26.737 -1.000 23.365 -1.000 bad 1226 159 . LYS CE 9 C4H2b 0.770 1.880 24.351 -1.000 23.720 -1.000 bad 1227 159 . LYS NZ 14 N4H3u 0.700 1.640 18.231 -1.000 21.413 -1.000 bad 1228 160 . ALA N 12 N3H1s 0.700 1.640 2.370 9.243 13.872 0.666 [OK] 1229 160 . ALA CA 4 C4H1b 0.770 1.880 2.854 12.231 13.959 0.876 [OK] 1230 160 . ALA C 1 C3H0s 0.770 1.610 3.463 9.913 8.858 1.119 possible 1231 160 . ALA O 16 O1H0u 0.660 1.420 3.258 23.152 16.026 1.445 possible 1232 160 . ALA CB 10 C4H3u 0.770 1.880 3.667 41.019 36.551 1.122 possible 1233 161 . GLU N 12 N3H1s 0.700 1.640 3.998 17.569 13.461 1.305 possible 1234 161 . GLU CA 3 C4H1s 0.770 1.880 4.975 25.688 13.284 1.934 possible 1235 161 . GLU C 1 C3H0s 0.770 1.610 2.179 7.400 8.631 0.857 [OK] 1236 161 . GLU O 16 O1H0u 0.660 1.420 4.085 20.268 15.765 1.286 possible 1237 161 . GLU CB 8 C4H2s 0.770 1.880 6.047 59.063 23.214 2.544 possible 1238 161 . GLU CG 8 C4H2s 0.770 1.880 38.512 -1.000 23.304 -1.000 bad 1239 161 . GLU CD 2 C3H0b 0.770 1.610 6.922 17.165 9.437 1.819 possible 1240 161 . GLU OE1 16 O1H0u 0.660 1.420 41.710 -1.000 15.497 -1.000 bad 1241 161 . GLU OE2 16 O1H0u 0.660 1.420 4.796 25.851 16.213 1.594 possible 1242 162 . SER N 12 N3H1s 0.700 1.640 3.622 15.396 13.808 1.115 possible 1243 162 . SER CA 3 C4H1s 0.770 1.880 5.201 20.294 13.351 1.520 possible 1244 162 . SER C 1 C3H0s 0.770 1.610 2.799 8.098 8.858 0.914 [OK] 1245 162 . SER O 16 O1H0u 0.660 1.420 5.738 33.098 15.860 2.087 possible 1246 162 . SER CB 8 C4H2s 0.770 1.880 3.853 25.538 23.599 1.082 possible 1247 162 . SER OG 17 O2H1u 0.660 1.460 5.111 44.138 18.021 2.449 possible 1248 163 . MET N 12 N3H1s 0.700 1.640 5.879 32.083 13.405 2.393 possible 1249 163 . MET CA 3 C4H1s 0.770 1.880 2.623 9.635 13.194 0.730 [OK] 1250 163 . MET C 1 C3H0s 0.770 1.610 3.142 9.480 8.756 1.083 possible 1251 163 . MET O 16 O1H0u 0.660 1.420 9.421 -1.000 16.002 -1.000 bad 1252 163 . MET CB 8 C4H2s 0.770 1.880 7.766 -1.000 23.418 -1.000 bad 1253 163 . MET CG 9 C4H2b 0.770 1.880 36.291 -1.000 23.830 -1.000 bad 1254 163 . MET SD 19 S2H0u 1.040 1.770 17.752 -1.000 30.207 -1.000 bad 1255 163 . MET CE 10 C4H3u 0.770 1.880 61.153 -1.000 37.003 -1.000 bad 1256 164 . ARG N 12 N3H1s 0.700 1.640 2.982 11.669 13.486 0.865 [OK] 1257 164 . ARG CA 3 C4H1s 0.770 1.880 5.294 19.091 13.310 1.434 possible 1258 164 . ARG C 1 C3H0s 0.770 1.610 2.920 9.461 8.779 1.078 [OK] 1259 164 . ARG O 16 O1H0u 0.660 1.420 2.893 16.475 15.916 1.035 [OK] 1260 164 . ARG CB 8 C4H2s 0.770 1.880 5.776 56.855 22.833 2.490 possible 1261 164 . ARG CG 8 C4H2s 0.770 1.880 3.436 20.086 23.273 0.863 possible 1262 164 . ARG CD 8 C4H2s 0.770 1.880 7.804 83.746 22.849 3.665 possible 1263 164 . ARG NE 13 N3H1b 0.700 1.640 6.650 -1.000 15.019 -1.000 bad 1264 164 . ARG CZ 2 C3H0b 0.770 1.610 2.284 -1.000 9.678 -1.000 bad 1265 164 . ARG NH1 15 N3H2u 0.700 1.640 48.783 -1.000 22.056 -1.000 bad 1266 164 . ARG NH2 15 N3H2u 0.700 1.640 32.613 -1.000 23.132 -1.000 bad 1267 165 . PRO N 11 N3H0u 0.700 1.640 3.772 10.498 8.650 1.214 possible 1268 165 . PRO CA 4 C4H1b 0.770 1.880 6.325 28.556 13.828 2.065 possible 1269 165 . PRO C 1 C3H0s 0.770 1.610 3.490 9.293 8.768 1.060 possible 1270 165 . PRO O 16 O1H0u 0.660 1.420 4.309 17.458 15.856 1.101 possible 1271 165 . PRO CB 9 C4H2b 0.770 1.880 35.632 -1.000 25.314 -1.000 bad 1272 165 . PRO CG 9 C4H2b 0.770 1.880 38.403 -1.000 25.480 -1.000 bad 1273 165 . PRO CD 8 C4H2s 0.770 1.880 18.239 -1.000 23.390 -1.000 bad 1274 166 . GLU N 12 N3H1s 0.700 1.640 3.441 17.759 13.461 1.319 possible 1275 166 . GLU CA 3 C4H1s 0.770 1.880 3.323 15.945 13.284 1.200 possible 1276 166 . GLU C 1 C3H0s 0.770 1.610 3.223 9.035 8.631 1.047 possible 1277 166 . GLU O 16 O1H0u 0.660 1.420 3.779 18.578 15.765 1.178 possible 1278 166 . GLU CB 8 C4H2s 0.770 1.880 4.569 41.533 23.214 1.789 possible 1279 166 . GLU CG 8 C4H2s 0.770 1.880 4.563 44.796 23.304 1.922 possible 1280 166 . GLU CD 2 C3H0b 0.770 1.610 4.399 13.843 9.437 1.467 possible 1281 166 . GLU OE1 16 O1H0u 0.660 1.420 29.675 -1.000 15.497 -1.000 bad 1282 166 . GLU OE2 16 O1H0u 0.660 1.420 41.994 -1.000 16.213 -1.000 bad 1283 167 . VAL N 12 N3H1s 0.700 1.640 3.083 15.549 13.553 1.147 possible 1284 167 . VAL CA 3 C4H1s 0.770 1.880 3.201 13.889 13.078 1.062 possible 1285 167 . VAL C 1 C3H0s 0.770 1.610 2.363 7.485 8.528 0.878 [OK] 1286 167 . VAL O 16 O1H0u 0.660 1.420 2.890 18.416 15.998 1.151 [OK] 1287 167 . VAL CB 4 C4H1b 0.770 1.880 2.516 12.191 14.514 0.840 [OK] 1288 167 . VAL CG1 10 C4H3u 0.770 1.880 4.656 48.523 36.320 1.336 possible 1289 167 . VAL CG2 10 C4H3u 0.770 1.880 5.277 76.001 36.173 2.101 possible 1290 168 . ALA N 12 N3H1s 0.700 1.640 2.517 12.941 13.872 0.933 [OK] 1291 168 . ALA CA 4 C4H1b 0.770 1.880 3.174 17.234 13.959 1.235 possible 1292 168 . ALA C 1 C3H0s 0.770 1.610 2.885 9.134 8.858 1.031 [OK] 1293 168 . ALA O 16 O1H0u 0.660 1.420 2.701 17.416 16.026 1.087 [OK] 1294 168 . ALA CB 10 C4H3u 0.770 1.880 6.482 77.593 36.551 2.123 possible 1295 169 . SER N 12 N3H1s 0.700 1.640 3.345 13.491 13.808 0.977 possible 1296 169 . SER CA 3 C4H1s 0.770 1.880 4.007 18.919 13.351 1.417 possible 1297 169 . SER C 1 C3H0s 0.770 1.610 2.944 9.020 8.858 1.018 [OK] 1298 169 . SER O 16 O1H0u 0.660 1.420 3.890 15.237 15.860 0.961 possible 1299 169 . SER CB 8 C4H2s 0.770 1.880 34.594 -1.000 23.599 -1.000 bad 1300 169 . SER OG 17 O2H1u 0.660 1.460 18.522 -1.000 18.021 -1.000 bad 1301 170 . THR N 12 N3H1s 0.700 1.640 4.969 17.735 13.544 1.309 possible 1302 170 . THR CA 3 C4H1s 0.770 1.880 6.121 26.605 13.025 2.043 possible 1303 170 . THR C 1 C3H0s 0.770 1.610 2.560 7.985 8.685 0.919 [OK] 1304 170 . THR O 16 O1H0u 0.660 1.420 2.951 18.190 15.795 1.152 [OK] 1305 170 . THR CB 4 C4H1b 0.770 1.880 5.858 28.415 14.687 1.935 possible 1306 170 . THR OG1 17 O2H1u 0.660 1.460 3.975 30.300 17.610 1.721 possible 1307 170 . THR CG2 10 C4H3u 0.770 1.880 3.490 31.570 36.265 0.871 possible 1308 171 . PHE N 12 N3H1s 0.700 1.640 2.571 12.833 13.524 0.949 [OK] 1309 171 . PHE CA 3 C4H1s 0.770 1.880 2.954 14.359 13.371 1.074 [OK] 1310 171 . PHE C 1 C3H0s 0.770 1.610 1.992 7.184 8.697 0.826 [OK] 1311 171 . PHE O 16 O1H0u 0.660 1.420 2.628 14.023 15.961 0.879 [OK] 1312 171 . PHE CB 8 C4H2s 0.770 1.880 3.410 26.852 23.623 1.137 possible 1313 171 . PHE CG 2 C3H0b 0.770 1.610 2.639 10.061 9.684 1.039 [OK] 1314 171 . PHE CD1 5 C3H1s 0.770 1.760 3.101 20.008 20.325 0.984 possible 1315 171 . PHE CD2 6 C3H1b 0.770 1.760 3.015 23.730 20.948 1.133 possible 1316 171 . PHE CE1 6 C3H1b 0.770 1.760 3.087 20.732 21.532 0.963 possible 1317 171 . PHE CE2 6 C3H1b 0.770 1.760 3.121 27.097 21.625 1.253 possible 1318 171 . PHE CZ 6 C3H1b 0.770 1.760 3.044 22.039 21.555 1.022 possible 1319 172 . LYS N 12 N3H1s 0.700 1.640 2.356 11.390 13.429 0.848 [OK] 1320 172 . LYS CA 3 C4H1s 0.770 1.880 2.925 13.688 13.217 1.036 [OK] 1321 172 . LYS C 1 C3H0s 0.770 1.610 4.155 8.883 8.696 1.022 possible 1322 172 . LYS O 16 O1H0u 0.660 1.420 3.759 18.839 15.818 1.191 possible 1323 172 . LYS CB 8 C4H2s 0.770 1.880 7.701 57.777 22.578 2.559 possible 1324 172 . LYS CG 8 C4H2s 0.770 1.880 3.231 22.441 22.847 0.982 possible 1325 172 . LYS CD 8 C4H2s 0.770 1.880 24.753 -1.000 23.365 -1.000 bad 1326 172 . LYS CE 9 C4H2b 0.770 1.880 4.231 40.406 23.720 1.703 possible 1327 172 . LYS NZ 14 N4H3u 0.700 1.640 54.307 -1.000 21.413 -1.000 bad 1328 173 . VAL N 12 N3H1s 0.700 1.640 4.392 13.929 13.553 1.028 possible 1329 173 . VAL CA 3 C4H1s 0.770 1.880 5.101 21.156 13.078 1.618 possible 1330 173 . VAL C 1 C3H0s 0.770 1.610 3.107 8.396 8.528 0.985 possible 1331 173 . VAL O 16 O1H0u 0.660 1.420 2.949 15.663 15.998 0.979 [OK] 1332 173 . VAL CB 4 C4H1b 0.770 1.880 3.426 17.639 14.514 1.215 possible 1333 173 . VAL CG1 10 C4H3u 0.770 1.880 33.226 -1.000 36.320 -1.000 bad 1334 173 . VAL CG2 10 C4H3u 0.770 1.880 33.023 -1.000 36.173 -1.000 bad 1335 174 . LEU N 12 N3H1s 0.700 1.640 3.094 13.146 13.517 0.973 possible 1336 174 . LEU CA 3 C4H1s 0.770 1.880 3.323 14.514 13.055 1.112 possible 1337 174 . LEU C 1 C3H0s 0.770 1.610 2.251 8.280 8.781 0.943 [OK] 1338 174 . LEU O 16 O1H0u 0.660 1.420 2.729 18.079 15.957 1.133 [OK] 1339 174 . LEU CB 8 C4H2s 0.770 1.880 3.155 22.779 22.818 0.998 possible 1340 174 . LEU CG 4 C4H1b 0.770 1.880 3.478 18.725 14.704 1.273 possible 1341 174 . LEU CD1 10 C4H3u 0.770 1.880 3.385 41.517 37.235 1.115 possible 1342 174 . LEU CD2 10 C4H3u 0.770 1.880 3.579 42.632 37.020 1.152 possible 1343 175 . ARG N 12 N3H1s 0.700 1.640 2.870 14.035 13.486 1.041 [OK] 1344 175 . ARG CA 3 C4H1s 0.770 1.880 3.078 16.969 13.310 1.275 possible 1345 175 . ARG C 1 C3H0s 0.770 1.610 2.330 7.617 8.779 0.868 [OK] 1346 175 . ARG O 16 O1H0u 0.660 1.420 2.640 15.599 15.916 0.980 [OK] 1347 175 . ARG CB 8 C4H2s 0.770 1.880 3.170 28.507 22.833 1.249 possible 1348 175 . ARG CG 8 C4H2s 0.770 1.880 3.142 23.591 23.273 1.014 possible 1349 175 . ARG CD 8 C4H2s 0.770 1.880 3.227 23.340 22.849 1.021 possible 1350 175 . ARG NE 13 N3H1b 0.700 1.640 3.160 16.816 15.019 1.120 possible 1351 175 . ARG CZ 2 C3H0b 0.770 1.610 3.837 12.639 9.678 1.306 possible 1352 175 . ARG NH1 15 N3H2u 0.700 1.640 5.411 51.897 22.056 2.353 possible 1353 175 . ARG NH2 15 N3H2u 0.700 1.640 36.474 -1.000 23.132 -1.000 bad 1354 176 . ASN N 12 N3H1s 0.700 1.640 2.339 12.189 13.525 0.901 [OK] 1355 176 . ASN CA 3 C4H1s 0.770 1.880 3.244 14.436 13.052 1.106 possible 1356 176 . ASN C 1 C3H0s 0.770 1.610 2.750 8.204 8.853 0.927 [OK] 1357 176 . ASN O 16 O1H0u 0.660 1.420 2.616 14.374 15.857 0.906 [OK] 1358 176 . ASN CB 8 C4H2s 0.770 1.880 4.494 31.352 22.756 1.378 possible 1359 176 . ASN CG 2 C3H0b 0.770 1.610 6.714 17.518 9.537 1.837 possible 1360 176 . ASN OD1 16 O1H0u 0.660 1.420 37.412 -1.000 16.247 -1.000 bad 1361 176 . ASN ND2 15 N3H2u 0.700 1.640 27.657 -1.000 22.525 -1.000 bad 1362 177 . VAL N 12 N3H1s 0.700 1.640 3.547 14.475 13.553 1.068 possible 1363 177 . VAL CA 3 C4H1s 0.770 1.880 4.543 20.105 13.078 1.537 possible 1364 177 . VAL C 1 C3H0s 0.770 1.610 3.164 8.138 8.528 0.954 possible 1365 177 . VAL O 16 O1H0u 0.660 1.420 3.077 18.062 15.998 1.129 possible 1366 177 . VAL CB 4 C4H1b 0.770 1.880 3.418 19.507 14.514 1.344 possible 1367 177 . VAL CG1 10 C4H3u 0.770 1.880 27.433 -1.000 36.320 -1.000 bad 1368 177 . VAL CG2 10 C4H3u 0.770 1.880 24.967 -1.000 36.173 -1.000 bad 1369 178 . THR N 12 N3H1s 0.700 1.640 3.472 15.021 13.544 1.109 possible 1370 178 . THR CA 3 C4H1s 0.770 1.880 3.804 20.120 13.025 1.545 possible 1371 178 . THR C 1 C3H0s 0.770 1.610 2.339 7.307 8.685 0.841 [OK] 1372 178 . THR O 16 O1H0u 0.660 1.420 3.042 16.556 15.795 1.048 possible 1373 178 . THR CB 4 C4H1b 0.770 1.880 3.027 12.664 14.687 0.862 possible 1374 178 . THR OG1 17 O2H1u 0.660 1.460 3.302 25.954 17.610 1.474 possible 1375 178 . THR CG2 10 C4H3u 0.770 1.880 3.127 34.528 36.265 0.952 possible 1376 179 . VAL N 12 N3H1s 0.700 1.640 2.329 11.190 13.553 0.826 [OK] 1377 179 . VAL CA 3 C4H1s 0.770 1.880 2.713 12.449 13.078 0.952 [OK] 1378 179 . VAL C 1 C3H0s 0.770 1.610 2.555 7.664 8.528 0.899 [OK] 1379 179 . VAL O 16 O1H0u 0.660 1.420 2.519 15.426 15.998 0.964 [OK] 1380 179 . VAL CB 4 C4H1b 0.770 1.880 3.642 15.184 14.514 1.046 possible 1381 179 . VAL CG1 10 C4H3u 0.770 1.880 31.898 -1.000 36.320 -1.000 bad 1382 179 . VAL CG2 10 C4H3u 0.770 1.880 4.525 39.980 36.173 1.105 possible 1383 180 . VAL N 12 N3H1s 0.700 1.640 2.711 13.538 13.553 0.999 [OK] 1384 180 . VAL CA 3 C4H1s 0.770 1.880 4.808 18.726 13.078 1.432 possible 1385 180 . VAL C 1 C3H0s 0.770 1.610 2.636 7.879 8.528 0.924 [OK] 1386 180 . VAL O 16 O1H0u 0.660 1.420 4.496 21.963 15.998 1.373 possible 1387 180 . VAL CB 4 C4H1b 0.770 1.880 4.897 20.239 14.514 1.394 possible 1388 180 . VAL CG1 10 C4H3u 0.770 1.880 56.050 -1.000 36.320 -1.000 bad 1389 180 . VAL CG2 10 C4H3u 0.770 1.880 32.437 -1.000 36.173 -1.000 bad 1390 181 . LEU N 12 N3H1s 0.700 1.640 3.357 16.312 13.517 1.207 possible 1391 181 . LEU CA 3 C4H1s 0.770 1.880 4.428 19.213 13.055 1.472 possible 1392 181 . LEU C 1 C3H0s 0.770 1.610 2.335 8.166 8.781 0.930 [OK] 1393 181 . LEU O 16 O1H0u 0.660 1.420 2.503 15.496 15.957 0.971 [OK] 1394 181 . LEU CB 8 C4H2s 0.770 1.880 3.642 27.041 22.818 1.185 possible 1395 181 . LEU CG 4 C4H1b 0.770 1.880 6.518 38.464 14.704 2.616 possible 1396 181 . LEU CD1 10 C4H3u 0.770 1.880 6.935 57.660 37.235 1.549 possible 1397 181 . LEU CD2 10 C4H3u 0.770 1.880 4.432 37.028 37.020 1.000 possible 1398 182 . TRP N 12 N3H1s 0.700 1.640 3.223 15.502 13.639 1.137 possible 1399 182 . TRP CA 3 C4H1s 0.770 1.880 2.575 10.988 13.323 0.825 [OK] 1400 182 . TRP C 1 C3H0s 0.770 1.610 2.296 7.771 8.687 0.895 [OK] 1401 182 . TRP O 16 O1H0u 0.660 1.420 2.545 11.975 15.797 0.758 [OK] 1402 182 . TRP CB 8 C4H2s 0.770 1.880 3.325 25.396 23.826 1.066 possible 1403 182 . TRP CG 2 C3H0b 0.770 1.610 3.208 12.652 9.915 1.276 possible 1404 182 . TRP CD1 5 C3H1s 0.770 1.760 3.037 20.177 20.597 0.980 possible 1405 182 . TRP CD2 2 C3H0b 0.770 1.610 3.234 14.881 10.068 1.478 possible 1406 182 . TRP NE1 13 N3H1b 0.700 1.640 3.054 15.422 16.723 0.922 possible 1407 182 . TRP CE2 2 C3H0b 0.770 1.610 3.195 13.017 9.848 1.322 possible 1408 182 . TRP CE3 6 C3H1b 0.770 1.760 3.530 23.563 20.383 1.156 possible 1409 182 . TRP CZ2 6 C3H1b 0.770 1.760 3.542 24.884 20.931 1.189 possible 1410 182 . TRP CZ3 6 C3H1b 0.770 1.760 3.637 24.450 21.429 1.141 possible 1411 182 . TRP CH2 6 C3H1b 0.770 1.760 3.380 23.193 21.219 1.093 possible 1412 183 . SER N 12 N3H1s 0.700 1.640 2.781 12.826 13.808 0.929 [OK] 1413 183 . SER CA 3 C4H1s 0.770 1.880 4.362 14.399 13.351 1.078 possible 1414 183 . SER C 1 C3H0s 0.770 1.610 3.397 8.574 8.858 0.968 possible 1415 183 . SER O 16 O1H0u 0.660 1.420 4.636 19.114 15.860 1.205 possible 1416 183 . SER CB 8 C4H2s 0.770 1.880 34.581 -1.000 23.599 -1.000 bad 1417 183 . SER OG 17 O2H1u 0.660 1.460 5.963 -1.000 18.021 -1.000 bad 1418 184 . ALA N 12 N3H1s 0.700 1.640 4.965 16.680 13.872 1.202 possible 1419 184 . ALA CA 4 C4H1b 0.770 1.880 6.712 30.188 13.959 2.163 possible 1420 184 . ALA C 1 C3H0s 0.770 1.610 2.481 8.265 8.858 0.933 [OK] 1421 184 . ALA O 16 O1H0u 0.660 1.420 2.889 13.262 16.026 0.828 [OK] 1422 184 . ALA CB 10 C4H3u 0.770 1.880 23.456 -1.000 36.551 -1.000 bad 1423 185 . TYR N 12 N3H1s 0.700 1.640 2.574 13.554 13.473 1.006 [OK] 1424 185 . TYR CA 3 C4H1s 0.770 1.880 3.063 15.747 13.249 1.189 possible 1425 185 . TYR C 1 C3H0s 0.770 1.610 2.330 8.155 8.714 0.936 [OK] 1426 185 . TYR O 16 O1H0u 0.660 1.420 2.528 17.631 15.901 1.109 [OK] 1427 185 . TYR CB 8 C4H2s 0.770 1.880 2.907 21.029 23.426 0.898 [OK] 1428 185 . TYR CG 2 C3H0b 0.770 1.610 2.575 9.257 9.695 0.955 [OK] 1429 185 . TYR CD1 5 C3H1s 0.770 1.760 2.833 22.517 20.057 1.123 [OK] 1430 185 . TYR CD2 5 C3H1s 0.770 1.760 2.689 15.612 20.578 0.759 [OK] 1431 185 . TYR CE1 5 C3H1s 0.770 1.760 3.068 25.400 20.534 1.237 possible 1432 185 . TYR CE2 5 C3H1s 0.770 1.760 3.415 23.773 20.577 1.155 possible 1433 185 . TYR CZ 2 C3H0b 0.770 1.610 2.436 9.370 9.888 0.948 [OK] 1434 185 . TYR OH 17 O2H1u 0.660 1.460 2.495 19.776 18.541 1.067 [OK] 1435 186 . PRO N 11 N3H0u 0.700 1.640 2.418 8.726 8.650 1.009 [OK] 1436 186 . PRO CA 4 C4H1b 0.770 1.880 2.798 15.713 13.828 1.136 [OK] 1437 186 . PRO C 1 C3H0s 0.770 1.610 2.429 8.470 8.768 0.966 [OK] 1438 186 . PRO O 16 O1H0u 0.660 1.420 2.396 15.886 15.856 1.002 [OK] 1439 186 . PRO CB 9 C4H2b 0.770 1.880 4.886 38.596 25.314 1.525 possible 1440 186 . PRO CG 9 C4H2b 0.770 1.880 4.620 27.403 25.480 1.075 possible 1441 186 . PRO CD 8 C4H2s 0.770 1.880 2.943 16.751 23.390 0.716 [OK] 1442 187 . VAL N 12 N3H1s 0.700 1.640 3.343 14.732 13.553 1.087 possible 1443 187 . VAL CA 3 C4H1s 0.770 1.880 3.982 19.203 13.078 1.468 possible 1444 187 . VAL C 1 C3H0s 0.770 1.610 2.632 7.816 8.528 0.917 [OK] 1445 187 . VAL O 16 O1H0u 0.660 1.420 3.199 16.291 15.998 1.018 possible 1446 187 . VAL CB 4 C4H1b 0.770 1.880 4.726 18.905 14.514 1.303 possible 1447 187 . VAL CG1 10 C4H3u 0.770 1.880 48.913 -1.000 36.320 -1.000 bad 1448 187 . VAL CG2 10 C4H3u 0.770 1.880 36.393 -1.000 36.173 -1.000 bad 1449 188 . VAL N 12 N3H1s 0.700 1.640 3.469 13.811 13.553 1.019 possible 1450 188 . VAL CA 3 C4H1s 0.770 1.880 3.793 14.211 13.078 1.087 possible 1451 188 . VAL C 1 C3H0s 0.770 1.610 2.734 8.137 8.528 0.954 [OK] 1452 188 . VAL O 16 O1H0u 0.660 1.420 2.595 16.120 15.998 1.008 [OK] 1453 188 . VAL CB 4 C4H1b 0.770 1.880 3.060 16.548 14.514 1.140 possible 1454 188 . VAL CG1 10 C4H3u 0.770 1.880 4.294 48.126 36.320 1.325 possible 1455 188 . VAL CG2 10 C4H3u 0.770 1.880 6.506 66.589 36.173 1.841 possible 1456 189 . TRP N 12 N3H1s 0.700 1.640 2.730 14.131 13.639 1.036 [OK] 1457 189 . TRP CA 3 C4H1s 0.770 1.880 3.052 14.881 13.323 1.117 possible 1458 189 . TRP C 1 C3H0s 0.770 1.610 2.390 8.425 8.687 0.970 [OK] 1459 189 . TRP O 16 O1H0u 0.660 1.420 3.154 20.743 15.797 1.313 possible 1460 189 . TRP CB 8 C4H2s 0.770 1.880 2.861 24.828 23.826 1.042 [OK] 1461 189 . TRP CG 2 C3H0b 0.770 1.610 2.935 10.430 9.915 1.052 [OK] 1462 189 . TRP CD1 5 C3H1s 0.770 1.760 3.225 23.899 20.597 1.160 possible 1463 189 . TRP CD2 2 C3H0b 0.770 1.610 3.067 11.687 10.068 1.161 possible 1464 189 . TRP NE1 13 N3H1b 0.700 1.640 3.516 23.724 16.723 1.419 possible 1465 189 . TRP CE2 2 C3H0b 0.770 1.610 3.060 11.907 9.848 1.209 possible 1466 189 . TRP CE3 6 C3H1b 0.770 1.760 3.499 21.247 20.383 1.042 possible 1467 189 . TRP CZ2 6 C3H1b 0.770 1.760 3.091 21.322 20.931 1.019 possible 1468 189 . TRP CZ3 6 C3H1b 0.770 1.760 3.530 34.558 21.429 1.613 possible 1469 189 . TRP CH2 6 C3H1b 0.770 1.760 3.227 25.351 21.219 1.195 possible 1470 190 . LEU N 12 N3H1s 0.700 1.640 2.501 13.855 13.517 1.025 [OK] 1471 190 . LEU CA 3 C4H1s 0.770 1.880 3.320 13.072 13.055 1.001 possible 1472 190 . LEU C 1 C3H0s 0.770 1.610 3.344 9.039 8.781 1.029 possible 1473 190 . LEU O 16 O1H0u 0.660 1.420 3.110 20.100 15.957 1.260 possible 1474 190 . LEU CB 8 C4H2s 0.770 1.880 3.911 26.817 22.818 1.175 possible 1475 190 . LEU CG 4 C4H1b 0.770 1.880 5.336 26.644 14.704 1.812 possible 1476 190 . LEU CD1 10 C4H3u 0.770 1.880 3.687 34.198 37.235 0.918 possible 1477 190 . LEU CD2 10 C4H3u 0.770 1.880 35.182 -1.000 37.020 -1.000 bad 1478 191 . ILE N 12 N3H1s 0.700 1.640 3.378 14.316 13.493 1.061 possible 1479 191 . ILE CA 3 C4H1s 0.770 1.880 3.510 12.295 12.946 0.950 possible 1480 191 . ILE C 1 C3H0s 0.770 1.610 2.402 8.442 8.445 1.000 [OK] 1481 191 . ILE O 16 O1H0u 0.660 1.420 2.660 16.466 15.930 1.034 [OK] 1482 191 . ILE CB 4 C4H1b 0.770 1.880 4.471 17.288 14.146 1.222 possible 1483 191 . ILE CG1 9 C4H2b 0.770 1.880 6.447 29.415 24.071 1.222 possible 1484 191 . ILE CG2 10 C4H3u 0.770 1.880 45.506 -1.000 35.763 -1.000 bad 1485 191 . ILE CD1 10 C4H3u 0.770 1.880 17.023 -1.000 38.219 -1.000 bad 1486 192 . GLY N 12 N3H1s 0.700 1.640 2.166 11.290 14.480 0.780 [OK] 1487 192 . GLY CA 8 C4H2s 0.770 1.880 3.206 24.814 23.470 1.057 possible 1488 192 . GLY C 2 C3H0b 0.770 1.610 2.759 10.277 9.652 1.065 [OK] 1489 192 . GLY O 16 O1H0u 0.660 1.420 2.487 16.607 16.154 1.028 [OK] 1490 193 . SER N 12 N3H1s 0.700 1.640 3.021 18.615 13.808 1.348 possible 1491 193 . SER CA 3 C4H1s 0.770 1.880 3.537 18.029 13.351 1.350 possible 1492 193 . SER C 1 C3H0s 0.770 1.610 2.830 8.419 8.858 0.950 [OK] 1493 193 . SER O 16 O1H0u 0.660 1.420 2.814 20.130 15.860 1.269 [OK] 1494 193 . SER CB 8 C4H2s 0.770 1.880 3.828 26.211 23.599 1.111 possible 1495 193 . SER OG 17 O2H1u 0.660 1.460 2.879 23.749 18.021 1.318 [OK] 1496 194 . GLU N 12 N3H1s 0.700 1.640 3.120 14.139 13.461 1.050 possible 1497 194 . GLU CA 3 C4H1s 0.770 1.880 3.621 14.693 13.284 1.106 possible 1498 194 . GLU C 1 C3H0s 0.770 1.610 2.931 9.189 8.631 1.065 [OK] 1499 194 . GLU O 16 O1H0u 0.660 1.420 2.709 15.817 15.765 1.003 [OK] 1500 194 . GLU CB 8 C4H2s 0.770 1.880 2.827 18.646 23.214 0.803 [OK] 1501 194 . GLU CG 8 C4H2s 0.770 1.880 4.569 24.994 23.304 1.073 possible 1502 194 . GLU CD 2 C3H0b 0.770 1.610 2.983 9.271 9.437 0.982 [OK] 1503 194 . GLU OE1 16 O1H0u 0.660 1.420 3.475 25.761 15.497 1.662 possible 1504 194 . GLU OE2 16 O1H0u 0.660 1.420 22.864 -1.000 16.213 -1.000 bad 1505 195 . GLY N 12 N3H1s 0.700 1.640 3.940 20.867 14.480 1.441 possible 1506 195 . GLY CA 8 C4H2s 0.770 1.880 3.710 33.619 23.470 1.432 possible 1507 195 . GLY C 2 C3H0b 0.770 1.610 2.952 9.180 9.652 0.951 [OK] 1508 195 . GLY O 16 O1H0u 0.660 1.420 4.712 37.132 16.154 2.299 possible 1509 196 . ALA N 12 N3H1s 0.700 1.640 2.683 15.389 13.872 1.109 [OK] 1510 196 . ALA CA 4 C4H1b 0.770 1.880 5.604 23.267 13.959 1.667 possible 1511 196 . ALA C 1 C3H0s 0.770 1.610 3.658 9.690 8.858 1.094 possible 1512 196 . ALA O 16 O1H0u 0.660 1.420 25.032 -1.000 16.026 -1.000 bad 1513 196 . ALA CB 10 C4H3u 0.770 1.880 14.491 -1.000 36.551 -1.000 bad 1514 197 . GLY N 12 N3H1s 0.700 1.640 3.792 17.651 14.480 1.219 possible 1515 197 . GLY CA 8 C4H2s 0.770 1.880 6.899 63.910 23.470 2.723 possible 1516 197 . GLY C 2 C3H0b 0.770 1.610 3.754 11.586 9.652 1.200 possible 1517 197 . GLY O 16 O1H0u 0.660 1.420 32.731 -1.000 16.154 -1.000 bad 1518 198 . ILE N 12 N3H1s 0.700 1.640 2.854 13.579 13.493 1.006 [OK] 1519 198 . ILE CA 3 C4H1s 0.770 1.880 4.137 14.946 12.946 1.154 possible 1520 198 . ILE C 1 C3H0s 0.770 1.610 3.457 10.752 8.445 1.273 possible 1521 198 . ILE O 16 O1H0u 0.660 1.420 24.240 -1.000 15.930 -1.000 bad 1522 198 . ILE CB 4 C4H1b 0.770 1.880 4.399 17.995 14.146 1.272 possible 1523 198 . ILE CG1 9 C4H2b 0.770 1.880 6.694 27.329 24.071 1.135 possible 1524 198 . ILE CG2 10 C4H3u 0.770 1.880 59.230 -1.000 35.763 -1.000 bad 1525 198 . ILE CD1 10 C4H3u 0.770 1.880 22.454 -1.000 38.219 -1.000 bad 1526 199 . VAL N 12 N3H1s 0.700 1.640 2.778 15.027 13.553 1.109 [OK] 1527 199 . VAL CA 3 C4H1s 0.770 1.880 3.647 12.812 13.078 0.980 possible 1528 199 . VAL C 1 C3H0s 0.770 1.610 3.720 9.153 8.528 1.073 possible 1529 199 . VAL O 16 O1H0u 0.660 1.420 3.812 28.559 15.998 1.785 possible 1530 199 . VAL CB 4 C4H1b 0.770 1.880 2.932 12.606 14.514 0.869 [OK] 1531 199 . VAL CG1 10 C4H3u 0.770 1.880 3.823 36.801 36.320 1.013 possible 1532 199 . VAL CG2 10 C4H3u 0.770 1.880 28.124 -1.000 36.173 -1.000 bad 1533 200 . PRO N 11 N3H0u 0.700 1.640 4.188 11.368 8.650 1.314 possible 1534 200 . PRO CA 4 C4H1b 0.770 1.880 7.695 46.018 13.828 3.328 possible 1535 200 . PRO C 1 C3H0s 0.770 1.610 2.764 8.950 8.768 1.021 [OK] 1536 200 . PRO O 16 O1H0u 0.660 1.420 2.695 14.136 15.856 0.892 [OK] 1537 200 . PRO CB 9 C4H2b 0.770 1.880 24.883 -1.000 25.314 -1.000 bad 1538 200 . PRO CG 9 C4H2b 0.770 1.880 15.973 -1.000 25.480 -1.000 bad 1539 200 . PRO CD 8 C4H2s 0.770 1.880 20.874 -1.000 23.390 -1.000 bad 1540 201 . LEU N 12 N3H1s 0.700 1.640 7.578 36.051 13.517 2.667 possible 1541 201 . LEU CA 3 C4H1s 0.770 1.880 3.287 14.483 13.055 1.109 possible 1542 201 . LEU C 1 C3H0s 0.770 1.610 2.379 8.464 8.781 0.964 [OK] 1543 201 . LEU O 16 O1H0u 0.660 1.420 2.335 12.839 15.957 0.805 [OK] 1544 201 . LEU CB 8 C4H2s 0.770 1.880 7.852 48.558 22.818 2.128 possible 1545 201 . LEU CG 4 C4H1b 0.770 1.880 4.035 19.899 14.704 1.353 possible 1546 201 . LEU CD1 10 C4H3u 0.770 1.880 6.361 58.960 37.235 1.583 possible 1547 201 . LEU CD2 10 C4H3u 0.770 1.880 4.196 45.473 37.020 1.228 possible 1548 202 . ASN N 12 N3H1s 0.700 1.640 2.647 13.247 13.525 0.979 [OK] 1549 202 . ASN CA 3 C4H1s 0.770 1.880 3.051 16.644 13.052 1.275 possible 1550 202 . ASN C 1 C3H0s 0.770 1.610 3.146 9.132 8.853 1.031 possible 1551 202 . ASN O 16 O1H0u 0.660 1.420 2.868 18.250 15.857 1.151 [OK] 1552 202 . ASN CB 8 C4H2s 0.770 1.880 4.908 36.978 22.756 1.625 possible 1553 202 . ASN CG 2 C3H0b 0.770 1.610 4.889 15.082 9.537 1.581 possible 1554 202 . ASN OD1 16 O1H0u 0.660 1.420 20.742 -1.000 16.247 -1.000 bad 1555 202 . ASN ND2 15 N3H2u 0.700 1.640 22.334 -1.000 22.525 -1.000 bad 1556 203 . ILE N 12 N3H1s 0.700 1.640 3.165 13.935 13.493 1.033 possible 1557 203 . ILE CA 3 C4H1s 0.770 1.880 3.254 13.999 12.946 1.081 possible 1558 203 . ILE C 1 C3H0s 0.770 1.610 2.157 7.677 8.445 0.909 [OK] 1559 203 . ILE O 16 O1H0u 0.660 1.420 2.550 12.262 15.930 0.770 [OK] 1560 203 . ILE CB 4 C4H1b 0.770 1.880 3.292 14.608 14.146 1.033 possible 1561 203 . ILE CG1 9 C4H2b 0.770 1.880 21.681 -1.000 24.071 -1.000 bad 1562 203 . ILE CG2 10 C4H3u 0.770 1.880 18.122 -1.000 35.763 -1.000 bad 1563 203 . ILE CD1 10 C4H3u 0.770 1.880 38.591 -1.000 38.219 -1.000 bad 1564 204 . GLU N 12 N3H1s 0.700 1.640 2.234 12.502 13.461 0.929 [OK] 1565 204 . GLU CA 3 C4H1s 0.770 1.880 3.182 14.519 13.284 1.093 possible 1566 204 . GLU C 1 C3H0s 0.770 1.610 2.329 7.394 8.631 0.857 [OK] 1567 204 . GLU O 16 O1H0u 0.660 1.420 2.497 16.611 15.765 1.054 [OK] 1568 204 . GLU CB 8 C4H2s 0.770 1.880 3.188 23.463 23.214 1.011 possible 1569 204 . GLU CG 8 C4H2s 0.770 1.880 3.977 29.190 23.304 1.253 possible 1570 204 . GLU CD 2 C3H0b 0.770 1.610 3.150 9.406 9.437 0.997 possible 1571 204 . GLU OE1 16 O1H0u 0.660 1.420 2.711 19.986 15.497 1.290 [OK] 1572 204 . GLU OE2 16 O1H0u 0.660 1.420 3.455 30.618 16.213 1.888 possible 1573 205 . THR N 12 N3H1s 0.700 1.640 2.401 11.642 13.544 0.860 [OK] 1574 205 . THR CA 3 C4H1s 0.770 1.880 3.415 16.722 13.025 1.284 possible 1575 205 . THR C 1 C3H0s 0.770 1.610 2.263 8.570 8.685 0.987 [OK] 1576 205 . THR O 16 O1H0u 0.660 1.420 2.942 18.381 15.795 1.164 [OK] 1577 205 . THR CB 4 C4H1b 0.770 1.880 2.916 15.124 14.687 1.030 [OK] 1578 205 . THR OG1 17 O2H1u 0.660 1.460 3.505 22.243 17.610 1.263 possible 1579 205 . THR CG2 10 C4H3u 0.770 1.880 3.457 42.326 36.265 1.167 possible 1580 206 . LEU N 12 N3H1s 0.700 1.640 2.559 13.322 13.517 0.986 [OK] 1581 206 . LEU CA 3 C4H1s 0.770 1.880 3.345 16.520 13.055 1.265 possible 1582 206 . LEU C 1 C3H0s 0.770 1.610 2.087 7.657 8.781 0.872 [OK] 1583 206 . LEU O 16 O1H0u 0.660 1.420 3.367 16.431 15.957 1.030 possible 1584 206 . LEU CB 8 C4H2s 0.770 1.880 2.972 21.350 22.818 0.936 [OK] 1585 206 . LEU CG 4 C4H1b 0.770 1.880 4.093 19.070 14.704 1.297 possible 1586 206 . LEU CD1 10 C4H3u 0.770 1.880 27.588 -1.000 37.235 -1.000 bad 1587 206 . LEU CD2 10 C4H3u 0.770 1.880 24.755 -1.000 37.020 -1.000 bad 1588 207 . LEU N 12 N3H1s 0.700 1.640 2.353 12.197 13.517 0.902 [OK] 1589 207 . LEU CA 3 C4H1s 0.770 1.880 3.993 17.946 13.055 1.375 possible 1590 207 . LEU C 1 C3H0s 0.770 1.610 2.302 7.996 8.781 0.911 [OK] 1591 207 . LEU O 16 O1H0u 0.660 1.420 3.336 14.921 15.957 0.935 possible 1592 207 . LEU CB 8 C4H2s 0.770 1.880 3.971 28.407 22.818 1.245 possible 1593 207 . LEU CG 4 C4H1b 0.770 1.880 3.079 13.108 14.704 0.891 possible 1594 207 . LEU CD1 10 C4H3u 0.770 1.880 4.679 44.472 37.235 1.194 possible 1595 207 . LEU CD2 10 C4H3u 0.770 1.880 51.510 -1.000 37.020 -1.000 bad 1596 208 . PHE N 12 N3H1s 0.700 1.640 2.737 15.027 13.524 1.111 [OK] 1597 208 . PHE CA 3 C4H1s 0.770 1.880 2.884 11.659 13.371 0.872 [OK] 1598 208 . PHE C 1 C3H0s 0.770 1.610 2.706 8.258 8.697 0.949 [OK] 1599 208 . PHE O 16 O1H0u 0.660 1.420 2.547 13.702 15.961 0.858 [OK] 1600 208 . PHE CB 8 C4H2s 0.770 1.880 3.233 25.576 23.623 1.083 possible 1601 208 . PHE CG 2 C3H0b 0.770 1.610 2.695 11.055 9.684 1.142 [OK] 1602 208 . PHE CD1 5 C3H1s 0.770 1.760 3.079 23.379 20.325 1.150 possible 1603 208 . PHE CD2 6 C3H1b 0.770 1.760 3.249 21.726 20.948 1.037 possible 1604 208 . PHE CE1 6 C3H1b 0.770 1.760 2.923 23.394 21.532 1.086 [OK] 1605 208 . PHE CE2 6 C3H1b 0.770 1.760 3.358 22.808 21.625 1.055 possible 1606 208 . PHE CZ 6 C3H1b 0.770 1.760 2.940 23.126 21.555 1.073 [OK] 1607 209 . MET N 12 N3H1s 0.700 1.640 3.075 14.805 13.405 1.104 possible 1608 209 . MET CA 3 C4H1s 0.770 1.880 2.771 12.919 13.194 0.979 [OK] 1609 209 . MET C 1 C3H0s 0.770 1.610 1.932 7.411 8.756 0.846 [OK] 1610 209 . MET O 16 O1H0u 0.660 1.420 2.697 14.778 16.002 0.924 [OK] 1611 209 . MET CB 8 C4H2s 0.770 1.880 3.487 23.627 23.418 1.009 possible 1612 209 . MET CG 9 C4H2b 0.770 1.880 3.126 26.418 23.830 1.109 possible 1613 209 . MET SD 19 S2H0u 1.040 1.770 4.285 33.431 30.207 1.107 possible 1614 209 . MET CE 10 C4H3u 0.770 1.880 5.740 53.228 37.003 1.438 possible 1615 210 . VAL N 12 N3H1s 0.700 1.640 2.698 12.411 13.553 0.916 [OK] 1616 210 . VAL CA 3 C4H1s 0.770 1.880 3.931 16.760 13.078 1.282 possible 1617 210 . VAL C 1 C3H0s 0.770 1.610 2.769 7.921 8.528 0.929 [OK] 1618 210 . VAL O 16 O1H0u 0.660 1.420 3.069 16.839 15.998 1.053 possible 1619 210 . VAL CB 4 C4H1b 0.770 1.880 4.454 18.690 14.514 1.288 possible 1620 210 . VAL CG1 10 C4H3u 0.770 1.880 45.126 -1.000 36.320 -1.000 bad 1621 210 . VAL CG2 10 C4H3u 0.770 1.880 24.205 -1.000 36.173 -1.000 bad 1622 211 . LEU N 12 N3H1s 0.700 1.640 2.607 11.952 13.517 0.884 [OK] 1623 211 . LEU CA 3 C4H1s 0.770 1.880 3.178 12.020 13.055 0.921 possible 1624 211 . LEU C 1 C3H0s 0.770 1.610 2.126 8.069 8.781 0.919 [OK] 1625 211 . LEU O 16 O1H0u 0.660 1.420 2.239 13.670 15.957 0.857 [OK] 1626 211 . LEU CB 8 C4H2s 0.770 1.880 2.771 18.973 22.818 0.831 [OK] 1627 211 . LEU CG 4 C4H1b 0.770 1.880 2.889 17.516 14.704 1.191 [OK] 1628 211 . LEU CD1 10 C4H3u 0.770 1.880 7.681 93.792 37.235 2.519 possible 1629 211 . LEU CD2 10 C4H3u 0.770 1.880 3.646 37.707 37.020 1.019 possible 1630 212 . ASP N 12 N3H1s 0.700 1.640 2.548 12.693 13.654 0.930 [OK] 1631 212 . ASP CA 3 C4H1s 0.770 1.880 2.797 14.162 13.254 1.069 [OK] 1632 212 . ASP C 1 C3H0s 0.770 1.610 2.471 8.475 8.750 0.969 [OK] 1633 212 . ASP O 16 O1H0u 0.660 1.420 2.429 15.719 15.757 0.998 [OK] 1634 212 . ASP CB 8 C4H2s 0.770 1.880 3.266 26.977 23.022 1.172 possible 1635 212 . ASP CG 2 C3H0b 0.770 1.610 2.721 9.893 9.336 1.060 [OK] 1636 212 . ASP OD1 16 O1H0u 0.660 1.420 2.832 21.853 15.078 1.449 [OK] 1637 212 . ASP OD2 16 O1H0u 0.660 1.420 3.035 24.310 15.582 1.560 possible 1638 213 . VAL N 12 N3H1s 0.700 1.640 2.504 13.216 13.553 0.975 [OK] 1639 213 . VAL CA 3 C4H1s 0.770 1.880 2.573 10.821 13.078 0.827 [OK] 1640 213 . VAL C 1 C3H0s 0.770 1.610 2.660 7.644 8.528 0.896 [OK] 1641 213 . VAL O 16 O1H0u 0.660 1.420 3.857 16.110 15.998 1.007 possible 1642 213 . VAL CB 4 C4H1b 0.770 1.880 4.280 19.776 14.514 1.363 possible 1643 213 . VAL CG1 10 C4H3u 0.770 1.880 24.649 -1.000 36.320 -1.000 bad 1644 213 . VAL CG2 10 C4H3u 0.770 1.880 3.176 30.793 36.173 0.851 possible 1645 214 . SER N 12 N3H1s 0.700 1.640 3.009 14.388 13.808 1.042 possible 1646 214 . SER CA 3 C4H1s 0.770 1.880 5.689 25.928 13.351 1.942 possible 1647 214 . SER C 1 C3H0s 0.770 1.610 2.431 8.424 8.858 0.951 [OK] 1648 214 . SER O 16 O1H0u 0.660 1.420 4.803 27.597 15.860 1.740 possible 1649 214 . SER CB 8 C4H2s 0.770 1.880 7.145 53.070 23.599 2.249 possible 1650 214 . SER OG 17 O2H1u 0.660 1.460 19.470 -1.000 18.021 -1.000 bad 1651 215 . ALA N 12 N3H1s 0.700 1.640 2.200 12.697 13.872 0.915 [OK] 1652 215 . ALA CA 4 C4H1b 0.770 1.880 3.805 16.656 13.959 1.193 possible 1653 215 . ALA C 1 C3H0s 0.770 1.610 2.665 9.349 8.858 1.055 [OK] 1654 215 . ALA O 16 O1H0u 0.660 1.420 3.261 19.879 16.026 1.240 possible 1655 215 . ALA CB 10 C4H3u 0.770 1.880 3.910 49.482 36.551 1.354 possible 1656 216 . LYS N 12 N3H1s 0.700 1.640 2.831 14.118 13.429 1.051 [OK] 1657 216 . LYS CA 3 C4H1s 0.770 1.880 3.108 16.331 13.217 1.236 possible 1658 216 . LYS C 1 C3H0s 0.770 1.610 2.629 9.222 8.696 1.061 [OK] 1659 216 . LYS O 16 O1H0u 0.660 1.420 2.919 25.339 15.818 1.602 [OK] 1660 216 . LYS CB 8 C4H2s 0.770 1.880 3.172 28.646 22.578 1.269 possible 1661 216 . LYS CG 8 C4H2s 0.770 1.880 3.257 27.941 22.847 1.223 possible 1662 216 . LYS CD 8 C4H2s 0.770 1.880 3.146 27.345 23.365 1.170 possible 1663 216 . LYS CE 9 C4H2b 0.770 1.880 3.182 23.821 23.720 1.004 possible 1664 216 . LYS NZ 14 N4H3u 0.700 1.640 3.065 16.976 21.413 0.793 possible 1665 217 . VAL N 12 N3H1s 0.700 1.640 2.816 13.856 13.553 1.022 [OK] 1666 217 . VAL CA 3 C4H1s 0.770 1.880 3.026 15.097 13.078 1.154 possible 1667 217 . VAL C 1 C3H0s 0.770 1.610 3.142 8.812 8.528 1.033 possible 1668 217 . VAL O 16 O1H0u 0.660 1.420 2.737 17.585 15.998 1.099 [OK] 1669 217 . VAL CB 4 C4H1b 0.770 1.880 4.955 17.526 14.514 1.208 possible 1670 217 . VAL CG1 10 C4H3u 0.770 1.880 6.352 82.956 36.320 2.284 possible 1671 217 . VAL CG2 10 C4H3u 0.770 1.880 3.322 37.500 36.173 1.037 possible 1672 218 . GLY N 12 N3H1s 0.700 1.640 4.727 19.446 14.480 1.343 possible 1673 218 . GLY CA 8 C4H2s 0.770 1.880 24.374 -1.000 23.470 -1.000 bad 1674 218 . GLY C 2 C3H0b 0.770 1.610 3.716 11.714 9.652 1.214 possible 1675 218 . GLY O 16 O1H0u 0.660 1.420 3.429 16.059 16.154 0.994 possible 1676 219 . PHE N 12 N3H1s 0.700 1.640 3.434 19.291 13.524 1.426 possible 1677 219 . PHE CA 3 C4H1s 0.770 1.880 3.604 20.037 13.371 1.499 possible 1678 219 . PHE C 1 C3H0s 0.770 1.610 1.954 7.026 8.697 0.808 [OK] 1679 219 . PHE O 16 O1H0u 0.660 1.420 2.506 15.109 15.961 0.947 [OK] 1680 219 . PHE CB 8 C4H2s 0.770 1.880 3.763 25.967 23.623 1.099 possible 1681 219 . PHE CG 2 C3H0b 0.770 1.610 2.624 9.825 9.684 1.015 [OK] 1682 219 . PHE CD1 5 C3H1s 0.770 1.760 3.021 19.339 20.325 0.952 possible 1683 219 . PHE CD2 6 C3H1b 0.770 1.760 3.700 31.276 20.948 1.493 possible 1684 219 . PHE CE1 6 C3H1b 0.770 1.760 3.040 20.825 21.532 0.967 possible 1685 219 . PHE CE2 6 C3H1b 0.770 1.760 3.115 21.663 21.625 1.002 possible 1686 219 . PHE CZ 6 C3H1b 0.770 1.760 3.210 22.580 21.555 1.048 possible 1687 220 . GLY N 12 N3H1s 0.700 1.640 3.019 14.336 14.480 0.990 possible 1688 220 . GLY CA 8 C4H2s 0.770 1.880 3.403 26.977 23.470 1.149 possible 1689 220 . GLY C 2 C3H0b 0.770 1.610 2.924 10.441 9.652 1.082 [OK] 1690 220 . GLY O 16 O1H0u 0.660 1.420 2.592 16.114 16.154 0.998 [OK] 1691 221 . LEU N 12 N3H1s 0.700 1.640 2.732 13.148 13.517 0.973 [OK] 1692 221 . LEU CA 3 C4H1s 0.770 1.880 3.732 16.049 13.055 1.229 possible 1693 221 . LEU C 1 C3H0s 0.770 1.610 2.469 7.899 8.781 0.900 [OK] 1694 221 . LEU O 16 O1H0u 0.660 1.420 3.069 15.027 15.957 0.942 possible 1695 221 . LEU CB 8 C4H2s 0.770 1.880 4.184 24.414 22.818 1.070 possible 1696 221 . LEU CG 4 C4H1b 0.770 1.880 3.857 20.074 14.704 1.365 possible 1697 221 . LEU CD1 10 C4H3u 0.770 1.880 42.617 -1.000 37.235 -1.000 bad 1698 221 . LEU CD2 10 C4H3u 0.770 1.880 7.727 73.153 37.020 1.976 possible 1699 222 . ILE N 12 N3H1s 0.700 1.640 3.120 13.753 13.493 1.019 possible 1700 222 . ILE CA 3 C4H1s 0.770 1.880 4.532 19.464 12.946 1.503 possible 1701 222 . ILE C 1 C3H0s 0.770 1.610 3.215 8.590 8.445 1.017 possible 1702 222 . ILE O 16 O1H0u 0.660 1.420 3.735 19.545 15.930 1.227 possible 1703 222 . ILE CB 4 C4H1b 0.770 1.880 3.388 18.116 14.146 1.281 possible 1704 222 . ILE CG1 9 C4H2b 0.770 1.880 5.228 38.452 24.071 1.597 possible 1705 222 . ILE CG2 10 C4H3u 0.770 1.880 38.315 -1.000 35.763 -1.000 bad 1706 222 . ILE CD1 10 C4H3u 0.770 1.880 47.027 -1.000 38.219 -1.000 bad 1707 223 . LEU N 12 N3H1s 0.700 1.640 3.102 14.316 13.517 1.059 possible 1708 223 . LEU CA 3 C4H1s 0.770 1.880 3.386 15.854 13.055 1.214 possible 1709 223 . LEU C 1 C3H0s 0.770 1.610 2.444 7.806 8.781 0.889 [OK] 1710 223 . LEU O 16 O1H0u 0.660 1.420 2.421 15.278 15.957 0.957 [OK] 1711 223 . LEU CB 8 C4H2s 0.770 1.880 2.694 20.285 22.818 0.889 [OK] 1712 223 . LEU CG 4 C4H1b 0.770 1.880 3.068 16.441 14.704 1.118 possible 1713 223 . LEU CD1 10 C4H3u 0.770 1.880 3.210 34.127 37.235 0.917 possible 1714 223 . LEU CD2 10 C4H3u 0.770 1.880 3.385 37.868 37.020 1.023 possible 1715 224 . LEU N 12 N3H1s 0.700 1.640 2.501 12.749 13.517 0.943 [OK] 1716 224 . LEU CA 3 C4H1s 0.770 1.880 2.822 11.885 13.055 0.910 [OK] 1717 224 . LEU C 1 C3H0s 0.770 1.610 3.286 8.927 8.781 1.017 possible 1718 224 . LEU O 16 O1H0u 0.660 1.420 4.336 26.876 15.957 1.684 possible 1719 224 . LEU CB 8 C4H2s 0.770 1.880 3.892 30.426 22.818 1.333 possible 1720 224 . LEU CG 4 C4H1b 0.770 1.880 2.998 14.688 14.704 0.999 [OK] 1721 224 . LEU CD1 10 C4H3u 0.770 1.880 3.787 42.142 37.235 1.132 possible 1722 224 . LEU CD2 10 C4H3u 0.770 1.880 3.190 32.953 37.020 0.890 possible 1723 225 . ARG N 12 N3H1s 0.700 1.640 3.468 15.089 13.486 1.119 possible 1724 225 . ARG CA 3 C4H1s 0.770 1.880 5.007 27.004 13.310 2.029 possible 1725 225 . ARG C 1 C3H0s 0.770 1.610 4.182 9.172 8.779 1.045 possible 1726 225 . ARG O 16 O1H0u 0.660 1.420 28.284 -1.000 15.916 -1.000 bad 1727 225 . ARG CB 8 C4H2s 0.770 1.880 13.461 -1.000 22.833 -1.000 bad 1728 225 . ARG CG 8 C4H2s 0.770 1.880 3.919 31.293 23.273 1.345 possible 1729 225 . ARG CD 8 C4H2s 0.770 1.880 23.249 -1.000 22.849 -1.000 bad 1730 225 . ARG NE 13 N3H1b 0.700 1.640 5.585 30.939 15.019 2.060 possible 1731 225 . ARG CZ 2 C3H0b 0.770 1.610 5.468 16.183 9.678 1.672 possible 1732 225 . ARG NH1 15 N3H2u 0.700 1.640 47.809 -1.000 22.056 -1.000 bad 1733 225 . ARG NH2 15 N3H2u 0.700 1.640 21.724 -1.000 23.132 -1.000 bad 1734 226 . SER N 12 N3H1s 0.700 1.640 4.339 14.142 13.808 1.024 possible 1735 226 . SER CA 3 C4H1s 0.770 1.880 7.813 43.862 13.351 3.285 possible 1736 226 . SER C 1 C3H0s 0.770 1.610 2.761 7.925 8.858 0.895 [OK] 1737 226 . SER O 16 O1H0u 0.660 1.420 3.785 21.234 15.860 1.339 possible 1738 226 . SER CB 8 C4H2s 0.770 1.880 6.168 39.140 23.599 1.659 possible 1739 226 . SER OG 17 O2H1u 0.660 1.460 3.089 18.676 18.021 1.036 possible 1740 227 . ARG N 12 N3H1s 0.700 1.640 6.371 36.530 13.486 2.709 possible 1741 227 . ARG CA 3 C4H1s 0.770 1.880 4.628 20.300 13.310 1.525 possible 1742 227 . ARG C 1 C3H0s 0.770 1.610 3.063 10.144 8.779 1.155 possible 1743 227 . ARG O 16 O1H0u 0.660 1.420 4.186 27.427 15.916 1.723 possible 1744 227 . ARG CB 8 C4H2s 0.770 1.880 7.365 41.922 22.833 1.836 possible 1745 227 . ARG CG 8 C4H2s 0.770 1.880 27.716 -1.000 23.273 -1.000 bad 1746 227 . ARG CD 8 C4H2s 0.770 1.880 5.382 50.675 22.849 2.218 possible 1747 227 . ARG NE 13 N3H1b 0.700 1.640 8.274 -1.000 15.019 -1.000 bad 1748 227 . ARG CZ 2 C3H0b 0.770 1.610 3.670 -1.000 9.678 -1.000 bad 1749 227 . ARG NH1 15 N3H2u 0.700 1.640 49.832 -1.000 22.056 -1.000 bad 1750 227 . ARG NH2 15 N3H2u 0.700 1.640 52.049 -1.000 23.132 -1.000 bad 1751 228 . ALA N 12 N3H1s 0.700 1.640 3.220 16.180 13.872 1.166 possible 1752 228 . ALA CA 4 C4H1b 0.770 1.880 3.266 17.350 13.959 1.243 possible 1753 228 . ALA C 1 C3H0s 0.770 1.610 2.764 8.591 8.858 0.970 [OK] 1754 228 . ALA O 16 O1H0u 0.660 1.420 4.011 31.232 16.026 1.949 possible 1755 228 . ALA CB 10 C4H3u 0.770 1.880 3.636 37.279 36.551 1.020 possible 1756 229 . ILE N 12 N3H1s 0.700 1.640 2.613 13.693 13.493 1.015 [OK] 1757 229 . ILE CA 3 C4H1s 0.770 1.880 3.369 15.674 12.946 1.211 possible 1758 229 . ILE C 1 C3H0s 0.770 1.610 2.894 9.780 8.445 1.158 [OK] 1759 229 . ILE O 16 O1H0u 0.660 1.420 3.339 16.229 15.930 1.019 possible 1760 229 . ILE CB 4 C4H1b 0.770 1.880 2.917 12.725 14.146 0.900 [OK] 1761 229 . ILE CG1 9 C4H2b 0.770 1.880 2.893 19.435 24.071 0.807 [OK] 1762 229 . ILE CG2 10 C4H3u 0.770 1.880 3.192 35.350 35.763 0.988 possible 1763 229 . ILE CD1 10 C4H3u 0.770 1.880 3.415 35.023 38.219 0.916 possible 1764 230 . PHE N 12 N3H1s 0.700 1.640 2.978 13.013 13.524 0.962 [OK] 1765 230 . PHE CA 3 C4H1s 0.770 1.880 3.808 19.733 13.371 1.476 possible 1766 230 . PHE C 1 C3H0s 0.770 1.610 3.355 8.829 8.697 1.015 possible 1767 230 . PHE O 16 O1H0u 0.660 1.420 3.062 17.251 15.961 1.081 possible 1768 230 . PHE CB 8 C4H2s 0.770 1.880 20.389 -1.000 23.623 -1.000 bad 1769 230 . PHE CG 2 C3H0b 0.770 1.610 6.448 17.967 9.684 1.855 possible 1770 230 . PHE CD1 5 C3H1s 0.770 1.760 5.083 30.132 20.325 1.482 possible 1771 230 . PHE CD2 6 C3H1b 0.770 1.760 19.939 -1.000 20.948 -1.000 bad 1772 230 . PHE CE1 6 C3H1b 0.770 1.760 6.280 63.384 21.532 2.944 possible 1773 230 . PHE CE2 6 C3H1b 0.770 1.760 19.508 -1.000 21.625 -1.000 bad 1774 230 . PHE CZ 6 C3H1b 0.770 1.760 7.399 78.852 21.555 3.658 possible 1775 231 . GLY N 12 N3H1s 0.700 1.640 13.199 -1.000 14.480 -1.000 bad 1776 231 . GLY CA 8 C4H2s 0.770 1.880 28.639 -1.000 23.470 -1.000 bad 1777 231 . GLY C 2 C3H0b 0.770 1.610 6.805 16.426 9.652 1.702 possible 1778 231 . GLY O 16 O1H0u 0.660 1.420 5.398 44.088 16.154 2.729 possible 1779 231 . GLY OXT 16 O1H0u 0.660 1.420 28.613 -1.000 1.420 -1.000 bad 1781 216 . RET C1 9 C4H2b 0.770 1.880 2.409 6.195 1.880 3.295 [OK] 1782 216 . RET C2 9 C4H2b 0.770 1.880 3.261 27.206 1.880 14.471 possible 1783 216 . RET C3 9 C4H2b 0.770 1.880 3.296 26.667 1.880 14.184 possible 1784 216 . RET C4 9 C4H2b 0.770 1.880 3.058 25.849 1.880 13.749 possible 1785 216 . RET C5 9 C4H2b 0.770 1.880 3.019 13.228 1.880 7.036 possible 1786 216 . RET C6 9 C4H2b 0.770 1.880 3.061 11.918 1.880 6.340 possible 1787 216 . RET C7 9 C4H2b 0.770 1.880 3.189 20.151 1.880 10.718 possible 1788 216 . RET C8 9 C4H2b 0.770 1.880 3.090 22.878 1.880 12.169 possible 1789 216 . RET C9 9 C4H2b 0.770 1.880 3.248 11.389 1.880 6.058 possible 1790 216 . RET C10 9 C4H2b 0.770 1.880 3.265 22.737 1.880 12.094 possible 1791 216 . RET C11 9 C4H2b 0.770 1.880 2.916 17.584 1.880 9.353 [OK] 1792 216 . RET C12 9 C4H2b 0.770 1.880 2.961 18.432 1.880 9.804 [OK] 1793 216 . RET C13 9 C4H2b 0.770 1.880 2.662 10.855 1.880 5.774 [OK] 1794 216 . RET C14 9 C4H2b 0.770 1.880 3.047 19.593 1.880 10.422 possible 1795 216 . RET C15 9 C4H2b 0.770 1.880 2.938 23.408 1.880 12.451 [OK] 1796 216 . RET C16 9 C4H2b 0.770 1.880 3.259 37.643 1.880 20.023 possible 1797 216 . RET C17 9 C4H2b 0.770 1.880 3.350 39.514 1.880 21.018 possible 1798 216 . RET C18 9 C4H2b 0.770 1.880 2.982 33.503 1.880 17.821 [OK] 1799 216 . RET C19 9 C4H2b 0.770 1.880 3.631 41.833 1.880 22.251 possible 1800 216 . RET C20 9 C4H2b 0.770 1.880 3.435 41.774 1.880 22.220 possible