number_ resnum chain resname atname typenum typenam covrad vdwrad surface volume refvol packeff goodbad 54 8 . PRO N 11 N3H0u 0.700 1.640 6.677 60.918 8.650 7.043 possible 55 8 . PRO CA 4 C4H1b 0.770 1.880 4.539 22.119 13.828 1.600 possible 56 8 . PRO C 1 C3H0s 0.770 1.610 2.638 9.987 8.768 1.139 [OK] 57 8 . PRO O 16 O1H0u 0.660 1.420 3.309 22.983 15.856 1.449 possible 58 8 . PRO CB 9 C4H2b 0.770 1.880 6.447 61.023 25.314 2.411 possible 59 8 . PRO CG 9 C4H2b 0.770 1.880 43.688 -1.000 25.480 -1.000 bad 60 8 . PRO CD 8 C4H2s 0.770 1.880 50.493 -1.000 23.390 -1.000 bad 61 9 . GLU N 12 N3H1s 0.700 1.640 3.789 18.484 13.461 1.373 possible 62 9 . GLU CA 3 C4H1s 0.770 1.880 3.428 16.408 13.284 1.235 possible 63 9 . GLU C 1 C3H0s 0.770 1.610 2.577 8.949 8.631 1.037 [OK] 64 9 . GLU O 16 O1H0u 0.660 1.420 2.981 16.548 15.765 1.050 [OK] 65 9 . GLU CB 8 C4H2s 0.770 1.880 4.611 36.124 23.214 1.556 possible 66 9 . GLU CG 8 C4H2s 0.770 1.880 3.612 27.065 23.304 1.161 possible 67 9 . GLU CD 2 C3H0b 0.770 1.610 5.027 14.784 9.437 1.567 possible 68 9 . GLU OE1 16 O1H0u 0.660 1.420 5.335 64.035 15.497 4.132 possible 69 9 . GLU OE2 16 O1H0u 0.660 1.420 7.598 79.449 16.213 4.900 possible 70 10 . TRP N 12 N3H1s 0.700 1.640 4.309 21.589 13.639 1.583 possible 71 10 . TRP CA 3 C4H1s 0.770 1.880 3.588 15.746 13.323 1.182 possible 72 10 . TRP C 1 C3H0s 0.770 1.610 2.274 7.841 8.687 0.903 [OK] 73 10 . TRP O 16 O1H0u 0.660 1.420 2.725 15.471 15.797 0.979 [OK] 74 10 . TRP CB 8 C4H2s 0.770 1.880 23.157 -1.000 23.826 -1.000 bad 75 10 . TRP CG 2 C3H0b 0.770 1.610 0.908 -1.000 9.915 -1.000 bad 76 10 . TRP CD1 5 C3H1s 0.770 1.760 10.746 -1.000 20.597 -1.000 bad 77 10 . TRP CD2 2 C3H0b 0.770 1.610 1.885 -1.000 10.068 -1.000 bad 78 10 . TRP NE1 13 N3H1b 0.700 1.640 20.018 -1.000 16.723 -1.000 bad 79 10 . TRP CE2 2 C3H0b 0.770 1.610 1.624 -1.000 9.848 -1.000 bad 80 10 . TRP CE3 6 C3H1b 0.770 1.760 9.047 -1.000 20.383 -1.000 bad 81 10 . TRP CZ2 6 C3H1b 0.770 1.760 34.383 -1.000 20.931 -1.000 bad 82 10 . TRP CZ3 6 C3H1b 0.770 1.760 19.515 -1.000 21.429 -1.000 bad 83 10 . TRP CH2 6 C3H1b 0.770 1.760 33.745 -1.000 21.219 -1.000 bad 84 11 . ILE N 12 N3H1s 0.700 1.640 2.668 13.468 13.493 0.998 [OK] 85 11 . ILE CA 3 C4H1s 0.770 1.880 3.932 17.478 12.946 1.350 possible 86 11 . ILE C 1 C3H0s 0.770 1.610 2.931 7.703 8.445 0.912 [OK] 87 11 . ILE O 16 O1H0u 0.660 1.420 6.934 38.946 15.930 2.445 possible 88 11 . ILE CB 4 C4H1b 0.770 1.880 2.643 11.497 14.146 0.813 [OK] 89 11 . ILE CG1 9 C4H2b 0.770 1.880 4.745 25.175 24.071 1.046 possible 90 11 . ILE CG2 10 C4H3u 0.770 1.880 43.168 -1.000 35.763 -1.000 bad 91 11 . ILE CD1 10 C4H3u 0.770 1.880 44.215 -1.000 38.219 -1.000 bad 92 12 . TRP N 12 N3H1s 0.700 1.640 3.029 12.940 13.639 0.949 possible 93 12 . TRP CA 3 C4H1s 0.770 1.880 3.363 15.116 13.323 1.135 possible 94 12 . TRP C 1 C3H0s 0.770 1.610 2.751 9.277 8.687 1.068 [OK] 95 12 . TRP O 16 O1H0u 0.660 1.420 2.831 17.891 15.797 1.133 [OK] 96 12 . TRP CB 8 C4H2s 0.770 1.880 3.377 24.908 23.826 1.045 possible 97 12 . TRP CG 2 C3H0b 0.770 1.610 3.108 11.335 9.915 1.143 possible 98 12 . TRP CD1 5 C3H1s 0.770 1.760 3.997 25.549 20.597 1.240 possible 99 12 . TRP CD2 2 C3H0b 0.770 1.610 3.470 13.593 10.068 1.350 possible 100 12 . TRP NE1 13 N3H1b 0.700 1.640 12.092 -1.000 16.723 -1.000 bad 101 12 . TRP CE2 2 C3H0b 0.770 1.610 4.178 14.351 9.848 1.457 possible 102 12 . TRP CE3 6 C3H1b 0.770 1.760 3.263 21.412 20.383 1.050 possible 103 12 . TRP CZ2 6 C3H1b 0.770 1.760 23.082 -1.000 20.931 -1.000 bad 104 12 . TRP CZ3 6 C3H1b 0.770 1.760 4.271 26.906 21.429 1.256 possible 105 12 . TRP CH2 6 C3H1b 0.770 1.760 29.744 -1.000 21.219 -1.000 bad 106 13 . LEU N 12 N3H1s 0.700 1.640 2.768 13.392 13.517 0.991 [OK] 107 13 . LEU CA 3 C4H1s 0.770 1.880 3.360 14.442 13.055 1.106 possible 108 13 . LEU C 1 C3H0s 0.770 1.610 2.408 8.958 8.781 1.020 [OK] 109 13 . LEU O 16 O1H0u 0.660 1.420 2.897 21.069 15.957 1.320 [OK] 110 13 . LEU CB 8 C4H2s 0.770 1.880 2.898 22.014 22.818 0.965 [OK] 111 13 . LEU CG 4 C4H1b 0.770 1.880 3.378 19.564 14.704 1.331 possible 112 13 . LEU CD1 10 C4H3u 0.770 1.880 4.106 45.245 37.235 1.215 possible 113 13 . LEU CD2 10 C4H3u 0.770 1.880 4.270 51.249 37.020 1.384 possible 114 14 . ALA N 12 N3H1s 0.700 1.640 2.508 14.279 13.872 1.029 [OK] 115 14 . ALA CA 4 C4H1b 0.770 1.880 3.239 12.924 13.959 0.926 possible 116 14 . ALA C 1 C3H0s 0.770 1.610 4.611 9.589 8.858 1.083 possible 117 14 . ALA O 16 O1H0u 0.660 1.420 6.005 33.527 16.026 2.092 possible 118 14 . ALA CB 10 C4H3u 0.770 1.880 33.927 -1.000 36.551 -1.000 bad 119 15 . LEU N 12 N3H1s 0.700 1.640 5.536 19.685 13.517 1.456 possible 120 15 . LEU CA 3 C4H1s 0.770 1.880 8.846 -1.000 13.055 -1.000 bad 121 15 . LEU C 1 C3H0s 0.770 1.610 2.691 8.629 8.781 0.983 [OK] 122 15 . LEU O 16 O1H0u 0.660 1.420 3.612 21.186 15.957 1.328 possible 123 15 . LEU CB 8 C4H2s 0.770 1.880 5.877 26.504 22.818 1.162 possible 124 15 . LEU CG 4 C4H1b 0.770 1.880 3.432 17.697 14.704 1.204 possible 125 15 . LEU CD1 10 C4H3u 0.770 1.880 57.099 -1.000 37.235 -1.000 bad 126 15 . LEU CD2 10 C4H3u 0.770 1.880 28.492 -1.000 37.020 -1.000 bad 127 16 . GLY N 12 N3H1s 0.700 1.640 2.711 14.689 14.480 1.014 [OK] 128 16 . GLY CA 8 C4H2s 0.770 1.880 3.328 28.615 23.470 1.219 possible 129 16 . GLY C 2 C3H0b 0.770 1.610 2.291 8.612 9.652 0.892 [OK] 130 16 . GLY O 16 O1H0u 0.660 1.420 2.801 18.234 16.154 1.129 [OK] 131 17 . THR N 12 N3H1s 0.700 1.640 2.868 14.749 13.544 1.089 [OK] 132 17 . THR CA 3 C4H1s 0.770 1.880 2.773 13.458 13.025 1.033 [OK] 133 17 . THR C 1 C3H0s 0.770 1.610 2.916 8.105 8.685 0.933 [OK] 134 17 . THR O 16 O1H0u 0.660 1.420 4.384 24.588 15.795 1.557 possible 135 17 . THR CB 4 C4H1b 0.770 1.880 3.227 17.878 14.687 1.217 possible 136 17 . THR OG1 17 O2H1u 0.660 1.460 3.412 20.449 17.610 1.161 possible 137 17 . THR CG2 10 C4H3u 0.770 1.880 7.668 72.416 36.265 1.997 possible 138 18 . ALA N 12 N3H1s 0.700 1.640 3.016 13.676 13.872 0.986 possible 139 18 . ALA CA 4 C4H1b 0.770 1.880 12.269 -1.000 13.959 -1.000 bad 140 18 . ALA C 1 C3H0s 0.770 1.610 3.776 9.354 8.858 1.056 possible 141 18 . ALA O 16 O1H0u 0.660 1.420 7.022 64.137 16.026 4.002 possible 142 18 . ALA CB 10 C4H3u 0.770 1.880 43.824 -1.000 36.551 -1.000 bad 143 19 . LEU N 12 N3H1s 0.700 1.640 3.392 14.667 13.517 1.085 possible 144 19 . LEU CA 3 C4H1s 0.770 1.880 3.588 14.873 13.055 1.139 possible 145 19 . LEU C 1 C3H0s 0.770 1.610 2.831 9.428 8.781 1.074 [OK] 146 19 . LEU O 16 O1H0u 0.660 1.420 2.794 18.875 15.957 1.183 [OK] 147 19 . LEU CB 8 C4H2s 0.770 1.880 3.023 22.627 22.818 0.992 possible 148 19 . LEU CG 4 C4H1b 0.770 1.880 4.510 22.467 14.704 1.528 possible 149 19 . LEU CD1 10 C4H3u 0.770 1.880 44.562 -1.000 37.235 -1.000 bad 150 19 . LEU CD2 10 C4H3u 0.770 1.880 18.969 -1.000 37.020 -1.000 bad 151 20 . MET N 12 N3H1s 0.700 1.640 2.836 14.520 13.405 1.083 [OK] 152 20 . MET CA 3 C4H1s 0.770 1.880 3.209 14.799 13.194 1.122 possible 153 20 . MET C 1 C3H0s 0.770 1.610 2.243 8.351 8.756 0.954 [OK] 154 20 . MET O 16 O1H0u 0.660 1.420 2.763 18.409 16.002 1.150 [OK] 155 20 . MET CB 8 C4H2s 0.770 1.880 2.773 21.958 23.418 0.938 [OK] 156 20 . MET CG 9 C4H2b 0.770 1.880 2.871 21.450 23.830 0.900 [OK] 157 20 . MET SD 19 S2H0u 1.040 1.770 3.193 35.557 30.207 1.177 possible 158 20 . MET CE 10 C4H3u 0.770 1.880 3.386 40.331 37.003 1.090 possible 159 21 . GLY N 12 N3H1s 0.700 1.640 2.793 14.396 14.480 0.994 [OK] 160 21 . GLY CA 8 C4H2s 0.770 1.880 6.595 48.437 23.470 2.064 possible 161 21 . GLY C 2 C3H0b 0.770 1.610 4.305 12.237 9.652 1.268 possible 162 21 . GLY O 16 O1H0u 0.660 1.420 3.320 15.929 16.154 0.986 possible 163 22 . LEU N 12 N3H1s 0.700 1.640 4.555 20.288 13.517 1.501 possible 164 22 . LEU CA 3 C4H1s 0.770 1.880 4.672 21.188 13.055 1.623 possible 165 22 . LEU C 1 C3H0s 0.770 1.610 2.259 7.508 8.781 0.855 [OK] 166 22 . LEU O 16 O1H0u 0.660 1.420 3.620 15.599 15.957 0.978 possible 167 22 . LEU CB 8 C4H2s 0.770 1.880 6.229 35.429 22.818 1.553 possible 168 22 . LEU CG 4 C4H1b 0.770 1.880 5.565 27.792 14.704 1.890 possible 169 22 . LEU CD1 10 C4H3u 0.770 1.880 56.220 -1.000 37.235 -1.000 bad 170 22 . LEU CD2 10 C4H3u 0.770 1.880 6.195 82.768 37.020 2.236 possible 171 23 . GLY N 12 N3H1s 0.700 1.640 2.702 13.095 14.480 0.904 [OK] 172 23 . GLY CA 8 C4H2s 0.770 1.880 3.732 34.444 23.470 1.468 possible 173 23 . GLY C 2 C3H0b 0.770 1.610 2.718 8.901 9.652 0.922 [OK] 174 23 . GLY O 16 O1H0u 0.660 1.420 2.832 17.845 16.154 1.105 [OK] 175 24 . THR N 12 N3H1s 0.700 1.640 2.471 13.197 13.544 0.974 [OK] 176 24 . THR CA 3 C4H1s 0.770 1.880 3.079 15.479 13.025 1.188 possible 177 24 . THR C 1 C3H0s 0.770 1.610 2.695 8.256 8.685 0.951 [OK] 178 24 . THR O 16 O1H0u 0.660 1.420 2.507 16.886 15.795 1.069 [OK] 179 24 . THR CB 4 C4H1b 0.770 1.880 2.988 15.674 14.687 1.067 [OK] 180 24 . THR OG1 17 O2H1u 0.660 1.460 4.936 33.735 17.610 1.916 possible 181 24 . THR CG2 10 C4H3u 0.770 1.880 6.226 59.890 36.265 1.651 possible 182 25 . LEU N 12 N3H1s 0.700 1.640 2.756 11.826 13.517 0.875 [OK] 183 25 . LEU CA 3 C4H1s 0.770 1.880 3.173 14.568 13.055 1.116 possible 184 25 . LEU C 1 C3H0s 0.770 1.610 3.356 9.303 8.781 1.059 possible 185 25 . LEU O 16 O1H0u 0.660 1.420 3.008 15.596 15.957 0.977 possible 186 25 . LEU CB 8 C4H2s 0.770 1.880 5.943 36.306 22.818 1.591 possible 187 25 . LEU CG 4 C4H1b 0.770 1.880 4.731 21.833 14.704 1.485 possible 188 25 . LEU CD1 10 C4H3u 0.770 1.880 62.351 -1.000 37.235 -1.000 bad 189 25 . LEU CD2 10 C4H3u 0.770 1.880 42.287 -1.000 37.020 -1.000 bad 190 26 . TYR N 12 N3H1s 0.700 1.640 5.305 18.123 13.473 1.345 possible 191 26 . TYR CA 3 C4H1s 0.770 1.880 6.843 26.379 13.249 1.991 possible 192 26 . TYR C 1 C3H0s 0.770 1.610 2.386 7.728 8.714 0.887 [OK] 193 26 . TYR O 16 O1H0u 0.660 1.420 2.735 13.810 15.901 0.868 [OK] 194 26 . TYR CB 8 C4H2s 0.770 1.880 7.181 48.378 23.426 2.065 possible 195 26 . TYR CG 2 C3H0b 0.770 1.610 5.590 15.675 9.695 1.617 possible 196 26 . TYR CD1 5 C3H1s 0.770 1.760 14.532 -1.000 20.057 -1.000 bad 197 26 . TYR CD2 5 C3H1s 0.770 1.760 5.213 36.715 20.578 1.784 possible 198 26 . TYR CE1 5 C3H1s 0.770 1.760 18.556 -1.000 20.534 -1.000 bad 199 26 . TYR CE2 5 C3H1s 0.770 1.760 4.883 25.782 20.577 1.253 possible 200 26 . TYR CZ 2 C3H0b 0.770 1.610 5.429 15.895 9.888 1.607 possible 201 26 . TYR OH 17 O2H1u 0.660 1.460 3.195 -1.000 18.541 -1.000 bad 202 27 . PHE N 12 N3H1s 0.700 1.640 2.487 13.281 13.524 0.982 [OK] 203 27 . PHE CA 3 C4H1s 0.770 1.880 2.976 13.115 13.371 0.981 [OK] 204 27 . PHE C 1 C3H0s 0.770 1.610 2.901 8.797 8.697 1.012 [OK] 205 27 . PHE O 16 O1H0u 0.660 1.420 2.840 17.660 15.961 1.106 [OK] 206 27 . PHE CB 8 C4H2s 0.770 1.880 3.353 26.066 23.623 1.103 possible 207 27 . PHE CG 2 C3H0b 0.770 1.610 2.604 10.174 9.684 1.051 [OK] 208 27 . PHE CD1 5 C3H1s 0.770 1.760 3.498 26.777 20.325 1.317 possible 209 27 . PHE CD2 6 C3H1b 0.770 1.760 3.657 31.591 20.948 1.508 possible 210 27 . PHE CE1 6 C3H1b 0.770 1.760 4.905 37.907 21.532 1.760 possible 211 27 . PHE CE2 6 C3H1b 0.770 1.760 3.692 24.294 21.625 1.123 possible 212 27 . PHE CZ 6 C3H1b 0.770 1.760 2.948 21.086 21.555 0.978 [OK] 213 28 . LEU N 12 N3H1s 0.700 1.640 2.907 13.152 13.517 0.973 [OK] 214 28 . LEU CA 3 C4H1s 0.770 1.880 3.330 17.908 13.055 1.372 possible 215 28 . LEU C 1 C3H0s 0.770 1.610 3.939 9.476 8.781 1.079 possible 216 28 . LEU O 16 O1H0u 0.660 1.420 4.055 25.022 15.957 1.568 possible 217 28 . LEU CB 8 C4H2s 0.770 1.880 3.159 19.618 22.818 0.860 possible 218 28 . LEU CG 4 C4H1b 0.770 1.880 11.822 -1.000 14.704 -1.000 bad 219 28 . LEU CD1 10 C4H3u 0.770 1.880 30.453 -1.000 37.235 -1.000 bad 220 28 . LEU CD2 10 C4H3u 0.770 1.880 45.839 -1.000 37.020 -1.000 bad 221 29 . VAL N 12 N3H1s 0.700 1.640 3.999 14.720 13.553 1.086 possible 222 29 . VAL CA 3 C4H1s 0.770 1.880 4.658 21.491 13.078 1.643 possible 223 29 . VAL C 1 C3H0s 0.770 1.610 2.565 7.498 8.528 0.879 [OK] 224 29 . VAL O 16 O1H0u 0.660 1.420 7.899 46.275 15.998 2.893 possible 225 29 . VAL CB 4 C4H1b 0.770 1.880 3.230 12.422 14.514 0.856 possible 226 29 . VAL CG1 10 C4H3u 0.770 1.880 46.231 -1.000 36.320 -1.000 bad 227 29 . VAL CG2 10 C4H3u 0.770 1.880 47.956 -1.000 36.173 -1.000 bad 228 30 . LYS N 12 N3H1s 0.700 1.640 3.003 12.086 13.429 0.900 possible 229 30 . LYS CA 3 C4H1s 0.770 1.880 4.731 20.996 13.217 1.589 possible 230 30 . LYS C 1 C3H0s 0.770 1.610 2.739 8.104 8.696 0.932 [OK] 231 30 . LYS O 16 O1H0u 0.660 1.420 5.385 31.187 15.818 1.972 possible 232 30 . LYS CB 8 C4H2s 0.770 1.880 3.447 25.361 22.578 1.123 possible 233 30 . LYS CG 8 C4H2s 0.770 1.880 6.545 41.174 22.847 1.802 possible 234 30 . LYS CD 8 C4H2s 0.770 1.880 5.464 41.834 23.365 1.790 possible 235 30 . LYS CE 9 C4H2b 0.770 1.880 26.407 -1.000 23.720 -1.000 bad 236 30 . LYS NZ 14 N4H3u 0.700 1.640 51.845 -1.000 21.413 -1.000 bad 237 31 . GLY N 12 N3H1s 0.700 1.640 3.565 14.283 14.480 0.986 possible 238 31 . GLY CA 8 C4H2s 0.770 1.880 5.433 44.066 23.470 1.878 possible 239 31 . GLY C 2 C3H0b 0.770 1.610 3.652 11.948 9.652 1.238 possible 240 31 . GLY O 16 O1H0u 0.660 1.420 28.319 -1.000 16.154 -1.000 bad 241 32 . MET N 12 N3H1s 0.700 1.640 4.098 17.599 13.405 1.313 possible 242 32 . MET CA 3 C4H1s 0.770 1.880 5.830 33.138 13.194 2.512 possible 243 32 . MET C 1 C3H0s 0.770 1.610 2.950 8.042 8.756 0.918 [OK] 244 32 . MET O 16 O1H0u 0.660 1.420 36.600 -1.000 16.002 -1.000 bad 245 32 . MET CB 8 C4H2s 0.770 1.880 5.104 41.862 23.418 1.788 possible 246 32 . MET CG 9 C4H2b 0.770 1.880 19.182 -1.000 23.830 -1.000 bad 247 32 . MET SD 19 S2H0u 1.040 1.770 37.443 -1.000 30.207 -1.000 bad 248 32 . MET CE 10 C4H3u 0.770 1.880 77.748 -1.000 37.003 -1.000 bad 249 33 . GLY N 12 N3H1s 0.700 1.640 36.149 -1.000 14.480 -1.000 bad 281 38 . ASP N 12 N3H1s 0.700 1.640 35.324 -1.000 13.654 -1.000 bad 282 38 . ASP CA 3 C4H1s 0.770 1.880 3.931 17.755 13.254 1.340 possible 283 38 . ASP C 1 C3H0s 0.770 1.610 2.762 9.397 8.750 1.074 [OK] 284 38 . ASP O 16 O1H0u 0.660 1.420 3.404 17.352 15.757 1.101 possible 285 38 . ASP CB 8 C4H2s 0.770 1.880 7.324 68.833 23.022 2.990 possible 286 38 . ASP CG 2 C3H0b 0.770 1.610 4.052 13.961 9.336 1.495 possible 287 38 . ASP OD1 16 O1H0u 0.660 1.420 37.558 -1.000 15.078 -1.000 bad 288 38 . ASP OD2 16 O1H0u 0.660 1.420 47.051 -1.000 15.582 -1.000 bad 289 39 . ALA N 12 N3H1s 0.700 1.640 5.122 26.295 13.872 1.896 possible 290 39 . ALA CA 4 C4H1b 0.770 1.880 4.979 21.880 13.959 1.567 possible 291 39 . ALA C 1 C3H0s 0.770 1.610 4.266 9.272 8.858 1.047 possible 292 39 . ALA O 16 O1H0u 0.660 1.420 5.075 37.377 16.026 2.332 possible 293 39 . ALA CB 10 C4H3u 0.770 1.880 67.840 -1.000 36.551 -1.000 bad 294 40 . LYS N 12 N3H1s 0.700 1.640 5.616 25.932 13.429 1.931 possible 295 40 . LYS CA 3 C4H1s 0.770 1.880 6.786 37.371 13.217 2.827 possible 296 40 . LYS C 1 C3H0s 0.770 1.610 2.562 7.869 8.696 0.905 [OK] 297 40 . LYS O 16 O1H0u 0.660 1.420 3.658 22.530 15.818 1.424 possible 298 40 . LYS CB 8 C4H2s 0.770 1.880 17.343 -1.000 22.578 -1.000 bad 299 40 . LYS CG 8 C4H2s 0.770 1.880 13.993 -1.000 22.847 -1.000 bad 300 40 . LYS CD 8 C4H2s 0.770 1.880 22.910 -1.000 23.365 -1.000 bad 301 40 . LYS CE 9 C4H2b 0.770 1.880 42.541 -1.000 23.720 -1.000 bad 302 40 . LYS NZ 14 N4H3u 0.700 1.640 55.878 -1.000 21.413 -1.000 bad 303 41 . LYS N 12 N3H1s 0.700 1.640 2.883 14.228 13.429 1.059 [OK] 304 41 . LYS CA 3 C4H1s 0.770 1.880 5.302 23.454 13.217 1.775 possible 305 41 . LYS C 1 C3H0s 0.770 1.610 2.479 8.848 8.696 1.018 [OK] 306 41 . LYS O 16 O1H0u 0.660 1.420 3.494 18.237 15.818 1.153 possible 307 41 . LYS CB 8 C4H2s 0.770 1.880 3.835 30.541 22.578 1.353 possible 308 41 . LYS CG 8 C4H2s 0.770 1.880 5.624 40.677 22.847 1.780 possible 309 41 . LYS CD 8 C4H2s 0.770 1.880 4.778 47.996 23.365 2.054 possible 310 41 . LYS CE 9 C4H2b 0.770 1.880 39.514 -1.000 23.720 -1.000 bad 311 41 . LYS NZ 14 N4H3u 0.700 1.640 51.638 -1.000 21.413 -1.000 bad 312 42 . PHE N 12 N3H1s 0.700 1.640 2.627 14.666 13.524 1.084 [OK] 313 42 . PHE CA 3 C4H1s 0.770 1.880 3.204 14.721 13.371 1.101 possible 314 42 . PHE C 1 C3H0s 0.770 1.610 2.330 8.389 8.697 0.965 [OK] 315 42 . PHE O 16 O1H0u 0.660 1.420 2.758 14.722 15.961 0.922 [OK] 316 42 . PHE CB 8 C4H2s 0.770 1.880 4.863 31.262 23.623 1.323 possible 317 42 . PHE CG 2 C3H0b 0.770 1.610 3.075 9.644 9.684 0.996 possible 318 42 . PHE CD1 5 C3H1s 0.770 1.760 5.674 31.387 20.325 1.544 possible 319 42 . PHE CD2 6 C3H1b 0.770 1.760 3.111 24.057 20.948 1.148 possible 320 42 . PHE CE1 6 C3H1b 0.770 1.760 5.774 44.870 21.532 2.084 possible 321 42 . PHE CE2 6 C3H1b 0.770 1.760 3.278 25.034 21.625 1.158 possible 322 42 . PHE CZ 6 C3H1b 0.770 1.760 4.380 29.523 21.555 1.370 possible 323 43 . TYR N 12 N3H1s 0.700 1.640 4.595 19.874 13.473 1.475 possible 324 43 . TYR CA 3 C4H1s 0.770 1.880 4.267 17.431 13.249 1.316 possible 325 43 . TYR C 1 C3H0s 0.770 1.610 2.095 7.528 8.714 0.864 [OK] 326 43 . TYR O 16 O1H0u 0.660 1.420 2.917 15.200 15.901 0.956 [OK] 327 43 . TYR CB 8 C4H2s 0.770 1.880 5.264 50.912 23.426 2.173 possible 328 43 . TYR CG 2 C3H0b 0.770 1.610 3.343 11.022 9.695 1.137 possible 329 43 . TYR CD1 5 C3H1s 0.770 1.760 3.498 27.801 20.057 1.386 possible 330 43 . TYR CD2 5 C3H1s 0.770 1.760 5.001 32.189 20.578 1.564 possible 331 43 . TYR CE1 5 C3H1s 0.770 1.760 4.812 42.680 20.534 2.079 possible 332 43 . TYR CE2 5 C3H1s 0.770 1.760 7.262 65.632 20.577 3.190 possible 333 43 . TYR CZ 2 C3H0b 0.770 1.610 4.464 15.292 9.888 1.547 possible 334 43 . TYR OH 17 O2H1u 0.660 1.460 46.852 -1.000 18.541 -1.000 bad 335 44 . ALA N 12 N3H1s 0.700 1.640 2.404 12.860 13.872 0.927 [OK] 336 44 . ALA CA 4 C4H1b 0.770 1.880 4.268 17.721 13.959 1.270 possible 337 44 . ALA C 1 C3H0s 0.770 1.610 3.247 9.463 8.858 1.068 possible 338 44 . ALA O 16 O1H0u 0.660 1.420 5.490 21.257 16.026 1.326 possible 339 44 . ALA CB 10 C4H3u 0.770 1.880 32.151 -1.000 36.551 -1.000 bad 340 45 . ILE N 12 N3H1s 0.700 1.640 2.729 12.419 13.493 0.920 [OK] 341 45 . ILE CA 3 C4H1s 0.770 1.880 2.858 13.608 12.946 1.051 [OK] 342 45 . ILE C 1 C3H0s 0.770 1.610 2.562 8.157 8.445 0.966 [OK] 343 45 . ILE O 16 O1H0u 0.660 1.420 3.006 15.514 15.930 0.974 possible 344 45 . ILE CB 4 C4H1b 0.770 1.880 3.170 15.916 14.146 1.125 possible 345 45 . ILE CG1 9 C4H2b 0.770 1.880 3.380 24.479 24.071 1.017 possible 346 45 . ILE CG2 10 C4H3u 0.770 1.880 3.485 42.025 35.763 1.175 possible 347 45 . ILE CD1 10 C4H3u 0.770 1.880 32.971 -1.000 38.219 -1.000 bad 348 46 . THR N 12 N3H1s 0.700 1.640 2.623 13.310 13.544 0.983 [OK] 349 46 . THR CA 3 C4H1s 0.770 1.880 3.225 14.405 13.025 1.106 possible 350 46 . THR C 1 C3H0s 0.770 1.610 2.528 8.369 8.685 0.964 [OK] 351 46 . THR O 16 O1H0u 0.660 1.420 3.078 16.963 15.795 1.074 possible 352 46 . THR CB 4 C4H1b 0.770 1.880 3.062 14.172 14.687 0.965 possible 353 46 . THR OG1 17 O2H1u 0.660 1.460 3.593 32.605 17.610 1.852 possible 354 46 . THR CG2 10 C4H3u 0.770 1.880 3.053 28.486 36.265 0.785 possible 355 47 . THR N 12 N3H1s 0.700 1.640 2.563 12.246 13.544 0.904 [OK] 356 47 . THR CA 3 C4H1s 0.770 1.880 3.057 14.847 13.025 1.140 possible 357 47 . THR C 1 C3H0s 0.770 1.610 2.715 8.125 8.685 0.936 [OK] 358 47 . THR O 16 O1H0u 0.660 1.420 3.020 18.887 15.795 1.196 possible 359 47 . THR CB 4 C4H1b 0.770 1.880 3.007 13.869 14.687 0.944 possible 360 47 . THR OG1 17 O2H1u 0.660 1.460 2.952 25.263 17.610 1.435 [OK] 361 47 . THR CG2 10 C4H3u 0.770 1.880 19.077 -1.000 36.265 -1.000 bad 362 48 . LEU N 12 N3H1s 0.700 1.640 2.762 12.024 13.517 0.890 [OK] 363 48 . LEU CA 3 C4H1s 0.770 1.880 6.558 27.143 13.055 2.079 possible 364 48 . LEU C 1 C3H0s 0.770 1.610 2.352 8.184 8.781 0.932 [OK] 365 48 . LEU O 16 O1H0u 0.660 1.420 3.253 16.344 15.957 1.024 possible 366 48 . LEU CB 8 C4H2s 0.770 1.880 9.253 -1.000 22.818 -1.000 bad 367 48 . LEU CG 4 C4H1b 0.770 1.880 3.806 14.136 14.704 0.961 possible 368 48 . LEU CD1 10 C4H3u 0.770 1.880 35.133 -1.000 37.235 -1.000 bad 369 48 . LEU CD2 10 C4H3u 0.770 1.880 3.413 30.485 37.020 0.823 possible 370 49 . VAL N 12 N3H1s 0.700 1.640 2.354 11.614 13.553 0.857 [OK] 371 49 . VAL CA 3 C4H1s 0.770 1.880 3.214 15.353 13.078 1.174 possible 372 49 . VAL C 1 C3H0s 0.770 1.610 2.595 8.232 8.528 0.965 [OK] 373 49 . VAL O 16 O1H0u 0.660 1.420 2.661 16.744 15.998 1.047 [OK] 374 49 . VAL CB 4 C4H1b 0.770 1.880 3.142 17.250 14.514 1.189 possible 375 49 . VAL CG1 10 C4H3u 0.770 1.880 4.154 50.084 36.320 1.379 possible 376 49 . VAL CG2 10 C4H3u 0.770 1.880 3.329 32.334 36.173 0.894 possible 377 50 . PRO N 11 N3H0u 0.700 1.640 2.735 8.842 8.650 1.022 [OK] 378 50 . PRO CA 4 C4H1b 0.770 1.880 3.077 16.665 13.828 1.205 possible 379 50 . PRO C 1 C3H0s 0.770 1.610 2.571 8.838 8.768 1.008 [OK] 380 50 . PRO O 16 O1H0u 0.660 1.420 2.475 14.179 15.856 0.894 [OK] 381 50 . PRO CB 9 C4H2b 0.770 1.880 3.386 28.047 25.314 1.108 possible 382 50 . PRO CG 9 C4H2b 0.770 1.880 3.755 45.256 25.480 1.776 possible 383 50 . PRO CD 8 C4H2s 0.770 1.880 3.159 17.621 23.390 0.753 possible 384 51 . ALA N 12 N3H1s 0.700 1.640 2.559 14.259 13.872 1.028 [OK] 385 51 . ALA CA 4 C4H1b 0.770 1.880 2.972 14.164 13.959 1.015 [OK] 386 51 . ALA C 1 C3H0s 0.770 1.610 3.852 9.590 8.858 1.083 possible 387 51 . ALA O 16 O1H0u 0.660 1.420 4.111 20.408 16.026 1.273 possible 388 51 . ALA CB 10 C4H3u 0.770 1.880 29.599 -1.000 36.551 -1.000 bad 389 52 . ILE N 12 N3H1s 0.700 1.640 3.847 14.462 13.493 1.072 possible 390 52 . ILE CA 3 C4H1s 0.770 1.880 3.727 13.965 12.946 1.079 possible 391 52 . ILE C 1 C3H0s 0.770 1.610 2.750 7.825 8.445 0.927 [OK] 392 52 . ILE O 16 O1H0u 0.660 1.420 2.813 16.056 15.930 1.008 [OK] 393 52 . ILE CB 4 C4H1b 0.770 1.880 3.214 15.788 14.146 1.116 possible 394 52 . ILE CG1 9 C4H2b 0.770 1.880 19.662 -1.000 24.071 -1.000 bad 395 52 . ILE CG2 10 C4H3u 0.770 1.880 5.697 63.044 35.763 1.763 possible 396 52 . ILE CD1 10 C4H3u 0.770 1.880 23.502 -1.000 38.219 -1.000 bad 397 53 . ALA N 12 N3H1s 0.700 1.640 3.083 13.919 13.872 1.003 possible 398 53 . ALA CA 4 C4H1b 0.770 1.880 3.358 18.728 13.959 1.342 possible 399 53 . ALA C 1 C3H0s 0.770 1.610 2.391 8.260 8.858 0.933 [OK] 400 53 . ALA O 16 O1H0u 0.660 1.420 2.513 15.132 16.026 0.944 [OK] 401 53 . ALA CB 10 C4H3u 0.770 1.880 3.212 34.298 36.551 0.938 possible 402 54 . PHE N 12 N3H1s 0.700 1.640 2.292 11.218 13.524 0.830 [OK] 403 54 . PHE CA 3 C4H1s 0.770 1.880 2.864 13.844 13.371 1.035 [OK] 404 54 . PHE C 1 C3H0s 0.770 1.610 2.008 7.653 8.697 0.880 [OK] 405 54 . PHE O 16 O1H0u 0.660 1.420 2.459 14.773 15.961 0.926 [OK] 406 54 . PHE CB 8 C4H2s 0.770 1.880 3.016 20.787 23.623 0.880 possible 407 54 . PHE CG 2 C3H0b 0.770 1.610 2.936 10.636 9.684 1.098 [OK] 408 54 . PHE CD1 5 C3H1s 0.770 1.760 4.308 27.585 20.325 1.357 possible 409 54 . PHE CD2 6 C3H1b 0.770 1.760 3.039 19.594 20.948 0.935 possible 410 54 . PHE CE1 6 C3H1b 0.770 1.760 22.172 -1.000 21.532 -1.000 bad 411 54 . PHE CE2 6 C3H1b 0.770 1.760 14.502 -1.000 21.625 -1.000 bad 412 54 . PHE CZ 6 C3H1b 0.770 1.760 35.638 -1.000 21.555 -1.000 bad 413 55 . THR N 12 N3H1s 0.700 1.640 2.789 12.663 13.544 0.935 [OK] 414 55 . THR CA 3 C4H1s 0.770 1.880 3.637 16.882 13.025 1.296 possible 415 55 . THR C 1 C3H0s 0.770 1.610 2.951 8.371 8.685 0.964 [OK] 416 55 . THR O 16 O1H0u 0.660 1.420 3.968 22.018 15.795 1.394 possible 417 55 . THR CB 4 C4H1b 0.770 1.880 13.197 -1.000 14.687 -1.000 bad 418 55 . THR OG1 17 O2H1u 0.660 1.460 33.802 -1.000 17.610 -1.000 bad 419 55 . THR CG2 10 C4H3u 0.770 1.880 26.359 -1.000 36.265 -1.000 bad 420 56 . MET N 12 N3H1s 0.700 1.640 3.195 13.384 13.405 0.998 possible 421 56 . MET CA 3 C4H1s 0.770 1.880 3.572 12.640 13.194 0.958 possible 422 56 . MET C 1 C3H0s 0.770 1.610 2.872 9.661 8.756 1.103 [OK] 423 56 . MET O 16 O1H0u 0.660 1.420 3.001 17.127 16.002 1.070 possible 424 56 . MET CB 8 C4H2s 0.770 1.880 3.191 25.516 23.418 1.090 possible 425 56 . MET CG 9 C4H2b 0.770 1.880 3.406 27.082 23.830 1.136 possible 426 56 . MET SD 19 S2H0u 1.040 1.770 6.320 57.001 30.207 1.887 possible 427 56 . MET CE 10 C4H3u 0.770 1.880 47.158 -1.000 37.003 -1.000 bad 428 57 . TYR N 12 N3H1s 0.700 1.640 2.857 13.334 13.473 0.990 [OK] 429 57 . TYR CA 3 C4H1s 0.770 1.880 3.429 16.415 13.249 1.239 possible 430 57 . TYR C 1 C3H0s 0.770 1.610 2.389 8.212 8.714 0.942 [OK] 431 57 . TYR O 16 O1H0u 0.660 1.420 2.853 20.942 15.901 1.317 [OK] 432 57 . TYR CB 8 C4H2s 0.770 1.880 3.023 21.534 23.426 0.919 possible 433 57 . TYR CG 2 C3H0b 0.770 1.610 2.974 11.749 9.695 1.212 [OK] 434 57 . TYR CD1 5 C3H1s 0.770 1.760 3.274 24.486 20.057 1.221 possible 435 57 . TYR CD2 5 C3H1s 0.770 1.760 3.253 26.165 20.578 1.271 possible 436 57 . TYR CE1 5 C3H1s 0.770 1.760 3.849 32.724 20.534 1.594 possible 437 57 . TYR CE2 5 C3H1s 0.770 1.760 3.234 29.137 20.577 1.416 possible 438 57 . TYR CZ 2 C3H0b 0.770 1.610 3.691 13.742 9.888 1.390 possible 439 57 . TYR OH 17 O2H1u 0.660 1.460 3.489 21.584 18.541 1.164 possible 440 58 . LEU N 12 N3H1s 0.700 1.640 2.176 11.267 13.517 0.834 [OK] 441 58 . LEU CA 3 C4H1s 0.770 1.880 2.700 13.237 13.055 1.014 [OK] 442 58 . LEU C 1 C3H0s 0.770 1.610 2.992 8.747 8.781 0.996 [OK] 443 58 . LEU O 16 O1H0u 0.660 1.420 2.787 15.232 15.957 0.955 [OK] 444 58 . LEU CB 8 C4H2s 0.770 1.880 3.551 25.249 22.818 1.107 possible 445 58 . LEU CG 4 C4H1b 0.770 1.880 3.053 15.335 14.704 1.043 possible 446 58 . LEU CD1 10 C4H3u 0.770 1.880 26.940 -1.000 37.235 -1.000 bad 447 58 . LEU CD2 10 C4H3u 0.770 1.880 46.181 -1.000 37.020 -1.000 bad 448 59 . SER N 12 N3H1s 0.700 1.640 3.514 13.535 13.808 0.980 possible 449 59 . SER CA 3 C4H1s 0.770 1.880 4.562 19.992 13.351 1.497 possible 450 59 . SER C 1 C3H0s 0.770 1.610 2.860 8.632 8.858 0.974 [OK] 451 59 . SER O 16 O1H0u 0.660 1.420 5.181 32.910 15.860 2.075 possible 452 59 . SER CB 8 C4H2s 0.770 1.880 4.976 30.557 23.599 1.295 possible 453 59 . SER OG 17 O2H1u 0.660 1.460 29.373 -1.000 18.021 -1.000 bad 454 60 . MET N 12 N3H1s 0.700 1.640 2.798 13.297 13.405 0.992 [OK] 455 60 . MET CA 3 C4H1s 0.770 1.880 4.262 17.933 13.194 1.359 possible 456 60 . MET C 1 C3H0s 0.770 1.610 2.180 8.214 8.756 0.938 [OK] 457 60 . MET O 16 O1H0u 0.660 1.420 3.832 33.063 16.002 2.066 possible 458 60 . MET CB 8 C4H2s 0.770 1.880 3.558 25.690 23.418 1.097 possible 459 60 . MET CG 9 C4H2b 0.770 1.880 3.231 27.200 23.830 1.141 possible 460 60 . MET SD 19 S2H0u 1.040 1.770 4.049 44.726 30.207 1.481 possible 461 60 . MET CE 10 C4H3u 0.770 1.880 3.993 36.660 37.003 0.991 possible 462 61 . LEU N 12 N3H1s 0.700 1.640 2.612 13.787 13.517 1.020 [OK] 463 61 . LEU CA 3 C4H1s 0.770 1.880 3.170 14.328 13.055 1.098 possible 464 61 . LEU C 1 C3H0s 0.770 1.610 2.827 8.222 8.781 0.936 [OK] 465 61 . LEU O 16 O1H0u 0.660 1.420 7.469 85.269 15.957 5.344 possible 466 61 . LEU CB 8 C4H2s 0.770 1.880 3.183 25.483 22.818 1.117 possible 467 61 . LEU CG 4 C4H1b 0.770 1.880 6.771 30.724 14.704 2.089 possible 468 61 . LEU CD1 10 C4H3u 0.770 1.880 6.351 57.114 37.235 1.534 possible 469 61 . LEU CD2 10 C4H3u 0.770 1.880 12.161 -1.000 37.020 -1.000 bad 470 62 . LEU N 12 N3H1s 0.700 1.640 3.233 13.773 13.517 1.019 possible 471 62 . LEU CA 3 C4H1s 0.770 1.880 7.075 29.827 13.055 2.285 possible 472 62 . LEU C 1 C3H0s 0.770 1.610 3.209 9.558 8.781 1.088 possible 473 62 . LEU O 16 O1H0u 0.660 1.420 39.621 -1.000 15.957 -1.000 bad 474 62 . LEU CB 8 C4H2s 0.770 1.880 3.476 22.156 22.818 0.971 possible 475 62 . LEU CG 4 C4H1b 0.770 1.880 8.258 -1.000 14.704 -1.000 bad 476 62 . LEU CD1 10 C4H3u 0.770 1.880 54.095 -1.000 37.235 -1.000 bad 477 62 . LEU CD2 10 C4H3u 0.770 1.880 52.264 -1.000 37.020 -1.000 bad 478 63 . GLY N 12 N3H1s 0.700 1.640 22.602 -1.000 14.480 -1.000 bad 554 74 . GLU N 12 N3H1s 0.700 1.640 29.886 -1.000 13.461 -1.000 bad 555 74 . GLU CA 3 C4H1s 0.770 1.880 12.631 -1.000 13.284 -1.000 bad 556 74 . GLU C 1 C3H0s 0.770 1.610 3.867 10.279 8.631 1.191 possible 557 74 . GLU O 16 O1H0u 0.660 1.420 3.972 32.345 15.765 2.052 possible 558 74 . GLU CB 8 C4H2s 0.770 1.880 22.382 -1.000 23.214 -1.000 bad 559 74 . GLU CG 8 C4H2s 0.770 1.880 7.721 63.928 23.304 2.743 possible 560 74 . GLU CD 2 C3H0b 0.770 1.610 6.810 -1.000 9.437 -1.000 bad 561 74 . GLU OE1 16 O1H0u 0.660 1.420 46.627 -1.000 15.497 -1.000 bad 562 74 . GLU OE2 16 O1H0u 0.660 1.420 37.536 -1.000 16.213 -1.000 bad 563 75 . GLN N 12 N3H1s 0.700 1.640 4.324 17.720 13.449 1.318 possible 564 75 . GLN CA 3 C4H1s 0.770 1.880 4.538 21.636 13.231 1.635 possible 565 75 . GLN C 1 C3H0s 0.770 1.610 2.985 9.819 8.744 1.123 [OK] 566 75 . GLN O 16 O1H0u 0.660 1.420 3.314 20.311 15.767 1.288 possible 567 75 . GLN CB 8 C4H2s 0.770 1.880 5.915 53.098 23.059 2.303 possible 568 75 . GLN CG 8 C4H2s 0.770 1.880 3.983 30.671 23.218 1.321 possible 569 75 . GLN CD 2 C3H0b 0.770 1.610 6.587 17.518 9.618 1.821 possible 570 75 . GLN OE1 16 O1H0u 0.660 1.420 32.122 -1.000 16.571 -1.000 bad 571 75 . GLN NE2 15 N3H2u 0.700 1.640 53.505 -1.000 23.255 -1.000 bad 572 76 . ASN N 12 N3H1s 0.700 1.640 2.989 13.977 13.525 1.033 [OK] 573 76 . ASN CA 3 C4H1s 0.770 1.880 2.774 11.747 13.052 0.900 [OK] 574 76 . ASN C 1 C3H0s 0.770 1.610 2.505 8.857 8.853 1.000 [OK] 575 76 . ASN O 16 O1H0u 0.660 1.420 2.413 16.413 15.857 1.035 [OK] 576 76 . ASN CB 8 C4H2s 0.770 1.880 6.793 39.269 22.756 1.726 possible 577 76 . ASN CG 2 C3H0b 0.770 1.610 3.422 11.721 9.537 1.229 possible 578 76 . ASN OD1 16 O1H0u 0.660 1.420 6.086 36.721 16.247 2.260 possible 579 76 . ASN ND2 15 N3H2u 0.700 1.640 48.426 -1.000 22.525 -1.000 bad 580 77 . PRO N 11 N3H0u 0.700 1.640 3.007 9.396 8.650 1.086 possible 581 77 . PRO CA 4 C4H1b 0.770 1.880 2.452 10.843 13.828 0.784 [OK] 582 77 . PRO C 1 C3H0s 0.770 1.610 3.792 9.374 8.768 1.069 possible 583 77 . PRO O 16 O1H0u 0.660 1.420 4.324 26.301 15.856 1.659 possible 584 77 . PRO CB 9 C4H2b 0.770 1.880 22.408 -1.000 25.314 -1.000 bad 585 77 . PRO CG 9 C4H2b 0.770 1.880 37.844 -1.000 25.480 -1.000 bad 586 77 . PRO CD 8 C4H2s 0.770 1.880 4.293 31.770 23.390 1.358 possible 587 78 . ILE N 12 N3H1s 0.700 1.640 3.741 16.987 13.493 1.259 possible 588 78 . ILE CA 3 C4H1s 0.770 1.880 4.394 19.932 12.946 1.540 possible 589 78 . ILE C 1 C3H0s 0.770 1.610 2.615 8.300 8.445 0.983 [OK] 590 78 . ILE O 16 O1H0u 0.660 1.420 2.991 20.716 15.930 1.300 [OK] 591 78 . ILE CB 4 C4H1b 0.770 1.880 3.916 19.713 14.146 1.394 possible 592 78 . ILE CG1 9 C4H2b 0.770 1.880 6.264 55.376 24.071 2.301 possible 593 78 . ILE CG2 10 C4H3u 0.770 1.880 3.863 49.832 35.763 1.393 possible 594 78 . ILE CD1 10 C4H3u 0.770 1.880 38.929 -1.000 38.219 -1.000 bad 595 79 . TYR N 12 N3H1s 0.700 1.640 3.019 16.320 13.473 1.211 possible 596 79 . TYR CA 3 C4H1s 0.770 1.880 3.626 17.501 13.249 1.321 possible 597 79 . TYR C 1 C3H0s 0.770 1.610 2.198 8.008 8.714 0.919 [OK] 598 79 . TYR O 16 O1H0u 0.660 1.420 3.156 17.808 15.901 1.120 possible 599 79 . TYR CB 8 C4H2s 0.770 1.880 3.177 23.968 23.426 1.023 possible 600 79 . TYR CG 2 C3H0b 0.770 1.610 3.543 12.816 9.695 1.322 possible 601 79 . TYR CD1 5 C3H1s 0.770 1.760 3.502 24.804 20.057 1.237 possible 602 79 . TYR CD2 5 C3H1s 0.770 1.760 3.912 26.426 20.578 1.284 possible 603 79 . TYR CE1 5 C3H1s 0.770 1.760 4.349 33.090 20.534 1.611 possible 604 79 . TYR CE2 5 C3H1s 0.770 1.760 3.686 30.905 20.577 1.502 possible 605 79 . TYR CZ 2 C3H0b 0.770 1.610 3.089 11.731 9.888 1.186 possible 606 79 . TYR OH 17 O2H1u 0.660 1.460 6.969 102.609 18.541 5.534 possible 607 80 . TRP N 12 N3H1s 0.700 1.640 2.728 16.158 13.639 1.185 [OK] 608 80 . TRP CA 3 C4H1s 0.770 1.880 2.916 11.811 13.323 0.886 [OK] 609 80 . TRP C 1 C3H0s 0.770 1.610 2.826 8.676 8.687 0.999 [OK] 610 80 . TRP O 16 O1H0u 0.660 1.420 3.115 15.218 15.797 0.963 possible 611 80 . TRP CB 8 C4H2s 0.770 1.880 5.677 35.694 23.826 1.498 possible 612 80 . TRP CG 2 C3H0b 0.770 1.610 6.142 16.501 9.915 1.664 possible 613 80 . TRP CD1 5 C3H1s 0.770 1.760 14.595 -1.000 20.597 -1.000 bad 614 80 . TRP CD2 2 C3H0b 0.770 1.610 6.422 17.720 10.068 1.760 possible 615 80 . TRP NE1 13 N3H1b 0.700 1.640 24.128 -1.000 16.723 -1.000 bad 616 80 . TRP CE2 2 C3H0b 0.770 1.610 1.734 -1.000 9.848 -1.000 bad 617 80 . TRP CE3 6 C3H1b 0.770 1.760 6.591 28.666 20.383 1.406 possible 618 80 . TRP CZ2 6 C3H1b 0.770 1.760 25.103 -1.000 20.931 -1.000 bad 619 80 . TRP CZ3 6 C3H1b 0.770 1.760 9.278 -1.000 21.429 -1.000 bad 620 80 . TRP CH2 6 C3H1b 0.770 1.760 21.614 -1.000 21.219 -1.000 bad 621 81 . ALA N 12 N3H1s 0.700 1.640 2.766 13.732 13.872 0.990 [OK] 622 81 . ALA CA 4 C4H1b 0.770 1.880 3.602 18.399 13.959 1.318 possible 623 81 . ALA C 1 C3H0s 0.770 1.610 3.261 9.159 8.858 1.034 possible 624 81 . ALA O 16 O1H0u 0.660 1.420 2.928 14.938 16.026 0.932 [OK] 625 81 . ALA CB 10 C4H3u 0.770 1.880 4.562 60.076 36.551 1.644 possible 626 82 . ARG N 12 N3H1s 0.700 1.640 3.244 16.069 13.486 1.192 possible 627 82 . ARG CA 3 C4H1s 0.770 1.880 3.537 19.094 13.310 1.435 possible 628 82 . ARG C 1 C3H0s 0.770 1.610 2.422 8.106 8.779 0.923 [OK] 629 82 . ARG O 16 O1H0u 0.660 1.420 2.600 14.125 15.916 0.887 [OK] 630 82 . ARG CB 8 C4H2s 0.770 1.880 4.065 31.089 22.833 1.362 possible 631 82 . ARG CG 8 C4H2s 0.770 1.880 4.129 27.608 23.273 1.186 possible 632 82 . ARG CD 8 C4H2s 0.770 1.880 4.222 39.005 22.849 1.707 possible 633 82 . ARG NE 13 N3H1b 0.700 1.640 3.521 18.819 15.019 1.253 possible 634 82 . ARG CZ 2 C3H0b 0.770 1.610 3.471 12.864 9.678 1.329 possible 635 82 . ARG NH1 15 N3H2u 0.700 1.640 3.777 25.815 22.056 1.170 possible 636 82 . ARG NH2 15 N3H2u 0.700 1.640 3.310 29.748 23.132 1.286 possible 637 83 . TYR N 12 N3H1s 0.700 1.640 2.631 13.086 13.473 0.971 [OK] 638 83 . TYR CA 3 C4H1s 0.770 1.880 3.455 14.295 13.249 1.079 possible 639 83 . TYR C 1 C3H0s 0.770 1.610 2.510 8.464 8.714 0.971 [OK] 640 83 . TYR O 16 O1H0u 0.660 1.420 3.513 17.142 15.901 1.078 possible 641 83 . TYR CB 8 C4H2s 0.770 1.880 3.240 20.074 23.426 0.857 possible 642 83 . TYR CG 2 C3H0b 0.770 1.610 2.620 9.958 9.695 1.027 [OK] 643 83 . TYR CD1 5 C3H1s 0.770 1.760 3.377 23.391 20.057 1.166 possible 644 83 . TYR CD2 5 C3H1s 0.770 1.760 2.944 19.378 20.578 0.942 [OK] 645 83 . TYR CE1 5 C3H1s 0.770 1.760 3.540 27.806 20.534 1.354 possible 646 83 . TYR CE2 5 C3H1s 0.770 1.760 2.984 21.188 20.577 1.030 [OK] 647 83 . TYR CZ 2 C3H0b 0.770 1.610 3.224 12.515 9.888 1.266 possible 648 83 . TYR OH 17 O2H1u 0.660 1.460 3.552 26.318 18.541 1.419 possible 649 84 . ALA N 12 N3H1s 0.700 1.640 2.839 12.756 13.872 0.920 [OK] 650 84 . ALA CA 4 C4H1b 0.770 1.880 3.167 14.552 13.959 1.043 possible 651 84 . ALA C 1 C3H0s 0.770 1.610 2.710 8.852 8.858 0.999 [OK] 652 84 . ALA O 16 O1H0u 0.660 1.420 2.467 13.511 16.026 0.843 [OK] 653 84 . ALA CB 10 C4H3u 0.770 1.880 20.346 -1.000 36.551 -1.000 bad 654 85 . ASP N 12 N3H1s 0.700 1.640 2.639 12.862 13.654 0.942 [OK] 655 85 . ASP CA 3 C4H1s 0.770 1.880 3.258 17.234 13.254 1.300 possible 656 85 . ASP C 1 C3H0s 0.770 1.610 2.163 7.671 8.750 0.877 [OK] 657 85 . ASP O 16 O1H0u 0.660 1.420 2.775 16.518 15.757 1.048 [OK] 658 85 . ASP CB 8 C4H2s 0.770 1.880 3.260 23.147 23.022 1.005 possible 659 85 . ASP CG 2 C3H0b 0.770 1.610 2.668 10.247 9.336 1.098 [OK] 660 85 . ASP OD1 16 O1H0u 0.660 1.420 3.337 31.445 15.078 2.086 possible 661 85 . ASP OD2 16 O1H0u 0.660 1.420 2.829 21.769 15.582 1.397 [OK] 662 86 . TRP N 12 N3H1s 0.700 1.640 2.161 10.690 13.639 0.784 [OK] 663 86 . TRP CA 3 C4H1s 0.770 1.880 2.495 12.699 13.323 0.953 [OK] 664 86 . TRP C 1 C3H0s 0.770 1.610 2.971 8.938 8.687 1.029 [OK] 665 86 . TRP O 16 O1H0u 0.660 1.420 2.508 12.463 15.797 0.789 [OK] 666 86 . TRP CB 8 C4H2s 0.770 1.880 3.892 23.204 23.826 0.974 possible 667 86 . TRP CG 2 C3H0b 0.770 1.610 2.316 9.414 9.915 0.949 [OK] 668 86 . TRP CD1 5 C3H1s 0.770 1.760 3.315 22.102 20.597 1.073 possible 669 86 . TRP CD2 2 C3H0b 0.770 1.610 2.500 10.432 10.068 1.036 [OK] 670 86 . TRP NE1 13 N3H1b 0.700 1.640 3.525 25.160 16.723 1.505 possible 671 86 . TRP CE2 2 C3H0b 0.770 1.610 2.758 10.926 9.848 1.109 [OK] 672 86 . TRP CE3 6 C3H1b 0.770 1.760 3.927 28.179 20.383 1.382 possible 673 86 . TRP CZ2 6 C3H1b 0.770 1.760 2.996 19.976 20.931 0.954 [OK] 674 86 . TRP CZ3 6 C3H1b 0.770 1.760 3.040 18.797 21.429 0.877 possible 675 86 . TRP CH2 6 C3H1b 0.770 1.760 3.273 22.974 21.219 1.083 possible 676 87 . LEU N 12 N3H1s 0.700 1.640 3.732 13.942 13.517 1.031 possible 677 87 . LEU CA 3 C4H1s 0.770 1.880 3.777 15.033 13.055 1.152 possible 678 87 . LEU C 1 C3H0s 0.770 1.610 2.675 8.154 8.781 0.929 [OK] 679 87 . LEU O 16 O1H0u 0.660 1.420 2.648 14.262 15.957 0.894 [OK] 680 87 . LEU CB 8 C4H2s 0.770 1.880 3.383 23.940 22.818 1.049 possible 681 87 . LEU CG 4 C4H1b 0.770 1.880 2.413 11.532 14.704 0.784 [OK] 682 87 . LEU CD1 10 C4H3u 0.770 1.880 19.113 -1.000 37.235 -1.000 bad 683 87 . LEU CD2 10 C4H3u 0.770 1.880 17.162 -1.000 37.020 -1.000 bad 684 88 . PHE N 12 N3H1s 0.700 1.640 2.651 12.076 13.524 0.893 [OK] 685 88 . PHE CA 3 C4H1s 0.770 1.880 3.196 14.612 13.371 1.093 possible 686 88 . PHE C 1 C3H0s 0.770 1.610 2.647 8.653 8.697 0.995 [OK] 687 88 . PHE O 16 O1H0u 0.660 1.420 2.885 13.990 15.961 0.877 [OK] 688 88 . PHE CB 8 C4H2s 0.770 1.880 3.848 31.866 23.623 1.349 possible 689 88 . PHE CG 2 C3H0b 0.770 1.610 5.100 13.906 9.684 1.436 possible 690 88 . PHE CD1 5 C3H1s 0.770 1.760 7.357 62.299 20.325 3.065 possible 691 88 . PHE CD2 6 C3H1b 0.770 1.760 5.516 35.543 20.948 1.697 possible 692 88 . PHE CE1 6 C3H1b 0.770 1.760 28.478 -1.000 21.532 -1.000 bad 693 88 . PHE CE2 6 C3H1b 0.770 1.760 19.479 -1.000 21.625 -1.000 bad 694 88 . PHE CZ 6 C3H1b 0.770 1.760 27.930 -1.000 21.555 -1.000 bad 695 89 . THR N 12 N3H1s 0.700 1.640 2.753 14.020 13.544 1.035 [OK] 696 89 . THR CA 3 C4H1s 0.770 1.880 3.214 15.125 13.025 1.161 possible 697 89 . THR C 1 C3H0s 0.770 1.610 2.182 8.495 8.685 0.978 [OK] 698 89 . THR O 16 O1H0u 0.660 1.420 2.561 14.375 15.795 0.910 [OK] 699 89 . THR CB 4 C4H1b 0.770 1.880 3.317 21.357 14.687 1.454 possible 700 89 . THR OG1 17 O2H1u 0.660 1.460 2.576 17.479 17.610 0.993 [OK] 701 89 . THR CG2 10 C4H3u 0.770 1.880 3.271 26.780 36.265 0.738 possible 702 90 . THR N 12 N3H1s 0.700 1.640 2.245 11.654 13.544 0.860 [OK] 703 90 . THR CA 3 C4H1s 0.770 1.880 3.124 14.253 13.025 1.094 possible 704 90 . THR C 1 C3H0s 0.770 1.610 2.604 7.967 8.685 0.917 [OK] 705 90 . THR O 16 O1H0u 0.660 1.420 2.947 17.221 15.795 1.090 [OK] 706 90 . THR CB 4 C4H1b 0.770 1.880 2.503 11.680 14.687 0.795 [OK] 707 90 . THR OG1 17 O2H1u 0.660 1.460 2.665 17.734 17.610 1.007 [OK] 708 90 . THR CG2 10 C4H3u 0.770 1.880 3.447 45.184 36.265 1.246 possible 709 91 . PRO N 11 N3H0u 0.700 1.640 3.053 8.500 8.650 0.983 possible 710 91 . PRO CA 4 C4H1b 0.770 1.880 3.687 20.746 13.828 1.500 possible 711 91 . PRO C 1 C3H0s 0.770 1.610 3.223 9.107 8.768 1.039 possible 712 91 . PRO O 16 O1H0u 0.660 1.420 3.213 16.419 15.856 1.036 possible 713 91 . PRO CB 9 C4H2b 0.770 1.880 6.040 45.073 25.314 1.781 possible 714 91 . PRO CG 9 C4H2b 0.770 1.880 5.867 41.312 25.480 1.621 possible 715 91 . PRO CD 8 C4H2s 0.770 1.880 3.201 20.037 23.390 0.857 possible 716 92 . LEU N 12 N3H1s 0.700 1.640 2.888 12.247 13.517 0.906 [OK] 717 92 . LEU CA 3 C4H1s 0.770 1.880 3.069 14.670 13.055 1.124 possible 718 92 . LEU C 1 C3H0s 0.770 1.610 3.127 9.974 8.781 1.136 possible 719 92 . LEU O 16 O1H0u 0.660 1.420 2.923 15.277 15.957 0.957 [OK] 720 92 . LEU CB 8 C4H2s 0.770 1.880 3.293 23.749 22.818 1.041 possible 721 92 . LEU CG 4 C4H1b 0.770 1.880 3.318 15.995 14.704 1.088 possible 722 92 . LEU CD1 10 C4H3u 0.770 1.880 29.492 -1.000 37.235 -1.000 bad 723 92 . LEU CD2 10 C4H3u 0.770 1.880 4.536 39.554 37.020 1.068 possible 724 93 . LEU N 12 N3H1s 0.700 1.640 3.147 13.478 13.517 0.997 possible 725 93 . LEU CA 3 C4H1s 0.770 1.880 3.502 16.775 13.055 1.285 possible 726 93 . LEU C 1 C3H0s 0.770 1.610 3.333 9.369 8.781 1.067 possible 727 93 . LEU O 16 O1H0u 0.660 1.420 3.103 19.807 15.957 1.241 possible 728 93 . LEU CB 8 C4H2s 0.770 1.880 3.631 25.963 22.818 1.138 possible 729 93 . LEU CG 4 C4H1b 0.770 1.880 3.858 14.792 14.704 1.006 possible 730 93 . LEU CD1 10 C4H3u 0.770 1.880 4.130 41.622 37.235 1.118 possible 731 93 . LEU CD2 10 C4H3u 0.770 1.880 3.835 47.298 37.020 1.278 possible 732 94 . LEU N 12 N3H1s 0.700 1.640 3.314 13.752 13.517 1.017 possible 733 94 . LEU CA 3 C4H1s 0.770 1.880 3.381 13.536 13.055 1.037 possible 734 94 . LEU C 1 C3H0s 0.770 1.610 2.971 8.667 8.781 0.987 [OK] 735 94 . LEU O 16 O1H0u 0.660 1.420 2.978 15.378 15.957 0.964 [OK] 736 94 . LEU CB 8 C4H2s 0.770 1.880 3.755 28.402 22.818 1.245 possible 737 94 . LEU CG 4 C4H1b 0.770 1.880 3.431 17.090 14.704 1.162 possible 738 94 . LEU CD1 10 C4H3u 0.770 1.880 3.821 58.037 37.235 1.559 possible 739 94 . LEU CD2 10 C4H3u 0.770 1.880 3.737 42.905 37.020 1.159 possible 740 95 . LEU N 12 N3H1s 0.700 1.640 3.354 13.356 13.517 0.988 possible 741 95 . LEU CA 3 C4H1s 0.770 1.880 3.471 19.230 13.055 1.473 possible 742 95 . LEU C 1 C3H0s 0.770 1.610 2.626 7.915 8.781 0.901 [OK] 743 95 . LEU O 16 O1H0u 0.660 1.420 3.199 15.034 15.957 0.942 possible 744 95 . LEU CB 8 C4H2s 0.770 1.880 4.000 24.733 22.818 1.084 possible 745 95 . LEU CG 4 C4H1b 0.770 1.880 3.282 16.707 14.704 1.136 possible 746 95 . LEU CD1 10 C4H3u 0.770 1.880 37.848 -1.000 37.235 -1.000 bad 747 95 . LEU CD2 10 C4H3u 0.770 1.880 20.474 -1.000 37.020 -1.000 bad 748 96 . ASP N 12 N3H1s 0.700 1.640 2.795 12.686 13.654 0.929 [OK] 749 96 . ASP CA 3 C4H1s 0.770 1.880 3.001 14.712 13.254 1.110 possible 750 96 . ASP C 1 C3H0s 0.770 1.610 2.562 7.992 8.750 0.913 [OK] 751 96 . ASP O 16 O1H0u 0.660 1.420 3.105 21.212 15.757 1.346 possible 752 96 . ASP CB 8 C4H2s 0.770 1.880 3.440 23.353 23.022 1.014 possible 753 96 . ASP CG 2 C3H0b 0.770 1.610 3.523 12.928 9.336 1.385 possible 754 96 . ASP OD1 16 O1H0u 0.660 1.420 3.422 31.182 15.078 2.068 possible 755 96 . ASP OD2 16 O1H0u 0.660 1.420 3.343 39.003 15.582 2.503 possible 756 97 . LEU N 12 N3H1s 0.700 1.640 3.017 14.323 13.517 1.060 possible 757 97 . LEU CA 3 C4H1s 0.770 1.880 3.536 16.619 13.055 1.273 possible 758 97 . LEU C 1 C3H0s 0.770 1.610 2.838 8.247 8.781 0.939 [OK] 759 97 . LEU O 16 O1H0u 0.660 1.420 3.753 29.517 15.957 1.850 possible 760 97 . LEU CB 8 C4H2s 0.770 1.880 3.211 24.396 22.818 1.069 possible 761 97 . LEU CG 4 C4H1b 0.770 1.880 4.224 22.341 14.704 1.519 possible 762 97 . LEU CD1 10 C4H3u 0.770 1.880 4.219 44.905 37.235 1.206 possible 763 97 . LEU CD2 10 C4H3u 0.770 1.880 3.765 37.364 37.020 1.009 possible 764 98 . ALA N 12 N3H1s 0.700 1.640 3.203 13.440 13.872 0.969 possible 765 98 . ALA CA 4 C4H1b 0.770 1.880 4.286 26.315 13.959 1.885 possible 766 98 . ALA C 1 C3H0s 0.770 1.610 3.790 9.780 8.858 1.104 possible 767 98 . ALA O 16 O1H0u 0.660 1.420 16.813 -1.000 16.026 -1.000 bad 768 98 . ALA CB 10 C4H3u 0.770 1.880 5.195 75.381 36.551 2.062 possible 769 99 . LEU N 12 N3H1s 0.700 1.640 3.823 14.289 13.517 1.057 possible 770 99 . LEU CA 3 C4H1s 0.770 1.880 6.043 27.720 13.055 2.123 possible 771 99 . LEU C 1 C3H0s 0.770 1.610 2.731 8.194 8.781 0.933 [OK] 772 99 . LEU O 16 O1H0u 0.660 1.420 25.811 -1.000 15.957 -1.000 bad 773 99 . LEU CB 8 C4H2s 0.770 1.880 3.193 20.648 22.818 0.905 possible 774 99 . LEU CG 4 C4H1b 0.770 1.880 4.077 19.312 14.704 1.313 possible 775 99 . LEU CD1 10 C4H3u 0.770 1.880 26.935 -1.000 37.235 -1.000 bad 776 99 . LEU CD2 10 C4H3u 0.770 1.880 3.331 44.539 37.020 1.203 possible 777 100 . LEU N 12 N3H1s 0.700 1.640 2.720 15.591 13.517 1.153 [OK] 778 100 . LEU CA 3 C4H1s 0.770 1.880 3.875 15.083 13.055 1.155 possible 779 100 . LEU C 1 C3H0s 0.770 1.610 5.936 15.528 8.781 1.768 possible 780 100 . LEU O 16 O1H0u 0.660 1.420 16.437 -1.000 15.957 -1.000 bad 781 100 . LEU CB 8 C4H2s 0.770 1.880 3.406 22.817 22.818 1.000 possible 782 100 . LEU CG 4 C4H1b 0.770 1.880 2.944 13.137 14.704 0.893 [OK] 783 100 . LEU CD1 10 C4H3u 0.770 1.880 6.119 82.657 37.235 2.220 possible 784 100 . LEU CD2 10 C4H3u 0.770 1.880 4.796 61.564 37.020 1.663 possible 785 101 . VAL N 12 N3H1s 0.700 1.640 36.321 -1.000 13.553 -1.000 bad 822 106 . GLY N 12 N3H1s 0.700 1.640 44.625 -1.000 14.480 -1.000 bad 823 106 . GLY CA 8 C4H2s 0.770 1.880 23.549 -1.000 23.470 -1.000 bad 824 106 . GLY C 2 C3H0b 0.770 1.610 4.976 15.780 9.652 1.635 possible 825 106 . GLY O 16 O1H0u 0.660 1.420 4.771 20.889 16.154 1.293 possible 826 107 . THR N 12 N3H1s 0.700 1.640 6.516 32.453 13.544 2.396 possible 827 107 . THR CA 3 C4H1s 0.770 1.880 4.316 26.021 13.025 1.998 possible 828 107 . THR C 1 C3H0s 0.770 1.610 3.045 8.077 8.685 0.930 possible 829 107 . THR O 16 O1H0u 0.660 1.420 3.390 26.004 15.795 1.646 possible 830 107 . THR CB 4 C4H1b 0.770 1.880 3.519 13.549 14.687 0.923 possible 831 107 . THR OG1 17 O2H1u 0.660 1.460 36.932 -1.000 17.610 -1.000 bad 832 107 . THR CG2 10 C4H3u 0.770 1.880 5.718 75.705 36.265 2.088 possible 833 108 . ILE N 12 N3H1s 0.700 1.640 3.106 12.169 13.493 0.902 possible 834 108 . ILE CA 3 C4H1s 0.770 1.880 3.549 18.794 12.946 1.452 possible 835 108 . ILE C 1 C3H0s 0.770 1.610 3.304 9.025 8.445 1.069 possible 836 108 . ILE O 16 O1H0u 0.660 1.420 3.131 23.670 15.930 1.486 possible 837 108 . ILE CB 4 C4H1b 0.770 1.880 3.854 14.844 14.146 1.049 possible 838 108 . ILE CG1 9 C4H2b 0.770 1.880 19.933 -1.000 24.071 -1.000 bad 839 108 . ILE CG2 10 C4H3u 0.770 1.880 7.540 102.338 35.763 2.862 possible 840 108 . ILE CD1 10 C4H3u 0.770 1.880 21.791 -1.000 38.219 -1.000 bad 841 109 . LEU N 12 N3H1s 0.700 1.640 3.552 12.644 13.517 0.935 possible 842 109 . LEU CA 3 C4H1s 0.770 1.880 4.921 22.830 13.055 1.749 possible 843 109 . LEU C 1 C3H0s 0.770 1.610 4.145 9.447 8.781 1.076 possible 844 109 . LEU O 16 O1H0u 0.660 1.420 6.840 45.655 15.957 2.861 possible 845 109 . LEU CB 8 C4H2s 0.770 1.880 21.148 -1.000 22.818 -1.000 bad 846 109 . LEU CG 4 C4H1b 0.770 1.880 2.796 11.916 14.704 0.810 [OK] 847 109 . LEU CD1 10 C4H3u 0.770 1.880 47.453 -1.000 37.235 -1.000 bad 848 109 . LEU CD2 10 C4H3u 0.770 1.880 40.323 -1.000 37.020 -1.000 bad 849 110 . ALA N 12 N3H1s 0.700 1.640 4.496 17.734 13.872 1.278 possible 850 110 . ALA CA 4 C4H1b 0.770 1.880 15.200 -1.000 13.959 -1.000 bad 851 110 . ALA C 1 C3H0s 0.770 1.610 3.346 9.283 8.858 1.048 possible 852 110 . ALA O 16 O1H0u 0.660 1.420 6.059 41.064 16.026 2.562 possible 853 110 . ALA CB 10 C4H3u 0.770 1.880 26.103 -1.000 36.551 -1.000 bad 854 111 . LEU N 12 N3H1s 0.700 1.640 3.607 16.929 13.517 1.252 possible 855 111 . LEU CA 3 C4H1s 0.770 1.880 3.663 16.881 13.055 1.293 possible 856 111 . LEU C 1 C3H0s 0.770 1.610 3.080 9.539 8.781 1.086 possible 857 111 . LEU O 16 O1H0u 0.660 1.420 2.930 19.883 15.957 1.246 [OK] 858 111 . LEU CB 8 C4H2s 0.770 1.880 3.881 55.127 22.818 2.416 possible 862 112 . VAL N 12 N3H1s 0.700 1.640 3.073 14.401 13.553 1.063 possible 863 112 . VAL CA 3 C4H1s 0.770 1.880 3.281 15.667 13.078 1.198 possible 864 112 . VAL C 1 C3H0s 0.770 1.610 3.264 8.767 8.528 1.028 possible 865 112 . VAL O 16 O1H0u 0.660 1.420 4.628 19.962 15.998 1.248 possible 866 112 . VAL CB 4 C4H1b 0.770 1.880 5.149 22.109 14.514 1.523 possible 867 112 . VAL CG1 10 C4H3u 0.770 1.880 31.533 -1.000 36.320 -1.000 bad 868 112 . VAL CG2 10 C4H3u 0.770 1.880 13.922 -1.000 36.173 -1.000 bad 869 113 . GLY N 12 N3H1s 0.700 1.640 5.102 18.417 14.480 1.272 possible 870 113 . GLY CA 8 C4H2s 0.770 1.880 37.271 -1.000 23.470 -1.000 bad 871 113 . GLY C 2 C3H0b 0.770 1.610 3.237 9.811 9.652 1.016 possible 872 113 . GLY O 16 O1H0u 0.660 1.420 1.989 -1.000 16.154 -1.000 bad 873 114 . ALA N 12 N3H1s 0.700 1.640 3.659 16.777 13.872 1.209 possible 874 114 . ALA CA 4 C4H1b 0.770 1.880 3.590 13.575 13.959 0.972 possible 875 114 . ALA C 1 C3H0s 0.770 1.610 2.302 7.779 8.858 0.878 [OK] 876 114 . ALA O 16 O1H0u 0.660 1.420 2.534 13.511 16.026 0.843 [OK] 877 114 . ALA CB 10 C4H3u 0.770 1.880 3.872 35.362 36.551 0.967 possible 878 115 . ASP N 12 N3H1s 0.700 1.640 2.803 12.451 13.654 0.912 [OK] 879 115 . ASP CA 3 C4H1s 0.770 1.880 2.679 12.388 13.254 0.935 [OK] 880 115 . ASP C 1 C3H0s 0.770 1.610 2.878 9.362 8.750 1.070 [OK] 881 115 . ASP O 16 O1H0u 0.660 1.420 3.246 21.144 15.757 1.342 possible 882 115 . ASP CB 8 C4H2s 0.770 1.880 3.319 25.980 23.022 1.129 possible 883 115 . ASP CG 2 C3H0b 0.770 1.610 3.415 10.028 9.336 1.074 possible 884 115 . ASP OD1 16 O1H0u 0.660 1.420 3.349 25.118 15.078 1.666 possible 885 115 . ASP OD2 16 O1H0u 0.660 1.420 3.337 21.821 15.582 1.400 possible 886 116 . GLY N 12 N3H1s 0.700 1.640 2.900 14.013 14.480 0.968 [OK] 887 116 . GLY CA 8 C4H2s 0.770 1.880 20.681 -1.000 23.470 -1.000 bad 888 116 . GLY C 2 C3H0b 0.770 1.610 2.175 -1.000 9.652 -1.000 bad 889 116 . GLY O 16 O1H0u 0.660 1.420 8.127 -1.000 16.154 -1.000 bad 890 117 . ILE N 12 N3H1s 0.700 1.640 6.407 16.663 13.493 1.235 possible 891 117 . ILE CA 3 C4H1s 0.770 1.880 6.703 27.237 12.946 2.104 possible 892 117 . ILE C 1 C3H0s 0.770 1.610 2.219 7.556 8.445 0.895 [OK] 893 117 . ILE O 16 O1H0u 0.660 1.420 3.633 17.569 15.930 1.103 possible 894 117 . ILE CB 4 C4H1b 0.770 1.880 2.960 11.769 14.146 0.832 [OK] 895 117 . ILE CG1 9 C4H2b 0.770 1.880 16.839 -1.000 24.071 -1.000 bad 896 117 . ILE CG2 10 C4H3u 0.770 1.880 2.940 31.263 35.763 0.874 [OK] 897 117 . ILE CD1 10 C4H3u 0.770 1.880 18.349 -1.000 38.219 -1.000 bad 898 118 . MET N 12 N3H1s 0.700 1.640 2.516 12.421 13.405 0.927 [OK] 899 118 . MET CA 3 C4H1s 0.770 1.880 2.577 12.816 13.194 0.971 [OK] 900 118 . MET C 1 C3H0s 0.770 1.610 2.809 8.633 8.756 0.986 [OK] 901 118 . MET O 16 O1H0u 0.660 1.420 2.584 16.090 16.002 1.006 [OK] 902 118 . MET CB 8 C4H2s 0.770 1.880 3.709 24.465 23.418 1.045 possible 903 118 . MET CG 9 C4H2b 0.770 1.880 2.755 19.189 23.830 0.805 [OK] 904 118 . MET SD 19 S2H0u 1.040 1.770 3.324 26.518 30.207 0.878 possible 905 118 . MET CE 10 C4H3u 0.770 1.880 3.368 41.688 37.003 1.127 possible 906 119 . ILE N 12 N3H1s 0.700 1.640 3.443 15.164 13.493 1.124 possible 907 119 . ILE CA 3 C4H1s 0.770 1.880 3.488 16.269 12.946 1.257 possible 908 119 . ILE C 1 C3H0s 0.770 1.610 2.587 7.778 8.445 0.921 [OK] 909 119 . ILE O 16 O1H0u 0.660 1.420 2.666 17.285 15.930 1.085 [OK] 910 119 . ILE CB 4 C4H1b 0.770 1.880 3.863 19.963 14.146 1.411 possible 911 119 . ILE CG1 9 C4H2b 0.770 1.880 3.826 25.080 24.071 1.042 possible 912 119 . ILE CG2 10 C4H3u 0.770 1.880 6.341 49.159 35.763 1.375 possible 913 119 . ILE CD1 10 C4H3u 0.770 1.880 25.719 -1.000 38.219 -1.000 bad 914 120 . GLY N 12 N3H1s 0.700 1.640 3.817 15.142 14.480 1.046 possible 915 120 . GLY CA 8 C4H2s 0.770 1.880 30.188 -1.000 23.470 -1.000 bad 916 120 . GLY C 2 C3H0b 0.770 1.610 3.414 10.711 9.652 1.110 possible 917 120 . GLY O 16 O1H0u 0.660 1.420 3.814 17.456 16.154 1.081 possible 918 121 . THR N 12 N3H1s 0.700 1.640 3.170 15.216 13.544 1.123 possible 919 121 . THR CA 3 C4H1s 0.770 1.880 2.815 13.909 13.025 1.068 [OK] 920 121 . THR C 1 C3H0s 0.770 1.610 3.403 9.350 8.685 1.077 possible 921 121 . THR O 16 O1H0u 0.660 1.420 4.080 22.936 15.795 1.452 possible 922 121 . THR CB 4 C4H1b 0.770 1.880 3.663 14.191 14.687 0.966 possible 923 121 . THR OG1 17 O2H1u 0.660 1.460 3.313 18.069 17.610 1.026 possible 924 121 . THR CG2 10 C4H3u 0.770 1.880 2.854 27.440 36.265 0.757 [OK] 925 122 . GLY N 12 N3H1s 0.700 1.640 3.419 14.256 14.480 0.984 possible 926 122 . GLY CA 8 C4H2s 0.770 1.880 3.522 27.717 23.470 1.181 possible 927 122 . GLY C 2 C3H0b 0.770 1.610 2.537 9.141 9.652 0.947 [OK] 928 122 . GLY O 16 O1H0u 0.660 1.420 2.603 21.102 16.154 1.306 [OK] 929 123 . LEU N 12 N3H1s 0.700 1.640 2.719 14.097 13.517 1.043 [OK] 930 123 . LEU CA 3 C4H1s 0.770 1.880 3.103 15.388 13.055 1.179 possible 931 123 . LEU C 1 C3H0s 0.770 1.610 3.477 9.045 8.781 1.030 possible 932 123 . LEU O 16 O1H0u 0.660 1.420 4.436 18.572 15.957 1.164 possible 933 123 . LEU CB 8 C4H2s 0.770 1.880 3.170 22.498 22.818 0.986 possible 934 123 . LEU CG 4 C4H1b 0.770 1.880 5.660 25.678 14.704 1.746 possible 935 123 . LEU CD1 10 C4H3u 0.770 1.880 4.299 37.170 37.235 0.998 possible 936 123 . LEU CD2 10 C4H3u 0.770 1.880 44.306 -1.000 37.020 -1.000 bad 937 124 . VAL N 12 N3H1s 0.700 1.640 3.703 14.285 13.553 1.054 possible 938 124 . VAL CA 3 C4H1s 0.770 1.880 5.464 23.313 13.078 1.783 possible 939 124 . VAL C 1 C3H0s 0.770 1.610 2.488 7.614 8.528 0.893 [OK] 940 124 . VAL O 16 O1H0u 0.660 1.420 11.120 -1.000 15.998 -1.000 bad 941 124 . VAL CB 4 C4H1b 0.770 1.880 2.777 12.163 14.514 0.838 [OK] 942 124 . VAL CG1 10 C4H3u 0.770 1.880 30.213 -1.000 36.320 -1.000 bad 943 124 . VAL CG2 10 C4H3u 0.770 1.880 44.237 -1.000 36.173 -1.000 bad 944 125 . GLY N 12 N3H1s 0.700 1.640 3.082 12.916 14.480 0.892 possible 945 125 . GLY CA 8 C4H2s 0.770 1.880 25.911 -1.000 23.470 -1.000 bad 946 125 . GLY C 2 C3H0b 0.770 1.610 4.556 13.545 9.652 1.403 possible 947 125 . GLY O 16 O1H0u 0.660 1.420 26.026 -1.000 16.154 -1.000 bad 948 126 . ALA N 12 N3H1s 0.700 1.640 4.193 18.473 13.872 1.332 possible 949 126 . ALA CA 4 C4H1b 0.770 1.880 7.305 26.156 13.959 1.874 possible 950 126 . ALA C 1 C3H0s 0.770 1.610 2.846 9.717 8.858 1.097 [OK] 951 126 . ALA O 16 O1H0u 0.660 1.420 22.781 -1.000 16.026 -1.000 bad 952 126 . ALA CB 10 C4H3u 0.770 1.880 20.865 -1.000 36.551 -1.000 bad 953 127 . LEU N 12 N3H1s 0.700 1.640 2.766 13.957 13.517 1.033 [OK] 954 127 . LEU CA 3 C4H1s 0.770 1.880 2.916 14.324 13.055 1.097 [OK] 955 127 . LEU C 1 C3H0s 0.770 1.610 4.476 10.757 8.781 1.225 possible 956 127 . LEU O 16 O1H0u 0.660 1.420 37.094 -1.000 15.957 -1.000 bad 957 127 . LEU CB 8 C4H2s 0.770 1.880 8.159 -1.000 22.818 -1.000 bad 958 127 . LEU CG 4 C4H1b 0.770 1.880 3.349 13.098 14.704 0.891 possible 959 127 . LEU CD1 10 C4H3u 0.770 1.880 17.750 -1.000 37.235 -1.000 bad 960 127 . LEU CD2 10 C4H3u 0.770 1.880 3.362 39.114 37.020 1.057 possible 961 128 . THR N 12 N3H1s 0.700 1.640 32.985 -1.000 13.544 -1.000 bad 1043 137 . TRP N 12 N3H1s 0.700 1.640 44.538 -1.000 13.639 -1.000 bad 1044 137 . TRP CA 3 C4H1s 0.770 1.880 6.491 22.612 13.323 1.697 possible 1045 137 . TRP C 1 C3H0s 0.770 1.610 2.807 8.809 8.687 1.014 [OK] 1046 137 . TRP O 16 O1H0u 0.660 1.420 3.946 17.691 15.797 1.120 possible 1047 137 . TRP CB 8 C4H2s 0.770 1.880 4.126 27.241 23.826 1.143 possible 1048 137 . TRP CG 2 C3H0b 0.770 1.610 4.110 10.899 9.915 1.099 possible 1049 137 . TRP CD1 5 C3H1s 0.770 1.760 14.856 -1.000 20.597 -1.000 bad 1050 137 . TRP CD2 2 C3H0b 0.770 1.610 5.865 15.195 10.068 1.509 possible 1051 137 . TRP NE1 13 N3H1b 0.700 1.640 23.520 -1.000 16.723 -1.000 bad 1052 137 . TRP CE2 2 C3H0b 0.770 1.610 2.515 -1.000 9.848 -1.000 bad 1053 137 . TRP CE3 6 C3H1b 0.770 1.760 5.419 20.721 20.383 1.017 possible 1054 137 . TRP CZ2 6 C3H1b 0.770 1.760 36.560 -1.000 20.931 -1.000 bad 1055 137 . TRP CZ3 6 C3H1b 0.770 1.760 5.512 27.078 21.429 1.264 possible 1056 137 . TRP CH2 6 C3H1b 0.770 1.760 32.976 -1.000 21.219 -1.000 bad 1057 138 . TRP N 12 N3H1s 0.700 1.640 4.469 22.943 13.639 1.682 possible 1058 138 . TRP CA 3 C4H1s 0.770 1.880 2.652 12.879 13.323 0.967 [OK] 1059 138 . TRP C 1 C3H0s 0.770 1.610 2.468 8.173 8.687 0.941 [OK] 1060 138 . TRP O 16 O1H0u 0.660 1.420 2.231 11.870 15.797 0.751 [OK] 1061 138 . TRP CB 8 C4H2s 0.770 1.880 5.872 50.868 23.826 2.135 possible 1062 138 . TRP CG 2 C3H0b 0.770 1.610 3.178 11.653 9.915 1.175 possible 1063 138 . TRP CD1 5 C3H1s 0.770 1.760 3.105 16.837 20.597 0.817 possible 1064 138 . TRP CD2 2 C3H0b 0.770 1.610 3.161 12.389 10.068 1.231 possible 1065 138 . TRP NE1 13 N3H1b 0.700 1.640 2.985 16.941 16.723 1.013 [OK] 1066 138 . TRP CE2 2 C3H0b 0.770 1.610 3.055 11.394 9.848 1.157 possible 1067 138 . TRP CE3 6 C3H1b 0.770 1.760 11.854 -1.000 20.383 -1.000 bad 1068 138 . TRP CZ2 6 C3H1b 0.770 1.760 5.022 27.725 20.931 1.325 possible 1069 138 . TRP CZ3 6 C3H1b 0.770 1.760 20.370 -1.000 21.429 -1.000 bad 1070 138 . TRP CH2 6 C3H1b 0.770 1.760 20.521 -1.000 21.219 -1.000 bad 1071 139 . ALA N 12 N3H1s 0.700 1.640 4.683 21.581 13.872 1.556 possible 1072 139 . ALA CA 4 C4H1b 0.770 1.880 6.205 25.191 13.959 1.805 possible 1073 139 . ALA C 1 C3H0s 0.770 1.610 4.695 9.442 8.858 1.066 possible 1074 139 . ALA O 16 O1H0u 0.660 1.420 8.188 -1.000 16.026 -1.000 bad 1075 139 . ALA CB 10 C4H3u 0.770 1.880 63.174 -1.000 36.551 -1.000 bad 1076 140 . ILE N 12 N3H1s 0.700 1.640 4.991 20.841 13.493 1.545 possible 1077 140 . ILE CA 3 C4H1s 0.770 1.880 7.212 22.696 12.946 1.753 possible 1078 140 . ILE C 1 C3H0s 0.770 1.610 2.605 8.322 8.445 0.985 [OK] 1079 140 . ILE O 16 O1H0u 0.660 1.420 2.971 14.713 15.930 0.924 [OK] 1080 140 . ILE CB 4 C4H1b 0.770 1.880 13.427 -1.000 14.146 -1.000 bad 1081 140 . ILE CG1 9 C4H2b 0.770 1.880 15.454 -1.000 24.071 -1.000 bad 1082 140 . ILE CG2 10 C4H3u 0.770 1.880 6.986 41.437 35.763 1.159 possible 1083 140 . ILE CD1 10 C4H3u 0.770 1.880 32.516 -1.000 38.219 -1.000 bad 1084 141 . SER N 12 N3H1s 0.700 1.640 2.656 12.299 13.808 0.891 [OK] 1085 141 . SER CA 3 C4H1s 0.770 1.880 3.023 16.922 13.351 1.267 possible 1086 141 . SER C 1 C3H0s 0.770 1.610 2.518 8.339 8.858 0.941 [OK] 1087 141 . SER O 16 O1H0u 0.660 1.420 2.452 15.125 15.860 0.954 [OK] 1088 141 . SER CB 8 C4H2s 0.770 1.880 2.756 18.792 23.599 0.796 [OK] 1089 141 . SER OG 17 O2H1u 0.660 1.460 2.365 17.732 18.021 0.984 [OK] 1090 142 . THR N 12 N3H1s 0.700 1.640 2.542 12.638 13.544 0.933 [OK] 1091 142 . THR CA 3 C4H1s 0.770 1.880 2.748 14.101 13.025 1.083 [OK] 1092 142 . THR C 1 C3H0s 0.770 1.610 4.695 9.828 8.685 1.132 possible 1093 142 . THR O 16 O1H0u 0.660 1.420 4.737 26.035 15.795 1.648 possible 1094 142 . THR CB 4 C4H1b 0.770 1.880 11.659 -1.000 14.687 -1.000 bad 1095 142 . THR OG1 17 O2H1u 0.660 1.460 5.100 23.009 17.610 1.307 possible 1096 142 . THR CG2 10 C4H3u 0.770 1.880 29.032 -1.000 36.265 -1.000 bad 1097 143 . ALA N 12 N3H1s 0.700 1.640 5.485 18.053 13.872 1.301 possible 1098 143 . ALA CA 4 C4H1b 0.770 1.880 12.463 -1.000 13.959 -1.000 bad 1099 143 . ALA C 1 C3H0s 0.770 1.610 4.344 9.683 8.858 1.093 possible 1100 143 . ALA O 16 O1H0u 0.660 1.420 6.988 44.015 16.026 2.746 possible 1101 143 . ALA CB 10 C4H3u 0.770 1.880 42.928 -1.000 36.551 -1.000 bad 1102 144 . ALA N 12 N3H1s 0.700 1.640 4.711 15.966 13.872 1.151 possible 1103 144 . ALA CA 4 C4H1b 0.770 1.880 5.318 24.991 13.959 1.790 possible 1104 144 . ALA C 1 C3H0s 0.770 1.610 2.400 8.582 8.858 0.969 [OK] 1105 144 . ALA O 16 O1H0u 0.660 1.420 3.208 15.996 16.026 0.998 possible 1106 144 . ALA CB 10 C4H3u 0.770 1.880 5.170 49.312 36.551 1.349 possible 1107 145 . MET N 12 N3H1s 0.700 1.640 2.415 12.573 13.405 0.938 [OK] 1108 145 . MET CA 3 C4H1s 0.770 1.880 2.852 12.602 13.194 0.955 [OK] 1109 145 . MET C 1 C3H0s 0.770 1.610 2.825 8.376 8.756 0.957 [OK] 1110 145 . MET O 16 O1H0u 0.660 1.420 2.685 16.766 16.002 1.048 [OK] 1111 145 . MET CB 8 C4H2s 0.770 1.880 3.452 23.239 23.418 0.992 possible 1112 145 . MET CG 9 C4H2b 0.770 1.880 3.523 29.495 23.830 1.238 possible 1113 145 . MET SD 19 S2H0u 1.040 1.770 5.341 57.362 30.207 1.899 possible 1114 145 . MET CE 10 C4H3u 0.770 1.880 3.034 38.377 37.003 1.037 possible 1115 146 . LEU N 12 N3H1s 0.700 1.640 3.690 15.447 13.517 1.143 possible 1116 146 . LEU CA 3 C4H1s 0.770 1.880 3.734 16.042 13.055 1.229 possible 1117 146 . LEU C 1 C3H0s 0.770 1.610 2.494 8.102 8.781 0.923 [OK] 1118 146 . LEU O 16 O1H0u 0.660 1.420 2.902 13.209 15.957 0.828 [OK] 1119 146 . LEU CB 8 C4H2s 0.770 1.880 4.150 27.857 22.818 1.221 possible 1120 146 . LEU CG 4 C4H1b 0.770 1.880 14.907 -1.000 14.704 -1.000 bad 1121 146 . LEU CD1 10 C4H3u 0.770 1.880 31.548 -1.000 37.235 -1.000 bad 1122 146 . LEU CD2 10 C4H3u 0.770 1.880 56.739 -1.000 37.020 -1.000 bad 1123 147 . TYR N 12 N3H1s 0.700 1.640 4.183 15.642 13.473 1.161 possible 1124 147 . TYR CA 3 C4H1s 0.770 1.880 4.913 16.507 13.249 1.246 possible 1125 147 . TYR C 1 C3H0s 0.770 1.610 3.350 8.653 8.714 0.993 possible 1126 147 . TYR O 16 O1H0u 0.660 1.420 3.090 13.691 15.901 0.861 possible 1127 147 . TYR CB 8 C4H2s 0.770 1.880 5.521 34.282 23.426 1.463 possible 1128 147 . TYR CG 2 C3H0b 0.770 1.610 7.429 23.028 9.695 2.375 possible 1129 147 . TYR CD1 5 C3H1s 0.770 1.760 23.757 -1.000 20.057 -1.000 bad 1130 147 . TYR CD2 5 C3H1s 0.770 1.760 7.275 25.660 20.578 1.247 possible 1131 147 . TYR CE1 5 C3H1s 0.770 1.760 22.465 -1.000 20.534 -1.000 bad 1132 147 . TYR CE2 5 C3H1s 0.770 1.760 7.214 32.282 20.577 1.569 possible 1133 147 . TYR CZ 2 C3H0b 0.770 1.610 3.335 -1.000 9.888 -1.000 bad 1134 147 . TYR OH 17 O2H1u 0.660 1.460 47.625 -1.000 18.541 -1.000 bad 1135 148 . ILE N 12 N3H1s 0.700 1.640 3.666 13.920 13.493 1.032 possible 1136 148 . ILE CA 3 C4H1s 0.770 1.880 4.103 21.286 12.946 1.644 possible 1137 148 . ILE C 1 C3H0s 0.770 1.610 2.791 8.372 8.445 0.991 [OK] 1138 148 . ILE O 16 O1H0u 0.660 1.420 2.962 15.724 15.930 0.987 [OK] 1139 148 . ILE CB 4 C4H1b 0.770 1.880 3.131 13.953 14.146 0.986 possible 1140 148 . ILE CG1 9 C4H2b 0.770 1.880 3.805 27.462 24.071 1.141 possible 1141 148 . ILE CG2 10 C4H3u 0.770 1.880 3.625 39.969 35.763 1.118 possible 1142 148 . ILE CD1 10 C4H3u 0.770 1.880 3.447 41.182 38.219 1.078 possible 1143 149 . LEU N 12 N3H1s 0.700 1.640 3.051 14.032 13.517 1.038 possible 1144 149 . LEU CA 3 C4H1s 0.770 1.880 3.141 14.279 13.055 1.094 possible 1145 149 . LEU C 1 C3H0s 0.770 1.610 3.374 9.510 8.781 1.083 possible 1146 149 . LEU O 16 O1H0u 0.660 1.420 2.972 21.568 15.957 1.352 [OK] 1147 149 . LEU CB 8 C4H2s 0.770 1.880 3.713 22.157 22.818 0.971 possible 1148 149 . LEU CG 4 C4H1b 0.770 1.880 3.768 20.272 14.704 1.379 possible 1149 149 . LEU CD1 10 C4H3u 0.770 1.880 3.533 46.558 37.235 1.250 possible 1150 149 . LEU CD2 10 C4H3u 0.770 1.880 6.328 94.202 37.020 2.545 possible 1151 150 . TYR N 12 N3H1s 0.700 1.640 3.807 14.204 13.473 1.054 possible 1152 150 . TYR CA 3 C4H1s 0.770 1.880 3.961 16.860 13.249 1.273 possible 1153 150 . TYR C 1 C3H0s 0.770 1.610 2.569 8.285 8.714 0.951 [OK] 1154 150 . TYR O 16 O1H0u 0.660 1.420 3.589 18.021 15.901 1.133 possible 1155 150 . TYR CB 8 C4H2s 0.770 1.880 5.148 31.326 23.426 1.337 possible 1156 150 . TYR CG 2 C3H0b 0.770 1.610 4.374 11.916 9.695 1.229 possible 1157 150 . TYR CD1 5 C3H1s 0.770 1.760 5.180 27.442 20.057 1.368 possible 1158 150 . TYR CD2 5 C3H1s 0.770 1.760 20.613 -1.000 20.578 -1.000 bad 1159 150 . TYR CE1 5 C3H1s 0.770 1.760 11.823 -1.000 20.534 -1.000 bad 1160 150 . TYR CE2 5 C3H1s 0.770 1.760 19.054 -1.000 20.577 -1.000 bad 1161 150 . TYR CZ 2 C3H0b 0.770 1.610 1.828 -1.000 9.888 -1.000 bad 1162 150 . TYR OH 17 O2H1u 0.660 1.460 34.400 -1.000 18.541 -1.000 bad 1163 151 . VAL N 12 N3H1s 0.700 1.640 2.650 12.060 13.553 0.890 [OK] 1164 151 . VAL CA 3 C4H1s 0.770 1.880 3.374 15.300 13.078 1.170 possible 1165 151 . VAL C 1 C3H0s 0.770 1.610 2.653 7.964 8.528 0.934 [OK] 1166 151 . VAL O 16 O1H0u 0.660 1.420 3.804 18.750 15.998 1.172 possible 1167 151 . VAL CB 4 C4H1b 0.770 1.880 3.799 14.918 14.514 1.028 possible 1168 151 . VAL CG1 10 C4H3u 0.770 1.880 5.630 72.138 36.320 1.986 possible 1169 151 . VAL CG2 10 C4H3u 0.770 1.880 6.097 69.303 36.173 1.916 possible 1170 152 . LEU N 12 N3H1s 0.700 1.640 2.893 13.013 13.517 0.963 [OK] 1171 152 . LEU CA 3 C4H1s 0.770 1.880 4.173 23.080 13.055 1.768 possible 1172 152 . LEU C 1 C3H0s 0.770 1.610 2.802 9.070 8.781 1.033 [OK] 1173 152 . LEU O 16 O1H0u 0.660 1.420 3.563 24.013 15.957 1.505 possible 1174 152 . LEU CB 8 C4H2s 0.770 1.880 3.490 22.565 22.818 0.989 possible 1175 152 . LEU CG 4 C4H1b 0.770 1.880 3.716 18.180 14.704 1.236 possible 1176 152 . LEU CD1 10 C4H3u 0.770 1.880 3.928 40.109 37.235 1.077 possible 1177 152 . LEU CD2 10 C4H3u 0.770 1.880 3.448 43.231 37.020 1.168 possible 1178 153 . PHE N 12 N3H1s 0.700 1.640 3.090 14.778 13.524 1.093 possible 1179 153 . PHE CA 3 C4H1s 0.770 1.880 3.288 15.681 13.371 1.173 possible 1180 153 . PHE C 1 C3H0s 0.770 1.610 4.355 9.562 8.697 1.099 possible 1181 153 . PHE O 16 O1H0u 0.660 1.420 4.933 26.919 15.961 1.687 possible 1182 153 . PHE CB 8 C4H2s 0.770 1.880 6.087 35.242 23.623 1.492 possible 1183 153 . PHE CG 2 C3H0b 0.770 1.610 5.924 18.733 9.684 1.934 possible 1184 153 . PHE CD1 5 C3H1s 0.770 1.760 6.173 27.377 20.325 1.347 possible 1185 153 . PHE CD2 6 C3H1b 0.770 1.760 17.406 -1.000 20.948 -1.000 bad 1186 153 . PHE CE1 6 C3H1b 0.770 1.760 6.080 43.623 21.532 2.026 possible 1187 153 . PHE CE2 6 C3H1b 0.770 1.760 36.818 -1.000 21.625 -1.000 bad 1188 153 . PHE CZ 6 C3H1b 0.770 1.760 33.797 -1.000 21.555 -1.000 bad 1189 154 . PHE N 12 N3H1s 0.700 1.640 4.213 15.745 13.524 1.164 possible 1190 154 . PHE CA 3 C4H1s 0.770 1.880 4.307 17.324 13.371 1.296 possible 1191 154 . PHE C 1 C3H0s 0.770 1.610 4.488 9.854 8.697 1.133 possible 1192 154 . PHE O 16 O1H0u 0.660 1.420 9.452 -1.000 15.961 -1.000 bad 1193 154 . PHE CB 8 C4H2s 0.770 1.880 6.249 35.605 23.623 1.507 possible 1194 154 . PHE CG 2 C3H0b 0.770 1.610 0.859 -1.000 9.684 -1.000 bad 1195 154 . PHE CD1 5 C3H1s 0.770 1.760 21.076 -1.000 20.325 -1.000 bad 1196 154 . PHE CD2 6 C3H1b 0.770 1.760 11.185 -1.000 20.948 -1.000 bad 1197 154 . PHE CE1 6 C3H1b 0.770 1.760 34.987 -1.000 21.532 -1.000 bad 1198 154 . PHE CE2 6 C3H1b 0.770 1.760 18.348 -1.000 21.625 -1.000 bad 1199 154 . PHE CZ 6 C3H1b 0.770 1.760 36.477 -1.000 21.555 -1.000 bad 1200 155 . GLY N 12 N3H1s 0.700 1.640 4.742 15.842 14.480 1.094 possible 1201 155 . GLY CA 8 C4H2s 0.770 1.880 31.327 -1.000 23.470 -1.000 bad 1202 155 . GLY C 2 C3H0b 0.770 1.610 4.046 13.458 9.652 1.394 possible 1203 155 . GLY O 16 O1H0u 0.660 1.420 26.484 -1.000 16.154 -1.000 bad 1204 156 . PHE N 12 N3H1s 0.700 1.640 4.098 22.105 13.524 1.635 possible 1205 156 . PHE CA 3 C4H1s 0.770 1.880 4.463 21.872 13.371 1.636 possible 1206 156 . PHE C 1 C3H0s 0.770 1.610 2.511 8.216 8.697 0.945 [OK] 1207 156 . PHE O 16 O1H0u 0.660 1.420 11.679 -1.000 15.961 -1.000 bad 1208 156 . PHE CB 8 C4H2s 0.770 1.880 4.184 37.844 23.623 1.602 possible 1209 156 . PHE CG 2 C3H0b 0.770 1.610 2.638 8.438 9.684 0.871 [OK] 1210 156 . PHE CD1 5 C3H1s 0.770 1.760 3.376 28.657 20.325 1.410 possible 1211 156 . PHE CD2 6 C3H1b 0.770 1.760 4.592 20.388 20.948 0.973 possible 1212 156 . PHE CE1 6 C3H1b 0.770 1.760 3.792 22.843 21.532 1.061 possible 1213 156 . PHE CE2 6 C3H1b 0.770 1.760 5.495 41.460 21.625 1.917 possible 1214 156 . PHE CZ 6 C3H1b 0.770 1.760 5.262 32.787 21.555 1.521 possible 1215 157 . THR N 12 N3H1s 0.700 1.640 2.980 16.383 13.544 1.210 [OK] 1216 157 . THR CA 3 C4H1s 0.770 1.880 4.354 21.023 13.025 1.614 possible 1217 157 . THR C 1 C3H0s 0.770 1.610 3.067 8.000 8.685 0.921 possible 1218 157 . THR O 16 O1H0u 0.660 1.420 37.046 -1.000 15.795 -1.000 bad 1219 157 . THR CB 4 C4H1b 0.770 1.880 4.131 20.049 14.687 1.365 possible 1220 157 . THR OG1 17 O2H1u 0.660 1.460 6.638 54.896 17.610 3.117 possible 1221 157 . THR CG2 10 C4H3u 0.770 1.880 64.178 -1.000 36.265 -1.000 bad 1222 158 . SER N 12 N3H1s 0.700 1.640 29.605 -1.000 13.808 -1.000 bad 1283 166 . GLU N 12 N3H1s 0.700 1.640 33.121 -1.000 13.461 -1.000 bad 1284 166 . GLU CA 3 C4H1s 0.770 1.880 6.763 22.746 13.284 1.712 possible 1285 166 . GLU C 1 C3H0s 0.770 1.610 3.718 10.202 8.631 1.182 possible 1286 166 . GLU O 16 O1H0u 0.660 1.420 3.076 16.403 15.765 1.040 possible 1287 166 . GLU CB 8 C4H2s 0.770 1.880 6.730 39.124 23.214 1.685 possible 1288 166 . GLU CG 8 C4H2s 0.770 1.880 26.354 -1.000 23.304 -1.000 bad 1289 166 . GLU CD 2 C3H0b 0.770 1.610 5.144 -1.000 9.437 -1.000 bad 1290 166 . GLU OE1 16 O1H0u 0.660 1.420 46.356 -1.000 15.497 -1.000 bad 1291 166 . GLU OE2 16 O1H0u 0.660 1.420 4.174 -1.000 16.213 -1.000 bad 1292 167 . VAL N 12 N3H1s 0.700 1.640 3.673 16.707 13.553 1.233 possible 1293 167 . VAL CA 3 C4H1s 0.770 1.880 3.722 16.884 13.078 1.291 possible 1294 167 . VAL C 1 C3H0s 0.770 1.610 2.502 8.665 8.528 1.016 [OK] 1295 167 . VAL O 16 O1H0u 0.660 1.420 2.548 14.870 15.998 0.929 [OK] 1296 167 . VAL CB 4 C4H1b 0.770 1.880 3.645 17.051 14.514 1.175 possible 1297 167 . VAL CG1 10 C4H3u 0.770 1.880 36.890 -1.000 36.320 -1.000 bad 1298 167 . VAL CG2 10 C4H3u 0.770 1.880 43.308 -1.000 36.173 -1.000 bad 1299 168 . ALA N 12 N3H1s 0.700 1.640 3.342 15.951 13.872 1.150 possible 1300 168 . ALA CA 4 C4H1b 0.770 1.880 3.991 14.704 13.959 1.053 possible 1301 168 . ALA C 1 C3H0s 0.770 1.610 3.164 9.218 8.858 1.041 possible 1302 168 . ALA O 16 O1H0u 0.660 1.420 2.610 14.091 16.026 0.879 [OK] 1303 168 . ALA CB 10 C4H3u 0.770 1.880 48.985 -1.000 36.551 -1.000 bad 1304 169 . SER N 12 N3H1s 0.700 1.640 5.755 23.678 13.808 1.715 possible 1305 169 . SER CA 3 C4H1s 0.770 1.880 6.024 29.404 13.351 2.202 possible 1306 169 . SER C 1 C3H0s 0.770 1.610 2.499 8.069 8.858 0.911 [OK] 1307 169 . SER O 16 O1H0u 0.660 1.420 4.312 17.729 15.860 1.118 possible 1308 169 . SER CB 8 C4H2s 0.770 1.880 20.346 -1.000 23.599 -1.000 bad 1309 169 . SER OG 17 O2H1u 0.660 1.460 26.957 -1.000 18.021 -1.000 bad 1310 170 . THR N 12 N3H1s 0.700 1.640 3.096 13.212 13.544 0.975 possible 1311 170 . THR CA 3 C4H1s 0.770 1.880 3.686 15.067 13.025 1.157 possible 1312 170 . THR C 1 C3H0s 0.770 1.610 2.296 7.904 8.685 0.910 [OK] 1313 170 . THR O 16 O1H0u 0.660 1.420 2.470 13.463 15.795 0.852 [OK] 1314 170 . THR CB 4 C4H1b 0.770 1.880 3.158 14.503 14.687 0.987 possible 1315 170 . THR OG1 17 O2H1u 0.660 1.460 3.937 40.869 17.610 2.321 possible 1316 170 . THR CG2 10 C4H3u 0.770 1.880 3.970 51.443 36.265 1.419 possible 1317 171 . PHE N 12 N3H1s 0.700 1.640 2.371 12.675 13.524 0.937 [OK] 1318 171 . PHE CA 3 C4H1s 0.770 1.880 2.715 12.727 13.371 0.952 [OK] 1319 171 . PHE C 1 C3H0s 0.770 1.610 2.192 8.147 8.697 0.937 [OK] 1320 171 . PHE O 16 O1H0u 0.660 1.420 3.112 18.254 15.961 1.144 possible 1321 171 . PHE CB 8 C4H2s 0.770 1.880 3.448 22.677 23.623 0.960 possible 1322 171 . PHE CG 2 C3H0b 0.770 1.610 3.681 11.599 9.684 1.198 possible 1323 171 . PHE CD1 5 C3H1s 0.770 1.760 3.407 21.032 20.325 1.035 possible 1324 171 . PHE CD2 6 C3H1b 0.770 1.760 3.985 21.890 20.948 1.045 possible 1325 171 . PHE CE1 6 C3H1b 0.770 1.760 3.496 24.982 21.532 1.160 possible 1326 171 . PHE CE2 6 C3H1b 0.770 1.760 6.479 55.569 21.625 2.570 possible 1327 171 . PHE CZ 6 C3H1b 0.770 1.760 3.778 19.792 21.555 0.918 possible 1328 172 . LYS N 12 N3H1s 0.700 1.640 2.149 11.577 13.429 0.862 [OK] 1329 172 . LYS CA 3 C4H1s 0.770 1.880 2.834 13.252 13.217 1.003 [OK] 1330 172 . LYS C 1 C3H0s 0.770 1.610 3.427 9.160 8.696 1.053 possible 1331 172 . LYS O 16 O1H0u 0.660 1.420 2.694 15.425 15.818 0.975 [OK] 1332 172 . LYS CB 8 C4H2s 0.770 1.880 6.638 35.621 22.578 1.578 possible 1333 172 . LYS CG 8 C4H2s 0.770 1.880 11.453 -1.000 22.847 -1.000 bad 1334 172 . LYS CD 8 C4H2s 0.770 1.880 19.231 -1.000 23.365 -1.000 bad 1335 172 . LYS CE 9 C4H2b 0.770 1.880 23.150 -1.000 23.720 -1.000 bad 1336 172 . LYS NZ 14 N4H3u 0.700 1.640 55.157 -1.000 21.413 -1.000 bad 1337 173 . VAL N 12 N3H1s 0.700 1.640 4.764 16.861 13.553 1.244 possible 1338 173 . VAL CA 3 C4H1s 0.770 1.880 5.354 16.551 13.078 1.266 possible 1339 173 . VAL C 1 C3H0s 0.770 1.610 2.736 8.392 8.528 0.984 [OK] 1340 173 . VAL O 16 O1H0u 0.660 1.420 2.254 11.909 15.998 0.744 [OK] 1341 173 . VAL CB 4 C4H1b 0.770 1.880 11.707 -1.000 14.514 -1.000 bad 1342 173 . VAL CG1 10 C4H3u 0.770 1.880 5.549 46.518 36.320 1.281 possible 1343 173 . VAL CG2 10 C4H3u 0.770 1.880 33.251 -1.000 36.173 -1.000 bad 1344 174 . LEU N 12 N3H1s 0.700 1.640 2.869 12.805 13.517 0.947 [OK] 1345 174 . LEU CA 3 C4H1s 0.770 1.880 3.421 16.371 13.055 1.254 possible 1346 174 . LEU C 1 C3H0s 0.770 1.610 2.599 8.045 8.781 0.916 [OK] 1347 174 . LEU O 16 O1H0u 0.660 1.420 2.623 13.423 15.957 0.841 [OK] 1348 174 . LEU CB 8 C4H2s 0.770 1.880 2.858 18.903 22.818 0.828 [OK] 1349 174 . LEU CG 4 C4H1b 0.770 1.880 3.425 16.445 14.704 1.118 possible 1350 174 . LEU CD1 10 C4H3u 0.770 1.880 3.909 47.582 37.235 1.278 possible 1351 174 . LEU CD2 10 C4H3u 0.770 1.880 3.149 29.657 37.020 0.801 possible 1352 175 . ARG N 12 N3H1s 0.700 1.640 2.963 14.981 13.486 1.111 [OK] 1353 175 . ARG CA 3 C4H1s 0.770 1.880 3.160 15.106 13.310 1.135 possible 1354 175 . ARG C 1 C3H0s 0.770 1.610 2.449 7.960 8.779 0.907 [OK] 1355 175 . ARG O 16 O1H0u 0.660 1.420 2.759 14.558 15.916 0.915 [OK] 1356 175 . ARG CB 8 C4H2s 0.770 1.880 3.716 35.263 22.833 1.544 possible 1357 175 . ARG CG 8 C4H2s 0.770 1.880 3.762 28.358 23.273 1.219 possible 1358 175 . ARG CD 8 C4H2s 0.770 1.880 3.742 26.107 22.849 1.143 possible 1359 175 . ARG NE 13 N3H1b 0.700 1.640 4.486 25.675 15.019 1.710 possible 1360 175 . ARG CZ 2 C3H0b 0.770 1.610 5.988 17.628 9.678 1.821 possible 1361 175 . ARG NH1 15 N3H2u 0.700 1.640 19.125 -1.000 22.056 -1.000 bad 1362 175 . ARG NH2 15 N3H2u 0.700 1.640 21.739 -1.000 23.132 -1.000 bad 1363 176 . ASN N 12 N3H1s 0.700 1.640 2.571 12.554 13.525 0.928 [OK] 1364 176 . ASN CA 3 C4H1s 0.770 1.880 4.053 17.482 13.052 1.339 possible 1365 176 . ASN C 1 C3H0s 0.770 1.610 3.353 9.344 8.853 1.056 possible 1366 176 . ASN O 16 O1H0u 0.660 1.420 3.767 17.563 15.857 1.108 possible 1367 176 . ASN CB 8 C4H2s 0.770 1.880 30.302 -1.000 22.756 -1.000 bad 1368 176 . ASN CG 2 C3H0b 0.770 1.610 2.168 -1.000 9.537 -1.000 bad 1369 176 . ASN OD1 16 O1H0u 0.660 1.420 10.890 -1.000 16.247 -1.000 bad 1370 176 . ASN ND2 15 N3H2u 0.700 1.640 23.796 -1.000 22.525 -1.000 bad 1371 177 . VAL N 12 N3H1s 0.700 1.640 3.315 12.037 13.553 0.888 possible 1372 177 . VAL CA 3 C4H1s 0.770 1.880 4.691 20.079 13.078 1.535 possible 1373 177 . VAL C 1 C3H0s 0.770 1.610 2.706 7.862 8.528 0.922 [OK] 1374 177 . VAL O 16 O1H0u 0.660 1.420 3.001 14.626 15.998 0.914 possible 1375 177 . VAL CB 4 C4H1b 0.770 1.880 3.191 12.945 14.514 0.892 possible 1376 177 . VAL CG1 10 C4H3u 0.770 1.880 4.880 72.601 36.320 1.999 possible 1377 177 . VAL CG2 10 C4H3u 0.770 1.880 25.840 -1.000 36.173 -1.000 bad 1378 178 . THR N 12 N3H1s 0.700 1.640 2.879 12.846 13.544 0.948 [OK] 1379 178 . THR CA 3 C4H1s 0.770 1.880 3.770 18.764 13.025 1.441 possible 1380 178 . THR C 1 C3H0s 0.770 1.610 2.520 8.505 8.685 0.979 [OK] 1381 178 . THR O 16 O1H0u 0.660 1.420 2.945 18.119 15.795 1.147 [OK] 1382 178 . THR CB 4 C4H1b 0.770 1.880 2.907 15.374 14.687 1.047 [OK] 1383 178 . THR OG1 17 O2H1u 0.660 1.460 3.023 23.254 17.610 1.321 possible 1384 178 . THR CG2 10 C4H3u 0.770 1.880 3.830 62.073 36.265 1.712 possible 1385 179 . VAL N 12 N3H1s 0.700 1.640 2.636 12.945 13.553 0.955 [OK] 1386 179 . VAL CA 3 C4H1s 0.770 1.880 3.019 13.064 13.078 0.999 possible 1387 179 . VAL C 1 C3H0s 0.770 1.610 2.897 8.167 8.528 0.958 [OK] 1388 179 . VAL O 16 O1H0u 0.660 1.420 3.598 26.251 15.998 1.641 possible 1389 179 . VAL CB 4 C4H1b 0.770 1.880 3.711 14.741 14.514 1.016 possible 1390 179 . VAL CG1 10 C4H3u 0.770 1.880 36.193 -1.000 36.320 -1.000 bad 1391 179 . VAL CG2 10 C4H3u 0.770 1.880 4.269 42.939 36.173 1.187 possible 1392 180 . VAL N 12 N3H1s 0.700 1.640 2.947 12.495 13.553 0.922 [OK] 1393 180 . VAL CA 3 C4H1s 0.770 1.880 4.244 18.391 13.078 1.406 possible 1394 180 . VAL C 1 C3H0s 0.770 1.610 3.119 8.819 8.528 1.034 possible 1395 180 . VAL O 16 O1H0u 0.660 1.420 4.920 31.947 15.998 1.997 possible 1396 180 . VAL CB 4 C4H1b 0.770 1.880 4.745 18.969 14.514 1.307 possible 1397 180 . VAL CG1 10 C4H3u 0.770 1.880 57.377 -1.000 36.320 -1.000 bad 1398 180 . VAL CG2 10 C4H3u 0.770 1.880 37.340 -1.000 36.173 -1.000 bad 1399 181 . LEU N 12 N3H1s 0.700 1.640 3.086 13.212 13.517 0.977 possible 1400 181 . LEU CA 3 C4H1s 0.770 1.880 4.070 14.962 13.055 1.146 possible 1401 181 . LEU C 1 C3H0s 0.770 1.610 3.126 9.523 8.781 1.085 possible 1402 181 . LEU O 16 O1H0u 0.660 1.420 2.936 17.548 15.957 1.100 [OK] 1403 181 . LEU CB 8 C4H2s 0.770 1.880 3.826 28.028 22.818 1.228 possible 1404 181 . LEU CG 4 C4H1b 0.770 1.880 3.682 18.647 14.704 1.268 possible 1405 181 . LEU CD1 10 C4H3u 0.770 1.880 4.182 35.540 37.235 0.954 possible 1406 181 . LEU CD2 10 C4H3u 0.770 1.880 7.632 92.406 37.020 2.496 possible 1407 182 . TRP N 12 N3H1s 0.700 1.640 2.789 14.122 13.639 1.035 [OK] 1408 182 . TRP CA 3 C4H1s 0.770 1.880 2.642 11.922 13.323 0.895 [OK] 1409 182 . TRP C 1 C3H0s 0.770 1.610 2.669 8.762 8.687 1.009 [OK] 1410 182 . TRP O 16 O1H0u 0.660 1.420 2.538 14.227 15.797 0.901 [OK] 1411 182 . TRP CB 8 C4H2s 0.770 1.880 3.531 29.878 23.826 1.254 possible 1412 182 . TRP CG 2 C3H0b 0.770 1.610 2.694 11.225 9.915 1.132 [OK] 1413 182 . TRP CD1 5 C3H1s 0.770 1.760 3.553 24.338 20.597 1.182 possible 1414 182 . TRP CD2 2 C3H0b 0.770 1.610 2.716 10.216 10.068 1.015 [OK] 1415 182 . TRP NE1 13 N3H1b 0.700 1.640 3.538 22.215 16.723 1.328 possible 1416 182 . TRP CE2 2 C3H0b 0.770 1.610 2.934 9.750 9.848 0.990 [OK] 1417 182 . TRP CE3 6 C3H1b 0.770 1.760 3.127 24.719 20.383 1.213 possible 1418 182 . TRP CZ2 6 C3H1b 0.770 1.760 3.431 26.995 20.931 1.290 possible 1419 182 . TRP CZ3 6 C3H1b 0.770 1.760 3.320 26.162 21.429 1.221 possible 1420 182 . TRP CH2 6 C3H1b 0.770 1.760 3.329 26.927 21.219 1.269 possible 1421 183 . SER N 12 N3H1s 0.700 1.640 3.399 15.974 13.808 1.157 possible 1422 183 . SER CA 3 C4H1s 0.770 1.880 3.954 18.190 13.351 1.362 possible 1423 183 . SER C 1 C3H0s 0.770 1.610 3.175 8.671 8.858 0.979 possible 1424 183 . SER O 16 O1H0u 0.660 1.420 2.803 13.402 15.860 0.845 [OK] 1425 183 . SER CB 8 C4H2s 0.770 1.880 5.356 44.080 23.599 1.868 possible 1426 183 . SER OG 17 O2H1u 0.660 1.460 26.327 -1.000 18.021 -1.000 bad 1427 184 . ALA N 12 N3H1s 0.700 1.640 5.183 20.939 13.872 1.509 possible 1428 184 . ALA CA 4 C4H1b 0.770 1.880 4.731 16.327 13.959 1.170 possible 1429 184 . ALA C 1 C3H0s 0.770 1.610 2.584 8.749 8.858 0.988 [OK] 1430 184 . ALA O 16 O1H0u 0.660 1.420 2.290 11.888 16.026 0.742 [OK] 1431 184 . ALA CB 10 C4H3u 0.770 1.880 6.982 82.047 36.551 2.245 possible 1432 185 . TYR N 12 N3H1s 0.700 1.640 2.703 13.382 13.473 0.993 [OK] 1433 185 . TYR CA 3 C4H1s 0.770 1.880 2.609 12.121 13.249 0.915 [OK] 1434 185 . TYR C 1 C3H0s 0.770 1.610 2.203 7.907 8.714 0.907 [OK] 1435 185 . TYR O 16 O1H0u 0.660 1.420 2.317 14.426 15.901 0.907 [OK] 1436 185 . TYR CB 8 C4H2s 0.770 1.880 2.944 19.905 23.426 0.850 [OK] 1437 185 . TYR CG 2 C3H0b 0.770 1.610 2.636 9.977 9.695 1.029 [OK] 1438 185 . TYR CD1 5 C3H1s 0.770 1.760 2.871 18.111 20.057 0.903 [OK] 1439 185 . TYR CD2 5 C3H1s 0.770 1.760 2.561 16.708 20.578 0.812 [OK] 1440 185 . TYR CE1 5 C3H1s 0.770 1.760 3.361 19.682 20.534 0.959 possible 1441 185 . TYR CE2 5 C3H1s 0.770 1.760 3.084 19.305 20.577 0.938 possible 1442 185 . TYR CZ 2 C3H0b 0.770 1.610 2.574 10.002 9.888 1.012 [OK] 1443 185 . TYR OH 17 O2H1u 0.660 1.460 3.023 25.049 18.541 1.351 possible 1444 186 . PRO N 11 N3H0u 0.700 1.640 2.450 8.332 8.650 0.963 [OK] 1445 186 . PRO CA 4 C4H1b 0.770 1.880 3.053 15.770 13.828 1.140 possible 1446 186 . PRO C 1 C3H0s 0.770 1.610 3.782 9.635 8.768 1.099 possible 1447 186 . PRO O 16 O1H0u 0.660 1.420 3.544 20.688 15.856 1.305 possible 1448 186 . PRO CB 9 C4H2b 0.770 1.880 4.833 29.253 25.314 1.156 possible 1449 186 . PRO CG 9 C4H2b 0.770 1.880 4.996 41.183 25.480 1.616 possible 1450 186 . PRO CD 8 C4H2s 0.770 1.880 2.815 19.452 23.390 0.832 [OK] 1451 187 . VAL N 12 N3H1s 0.700 1.640 3.876 14.290 13.553 1.054 possible 1452 187 . VAL CA 3 C4H1s 0.770 1.880 4.701 21.711 13.078 1.660 possible 1453 187 . VAL C 1 C3H0s 0.770 1.610 2.054 7.665 8.528 0.899 [OK] 1454 187 . VAL O 16 O1H0u 0.660 1.420 5.080 22.387 15.998 1.399 possible 1455 187 . VAL CB 4 C4H1b 0.770 1.880 2.990 11.871 14.514 0.818 [OK] 1456 187 . VAL CG1 10 C4H3u 0.770 1.880 28.786 -1.000 36.320 -1.000 bad 1457 187 . VAL CG2 10 C4H3u 0.770 1.880 37.211 -1.000 36.173 -1.000 bad 1458 188 . VAL N 12 N3H1s 0.700 1.640 2.307 11.086 13.553 0.818 [OK] 1459 188 . VAL CA 3 C4H1s 0.770 1.880 2.953 12.309 13.078 0.941 [OK] 1460 188 . VAL C 1 C3H0s 0.770 1.610 2.531 7.845 8.528 0.920 [OK] 1461 188 . VAL O 16 O1H0u 0.660 1.420 3.220 18.291 15.998 1.143 possible 1462 188 . VAL CB 4 C4H1b 0.770 1.880 2.646 12.103 14.514 0.834 [OK] 1463 188 . VAL CG1 10 C4H3u 0.770 1.880 3.637 43.988 36.320 1.211 possible 1464 188 . VAL CG2 10 C4H3u 0.770 1.880 4.050 37.281 36.173 1.031 possible 1465 189 . TRP N 12 N3H1s 0.700 1.640 2.724 13.273 13.639 0.973 [OK] 1466 189 . TRP CA 3 C4H1s 0.770 1.880 3.821 19.877 13.323 1.492 possible 1467 189 . TRP C 1 C3H0s 0.770 1.610 2.204 7.638 8.687 0.879 [OK] 1468 189 . TRP O 16 O1H0u 0.660 1.420 6.034 44.153 15.797 2.795 possible 1469 189 . TRP CB 8 C4H2s 0.770 1.880 3.512 23.909 23.826 1.003 possible 1470 189 . TRP CG 2 C3H0b 0.770 1.610 3.556 9.696 9.915 0.978 possible 1471 189 . TRP CD1 5 C3H1s 0.770 1.760 3.698 25.958 20.597 1.260 possible 1472 189 . TRP CD2 2 C3H0b 0.770 1.610 3.826 13.361 10.068 1.327 possible 1473 189 . TRP NE1 13 N3H1b 0.700 1.640 3.765 23.400 16.723 1.399 possible 1474 189 . TRP CE2 2 C3H0b 0.770 1.610 3.771 13.732 9.848 1.394 possible 1475 189 . TRP CE3 6 C3H1b 0.770 1.760 3.977 29.805 20.383 1.462 possible 1476 189 . TRP CZ2 6 C3H1b 0.770 1.760 3.839 24.113 20.931 1.152 possible 1477 189 . TRP CZ3 6 C3H1b 0.770 1.760 32.631 -1.000 21.429 -1.000 bad 1478 189 . TRP CH2 6 C3H1b 0.770 1.760 5.127 51.094 21.219 2.408 possible 1479 190 . LEU N 12 N3H1s 0.700 1.640 3.033 14.138 13.517 1.046 possible 1480 190 . LEU CA 3 C4H1s 0.770 1.880 4.226 17.303 13.055 1.325 possible 1481 190 . LEU C 1 C3H0s 0.770 1.610 4.049 9.819 8.781 1.118 possible 1482 190 . LEU O 16 O1H0u 0.660 1.420 22.264 -1.000 15.957 -1.000 bad 1483 190 . LEU CB 8 C4H2s 0.770 1.880 4.044 27.238 22.818 1.194 possible 1484 190 . LEU CG 4 C4H1b 0.770 1.880 10.162 -1.000 14.704 -1.000 bad 1485 190 . LEU CD1 10 C4H3u 0.770 1.880 26.035 -1.000 37.235 -1.000 bad 1486 190 . LEU CD2 10 C4H3u 0.770 1.880 56.629 -1.000 37.020 -1.000 bad 1487 191 . ILE N 12 N3H1s 0.700 1.640 4.226 15.190 13.493 1.126 possible 1488 191 . ILE CA 3 C4H1s 0.770 1.880 7.244 26.402 12.946 2.039 possible 1489 191 . ILE C 1 C3H0s 0.770 1.610 2.710 7.727 8.445 0.915 [OK] 1490 191 . ILE O 16 O1H0u 0.660 1.420 35.392 -1.000 15.930 -1.000 bad 1491 191 . ILE CB 4 C4H1b 0.770 1.880 2.608 11.673 14.146 0.825 [OK] 1492 191 . ILE CG1 9 C4H2b 0.770 1.880 22.149 -1.000 24.071 -1.000 bad 1493 191 . ILE CG2 10 C4H3u 0.770 1.880 21.418 -1.000 35.763 -1.000 bad 1494 191 . ILE CD1 10 C4H3u 0.770 1.880 24.755 -1.000 38.219 -1.000 bad 1495 192 . GLY N 12 N3H1s 0.700 1.640 29.488 -1.000 14.480 -1.000 bad 1557 202 . ASN N 12 N3H1s 0.700 1.640 21.337 -1.000 13.525 -1.000 bad 1558 202 . ASN CA 3 C4H1s 0.770 1.880 3.233 18.917 13.052 1.449 possible 1559 202 . ASN C 1 C3H0s 0.770 1.610 3.008 10.592 8.853 1.196 possible 1560 202 . ASN O 16 O1H0u 0.660 1.420 2.767 21.331 15.857 1.345 [OK] 1561 202 . ASN CB 8 C4H2s 0.770 1.880 5.994 59.364 22.756 2.609 possible 1562 202 . ASN CG 2 C3H0b 0.770 1.610 7.796 18.815 9.537 1.973 possible 1563 202 . ASN OD1 16 O1H0u 0.660 1.420 41.228 -1.000 16.247 -1.000 bad 1564 202 . ASN ND2 15 N3H2u 0.700 1.640 26.675 -1.000 22.525 -1.000 bad 1565 203 . ILE N 12 N3H1s 0.700 1.640 3.614 15.936 13.493 1.181 possible 1566 203 . ILE CA 3 C4H1s 0.770 1.880 3.043 12.902 12.946 0.997 possible 1567 203 . ILE C 1 C3H0s 0.770 1.610 2.869 8.870 8.445 1.050 [OK] 1568 203 . ILE O 16 O1H0u 0.660 1.420 2.552 14.131 15.930 0.887 [OK] 1569 203 . ILE CB 4 C4H1b 0.770 1.880 3.834 16.749 14.146 1.184 possible 1570 203 . ILE CG1 9 C4H2b 0.770 1.880 3.901 26.401 24.071 1.097 possible 1571 203 . ILE CG2 10 C4H3u 0.770 1.880 34.441 -1.000 35.763 -1.000 bad 1572 203 . ILE CD1 10 C4H3u 0.770 1.880 50.480 -1.000 38.219 -1.000 bad 1573 204 . GLU N 12 N3H1s 0.700 1.640 4.276 21.645 13.461 1.608 possible 1574 204 . GLU CA 3 C4H1s 0.770 1.880 3.689 16.978 13.284 1.278 possible 1575 204 . GLU C 1 C3H0s 0.770 1.610 2.146 7.763 8.631 0.899 [OK] 1576 204 . GLU O 16 O1H0u 0.660 1.420 2.434 17.921 15.765 1.137 [OK] 1577 204 . GLU CB 8 C4H2s 0.770 1.880 7.389 56.884 23.214 2.450 possible 1578 204 . GLU CG 8 C4H2s 0.770 1.880 3.777 32.174 23.304 1.381 possible 1579 204 . GLU CD 2 C3H0b 0.770 1.610 5.013 12.459 9.437 1.320 possible 1580 204 . GLU OE1 16 O1H0u 0.660 1.420 6.140 56.270 15.497 3.631 possible 1581 204 . GLU OE2 16 O1H0u 0.660 1.420 4.640 31.494 16.213 1.942 possible 1582 205 . THR N 12 N3H1s 0.700 1.640 3.145 16.086 13.544 1.188 possible 1583 205 . THR CA 3 C4H1s 0.770 1.880 3.425 15.585 13.025 1.197 possible 1584 205 . THR C 1 C3H0s 0.770 1.610 2.259 8.209 8.685 0.945 [OK] 1585 205 . THR O 16 O1H0u 0.660 1.420 3.244 18.877 15.795 1.195 possible 1586 205 . THR CB 4 C4H1b 0.770 1.880 3.264 16.832 14.687 1.146 possible 1587 205 . THR OG1 17 O2H1u 0.660 1.460 2.844 20.503 17.610 1.164 [OK] 1588 205 . THR CG2 10 C4H3u 0.770 1.880 3.344 32.978 36.265 0.909 possible 1589 206 . LEU N 12 N3H1s 0.700 1.640 2.811 14.098 13.517 1.043 [OK] 1590 206 . LEU CA 3 C4H1s 0.770 1.880 2.751 12.669 13.055 0.970 [OK] 1591 206 . LEU C 1 C3H0s 0.770 1.610 2.212 7.996 8.781 0.911 [OK] 1592 206 . LEU O 16 O1H0u 0.660 1.420 2.738 14.957 15.957 0.937 [OK] 1593 206 . LEU CB 8 C4H2s 0.770 1.880 2.714 17.397 22.818 0.762 [OK] 1594 206 . LEU CG 4 C4H1b 0.770 1.880 4.221 15.161 14.704 1.031 possible 1595 206 . LEU CD1 10 C4H3u 0.770 1.880 27.257 -1.000 37.235 -1.000 bad 1596 206 . LEU CD2 10 C4H3u 0.770 1.880 19.706 -1.000 37.020 -1.000 bad 1597 207 . LEU N 12 N3H1s 0.700 1.640 2.316 11.232 13.517 0.831 [OK] 1598 207 . LEU CA 3 C4H1s 0.770 1.880 2.971 13.704 13.055 1.050 [OK] 1599 207 . LEU C 1 C3H0s 0.770 1.610 2.814 9.339 8.781 1.064 [OK] 1600 207 . LEU O 16 O1H0u 0.660 1.420 3.452 19.286 15.957 1.209 possible 1601 207 . LEU CB 8 C4H2s 0.770 1.880 3.057 21.452 22.818 0.940 possible 1602 207 . LEU CG 4 C4H1b 0.770 1.880 3.885 19.060 14.704 1.296 possible 1603 207 . LEU CD1 10 C4H3u 0.770 1.880 41.592 -1.000 37.235 -1.000 bad 1604 207 . LEU CD2 10 C4H3u 0.770 1.880 4.997 46.163 37.020 1.247 possible 1605 208 . PHE N 12 N3H1s 0.700 1.640 2.735 13.887 13.524 1.027 [OK] 1606 208 . PHE CA 3 C4H1s 0.770 1.880 2.974 13.276 13.371 0.993 [OK] 1607 208 . PHE C 1 C3H0s 0.770 1.610 3.054 9.033 8.697 1.039 possible 1608 208 . PHE O 16 O1H0u 0.660 1.420 2.615 15.188 15.961 0.952 [OK] 1609 208 . PHE CB 8 C4H2s 0.770 1.880 4.126 34.210 23.623 1.448 possible 1610 208 . PHE CG 2 C3H0b 0.770 1.610 2.910 11.008 9.684 1.137 [OK] 1611 208 . PHE CD1 5 C3H1s 0.770 1.760 3.474 20.332 20.325 1.000 possible 1612 208 . PHE CD2 6 C3H1b 0.770 1.760 2.951 20.494 20.948 0.978 [OK] 1613 208 . PHE CE1 6 C3H1b 0.770 1.760 3.946 31.624 21.532 1.469 possible 1614 208 . PHE CE2 6 C3H1b 0.770 1.760 2.671 17.774 21.625 0.822 [OK] 1615 208 . PHE CZ 6 C3H1b 0.770 1.760 3.486 25.635 21.555 1.189 possible 1616 209 . MET N 12 N3H1s 0.700 1.640 3.817 16.028 13.405 1.196 possible 1617 209 . MET CA 3 C4H1s 0.770 1.880 3.756 16.412 13.194 1.244 possible 1618 209 . MET C 1 C3H0s 0.770 1.610 2.057 7.286 8.756 0.832 [OK] 1619 209 . MET O 16 O1H0u 0.660 1.420 2.655 16.400 16.002 1.025 [OK] 1620 209 . MET CB 8 C4H2s 0.770 1.880 3.341 28.481 23.418 1.216 possible 1621 209 . MET CG 9 C4H2b 0.770 1.880 3.698 27.585 23.830 1.158 possible 1622 209 . MET SD 19 S2H0u 1.040 1.770 3.151 32.021 30.207 1.060 possible 1623 209 . MET CE 10 C4H3u 0.770 1.880 15.907 -1.000 37.003 -1.000 bad 1624 210 . VAL N 12 N3H1s 0.700 1.640 2.363 11.739 13.553 0.866 [OK] 1625 210 . VAL CA 3 C4H1s 0.770 1.880 3.746 16.054 13.078 1.228 possible 1626 210 . VAL C 1 C3H0s 0.770 1.610 2.495 7.730 8.528 0.906 [OK] 1627 210 . VAL O 16 O1H0u 0.660 1.420 3.354 14.455 15.998 0.904 possible 1628 210 . VAL CB 4 C4H1b 0.770 1.880 3.388 13.357 14.514 0.920 possible 1629 210 . VAL CG1 10 C4H3u 0.770 1.880 48.106 -1.000 36.320 -1.000 bad 1630 210 . VAL CG2 10 C4H3u 0.770 1.880 22.934 -1.000 36.173 -1.000 bad 1631 211 . LEU N 12 N3H1s 0.700 1.640 3.027 13.253 13.517 0.980 possible 1632 211 . LEU CA 3 C4H1s 0.770 1.880 3.484 14.700 13.055 1.126 possible 1633 211 . LEU C 1 C3H0s 0.770 1.610 2.865 9.250 8.781 1.053 [OK] 1634 211 . LEU O 16 O1H0u 0.660 1.420 2.870 12.979 15.957 0.813 [OK] 1635 211 . LEU CB 8 C4H2s 0.770 1.880 3.055 19.219 22.818 0.842 possible 1636 211 . LEU CG 4 C4H1b 0.770 1.880 3.453 17.984 14.704 1.223 possible 1637 211 . LEU CD1 10 C4H3u 0.770 1.880 6.212 65.205 37.235 1.751 possible 1638 211 . LEU CD2 10 C4H3u 0.770 1.880 3.419 34.622 37.020 0.935 possible 1639 212 . ASP N 12 N3H1s 0.700 1.640 2.784 14.439 13.654 1.057 [OK] 1640 212 . ASP CA 3 C4H1s 0.770 1.880 3.139 15.443 13.254 1.165 possible 1641 212 . ASP C 1 C3H0s 0.770 1.610 2.415 8.323 8.750 0.951 [OK] 1642 212 . ASP O 16 O1H0u 0.660 1.420 2.353 12.458 15.757 0.791 [OK] 1643 212 . ASP CB 8 C4H2s 0.770 1.880 3.007 21.997 23.022 0.955 possible 1644 212 . ASP CG 2 C3H0b 0.770 1.610 2.879 9.795 9.336 1.049 [OK] 1645 212 . ASP OD1 16 O1H0u 0.660 1.420 3.439 27.042 15.078 1.793 possible 1646 212 . ASP OD2 16 O1H0u 0.660 1.420 2.831 17.622 15.582 1.131 [OK] 1647 213 . VAL N 12 N3H1s 0.700 1.640 2.872 15.456 13.553 1.140 [OK] 1648 213 . VAL CA 3 C4H1s 0.770 1.880 2.628 12.737 13.078 0.974 [OK] 1649 213 . VAL C 1 C3H0s 0.770 1.610 3.023 8.604 8.528 1.009 possible 1650 213 . VAL O 16 O1H0u 0.660 1.420 2.745 14.770 15.998 0.923 [OK] 1651 213 . VAL CB 4 C4H1b 0.770 1.880 3.321 17.424 14.514 1.200 possible 1652 213 . VAL CG1 10 C4H3u 0.770 1.880 14.743 -1.000 36.320 -1.000 bad 1653 213 . VAL CG2 10 C4H3u 0.770 1.880 3.880 41.232 36.173 1.140 possible 1654 214 . SER N 12 N3H1s 0.700 1.640 3.227 12.100 13.808 0.876 possible 1655 214 . SER CA 3 C4H1s 0.770 1.880 9.844 -1.000 13.351 -1.000 bad 1656 214 . SER C 1 C3H0s 0.770 1.610 2.746 8.132 8.858 0.918 [OK] 1657 214 . SER O 16 O1H0u 0.660 1.420 4.809 32.725 15.860 2.063 possible 1658 214 . SER CB 8 C4H2s 0.770 1.880 10.888 -1.000 23.599 -1.000 bad 1659 214 . SER OG 17 O2H1u 0.660 1.460 25.993 -1.000 18.021 -1.000 bad 1660 215 . ALA N 12 N3H1s 0.700 1.640 2.711 11.124 13.872 0.802 [OK] 1661 215 . ALA CA 4 C4H1b 0.770 1.880 3.597 16.940 13.959 1.214 possible 1662 215 . ALA C 1 C3H0s 0.770 1.610 2.592 8.865 8.858 1.001 [OK] 1663 215 . ALA O 16 O1H0u 0.660 1.420 3.066 19.085 16.026 1.191 possible 1664 215 . ALA CB 10 C4H3u 0.770 1.880 3.842 51.856 36.551 1.419 possible 1665 216 . LYS N 12 N3H1s 0.700 1.640 2.663 12.552 13.429 0.935 [OK] 1666 216 . LYS CA 3 C4H1s 0.770 1.880 3.450 15.639 13.217 1.183 possible 1667 216 . LYS C 1 C3H0s 0.770 1.610 2.928 8.691 8.696 0.999 [OK] 1668 216 . LYS O 16 O1H0u 0.660 1.420 3.181 21.645 15.818 1.368 possible 1669 216 . LYS CB 8 C4H2s 0.770 1.880 3.382 26.839 22.578 1.189 possible 1670 216 . LYS CG 8 C4H2s 0.770 1.880 2.983 23.641 22.847 1.035 [OK] 1671 216 . LYS CD 8 C4H2s 0.770 1.880 2.957 21.303 23.365 0.912 [OK] 1672 216 . LYS CE 9 C4H2b 0.770 1.880 3.019 22.041 23.720 0.929 possible 1673 216 . LYS NZ 14 N4H3u 0.700 1.640 2.914 20.286 21.413 0.947 [OK] 1674 217 . VAL N 12 N3H1s 0.700 1.640 3.125 13.779 13.553 1.017 possible 1675 217 . VAL CA 3 C4H1s 0.770 1.880 3.800 17.211 13.078 1.316 possible 1676 217 . VAL C 1 C3H0s 0.770 1.610 2.859 8.732 8.528 1.024 [OK] 1677 217 . VAL O 16 O1H0u 0.660 1.420 3.268 22.587 15.998 1.412 possible 1678 217 . VAL CB 4 C4H1b 0.770 1.880 3.033 13.993 14.514 0.964 possible 1679 217 . VAL CG1 10 C4H3u 0.770 1.880 26.425 -1.000 36.320 -1.000 bad 1680 217 . VAL CG2 10 C4H3u 0.770 1.880 4.488 67.800 36.173 1.874 possible 1681 218 . GLY N 12 N3H1s 0.700 1.640 3.495 15.975 14.480 1.103 possible 1682 218 . GLY CA 8 C4H2s 0.770 1.880 24.861 -1.000 23.470 -1.000 bad 1683 218 . GLY C 2 C3H0b 0.770 1.610 4.630 13.811 9.652 1.431 possible 1684 218 . GLY O 16 O1H0u 0.660 1.420 7.214 35.583 16.154 2.203 possible 1685 219 . PHE N 12 N3H1s 0.700 1.640 3.625 17.162 13.524 1.269 possible 1686 219 . PHE CA 3 C4H1s 0.770 1.880 3.677 18.607 13.371 1.392 possible 1687 219 . PHE C 1 C3H0s 0.770 1.610 3.518 8.888 8.697 1.022 possible 1688 219 . PHE O 16 O1H0u 0.660 1.420 3.509 19.224 15.961 1.204 possible 1689 219 . PHE CB 8 C4H2s 0.770 1.880 3.824 20.045 23.623 0.849 possible 1690 219 . PHE CG 2 C3H0b 0.770 1.610 3.856 15.217 9.684 1.571 possible 1691 219 . PHE CD1 5 C3H1s 0.770 1.760 4.018 33.188 20.325 1.633 possible 1692 219 . PHE CD2 6 C3H1b 0.770 1.760 3.774 26.743 20.948 1.277 possible 1693 219 . PHE CE1 6 C3H1b 0.770 1.760 3.727 27.694 21.532 1.286 possible 1694 219 . PHE CE2 6 C3H1b 0.770 1.760 3.719 27.740 21.625 1.283 possible 1695 219 . PHE CZ 6 C3H1b 0.770 1.760 3.743 29.962 21.555 1.390 possible 1696 220 . GLY N 12 N3H1s 0.700 1.640 3.585 15.437 14.480 1.066 possible 1697 220 . GLY CA 8 C4H2s 0.770 1.880 3.705 32.957 23.470 1.404 possible 1698 220 . GLY C 2 C3H0b 0.770 1.610 2.546 8.442 9.652 0.875 [OK] 1699 220 . GLY O 16 O1H0u 0.660 1.420 2.506 14.745 16.154 0.913 [OK] 1700 221 . LEU N 12 N3H1s 0.700 1.640 3.254 14.976 13.517 1.108 possible 1701 221 . LEU CA 3 C4H1s 0.770 1.880 3.083 14.523 13.055 1.112 possible 1702 221 . LEU C 1 C3H0s 0.770 1.610 3.907 9.795 8.781 1.115 possible 1703 221 . LEU O 16 O1H0u 0.660 1.420 3.468 18.343 15.957 1.150 possible 1704 221 . LEU CB 8 C4H2s 0.770 1.880 5.909 30.764 22.818 1.348 possible 1705 221 . LEU CG 4 C4H1b 0.770 1.880 7.421 44.854 14.704 3.050 possible 1706 221 . LEU CD1 10 C4H3u 0.770 1.880 20.027 -1.000 37.235 -1.000 bad 1707 221 . LEU CD2 10 C4H3u 0.770 1.880 50.537 -1.000 37.020 -1.000 bad 1708 222 . ILE N 12 N3H1s 0.700 1.640 4.618 17.297 13.493 1.282 possible 1709 222 . ILE CA 3 C4H1s 0.770 1.880 4.509 16.505 12.946 1.275 possible 1710 222 . ILE C 1 C3H0s 0.770 1.610 2.540 7.891 8.445 0.934 [OK] 1711 222 . ILE O 16 O1H0u 0.660 1.420 3.464 21.864 15.930 1.372 possible 1712 222 . ILE CB 4 C4H1b 0.770 1.880 3.057 14.565 14.146 1.030 possible 1713 222 . ILE CG1 9 C4H2b 0.770 1.880 7.679 79.235 24.071 3.292 possible 1714 222 . ILE CG2 10 C4H3u 0.770 1.880 3.991 43.929 35.763 1.228 possible 1715 222 . ILE CD1 10 C4H3u 0.770 1.880 6.137 67.477 38.219 1.766 possible 1716 223 . LEU N 12 N3H1s 0.700 1.640 2.620 12.638 13.517 0.935 [OK] 1717 223 . LEU CA 3 C4H1s 0.770 1.880 4.027 16.544 13.055 1.267 possible 1718 223 . LEU C 1 C3H0s 0.770 1.610 3.318 8.791 8.781 1.001 possible 1719 223 . LEU O 16 O1H0u 0.660 1.420 4.959 58.397 15.957 3.660 possible 1720 223 . LEU CB 8 C4H2s 0.770 1.880 4.063 29.195 22.818 1.279 possible 1721 223 . LEU CG 4 C4H1b 0.770 1.880 4.898 22.062 14.704 1.500 possible 1722 223 . LEU CD1 10 C4H3u 0.770 1.880 4.984 64.473 37.235 1.732 possible 1723 223 . LEU CD2 10 C4H3u 0.770 1.880 4.550 37.455 37.020 1.012 possible 1724 224 . LEU N 12 N3H1s 0.700 1.640 3.368 14.576 13.517 1.078 possible 1725 224 . LEU CA 3 C4H1s 0.770 1.880 5.113 27.062 13.055 2.073 possible 1726 224 . LEU C 1 C3H0s 0.770 1.610 2.517 7.618 8.781 0.868 [OK] 1727 224 . LEU O 16 O1H0u 0.660 1.420 24.845 -1.000 15.957 -1.000 bad 1728 224 . LEU CB 8 C4H2s 0.770 1.880 3.290 25.774 22.818 1.130 possible 1729 224 . LEU CG 4 C4H1b 0.770 1.880 6.462 18.466 14.704 1.256 possible 1730 224 . LEU CD1 10 C4H3u 0.770 1.880 25.771 -1.000 37.235 -1.000 bad 1731 224 . LEU CD2 10 C4H3u 0.770 1.880 26.939 -1.000 37.020 -1.000 bad 1732 225 . ARG N 12 N3H1s 0.700 1.640 2.576 12.494 13.486 0.926 [OK] 1733 225 . ARG CA 3 C4H1s 0.770 1.880 7.087 25.432 13.310 1.911 possible 1734 225 . ARG C 1 C3H0s 0.770 1.610 2.470 8.448 8.779 0.962 [OK] 1735 225 . ARG O 16 O1H0u 0.660 1.420 18.438 -1.000 15.916 -1.000 bad 1736 225 . ARG CB 8 C4H2s 0.770 1.880 3.737 26.181 22.833 1.147 possible 1737 225 . ARG CG 8 C4H2s 0.770 1.880 34.353 -1.000 23.273 -1.000 bad 1738 225 . ARG CD 8 C4H2s 0.770 1.880 27.536 -1.000 22.849 -1.000 bad 1739 225 . ARG NE 13 N3H1b 0.700 1.640 9.938 -1.000 15.019 -1.000 bad 1740 225 . ARG CZ 2 C3H0b 0.770 1.610 2.114 -1.000 9.678 -1.000 bad 1741 225 . ARG NH1 15 N3H2u 0.700 1.640 24.154 -1.000 22.056 -1.000 bad 1742 225 . ARG NH2 15 N3H2u 0.700 1.640 30.524 -1.000 23.132 -1.000 bad 1743 226 . SER N 12 N3H1s 0.700 1.640 4.487 49.091 13.808 3.555 possible 1904 216 . RET C1 9 C4H2b 0.770 1.880 2.617 6.374 1.880 3.390 [OK] 1905 216 . RET C2 9 C4H2b 0.770 1.880 3.275 20.977 1.880 11.158 possible 1906 216 . RET C3 9 C4H2b 0.770 1.880 3.524 27.870 1.880 14.824 possible 1907 216 . RET C4 9 C4H2b 0.770 1.880 2.623 21.355 1.880 11.359 [OK] 1908 216 . RET C5 9 C4H2b 0.770 1.880 2.556 10.141 1.880 5.394 [OK] 1909 216 . RET C6 9 C4H2b 0.770 1.880 3.188 13.067 1.880 6.950 possible 1910 216 . RET C7 9 C4H2b 0.770 1.880 3.191 21.547 1.880 11.461 possible 1911 216 . RET C8 9 C4H2b 0.770 1.880 3.745 25.734 1.880 13.688 possible 1912 216 . RET C9 9 C4H2b 0.770 1.880 3.338 13.266 1.880 7.056 possible 1913 216 . RET C10 9 C4H2b 0.770 1.880 3.358 23.084 1.880 12.279 possible 1914 216 . RET C11 9 C4H2b 0.770 1.880 2.745 18.803 1.880 10.002 [OK] 1915 216 . RET C12 9 C4H2b 0.770 1.880 2.951 20.865 1.880 11.098 [OK] 1916 216 . RET C13 9 C4H2b 0.770 1.880 3.460 14.411 1.880 7.665 possible 1917 216 . RET C14 9 C4H2b 0.770 1.880 3.144 20.796 1.880 11.062 possible 1918 216 . RET C15 9 C4H2b 0.770 1.880 2.983 20.400 1.880 10.851 [OK] 1919 216 . RET C16 9 C4H2b 0.770 1.880 2.762 28.156 1.880 14.976 [OK] 1920 216 . RET C17 9 C4H2b 0.770 1.880 3.506 32.319 1.880 17.191 possible 1921 216 . RET C18 9 C4H2b 0.770 1.880 2.988 33.571 1.880 17.857 [OK] 1922 216 . RET C19 9 C4H2b 0.770 1.880 3.241 36.303 1.880 19.310 possible 1923 216 . RET C20 9 C4H2b 0.770 1.880 3.422 37.231 1.880 19.804 possible