NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
540701 | 2lqp | 18323 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 ASP 78 1HT ASP 78 8.411 18.001 4.568 2 H2 ASP 78 2HT ASP 78 7.828 16.572 3.859 3 H3 ASP 78 3HT ASP 78 7.664 16.820 5.531 4 HA ASP 78 HA ASP 78 5.565 17.319 4.809 5 HB2 ASP 78 2HB ASP 78 7.228 19.846 4.767 6 HB3 ASP 78 1HB ASP 78 5.464 19.861 4.705 7 H THR 79 H THR 79 7.388 19.583 2.728 8 HA THR 79 HA THR 79 5.914 18.505 0.381 9 HB THR 79 HB THR 79 6.894 21.352 0.534 10 HG1 THR 79 1HG THR 79 4.286 20.589 1.253 11 HG21 THR 79 3HG2 THR 79 4.654 19.939 -0.950 12 HG22 THR 79 1HG2 THR 79 6.157 20.542 -1.647 13 HG23 THR 79 2HG2 THR 79 4.959 21.673 -1.021 14 H ASP 80 H ASP 80 8.823 18.449 1.765 15 HA ASP 80 HA ASP 80 10.622 19.304 -0.247 16 HB2 ASP 80 2HB ASP 80 10.869 17.255 1.958 17 HB3 ASP 80 1HB ASP 80 12.206 17.685 0.892 18 H SER 81 H SER 81 9.171 16.125 0.434 19 HA SER 81 HA SER 81 9.243 15.379 -2.344 20 HB2 SER 81 2HB SER 81 10.815 13.601 -2.250 21 HB3 SER 81 1HB SER 81 11.626 14.975 -1.505 22 HG SER 81 HG SER 81 11.701 13.884 0.284 23 H GLU 82 H GLU 82 8.510 14.853 0.961 24 HA GLU 82 HA GLU 82 7.362 12.333 1.031 25 HB2 GLU 82 2HB GLU 82 7.664 13.899 2.971 26 HB3 GLU 82 1HB GLU 82 6.284 14.822 2.382 27 HG2 GLU 82 2HG GLU 82 4.829 12.877 2.634 28 HG3 GLU 82 1HG GLU 82 6.202 11.885 3.122 29 H GLU 83 H GLU 83 6.416 15.059 -0.783 30 HA GLU 83 HA GLU 83 3.620 14.637 -0.927 31 HB2 GLU 83 2HB GLU 83 4.698 16.745 -1.590 32 HB3 GLU 83 1HB GLU 83 5.452 15.927 -2.958 33 HG2 GLU 83 2HG GLU 83 3.264 15.409 -3.906 34 HG3 GLU 83 1HG GLU 83 2.460 16.096 -2.496 35 H GLU 84 H GLU 84 6.216 13.628 -3.217 36 HA GLU 84 HA GLU 84 4.616 12.346 -5.082 37 HB2 GLU 84 2HB GLU 84 7.110 12.592 -5.235 38 HB3 GLU 84 1HB GLU 84 7.261 11.271 -4.081 39 HG2 GLU 84 2HG GLU 84 5.664 10.959 -6.630 40 HG3 GLU 84 1HG GLU 84 7.400 10.676 -6.591 41 H ILE 85 H ILE 85 5.904 11.070 -2.027 42 HA ILE 85 HA ILE 85 4.896 8.459 -2.190 43 HB ILE 85 HB ILE 85 5.285 10.279 0.208 44 HG12 ILE 85 2HG1 ILE 85 7.039 8.063 -0.893 45 HG13 ILE 85 1HG1 ILE 85 7.319 9.784 -1.158 46 HG21 ILE 85 1HG2 ILE 85 3.761 8.354 0.714 47 HG22 ILE 85 2HG2 ILE 85 5.279 8.280 1.577 48 HG23 ILE 85 3HG2 ILE 85 5.026 7.257 0.168 49 HD11 ILE 85 3HD1 ILE 85 7.415 8.261 1.450 50 HD12 ILE 85 1HD1 ILE 85 7.276 10.018 1.404 51 HD13 ILE 85 2HD1 ILE 85 8.689 9.228 0.706 52 H ARG 86 H ARG 86 3.477 11.413 -0.790 53 HA ARG 86 HA ARG 86 1.052 10.316 0.064 54 HB2 ARG 86 2HB ARG 86 1.819 13.106 -0.813 55 HB3 ARG 86 1HB ARG 86 0.199 12.725 -0.232 56 HG2 ARG 86 2HG ARG 86 1.119 11.911 1.887 57 HG3 ARG 86 1HG ARG 86 2.759 12.184 1.308 58 HD2 ARG 86 2HD ARG 86 2.313 14.601 1.147 59 HD3 ARG 86 1HD ARG 86 0.655 14.341 1.685 60 HE ARG 86 HE ARG 86 2.418 13.223 3.587 61 HH11 ARG 86 1HH2 ARG 86 1.360 16.277 2.322 62 HH12 ARG 86 2HH2 ARG 86 1.740 17.157 3.766 63 HH21 ARG 86 1HH1 ARG 86 2.916 14.381 5.478 64 HH22 ARG 86 2HH1 ARG 86 2.622 16.087 5.544 65 H GLU 87 H GLU 87 2.064 11.440 -3.118 66 HA GLU 87 HA GLU 87 -0.565 11.284 -4.271 67 HB2 GLU 87 2HB GLU 87 2.190 11.421 -5.502 68 HB3 GLU 87 1HB GLU 87 0.692 11.447 -6.437 69 HG2 GLU 87 2HG GLU 87 -0.052 13.449 -5.230 70 HG3 GLU 87 1HG GLU 87 1.406 13.411 -4.241 71 H ALA 88 H ALA 88 2.324 9.423 -5.099 72 HA ALA 88 HA ALA 88 1.387 7.389 -6.569 73 HB1 ALA 88 1HB ALA 88 3.713 7.440 -6.011 74 HB2 ALA 88 2HB ALA 88 3.087 5.881 -5.480 75 HB3 ALA 88 3HB ALA 88 3.373 7.164 -4.302 76 H PHE 89 H PHE 89 1.293 7.360 -3.015 77 HA PHE 89 HA PHE 89 -0.126 4.913 -2.853 78 HB2 PHE 89 2HB PHE 89 0.537 7.110 -0.954 79 HB3 PHE 89 1HB PHE 89 -0.668 5.902 -0.481 80 HD1 PHE 89 2HD PHE 89 0.024 3.381 -1.027 81 HD2 PHE 89 1HD PHE 89 2.788 6.622 -0.509 82 HE1 PHE 89 2HE PHE 89 1.835 1.761 -0.543 83 HE2 PHE 89 1HE PHE 89 4.594 5.001 -0.027 84 HZ PHE 89 HZ PHE 89 4.123 2.576 -0.048 85 H ARG 90 H ARG 90 -1.201 8.325 -2.884 86 HA ARG 90 HA ARG 90 -3.915 7.852 -2.268 87 HB2 ARG 90 2HB ARG 90 -2.378 10.032 -3.568 88 HB3 ARG 90 1HB ARG 90 -4.122 10.034 -3.814 89 HG2 ARG 90 2HG ARG 90 -4.484 9.965 -1.390 90 HG3 ARG 90 1HG ARG 90 -2.740 9.914 -1.114 91 HD2 ARG 90 2HD ARG 90 -2.517 12.056 -2.297 92 HD3 ARG 90 1HD ARG 90 -4.261 12.117 -2.503 93 HE ARG 90 HE ARG 90 -2.786 12.592 -0.024 94 HH11 ARG 90 1HH2 ARG 90 -5.820 11.975 -1.588 95 HH12 ARG 90 2HH2 ARG 90 -6.779 12.597 -0.284 96 HH21 ARG 90 1HH1 ARG 90 -4.046 13.404 1.703 97 HH22 ARG 90 2HH1 ARG 90 -5.776 13.399 1.579 98 H VAL 91 H VAL 91 -2.273 8.046 -5.419 99 HA VAL 91 HA VAL 91 -4.606 7.541 -6.975 100 HB VAL 91 HB VAL 91 -2.989 7.099 -8.815 101 HG11 VAL 91 1HG1 VAL 91 -2.281 9.473 -7.065 102 HG12 VAL 91 2HG1 VAL 91 -3.630 9.417 -8.201 103 HG13 VAL 91 3HG1 VAL 91 -1.970 9.340 -8.795 104 HG21 VAL 91 3HG2 VAL 91 -1.277 5.967 -7.388 105 HG22 VAL 91 1HG2 VAL 91 -0.918 7.523 -6.652 106 HG23 VAL 91 2HG2 VAL 91 -0.593 7.265 -8.359 107 H PHE 92 H PHE 92 -2.269 5.514 -5.389 108 HA PHE 92 HA PHE 92 -2.658 3.089 -6.728 109 HB2 PHE 92 2HB PHE 92 -1.511 3.975 -4.225 110 HB3 PHE 92 1HB PHE 92 -2.340 2.456 -3.970 111 HD1 PHE 92 1HD PHE 92 -0.311 3.939 -6.768 112 HD2 PHE 92 2HD PHE 92 -0.879 0.638 -4.080 113 HE1 PHE 92 1HE PHE 92 1.563 2.734 -7.849 114 HE2 PHE 92 2HE PHE 92 0.996 -0.566 -5.160 115 HZ PHE 92 HZ PHE 92 2.214 0.479 -7.049 116 H ASP 93 H ASP 93 -4.405 4.299 -3.844 117 HA ASP 93 HA ASP 93 -6.129 2.183 -3.459 118 HB2 ASP 93 2HB ASP 93 -5.942 4.352 -2.122 119 HB3 ASP 93 1HB ASP 93 -7.027 5.062 -3.314 120 H LYS 94 H LYS 94 -6.810 1.152 -5.305 121 HA LYS 94 HA LYS 94 -7.721 2.291 -7.668 122 HB2 LYS 94 2HB LYS 94 -8.564 -0.280 -6.308 123 HB3 LYS 94 1HB LYS 94 -8.958 0.135 -7.974 124 HG2 LYS 94 2HG LYS 94 -6.601 0.229 -8.566 125 HG3 LYS 94 1HG LYS 94 -6.134 0.000 -6.883 126 HD2 LYS 94 2HD LYS 94 -5.904 -2.151 -7.853 127 HD3 LYS 94 1HD LYS 94 -7.438 -2.218 -6.994 128 HE2 LYS 94 2HE LYS 94 -8.681 -1.919 -9.032 129 HE3 LYS 94 1HE LYS 94 -7.222 -1.536 -9.940 130 HZ1 LYS 94 3HZ LYS 94 -6.739 -3.681 -10.190 131 HZ2 LYS 94 1HZ LYS 94 -8.338 -3.992 -9.720 132 HZ3 LYS 94 2HZ LYS 94 -7.089 -4.058 -8.571 133 H ASP 95 H ASP 95 -9.706 1.039 -4.992 134 HA ASP 95 HA ASP 95 -12.118 2.229 -5.979 135 HB2 ASP 95 2HB ASP 95 -12.073 0.156 -4.621 136 HB3 ASP 95 1HB ASP 95 -11.475 1.089 -3.252 137 H GLY 96 H GLY 96 -9.747 3.955 -5.371 138 HA2 GLY 96 2HA GLY 96 -9.146 5.807 -4.008 139 HA3 GLY 96 1HA GLY 96 -10.592 6.369 -4.835 140 H ASN 97 H ASN 97 -10.295 3.975 -2.219 141 HA ASN 97 HA ASN 97 -12.461 5.193 -0.788 142 HB2 ASN 97 2HB ASN 97 -11.873 3.466 0.975 143 HB3 ASN 97 1HB ASN 97 -12.322 2.840 -0.607 144 HD21 ASN 97 1HD2 ASN 97 -9.372 3.753 1.260 145 HD22 ASN 97 2HD2 ASN 97 -8.400 2.540 0.580 146 H GLY 98 H GLY 98 -9.206 5.980 -0.981 147 HA2 GLY 98 2HA GLY 98 -8.235 7.829 0.116 148 HA3 GLY 98 1HA GLY 98 -9.431 7.680 1.399 149 H TYR 99 H TYR 99 -8.320 4.653 0.762 150 HA TYR 99 HA TYR 99 -5.943 4.799 2.488 151 HB2 TYR 99 2HB TYR 99 -8.358 3.078 3.078 152 HB3 TYR 99 1HB TYR 99 -6.798 2.950 3.892 153 HD1 TYR 99 1HD TYR 99 -5.989 4.756 5.367 154 HD2 TYR 99 2HD TYR 99 -9.841 4.958 3.476 155 HE1 TYR 99 1HE TYR 99 -6.649 6.589 6.906 156 HE2 TYR 99 2HE TYR 99 -10.501 6.789 5.014 157 HH TYR 99 HH TYR 99 -8.189 8.284 7.194 158 H ILE 100 H ILE 100 -5.378 2.149 2.792 159 HA ILE 100 HA ILE 100 -5.370 1.064 0.019 160 HB ILE 100 HB ILE 100 -3.073 1.046 1.967 161 HG12 ILE 100 2HG1 ILE 100 -3.625 3.324 1.018 162 HG13 ILE 100 1HG1 ILE 100 -2.024 2.737 0.590 163 HG21 ILE 100 1HG2 ILE 100 -1.851 0.382 -0.196 164 HG22 ILE 100 2HG2 ILE 100 -3.450 0.010 -0.833 165 HG23 ILE 100 3HG2 ILE 100 -2.846 -0.845 0.588 166 HD11 ILE 100 3HD1 ILE 100 -3.054 3.715 -1.373 167 HD12 ILE 100 1HD1 ILE 100 -4.485 2.717 -1.189 168 HD13 ILE 100 2HD1 ILE 100 -2.944 1.979 -1.619 169 H SER 101 H SER 101 -6.021 -0.948 -0.178 170 HA SER 101 HA SER 101 -6.172 -2.699 2.199 171 HB2 SER 101 2HB SER 101 -7.840 -2.513 -0.311 172 HB3 SER 101 1HB SER 101 -7.820 -3.982 0.663 173 HG SER 101 HG SER 101 -9.460 -2.353 1.186 174 H ALA 102 H ALA 102 -5.854 -4.990 1.765 175 HA ALA 102 HA ALA 102 -3.399 -5.478 0.425 176 HB1 ALA 102 1HB ALA 102 -3.553 -7.001 2.125 177 HB2 ALA 102 2HB ALA 102 -4.394 -7.987 0.934 178 HB3 ALA 102 3HB ALA 102 -5.314 -7.008 2.074 179 H ALA 103 H ALA 103 -6.760 -6.123 -0.445 180 HA ALA 103 HA ALA 103 -6.259 -7.824 -2.613 181 HB1 ALA 103 1HB ALA 103 -8.515 -7.442 -3.224 182 HB2 ALA 103 2HB ALA 103 -8.530 -5.855 -2.454 183 HB3 ALA 103 3HB ALA 103 -8.469 -7.315 -1.466 184 H GLU 104 H GLU 104 -6.270 -4.305 -2.385 185 HA GLU 104 HA GLU 104 -6.241 -3.788 -5.169 186 HB2 GLU 104 2HB GLU 104 -5.157 -2.110 -2.894 187 HB3 GLU 104 1HB GLU 104 -5.528 -1.542 -4.525 188 HG2 GLU 104 2HG GLU 104 -7.883 -2.151 -4.227 189 HG3 GLU 104 1HG GLU 104 -7.523 -2.786 -2.620 190 H LEU 105 H LEU 105 -3.688 -4.464 -2.805 191 HA LEU 105 HA LEU 105 -1.493 -3.616 -4.382 192 HB2 LEU 105 2HB LEU 105 -1.498 -5.843 -2.358 193 HB3 LEU 105 1HB LEU 105 -0.121 -4.867 -2.865 194 HG LEU 105 HG LEU 105 -2.578 -3.891 -1.395 195 HD11 LEU 105 1HD1 LEU 105 -1.116 -5.043 0.112 196 HD12 LEU 105 2HD1 LEU 105 -0.844 -3.327 0.359 197 HD13 LEU 105 3HD1 LEU 105 0.309 -4.272 -0.579 198 HD21 LEU 105 3HD2 LEU 105 -1.972 -2.063 -2.755 199 HD22 LEU 105 1HD2 LEU 105 -0.250 -2.429 -2.634 200 HD23 LEU 105 2HD2 LEU 105 -1.112 -1.750 -1.256 201 H ARG 106 H ARG 106 -2.909 -6.885 -3.946 202 HA ARG 106 HA ARG 106 -1.135 -8.142 -5.734 203 HB2 ARG 106 2HB ARG 106 -2.883 -9.932 -5.842 204 HB3 ARG 106 1HB ARG 106 -2.396 -9.492 -4.206 205 HG2 ARG 106 2HG ARG 106 -4.371 -7.999 -4.038 206 HG3 ARG 106 1HG ARG 106 -4.882 -8.510 -5.646 207 HD2 ARG 106 2HD ARG 106 -4.921 -10.869 -4.817 208 HD3 ARG 106 1HD ARG 106 -4.591 -10.250 -3.198 209 HE ARG 106 HE ARG 106 -6.828 -8.891 -4.236 210 HH11 ARG 106 1HH2 ARG 106 -5.843 -12.045 -3.152 211 HH12 ARG 106 2HH2 ARG 106 -7.440 -12.528 -2.687 212 HH21 ARG 106 1HH1 ARG 106 -8.923 -9.537 -3.630 213 HH22 ARG 106 2HH1 ARG 106 -9.178 -11.113 -2.957 214 H HIS 107 H HIS 107 -4.397 -6.759 -6.270 215 HA HIS 107 HA HIS 107 -4.552 -7.503 -9.000 216 HB2 HIS 107 2HB HIS 107 -5.894 -5.307 -7.431 217 HB3 HIS 107 1HB HIS 107 -6.310 -5.730 -9.088 218 HD1 HIS 107 1HD HIS 107 -6.321 -8.755 -9.016 219 HD2 HIS 107 2HD HIS 107 -7.927 -6.436 -5.945 220 HE1 HIS 107 1HE HIS 107 -8.015 -10.215 -7.825 221 HE2 HIS 107 2HE HIS 107 -9.003 -8.815 -5.951 222 H VAL 108 H VAL 108 -3.720 -4.362 -7.477 223 HA VAL 108 HA VAL 108 -3.200 -3.034 -9.921 224 HB VAL 108 HB VAL 108 -3.555 -2.008 -7.585 225 HG11 VAL 108 1HG1 VAL 108 -0.544 -2.254 -7.458 226 HG12 VAL 108 2HG1 VAL 108 -1.621 -3.364 -6.624 227 HG13 VAL 108 3HG1 VAL 108 -1.641 -1.656 -6.213 228 HG21 VAL 108 3HG2 VAL 108 -2.246 -0.023 -8.190 229 HG22 VAL 108 1HG2 VAL 108 -3.000 -0.715 -9.627 230 HG23 VAL 108 2HG2 VAL 108 -1.284 -0.981 -9.317 231 H MET 109 H MET 109 -0.939 -4.599 -7.625 232 HA MET 109 HA MET 109 1.406 -4.086 -9.078 233 HB2 MET 109 2HB MET 109 0.710 -6.405 -7.271 234 HB3 MET 109 1HB MET 109 2.333 -6.060 -7.864 235 HG2 MET 109 2HG MET 109 0.707 -3.981 -6.388 236 HG3 MET 109 1HG MET 109 1.746 -5.124 -5.541 237 HE1 MET 109 3HE MET 109 4.120 -4.766 -5.095 238 HE2 MET 109 1HE MET 109 3.253 -3.355 -4.474 239 HE3 MET 109 2HE MET 109 4.798 -3.153 -5.297 240 H THR 110 H THR 110 -0.817 -6.860 -9.194 241 HA THR 110 HA THR 110 0.560 -8.297 -11.191 242 HB THR 110 HB THR 110 -2.393 -8.253 -10.508 243 HG1 THR 110 1HG THR 110 -0.529 -10.244 -9.843 244 HG21 THR 110 3HG2 THR 110 -2.118 -9.197 -12.710 245 HG22 THR 110 1HG2 THR 110 -2.336 -10.535 -11.584 246 HG23 THR 110 2HG2 THR 110 -0.725 -10.142 -12.186 247 H ASN 111 H ASN 111 -1.946 -5.828 -11.318 248 HA ASN 111 HA ASN 111 -2.373 -5.864 -14.133 249 HB2 ASN 111 2HB ASN 111 -3.869 -4.813 -12.382 250 HB3 ASN 111 1HB ASN 111 -2.716 -3.486 -12.304 251 HD21 ASN 111 1HD2 ASN 111 -4.879 -2.361 -13.121 252 HD22 ASN 111 2HD2 ASN 111 -5.055 -2.267 -14.807 253 H LEU 112 H LEU 112 -0.170 -4.159 -12.011 254 HA LEU 112 HA LEU 112 0.891 -2.320 -13.870 255 HB2 LEU 112 2HB LEU 112 1.856 -3.497 -11.281 256 HB3 LEU 112 1HB LEU 112 2.959 -2.522 -12.235 257 HG LEU 112 HG LEU 112 0.184 -1.562 -11.497 258 HD11 LEU 112 1HD1 LEU 112 1.026 -1.810 -9.345 259 HD12 LEU 112 2HD1 LEU 112 1.606 -0.194 -9.724 260 HD13 LEU 112 3HD1 LEU 112 2.700 -1.572 -9.846 261 HD21 LEU 112 3HD2 LEU 112 2.700 -0.278 -12.584 262 HD22 LEU 112 1HD2 LEU 112 1.516 0.690 -11.711 263 HD23 LEU 112 2HD2 LEU 112 1.048 -0.150 -13.182 264 H GLY 113 H GLY 113 1.638 -5.676 -13.133 265 HA2 GLY 113 2HA GLY 113 2.451 -6.802 -15.303 266 HA3 GLY 113 1HA GLY 113 3.777 -5.650 -15.185 267 H GLU 114 H GLU 114 2.989 -6.303 -12.069 268 HA GLU 114 HA GLU 114 4.861 -8.607 -11.895 269 HB2 GLU 114 2HB GLU 114 5.678 -6.277 -11.105 270 HB3 GLU 114 1HB GLU 114 4.570 -6.503 -9.753 271 HG2 GLU 114 2HG GLU 114 6.672 -7.353 -9.008 272 HG3 GLU 114 1HG GLU 114 5.695 -8.768 -9.393 273 H LYS 115 H LYS 115 3.779 -10.356 -11.266 274 HA LYS 115 HA LYS 115 1.352 -10.105 -9.632 275 HB2 LYS 115 2HB LYS 115 1.323 -11.523 -11.671 276 HB3 LYS 115 1HB LYS 115 2.562 -12.550 -10.949 277 HG2 LYS 115 2HG LYS 115 1.068 -13.094 -9.086 278 HG3 LYS 115 1HG LYS 115 -0.162 -12.008 -9.730 279 HD2 LYS 115 2HD LYS 115 -0.296 -13.380 -11.783 280 HD3 LYS 115 1HD LYS 115 0.921 -14.474 -11.125 281 HE2 LYS 115 2HE LYS 115 -1.148 -15.517 -10.619 282 HE3 LYS 115 1HE LYS 115 -0.664 -14.746 -9.110 283 HZ1 LYS 115 3HZ LYS 115 -2.841 -14.084 -9.339 284 HZ2 LYS 115 1HZ LYS 115 -2.744 -13.931 -11.025 285 HZ3 LYS 115 2HZ LYS 115 -2.014 -12.768 -10.024 286 H LEU 116 H LEU 116 1.941 -9.776 -7.555 287 HA LEU 116 HA LEU 116 4.085 -11.202 -6.257 288 HB2 LEU 116 2HB LEU 116 1.979 -9.230 -5.381 289 HB3 LEU 116 1HB LEU 116 2.893 -10.125 -4.167 290 HG LEU 116 HG LEU 116 4.994 -9.272 -5.047 291 HD11 LEU 116 1HD1 LEU 116 4.822 -7.489 -6.889 292 HD12 LEU 116 2HD1 LEU 116 3.199 -8.115 -7.187 293 HD13 LEU 116 3HD1 LEU 116 4.599 -9.164 -7.390 294 HD21 LEU 116 3HD2 LEU 116 3.037 -6.967 -4.896 295 HD22 LEU 116 1HD2 LEU 116 4.736 -6.963 -4.422 296 HD23 LEU 116 2HD2 LEU 116 3.557 -7.874 -3.478 297 H THR 117 H THR 117 3.117 -11.938 -3.842 298 HA THR 117 HA THR 117 1.305 -14.204 -4.480 299 HB THR 117 HB THR 117 2.295 -15.198 -2.357 300 HG1 THR 117 1HG THR 117 4.582 -13.905 -2.436 301 HG21 THR 117 3HG2 THR 117 4.010 -14.599 -4.773 302 HG22 THR 117 1HG2 THR 117 3.034 -16.037 -4.474 303 HG23 THR 117 2HG2 THR 117 4.487 -15.743 -3.518 304 H ASP 118 H ASP 118 -0.650 -14.220 -3.594 305 HA ASP 118 HA ASP 118 -1.728 -12.099 -2.150 306 HB2 ASP 118 2HB ASP 118 -2.591 -14.935 -2.643 307 HB3 ASP 118 1HB ASP 118 -3.513 -13.938 -1.523 308 H GLU 119 H GLU 119 -0.284 -15.115 -1.032 309 HA GLU 119 HA GLU 119 -1.035 -14.927 1.677 310 HB2 GLU 119 2HB GLU 119 1.413 -16.195 0.418 311 HB3 GLU 119 1HB GLU 119 0.864 -16.477 2.071 312 HG2 GLU 119 2HG GLU 119 -1.283 -17.328 1.222 313 HG3 GLU 119 1HG GLU 119 -0.752 -17.028 -0.431 314 H GLU 120 H GLU 120 1.695 -13.572 -0.127 315 HA GLU 120 HA GLU 120 2.996 -12.502 2.226 316 HB2 GLU 120 2HB GLU 120 3.387 -11.937 -0.721 317 HB3 GLU 120 1HB GLU 120 4.366 -11.232 0.561 318 HG2 GLU 120 2HG GLU 120 5.055 -13.456 1.309 319 HG3 GLU 120 1HG GLU 120 4.029 -14.205 0.087 320 H VAL 121 H VAL 121 1.053 -11.180 -0.444 321 HA VAL 121 HA VAL 121 0.998 -8.490 0.303 322 HB VAL 121 HB VAL 121 -1.103 -10.228 -0.998 323 HG11 VAL 121 1HG1 VAL 121 -1.063 -7.246 -0.548 324 HG12 VAL 121 2HG1 VAL 121 -2.317 -8.383 -0.065 325 HG13 VAL 121 3HG1 VAL 121 -2.069 -8.019 -1.769 326 HG21 VAL 121 3HG2 VAL 121 1.041 -9.863 -2.220 327 HG22 VAL 121 1HG2 VAL 121 0.762 -8.124 -2.125 328 HG23 VAL 121 2HG2 VAL 121 -0.341 -9.144 -3.047 329 H ASP 122 H ASP 122 -1.609 -10.825 0.937 330 HA ASP 122 HA ASP 122 -3.103 -9.425 2.758 331 HB2 ASP 122 2HB ASP 122 -3.614 -11.701 1.841 332 HB3 ASP 122 1HB ASP 122 -2.426 -12.373 2.952 333 H GLU 123 H GLU 123 -0.164 -11.361 3.427 334 HA GLU 123 HA GLU 123 -0.228 -10.821 6.244 335 HB2 GLU 123 2HB GLU 123 0.927 -12.787 5.289 336 HB3 GLU 123 1HB GLU 123 2.099 -11.706 4.533 337 HG2 GLU 123 2HG GLU 123 2.791 -10.866 6.724 338 HG3 GLU 123 1HG GLU 123 1.562 -11.853 7.514 339 H MET 124 H MET 124 1.193 -9.253 3.446 340 HA MET 124 HA MET 124 3.139 -7.625 4.561 341 HB2 MET 124 2HB MET 124 2.463 -7.868 2.111 342 HB3 MET 124 1HB MET 124 1.211 -6.676 2.446 343 HG2 MET 124 2HG MET 124 2.996 -5.367 1.673 344 HG3 MET 124 1HG MET 124 3.144 -5.239 3.426 345 HE1 MET 124 3HE MET 124 5.076 -5.919 0.204 346 HE2 MET 124 1HE MET 124 3.976 -7.294 0.373 347 HE3 MET 124 2HE MET 124 5.719 -7.541 0.448 348 H ILE 125 H ILE 125 -0.145 -6.441 3.784 349 HA ILE 125 HA ILE 125 0.045 -4.091 5.273 350 HB ILE 125 HB ILE 125 -2.304 -5.762 4.368 351 HG12 ILE 125 2HG1 ILE 125 -1.303 -2.996 3.593 352 HG13 ILE 125 1HG1 ILE 125 -0.998 -4.477 2.689 353 HG21 ILE 125 1HG2 ILE 125 -2.339 -3.240 6.041 354 HG22 ILE 125 2HG2 ILE 125 -3.182 -4.758 6.344 355 HG23 ILE 125 3HG2 ILE 125 -3.707 -3.709 5.039 356 HD11 ILE 125 3HD1 ILE 125 -3.575 -4.739 2.657 357 HD12 ILE 125 1HD1 ILE 125 -2.863 -3.536 1.581 358 HD13 ILE 125 2HD1 ILE 125 -3.617 -3.038 3.097 359 H ARG 126 H ARG 126 -1.253 -7.258 6.205 360 HA ARG 126 HA ARG 126 -2.311 -6.753 8.659 361 HB2 ARG 126 2HB ARG 126 -0.697 -9.061 7.635 362 HB3 ARG 126 1HB ARG 126 -1.334 -9.081 9.272 363 HG2 ARG 126 2HG ARG 126 -3.277 -8.332 7.114 364 HG3 ARG 126 1HG ARG 126 -2.738 -10.007 7.127 365 HD2 ARG 126 2HD ARG 126 -4.776 -9.699 8.488 366 HD3 ARG 126 1HD ARG 126 -3.412 -10.247 9.460 367 HE ARG 126 HE ARG 126 -3.770 -7.366 9.387 368 HH11 ARG 126 1HH2 ARG 126 -4.505 -10.382 10.901 369 HH12 ARG 126 2HH2 ARG 126 -4.900 -9.681 12.435 370 HH21 ARG 126 1HH1 ARG 126 -4.266 -6.426 11.407 371 HH22 ARG 126 2HH1 ARG 126 -4.763 -7.439 12.721 372 H GLU 127 H GLU 127 1.158 -7.003 7.923 373 HA GLU 127 HA GLU 127 1.870 -6.679 10.718 374 HB2 GLU 127 2HB GLU 127 3.540 -6.726 8.203 375 HB3 GLU 127 1HB GLU 127 4.199 -6.598 9.834 376 HG2 GLU 127 2HG GLU 127 3.168 -8.730 10.448 377 HG3 GLU 127 1HG GLU 127 2.422 -8.849 8.854 378 H ALA 128 H ALA 128 1.543 -4.675 7.864 379 HA ALA 128 HA ALA 128 2.643 -2.330 9.272 380 HB1 ALA 128 1HB ALA 128 3.474 -2.462 7.060 381 HB2 ALA 128 2HB ALA 128 2.213 -1.234 6.989 382 HB3 ALA 128 3HB ALA 128 1.891 -2.864 6.398 383 H ASP 129 H ASP 129 0.162 -3.466 10.191 384 HA ASP 129 HA ASP 129 -1.741 -1.289 9.498 385 HB2 ASP 129 2HB ASP 129 -2.238 -3.856 9.030 386 HB3 ASP 129 1HB ASP 129 -2.689 -3.856 10.721 387 H ILE 130 H ILE 130 -1.860 0.145 11.054 388 HA ILE 130 HA ILE 130 -1.107 -0.521 13.804 389 HB ILE 130 HB ILE 130 -2.052 2.155 12.784 390 HG12 ILE 130 2HG1 ILE 130 -0.278 1.443 11.319 391 HG13 ILE 130 1HG1 ILE 130 0.367 2.627 12.448 392 HG21 ILE 130 1HG2 ILE 130 -0.219 1.300 15.049 393 HG22 ILE 130 2HG2 ILE 130 -1.875 1.879 15.231 394 HG23 ILE 130 3HG2 ILE 130 -0.621 2.966 14.635 395 HD11 ILE 130 3HD1 ILE 130 1.081 0.589 13.878 396 HD12 ILE 130 1HD1 ILE 130 1.996 0.922 12.408 397 HD13 ILE 130 2HD1 ILE 130 0.783 -0.358 12.420 398 H ASP 131 H ASP 131 -3.963 0.467 11.982 399 HA ASP 131 HA ASP 131 -5.627 0.623 14.369 400 HB2 ASP 131 2HB ASP 131 -6.407 0.755 11.449 401 HB3 ASP 131 1HB ASP 131 -7.414 1.202 12.825 402 H GLY 132 H GLY 132 -4.780 -1.728 11.968 403 HA2 GLY 132 2HA GLY 132 -5.291 -3.990 11.823 404 HA3 GLY 132 1HA GLY 132 -6.143 -3.840 13.355 405 H ASP 133 H ASP 133 -6.728 -2.019 10.380 406 HA ASP 133 HA ASP 133 -9.409 -3.276 10.164 407 HB2 ASP 133 2HB ASP 133 -10.242 -1.071 9.437 408 HB3 ASP 133 1HB ASP 133 -9.595 -1.024 11.076 409 H GLY 134 H GLY 134 -7.086 -4.152 8.754 410 HA2 GLY 134 2HA GLY 134 -6.309 -4.579 6.617 411 HA3 GLY 134 1HA GLY 134 -8.021 -4.540 6.214 412 H GLN 135 H GLN 135 -6.828 -1.601 7.461 413 HA GLN 135 HA GLN 135 -6.342 -0.498 4.762 414 HB2 GLN 135 2HB GLN 135 -8.240 0.562 6.855 415 HB3 GLN 135 1HB GLN 135 -7.660 1.526 5.503 416 HG2 GLN 135 2HG GLN 135 -8.973 -1.163 5.104 417 HG3 GLN 135 1HG GLN 135 -9.904 0.330 5.175 418 HE21 GLN 135 1HE2 GLN 135 -10.184 -0.840 2.793 419 HE22 GLN 135 2HE2 GLN 135 -9.196 -0.146 1.599 420 H VAL 136 H VAL 136 -4.638 0.796 4.665 421 HA VAL 136 HA VAL 136 -3.608 2.020 7.150 422 HB VAL 136 HB VAL 136 -1.474 1.178 6.921 423 HG11 VAL 136 1HG1 VAL 136 -1.607 -1.163 6.699 424 HG12 VAL 136 2HG1 VAL 136 -2.953 -1.050 5.559 425 HG13 VAL 136 3HG1 VAL 136 -3.196 -0.645 7.260 426 HG21 VAL 136 3HG2 VAL 136 -0.891 1.856 4.727 427 HG22 VAL 136 1HG2 VAL 136 -2.105 0.812 4.004 428 HG23 VAL 136 2HG2 VAL 136 -0.669 0.109 4.738 429 H ASN 137 H ASN 137 -2.746 4.031 6.914 430 HA ASN 137 HA ASN 137 -3.428 5.476 4.542 431 HB2 ASN 137 2HB ASN 137 -2.503 7.403 5.668 432 HB3 ASN 137 1HB ASN 137 -3.440 6.465 6.829 433 HD21 ASN 137 1HD2 ASN 137 -1.670 8.038 8.072 434 HD22 ASN 137 2HD2 ASN 137 -0.282 7.192 8.562 435 H TYR 138 H TYR 138 -1.125 7.233 4.495 436 HA TYR 138 HA TYR 138 0.435 5.808 2.556 437 HB2 TYR 138 2HB TYR 138 1.235 8.481 3.667 438 HB3 TYR 138 1HB TYR 138 1.342 7.884 2.010 439 HD1 TYR 138 1HD TYR 138 -1.374 6.811 1.547 440 HD2 TYR 138 2HD TYR 138 -0.126 10.392 3.562 441 HE1 TYR 138 1HE TYR 138 -3.580 7.850 1.059 442 HE2 TYR 138 2HE TYR 138 -2.330 11.433 3.071 443 HH TYR 138 HH TYR 138 -4.547 10.864 2.491 444 H GLU 139 H GLU 139 1.314 7.359 5.670 445 HA GLU 139 HA GLU 139 3.978 6.524 5.701 446 HB2 GLU 139 2HB GLU 139 2.085 7.107 7.980 447 HB3 GLU 139 1HB GLU 139 3.817 6.823 8.195 448 HG2 GLU 139 2HG GLU 139 4.338 8.668 6.678 449 HG3 GLU 139 1HG GLU 139 2.621 8.936 6.383 450 H GLU 140 H GLU 140 1.486 5.149 7.776 451 HA GLU 140 HA GLU 140 2.509 2.903 8.770 452 HB2 GLU 140 2HB GLU 140 -0.151 3.018 7.319 453 HB3 GLU 140 1HB GLU 140 0.329 1.698 8.387 454 HG2 GLU 140 2HG GLU 140 0.561 3.305 10.249 455 HG3 GLU 140 1HG GLU 140 0.083 4.616 9.177 456 H PHE 141 H PHE 141 1.836 3.447 5.413 457 HA PHE 141 HA PHE 141 2.528 0.756 4.558 458 HB2 PHE 141 2HB PHE 141 0.866 2.521 3.446 459 HB3 PHE 141 1HB PHE 141 2.329 3.073 2.652 460 HD1 PHE 141 1HD PHE 141 3.881 1.111 1.710 461 HD2 PHE 141 2HD PHE 141 -0.339 0.802 2.433 462 HE1 PHE 141 1HE PHE 141 3.747 -0.805 0.135 463 HE2 PHE 141 2HE PHE 141 -0.474 -1.103 0.879 464 HZ PHE 141 HZ PHE 141 1.564 -1.913 -0.283 465 H VAL 142 H VAL 142 3.833 4.041 4.023 466 HA VAL 142 HA VAL 142 6.117 3.612 2.615 467 HB VAL 142 HB VAL 142 5.807 5.352 5.062 468 HG11 VAL 142 1HG1 VAL 142 8.092 5.140 3.090 469 HG12 VAL 142 2HG1 VAL 142 8.166 5.071 4.851 470 HG13 VAL 142 3HG1 VAL 142 7.797 6.593 4.045 471 HG21 VAL 142 3HG2 VAL 142 5.268 7.071 3.542 472 HG22 VAL 142 1HG2 VAL 142 4.447 5.672 2.856 473 HG23 VAL 142 2HG2 VAL 142 5.977 6.201 2.175 474 H GLN 143 H GLN 143 6.183 3.583 6.188 475 HA GLN 143 HA GLN 143 8.663 2.552 6.660 476 HB2 GLN 143 2HB GLN 143 6.822 3.199 8.341 477 HB3 GLN 143 1HB GLN 143 6.267 1.532 8.192 478 HG2 GLN 143 2HG GLN 143 7.744 1.539 10.059 479 HG3 GLN 143 1HG GLN 143 8.674 0.839 8.739 480 HE21 GLN 143 1HE2 GLN 143 10.789 1.584 9.088 481 HE22 GLN 143 2HE2 GLN 143 11.201 3.213 9.325 482 H MET 144 H MET 144 6.149 0.994 5.021 483 HA MET 144 HA MET 144 7.288 -1.699 5.405 484 HB2 MET 144 2HB MET 144 4.725 -1.133 5.537 485 HB3 MET 144 1HB MET 144 4.812 -1.153 3.776 486 HG2 MET 144 2HG MET 144 4.209 -3.372 4.513 487 HG3 MET 144 1HG MET 144 5.873 -3.429 3.927 488 HE1 MET 144 3HE MET 144 5.661 -5.980 6.813 489 HE2 MET 144 1HE MET 144 5.180 -5.643 5.144 490 HE3 MET 144 2HE MET 144 4.077 -5.304 6.468 491 H MET 145 H MET 145 6.221 0.431 2.737 492 HA MET 145 HA MET 145 6.908 -0.903 0.512 493 HB2 MET 145 2HB MET 145 6.202 1.532 0.684 494 HB3 MET 145 1HB MET 145 7.900 1.918 0.943 495 HG2 MET 145 2HG MET 145 8.193 0.426 -1.273 496 HG3 MET 145 1HG MET 145 6.534 0.957 -1.544 497 HE1 MET 145 3HE MET 145 5.744 3.365 -1.529 498 HE2 MET 145 1HE MET 145 6.767 4.805 -1.400 499 HE3 MET 145 2HE MET 145 6.547 3.747 -0.007 500 H THR 146 H THR 146 9.295 0.782 2.571 501 HA THR 146 HA THR 146 11.552 0.030 1.008 502 HB THR 146 HB THR 146 11.569 0.624 3.969 503 HG1 THR 146 1HG THR 146 10.920 2.206 1.803 504 HG21 THR 146 3HG2 THR 146 13.680 -0.121 2.875 505 HG22 THR 146 1HG2 THR 146 13.774 1.535 3.473 506 HG23 THR 146 2HG2 THR 146 13.542 1.231 1.751 507 H ALA 147 H ALA 147 10.412 -1.177 4.164 508 HA ALA 147 HA ALA 147 12.183 -3.345 4.358 509 HB1 ALA 147 1HB ALA 147 10.654 -4.231 6.039 510 HB2 ALA 147 2HB ALA 147 9.367 -3.170 5.463 511 HB3 ALA 147 3HB ALA 147 10.798 -2.485 6.234 512 H LYS 148 H LYS 148 12.198 -4.171 2.146 513 HA LYS 148 HA LYS 148 11.537 -5.589 0.454 514 HB2 LYS 148 2HB LYS 148 11.909 -7.159 2.362 515 HB3 LYS 148 1HB LYS 148 10.194 -7.046 2.744 516 HG2 LYS 148 2HG LYS 148 9.605 -7.962 0.555 517 HG3 LYS 148 1HG LYS 148 11.304 -7.979 0.078 518 HD2 LYS 148 2HD LYS 148 11.800 -9.554 1.920 519 HD3 LYS 148 1HD LYS 148 10.094 -9.562 2.366 520 HE2 LYS 148 2HE LYS 148 11.219 -10.446 -0.309 521 HE3 LYS 148 1HE LYS 148 10.651 -11.522 0.968 522 HZ1 LYS 148 3HZ LYS 148 8.521 -10.025 0.737 523 HZ2 LYS 148 1HZ LYS 148 8.777 -11.365 -0.273 524 HZ3 LYS 148 2HZ LYS 148 9.125 -9.799 -0.835 Start of MODEL 2 1 H1 ASP 78 1HT ASP 78 6.975 19.389 -4.418 2 H2 ASP 78 2HT ASP 78 7.100 17.779 -4.949 3 H3 ASP 78 3HT ASP 78 5.692 18.675 -5.268 4 HA ASP 78 HA ASP 78 6.548 19.210 -7.222 5 HB2 ASP 78 2HB ASP 78 8.482 20.640 -5.387 6 HB3 ASP 78 1HB ASP 78 8.494 20.858 -7.135 7 H THR 79 H THR 79 8.044 17.008 -5.354 8 HA THR 79 HA THR 79 9.538 15.902 -7.505 9 HB THR 79 HB THR 79 11.159 17.641 -6.893 10 HG1 THR 79 1HG THR 79 12.748 15.902 -5.959 11 HG21 THR 79 3HG2 THR 79 10.428 17.918 -4.535 12 HG22 THR 79 1HG2 THR 79 12.170 17.677 -4.663 13 HG23 THR 79 2HG2 THR 79 11.131 16.349 -4.149 14 H ASP 80 H ASP 80 11.455 14.629 -5.560 15 HA ASP 80 HA ASP 80 9.803 12.413 -4.828 16 HB2 ASP 80 2HB ASP 80 12.235 12.280 -5.479 17 HB3 ASP 80 1HB ASP 80 12.625 12.990 -3.913 18 H SER 81 H SER 81 9.362 15.158 -3.584 19 HA SER 81 HA SER 81 9.981 14.919 -0.799 20 HB2 SER 81 2HB SER 81 8.880 16.965 -0.555 21 HB3 SER 81 1HB SER 81 9.448 17.042 -2.221 22 HG SER 81 HG SER 81 6.933 17.070 -1.271 23 H GLU 82 H GLU 82 8.131 15.105 0.826 24 HA GLU 82 HA GLU 82 6.778 12.755 1.128 25 HB2 GLU 82 2HB GLU 82 6.998 14.554 2.844 26 HB3 GLU 82 1HB GLU 82 5.753 15.469 2.000 27 HG2 GLU 82 2HG GLU 82 4.139 13.663 2.365 28 HG3 GLU 82 1HG GLU 82 5.381 12.685 3.145 29 H GLU 83 H GLU 83 6.086 15.239 -1.121 30 HA GLU 83 HA GLU 83 3.305 14.896 -1.450 31 HB2 GLU 83 2HB GLU 83 4.663 16.809 -2.328 32 HB3 GLU 83 1HB GLU 83 5.304 15.724 -3.561 33 HG2 GLU 83 2HG GLU 83 3.444 16.905 -4.540 34 HG3 GLU 83 1HG GLU 83 2.920 15.249 -4.258 35 H GLU 84 H GLU 84 6.044 13.442 -3.269 36 HA GLU 84 HA GLU 84 4.588 11.951 -5.090 37 HB2 GLU 84 2HB GLU 84 7.066 12.005 -5.075 38 HB3 GLU 84 1HB GLU 84 7.066 10.973 -3.643 39 HG2 GLU 84 2HG GLU 84 5.874 9.213 -4.910 40 HG3 GLU 84 1HG GLU 84 5.863 10.250 -6.335 41 H ILE 85 H ILE 85 5.461 11.047 -1.749 42 HA ILE 85 HA ILE 85 4.274 8.527 -1.694 43 HB ILE 85 HB ILE 85 4.437 10.607 0.510 44 HG12 ILE 85 2HG1 ILE 85 6.382 8.394 -0.217 45 HG13 ILE 85 1HG1 ILE 85 6.611 10.097 -0.622 46 HG21 ILE 85 1HG2 ILE 85 4.401 8.679 2.028 47 HG22 ILE 85 2HG2 ILE 85 4.241 7.592 0.656 48 HG23 ILE 85 3HG2 ILE 85 2.941 8.712 1.046 49 HD11 ILE 85 3HD1 ILE 85 7.822 9.761 1.406 50 HD12 ILE 85 1HD1 ILE 85 6.499 8.843 2.126 51 HD13 ILE 85 2HD1 ILE 85 6.332 10.579 1.876 52 H ARG 86 H ARG 86 2.947 11.702 -0.883 53 HA ARG 86 HA ARG 86 0.368 10.863 -0.176 54 HB2 ARG 86 2HB ARG 86 1.379 13.476 -1.307 55 HB3 ARG 86 1HB ARG 86 -0.291 13.237 -0.791 56 HG2 ARG 86 2HG ARG 86 0.436 12.681 1.468 57 HG3 ARG 86 1HG ARG 86 2.128 12.766 0.979 58 HD2 ARG 86 2HD ARG 86 1.439 14.841 2.118 59 HD3 ARG 86 1HD ARG 86 1.856 15.155 0.436 60 HE ARG 86 HE ARG 86 -0.386 15.648 0.005 61 HH11 ARG 86 1HH2 ARG 86 0.045 14.278 3.149 62 HH12 ARG 86 2HH2 ARG 86 -1.569 14.628 3.671 63 HH21 ARG 86 1HH1 ARG 86 -2.501 16.103 0.676 64 HH22 ARG 86 2HH1 ARG 86 -3.011 15.660 2.272 65 H GLU 87 H GLU 87 1.739 11.686 -3.330 66 HA GLU 87 HA GLU 87 -0.771 11.442 -4.724 67 HB2 GLU 87 2HB GLU 87 2.089 11.533 -5.705 68 HB3 GLU 87 1HB GLU 87 0.675 11.541 -6.759 69 HG2 GLU 87 2HG GLU 87 1.192 13.582 -4.580 70 HG3 GLU 87 1HG GLU 87 1.565 13.834 -6.285 71 H ALA 88 H ALA 88 2.220 9.589 -4.961 72 HA ALA 88 HA ALA 88 1.490 7.485 -6.499 73 HB1 ALA 88 1HB ALA 88 3.734 7.577 -5.623 74 HB2 ALA 88 2HB ALA 88 3.029 6.033 -5.140 75 HB3 ALA 88 3HB ALA 88 3.151 7.352 -3.974 76 H PHE 89 H PHE 89 1.025 7.534 -2.961 77 HA PHE 89 HA PHE 89 -0.439 5.121 -2.895 78 HB2 PHE 89 2HB PHE 89 0.004 7.394 -1.004 79 HB3 PHE 89 1HB PHE 89 -1.235 6.188 -0.618 80 HD1 PHE 89 1HD PHE 89 -0.449 3.664 -1.056 81 HD2 PHE 89 2HD PHE 89 2.184 6.954 -0.258 82 HE1 PHE 89 1HE PHE 89 1.310 2.079 -0.317 83 HE2 PHE 89 2HE PHE 89 3.935 5.363 0.484 84 HZ PHE 89 HZ PHE 89 3.504 2.945 0.440 85 H ARG 90 H ARG 90 -1.511 8.523 -3.038 86 HA ARG 90 HA ARG 90 -4.258 8.085 -2.771 87 HB2 ARG 90 2HB ARG 90 -2.648 10.143 -4.258 88 HB3 ARG 90 1HB ARG 90 -4.403 10.141 -4.395 89 HG2 ARG 90 2HG ARG 90 -3.133 10.017 -1.661 90 HG3 ARG 90 1HG ARG 90 -3.235 11.567 -2.496 91 HD2 ARG 90 2HD ARG 90 -5.711 11.147 -2.787 92 HD3 ARG 90 1HD ARG 90 -5.528 9.727 -1.767 93 HE ARG 90 HE ARG 90 -5.256 11.124 0.089 94 HH11 ARG 90 1HH2 ARG 90 -5.282 12.893 -2.883 95 HH12 ARG 90 2HH2 ARG 90 -5.431 14.439 -2.117 96 HH21 ARG 90 1HH1 ARG 90 -5.451 13.143 1.093 97 HH22 ARG 90 2HH1 ARG 90 -5.526 14.581 0.129 98 H VAL 91 H VAL 91 -2.249 7.989 -5.686 99 HA VAL 91 HA VAL 91 -4.318 7.403 -7.513 100 HB VAL 91 HB VAL 91 -1.360 6.774 -7.618 101 HG11 VAL 91 1HG1 VAL 91 -3.553 6.595 -9.696 102 HG12 VAL 91 2HG1 VAL 91 -2.441 5.325 -9.188 103 HG13 VAL 91 3HG1 VAL 91 -1.846 6.696 -10.123 104 HG21 VAL 91 3HG2 VAL 91 -1.417 8.768 -9.192 105 HG22 VAL 91 1HG2 VAL 91 -1.739 9.152 -7.501 106 HG23 VAL 91 2HG2 VAL 91 -3.072 9.053 -8.653 107 H PHE 92 H PHE 92 -2.169 5.343 -5.613 108 HA PHE 92 HA PHE 92 -2.816 2.858 -6.740 109 HB2 PHE 92 2HB PHE 92 -1.797 3.755 -4.079 110 HB3 PHE 92 1HB PHE 92 -2.338 2.092 -4.212 111 HD1 PHE 92 1HD PHE 92 -0.726 4.175 -6.881 112 HD2 PHE 92 2HD PHE 92 -0.297 0.895 -4.137 113 HE1 PHE 92 1HE PHE 92 1.410 3.542 -7.967 114 HE2 PHE 92 2HE PHE 92 1.838 0.266 -5.224 115 HZ PHE 92 HZ PHE 92 2.692 1.589 -7.139 116 H ASP 93 H ASP 93 -4.297 4.440 -3.890 117 HA ASP 93 HA ASP 93 -6.239 2.492 -3.416 118 HB2 ASP 93 2HB ASP 93 -5.677 4.527 -1.981 119 HB3 ASP 93 1HB ASP 93 -6.712 5.457 -3.060 120 H LYS 94 H LYS 94 -6.906 1.743 -5.470 121 HA LYS 94 HA LYS 94 -7.963 3.239 -7.550 122 HB2 LYS 94 2HB LYS 94 -8.023 0.441 -6.693 123 HB3 LYS 94 1HB LYS 94 -9.530 0.885 -7.484 124 HG2 LYS 94 2HG LYS 94 -8.100 0.108 -9.216 125 HG3 LYS 94 1HG LYS 94 -8.096 1.860 -9.365 126 HD2 LYS 94 2HD LYS 94 -5.970 1.900 -8.012 127 HD3 LYS 94 1HD LYS 94 -5.958 0.139 -8.073 128 HE2 LYS 94 2HE LYS 94 -4.557 1.138 -9.869 129 HE3 LYS 94 1HE LYS 94 -5.902 0.201 -10.524 130 HZ1 LYS 94 3HZ LYS 94 -5.400 2.610 -11.373 131 HZ2 LYS 94 1HZ LYS 94 -6.305 3.058 -10.010 132 HZ3 LYS 94 2HZ LYS 94 -7.000 2.064 -11.200 133 H ASP 95 H ASP 95 -9.800 1.694 -4.904 134 HA ASP 95 HA ASP 95 -12.224 3.048 -5.631 135 HB2 ASP 95 2HB ASP 95 -11.411 1.375 -3.251 136 HB3 ASP 95 1HB ASP 95 -13.026 2.058 -3.439 137 H GLY 96 H GLY 96 -9.598 4.397 -4.649 138 HA2 GLY 96 2HA GLY 96 -8.964 6.046 -3.065 139 HA3 GLY 96 1HA GLY 96 -10.272 6.838 -3.929 140 H ASN 97 H ASN 97 -10.281 4.216 -1.518 141 HA ASN 97 HA ASN 97 -12.546 5.324 -0.168 142 HB2 ASN 97 2HB ASN 97 -10.668 3.142 0.754 143 HB3 ASN 97 1HB ASN 97 -12.275 3.478 1.392 144 HD21 ASN 97 1HD2 ASN 97 -13.850 3.791 -0.842 145 HD22 ASN 97 2HD2 ASN 97 -13.803 2.397 -1.810 146 H GLY 98 H GLY 98 -9.236 6.048 -0.040 147 HA2 GLY 98 2HA GLY 98 -8.507 7.971 1.231 148 HA3 GLY 98 1HA GLY 98 -9.607 7.496 2.521 149 H TYR 99 H TYR 99 -8.687 4.625 2.001 150 HA TYR 99 HA TYR 99 -5.981 4.754 3.207 151 HB2 TYR 99 2HB TYR 99 -8.196 2.961 4.231 152 HB3 TYR 99 1HB TYR 99 -6.574 3.158 4.901 153 HD1 TYR 99 1HD TYR 99 -9.797 4.896 4.291 154 HD2 TYR 99 2HD TYR 99 -6.021 4.993 6.338 155 HE1 TYR 99 1HE TYR 99 -10.585 6.812 5.653 156 HE2 TYR 99 2HE TYR 99 -6.812 6.912 7.701 157 HH TYR 99 HH TYR 99 -8.882 8.859 7.106 158 H ILE 100 H ILE 100 -4.654 2.957 2.742 159 HA ILE 100 HA ILE 100 -5.334 1.653 0.259 160 HB ILE 100 HB ILE 100 -2.907 1.074 1.951 161 HG12 ILE 100 2HG1 ILE 100 -3.085 3.510 1.781 162 HG13 ILE 100 1HG1 ILE 100 -1.810 2.944 0.704 163 HG21 ILE 100 1HG2 ILE 100 -3.591 0.915 -1.000 164 HG22 ILE 100 2HG2 ILE 100 -3.048 -0.380 0.062 165 HG23 ILE 100 3HG2 ILE 100 -1.930 0.897 -0.425 166 HD11 ILE 100 3HD1 ILE 100 -4.592 3.859 -0.021 167 HD12 ILE 100 1HD1 ILE 100 -3.603 2.926 -1.142 168 HD13 ILE 100 2HD1 ILE 100 -3.050 4.501 -0.587 169 H SER 101 H SER 101 -5.974 -0.366 -0.118 170 HA SER 101 HA SER 101 -6.287 -2.227 2.161 171 HB2 SER 101 2HB SER 101 -8.423 -1.969 1.273 172 HB3 SER 101 1HB SER 101 -7.821 -1.749 -0.369 173 HG SER 101 HG SER 101 -8.689 -3.965 0.736 174 H ALA 102 H ALA 102 -6.077 -4.518 1.603 175 HA ALA 102 HA ALA 102 -3.553 -5.066 0.397 176 HB1 ALA 102 1HB ALA 102 -3.792 -7.188 1.287 177 HB2 ALA 102 2HB ALA 102 -5.530 -7.229 0.992 178 HB3 ALA 102 3HB ALA 102 -4.885 -6.273 2.321 179 H ALA 103 H ALA 103 -6.881 -5.517 -0.718 180 HA ALA 103 HA ALA 103 -6.290 -7.167 -2.904 181 HB1 ALA 103 1HB ALA 103 -8.475 -6.473 -3.766 182 HB2 ALA 103 2HB ALA 103 -8.518 -5.145 -2.608 183 HB3 ALA 103 3HB ALA 103 -8.564 -6.812 -2.037 184 H GLU 104 H GLU 104 -6.195 -3.669 -2.527 185 HA GLU 104 HA GLU 104 -6.004 -3.015 -5.263 186 HB2 GLU 104 2HB GLU 104 -4.904 -1.520 -2.875 187 HB3 GLU 104 1HB GLU 104 -5.207 -0.849 -4.475 188 HG2 GLU 104 2HG GLU 104 -7.606 -1.386 -4.247 189 HG3 GLU 104 1HG GLU 104 -7.297 -2.049 -2.640 190 H LEU 105 H LEU 105 -3.574 -3.905 -2.846 191 HA LEU 105 HA LEU 105 -1.314 -3.116 -4.381 192 HB2 LEU 105 2HB LEU 105 -1.387 -5.340 -2.351 193 HB3 LEU 105 1HB LEU 105 -0.011 -4.351 -2.821 194 HG LEU 105 HG LEU 105 -2.488 -3.436 -1.344 195 HD11 LEU 105 1HD1 LEU 105 -0.680 -2.811 0.350 196 HD12 LEU 105 2HD1 LEU 105 0.424 -3.790 -0.608 197 HD13 LEU 105 3HD1 LEU 105 -0.988 -4.532 0.146 198 HD21 LEU 105 3HD2 LEU 105 -1.940 -1.604 -2.735 199 HD22 LEU 105 1HD2 LEU 105 -0.208 -1.909 -2.608 200 HD23 LEU 105 2HD2 LEU 105 -1.094 -1.254 -1.233 201 H ARG 106 H ARG 106 -2.810 -6.356 -3.933 202 HA ARG 106 HA ARG 106 -1.021 -7.668 -5.645 203 HB2 ARG 106 2HB ARG 106 -2.730 -9.462 -5.719 204 HB3 ARG 106 1HB ARG 106 -2.409 -8.897 -4.079 205 HG2 ARG 106 2HG ARG 106 -4.384 -7.397 -4.247 206 HG3 ARG 106 1HG ARG 106 -4.743 -8.083 -5.831 207 HD2 ARG 106 2HD ARG 106 -4.857 -10.343 -4.754 208 HD3 ARG 106 1HD ARG 106 -4.686 -9.548 -3.189 209 HE ARG 106 HE ARG 106 -6.818 -8.347 -4.611 210 HH11 ARG 106 1HH2 ARG 106 -5.908 -11.277 -3.032 211 HH12 ARG 106 2HH2 ARG 106 -7.530 -11.711 -2.602 212 HH21 ARG 106 1HH1 ARG 106 -8.941 -8.899 -4.053 213 HH22 ARG 106 2HH1 ARG 106 -9.249 -10.364 -3.182 214 H HIS 107 H HIS 107 -4.228 -6.204 -6.346 215 HA HIS 107 HA HIS 107 -4.420 -7.036 -8.980 216 HB2 HIS 107 2HB HIS 107 -6.292 -6.040 -7.834 217 HB3 HIS 107 1HB HIS 107 -5.415 -4.529 -7.612 218 HD1 HIS 107 1HD HIS 107 -6.012 -6.697 -10.699 219 HD2 HIS 107 2HD HIS 107 -6.422 -2.747 -9.439 220 HE1 HIS 107 1HE HIS 107 -6.893 -5.398 -12.688 221 HE2 HIS 107 2HE HIS 107 -7.147 -2.986 -11.936 222 H VAL 108 H VAL 108 -3.253 -3.819 -7.847 223 HA VAL 108 HA VAL 108 -2.447 -3.026 -10.417 224 HB VAL 108 HB VAL 108 -1.356 -1.171 -9.340 225 HG11 VAL 108 1HG1 VAL 108 -3.758 -1.013 -9.395 226 HG12 VAL 108 2HG1 VAL 108 -3.234 -0.433 -7.816 227 HG13 VAL 108 3HG1 VAL 108 -3.918 -2.050 -7.979 228 HG21 VAL 108 3HG2 VAL 108 -0.102 -2.079 -7.574 229 HG22 VAL 108 1HG2 VAL 108 -1.472 -2.974 -6.924 230 HG23 VAL 108 2HG2 VAL 108 -1.392 -1.221 -6.730 231 H MET 109 H MET 109 -0.789 -4.792 -7.874 232 HA MET 109 HA MET 109 1.851 -4.512 -8.796 233 HB2 MET 109 2HB MET 109 0.395 -6.598 -7.188 234 HB3 MET 109 1HB MET 109 2.047 -6.911 -7.707 235 HG2 MET 109 2HG MET 109 1.356 -4.310 -6.351 236 HG3 MET 109 1HG MET 109 1.661 -5.761 -5.395 237 HE1 MET 109 3HE MET 109 3.400 -2.989 -5.273 238 HE2 MET 109 1HE MET 109 4.917 -3.818 -4.899 239 HE3 MET 109 2HE MET 109 3.398 -4.405 -4.227 240 H THR 110 H THR 110 -0.478 -7.142 -9.469 241 HA THR 110 HA THR 110 1.146 -8.451 -11.374 242 HB THR 110 HB THR 110 -1.860 -8.461 -11.030 243 HG1 THR 110 1HG THR 110 -0.010 -9.329 -9.482 244 HG21 THR 110 3HG2 THR 110 -1.350 -9.253 -13.245 245 HG22 THR 110 1HG2 THR 110 -1.635 -10.674 -12.244 246 HG23 THR 110 2HG2 THR 110 0.013 -10.200 -12.650 247 H ASN 111 H ASN 111 -1.388 -6.032 -11.658 248 HA ASN 111 HA ASN 111 -1.545 -5.882 -14.471 249 HB2 ASN 111 2HB ASN 111 -3.119 -4.846 -12.765 250 HB3 ASN 111 1HB ASN 111 -1.925 -3.568 -12.576 251 HD21 ASN 111 1HD2 ASN 111 -3.259 -1.915 -13.531 252 HD22 ASN 111 2HD2 ASN 111 -3.634 -1.915 -15.187 253 H LEU 112 H LEU 112 0.510 -4.265 -12.106 254 HA LEU 112 HA LEU 112 1.746 -2.430 -13.843 255 HB2 LEU 112 2HB LEU 112 2.527 -3.692 -11.222 256 HB3 LEU 112 1HB LEU 112 3.677 -2.669 -12.079 257 HG LEU 112 HG LEU 112 0.872 -1.658 -11.608 258 HD11 LEU 112 1HD1 LEU 112 3.126 -1.818 -9.602 259 HD12 LEU 112 2HD1 LEU 112 1.441 -2.271 -9.378 260 HD13 LEU 112 3HD1 LEU 112 1.886 -0.571 -9.490 261 HD21 LEU 112 3HD2 LEU 112 2.575 -0.439 -13.055 262 HD22 LEU 112 1HD2 LEU 112 3.553 -0.234 -11.604 263 HD23 LEU 112 2HD2 LEU 112 1.954 0.504 -11.706 264 H GLY 113 H GLY 113 2.455 -5.811 -13.023 265 HA2 GLY 113 2HA GLY 113 3.355 -6.987 -15.119 266 HA3 GLY 113 1HA GLY 113 4.663 -5.814 -15.009 267 H GLU 114 H GLU 114 3.804 -6.348 -11.912 268 HA GLU 114 HA GLU 114 5.787 -8.534 -11.562 269 HB2 GLU 114 2HB GLU 114 5.070 -6.198 -9.771 270 HB3 GLU 114 1HB GLU 114 6.132 -7.525 -9.296 271 HG2 GLU 114 2HG GLU 114 7.656 -7.010 -11.137 272 HG3 GLU 114 1HG GLU 114 6.578 -5.732 -11.699 273 H LYS 115 H LYS 115 4.644 -10.374 -11.294 274 HA LYS 115 HA LYS 115 2.093 -10.367 -9.908 275 HB2 LYS 115 2HB LYS 115 2.920 -11.818 -11.961 276 HB3 LYS 115 1HB LYS 115 3.528 -12.884 -10.702 277 HG2 LYS 115 2HG LYS 115 0.656 -11.945 -11.022 278 HG3 LYS 115 1HG LYS 115 1.266 -13.564 -11.361 279 HD2 LYS 115 2HD LYS 115 2.004 -13.679 -8.933 280 HD3 LYS 115 1HD LYS 115 1.096 -12.189 -8.671 281 HE2 LYS 115 2HE LYS 115 -0.960 -13.273 -9.451 282 HE3 LYS 115 1HE LYS 115 -0.067 -14.764 -9.757 283 HZ1 LYS 115 3HZ LYS 115 0.303 -15.100 -7.505 284 HZ2 LYS 115 1HZ LYS 115 -1.296 -14.540 -7.548 285 HZ3 LYS 115 2HZ LYS 115 -0.040 -13.488 -7.095 286 H LEU 116 H LEU 116 2.578 -9.804 -7.788 287 HA LEU 116 HA LEU 116 4.561 -11.220 -6.245 288 HB2 LEU 116 2HB LEU 116 2.531 -9.080 -5.729 289 HB3 LEU 116 1HB LEU 116 3.125 -9.986 -4.340 290 HG LEU 116 HG LEU 116 5.448 -9.422 -4.974 291 HD11 LEU 116 1HD1 LEU 116 5.782 -7.661 -6.723 292 HD12 LEU 116 2HD1 LEU 116 4.088 -7.840 -7.170 293 HD13 LEU 116 3HD1 LEU 116 5.200 -9.189 -7.379 294 HD21 LEU 116 3HD2 LEU 116 3.496 -7.121 -4.690 295 HD22 LEU 116 1HD2 LEU 116 5.243 -6.935 -4.532 296 HD23 LEU 116 2HD2 LEU 116 4.356 -7.956 -3.399 297 H THR 117 H THR 117 3.446 -11.834 -3.898 298 HA THR 117 HA THR 117 1.571 -14.037 -4.556 299 HB THR 117 HB THR 117 2.389 -14.985 -2.356 300 HG1 THR 117 1HG THR 117 4.142 -12.794 -2.681 301 HG21 THR 117 3HG2 THR 117 4.556 -14.509 -4.416 302 HG22 THR 117 1HG2 THR 117 3.245 -15.671 -4.624 303 HG23 THR 117 2HG2 THR 117 4.412 -15.881 -3.319 304 H ASP 118 H ASP 118 -0.455 -13.840 -3.863 305 HA ASP 118 HA ASP 118 -1.440 -11.636 -2.471 306 HB2 ASP 118 2HB ASP 118 -2.563 -14.411 -2.865 307 HB3 ASP 118 1HB ASP 118 -3.467 -13.122 -2.072 308 H GLU 119 H GLU 119 -0.213 -14.701 -1.299 309 HA GLU 119 HA GLU 119 -1.191 -14.525 1.347 310 HB2 GLU 119 2HB GLU 119 1.276 -15.894 0.248 311 HB3 GLU 119 1HB GLU 119 0.603 -16.158 1.858 312 HG2 GLU 119 2HG GLU 119 -1.517 -16.901 0.872 313 HG3 GLU 119 1HG GLU 119 -0.880 -16.603 -0.743 314 H GLU 120 H GLU 120 1.700 -13.260 -0.239 315 HA GLU 120 HA GLU 120 2.888 -12.306 2.213 316 HB2 GLU 120 2HB GLU 120 3.470 -11.704 -0.693 317 HB3 GLU 120 1HB GLU 120 4.379 -11.009 0.646 318 HG2 GLU 120 2HG GLU 120 5.007 -13.242 1.425 319 HG3 GLU 120 1HG GLU 120 4.035 -13.981 0.153 320 H VAL 121 H VAL 121 1.122 -10.852 -0.506 321 HA VAL 121 HA VAL 121 1.130 -8.188 0.286 322 HB VAL 121 HB VAL 121 -1.035 -9.817 -1.068 323 HG11 VAL 121 1HG1 VAL 121 -2.123 -7.883 -0.148 324 HG12 VAL 121 2HG1 VAL 121 -1.848 -7.558 -1.854 325 HG13 VAL 121 3HG1 VAL 121 -0.797 -6.830 -0.637 326 HG21 VAL 121 3HG2 VAL 121 1.218 -9.552 -2.189 327 HG22 VAL 121 1HG2 VAL 121 0.930 -7.812 -2.210 328 HG23 VAL 121 2HG2 VAL 121 -0.136 -8.894 -3.107 329 H ASP 122 H ASP 122 -1.540 -10.458 0.832 330 HA ASP 122 HA ASP 122 -2.982 -9.016 2.669 331 HB2 ASP 122 2HB ASP 122 -3.565 -11.277 1.654 332 HB3 ASP 122 1HB ASP 122 -2.569 -12.002 2.914 333 H GLU 123 H GLU 123 -0.132 -11.055 3.256 334 HA GLU 123 HA GLU 123 -0.187 -10.785 6.095 335 HB2 GLU 123 2HB GLU 123 1.020 -12.597 4.923 336 HB3 GLU 123 1HB GLU 123 2.170 -11.409 4.305 337 HG2 GLU 123 2HG GLU 123 2.810 -10.805 6.595 338 HG3 GLU 123 1HG GLU 123 1.616 -11.929 7.242 339 H MET 124 H MET 124 1.445 -8.988 3.512 340 HA MET 124 HA MET 124 3.194 -7.429 4.989 341 HB2 MET 124 2HB MET 124 1.673 -6.821 2.456 342 HB3 MET 124 1HB MET 124 2.760 -5.640 3.171 343 HG2 MET 124 2HG MET 124 3.693 -8.460 2.679 344 HG3 MET 124 1HG MET 124 3.713 -7.266 1.382 345 HE1 MET 124 3HE MET 124 6.392 -7.823 1.338 346 HE2 MET 124 1HE MET 124 6.066 -8.914 2.693 347 HE3 MET 124 2HE MET 124 7.386 -7.750 2.791 348 H ILE 125 H ILE 125 -0.044 -6.278 3.916 349 HA ILE 125 HA ILE 125 -0.038 -3.994 5.512 350 HB ILE 125 HB ILE 125 -2.230 -5.648 4.254 351 HG12 ILE 125 2HG1 ILE 125 -1.257 -2.802 3.816 352 HG13 ILE 125 1HG1 ILE 125 -0.800 -4.189 2.832 353 HG21 ILE 125 1HG2 ILE 125 -3.391 -4.842 6.146 354 HG22 ILE 125 2HG2 ILE 125 -3.720 -3.607 4.937 355 HG23 ILE 125 3HG2 ILE 125 -2.493 -3.337 6.161 356 HD11 ILE 125 3HD1 ILE 125 -3.427 -2.756 2.988 357 HD12 ILE 125 1HD1 ILE 125 -3.433 -4.471 2.599 358 HD13 ILE 125 2HD1 ILE 125 -2.563 -3.337 1.569 359 H ARG 126 H ARG 126 -1.257 -7.249 6.153 360 HA ARG 126 HA ARG 126 -2.577 -6.834 8.526 361 HB2 ARG 126 2HB ARG 126 -0.934 -9.136 7.509 362 HB3 ARG 126 1HB ARG 126 -1.724 -9.222 9.078 363 HG2 ARG 126 2HG ARG 126 -3.329 -8.364 6.670 364 HG3 ARG 126 1HG ARG 126 -2.988 -10.076 6.910 365 HD2 ARG 126 2HD ARG 126 -3.951 -9.922 9.199 366 HD3 ARG 126 1HD ARG 126 -4.349 -8.235 8.905 367 HE ARG 126 HE ARG 126 -5.478 -9.821 6.854 368 HH11 ARG 126 1HH2 ARG 126 -5.719 -9.158 10.234 369 HH12 ARG 126 2HH2 ARG 126 -7.414 -9.502 10.327 370 HH21 ARG 126 1HH1 ARG 126 -7.710 -10.268 6.958 371 HH22 ARG 126 2HH1 ARG 126 -8.542 -10.129 8.471 372 H GLU 127 H GLU 127 0.927 -7.200 8.038 373 HA GLU 127 HA GLU 127 1.469 -7.062 10.872 374 HB2 GLU 127 2HB GLU 127 3.308 -6.862 8.483 375 HB3 GLU 127 1HB GLU 127 3.847 -6.917 10.160 376 HG2 GLU 127 2HG GLU 127 2.150 -9.052 8.839 377 HG3 GLU 127 1HG GLU 127 3.896 -9.157 9.046 378 H ALA 128 H ALA 128 1.813 -4.843 8.129 379 HA ALA 128 HA ALA 128 2.897 -2.689 9.616 380 HB1 ALA 128 1HB ALA 128 1.246 -1.760 7.397 381 HB2 ALA 128 2HB ALA 128 2.181 -3.171 6.929 382 HB3 ALA 128 3HB ALA 128 3.003 -1.741 7.557 383 H ASP 129 H ASP 129 -0.440 -3.328 8.572 384 HA ASP 129 HA ASP 129 -1.764 -1.180 9.555 385 HB2 ASP 129 2HB ASP 129 -2.693 -3.300 8.436 386 HB3 ASP 129 1HB ASP 129 -2.843 -3.947 10.059 387 H ILE 130 H ILE 130 -2.046 -0.245 11.432 388 HA ILE 130 HA ILE 130 -1.123 -1.615 13.882 389 HB ILE 130 HB ILE 130 -1.754 1.320 13.492 390 HG12 ILE 130 2HG1 ILE 130 0.871 -0.182 13.270 391 HG13 ILE 130 1HG1 ILE 130 0.043 0.638 11.953 392 HG21 ILE 130 1HG2 ILE 130 -0.069 -0.148 15.554 393 HG22 ILE 130 2HG2 ILE 130 -1.723 0.390 15.834 394 HG23 ILE 130 3HG2 ILE 130 -0.452 1.572 15.549 395 HD11 ILE 130 3HD1 ILE 130 1.798 2.100 12.767 396 HD12 ILE 130 1HD1 ILE 130 1.224 1.939 14.426 397 HD13 ILE 130 2HD1 ILE 130 0.241 2.785 13.230 398 H ASP 131 H ASP 131 -3.950 -0.263 12.366 399 HA ASP 131 HA ASP 131 -5.525 -0.378 14.844 400 HB2 ASP 131 2HB ASP 131 -6.178 0.514 12.033 401 HB3 ASP 131 1HB ASP 131 -7.352 0.484 13.346 402 H GLY 132 H GLY 132 -4.797 -2.323 12.141 403 HA2 GLY 132 2HA GLY 132 -5.475 -4.448 11.546 404 HA3 GLY 132 1HA GLY 132 -6.331 -4.529 13.083 405 H ASP 133 H ASP 133 -6.822 -2.102 10.560 406 HA ASP 133 HA ASP 133 -9.638 -2.981 10.311 407 HB2 ASP 133 2HB ASP 133 -9.990 -0.672 9.405 408 HB3 ASP 133 1HB ASP 133 -9.428 -0.711 11.077 409 H GLY 134 H GLY 134 -7.569 -4.353 8.871 410 HA2 GLY 134 2HA GLY 134 -7.031 -5.080 6.755 411 HA3 GLY 134 1HA GLY 134 -8.685 -4.633 6.363 412 H GLN 135 H GLN 135 -7.012 -1.943 7.454 413 HA GLN 135 HA GLN 135 -5.903 -1.223 4.842 414 HB2 GLN 135 2HB GLN 135 -8.174 0.270 6.168 415 HB3 GLN 135 1HB GLN 135 -7.172 0.948 4.886 416 HG2 GLN 135 2HG GLN 135 -7.779 -1.024 3.457 417 HG3 GLN 135 1HG GLN 135 -8.915 -1.518 4.710 418 HE21 GLN 135 1HE2 GLN 135 -10.858 -0.247 4.990 419 HE22 GLN 135 2HE2 GLN 135 -11.320 0.943 3.870 420 H VAL 136 H VAL 136 -4.525 0.626 4.923 421 HA VAL 136 HA VAL 136 -3.842 1.569 7.645 422 HB VAL 136 HB VAL 136 -1.619 0.959 7.525 423 HG11 VAL 136 1HG1 VAL 136 -3.070 -1.061 7.513 424 HG12 VAL 136 2HG1 VAL 136 -1.480 -1.342 6.805 425 HG13 VAL 136 3HG1 VAL 136 -2.888 -1.127 5.758 426 HG21 VAL 136 3HG2 VAL 136 -0.889 1.984 5.537 427 HG22 VAL 136 1HG2 VAL 136 -1.984 1.031 4.544 428 HG23 VAL 136 2HG2 VAL 136 -0.561 0.273 5.267 429 H ASN 137 H ASN 137 -2.964 3.591 7.782 430 HA ASN 137 HA ASN 137 -3.740 5.449 5.788 431 HB2 ASN 137 2HB ASN 137 -1.682 5.998 7.926 432 HB3 ASN 137 1HB ASN 137 -2.806 7.129 7.172 433 HD21 ASN 137 1HD2 ASN 137 -2.368 5.768 10.061 434 HD22 ASN 137 2HD2 ASN 137 -3.971 5.484 10.537 435 H TYR 138 H TYR 138 -1.462 7.188 5.747 436 HA TYR 138 HA TYR 138 -0.095 6.032 3.495 437 HB2 TYR 138 2HB TYR 138 0.118 8.677 4.929 438 HB3 TYR 138 1HB TYR 138 1.135 8.252 3.553 439 HD1 TYR 138 2HD TYR 138 -2.456 8.447 4.615 440 HD2 TYR 138 1HD TYR 138 0.343 8.560 1.356 441 HE1 TYR 138 2HE TYR 138 -4.288 9.074 3.061 442 HE2 TYR 138 1HE TYR 138 -1.487 9.185 -0.194 443 HH TYR 138 HH TYR 138 -4.366 10.373 0.744 444 H GLU 139 H GLU 139 1.044 7.249 6.672 445 HA GLU 139 HA GLU 139 3.735 6.513 6.333 446 HB2 GLU 139 2HB GLU 139 2.091 6.764 8.858 447 HB3 GLU 139 1HB GLU 139 3.850 6.623 8.823 448 HG2 GLU 139 2HG GLU 139 2.278 8.799 7.408 449 HG3 GLU 139 1HG GLU 139 3.061 8.995 8.974 450 H GLU 140 H GLU 140 1.408 4.892 8.428 451 HA GLU 140 HA GLU 140 2.541 2.574 9.154 452 HB2 GLU 140 2HB GLU 140 -0.200 2.794 7.894 453 HB3 GLU 140 1HB GLU 140 0.377 1.368 8.754 454 HG2 GLU 140 2HG GLU 140 0.628 2.613 10.803 455 HG3 GLU 140 1HG GLU 140 0.297 4.137 9.981 456 H PHE 141 H PHE 141 1.686 3.454 5.894 457 HA PHE 141 HA PHE 141 2.364 0.860 4.755 458 HB2 PHE 141 2HB PHE 141 0.581 2.664 3.927 459 HB3 PHE 141 1HB PHE 141 1.968 3.328 3.086 460 HD1 PHE 141 2HD PHE 141 3.521 1.319 2.002 461 HD2 PHE 141 1HD PHE 141 -0.706 1.185 2.675 462 HE1 PHE 141 2HE PHE 141 3.301 -0.450 0.281 463 HE2 PHE 141 1HE PHE 141 -0.932 -0.587 0.984 464 HZ PHE 141 HZ PHE 141 1.075 -1.408 -0.233 465 H VAL 142 H VAL 142 3.519 4.235 4.458 466 HA VAL 142 HA VAL 142 5.622 4.126 2.827 467 HB VAL 142 HB VAL 142 5.591 5.417 5.557 468 HG11 VAL 142 1HG1 VAL 142 7.462 6.848 4.549 469 HG12 VAL 142 2HG1 VAL 142 7.647 5.572 3.346 470 HG13 VAL 142 3HG1 VAL 142 7.917 5.220 5.054 471 HG21 VAL 142 3HG2 VAL 142 4.034 6.062 3.521 472 HG22 VAL 142 1HG2 VAL 142 5.497 6.802 2.882 473 HG23 VAL 142 2HG2 VAL 142 4.843 7.337 4.429 474 H GLN 143 H GLN 143 6.054 3.306 6.291 475 HA GLN 143 HA GLN 143 8.608 2.416 6.263 476 HB2 GLN 143 2HB GLN 143 6.242 1.116 7.616 477 HB3 GLN 143 1HB GLN 143 7.925 0.736 7.990 478 HG2 GLN 143 2HG GLN 143 8.357 3.035 8.626 479 HG3 GLN 143 1HG GLN 143 6.738 3.519 8.119 480 HE21 GLN 143 1HE2 GLN 143 6.923 4.210 10.607 481 HE22 GLN 143 2HE2 GLN 143 6.320 3.062 11.705 482 H MET 144 H MET 144 5.969 0.051 5.855 483 HA MET 144 HA MET 144 7.603 -1.996 4.848 484 HB2 MET 144 2HB MET 144 4.645 -1.505 4.467 485 HB3 MET 144 1HB MET 144 5.466 -2.991 3.996 486 HG2 MET 144 2HG MET 144 5.536 -1.864 6.806 487 HG3 MET 144 1HG MET 144 4.383 -3.077 6.266 488 HE1 MET 144 3HE MET 144 4.700 -5.440 6.504 489 HE2 MET 144 1HE MET 144 5.089 -4.769 8.093 490 HE3 MET 144 2HE MET 144 6.057 -6.082 7.425 491 H MET 145 H MET 145 5.461 0.224 2.985 492 HA MET 145 HA MET 145 5.345 0.609 0.724 493 HB2 MET 145 2HB MET 145 7.190 2.059 1.389 494 HB3 MET 145 1HB MET 145 8.336 0.751 1.148 495 HG2 MET 145 2HG MET 145 8.339 2.239 -0.790 496 HG3 MET 145 1HG MET 145 7.694 0.676 -1.258 497 HE1 MET 145 3HE MET 145 6.297 4.019 0.489 498 HE2 MET 145 1HE MET 145 5.607 4.715 -0.984 499 HE3 MET 145 2HE MET 145 7.322 4.327 -0.911 500 H THR 146 H THR 146 8.500 -0.851 0.326 501 HA THR 146 HA THR 146 7.310 -3.249 -0.909 502 HB THR 146 HB THR 146 8.998 -2.908 -2.800 503 HG1 THR 146 1HG THR 146 9.162 -0.406 -2.941 504 HG21 THR 146 3HG2 THR 146 6.633 -1.058 -2.420 505 HG22 THR 146 1HG2 THR 146 6.648 -2.624 -3.229 506 HG23 THR 146 2HG2 THR 146 7.477 -1.247 -3.955 507 H ALA 147 H ALA 147 9.111 -2.271 1.467 508 HA ALA 147 HA ALA 147 11.632 -3.566 1.056 509 HB1 ALA 147 1HB ALA 147 10.167 -2.647 3.538 510 HB2 ALA 147 2HB ALA 147 11.540 -1.876 2.745 511 HB3 ALA 147 3HB ALA 147 11.758 -3.405 3.594 512 H LYS 148 H LYS 148 12.171 -5.678 1.306 513 HA LYS 148 HA LYS 148 10.033 -7.568 1.982 514 HB2 LYS 148 2HB LYS 148 11.678 -9.275 1.222 515 HB3 LYS 148 1HB LYS 148 11.313 -8.063 -0.005 516 HG2 LYS 148 2HG LYS 148 13.368 -6.850 0.524 517 HG3 LYS 148 1HG LYS 148 13.714 -7.962 1.846 518 HD2 LYS 148 2HD LYS 148 15.054 -8.655 -0.039 519 HD3 LYS 148 1HD LYS 148 13.762 -9.838 0.155 520 HE2 LYS 148 2HE LYS 148 12.563 -9.010 -1.706 521 HE3 LYS 148 1HE LYS 148 13.448 -7.485 -1.710 522 HZ1 LYS 148 3HZ LYS 148 15.185 -9.729 -1.980 523 HZ2 LYS 148 1HZ LYS 148 15.030 -8.361 -2.970 524 HZ3 LYS 148 2HZ LYS 148 14.013 -9.701 -3.208 Start of MODEL 3 1 H1 ASP 78 1HT ASP 78 16.685 17.985 0.654 2 H2 ASP 78 2HT ASP 78 17.706 16.657 0.382 3 H3 ASP 78 3HT ASP 78 18.311 18.053 1.136 4 HA ASP 78 HA ASP 78 17.648 15.951 2.523 5 HB2 ASP 78 2HB ASP 78 17.240 17.460 4.423 6 HB3 ASP 78 1HB ASP 78 18.561 18.054 3.417 7 H THR 79 H THR 79 15.469 16.744 0.423 8 HA THR 79 HA THR 79 13.171 15.919 2.107 9 HB THR 79 HB THR 79 13.123 18.034 -0.061 10 HG1 THR 79 1HG THR 79 12.492 18.208 2.691 11 HG21 THR 79 3HG2 THR 79 10.963 16.591 1.474 12 HG22 THR 79 1HG2 THR 79 11.060 16.914 -0.257 13 HG23 THR 79 2HG2 THR 79 10.702 18.226 0.867 14 H ASP 80 H ASP 80 12.219 14.122 1.357 15 HA ASP 80 HA ASP 80 12.975 13.113 -1.283 16 HB2 ASP 80 2HB ASP 80 11.750 11.068 -0.537 17 HB3 ASP 80 1HB ASP 80 13.061 11.534 0.545 18 H SER 81 H SER 81 10.559 15.013 -0.013 19 HA SER 81 HA SER 81 8.693 15.926 -1.019 20 HB2 SER 81 2HB SER 81 10.026 15.235 -3.185 21 HB3 SER 81 1HB SER 81 8.802 13.978 -3.302 22 HG SER 81 HG SER 81 8.618 16.647 -3.767 23 H GLU 82 H GLU 82 7.858 14.771 0.927 24 HA GLU 82 HA GLU 82 6.701 12.272 0.982 25 HB2 GLU 82 2HB GLU 82 6.854 13.844 2.910 26 HB3 GLU 82 1HB GLU 82 5.550 14.795 2.202 27 HG2 GLU 82 2HG GLU 82 4.020 12.907 2.370 28 HG3 GLU 82 1HG GLU 82 5.322 11.865 2.950 29 H GLU 83 H GLU 83 5.850 14.922 -0.983 30 HA GLU 83 HA GLU 83 3.075 14.472 -1.289 31 HB2 GLU 83 2HB GLU 83 5.121 15.776 -3.081 32 HB3 GLU 83 1HB GLU 83 3.391 15.773 -3.416 33 HG2 GLU 83 2HG GLU 83 2.954 16.849 -1.243 34 HG3 GLU 83 1HG GLU 83 4.682 16.837 -0.888 35 H GLU 84 H GLU 84 5.824 13.362 -3.336 36 HA GLU 84 HA GLU 84 4.359 12.005 -5.262 37 HB2 GLU 84 2HB GLU 84 6.824 12.195 -5.333 38 HB3 GLU 84 1HB GLU 84 6.938 11.040 -4.004 39 HG2 GLU 84 2HG GLU 84 5.864 9.312 -5.357 40 HG3 GLU 84 1HG GLU 84 5.619 10.458 -6.675 41 H ILE 85 H ILE 85 5.438 10.815 -2.080 42 HA ILE 85 HA ILE 85 4.400 8.230 -2.219 43 HB ILE 85 HB ILE 85 4.533 10.065 0.196 44 HG12 ILE 85 2HG1 ILE 85 6.600 8.093 -0.834 45 HG13 ILE 85 1HG1 ILE 85 6.698 9.840 -1.048 46 HG21 ILE 85 1HG2 ILE 85 4.510 7.044 -0.027 47 HG22 ILE 85 2HG2 ILE 85 3.195 8.044 0.589 48 HG23 ILE 85 3HG2 ILE 85 4.712 7.950 1.466 49 HD11 ILE 85 3HD1 ILE 85 8.001 9.392 0.891 50 HD12 ILE 85 1HD1 ILE 85 6.800 8.271 1.531 51 HD13 ILE 85 2HD1 ILE 85 6.468 10.002 1.509 52 H ARG 86 H ARG 86 2.923 11.233 -1.028 53 HA ARG 86 HA ARG 86 0.429 10.188 -0.304 54 HB2 ARG 86 2HB ARG 86 1.266 12.937 -1.252 55 HB3 ARG 86 1HB ARG 86 -0.380 12.582 -0.735 56 HG2 ARG 86 2HG ARG 86 0.412 11.880 1.457 57 HG3 ARG 86 1HG ARG 86 2.087 12.073 0.954 58 HD2 ARG 86 2HD ARG 86 1.727 14.491 0.646 59 HD3 ARG 86 1HD ARG 86 0.038 14.307 1.115 60 HE ARG 86 HE ARG 86 1.557 13.227 3.182 61 HH11 ARG 86 1HH2 ARG 86 1.090 16.282 1.599 62 HH12 ARG 86 2HH2 ARG 86 1.533 17.220 2.990 63 HH21 ARG 86 1HH1 ARG 86 2.137 14.464 5.002 64 HH22 ARG 86 2HH1 ARG 86 2.130 16.195 4.903 65 H GLU 87 H GLU 87 1.660 11.203 -3.453 66 HA GLU 87 HA GLU 87 -0.879 10.978 -4.787 67 HB2 GLU 87 2HB GLU 87 1.952 11.118 -5.828 68 HB3 GLU 87 1HB GLU 87 0.522 11.108 -6.861 69 HG2 GLU 87 2HG GLU 87 1.004 13.127 -4.652 70 HG3 GLU 87 1HG GLU 87 1.380 13.417 -6.349 71 H ALA 88 H ALA 88 2.087 9.131 -5.294 72 HA ALA 88 HA ALA 88 1.281 7.047 -6.788 73 HB1 ALA 88 1HB ALA 88 2.883 5.579 -5.463 74 HB2 ALA 88 2HB ALA 88 3.101 6.954 -4.377 75 HB3 ALA 88 3HB ALA 88 3.553 7.090 -6.077 76 H PHE 89 H PHE 89 0.944 7.080 -3.246 77 HA PHE 89 HA PHE 89 -0.505 4.661 -3.118 78 HB2 PHE 89 2HB PHE 89 -0.002 6.939 -1.256 79 HB3 PHE 89 1HB PHE 89 -1.264 5.766 -0.837 80 HD1 PHE 89 2HD PHE 89 -0.609 3.242 -1.002 81 HD2 PHE 89 1HD PHE 89 2.247 6.431 -0.752 82 HE1 PHE 89 2HE PHE 89 1.132 1.639 -0.262 83 HE2 PHE 89 1HE PHE 89 3.979 4.824 -0.011 84 HZ PHE 89 HZ PHE 89 3.423 2.444 0.223 85 H ARG 90 H ARG 90 -1.596 8.067 -3.318 86 HA ARG 90 HA ARG 90 -4.339 7.580 -2.973 87 HB2 ARG 90 2HB ARG 90 -2.740 9.702 -4.288 88 HB3 ARG 90 1HB ARG 90 -4.456 9.643 -4.671 89 HG2 ARG 90 2HG ARG 90 -5.015 9.739 -2.288 90 HG3 ARG 90 1HG ARG 90 -3.297 9.738 -1.868 91 HD2 ARG 90 2HD ARG 90 -2.995 11.791 -3.157 92 HD3 ARG 90 1HD ARG 90 -4.707 11.803 -3.549 93 HE ARG 90 HE ARG 90 -3.509 12.510 -0.984 94 HH11 ARG 90 1HH2 ARG 90 -6.341 11.598 -2.763 95 HH12 ARG 90 2HH2 ARG 90 -7.455 12.266 -1.612 96 HH21 ARG 90 1HH1 ARG 90 -4.972 13.378 0.554 97 HH22 ARG 90 2HH1 ARG 90 -6.681 13.266 0.268 98 H VAL 91 H VAL 91 -2.352 7.497 -5.901 99 HA VAL 91 HA VAL 91 -4.397 6.886 -7.744 100 HB VAL 91 HB VAL 91 -1.445 6.197 -7.793 101 HG11 VAL 91 1HG1 VAL 91 -1.847 6.062 -10.285 102 HG12 VAL 91 2HG1 VAL 91 -3.576 6.081 -9.944 103 HG13 VAL 91 3HG1 VAL 91 -2.577 4.751 -9.359 104 HG21 VAL 91 3HG2 VAL 91 -2.971 8.415 -9.186 105 HG22 VAL 91 1HG2 VAL 91 -1.221 8.196 -9.133 106 HG23 VAL 91 2HG2 VAL 91 -2.101 8.633 -7.667 107 H PHE 92 H PHE 92 -2.338 4.856 -5.734 108 HA PHE 92 HA PHE 92 -3.059 2.341 -6.778 109 HB2 PHE 92 2HB PHE 92 -1.944 3.312 -4.188 110 HB3 PHE 92 1HB PHE 92 -2.555 1.673 -4.216 111 HD1 PHE 92 1HD PHE 92 -0.899 3.625 -6.950 112 HD2 PHE 92 2HD PHE 92 -0.615 0.330 -4.207 113 HE1 PHE 92 1HE PHE 92 1.161 2.860 -8.084 114 HE2 PHE 92 2HE PHE 92 1.450 -0.434 -5.344 115 HZ PHE 92 HZ PHE 92 2.336 0.829 -7.286 116 H ASP 93 H ASP 93 -4.469 4.101 -3.991 117 HA ASP 93 HA ASP 93 -6.401 2.311 -3.210 118 HB2 ASP 93 2HB ASP 93 -5.993 4.558 -2.192 119 HB3 ASP 93 1HB ASP 93 -6.841 5.285 -3.540 120 H LYS 94 H LYS 94 -7.234 1.082 -4.899 121 HA LYS 94 HA LYS 94 -8.158 1.954 -7.357 122 HB2 LYS 94 2HB LYS 94 -8.164 -0.461 -5.912 123 HB3 LYS 94 1HB LYS 94 -9.864 -0.178 -6.247 124 HG2 LYS 94 2HG LYS 94 -9.144 -1.389 -8.126 125 HG3 LYS 94 1HG LYS 94 -9.081 0.275 -8.696 126 HD2 LYS 94 2HD LYS 94 -6.669 0.359 -8.192 127 HD3 LYS 94 1HD LYS 94 -6.736 -1.295 -7.591 128 HE2 LYS 94 2HE LYS 94 -5.928 -1.294 -9.896 129 HE3 LYS 94 1HE LYS 94 -7.521 -2.048 -9.824 130 HZ1 LYS 94 3HZ LYS 94 -8.534 -0.106 -10.645 131 HZ2 LYS 94 1HZ LYS 94 -7.188 -0.374 -11.640 132 HZ3 LYS 94 2HZ LYS 94 -7.127 0.822 -10.435 133 H ASP 95 H ASP 95 -10.141 1.366 -4.470 134 HA ASP 95 HA ASP 95 -12.460 2.586 -5.579 135 HB2 ASP 95 2HB ASP 95 -11.682 1.783 -2.774 136 HB3 ASP 95 1HB ASP 95 -13.263 2.446 -3.185 137 H GLY 96 H GLY 96 -9.704 4.001 -5.011 138 HA2 GLY 96 2HA GLY 96 -8.955 6.028 -4.103 139 HA3 GLY 96 1HA GLY 96 -10.221 6.593 -5.178 140 H ASN 97 H ASN 97 -10.234 4.963 -1.983 141 HA ASN 97 HA ASN 97 -12.154 7.009 -1.042 142 HB2 ASN 97 2HB ASN 97 -12.667 5.339 0.759 143 HB3 ASN 97 1HB ASN 97 -13.082 4.822 -0.873 144 HD21 ASN 97 1HD2 ASN 97 -9.681 4.811 -0.084 145 HD22 ASN 97 2HD2 ASN 97 -9.537 3.131 0.114 146 H GLY 98 H GLY 98 -8.992 6.827 -1.048 147 HA2 GLY 98 2HA GLY 98 -7.427 7.945 0.240 148 HA3 GLY 98 1HA GLY 98 -8.720 8.383 1.349 149 H TYR 99 H TYR 99 -7.944 5.095 0.410 150 HA TYR 99 HA TYR 99 -6.449 4.556 2.843 151 HB2 TYR 99 2HB TYR 99 -9.247 3.514 2.396 152 HB3 TYR 99 1HB TYR 99 -8.099 2.717 3.466 153 HD1 TYR 99 2HD TYR 99 -7.060 4.038 5.367 154 HD2 TYR 99 1HD TYR 99 -10.405 5.474 3.096 155 HE1 TYR 99 2HE TYR 99 -7.573 5.673 7.161 156 HE2 TYR 99 1HE TYR 99 -10.919 7.116 4.882 157 HH TYR 99 HH TYR 99 -10.520 7.417 7.268 158 H ILE 100 H ILE 100 -5.619 2.279 2.853 159 HA ILE 100 HA ILE 100 -5.505 1.161 0.087 160 HB ILE 100 HB ILE 100 -3.344 1.204 2.194 161 HG12 ILE 100 2HG1 ILE 100 -3.769 3.433 1.219 162 HG13 ILE 100 1HG1 ILE 100 -2.221 2.799 0.672 163 HG21 ILE 100 1HG2 ILE 100 -2.940 -0.720 0.921 164 HG22 ILE 100 2HG2 ILE 100 -1.986 0.512 0.086 165 HG23 ILE 100 3HG2 ILE 100 -3.542 0.014 -0.566 166 HD11 ILE 100 3HD1 ILE 100 -3.114 3.572 -1.324 167 HD12 ILE 100 1HD1 ILE 100 -4.759 3.163 -0.864 168 HD13 ILE 100 2HD1 ILE 100 -3.647 1.900 -1.366 169 H SER 101 H SER 101 -6.270 -0.830 -0.109 170 HA SER 101 HA SER 101 -6.406 -2.613 2.251 171 HB2 SER 101 2HB SER 101 -8.596 -2.421 1.420 172 HB3 SER 101 1HB SER 101 -8.057 -2.380 -0.257 173 HG SER 101 HG SER 101 -8.977 -4.431 0.646 174 H ALA 102 H ALA 102 -6.076 -4.904 1.797 175 HA ALA 102 HA ALA 102 -3.619 -5.346 0.438 176 HB1 ALA 102 1HB ALA 102 -3.761 -6.816 2.197 177 HB2 ALA 102 2HB ALA 102 -4.462 -7.863 0.972 178 HB3 ALA 102 3HB ALA 102 -5.512 -6.955 2.061 179 H ALA 103 H ALA 103 -6.974 -6.064 -0.374 180 HA ALA 103 HA ALA 103 -6.492 -7.789 -2.525 181 HB1 ALA 103 1HB ALA 103 -8.691 -7.620 -1.616 182 HB2 ALA 103 2HB ALA 103 -8.779 -7.030 -3.277 183 HB3 ALA 103 3HB ALA 103 -8.750 -5.886 -1.934 184 H GLU 104 H GLU 104 -6.598 -4.261 -2.364 185 HA GLU 104 HA GLU 104 -6.565 -3.808 -5.160 186 HB2 GLU 104 2HB GLU 104 -5.545 -2.033 -2.926 187 HB3 GLU 104 1HB GLU 104 -5.965 -1.521 -4.568 188 HG2 GLU 104 2HG GLU 104 -8.287 -2.290 -4.204 189 HG3 GLU 104 1HG GLU 104 -7.855 -2.767 -2.558 190 H LEU 105 H LEU 105 -4.021 -4.382 -2.770 191 HA LEU 105 HA LEU 105 -1.837 -3.461 -4.307 192 HB2 LEU 105 2HB LEU 105 -1.970 -5.633 -2.219 193 HB3 LEU 105 1HB LEU 105 -0.479 -4.927 -2.842 194 HG LEU 105 HG LEU 105 -2.693 -3.397 -1.448 195 HD11 LEU 105 1HD1 LEU 105 0.087 -4.078 -0.449 196 HD12 LEU 105 2HD1 LEU 105 -1.366 -4.958 -0.002 197 HD13 LEU 105 3HD1 LEU 105 -1.196 -3.282 0.445 198 HD21 LEU 105 3HD2 LEU 105 -0.130 -2.574 -2.789 199 HD22 LEU 105 1HD2 LEU 105 -0.658 -1.691 -1.366 200 HD23 LEU 105 2HD2 LEU 105 -1.696 -1.762 -2.768 201 H ARG 106 H ARG 106 -3.206 -6.752 -3.996 202 HA ARG 106 HA ARG 106 -1.362 -7.884 -5.821 203 HB2 ARG 106 2HB ARG 106 -3.129 -9.728 -5.991 204 HB3 ARG 106 1HB ARG 106 -2.426 -9.425 -4.403 205 HG2 ARG 106 2HG ARG 106 -4.366 -8.012 -3.814 206 HG3 ARG 106 1HG ARG 106 -5.063 -8.321 -5.405 207 HD2 ARG 106 2HD ARG 106 -4.340 -10.510 -3.454 208 HD3 ARG 106 1HD ARG 106 -5.941 -9.800 -3.559 209 HE ARG 106 HE ARG 106 -5.141 -10.601 -6.140 210 HH11 ARG 106 1HH2 ARG 106 -6.070 -11.901 -3.051 211 HH12 ARG 106 2HH2 ARG 106 -6.649 -13.397 -3.707 212 HH21 ARG 106 1HH1 ARG 106 -5.894 -12.577 -6.994 213 HH22 ARG 106 2HH1 ARG 106 -6.550 -13.777 -5.929 214 H HIS 107 H HIS 107 -4.655 -6.573 -6.265 215 HA HIS 107 HA HIS 107 -4.855 -7.275 -9.009 216 HB2 HIS 107 2HB HIS 107 -6.776 -6.692 -7.613 217 HB3 HIS 107 1HB HIS 107 -6.161 -5.051 -7.441 218 HD1 HIS 107 1HD HIS 107 -5.671 -3.898 -9.985 219 HD2 HIS 107 2HD HIS 107 -8.597 -6.848 -9.654 220 HE1 HIS 107 1HE HIS 107 -7.200 -3.619 -11.987 221 HE2 HIS 107 2HE HIS 107 -8.991 -5.409 -11.796 222 H VAL 108 H VAL 108 -3.989 -4.179 -7.430 223 HA VAL 108 HA VAL 108 -3.496 -2.801 -9.857 224 HB VAL 108 HB VAL 108 -3.849 -1.801 -7.508 225 HG11 VAL 108 1HG1 VAL 108 -1.936 -1.464 -6.130 226 HG12 VAL 108 2HG1 VAL 108 -0.841 -2.057 -7.378 227 HG13 VAL 108 3HG1 VAL 108 -1.926 -3.168 -6.554 228 HG21 VAL 108 3HG2 VAL 108 -2.565 0.195 -8.094 229 HG22 VAL 108 1HG2 VAL 108 -3.270 -0.495 -9.554 230 HG23 VAL 108 2HG2 VAL 108 -1.561 -0.742 -9.200 231 H MET 109 H MET 109 -1.221 -4.382 -7.585 232 HA MET 109 HA MET 109 1.112 -3.829 -9.044 233 HB2 MET 109 2HB MET 109 0.456 -6.138 -7.223 234 HB3 MET 109 1HB MET 109 2.064 -5.813 -7.854 235 HG2 MET 109 2HG MET 109 0.456 -3.751 -6.320 236 HG3 MET 109 1HG MET 109 1.613 -4.832 -5.546 237 HE1 MET 109 3HE MET 109 4.922 -4.125 -7.054 238 HE2 MET 109 1HE MET 109 3.777 -5.290 -6.382 239 HE3 MET 109 2HE MET 109 4.371 -3.966 -5.389 240 H THR 110 H THR 110 -1.050 -6.645 -9.141 241 HA THR 110 HA THR 110 0.340 -8.082 -11.121 242 HB THR 110 HB THR 110 -2.615 -8.070 -10.449 243 HG1 THR 110 1HG THR 110 -0.403 -9.611 -9.574 244 HG21 THR 110 3HG2 THR 110 -2.487 -10.391 -11.459 245 HG22 THR 110 1HG2 THR 110 -0.896 -9.956 -12.079 246 HG23 THR 110 2HG2 THR 110 -2.323 -9.069 -12.615 247 H ASN 111 H ASN 111 -2.140 -5.589 -11.282 248 HA ASN 111 HA ASN 111 -2.553 -5.724 -14.117 249 HB2 ASN 111 2HB ASN 111 -4.217 -4.771 -12.601 250 HB3 ASN 111 1HB ASN 111 -3.097 -3.490 -12.152 251 HD21 ASN 111 1HD2 ASN 111 -3.903 -4.899 -15.378 252 HD22 ASN 111 2HD2 ASN 111 -4.332 -3.412 -16.078 253 H LEU 112 H LEU 112 -0.491 -3.891 -11.962 254 HA LEU 112 HA LEU 112 0.537 -2.029 -13.830 255 HB2 LEU 112 2HB LEU 112 1.492 -3.092 -11.190 256 HB3 LEU 112 1HB LEU 112 2.524 -2.021 -12.121 257 HG LEU 112 HG LEU 112 -0.351 -1.341 -11.440 258 HD11 LEU 112 1HD1 LEU 112 0.647 -1.560 -9.308 259 HD12 LEU 112 2HD1 LEU 112 0.759 0.160 -9.668 260 HD13 LEU 112 3HD1 LEU 112 2.177 -0.873 -9.853 261 HD21 LEU 112 3HD2 LEU 112 0.784 1.043 -11.688 262 HD22 LEU 112 1HD2 LEU 112 0.295 0.152 -13.122 263 HD23 LEU 112 2HD2 LEU 112 1.983 0.159 -12.622 264 H GLY 113 H GLY 113 1.427 -5.323 -12.987 265 HA2 GLY 113 2HA GLY 113 2.416 -6.651 -14.822 266 HA3 GLY 113 1HA GLY 113 3.472 -5.282 -15.153 267 H GLU 114 H GLU 114 3.415 -5.054 -11.998 268 HA GLU 114 HA GLU 114 5.945 -6.331 -11.612 269 HB2 GLU 114 2HB GLU 114 4.016 -5.012 -9.689 270 HB3 GLU 114 1HB GLU 114 5.613 -5.599 -9.225 271 HG2 GLU 114 2HG GLU 114 5.123 -3.591 -11.442 272 HG3 GLU 114 1HG GLU 114 5.570 -3.151 -9.795 273 H LYS 115 H LYS 115 6.429 -7.971 -10.011 274 HA LYS 115 HA LYS 115 4.263 -9.989 -9.745 275 HB2 LYS 115 2HB LYS 115 7.265 -10.322 -9.926 276 HB3 LYS 115 1HB LYS 115 6.131 -11.638 -9.612 277 HG2 LYS 115 2HG LYS 115 4.979 -11.152 -11.742 278 HG3 LYS 115 1HG LYS 115 6.124 -9.848 -12.062 279 HD2 LYS 115 2HD LYS 115 7.979 -11.447 -12.075 280 HD3 LYS 115 1HD LYS 115 6.871 -12.761 -11.683 281 HE2 LYS 115 2HE LYS 115 7.313 -12.759 -14.088 282 HE3 LYS 115 1HE LYS 115 5.632 -12.313 -13.796 283 HZ1 LYS 115 3HZ LYS 115 7.552 -10.130 -13.877 284 HZ2 LYS 115 1HZ LYS 115 5.972 -10.212 -14.488 285 HZ3 LYS 115 2HZ LYS 115 7.253 -10.918 -15.353 286 H LEU 116 H LEU 116 3.785 -10.840 -7.783 287 HA LEU 116 HA LEU 116 5.518 -10.493 -5.497 288 HB2 LEU 116 2HB LEU 116 4.007 -9.197 -4.159 289 HB3 LEU 116 1HB LEU 116 4.248 -8.320 -5.668 290 HG LEU 116 HG LEU 116 1.866 -10.064 -4.949 291 HD11 LEU 116 1HD1 LEU 116 0.651 -8.074 -4.760 292 HD12 LEU 116 2HD1 LEU 116 1.849 -7.139 -5.643 293 HD13 LEU 116 3HD1 LEU 116 2.178 -7.670 -3.998 294 HD21 LEU 116 3HD2 LEU 116 2.105 -10.392 -7.281 295 HD22 LEU 116 1HD2 LEU 116 2.720 -8.756 -7.541 296 HD23 LEU 116 2HD2 LEU 116 1.013 -9.016 -7.188 297 H THR 117 H THR 117 4.474 -11.538 -3.498 298 HA THR 117 HA THR 117 2.927 -13.905 -4.340 299 HB THR 117 HB THR 117 3.549 -14.593 -1.894 300 HG1 THR 117 1HG THR 117 5.345 -12.464 -2.417 301 HG21 THR 117 3HG2 THR 117 5.740 -15.412 -2.648 302 HG22 THR 117 1HG2 THR 117 5.710 -14.274 -3.995 303 HG23 THR 117 2HG2 THR 117 4.538 -15.589 -3.927 304 H ASP 118 H ASP 118 0.806 -13.963 -3.946 305 HA ASP 118 HA ASP 118 -0.672 -11.912 -2.779 306 HB2 ASP 118 2HB ASP 118 -2.519 -13.594 -2.640 307 HB3 ASP 118 1HB ASP 118 -1.732 -13.544 -4.213 308 H GLU 119 H GLU 119 0.460 -14.955 -1.318 309 HA GLU 119 HA GLU 119 -0.776 -14.668 1.167 310 HB2 GLU 119 2HB GLU 119 1.930 -15.901 0.598 311 HB3 GLU 119 1HB GLU 119 0.885 -16.253 1.971 312 HG2 GLU 119 2HG GLU 119 -0.900 -16.913 0.236 313 HG3 GLU 119 1HG GLU 119 0.403 -16.872 -0.944 314 H GLU 120 H GLU 120 2.045 -13.125 -0.173 315 HA GLU 120 HA GLU 120 3.032 -12.093 2.349 316 HB2 GLU 120 2HB GLU 120 4.559 -12.458 0.423 317 HB3 GLU 120 1HB GLU 120 3.702 -11.201 -0.468 318 HG2 GLU 120 2HG GLU 120 4.272 -9.566 1.302 319 HG3 GLU 120 1HG GLU 120 5.145 -10.828 2.172 320 H VAL 121 H VAL 121 1.135 -10.900 -0.404 321 HA VAL 121 HA VAL 121 0.850 -8.222 0.289 322 HB VAL 121 HB VAL 121 -1.163 -10.128 -0.929 323 HG11 VAL 121 1HG1 VAL 121 -2.176 -7.965 -1.806 324 HG12 VAL 121 2HG1 VAL 121 -1.202 -7.140 -0.595 325 HG13 VAL 121 3HG1 VAL 121 -2.429 -8.294 -0.094 326 HG21 VAL 121 3HG2 VAL 121 0.549 -8.005 -2.239 327 HG22 VAL 121 1HG2 VAL 121 -0.448 -9.226 -3.037 328 HG23 VAL 121 2HG2 VAL 121 1.009 -9.706 -2.157 329 H ASP 122 H ASP 122 -1.618 -10.687 0.945 330 HA ASP 122 HA ASP 122 -3.159 -9.348 2.783 331 HB2 ASP 122 2HB ASP 122 -3.517 -11.675 1.851 332 HB3 ASP 122 1HB ASP 122 -2.373 -12.257 3.057 333 H GLU 123 H GLU 123 -0.170 -11.218 3.466 334 HA GLU 123 HA GLU 123 -0.239 -10.663 6.271 335 HB2 GLU 123 2HB GLU 123 1.007 -12.566 5.300 336 HB3 GLU 123 1HB GLU 123 2.125 -11.424 4.553 337 HG2 GLU 123 2HG GLU 123 2.745 -10.557 6.777 338 HG3 GLU 123 1HG GLU 123 1.613 -11.675 7.533 339 H MET 124 H MET 124 1.037 -8.975 3.488 340 HA MET 124 HA MET 124 2.949 -7.295 4.603 341 HB2 MET 124 2HB MET 124 2.281 -7.538 2.166 342 HB3 MET 124 1HB MET 124 0.968 -6.416 2.511 343 HG2 MET 124 2HG MET 124 2.764 -5.096 1.685 344 HG3 MET 124 1HG MET 124 2.709 -4.821 3.425 345 HE1 MET 124 3HE MET 124 5.164 -4.430 1.199 346 HE2 MET 124 1HE MET 124 4.688 -5.944 0.414 347 HE3 MET 124 2HE MET 124 6.294 -5.780 1.117 348 H ILE 125 H ILE 125 -0.373 -6.180 3.834 349 HA ILE 125 HA ILE 125 -0.253 -3.871 5.368 350 HB ILE 125 HB ILE 125 -2.520 -5.595 4.368 351 HG12 ILE 125 2HG1 ILE 125 -1.715 -2.719 3.755 352 HG13 ILE 125 1HG1 ILE 125 -1.249 -4.119 2.796 353 HG21 ILE 125 1HG2 ILE 125 -3.631 -4.816 6.252 354 HG22 ILE 125 2HG2 ILE 125 -3.953 -3.487 5.141 355 HG23 ILE 125 3HG2 ILE 125 -2.679 -3.341 6.338 356 HD11 ILE 125 3HD1 ILE 125 -3.965 -2.867 3.103 357 HD12 ILE 125 1HD1 ILE 125 -3.842 -4.576 2.721 358 HD13 ILE 125 2HD1 ILE 125 -3.146 -3.390 1.633 359 H ARG 126 H ARG 126 -1.405 -7.109 6.220 360 HA ARG 126 HA ARG 126 -2.545 -6.702 8.658 361 HB2 ARG 126 2HB ARG 126 -0.750 -8.898 7.673 362 HB3 ARG 126 1HB ARG 126 -1.511 -8.981 9.254 363 HG2 ARG 126 2HG ARG 126 -3.230 -8.358 6.854 364 HG3 ARG 126 1HG ARG 126 -2.716 -10.021 7.122 365 HD2 ARG 126 2HD ARG 126 -4.072 -8.335 9.239 366 HD3 ARG 126 1HD ARG 126 -4.928 -9.447 8.179 367 HE ARG 126 HE ARG 126 -2.956 -10.990 9.259 368 HH11 ARG 126 1HH2 ARG 126 -5.375 -8.855 10.510 369 HH12 ARG 126 2HH2 ARG 126 -5.574 -9.725 11.996 370 HH21 ARG 126 1HH1 ARG 126 -3.221 -12.150 11.202 371 HH22 ARG 126 2HH1 ARG 126 -4.357 -11.590 12.386 372 H GLU 127 H GLU 127 0.965 -6.858 8.010 373 HA GLU 127 HA GLU 127 1.649 -6.624 10.784 374 HB2 GLU 127 2HB GLU 127 3.283 -6.263 8.272 375 HB3 GLU 127 1HB GLU 127 3.952 -6.197 9.905 376 HG2 GLU 127 2HG GLU 127 3.196 -8.470 10.355 377 HG3 GLU 127 1HG GLU 127 2.404 -8.547 8.780 378 H ALA 128 H ALA 128 1.827 -4.355 8.049 379 HA ALA 128 HA ALA 128 2.695 -2.130 9.542 380 HB1 ALA 128 1HB ALA 128 2.893 -1.527 7.359 381 HB2 ALA 128 2HB ALA 128 1.219 -1.004 7.481 382 HB3 ALA 128 3HB ALA 128 1.596 -2.607 6.850 383 H ASP 129 H ASP 129 -0.598 -3.062 8.570 384 HA ASP 129 HA ASP 129 -2.132 -1.043 9.473 385 HB2 ASP 129 2HB ASP 129 -2.765 -3.425 8.630 386 HB3 ASP 129 1HB ASP 129 -2.882 -3.828 10.327 387 H ILE 130 H ILE 130 -2.116 0.114 11.236 388 HA ILE 130 HA ILE 130 -1.122 -1.030 13.768 389 HB ILE 130 HB ILE 130 -1.723 1.864 13.112 390 HG12 ILE 130 2HG1 ILE 130 0.849 0.272 12.996 391 HG13 ILE 130 1HG1 ILE 130 0.039 1.034 11.632 392 HG21 ILE 130 1HG2 ILE 130 -1.650 1.138 15.557 393 HG22 ILE 130 2HG2 ILE 130 -0.444 2.338 15.119 394 HG23 ILE 130 3HG2 ILE 130 0.017 0.643 15.281 395 HD11 ILE 130 3HD1 ILE 130 0.317 3.252 12.846 396 HD12 ILE 130 1HD1 ILE 130 1.816 2.515 12.274 397 HD13 ILE 130 2HD1 ILE 130 1.378 2.408 13.976 398 H ASP 131 H ASP 131 -3.980 0.349 12.307 399 HA ASP 131 HA ASP 131 -5.432 0.533 14.809 400 HB2 ASP 131 2HB ASP 131 -6.250 0.855 11.920 401 HB3 ASP 131 1HB ASP 131 -7.374 1.017 13.268 402 H GLY 132 H GLY 132 -4.921 -1.828 12.338 403 HA2 GLY 132 2HA GLY 132 -5.550 -4.054 12.203 404 HA3 GLY 132 1HA GLY 132 -6.205 -3.907 13.832 405 H ASP 133 H ASP 133 -7.083 -2.008 10.980 406 HA ASP 133 HA ASP 133 -9.889 -2.886 11.286 407 HB2 ASP 133 2HB ASP 133 -10.355 -0.860 9.888 408 HB3 ASP 133 1HB ASP 133 -9.616 -0.514 11.449 409 H GLY 134 H GLY 134 -7.200 -2.820 9.042 410 HA2 GLY 134 2HA GLY 134 -7.208 -4.660 7.376 411 HA3 GLY 134 1HA GLY 134 -8.866 -4.213 7.009 412 H GLN 135 H GLN 135 -6.961 -1.503 7.670 413 HA GLN 135 HA GLN 135 -6.023 -1.168 4.928 414 HB2 GLN 135 2HB GLN 135 -8.096 0.637 6.182 415 HB3 GLN 135 1HB GLN 135 -7.149 1.069 4.759 416 HG2 GLN 135 2HG GLN 135 -7.979 -1.048 3.661 417 HG3 GLN 135 1HG GLN 135 -9.058 -1.266 5.033 418 HE21 GLN 135 1HE2 GLN 135 -10.883 0.217 5.247 419 HE22 GLN 135 2HE2 GLN 135 -11.354 1.219 3.959 420 H VAL 136 H VAL 136 -4.572 0.603 4.666 421 HA VAL 136 HA VAL 136 -3.590 1.828 7.163 422 HB VAL 136 HB VAL 136 -1.439 1.035 6.958 423 HG11 VAL 136 1HG1 VAL 136 -2.895 -1.181 5.562 424 HG12 VAL 136 2HG1 VAL 136 -3.047 -0.848 7.289 425 HG13 VAL 136 3HG1 VAL 136 -1.487 -1.325 6.617 426 HG21 VAL 136 3HG2 VAL 136 -2.013 0.719 4.031 427 HG22 VAL 136 1HG2 VAL 136 -0.571 0.021 4.767 428 HG23 VAL 136 2HG2 VAL 136 -0.824 1.764 4.800 429 H ASN 137 H ASN 137 -2.684 3.813 6.944 430 HA ASN 137 HA ASN 137 -3.401 5.307 4.612 431 HB2 ASN 137 2HB ASN 137 -3.264 6.147 7.052 432 HB3 ASN 137 1HB ASN 137 -1.534 6.311 6.753 433 HD21 ASN 137 1HD2 ASN 137 -4.705 7.301 5.343 434 HD22 ASN 137 2HD2 ASN 137 -4.130 8.770 4.716 435 H TYR 138 H TYR 138 -1.054 7.053 4.615 436 HA TYR 138 HA TYR 138 0.456 5.655 2.615 437 HB2 TYR 138 2HB TYR 138 1.212 8.319 3.791 438 HB3 TYR 138 1HB TYR 138 1.439 7.732 2.143 439 HD1 TYR 138 1HD TYR 138 -1.062 6.736 1.257 440 HD2 TYR 138 2HD TYR 138 -0.332 10.084 3.840 441 HE1 TYR 138 1HE TYR 138 -3.244 7.713 0.598 442 HE2 TYR 138 2HE TYR 138 -2.520 11.068 3.180 443 HH TYR 138 HH TYR 138 -4.910 9.669 2.084 444 H GLU 139 H GLU 139 1.396 7.157 5.737 445 HA GLU 139 HA GLU 139 4.060 6.309 5.711 446 HB2 GLU 139 2HB GLU 139 2.207 6.876 8.023 447 HB3 GLU 139 1HB GLU 139 3.938 6.570 8.214 448 HG2 GLU 139 2HG GLU 139 4.462 8.428 6.719 449 HG3 GLU 139 1HG GLU 139 2.746 8.716 6.440 450 H GLU 140 H GLU 140 1.576 4.935 7.778 451 HA GLU 140 HA GLU 140 2.593 2.659 8.767 452 HB2 GLU 140 2HB GLU 140 -0.090 2.846 7.362 453 HB3 GLU 140 1HB GLU 140 0.399 1.468 8.356 454 HG2 GLU 140 2HG GLU 140 0.619 2.901 10.308 455 HG3 GLU 140 1HG GLU 140 0.294 4.336 9.332 456 H PHE 141 H PHE 141 1.886 3.255 5.426 457 HA PHE 141 HA PHE 141 2.558 0.570 4.518 458 HB2 PHE 141 2HB PHE 141 0.879 2.381 3.458 459 HB3 PHE 141 1HB PHE 141 2.326 2.884 2.616 460 HD1 PHE 141 1HD PHE 141 3.827 0.762 1.773 461 HD2 PHE 141 2HD PHE 141 -0.419 0.790 2.368 462 HE1 PHE 141 1HE PHE 141 3.595 -1.165 0.230 463 HE2 PHE 141 2HE PHE 141 -0.648 -1.120 0.849 464 HZ PHE 141 HZ PHE 141 1.350 -2.109 -0.238 465 H VAL 142 H VAL 142 3.840 3.870 4.004 466 HA VAL 142 HA VAL 142 6.060 3.493 2.503 467 HB VAL 142 HB VAL 142 5.879 5.105 5.044 468 HG11 VAL 142 1HG1 VAL 142 8.219 4.808 4.741 469 HG12 VAL 142 2HG1 VAL 142 7.853 6.367 4.004 470 HG13 VAL 142 3HG1 VAL 142 8.087 4.945 2.986 471 HG21 VAL 142 3HG2 VAL 142 5.221 6.878 3.660 472 HG22 VAL 142 1HG2 VAL 142 4.463 5.512 2.843 473 HG23 VAL 142 2HG2 VAL 142 5.974 6.169 2.230 474 H GLN 143 H GLN 143 6.255 3.234 6.066 475 HA GLN 143 HA GLN 143 8.736 2.179 6.404 476 HB2 GLN 143 2HB GLN 143 6.188 1.441 7.856 477 HB3 GLN 143 1HB GLN 143 7.791 0.938 8.394 478 HG2 GLN 143 2HG GLN 143 8.498 3.290 8.528 479 HG3 GLN 143 1HG GLN 143 6.911 3.807 7.965 480 HE21 GLN 143 1HE2 GLN 143 5.897 4.708 9.778 481 HE22 GLN 143 2HE2 GLN 143 5.800 3.955 11.298 482 H MET 144 H MET 144 6.210 0.697 4.711 483 HA MET 144 HA MET 144 7.291 -2.031 4.917 484 HB2 MET 144 2HB MET 144 4.915 -1.136 3.274 485 HB3 MET 144 1HB MET 144 5.331 -2.764 3.758 486 HG2 MET 144 2HG MET 144 4.621 -0.529 5.672 487 HG3 MET 144 1HG MET 144 3.543 -1.840 5.185 488 HE1 MET 144 3HE MET 144 4.011 -4.120 5.255 489 HE2 MET 144 1HE MET 144 3.414 -4.078 6.920 490 HE3 MET 144 2HE MET 144 4.871 -4.983 6.526 491 H MET 145 H MET 145 6.481 0.345 2.365 492 HA MET 145 HA MET 145 7.354 -0.947 0.132 493 HB2 MET 145 2HB MET 145 7.912 1.953 0.814 494 HB3 MET 145 1HB MET 145 8.008 1.254 -0.800 495 HG2 MET 145 2HG MET 145 5.504 0.446 -0.143 496 HG3 MET 145 1HG MET 145 5.603 1.906 0.835 497 HE1 MET 145 3HE MET 145 7.547 3.872 -1.166 498 HE2 MET 145 1HE MET 145 6.357 4.013 0.135 499 HE3 MET 145 2HE MET 145 6.054 4.768 -1.428 500 H THR 146 H THR 146 9.530 1.161 2.039 501 HA THR 146 HA THR 146 11.809 -0.542 1.172 502 HB THR 146 HB THR 146 12.059 2.378 1.885 503 HG1 THR 146 1HG THR 146 10.864 2.606 0.140 504 HG21 THR 146 3HG2 THR 146 14.038 0.753 1.790 505 HG22 THR 146 1HG2 THR 146 14.169 2.199 0.787 506 HG23 THR 146 2HG2 THR 146 13.736 0.654 0.056 507 H ALA 147 H ALA 147 10.518 -1.377 3.349 508 HA ALA 147 HA ALA 147 11.047 -0.328 5.841 509 HB1 ALA 147 1HB ALA 147 10.729 -2.513 6.705 510 HB2 ALA 147 2HB ALA 147 11.333 -3.268 5.231 511 HB3 ALA 147 3HB ALA 147 9.766 -2.461 5.228 512 H LYS 148 H LYS 148 12.952 0.495 6.479 513 HA LYS 148 HA LYS 148 15.289 -1.244 6.595 514 HB2 LYS 148 2HB LYS 148 15.489 -0.144 4.386 515 HB3 LYS 148 1HB LYS 148 15.387 1.430 5.169 516 HG2 LYS 148 2HG LYS 148 17.442 0.971 6.426 517 HG3 LYS 148 1HG LYS 148 17.526 -0.649 5.730 518 HD2 LYS 148 2HD LYS 148 17.709 0.331 3.469 519 HD3 LYS 148 1HD LYS 148 17.658 1.951 4.170 520 HE2 LYS 148 2HE LYS 148 19.752 -0.141 4.831 521 HE3 LYS 148 1HE LYS 148 19.987 1.179 3.685 522 HZ1 LYS 148 3HZ LYS 148 19.132 1.681 6.466 523 HZ2 LYS 148 1HZ LYS 148 19.832 2.764 5.362 524 HZ3 LYS 148 2HZ LYS 148 20.772 1.530 6.058 Start of MODEL 4 1 H1 ASP 78 1HT ASP 78 7.582 23.870 -0.759 2 H2 ASP 78 2HT ASP 78 8.582 25.244 -0.772 3 H3 ASP 78 3HT ASP 78 8.415 24.324 0.648 4 HA ASP 78 HA ASP 78 10.079 23.873 -1.680 5 HB2 ASP 78 2HB ASP 78 10.138 23.180 1.267 6 HB3 ASP 78 1HB ASP 78 11.374 22.630 0.136 7 H THR 79 H THR 79 7.775 22.082 0.332 8 HA THR 79 HA THR 79 7.068 19.874 0.244 9 HB THR 79 HB THR 79 6.159 19.266 -1.904 10 HG1 THR 79 1HG THR 79 6.836 20.881 -3.651 11 HG21 THR 79 3HG2 THR 79 4.995 21.098 -0.816 12 HG22 THR 79 1HG2 THR 79 5.033 21.401 -2.552 13 HG23 THR 79 2HG2 THR 79 6.138 22.266 -1.483 14 H ASP 80 H ASP 80 9.308 19.246 1.007 15 HA ASP 80 HA ASP 80 11.517 18.462 -0.241 16 HB2 ASP 80 2HB ASP 80 11.058 17.889 2.098 17 HB3 ASP 80 1HB ASP 80 9.934 16.637 1.578 18 H SER 81 H SER 81 9.048 15.890 0.041 19 HA SER 81 HA SER 81 8.832 15.419 -2.745 20 HB2 SER 81 2HB SER 81 10.163 13.493 -3.043 21 HB3 SER 81 1HB SER 81 11.218 14.636 -2.216 22 HG SER 81 HG SER 81 10.108 13.491 -0.268 23 H GLU 82 H GLU 82 8.126 14.918 0.479 24 HA GLU 82 HA GLU 82 6.860 12.507 0.753 25 HB2 GLU 82 2HB GLU 82 7.060 14.248 2.521 26 HB3 GLU 82 1HB GLU 82 5.805 15.185 1.713 27 HG2 GLU 82 2HG GLU 82 4.200 13.360 2.033 28 HG3 GLU 82 1HG GLU 82 5.451 12.362 2.770 29 H GLU 83 H GLU 83 6.048 15.031 -1.413 30 HA GLU 83 HA GLU 83 3.275 14.606 -1.686 31 HB2 GLU 83 2HB GLU 83 5.334 15.702 -3.600 32 HB3 GLU 83 1HB GLU 83 3.595 15.759 -3.885 33 HG2 GLU 83 2HG GLU 83 4.961 16.921 -1.440 34 HG3 GLU 83 1HG GLU 83 4.504 17.861 -2.856 35 H GLU 84 H GLU 84 5.986 13.308 -3.682 36 HA GLU 84 HA GLU 84 4.501 11.839 -5.496 37 HB2 GLU 84 2HB GLU 84 7.024 11.986 -5.413 38 HB3 GLU 84 1HB GLU 84 6.981 10.776 -4.131 39 HG2 GLU 84 2HG GLU 84 7.345 9.580 -6.174 40 HG3 GLU 84 1HG GLU 84 5.666 9.293 -5.727 41 H ILE 85 H ILE 85 5.537 10.856 -2.225 42 HA ILE 85 HA ILE 85 4.402 8.296 -2.146 43 HB ILE 85 HB ILE 85 4.573 10.337 0.099 44 HG12 ILE 85 2HG1 ILE 85 6.564 8.203 -0.726 45 HG13 ILE 85 1HG1 ILE 85 6.744 9.925 -1.065 46 HG21 ILE 85 1HG2 ILE 85 4.572 7.309 0.243 47 HG22 ILE 85 2HG2 ILE 85 3.146 8.303 0.543 48 HG23 ILE 85 3HG2 ILE 85 4.551 8.439 1.595 49 HD11 ILE 85 3HD1 ILE 85 6.489 10.301 1.453 50 HD12 ILE 85 1HD1 ILE 85 7.991 9.531 0.937 51 HD13 ILE 85 2HD1 ILE 85 6.693 8.559 1.632 52 H ARG 86 H ARG 86 3.005 11.452 -1.198 53 HA ARG 86 HA ARG 86 0.476 10.537 -0.433 54 HB2 ARG 86 2HB ARG 86 1.403 13.179 -1.579 55 HB3 ARG 86 1HB ARG 86 -0.244 12.919 -1.018 56 HG2 ARG 86 2HG ARG 86 0.560 12.333 1.207 57 HG3 ARG 86 1HG ARG 86 2.233 12.460 0.669 58 HD2 ARG 86 2HD ARG 86 1.648 14.506 1.833 59 HD3 ARG 86 1HD ARG 86 1.809 14.876 0.120 60 HE ARG 86 HE ARG 86 -0.885 14.218 0.734 61 HH11 ARG 86 1HH2 ARG 86 1.533 16.698 1.079 62 HH12 ARG 86 2HH2 ARG 86 0.382 17.983 1.241 63 HH21 ARG 86 1HH1 ARG 86 -2.390 15.913 0.957 64 HH22 ARG 86 2HH1 ARG 86 -1.832 17.537 1.175 65 H GLU 87 H GLU 87 1.732 11.356 -3.640 66 HA GLU 87 HA GLU 87 -0.803 11.067 -4.960 67 HB2 GLU 87 2HB GLU 87 2.029 11.183 -6.008 68 HB3 GLU 87 1HB GLU 87 0.598 11.110 -7.038 69 HG2 GLU 87 2HG GLU 87 -0.264 13.175 -6.004 70 HG3 GLU 87 1HG GLU 87 1.152 13.245 -4.956 71 H ALA 88 H ALA 88 2.173 9.203 -5.380 72 HA ALA 88 HA ALA 88 1.373 7.051 -6.783 73 HB1 ALA 88 1HB ALA 88 3.657 7.247 -6.008 74 HB2 ALA 88 2HB ALA 88 3.027 5.677 -5.508 75 HB3 ALA 88 3HB ALA 88 3.152 6.991 -4.339 76 H PHE 89 H PHE 89 1.099 7.180 -3.223 77 HA PHE 89 HA PHE 89 -0.360 4.764 -3.022 78 HB2 PHE 89 2HB PHE 89 0.180 7.079 -1.206 79 HB3 PHE 89 1HB PHE 89 -1.040 5.891 -0.734 80 HD1 PHE 89 1HD PHE 89 -0.357 3.401 -0.759 81 HD2 PHE 89 2HD PHE 89 2.481 6.615 -0.901 82 HE1 PHE 89 1HE PHE 89 1.445 1.854 -0.050 83 HE2 PHE 89 2HE PHE 89 4.267 5.073 -0.191 84 HZ PHE 89 HZ PHE 89 3.757 2.700 0.222 85 H ARG 90 H ARG 90 -1.428 8.176 -3.271 86 HA ARG 90 HA ARG 90 -4.162 7.749 -2.817 87 HB2 ARG 90 2HB ARG 90 -2.539 9.794 -4.195 88 HB3 ARG 90 1HB ARG 90 -4.225 9.728 -4.694 89 HG2 ARG 90 2HG ARG 90 -4.934 9.930 -2.342 90 HG3 ARG 90 1HG ARG 90 -3.247 9.964 -1.830 91 HD2 ARG 90 2HD ARG 90 -2.867 11.988 -3.078 92 HD3 ARG 90 1HD ARG 90 -4.502 11.934 -3.727 93 HE ARG 90 HE ARG 90 -5.269 12.815 -1.716 94 HH11 ARG 90 1HH2 ARG 90 -2.053 11.571 -1.378 95 HH12 ARG 90 2HH2 ARG 90 -1.839 12.163 0.233 96 HH21 ARG 90 1HH1 ARG 90 -4.995 13.602 0.416 97 HH22 ARG 90 2HH1 ARG 90 -3.507 13.314 1.250 98 H VAL 91 H VAL 91 -2.295 7.526 -5.825 99 HA VAL 91 HA VAL 91 -4.432 6.855 -7.538 100 HB VAL 91 HB VAL 91 -1.473 6.249 -7.690 101 HG11 VAL 91 1HG1 VAL 91 -2.479 4.623 -9.105 102 HG12 VAL 91 2HG1 VAL 91 -2.036 5.946 -10.182 103 HG13 VAL 91 3HG1 VAL 91 -3.710 5.756 -9.663 104 HG21 VAL 91 3HG2 VAL 91 -3.238 8.316 -9.043 105 HG22 VAL 91 1HG2 VAL 91 -1.515 8.095 -9.346 106 HG23 VAL 91 2HG2 VAL 91 -2.069 8.634 -7.763 107 H PHE 92 H PHE 92 -2.199 4.873 -5.655 108 HA PHE 92 HA PHE 92 -2.844 2.336 -6.557 109 HB2 PHE 92 2HB PHE 92 -1.899 3.432 -3.943 110 HB3 PHE 92 1HB PHE 92 -2.447 1.762 -3.954 111 HD1 PHE 92 1HD PHE 92 -0.780 3.637 -6.726 112 HD2 PHE 92 2HD PHE 92 -0.416 0.580 -3.733 113 HE1 PHE 92 1HE PHE 92 1.368 2.924 -7.722 114 HE2 PHE 92 2HE PHE 92 1.734 -0.134 -4.731 115 HZ PHE 92 HZ PHE 92 2.626 1.036 -6.728 116 H ASP 93 H ASP 93 -4.428 4.022 -3.802 117 HA ASP 93 HA ASP 93 -6.354 2.135 -3.214 118 HB2 ASP 93 2HB ASP 93 -5.931 4.399 -2.098 119 HB3 ASP 93 1HB ASP 93 -6.971 5.086 -3.343 120 H LYS 94 H LYS 94 -7.045 1.050 -5.079 121 HA LYS 94 HA LYS 94 -7.915 2.116 -7.467 122 HB2 LYS 94 2HB LYS 94 -7.922 -0.420 -6.238 123 HB3 LYS 94 1HB LYS 94 -9.604 -0.144 -6.661 124 HG2 LYS 94 2HG LYS 94 -8.733 -1.164 -8.587 125 HG3 LYS 94 1HG LYS 94 -8.662 0.552 -8.997 126 HD2 LYS 94 2HD LYS 94 -6.289 0.602 -8.239 127 HD3 LYS 94 1HD LYS 94 -6.382 -1.127 -7.904 128 HE2 LYS 94 2HE LYS 94 -6.897 -1.575 -10.264 129 HE3 LYS 94 1HE LYS 94 -6.830 0.153 -10.612 130 HZ1 LYS 94 3HZ LYS 94 -4.632 0.087 -10.711 131 HZ2 LYS 94 1HZ LYS 94 -4.730 -1.605 -10.662 132 HZ3 LYS 94 2HZ LYS 94 -4.509 -0.727 -9.223 133 H ASP 95 H ASP 95 -9.959 1.223 -4.713 134 HA ASP 95 HA ASP 95 -12.316 2.420 -5.756 135 HB2 ASP 95 2HB ASP 95 -11.498 1.452 -3.021 136 HB3 ASP 95 1HB ASP 95 -13.087 2.145 -3.333 137 H GLY 96 H GLY 96 -9.642 3.946 -5.148 138 HA2 GLY 96 2HA GLY 96 -8.974 5.961 -4.168 139 HA3 GLY 96 1HA GLY 96 -10.331 6.509 -5.141 140 H ASN 97 H ASN 97 -10.151 4.648 -2.077 141 HA ASN 97 HA ASN 97 -12.140 6.503 -0.934 142 HB2 ASN 97 2HB ASN 97 -12.369 4.721 0.832 143 HB3 ASN 97 1HB ASN 97 -12.874 4.252 -0.786 144 HD21 ASN 97 1HD2 ASN 97 -10.902 3.210 -2.112 145 HD22 ASN 97 2HD2 ASN 97 -9.981 2.085 -1.237 146 H GLY 98 H GLY 98 -9.011 6.656 -1.126 147 HA2 GLY 98 2HA GLY 98 -7.414 7.776 0.125 148 HA3 GLY 98 1HA GLY 98 -8.698 8.195 1.251 149 H TYR 99 H TYR 99 -7.715 4.944 0.341 150 HA TYR 99 HA TYR 99 -6.182 4.511 2.750 151 HB2 TYR 99 2HB TYR 99 -8.976 3.435 2.444 152 HB3 TYR 99 1HB TYR 99 -7.771 2.597 3.420 153 HD1 TYR 99 1HD TYR 99 -6.554 3.935 5.248 154 HD2 TYR 99 2HD TYR 99 -10.137 5.294 3.324 155 HE1 TYR 99 1HE TYR 99 -6.956 5.515 7.117 156 HE2 TYR 99 2HE TYR 99 -10.546 6.878 5.189 157 HH TYR 99 HH TYR 99 -8.754 6.739 8.134 158 H ILE 100 H ILE 100 -5.485 2.115 2.859 159 HA ILE 100 HA ILE 100 -5.235 1.063 0.077 160 HB ILE 100 HB ILE 100 -3.237 0.922 2.327 161 HG12 ILE 100 2HG1 ILE 100 -3.455 3.208 1.474 162 HG13 ILE 100 1HG1 ILE 100 -1.933 2.509 0.939 163 HG21 ILE 100 1HG2 ILE 100 -3.279 -0.115 -0.494 164 HG22 ILE 100 2HG2 ILE 100 -2.805 -0.947 0.988 165 HG23 ILE 100 3HG2 ILE 100 -1.757 0.289 0.294 166 HD11 ILE 100 3HD1 ILE 100 -4.380 3.128 -0.674 167 HD12 ILE 100 1HD1 ILE 100 -3.332 1.804 -1.187 168 HD13 ILE 100 2HD1 ILE 100 -2.683 3.435 -1.042 169 H SER 101 H SER 101 -6.290 -0.796 -0.187 170 HA SER 101 HA SER 101 -6.555 -2.680 2.064 171 HB2 SER 101 2HB SER 101 -8.132 -2.250 -0.477 172 HB3 SER 101 1HB SER 101 -8.210 -3.788 0.376 173 HG SER 101 HG SER 101 -9.558 -1.639 0.907 174 H ALA 102 H ALA 102 -6.249 -4.941 1.595 175 HA ALA 102 HA ALA 102 -3.778 -5.490 0.360 176 HB1 ALA 102 1HB ALA 102 -4.202 -7.081 1.969 177 HB2 ALA 102 2HB ALA 102 -4.851 -7.972 0.594 178 HB3 ALA 102 3HB ALA 102 -5.936 -7.074 1.655 179 H ALA 103 H ALA 103 -7.104 -5.954 -0.797 180 HA ALA 103 HA ALA 103 -6.507 -7.511 -3.040 181 HB1 ALA 103 1HB ALA 103 -8.691 -6.950 -3.803 182 HB2 ALA 103 2HB ALA 103 -8.698 -5.442 -2.889 183 HB3 ALA 103 3HB ALA 103 -8.778 -6.988 -2.043 184 H GLU 104 H GLU 104 -6.366 -4.017 -2.573 185 HA GLU 104 HA GLU 104 -6.100 -3.332 -5.314 186 HB2 GLU 104 2HB GLU 104 -5.117 -1.828 -2.881 187 HB3 GLU 104 1HB GLU 104 -5.386 -1.156 -4.492 188 HG2 GLU 104 2HG GLU 104 -7.778 -1.769 -4.333 189 HG3 GLU 104 1HG GLU 104 -7.491 -2.407 -2.715 190 H LEU 105 H LEU 105 -3.758 -4.167 -2.772 191 HA LEU 105 HA LEU 105 -1.425 -3.367 -4.164 192 HB2 LEU 105 2HB LEU 105 -1.650 -5.628 -2.191 193 HB3 LEU 105 1HB LEU 105 -0.216 -4.672 -2.562 194 HG LEU 105 HG LEU 105 -2.757 -3.716 -1.223 195 HD11 LEU 105 1HD1 LEU 105 -1.396 -3.383 0.711 196 HD12 LEU 105 2HD1 LEU 105 0.085 -3.649 -0.198 197 HD13 LEU 105 3HD1 LEU 105 -1.007 -4.992 0.118 198 HD21 LEU 105 3HD2 LEU 105 -0.411 -2.208 -2.372 199 HD22 LEU 105 1HD2 LEU 105 -1.323 -1.557 -1.016 200 HD23 LEU 105 2HD2 LEU 105 -2.134 -1.872 -2.544 201 H ARG 106 H ARG 106 -2.885 -6.627 -3.838 202 HA ARG 106 HA ARG 106 -1.037 -7.895 -5.532 203 HB2 ARG 106 2HB ARG 106 -2.720 -9.685 -5.725 204 HB3 ARG 106 1HB ARG 106 -2.497 -9.171 -4.056 205 HG2 ARG 106 2HG ARG 106 -4.504 -7.672 -4.324 206 HG3 ARG 106 1HG ARG 106 -4.768 -8.393 -5.910 207 HD2 ARG 106 2HD ARG 106 -4.838 -10.644 -4.783 208 HD3 ARG 106 1HD ARG 106 -4.782 -9.803 -3.237 209 HE ARG 106 HE ARG 106 -6.884 -8.834 -4.943 210 HH11 ARG 106 1HH2 ARG 106 -5.936 -11.289 -2.653 211 HH12 ARG 106 2HH2 ARG 106 -7.560 -11.681 -2.202 212 HH21 ARG 106 1HH1 ARG 106 -9.016 -9.367 -4.346 213 HH22 ARG 106 2HH1 ARG 106 -9.300 -10.596 -3.158 214 H HIS 107 H HIS 107 -4.240 -6.477 -6.277 215 HA HIS 107 HA HIS 107 -4.265 -7.183 -9.012 216 HB2 HIS 107 2HB HIS 107 -6.185 -6.370 -7.572 217 HB3 HIS 107 1HB HIS 107 -5.543 -4.745 -7.796 218 HD1 HIS 107 1HD HIS 107 -5.326 -3.945 -10.392 219 HD2 HIS 107 2HD HIS 107 -7.766 -7.247 -9.672 220 HE1 HIS 107 1HE HIS 107 -6.804 -4.204 -12.433 221 HE2 HIS 107 2HE HIS 107 -8.296 -6.212 -12.009 222 H VAL 108 H VAL 108 -3.432 -4.059 -7.464 223 HA VAL 108 HA VAL 108 -2.684 -2.793 -9.874 224 HB VAL 108 HB VAL 108 -3.158 -1.716 -7.579 225 HG11 VAL 108 1HG1 VAL 108 -0.177 -2.099 -7.239 226 HG12 VAL 108 2HG1 VAL 108 -1.377 -3.115 -6.445 227 HG13 VAL 108 3HG1 VAL 108 -1.322 -1.387 -6.096 228 HG21 VAL 108 3HG2 VAL 108 -1.495 0.144 -8.086 229 HG22 VAL 108 1HG2 VAL 108 -2.536 -0.334 -9.426 230 HG23 VAL 108 2HG2 VAL 108 -0.865 -0.891 -9.369 231 H MET 109 H MET 109 -0.699 -4.487 -7.431 232 HA MET 109 HA MET 109 1.804 -4.038 -8.616 233 HB2 MET 109 2HB MET 109 0.724 -6.296 -6.940 234 HB3 MET 109 1HB MET 109 2.389 -6.296 -7.509 235 HG2 MET 109 2HG MET 109 1.179 -3.972 -5.982 236 HG3 MET 109 1HG MET 109 2.052 -5.291 -5.200 237 HE1 MET 109 3HE MET 109 2.693 -2.663 -4.662 238 HE2 MET 109 1HE MET 109 2.769 -1.689 -6.137 239 HE3 MET 109 2HE MET 109 4.240 -2.045 -5.234 240 H THR 110 H THR 110 -0.472 -6.741 -9.090 241 HA THR 110 HA THR 110 1.053 -8.076 -11.063 242 HB THR 110 HB THR 110 -1.934 -8.070 -10.577 243 HG1 THR 110 1HG THR 110 -1.058 -8.974 -8.846 244 HG21 THR 110 3HG2 THR 110 -0.150 -9.783 -12.316 245 HG22 THR 110 1HG2 THR 110 -1.597 -8.894 -12.791 246 HG23 THR 110 2HG2 THR 110 -1.736 -10.324 -11.769 247 H ASN 111 H ASN 111 -1.544 -5.662 -11.271 248 HA ASN 111 HA ASN 111 -1.762 -5.571 -14.084 249 HB2 ASN 111 2HB ASN 111 -3.392 -4.583 -12.508 250 HB3 ASN 111 1HB ASN 111 -2.212 -3.347 -12.086 251 HD21 ASN 111 1HD2 ASN 111 -3.417 -1.557 -12.988 252 HD22 ASN 111 2HD2 ASN 111 -3.680 -1.400 -14.656 253 H LEU 112 H LEU 112 0.297 -3.864 -11.799 254 HA LEU 112 HA LEU 112 1.461 -2.007 -13.560 255 HB2 LEU 112 2HB LEU 112 2.304 -3.275 -10.967 256 HB3 LEU 112 1HB LEU 112 3.416 -2.210 -11.827 257 HG LEU 112 HG LEU 112 0.581 -1.327 -11.266 258 HD11 LEU 112 1HD1 LEU 112 2.928 -1.373 -9.371 259 HD12 LEU 112 2HD1 LEU 112 1.256 -1.832 -9.065 260 HD13 LEU 112 3HD1 LEU 112 1.681 -0.132 -9.231 261 HD21 LEU 112 3HD2 LEU 112 3.229 0.093 -11.737 262 HD22 LEU 112 1HD2 LEU 112 1.759 0.923 -11.229 263 HD23 LEU 112 2HD2 LEU 112 1.813 0.104 -12.788 264 H GLY 113 H GLY 113 2.182 -5.374 -12.839 265 HA2 GLY 113 2HA GLY 113 3.128 -6.460 -14.975 266 HA3 GLY 113 1HA GLY 113 4.438 -5.304 -14.762 267 H GLU 114 H GLU 114 3.471 -5.997 -11.718 268 HA GLU 114 HA GLU 114 5.372 -8.264 -11.439 269 HB2 GLU 114 2HB GLU 114 6.249 -6.161 -10.501 270 HB3 GLU 114 1HB GLU 114 4.813 -6.014 -9.487 271 HG2 GLU 114 2HG GLU 114 5.357 -8.086 -8.337 272 HG3 GLU 114 1HG GLU 114 6.720 -8.365 -9.418 273 H LYS 115 H LYS 115 4.213 -10.047 -11.107 274 HA LYS 115 HA LYS 115 1.662 -9.963 -9.703 275 HB2 LYS 115 2HB LYS 115 1.827 -12.517 -10.166 276 HB3 LYS 115 1HB LYS 115 1.593 -11.422 -11.526 277 HG2 LYS 115 2HG LYS 115 3.915 -11.511 -12.119 278 HG3 LYS 115 1HG LYS 115 4.334 -12.344 -10.625 279 HD2 LYS 115 2HD LYS 115 4.295 -14.043 -12.291 280 HD3 LYS 115 1HD LYS 115 2.778 -14.228 -11.413 281 HE2 LYS 115 2HE LYS 115 2.518 -14.331 -13.911 282 HE3 LYS 115 1HE LYS 115 1.560 -13.056 -13.158 283 HZ1 LYS 115 3HZ LYS 115 2.967 -12.506 -15.216 284 HZ2 LYS 115 1HZ LYS 115 4.280 -12.502 -14.143 285 HZ3 LYS 115 2HZ LYS 115 2.988 -11.424 -13.905 286 H LEU 116 H LEU 116 2.065 -9.536 -7.572 287 HA LEU 116 HA LEU 116 4.080 -10.910 -6.050 288 HB2 LEU 116 2HB LEU 116 2.339 -8.654 -5.686 289 HB3 LEU 116 1HB LEU 116 2.045 -9.754 -4.346 290 HG LEU 116 HG LEU 116 4.597 -9.839 -4.062 291 HD11 LEU 116 1HD1 LEU 116 5.331 -8.939 -6.163 292 HD12 LEU 116 2HD1 LEU 116 5.723 -7.734 -4.938 293 HD13 LEU 116 3HD1 LEU 116 4.318 -7.507 -5.978 294 HD21 LEU 116 3HD2 LEU 116 3.286 -8.632 -2.467 295 HD22 LEU 116 1HD2 LEU 116 2.970 -7.329 -3.611 296 HD23 LEU 116 2HD2 LEU 116 4.588 -7.544 -2.943 297 H THR 117 H THR 117 2.957 -11.693 -3.747 298 HA THR 117 HA THR 117 1.179 -13.937 -4.520 299 HB THR 117 HB THR 117 2.112 -15.098 -2.532 300 HG1 THR 117 1HG THR 117 2.822 -13.526 -1.231 301 HG21 THR 117 3HG2 THR 117 4.218 -15.665 -3.537 302 HG22 THR 117 1HG2 THR 117 4.306 -14.110 -4.364 303 HG23 THR 117 2HG2 THR 117 3.100 -15.300 -4.850 304 H ASP 118 H ASP 118 -0.791 -13.997 -3.666 305 HA ASP 118 HA ASP 118 -1.937 -11.930 -2.206 306 HB2 ASP 118 2HB ASP 118 -2.742 -14.821 -2.505 307 HB3 ASP 118 1HB ASP 118 -3.735 -13.640 -1.652 308 H GLU 119 H GLU 119 -0.366 -14.881 -1.093 309 HA GLU 119 HA GLU 119 -1.143 -14.756 1.619 310 HB2 GLU 119 2HB GLU 119 1.331 -15.923 0.329 311 HB3 GLU 119 1HB GLU 119 0.850 -16.202 2.005 312 HG2 GLU 119 2HG GLU 119 -1.248 -17.205 1.278 313 HG3 GLU 119 1HG GLU 119 -0.880 -16.821 -0.400 314 H GLU 120 H GLU 120 1.525 -13.266 -0.162 315 HA GLU 120 HA GLU 120 2.768 -12.165 2.215 316 HB2 GLU 120 2HB GLU 120 3.175 -11.627 -0.733 317 HB3 GLU 120 1HB GLU 120 4.085 -10.815 0.543 318 HG2 GLU 120 2HG GLU 120 4.947 -12.930 1.357 319 HG3 GLU 120 1HG GLU 120 3.943 -13.823 0.221 320 H VAL 121 H VAL 121 0.869 -10.862 -0.499 321 HA VAL 121 HA VAL 121 0.687 -8.196 0.326 322 HB VAL 121 HB VAL 121 -1.170 -9.995 -1.223 323 HG11 VAL 121 1HG1 VAL 121 -1.625 -7.131 -0.401 324 HG12 VAL 121 2HG1 VAL 121 -2.729 -8.493 -0.247 325 HG13 VAL 121 3HG1 VAL 121 -2.375 -7.820 -1.837 326 HG21 VAL 121 3HG2 VAL 121 0.924 -9.235 -2.293 327 HG22 VAL 121 1HG2 VAL 121 0.475 -7.560 -1.972 328 HG23 VAL 121 2HG2 VAL 121 -0.484 -8.532 -3.086 329 H ASP 122 H ASP 122 -1.871 -10.638 0.756 330 HA ASP 122 HA ASP 122 -3.500 -9.341 2.535 331 HB2 ASP 122 2HB ASP 122 -3.785 -11.642 1.477 332 HB3 ASP 122 1HB ASP 122 -2.779 -12.264 2.780 333 H GLU 123 H GLU 123 -0.568 -11.246 3.310 334 HA GLU 123 HA GLU 123 -0.792 -10.779 6.127 335 HB2 GLU 123 2HB GLU 123 1.447 -11.771 4.367 336 HB3 GLU 123 1HB GLU 123 1.645 -11.540 6.105 337 HG2 GLU 123 2HG GLU 123 -0.172 -13.079 6.572 338 HG3 GLU 123 1HG GLU 123 -0.533 -13.239 4.856 339 H MET 124 H MET 124 0.744 -9.095 3.459 340 HA MET 124 HA MET 124 2.588 -7.460 4.709 341 HB2 MET 124 2HB MET 124 1.954 -7.635 2.223 342 HB3 MET 124 1HB MET 124 0.725 -6.424 2.579 343 HG2 MET 124 2HG MET 124 2.556 -4.982 3.552 344 HG3 MET 124 1HG MET 124 3.720 -6.152 2.927 345 HE1 MET 124 3HE MET 124 4.333 -6.588 0.703 346 HE2 MET 124 1HE MET 124 3.691 -5.885 -0.788 347 HE3 MET 124 2HE MET 124 2.757 -7.089 0.095 348 H ILE 125 H ILE 125 -0.698 -6.358 3.875 349 HA ILE 125 HA ILE 125 -0.659 -4.053 5.452 350 HB ILE 125 HB ILE 125 -2.898 -5.797 4.412 351 HG12 ILE 125 2HG1 ILE 125 -2.107 -2.927 3.806 352 HG13 ILE 125 1HG1 ILE 125 -1.577 -4.322 2.868 353 HG21 ILE 125 1HG2 ILE 125 -4.343 -3.685 5.142 354 HG22 ILE 125 2HG2 ILE 125 -3.074 -3.499 6.349 355 HG23 ILE 125 3HG2 ILE 125 -4.022 -4.984 6.292 356 HD11 ILE 125 3HD1 ILE 125 -3.471 -3.499 1.698 357 HD12 ILE 125 1HD1 ILE 125 -4.378 -3.242 3.190 358 HD13 ILE 125 2HD1 ILE 125 -4.074 -4.878 2.617 359 H ARG 126 H ARG 126 -1.759 -7.329 6.235 360 HA ARG 126 HA ARG 126 -2.865 -6.887 8.727 361 HB2 ARG 126 2HB ARG 126 -1.273 -9.213 7.682 362 HB3 ARG 126 1HB ARG 126 -2.136 -9.257 9.215 363 HG2 ARG 126 2HG ARG 126 -3.680 -8.357 6.793 364 HG3 ARG 126 1HG ARG 126 -3.295 -10.073 6.912 365 HD2 ARG 126 2HD ARG 126 -5.462 -9.683 7.932 366 HD3 ARG 126 1HD ARG 126 -4.305 -10.100 9.194 367 HE ARG 126 HE ARG 126 -4.595 -7.252 8.741 368 HH11 ARG 126 1HH2 ARG 126 -5.724 -10.089 10.364 369 HH12 ARG 126 2HH2 ARG 126 -6.428 -9.227 11.691 370 HH21 ARG 126 1HH1 ARG 126 -5.511 -6.099 10.488 371 HH22 ARG 126 2HH1 ARG 126 -6.305 -6.961 11.760 372 H GLU 127 H GLU 127 0.574 -7.296 7.906 373 HA GLU 127 HA GLU 127 1.331 -7.062 10.703 374 HB2 GLU 127 2HB GLU 127 2.980 -7.270 8.175 375 HB3 GLU 127 1HB GLU 127 3.660 -7.189 9.802 376 HG2 GLU 127 2HG GLU 127 2.462 -9.232 10.434 377 HG3 GLU 127 1HG GLU 127 1.700 -9.300 8.848 378 H ALA 128 H ALA 128 1.405 -5.084 7.783 379 HA ALA 128 HA ALA 128 2.882 -2.919 8.871 380 HB1 ALA 128 1HB ALA 128 0.759 -2.611 6.753 381 HB2 ALA 128 2HB ALA 128 2.293 -3.408 6.405 382 HB3 ALA 128 3HB ALA 128 2.273 -1.724 6.932 383 H ASP 129 H ASP 129 -0.631 -3.261 8.334 384 HA ASP 129 HA ASP 129 -1.587 -0.947 9.404 385 HB2 ASP 129 2HB ASP 129 -2.988 -2.746 8.473 386 HB3 ASP 129 1HB ASP 129 -2.733 -3.694 9.929 387 H ILE 130 H ILE 130 -1.658 0.026 11.323 388 HA ILE 130 HA ILE 130 -0.364 -1.286 13.603 389 HB ILE 130 HB ILE 130 -1.318 1.581 13.291 390 HG12 ILE 130 2HG1 ILE 130 1.423 0.308 13.077 391 HG13 ILE 130 1HG1 ILE 130 0.501 0.979 11.738 392 HG21 ILE 130 1HG2 ILE 130 0.495 0.287 15.371 393 HG22 ILE 130 2HG2 ILE 130 -1.171 0.780 15.669 394 HG23 ILE 130 3HG2 ILE 130 0.052 1.993 15.306 395 HD11 ILE 130 3HD1 ILE 130 0.516 3.202 12.909 396 HD12 ILE 130 1HD1 ILE 130 2.127 2.647 12.453 397 HD13 ILE 130 2HD1 ILE 130 1.588 2.509 14.125 398 H ASP 131 H ASP 131 -3.490 -0.104 12.605 399 HA ASP 131 HA ASP 131 -4.675 -0.596 15.244 400 HB2 ASP 131 2HB ASP 131 -5.811 0.500 12.665 401 HB3 ASP 131 1HB ASP 131 -6.758 0.255 14.132 402 H GLY 132 H GLY 132 -3.953 -2.370 12.523 403 HA2 GLY 132 2HA GLY 132 -4.687 -4.364 11.632 404 HA3 GLY 132 1HA GLY 132 -5.104 -4.756 13.298 405 H ASP 133 H ASP 133 -6.370 -2.651 10.701 406 HA ASP 133 HA ASP 133 -9.099 -3.652 11.300 407 HB2 ASP 133 2HB ASP 133 -9.845 -1.424 10.398 408 HB3 ASP 133 1HB ASP 133 -8.953 -1.335 11.917 409 H GLY 134 H GLY 134 -6.721 -2.837 8.838 410 HA2 GLY 134 2HA GLY 134 -6.772 -4.330 6.847 411 HA3 GLY 134 1HA GLY 134 -8.501 -4.014 6.766 412 H GLN 135 H GLN 135 -7.168 -1.179 7.727 413 HA GLN 135 HA GLN 135 -6.762 -0.213 4.943 414 HB2 GLN 135 2HB GLN 135 -8.017 1.308 7.255 415 HB3 GLN 135 1HB GLN 135 -7.800 1.900 5.608 416 HG2 GLN 135 2HG GLN 135 -9.518 -0.454 6.453 417 HG3 GLN 135 1HG GLN 135 -10.102 1.116 5.907 418 HE21 GLN 135 1HE2 GLN 135 -9.532 -2.008 4.835 419 HE22 GLN 135 2HE2 GLN 135 -9.369 -1.697 3.175 420 H VAL 136 H VAL 136 -4.786 0.474 4.594 421 HA VAL 136 HA VAL 136 -3.161 1.421 6.903 422 HB VAL 136 HB VAL 136 -2.122 0.416 4.255 423 HG11 VAL 136 1HG1 VAL 136 -0.770 0.808 6.924 424 HG12 VAL 136 2HG1 VAL 136 -0.676 1.948 5.580 425 HG13 VAL 136 3HG1 VAL 136 -0.003 0.329 5.412 426 HG21 VAL 136 3HG2 VAL 136 -3.210 -1.439 5.289 427 HG22 VAL 136 1HG2 VAL 136 -2.578 -1.011 6.879 428 HG23 VAL 136 2HG2 VAL 136 -1.488 -1.611 5.627 429 H ASN 137 H ASN 137 -2.628 3.452 6.980 430 HA ASN 137 HA ASN 137 -3.433 5.314 4.970 431 HB2 ASN 137 2HB ASN 137 -2.216 6.985 6.375 432 HB3 ASN 137 1HB ASN 137 -3.366 6.010 7.287 433 HD21 ASN 137 1HD2 ASN 137 0.009 5.327 6.187 434 HD22 ASN 137 2HD2 ASN 137 0.564 4.925 7.736 435 H TYR 138 H TYR 138 -1.052 7.029 5.135 436 HA TYR 138 HA TYR 138 0.381 5.884 2.891 437 HB2 TYR 138 2HB TYR 138 0.865 8.523 4.282 438 HB3 TYR 138 1HB TYR 138 1.359 8.064 2.653 439 HD1 TYR 138 2HD TYR 138 -0.532 7.367 1.004 440 HD2 TYR 138 1HD TYR 138 -1.214 9.593 4.614 441 HE1 TYR 138 2HE TYR 138 -2.716 8.143 0.114 442 HE2 TYR 138 1HE TYR 138 -3.396 10.367 3.726 443 HH TYR 138 HH TYR 138 -4.261 10.135 0.509 444 H GLU 139 H GLU 139 1.363 7.244 6.070 445 HA GLU 139 HA GLU 139 4.051 6.477 5.890 446 HB2 GLU 139 2HB GLU 139 2.309 6.957 8.308 447 HB3 GLU 139 1HB GLU 139 4.057 6.712 8.390 448 HG2 GLU 139 2HG GLU 139 2.730 8.828 6.676 449 HG3 GLU 139 1HG GLU 139 3.377 9.139 8.285 450 H GLU 140 H GLU 140 1.704 4.981 8.052 451 HA GLU 140 HA GLU 140 2.822 2.734 8.949 452 HB2 GLU 140 2HB GLU 140 0.106 2.840 7.621 453 HB3 GLU 140 1HB GLU 140 0.660 1.499 8.617 454 HG2 GLU 140 2HG GLU 140 0.864 2.957 10.538 455 HG3 GLU 140 1HG GLU 140 0.467 4.369 9.571 456 H PHE 141 H PHE 141 2.003 3.365 5.629 457 HA PHE 141 HA PHE 141 2.735 0.681 4.721 458 HB2 PHE 141 2HB PHE 141 0.838 2.246 3.791 459 HB3 PHE 141 1HB PHE 141 2.155 2.988 2.886 460 HD1 PHE 141 2HD PHE 141 3.862 1.116 1.825 461 HD2 PHE 141 1HD PHE 141 -0.304 0.530 2.715 462 HE1 PHE 141 2HE PHE 141 3.778 -0.737 0.200 463 HE2 PHE 141 1HE PHE 141 -0.374 -1.331 1.089 464 HZ PHE 141 HZ PHE 141 1.665 -1.962 -0.172 465 H VAL 142 H VAL 142 3.789 4.061 4.074 466 HA VAL 142 HA VAL 142 5.889 3.769 2.417 467 HB VAL 142 HB VAL 142 5.757 5.441 4.915 468 HG11 VAL 142 1HG1 VAL 142 8.091 5.292 4.541 469 HG12 VAL 142 2HG1 VAL 142 7.605 6.786 3.745 470 HG13 VAL 142 3HG1 VAL 142 7.893 5.336 2.786 471 HG21 VAL 142 3HG2 VAL 142 5.712 6.500 2.108 472 HG22 VAL 142 1HG2 VAL 142 4.906 7.127 3.546 473 HG23 VAL 142 2HG2 VAL 142 4.260 5.714 2.713 474 H GLN 143 H GLN 143 6.380 3.589 5.968 475 HA GLN 143 HA GLN 143 8.987 2.802 6.054 476 HB2 GLN 143 2HB GLN 143 6.654 1.813 7.693 477 HB3 GLN 143 1HB GLN 143 8.329 1.419 8.084 478 HG2 GLN 143 2HG GLN 143 8.882 3.782 8.288 479 HG3 GLN 143 1HG GLN 143 7.259 4.238 7.769 480 HE21 GLN 143 1HE2 GLN 143 6.285 5.088 9.635 481 HE22 GLN 143 2HE2 GLN 143 6.243 4.301 11.137 482 H MET 144 H MET 144 6.457 0.303 6.286 483 HA MET 144 HA MET 144 7.921 -1.933 5.815 484 HB2 MET 144 2HB MET 144 5.164 -1.260 4.797 485 HB3 MET 144 1HB MET 144 5.868 -2.871 4.645 486 HG2 MET 144 2HG MET 144 5.624 -1.389 7.275 487 HG3 MET 144 1HG MET 144 4.431 -2.546 6.696 488 HE1 MET 144 3HE MET 144 5.851 -5.911 6.917 489 HE2 MET 144 1HE MET 144 4.834 -4.787 6.008 490 HE3 MET 144 2HE MET 144 4.570 -5.020 7.735 491 H MET 145 H MET 145 6.546 0.138 3.255 492 HA MET 145 HA MET 145 7.088 -1.035 0.939 493 HB2 MET 145 2HB MET 145 6.547 1.479 1.459 494 HB3 MET 145 1HB MET 145 8.286 1.707 1.295 495 HG2 MET 145 2HG MET 145 7.938 0.321 -0.941 496 HG3 MET 145 1HG MET 145 6.279 0.895 -0.783 497 HE1 MET 145 3HE MET 145 5.949 3.487 0.116 498 HE2 MET 145 1HE MET 145 5.468 3.054 -1.529 499 HE3 MET 145 2HE MET 145 6.307 4.577 -1.225 500 H THR 146 H THR 146 8.682 -2.438 0.492 501 HA THR 146 HA THR 146 11.378 -2.093 1.462 502 HB THR 146 HB THR 146 10.429 -4.045 -0.639 503 HG1 THR 146 1HG THR 146 10.532 -4.406 2.168 504 HG21 THR 146 3HG2 THR 146 12.881 -3.789 -0.315 505 HG22 THR 146 1HG2 THR 146 12.312 -5.376 0.196 506 HG23 THR 146 2HG2 THR 146 12.675 -4.140 1.399 507 H ALA 147 H ALA 147 9.885 -2.095 -1.767 508 HA ALA 147 HA ALA 147 12.126 -1.470 -3.286 509 HB1 ALA 147 1HB ALA 147 10.561 -0.627 -4.961 510 HB2 ALA 147 2HB ALA 147 9.293 -0.502 -3.741 511 HB3 ALA 147 3HB ALA 147 9.908 -2.086 -4.214 512 H LYS 148 H LYS 148 13.084 0.456 -3.979 513 HA LYS 148 HA LYS 148 12.955 2.625 -2.091 514 HB2 LYS 148 2HB LYS 148 14.678 3.672 -3.542 515 HB3 LYS 148 1HB LYS 148 15.101 2.022 -3.090 516 HG2 LYS 148 2HG LYS 148 14.273 1.199 -5.258 517 HG3 LYS 148 1HG LYS 148 13.809 2.838 -5.712 518 HD2 LYS 148 2HD LYS 148 16.183 3.544 -5.490 519 HD3 LYS 148 1HD LYS 148 16.628 1.878 -5.124 520 HE2 LYS 148 2HE LYS 148 15.299 2.823 -7.688 521 HE3 LYS 148 1HE LYS 148 17.003 2.396 -7.515 522 HZ1 LYS 148 3HZ LYS 148 16.413 0.332 -7.976 523 HZ2 LYS 148 1HZ LYS 148 14.758 0.696 -7.878 524 HZ3 LYS 148 2HZ LYS 148 15.615 0.271 -6.476 Start of MODEL 5 1 H1 ASP 78 1HT ASP 78 19.616 14.539 -0.121 2 H2 ASP 78 2HT ASP 78 18.432 15.452 0.689 3 H3 ASP 78 3HT ASP 78 18.510 15.464 -1.011 4 HA ASP 78 HA ASP 78 18.204 12.890 -0.689 5 HB2 ASP 78 2HB ASP 78 17.065 14.210 1.774 6 HB3 ASP 78 1HB ASP 78 16.459 12.663 1.180 7 H THR 79 H THR 79 16.204 15.787 0.014 8 HA THR 79 HA THR 79 14.128 16.394 -0.825 9 HB THR 79 HB THR 79 14.158 16.714 -3.234 10 HG1 THR 79 1HG THR 79 14.984 14.647 -3.759 11 HG21 THR 79 3HG2 THR 79 16.832 17.095 -1.872 12 HG22 THR 79 1HG2 THR 79 15.530 18.274 -2.035 13 HG23 THR 79 2HG2 THR 79 16.448 17.774 -3.454 14 H ASP 80 H ASP 80 12.991 14.579 0.174 15 HA ASP 80 HA ASP 80 12.371 12.299 -1.567 16 HB2 ASP 80 2HB ASP 80 11.162 11.432 0.414 17 HB3 ASP 80 1HB ASP 80 12.849 11.799 0.759 18 H SER 81 H SER 81 10.969 15.266 -0.437 19 HA SER 81 HA SER 81 8.939 16.280 -0.803 20 HB2 SER 81 2HB SER 81 9.313 14.649 -3.312 21 HB3 SER 81 1HB SER 81 7.919 15.700 -3.087 22 HG SER 81 HG SER 81 10.668 16.380 -3.103 23 H GLU 82 H GLU 82 7.944 15.264 0.989 24 HA GLU 82 HA GLU 82 6.749 12.789 1.166 25 HB2 GLU 82 2HB GLU 82 6.916 14.634 2.936 26 HB3 GLU 82 1HB GLU 82 5.462 15.319 2.213 27 HG2 GLU 82 2HG GLU 82 4.287 13.168 2.582 28 HG3 GLU 82 1HG GLU 82 5.737 12.521 3.339 29 H GLU 83 H GLU 83 5.956 15.345 -0.960 30 HA GLU 83 HA GLU 83 3.180 14.923 -1.279 31 HB2 GLU 83 2HB GLU 83 4.393 16.947 -2.052 32 HB3 GLU 83 1HB GLU 83 5.158 15.980 -3.312 33 HG2 GLU 83 2HG GLU 83 2.958 15.433 -4.250 34 HG3 GLU 83 1HG GLU 83 2.172 16.344 -2.965 35 H GLU 84 H GLU 84 5.961 13.651 -3.193 36 HA GLU 84 HA GLU 84 4.555 12.211 -5.092 37 HB2 GLU 84 2HB GLU 84 7.042 12.315 -5.004 38 HB3 GLU 84 1HB GLU 84 7.012 11.220 -3.622 39 HG2 GLU 84 2HG GLU 84 5.961 9.479 -4.964 40 HG3 GLU 84 1HG GLU 84 5.844 10.569 -6.343 41 H ILE 85 H ILE 85 5.432 11.193 -1.797 42 HA ILE 85 HA ILE 85 4.317 8.635 -1.773 43 HB ILE 85 HB ILE 85 4.303 10.671 0.477 44 HG12 ILE 85 2HG1 ILE 85 6.395 8.581 -0.199 45 HG13 ILE 85 1HG1 ILE 85 6.555 10.298 -0.574 46 HG21 ILE 85 1HG2 ILE 85 4.328 8.691 1.933 47 HG22 ILE 85 2HG2 ILE 85 4.270 7.645 0.518 48 HG23 ILE 85 3HG2 ILE 85 2.899 8.687 0.905 49 HD11 ILE 85 3HD1 ILE 85 6.460 8.967 2.133 50 HD12 ILE 85 1HD1 ILE 85 6.098 10.682 1.951 51 HD13 ILE 85 2HD1 ILE 85 7.684 10.062 1.494 52 H ARG 86 H ARG 86 2.830 11.769 -0.946 53 HA ARG 86 HA ARG 86 0.255 10.810 -0.370 54 HB2 ARG 86 2HB ARG 86 1.320 13.472 -1.303 55 HB3 ARG 86 1HB ARG 86 -0.417 13.225 -1.125 56 HG2 ARG 86 2HG ARG 86 -0.087 12.558 1.221 57 HG3 ARG 86 1HG ARG 86 1.655 12.760 1.042 58 HD2 ARG 86 2HD ARG 86 1.504 15.098 0.902 59 HD3 ARG 86 1HD ARG 86 -0.186 15.058 0.403 60 HE ARG 86 HE ARG 86 -0.757 15.093 2.633 61 HH11 ARG 86 1HH2 ARG 86 2.500 13.960 2.268 62 HH12 ARG 86 2HH2 ARG 86 2.768 13.791 3.969 63 HH21 ARG 86 1HH1 ARG 86 -0.398 14.873 4.868 64 HH22 ARG 86 2HH1 ARG 86 1.137 14.306 5.438 65 H GLU 87 H GLU 87 1.754 11.613 -3.470 66 HA GLU 87 HA GLU 87 -0.687 11.324 -4.971 67 HB2 GLU 87 2HB GLU 87 2.219 11.453 -5.796 68 HB3 GLU 87 1HB GLU 87 0.874 11.378 -6.936 69 HG2 GLU 87 2HG GLU 87 -0.056 13.446 -6.055 70 HG3 GLU 87 1HG GLU 87 1.173 13.501 -4.792 71 H ALA 88 H ALA 88 2.325 9.473 -5.171 72 HA ALA 88 HA ALA 88 1.632 7.311 -6.619 73 HB1 ALA 88 1HB ALA 88 3.297 7.368 -4.103 74 HB2 ALA 88 2HB ALA 88 3.855 7.458 -5.774 75 HB3 ALA 88 3HB ALA 88 3.185 5.950 -5.147 76 H PHE 89 H PHE 89 1.139 7.463 -3.076 77 HA PHE 89 HA PHE 89 -0.296 5.035 -2.940 78 HB2 PHE 89 2HB PHE 89 0.096 7.374 -1.126 79 HB3 PHE 89 1HB PHE 89 -1.153 6.195 -0.720 80 HD1 PHE 89 1HD PHE 89 -0.424 3.668 -0.858 81 HD2 PHE 89 2HD PHE 89 2.309 6.943 -0.469 82 HE1 PHE 89 1HE PHE 89 1.310 2.123 -0.004 83 HE2 PHE 89 2HE PHE 89 4.041 5.389 0.401 84 HZ PHE 89 HZ PHE 89 3.539 3.001 0.630 85 H ARG 90 H ARG 90 -1.415 8.433 -3.231 86 HA ARG 90 HA ARG 90 -4.168 7.950 -3.001 87 HB2 ARG 90 2HB ARG 90 -2.494 10.047 -4.285 88 HB3 ARG 90 1HB ARG 90 -4.192 9.986 -4.749 89 HG2 ARG 90 2HG ARG 90 -4.879 10.134 -2.404 90 HG3 ARG 90 1HG ARG 90 -3.198 10.105 -1.872 91 HD2 ARG 90 2HD ARG 90 -2.789 12.163 -3.147 92 HD3 ARG 90 1HD ARG 90 -4.482 12.204 -3.616 93 HE ARG 90 HE ARG 90 -4.106 12.088 -0.758 94 HH11 ARG 90 1HH2 ARG 90 -4.256 14.149 -3.556 95 HH12 ARG 90 2HH2 ARG 90 -4.721 15.555 -2.662 96 HH21 ARG 90 1HH1 ARG 90 -4.703 13.955 0.419 97 HH22 ARG 90 2HH1 ARG 90 -4.975 15.447 -0.414 98 H VAL 91 H VAL 91 -2.048 7.814 -5.840 99 HA VAL 91 HA VAL 91 -4.024 7.175 -7.749 100 HB VAL 91 HB VAL 91 -1.063 6.537 -7.685 101 HG11 VAL 91 1HG1 VAL 91 -2.101 5.055 -9.278 102 HG12 VAL 91 2HG1 VAL 91 -1.372 6.375 -10.192 103 HG13 VAL 91 3HG1 VAL 91 -3.112 6.356 -9.910 104 HG21 VAL 91 3HG2 VAL 91 -1.637 8.947 -7.613 105 HG22 VAL 91 1HG2 VAL 91 -2.633 8.746 -9.054 106 HG23 VAL 91 2HG2 VAL 91 -0.889 8.509 -9.148 107 H PHE 92 H PHE 92 -1.955 5.176 -5.707 108 HA PHE 92 HA PHE 92 -2.582 2.649 -6.738 109 HB2 PHE 92 2HB PHE 92 -1.632 3.688 -4.107 110 HB3 PHE 92 1HB PHE 92 -2.193 2.021 -4.134 111 HD1 PHE 92 2HD PHE 92 -0.470 3.968 -6.838 112 HD2 PHE 92 1HD PHE 92 -0.200 0.770 -3.983 113 HE1 PHE 92 2HE PHE 92 1.667 3.246 -7.855 114 HE2 PHE 92 1HE PHE 92 1.938 0.047 -5.002 115 HZ PHE 92 HZ PHE 92 2.871 1.283 -6.938 116 H ASP 93 H ASP 93 -4.179 4.372 -4.024 117 HA ASP 93 HA ASP 93 -6.107 2.510 -3.385 118 HB2 ASP 93 2HB ASP 93 -5.720 4.811 -2.347 119 HB3 ASP 93 1HB ASP 93 -6.718 5.457 -3.644 120 H LYS 94 H LYS 94 -6.810 1.331 -5.178 121 HA LYS 94 HA LYS 94 -7.697 2.350 -7.624 122 HB2 LYS 94 2HB LYS 94 -8.498 -0.155 -6.123 123 HB3 LYS 94 1HB LYS 94 -8.944 0.173 -7.797 124 HG2 LYS 94 2HG LYS 94 -6.605 0.258 -8.460 125 HG3 LYS 94 1HG LYS 94 -6.089 0.115 -6.781 126 HD2 LYS 94 2HD LYS 94 -5.873 -2.081 -7.677 127 HD3 LYS 94 1HD LYS 94 -7.355 -2.112 -6.725 128 HE2 LYS 94 2HE LYS 94 -8.726 -1.996 -8.660 129 HE3 LYS 94 1HE LYS 94 -7.377 -1.534 -9.695 130 HZ1 LYS 94 3HZ LYS 94 -7.786 -3.804 -10.071 131 HZ2 LYS 94 1HZ LYS 94 -7.870 -4.157 -8.415 132 HZ3 LYS 94 2HZ LYS 94 -6.381 -3.737 -9.118 133 H ASP 95 H ASP 95 -9.717 1.135 -4.965 134 HA ASP 95 HA ASP 95 -12.119 2.327 -5.968 135 HB2 ASP 95 2HB ASP 95 -11.384 1.068 -3.320 136 HB3 ASP 95 1HB ASP 95 -13.012 1.623 -3.712 137 H GLY 96 H GLY 96 -9.698 4.030 -5.278 138 HA2 GLY 96 2HA GLY 96 -9.130 5.898 -3.955 139 HA3 GLY 96 1HA GLY 96 -10.570 6.458 -4.796 140 H ASN 97 H ASN 97 -10.319 4.057 -2.167 141 HA ASN 97 HA ASN 97 -12.486 5.308 -0.765 142 HB2 ASN 97 2HB ASN 97 -12.250 3.532 0.855 143 HB3 ASN 97 1HB ASN 97 -12.150 2.854 -0.765 144 HD21 ASN 97 1HD2 ASN 97 -11.073 1.287 1.207 145 HD22 ASN 97 2HD2 ASN 97 -9.377 1.339 1.170 146 H GLY 98 H GLY 98 -9.390 6.290 -1.023 147 HA2 GLY 98 2HA GLY 98 -8.339 8.013 0.136 148 HA3 GLY 98 1HA GLY 98 -9.568 7.882 1.388 149 H TYR 99 H TYR 99 -8.509 4.838 0.819 150 HA TYR 99 HA TYR 99 -6.192 4.967 2.642 151 HB2 TYR 99 2HB TYR 99 -8.542 3.111 3.074 152 HB3 TYR 99 1HB TYR 99 -7.078 3.219 4.055 153 HD1 TYR 99 1HD TYR 99 -6.561 5.386 5.281 154 HD2 TYR 99 2HD TYR 99 -10.354 4.623 3.409 155 HE1 TYR 99 1HE TYR 99 -7.592 7.203 6.620 156 HE2 TYR 99 2HE TYR 99 -11.382 6.440 4.747 157 HH TYR 99 HH TYR 99 -10.512 8.586 5.911 158 H ILE 100 H ILE 100 -5.596 2.340 2.927 159 HA ILE 100 HA ILE 100 -5.463 1.305 0.131 160 HB ILE 100 HB ILE 100 -3.287 1.291 2.219 161 HG12 ILE 100 2HG1 ILE 100 -3.715 3.521 1.208 162 HG13 ILE 100 1HG1 ILE 100 -2.153 2.874 0.722 163 HG21 ILE 100 1HG2 ILE 100 -1.949 0.542 0.153 164 HG22 ILE 100 2HG2 ILE 100 -3.511 0.172 -0.570 165 HG23 ILE 100 3HG2 ILE 100 -3.008 -0.657 0.903 166 HD11 ILE 100 3HD1 ILE 100 -4.579 3.394 -0.908 167 HD12 ILE 100 1HD1 ILE 100 -3.707 1.917 -1.318 168 HD13 ILE 100 2HD1 ILE 100 -2.882 3.474 -1.363 169 H SER 101 H SER 101 -6.211 -0.699 -0.119 170 HA SER 101 HA SER 101 -6.476 -2.468 2.231 171 HB2 SER 101 2HB SER 101 -8.606 -2.326 1.252 172 HB3 SER 101 1HB SER 101 -7.963 -2.251 -0.385 173 HG SER 101 HG SER 101 -8.020 -4.468 1.388 174 H ALA 102 H ALA 102 -6.216 -4.808 1.704 175 HA ALA 102 HA ALA 102 -3.625 -5.266 0.554 176 HB1 ALA 102 1HB ALA 102 -3.835 -6.742 2.300 177 HB2 ALA 102 2HB ALA 102 -4.602 -7.779 1.095 178 HB3 ALA 102 3HB ALA 102 -5.591 -6.784 2.162 179 H ALA 103 H ALA 103 -6.944 -5.941 -0.445 180 HA ALA 103 HA ALA 103 -6.346 -7.713 -2.517 181 HB1 ALA 103 1HB ALA 103 -8.603 -7.181 -1.504 182 HB2 ALA 103 2HB ALA 103 -8.577 -7.320 -3.262 183 HB3 ALA 103 3HB ALA 103 -8.619 -5.728 -2.502 184 H GLU 104 H GLU 104 -6.357 -4.177 -2.445 185 HA GLU 104 HA GLU 104 -6.222 -3.780 -5.235 186 HB2 GLU 104 2HB GLU 104 -5.179 -2.013 -3.008 187 HB3 GLU 104 1HB GLU 104 -5.537 -1.511 -4.663 188 HG2 GLU 104 2HG GLU 104 -7.901 -2.151 -4.339 189 HG3 GLU 104 1HG GLU 104 -7.530 -2.638 -2.685 190 H LEU 105 H LEU 105 -3.771 -4.457 -2.774 191 HA LEU 105 HA LEU 105 -1.499 -3.641 -4.262 192 HB2 LEU 105 2HB LEU 105 -1.628 -5.875 -2.245 193 HB3 LEU 105 1HB LEU 105 -0.221 -4.909 -2.684 194 HG LEU 105 HG LEU 105 -2.732 -3.920 -1.305 195 HD11 LEU 105 1HD1 LEU 105 -1.029 -3.348 0.489 196 HD12 LEU 105 2HD1 LEU 105 0.133 -4.315 -0.410 197 HD13 LEU 105 3HD1 LEU 105 -1.316 -5.066 0.253 198 HD21 LEU 105 3HD2 LEU 105 -1.250 -1.780 -1.123 199 HD22 LEU 105 1HD2 LEU 105 -2.072 -2.093 -2.651 200 HD23 LEU 105 2HD2 LEU 105 -0.358 -2.467 -2.481 201 H ARG 106 H ARG 106 -2.966 -6.880 -3.886 202 HA ARG 106 HA ARG 106 -1.152 -8.175 -5.612 203 HB2 ARG 106 2HB ARG 106 -2.976 -9.914 -5.807 204 HB3 ARG 106 1HB ARG 106 -2.452 -9.549 -4.167 205 HG2 ARG 106 2HG ARG 106 -4.380 -7.986 -3.933 206 HG3 ARG 106 1HG ARG 106 -4.929 -8.452 -5.541 207 HD2 ARG 106 2HD ARG 106 -5.034 -10.828 -4.748 208 HD3 ARG 106 1HD ARG 106 -4.628 -10.253 -3.134 209 HE ARG 106 HE ARG 106 -6.901 -8.904 -4.260 210 HH11 ARG 106 1HH2 ARG 106 -5.775 -11.720 -2.522 211 HH12 ARG 106 2HH2 ARG 106 -7.322 -12.064 -1.821 212 HH21 ARG 106 1HH1 ARG 106 -8.928 -9.376 -3.331 213 HH22 ARG 106 2HH1 ARG 106 -9.100 -10.741 -2.278 214 H HIS 107 H HIS 107 -4.402 -6.783 -6.264 215 HA HIS 107 HA HIS 107 -4.435 -7.510 -9.001 216 HB2 HIS 107 2HB HIS 107 -6.374 -6.807 -7.509 217 HB3 HIS 107 1HB HIS 107 -5.843 -5.147 -7.774 218 HD1 HIS 107 1HD HIS 107 -8.254 -7.325 -9.052 219 HD2 HIS 107 2HD HIS 107 -5.418 -4.888 -10.894 220 HE1 HIS 107 1HE HIS 107 -9.042 -6.985 -11.436 221 HE2 HIS 107 2HE HIS 107 -7.325 -5.502 -12.570 222 H VAL 108 H VAL 108 -3.725 -4.367 -7.454 223 HA VAL 108 HA VAL 108 -3.146 -3.003 -9.840 224 HB VAL 108 HB VAL 108 -3.484 -2.032 -7.474 225 HG11 VAL 108 1HG1 VAL 108 -0.471 -2.315 -7.361 226 HG12 VAL 108 2HG1 VAL 108 -1.560 -3.430 -6.548 227 HG13 VAL 108 3HG1 VAL 108 -1.556 -1.725 -6.096 228 HG21 VAL 108 3HG2 VAL 108 -1.264 -1.025 -9.274 229 HG22 VAL 108 1HG2 VAL 108 -2.043 -0.071 -8.010 230 HG23 VAL 108 2HG2 VAL 108 -2.978 -0.628 -9.399 231 H MET 109 H MET 109 -0.897 -4.634 -7.586 232 HA MET 109 HA MET 109 1.461 -4.117 -8.973 233 HB2 MET 109 2HB MET 109 0.603 -6.433 -7.246 234 HB3 MET 109 1HB MET 109 2.222 -6.328 -7.923 235 HG2 MET 109 2HG MET 109 0.974 -4.112 -6.276 236 HG3 MET 109 1HG MET 109 1.989 -5.377 -5.586 237 HE1 MET 109 3HE MET 109 3.689 -3.965 -4.615 238 HE2 MET 109 1HE MET 109 5.158 -3.597 -5.532 239 HE3 MET 109 2HE MET 109 4.541 -5.245 -5.475 240 H THR 110 H THR 110 -0.883 -6.753 -9.341 241 HA THR 110 HA THR 110 0.507 -8.138 -11.393 242 HB THR 110 HB THR 110 -2.454 -8.058 -10.751 243 HG1 THR 110 1HG THR 110 -1.079 -10.309 -10.185 244 HG21 THR 110 3HG2 THR 110 -2.322 -10.346 -11.934 245 HG22 THR 110 1HG2 THR 110 -0.790 -9.778 -12.599 246 HG23 THR 110 2HG2 THR 110 -2.285 -8.914 -12.961 247 H ASN 111 H ASN 111 -2.003 -5.638 -11.430 248 HA ASN 111 HA ASN 111 -2.365 -5.503 -14.230 249 HB2 ASN 111 2HB ASN 111 -3.924 -4.501 -12.654 250 HB3 ASN 111 1HB ASN 111 -2.697 -3.354 -12.129 251 HD21 ASN 111 1HD2 ASN 111 -5.228 -3.828 -14.396 252 HD22 ASN 111 2HD2 ASN 111 -4.863 -2.528 -15.422 253 H LEU 112 H LEU 112 -0.162 -3.912 -12.027 254 HA LEU 112 HA LEU 112 0.986 -2.069 -13.819 255 HB2 LEU 112 2HB LEU 112 1.874 -3.357 -11.253 256 HB3 LEU 112 1HB LEU 112 3.003 -2.345 -12.153 257 HG LEU 112 HG LEU 112 0.228 -1.318 -11.542 258 HD11 LEU 112 1HD1 LEU 112 0.907 -1.895 -9.350 259 HD12 LEU 112 2HD1 LEU 112 1.376 -0.205 -9.504 260 HD13 LEU 112 3HD1 LEU 112 2.589 -1.476 -9.663 261 HD21 LEU 112 3HD2 LEU 112 1.622 -0.009 -13.092 262 HD22 LEU 112 1HD2 LEU 112 2.951 -0.016 -11.932 263 HD23 LEU 112 2HD2 LEU 112 1.466 0.861 -11.567 264 H GLY 113 H GLY 113 1.698 -5.438 -13.086 265 HA2 GLY 113 2HA GLY 113 2.511 -6.719 -15.085 266 HA3 GLY 113 1HA GLY 113 3.711 -5.447 -15.282 267 H GLU 114 H GLU 114 3.424 -5.661 -12.054 268 HA GLU 114 HA GLU 114 5.691 -7.555 -11.841 269 HB2 GLU 114 2HB GLU 114 6.074 -5.231 -11.073 270 HB3 GLU 114 1HB GLU 114 4.767 -5.420 -9.903 271 HG2 GLU 114 2HG GLU 114 5.965 -7.255 -8.815 272 HG3 GLU 114 1HG GLU 114 7.243 -7.164 -10.024 273 H LYS 115 H LYS 115 4.994 -9.543 -11.368 274 HA LYS 115 HA LYS 115 2.580 -10.190 -10.061 275 HB2 LYS 115 2HB LYS 115 3.454 -12.452 -9.949 276 HB3 LYS 115 1HB LYS 115 3.829 -11.747 -11.522 277 HG2 LYS 115 2HG LYS 115 6.090 -11.106 -10.599 278 HG3 LYS 115 1HG LYS 115 5.703 -12.049 -9.160 279 HD2 LYS 115 2HD LYS 115 5.650 -13.176 -11.971 280 HD3 LYS 115 1HD LYS 115 7.040 -13.303 -10.897 281 HE2 LYS 115 2HE LYS 115 5.421 -14.371 -9.203 282 HE3 LYS 115 1HE LYS 115 4.294 -14.520 -10.550 283 HZ1 LYS 115 3HZ LYS 115 6.158 -16.329 -9.930 284 HZ2 LYS 115 1HZ LYS 115 6.978 -15.422 -11.106 285 HZ3 LYS 115 2HZ LYS 115 5.483 -16.139 -11.479 286 H LEU 116 H LEU 116 2.341 -11.325 -7.976 287 HA LEU 116 HA LEU 116 4.373 -10.864 -5.960 288 HB2 LEU 116 2HB LEU 116 2.482 -8.847 -6.386 289 HB3 LEU 116 1HB LEU 116 1.813 -9.737 -5.022 290 HG LEU 116 HG LEU 116 4.210 -9.582 -4.020 291 HD11 LEU 116 1HD1 LEU 116 4.331 -7.505 -6.222 292 HD12 LEU 116 2HD1 LEU 116 5.467 -8.815 -5.908 293 HD13 LEU 116 3HD1 LEU 116 5.370 -7.448 -4.799 294 HD21 LEU 116 3HD2 LEU 116 3.701 -7.127 -3.318 295 HD22 LEU 116 1HD2 LEU 116 2.513 -8.372 -2.938 296 HD23 LEU 116 2HD2 LEU 116 2.256 -7.305 -4.313 297 H THR 117 H THR 117 3.694 -11.804 -3.806 298 HA THR 117 HA THR 117 2.012 -14.181 -4.247 299 HB THR 117 HB THR 117 2.933 -14.731 -1.894 300 HG1 THR 117 1HG THR 117 4.416 -12.456 -2.646 301 HG21 THR 117 3HG2 THR 117 3.770 -15.887 -3.834 302 HG22 THR 117 1HG2 THR 117 5.161 -15.388 -2.874 303 HG23 THR 117 2HG2 THR 117 4.720 -14.484 -4.324 304 H ASP 118 H ASP 118 -0.052 -14.112 -3.653 305 HA ASP 118 HA ASP 118 -1.331 -11.979 -2.385 306 HB2 ASP 118 2HB ASP 118 -2.350 -13.909 -3.736 307 HB3 ASP 118 1HB ASP 118 -2.320 -14.823 -2.236 308 H GLU 119 H GLU 119 -0.077 -15.009 -1.037 309 HA GLU 119 HA GLU 119 -1.080 -14.759 1.567 310 HB2 GLU 119 2HB GLU 119 1.558 -15.987 0.722 311 HB3 GLU 119 1HB GLU 119 0.663 -16.339 2.202 312 HG2 GLU 119 2HG GLU 119 -1.257 -17.123 0.809 313 HG3 GLU 119 1HG GLU 119 -0.284 -16.850 -0.630 314 H GLU 120 H GLU 120 1.782 -13.350 0.039 315 HA GLU 120 HA GLU 120 2.846 -12.258 2.487 316 HB2 GLU 120 2HB GLU 120 3.430 -11.637 -0.414 317 HB3 GLU 120 1HB GLU 120 4.298 -10.927 0.946 318 HG2 GLU 120 2HG GLU 120 4.079 -13.906 0.424 319 HG3 GLU 120 1HG GLU 120 5.465 -12.919 -0.029 320 H VAL 121 H VAL 121 0.914 -11.060 -0.227 321 HA VAL 121 HA VAL 121 0.753 -8.352 0.430 322 HB VAL 121 HB VAL 121 -1.245 -10.242 -0.831 323 HG11 VAL 121 1HG1 VAL 121 -1.490 -7.291 -0.271 324 HG12 VAL 121 2HG1 VAL 121 -2.656 -8.565 0.068 325 HG13 VAL 121 3HG1 VAL 121 -2.362 -8.056 -1.593 326 HG21 VAL 121 3HG2 VAL 121 0.792 -9.720 -2.115 327 HG22 VAL 121 1HG2 VAL 121 0.486 -7.996 -1.905 328 HG23 VAL 121 2HG2 VAL 121 -0.618 -8.975 -2.865 329 H ASP 122 H ASP 122 -1.772 -10.752 1.170 330 HA ASP 122 HA ASP 122 -3.274 -9.341 2.975 331 HB2 ASP 122 2HB ASP 122 -3.725 -11.652 2.095 332 HB3 ASP 122 1HB ASP 122 -2.538 -12.269 3.238 333 H GLU 123 H GLU 123 -0.301 -11.224 3.658 334 HA GLU 123 HA GLU 123 -0.335 -10.631 6.455 335 HB2 GLU 123 2HB GLU 123 0.866 -12.571 5.553 336 HB3 GLU 123 1HB GLU 123 1.975 -11.492 4.708 337 HG2 GLU 123 2HG GLU 123 2.738 -10.554 6.838 338 HG3 GLU 123 1HG GLU 123 1.562 -11.533 7.715 339 H MET 124 H MET 124 1.021 -9.060 3.612 340 HA MET 124 HA MET 124 2.937 -7.381 4.692 341 HB2 MET 124 2HB MET 124 2.246 -7.700 2.243 342 HB3 MET 124 1HB MET 124 0.989 -6.506 2.558 343 HG2 MET 124 2HG MET 124 2.684 -4.872 3.247 344 HG3 MET 124 1HG MET 124 3.955 -6.064 2.974 345 HE1 MET 124 3HE MET 124 4.945 -4.097 0.044 346 HE2 MET 124 1HE MET 124 5.378 -5.710 0.630 347 HE3 MET 124 2HE MET 124 5.096 -4.400 1.773 348 H ILE 125 H ILE 125 -0.324 -6.229 3.843 349 HA ILE 125 HA ILE 125 -0.200 -3.870 5.337 350 HB ILE 125 HB ILE 125 -2.492 -5.559 4.326 351 HG12 ILE 125 2HG1 ILE 125 -1.543 -2.743 3.703 352 HG13 ILE 125 1HG1 ILE 125 -1.189 -4.172 2.733 353 HG21 ILE 125 1HG2 ILE 125 -3.486 -4.680 6.288 354 HG22 ILE 125 2HG2 ILE 125 -3.957 -3.525 5.041 355 HG23 ILE 125 3HG2 ILE 125 -2.629 -3.154 6.136 356 HD11 ILE 125 3HD1 ILE 125 -3.056 -3.287 1.612 357 HD12 ILE 125 1HD1 ILE 125 -3.802 -2.735 3.110 358 HD13 ILE 125 2HD1 ILE 125 -3.812 -4.448 2.708 359 H ARG 126 H ARG 126 -1.320 -7.094 6.267 360 HA ARG 126 HA ARG 126 -2.496 -6.547 8.688 361 HB2 ARG 126 2HB ARG 126 -0.869 -8.857 7.705 362 HB3 ARG 126 1HB ARG 126 -1.549 -8.883 9.328 363 HG2 ARG 126 2HG ARG 126 -3.340 -8.214 6.986 364 HG3 ARG 126 1HG ARG 126 -2.926 -9.901 7.300 365 HD2 ARG 126 2HD ARG 126 -4.126 -8.013 9.345 366 HD3 ARG 126 1HD ARG 126 -5.031 -9.224 8.440 367 HE ARG 126 HE ARG 126 -2.915 -10.557 9.658 368 HH11 ARG 126 1HH2 ARG 126 -5.670 -8.646 10.520 369 HH12 ARG 126 2HH2 ARG 126 -5.938 -9.456 12.028 370 HH21 ARG 126 1HH1 ARG 126 -3.251 -11.628 11.653 371 HH22 ARG 126 2HH1 ARG 126 -4.567 -11.145 12.669 372 H GLU 127 H GLU 127 0.989 -6.919 8.036 373 HA GLU 127 HA GLU 127 1.671 -6.581 10.808 374 HB2 GLU 127 2HB GLU 127 3.344 -6.556 8.294 375 HB3 GLU 127 1HB GLU 127 4.015 -6.383 9.917 376 HG2 GLU 127 2HG GLU 127 3.058 -8.555 10.564 377 HG3 GLU 127 1HG GLU 127 2.332 -8.722 8.966 378 H ALA 128 H ALA 128 1.771 -4.505 7.935 379 HA ALA 128 HA ALA 128 2.885 -2.238 9.206 380 HB1 ALA 128 1HB ALA 128 2.103 -2.911 6.623 381 HB2 ALA 128 2HB ALA 128 2.745 -1.346 7.110 382 HB3 ALA 128 3HB ALA 128 1.001 -1.599 7.029 383 H ASP 129 H ASP 129 -0.500 -2.994 8.428 384 HA ASP 129 HA ASP 129 -1.815 -0.810 9.401 385 HB2 ASP 129 2HB ASP 129 -2.881 -2.806 8.368 386 HB3 ASP 129 1HB ASP 129 -2.676 -3.665 9.890 387 H ILE 130 H ILE 130 -1.939 0.191 11.281 388 HA ILE 130 HA ILE 130 -0.764 -1.043 13.663 389 HB ILE 130 HB ILE 130 -1.805 1.778 13.239 390 HG12 ILE 130 2HG1 ILE 130 1.006 0.662 13.263 391 HG13 ILE 130 1HG1 ILE 130 0.145 1.174 11.816 392 HG21 ILE 130 1HG2 ILE 130 -0.514 2.247 15.325 393 HG22 ILE 130 2HG2 ILE 130 -0.125 0.533 15.458 394 HG23 ILE 130 3HG2 ILE 130 -1.793 1.073 15.625 395 HD11 ILE 130 3HD1 ILE 130 -0.086 3.458 12.800 396 HD12 ILE 130 1HD1 ILE 130 1.600 2.999 12.561 397 HD13 ILE 130 2HD1 ILE 130 0.889 2.938 14.174 398 H ASP 131 H ASP 131 -3.854 -0.080 12.410 399 HA ASP 131 HA ASP 131 -5.209 -0.515 14.986 400 HB2 ASP 131 2HB ASP 131 -6.200 0.430 12.289 401 HB3 ASP 131 1HB ASP 131 -7.243 0.189 13.694 402 H GLY 132 H GLY 132 -4.159 -2.409 12.482 403 HA2 GLY 132 2HA GLY 132 -4.792 -4.443 11.581 404 HA3 GLY 132 1HA GLY 132 -5.224 -4.804 13.251 405 H ASP 133 H ASP 133 -6.528 -2.975 10.472 406 HA ASP 133 HA ASP 133 -9.213 -4.107 11.055 407 HB2 ASP 133 2HB ASP 133 -10.127 -1.949 10.215 408 HB3 ASP 133 1HB ASP 133 -9.201 -1.781 11.706 409 H GLY 134 H GLY 134 -6.793 -3.244 8.692 410 HA2 GLY 134 2HA GLY 134 -6.771 -4.701 6.685 411 HA3 GLY 134 1HA GLY 134 -8.496 -4.387 6.535 412 H GLN 135 H GLN 135 -7.137 -1.567 7.598 413 HA GLN 135 HA GLN 135 -6.427 -0.598 4.896 414 HB2 GLN 135 2HB GLN 135 -8.532 0.551 6.738 415 HB3 GLN 135 1HB GLN 135 -7.772 1.503 5.464 416 HG2 GLN 135 2HG GLN 135 -9.005 -1.184 4.857 417 HG3 GLN 135 1HG GLN 135 -9.993 0.275 4.903 418 HE21 GLN 135 1HE2 GLN 135 -6.941 1.260 3.892 419 HE22 GLN 135 2HE2 GLN 135 -7.182 1.166 2.217 420 H VAL 136 H VAL 136 -4.793 0.810 4.862 421 HA VAL 136 HA VAL 136 -3.865 1.991 7.419 422 HB VAL 136 HB VAL 136 -1.695 1.216 7.193 423 HG11 VAL 136 1HG1 VAL 136 -3.325 -0.661 7.519 424 HG12 VAL 136 2HG1 VAL 136 -1.773 -1.135 6.823 425 HG13 VAL 136 3HG1 VAL 136 -3.193 -0.977 5.788 426 HG21 VAL 136 3HG2 VAL 136 -1.144 1.960 5.018 427 HG22 VAL 136 1HG2 VAL 136 -2.318 0.888 4.265 428 HG23 VAL 136 2HG2 VAL 136 -0.854 0.223 4.993 429 H ASN 137 H ASN 137 -3.015 4.004 7.284 430 HA ASN 137 HA ASN 137 -3.721 5.583 5.033 431 HB2 ASN 137 2HB ASN 137 -1.842 6.277 7.295 432 HB3 ASN 137 1HB ASN 137 -2.634 7.413 6.203 433 HD21 ASN 137 1HD2 ASN 137 -2.901 6.362 9.281 434 HD22 ASN 137 2HD2 ASN 137 -4.586 6.422 9.484 435 H TYR 138 H TYR 138 -1.377 7.279 4.928 436 HA TYR 138 HA TYR 138 0.036 5.892 2.844 437 HB2 TYR 138 2HB TYR 138 0.843 8.562 3.974 438 HB3 TYR 138 1HB TYR 138 0.973 7.973 2.316 439 HD1 TYR 138 2HD TYR 138 -1.475 7.065 1.422 440 HD2 TYR 138 1HD TYR 138 -0.804 10.198 4.277 441 HE1 TYR 138 2HE TYR 138 -3.710 8.021 0.893 442 HE2 TYR 138 1HE TYR 138 -3.034 11.154 3.755 443 HH TYR 138 HH TYR 138 -5.314 9.472 1.678 444 H GLU 139 H GLU 139 1.069 7.348 5.962 445 HA GLU 139 HA GLU 139 3.747 6.562 5.825 446 HB2 GLU 139 2HB GLU 139 1.966 7.077 8.200 447 HB3 GLU 139 1HB GLU 139 3.707 6.800 8.327 448 HG2 GLU 139 2HG GLU 139 4.161 8.685 6.851 449 HG3 GLU 139 1HG GLU 139 2.435 8.934 6.592 450 H GLU 140 H GLU 140 1.382 5.100 7.990 451 HA GLU 140 HA GLU 140 2.464 2.835 8.904 452 HB2 GLU 140 2HB GLU 140 -0.239 2.997 7.568 453 HB3 GLU 140 1HB GLU 140 0.280 1.621 8.535 454 HG2 GLU 140 2HG GLU 140 0.545 3.071 10.489 455 HG3 GLU 140 1HG GLU 140 0.116 4.482 9.526 456 H PHE 141 H PHE 141 1.697 3.481 5.573 457 HA PHE 141 HA PHE 141 2.417 0.795 4.666 458 HB2 PHE 141 2HB PHE 141 0.560 2.424 3.703 459 HB3 PHE 141 1HB PHE 141 1.905 3.081 2.785 460 HD1 PHE 141 1HD PHE 141 3.540 1.102 1.840 461 HD2 PHE 141 2HD PHE 141 -0.655 0.744 2.642 462 HE1 PHE 141 1HE PHE 141 3.412 -0.809 0.280 463 HE2 PHE 141 2HE PHE 141 -0.781 -1.162 1.087 464 HZ PHE 141 HZ PHE 141 1.244 -1.944 -0.106 465 H VAL 142 H VAL 142 3.489 4.173 4.039 466 HA VAL 142 HA VAL 142 5.563 3.955 2.386 467 HB VAL 142 HB VAL 142 5.510 5.452 4.995 468 HG11 VAL 142 1HG1 VAL 142 7.375 6.834 3.886 469 HG12 VAL 142 2HG1 VAL 142 7.621 5.432 2.845 470 HG13 VAL 142 3HG1 VAL 142 7.833 5.280 4.588 471 HG21 VAL 142 3HG2 VAL 142 4.698 7.253 3.742 472 HG22 VAL 142 1HG2 VAL 142 3.992 5.912 2.838 473 HG23 VAL 142 2HG2 VAL 142 5.460 6.689 2.257 474 H GLN 143 H GLN 143 6.101 3.516 5.902 475 HA GLN 143 HA GLN 143 8.678 2.701 5.970 476 HB2 GLN 143 2HB GLN 143 6.265 1.655 7.426 477 HB3 GLN 143 1HB GLN 143 7.853 0.963 7.752 478 HG2 GLN 143 2HG GLN 143 7.210 2.846 9.287 479 HG3 GLN 143 1HG GLN 143 8.721 3.114 8.420 480 HE21 GLN 143 1HE2 GLN 143 8.874 5.149 7.485 481 HE22 GLN 143 2HE2 GLN 143 7.559 6.108 7.004 482 H MET 144 H MET 144 6.145 0.176 5.758 483 HA MET 144 HA MET 144 7.793 -1.914 5.012 484 HB2 MET 144 2HB MET 144 4.960 -1.426 4.069 485 HB3 MET 144 1HB MET 144 5.782 -2.985 4.098 486 HG2 MET 144 2HG MET 144 5.212 -1.256 6.523 487 HG3 MET 144 1HG MET 144 4.306 -2.687 6.051 488 HE1 MET 144 3HE MET 144 4.637 -4.781 7.262 489 HE2 MET 144 1HE MET 144 6.183 -5.633 7.141 490 HE3 MET 144 2HE MET 144 5.394 -5.029 5.688 491 H MET 145 H MET 145 6.098 0.381 2.848 492 HA MET 145 HA MET 145 6.629 -0.594 0.398 493 HB2 MET 145 2HB MET 145 5.644 1.717 1.134 494 HB3 MET 145 1HB MET 145 7.294 2.288 0.943 495 HG2 MET 145 2HG MET 145 7.336 1.704 -1.369 496 HG3 MET 145 1HG MET 145 5.830 0.796 -1.247 497 HE1 MET 145 3HE MET 145 6.637 4.437 0.376 498 HE2 MET 145 1HE MET 145 6.470 5.316 -1.149 499 HE3 MET 145 2HE MET 145 7.658 4.021 -0.999 500 H THR 146 H THR 146 8.932 1.715 1.886 501 HA THR 146 HA THR 146 11.070 0.639 0.194 502 HB THR 146 HB THR 146 12.397 2.515 1.125 503 HG1 THR 146 1HG THR 146 11.703 3.534 2.813 504 HG21 THR 146 3HG2 THR 146 10.859 4.356 0.211 505 HG22 THR 146 1HG2 THR 146 9.675 3.077 -0.057 506 HG23 THR 146 2HG2 THR 146 11.234 3.022 -0.880 507 H ALA 147 H ALA 147 10.724 1.445 3.662 508 HA ALA 147 HA ALA 147 12.948 0.136 4.636 509 HB1 ALA 147 1HB ALA 147 10.418 -0.064 6.234 510 HB2 ALA 147 2HB ALA 147 11.002 1.541 5.800 511 HB3 ALA 147 3HB ALA 147 12.027 0.459 6.735 512 H LYS 148 H LYS 148 13.575 -1.911 4.196 513 HA LYS 148 HA LYS 148 13.463 -4.178 3.809 514 HB2 LYS 148 2HB LYS 148 11.415 -3.842 6.017 515 HB3 LYS 148 1HB LYS 148 11.993 -5.409 5.453 516 HG2 LYS 148 2HG LYS 148 14.305 -4.801 6.035 517 HG3 LYS 148 1HG LYS 148 13.771 -3.197 6.539 518 HD2 LYS 148 2HD LYS 148 12.376 -4.195 8.300 519 HD3 LYS 148 1HD LYS 148 12.863 -5.810 7.792 520 HE2 LYS 148 2HE LYS 148 15.220 -5.263 8.328 521 HE3 LYS 148 1HE LYS 148 14.727 -3.650 8.841 522 HZ1 LYS 148 3HZ LYS 148 13.298 -5.865 10.056 523 HZ2 LYS 148 1HZ LYS 148 13.865 -4.429 10.756 524 HZ3 LYS 148 2HZ LYS 148 14.936 -5.721 10.490 Start of MODEL 6 1 H1 ASP 78 1HT ASP 78 10.124 14.890 3.083 2 H2 ASP 78 2HT ASP 78 9.268 15.964 4.085 3 H3 ASP 78 3HT ASP 78 10.961 16.056 3.984 4 HA ASP 78 HA ASP 78 9.137 16.530 1.699 5 HB2 ASP 78 2HB ASP 78 9.615 18.925 2.058 6 HB3 ASP 78 1HB ASP 78 8.792 18.223 3.451 7 H THR 79 H THR 79 12.227 15.816 2.934 8 HA THR 79 HA THR 79 13.794 17.102 0.894 9 HB THR 79 HB THR 79 14.592 14.735 2.595 10 HG1 THR 79 1HG THR 79 15.519 17.046 3.500 11 HG21 THR 79 3HG2 THR 79 16.032 15.427 0.621 12 HG22 THR 79 1HG2 THR 79 16.838 15.484 2.189 13 HG23 THR 79 2HG2 THR 79 16.269 16.972 1.435 14 H ASP 80 H ASP 80 12.715 13.749 1.456 15 HA ASP 80 HA ASP 80 13.824 12.739 -0.975 16 HB2 ASP 80 2HB ASP 80 11.710 11.661 0.895 17 HB3 ASP 80 1HB ASP 80 12.300 10.777 -0.511 18 H SER 81 H SER 81 10.380 12.857 -0.112 19 HA SER 81 HA SER 81 9.383 14.451 -2.109 20 HB2 SER 81 2HB SER 81 8.567 12.535 -3.692 21 HB3 SER 81 1HB SER 81 10.189 13.177 -3.891 22 HG SER 81 HG SER 81 9.422 10.843 -2.469 23 H GLU 82 H GLU 82 8.553 14.148 0.361 24 HA GLU 82 HA GLU 82 6.761 12.255 1.170 25 HB2 GLU 82 2HB GLU 82 7.431 14.253 2.484 26 HB3 GLU 82 1HB GLU 82 6.396 15.247 1.463 27 HG2 GLU 82 2HG GLU 82 4.428 13.946 2.160 28 HG3 GLU 82 1HG GLU 82 5.455 12.918 3.160 29 H GLU 83 H GLU 83 6.268 14.765 -1.242 30 HA GLU 83 HA GLU 83 3.461 14.505 -1.473 31 HB2 GLU 83 2HB GLU 83 5.570 15.545 -3.364 32 HB3 GLU 83 1HB GLU 83 3.838 15.647 -3.680 33 HG2 GLU 83 2HG GLU 83 3.494 16.910 -1.616 34 HG3 GLU 83 1HG GLU 83 5.201 16.745 -1.207 35 H GLU 84 H GLU 84 6.107 13.058 -3.424 36 HA GLU 84 HA GLU 84 4.544 11.710 -5.283 37 HB2 GLU 84 2HB GLU 84 7.034 11.717 -5.329 38 HB3 GLU 84 1HB GLU 84 7.036 10.587 -3.972 39 HG2 GLU 84 2HG GLU 84 5.764 8.952 -5.323 40 HG3 GLU 84 1HG GLU 84 5.746 10.082 -6.676 41 H ILE 85 H ILE 85 5.540 10.614 -2.029 42 HA ILE 85 HA ILE 85 4.315 8.118 -2.046 43 HB ILE 85 HB ILE 85 4.601 10.083 0.250 44 HG12 ILE 85 2HG1 ILE 85 6.461 7.855 -0.631 45 HG13 ILE 85 1HG1 ILE 85 6.727 9.568 -0.962 46 HG21 ILE 85 1HG2 ILE 85 4.347 7.071 0.287 47 HG22 ILE 85 2HG2 ILE 85 3.065 8.192 0.735 48 HG23 ILE 85 3HG2 ILE 85 4.540 8.113 1.687 49 HD11 ILE 85 3HD1 ILE 85 6.628 8.201 1.734 50 HD12 ILE 85 1HD1 ILE 85 6.543 9.952 1.552 51 HD13 ILE 85 2HD1 ILE 85 7.980 9.080 1.019 52 H ARG 86 H ARG 86 3.066 11.263 -1.015 53 HA ARG 86 HA ARG 86 0.499 10.425 -0.265 54 HB2 ARG 86 2HB ARG 86 1.521 13.071 -1.301 55 HB3 ARG 86 1HB ARG 86 -0.145 12.843 -0.770 56 HG2 ARG 86 2HG ARG 86 0.636 12.128 1.448 57 HG3 ARG 86 1HG ARG 86 2.313 12.292 0.927 58 HD2 ARG 86 2HD ARG 86 1.947 14.700 0.527 59 HD3 ARG 86 1HD ARG 86 0.276 14.535 1.052 60 HE ARG 86 HE ARG 86 2.639 14.569 2.757 61 HH11 ARG 86 1HH2 ARG 86 -0.699 13.744 2.407 62 HH12 ARG 86 2HH2 ARG 86 -1.039 13.827 4.101 63 HH21 ARG 86 1HH1 ARG 86 2.191 14.685 4.988 64 HH22 ARG 86 2HH1 ARG 86 0.588 14.362 5.558 65 H GLU 87 H GLU 87 1.816 11.238 -3.425 66 HA GLU 87 HA GLU 87 -0.740 11.152 -4.768 67 HB2 GLU 87 2HB GLU 87 2.104 11.161 -5.779 68 HB3 GLU 87 1HB GLU 87 0.692 11.152 -6.839 69 HG2 GLU 87 2HG GLU 87 -0.107 13.235 -5.861 70 HG3 GLU 87 1HG GLU 87 1.217 13.231 -4.696 71 H ALA 88 H ALA 88 2.140 9.143 -5.184 72 HA ALA 88 HA ALA 88 1.218 7.095 -6.680 73 HB1 ALA 88 1HB ALA 88 3.500 7.055 -5.961 74 HB2 ALA 88 2HB ALA 88 2.757 5.563 -5.388 75 HB3 ALA 88 3HB ALA 88 3.033 6.897 -4.267 76 H PHE 89 H PHE 89 0.934 7.146 -3.126 77 HA PHE 89 HA PHE 89 -0.623 4.791 -2.989 78 HB2 PHE 89 2HB PHE 89 0.001 7.036 -1.119 79 HB3 PHE 89 1HB PHE 89 -1.262 5.883 -0.675 80 HD1 PHE 89 2HD PHE 89 -0.641 3.337 -1.006 81 HD2 PHE 89 1HD PHE 89 2.238 6.495 -0.613 82 HE1 PHE 89 2HE PHE 89 1.088 1.684 -0.354 83 HE2 PHE 89 1HE PHE 89 3.959 4.838 0.039 84 HZ PHE 89 HZ PHE 89 3.394 2.451 0.158 85 H ARG 90 H ARG 90 -1.564 8.240 -3.046 86 HA ARG 90 HA ARG 90 -4.310 7.892 -2.667 87 HB2 ARG 90 2HB ARG 90 -2.668 9.915 -4.174 88 HB3 ARG 90 1HB ARG 90 -4.425 9.991 -4.253 89 HG2 ARG 90 2HG ARG 90 -3.072 9.762 -1.565 90 HG3 ARG 90 1HG ARG 90 -3.137 11.329 -2.370 91 HD2 ARG 90 2HD ARG 90 -5.634 11.017 -2.584 92 HD3 ARG 90 1HD ARG 90 -5.480 9.576 -1.584 93 HE ARG 90 HE ARG 90 -4.289 11.877 -0.349 94 HH11 ARG 90 1HH2 ARG 90 -7.256 10.242 -1.024 95 HH12 ARG 90 2HH2 ARG 90 -8.095 10.917 0.330 96 HH21 ARG 90 1HH1 ARG 90 -5.367 12.742 1.440 97 HH22 ARG 90 2HH1 ARG 90 -7.023 12.331 1.733 98 H VAL 91 H VAL 91 -2.412 7.733 -5.655 99 HA VAL 91 HA VAL 91 -4.586 7.280 -7.417 100 HB VAL 91 HB VAL 91 -1.652 6.568 -7.638 101 HG11 VAL 91 1HG1 VAL 91 -2.237 6.526 -10.132 102 HG12 VAL 91 2HG1 VAL 91 -3.922 6.414 -9.628 103 HG13 VAL 91 3HG1 VAL 91 -2.784 5.145 -9.179 104 HG21 VAL 91 3HG2 VAL 91 -1.448 8.601 -8.873 105 HG22 VAL 91 1HG2 VAL 91 -2.392 9.012 -7.442 106 HG23 VAL 91 2HG2 VAL 91 -3.198 8.787 -8.995 107 H PHE 92 H PHE 92 -2.388 5.093 -5.705 108 HA PHE 92 HA PHE 92 -3.098 2.659 -6.808 109 HB2 PHE 92 2HB PHE 92 -2.113 3.526 -4.132 110 HB3 PHE 92 1HB PHE 92 -2.710 1.877 -4.249 111 HD1 PHE 92 2HD PHE 92 -0.998 3.853 -6.921 112 HD2 PHE 92 1HD PHE 92 -0.709 0.619 -4.110 113 HE1 PHE 92 2HE PHE 92 1.129 3.127 -7.972 114 HE2 PHE 92 1HE PHE 92 1.418 -0.105 -5.159 115 HZ PHE 92 HZ PHE 92 2.338 1.148 -7.090 116 H ASP 93 H ASP 93 -4.642 4.207 -3.966 117 HA ASP 93 HA ASP 93 -6.575 2.301 -3.473 118 HB2 ASP 93 2HB ASP 93 -6.142 4.445 -2.181 119 HB3 ASP 93 1HB ASP 93 -7.127 5.267 -3.389 120 H LYS 94 H LYS 94 -7.387 1.301 -5.300 121 HA LYS 94 HA LYS 94 -8.278 2.501 -7.651 122 HB2 LYS 94 2HB LYS 94 -8.596 -0.101 -6.304 123 HB3 LYS 94 1HB LYS 94 -9.980 0.296 -7.312 124 HG2 LYS 94 2HG LYS 94 -8.471 -0.905 -8.704 125 HG3 LYS 94 1HG LYS 94 -8.319 0.779 -9.194 126 HD2 LYS 94 2HD LYS 94 -6.265 1.028 -7.946 127 HD3 LYS 94 1HD LYS 94 -6.475 -0.551 -7.191 128 HE2 LYS 94 2HE LYS 94 -4.876 -0.803 -8.986 129 HE3 LYS 94 1HE LYS 94 -6.379 -1.570 -9.498 130 HZ1 LYS 94 3HZ LYS 94 -5.247 -0.024 -11.141 131 HZ2 LYS 94 1HZ LYS 94 -5.772 1.249 -10.147 132 HZ3 LYS 94 2HZ LYS 94 -6.908 0.217 -10.874 133 H ASP 95 H ASP 95 -10.332 1.370 -4.962 134 HA ASP 95 HA ASP 95 -12.621 2.787 -5.955 135 HB2 ASP 95 2HB ASP 95 -12.087 1.353 -3.349 136 HB3 ASP 95 1HB ASP 95 -13.656 1.996 -3.827 137 H GLY 96 H GLY 96 -10.011 4.108 -4.958 138 HA2 GLY 96 2HA GLY 96 -9.356 5.867 -3.551 139 HA3 GLY 96 1HA GLY 96 -10.685 6.620 -4.416 140 H ASN 97 H ASN 97 -10.655 4.119 -1.856 141 HA ASN 97 HA ASN 97 -12.840 5.413 -0.504 142 HB2 ASN 97 2HB ASN 97 -11.091 3.155 0.477 143 HB3 ASN 97 1HB ASN 97 -12.663 3.621 1.118 144 HD21 ASN 97 1HD2 ASN 97 -14.151 3.999 -1.250 145 HD22 ASN 97 2HD2 ASN 97 -14.241 2.530 -2.096 146 H GLY 98 H GLY 98 -9.537 6.017 -0.532 147 HA2 GLY 98 2HA GLY 98 -8.573 7.837 0.657 148 HA3 GLY 98 1HA GLY 98 -9.754 7.612 1.941 149 H TYR 99 H TYR 99 -8.989 4.585 1.472 150 HA TYR 99 HA TYR 99 -6.429 4.588 2.973 151 HB2 TYR 99 2HB TYR 99 -8.654 2.705 3.735 152 HB3 TYR 99 1HB TYR 99 -7.246 3.211 4.671 153 HD1 TYR 99 2HD TYR 99 -7.123 5.492 5.650 154 HD2 TYR 99 1HD TYR 99 -10.658 4.046 3.681 155 HE1 TYR 99 2HE TYR 99 -8.445 7.325 6.673 156 HE2 TYR 99 1HE TYR 99 -11.978 5.879 4.704 157 HH TYR 99 HH TYR 99 -11.792 7.347 6.762 158 H ILE 100 H ILE 100 -5.125 2.730 2.613 159 HA ILE 100 HA ILE 100 -5.626 1.444 0.064 160 HB ILE 100 HB ILE 100 -3.329 0.962 1.964 161 HG12 ILE 100 2HG1 ILE 100 -3.537 3.375 1.574 162 HG13 ILE 100 1HG1 ILE 100 -2.162 2.753 0.666 163 HG21 ILE 100 1HG2 ILE 100 -3.833 0.465 -0.971 164 HG22 ILE 100 2HG2 ILE 100 -3.237 -0.648 0.256 165 HG23 ILE 100 3HG2 ILE 100 -2.191 0.635 -0.352 166 HD11 ILE 100 3HD1 ILE 100 -4.858 3.612 -0.360 167 HD12 ILE 100 1HD1 ILE 100 -3.848 2.519 -1.304 168 HD13 ILE 100 2HD1 ILE 100 -3.259 4.127 -0.889 169 H SER 101 H SER 101 -6.298 -0.565 -0.310 170 HA SER 101 HA SER 101 -6.766 -2.380 1.983 171 HB2 SER 101 2HB SER 101 -8.027 -2.130 -0.736 172 HB3 SER 101 1HB SER 101 -8.229 -3.574 0.247 173 HG SER 101 HG SER 101 -9.831 -1.786 0.454 174 H ALA 102 H ALA 102 -6.361 -4.652 1.638 175 HA ALA 102 HA ALA 102 -3.794 -5.149 0.528 176 HB1 ALA 102 1HB ALA 102 -4.980 -6.294 2.524 177 HB2 ALA 102 2HB ALA 102 -3.982 -7.291 1.469 178 HB3 ALA 102 3HB ALA 102 -5.736 -7.308 1.300 179 H ALA 103 H ALA 103 -7.050 -5.849 -0.612 180 HA ALA 103 HA ALA 103 -6.349 -7.629 -2.668 181 HB1 ALA 103 1HB ALA 103 -8.554 -7.112 -3.584 182 HB2 ALA 103 2HB ALA 103 -8.658 -5.683 -2.554 183 HB3 ALA 103 3HB ALA 103 -8.643 -7.292 -1.831 184 H GLU 104 H GLU 104 -6.417 -4.114 -2.533 185 HA GLU 104 HA GLU 104 -6.191 -3.622 -5.300 186 HB2 GLU 104 2HB GLU 104 -5.255 -1.979 -2.930 187 HB3 GLU 104 1HB GLU 104 -5.467 -1.386 -4.584 188 HG2 GLU 104 2HG GLU 104 -7.837 -1.864 -4.522 189 HG3 GLU 104 1HG GLU 104 -7.671 -2.666 -2.959 190 H LEU 105 H LEU 105 -3.808 -4.362 -2.791 191 HA LEU 105 HA LEU 105 -1.526 -3.509 -4.242 192 HB2 LEU 105 2HB LEU 105 -1.672 -5.707 -2.194 193 HB3 LEU 105 1HB LEU 105 -0.241 -4.786 -2.657 194 HG LEU 105 HG LEU 105 -2.732 -3.700 -1.320 195 HD11 LEU 105 1HD1 LEU 105 -1.450 -4.789 0.323 196 HD12 LEU 105 2HD1 LEU 105 -0.928 -3.113 0.433 197 HD13 LEU 105 3HD1 LEU 105 0.079 -4.295 -0.397 198 HD21 LEU 105 3HD2 LEU 105 -2.036 -1.911 -2.666 199 HD22 LEU 105 1HD2 LEU 105 -0.336 -2.361 -2.571 200 HD23 LEU 105 2HD2 LEU 105 -1.132 -1.618 -1.192 201 H ARG 106 H ARG 106 -3.039 -6.729 -3.956 202 HA ARG 106 HA ARG 106 -1.131 -7.992 -5.597 203 HB2 ARG 106 2HB ARG 106 -2.967 -9.738 -5.895 204 HB3 ARG 106 1HB ARG 106 -2.484 -9.396 -4.234 205 HG2 ARG 106 2HG ARG 106 -4.387 -7.850 -4.008 206 HG3 ARG 106 1HG ARG 106 -4.882 -8.210 -5.660 207 HD2 ARG 106 2HD ARG 106 -5.042 -10.623 -4.989 208 HD3 ARG 106 1HD ARG 106 -4.752 -10.122 -3.328 209 HE ARG 106 HE ARG 106 -6.940 -8.703 -4.555 210 HH11 ARG 106 1HH2 ARG 106 -5.960 -11.584 -2.929 211 HH12 ARG 106 2HH2 ARG 106 -7.542 -11.947 -2.331 212 HH21 ARG 106 1HH1 ARG 106 -9.016 -9.176 -3.778 213 HH22 ARG 106 2HH1 ARG 106 -9.271 -10.589 -2.808 214 H HIS 107 H HIS 107 -4.325 -6.539 -6.381 215 HA HIS 107 HA HIS 107 -4.228 -7.257 -9.118 216 HB2 HIS 107 2HB HIS 107 -5.724 -5.042 -7.703 217 HB3 HIS 107 1HB HIS 107 -6.023 -5.562 -9.364 218 HD1 HIS 107 1HD HIS 107 -6.081 -8.538 -9.223 219 HD2 HIS 107 2HD HIS 107 -7.721 -6.176 -6.205 220 HE1 HIS 107 1HE HIS 107 -7.798 -9.978 -8.039 221 HE2 HIS 107 2HE HIS 107 -8.809 -8.548 -6.200 222 H VAL 108 H VAL 108 -3.557 -4.154 -7.488 223 HA VAL 108 HA VAL 108 -2.876 -2.741 -9.826 224 HB VAL 108 HB VAL 108 -3.341 -1.785 -7.496 225 HG11 VAL 108 1HG1 VAL 108 -0.357 -2.084 -7.162 226 HG12 VAL 108 2HG1 VAL 108 -1.496 -3.238 -6.483 227 HG13 VAL 108 3HG1 VAL 108 -1.543 -1.551 -5.971 228 HG21 VAL 108 3HG2 VAL 108 -1.933 0.190 -7.928 229 HG22 VAL 108 1HG2 VAL 108 -2.622 -0.411 -9.435 230 HG23 VAL 108 2HG2 VAL 108 -0.938 -0.751 -9.038 231 H MET 109 H MET 109 -0.755 -4.404 -7.491 232 HA MET 109 HA MET 109 1.671 -3.868 -8.750 233 HB2 MET 109 2HB MET 109 0.791 -6.271 -7.140 234 HB3 MET 109 1HB MET 109 2.450 -6.011 -7.677 235 HG2 MET 109 2HG MET 109 0.909 -3.948 -6.094 236 HG3 MET 109 1HG MET 109 1.927 -5.168 -5.330 237 HE1 MET 109 3HE MET 109 2.788 -2.560 -4.413 238 HE2 MET 109 1HE MET 109 4.519 -2.569 -4.786 239 HE3 MET 109 2HE MET 109 3.721 -4.046 -4.249 240 H THR 110 H THR 110 -0.664 -6.470 -9.306 241 HA THR 110 HA THR 110 0.838 -7.840 -11.287 242 HB THR 110 HB THR 110 -2.155 -7.686 -10.844 243 HG1 THR 110 1HG THR 110 -0.885 -8.549 -9.129 244 HG21 THR 110 3HG2 THR 110 -0.432 -9.468 -12.576 245 HG22 THR 110 1HG2 THR 110 -1.789 -8.459 -13.080 246 HG23 THR 110 2HG2 THR 110 -2.075 -9.899 -12.102 247 H ASN 111 H ASN 111 -1.608 -5.291 -11.434 248 HA ASN 111 HA ASN 111 -1.778 -5.075 -14.252 249 HB2 ASN 111 2HB ASN 111 -3.399 -4.073 -12.653 250 HB3 ASN 111 1HB ASN 111 -2.180 -2.896 -12.189 251 HD21 ASN 111 1HD2 ASN 111 -3.258 -1.026 -13.071 252 HD22 ASN 111 2HD2 ASN 111 -3.520 -0.828 -14.735 253 H LEU 112 H LEU 112 0.291 -3.565 -11.845 254 HA LEU 112 HA LEU 112 1.586 -1.705 -13.519 255 HB2 LEU 112 2HB LEU 112 2.307 -3.052 -10.923 256 HB3 LEU 112 1HB LEU 112 3.456 -1.983 -11.720 257 HG LEU 112 HG LEU 112 0.608 -1.156 -11.083 258 HD11 LEU 112 1HD1 LEU 112 1.487 -1.561 -8.942 259 HD12 LEU 112 2HD1 LEU 112 1.820 0.150 -9.189 260 HD13 LEU 112 3HD1 LEU 112 3.108 -1.038 -9.398 261 HD21 LEU 112 3HD2 LEU 112 1.919 1.148 -11.119 262 HD22 LEU 112 1HD2 LEU 112 1.422 0.399 -12.631 263 HD23 LEU 112 2HD2 LEU 112 3.088 0.246 -12.081 264 H GLY 113 H GLY 113 2.196 -5.105 -12.769 265 HA2 GLY 113 2HA GLY 113 3.129 -6.273 -14.846 266 HA3 GLY 113 1HA GLY 113 4.450 -5.117 -14.706 267 H GLU 114 H GLU 114 3.567 -5.646 -11.617 268 HA GLU 114 HA GLU 114 5.555 -7.827 -11.264 269 HB2 GLU 114 2HB GLU 114 4.716 -5.614 -9.370 270 HB3 GLU 114 1HB GLU 114 5.899 -6.874 -9.013 271 HG2 GLU 114 2HG GLU 114 6.124 -4.903 -11.304 272 HG3 GLU 114 1HG GLU 114 6.961 -4.743 -9.763 273 H LYS 115 H LYS 115 4.455 -9.677 -11.094 274 HA LYS 115 HA LYS 115 1.902 -9.810 -9.705 275 HB2 LYS 115 2HB LYS 115 2.168 -12.308 -10.321 276 HB3 LYS 115 1HB LYS 115 1.931 -11.151 -11.630 277 HG2 LYS 115 2HG LYS 115 4.334 -11.109 -12.076 278 HG3 LYS 115 1HG LYS 115 4.633 -12.184 -10.712 279 HD2 LYS 115 2HD LYS 115 3.275 -13.937 -11.808 280 HD3 LYS 115 1HD LYS 115 2.997 -12.861 -13.177 281 HE2 LYS 115 2HE LYS 115 5.426 -12.753 -13.586 282 HE3 LYS 115 1HE LYS 115 5.703 -13.837 -12.224 283 HZ1 LYS 115 3HZ LYS 115 4.847 -15.616 -13.342 284 HZ2 LYS 115 1HZ LYS 115 5.513 -14.757 -14.643 285 HZ3 LYS 115 2HZ LYS 115 3.845 -14.669 -14.335 286 H LEU 116 H LEU 116 2.450 -9.349 -7.568 287 HA LEU 116 HA LEU 116 4.439 -10.861 -6.138 288 HB2 LEU 116 2HB LEU 116 2.402 -8.775 -5.464 289 HB3 LEU 116 1HB LEU 116 3.006 -9.766 -4.142 290 HG LEU 116 HG LEU 116 5.316 -9.137 -4.702 291 HD11 LEU 116 1HD1 LEU 116 5.585 -7.237 -6.391 292 HD12 LEU 116 2HD1 LEU 116 3.950 -7.619 -6.928 293 HD13 LEU 116 3HD1 LEU 116 5.226 -8.825 -7.068 294 HD21 LEU 116 3HD2 LEU 116 5.212 -6.910 -3.855 295 HD22 LEU 116 1HD2 LEU 116 3.764 -7.700 -3.227 296 HD23 LEU 116 2HD2 LEU 116 3.648 -6.613 -4.614 297 H THR 117 H THR 117 3.350 -11.636 -3.825 298 HA THR 117 HA THR 117 1.444 -13.787 -4.590 299 HB THR 117 HB THR 117 2.378 -14.983 -2.593 300 HG1 THR 117 1HG THR 117 4.345 -14.146 -1.777 301 HG21 THR 117 3HG2 THR 117 3.219 -15.242 -4.999 302 HG22 THR 117 1HG2 THR 117 4.320 -15.764 -3.723 303 HG23 THR 117 2HG2 THR 117 4.569 -14.212 -4.522 304 H ASP 118 H ASP 118 -0.482 -13.834 -3.637 305 HA ASP 118 HA ASP 118 -1.509 -11.726 -2.147 306 HB2 ASP 118 2HB ASP 118 -2.404 -14.594 -2.419 307 HB3 ASP 118 1HB ASP 118 -3.330 -13.400 -1.512 308 H GLU 119 H GLU 119 0.019 -14.711 -1.066 309 HA GLU 119 HA GLU 119 -0.661 -14.531 1.660 310 HB2 GLU 119 2HB GLU 119 1.736 -15.778 0.292 311 HB3 GLU 119 1HB GLU 119 1.326 -16.013 1.995 312 HG2 GLU 119 2HG GLU 119 -0.862 -16.931 1.358 313 HG3 GLU 119 1HG GLU 119 -0.490 -16.659 -0.343 314 H GLU 120 H GLU 120 2.044 -13.197 -0.206 315 HA GLU 120 HA GLU 120 3.379 -12.082 2.082 316 HB2 GLU 120 2HB GLU 120 3.623 -11.547 -0.884 317 HB3 GLU 120 1HB GLU 120 4.607 -10.729 0.330 318 HG2 GLU 120 2HG GLU 120 5.512 -12.847 1.101 319 HG3 GLU 120 1HG GLU 120 4.434 -13.739 0.029 320 H VAL 121 H VAL 121 1.228 -10.801 -0.442 321 HA VAL 121 HA VAL 121 1.150 -8.128 0.259 322 HB VAL 121 HB VAL 121 -1.057 -9.970 -0.690 323 HG11 VAL 121 1HG1 VAL 121 -2.168 -8.122 0.339 324 HG12 VAL 121 2HG1 VAL 121 -2.178 -7.819 -1.393 325 HG13 VAL 121 3HG1 VAL 121 -1.030 -6.972 -0.354 326 HG21 VAL 121 3HG2 VAL 121 0.778 -9.695 -2.275 327 HG22 VAL 121 1HG2 VAL 121 0.729 -7.944 -2.077 328 HG23 VAL 121 2HG2 VAL 121 -0.616 -8.783 -2.852 329 H ASP 122 H ASP 122 -1.345 -10.440 1.260 330 HA ASP 122 HA ASP 122 -2.538 -9.024 3.257 331 HB2 ASP 122 2HB ASP 122 -3.103 -11.362 2.408 332 HB3 ASP 122 1HB ASP 122 -1.906 -11.961 3.555 333 H GLU 123 H GLU 123 0.494 -10.872 3.471 334 HA GLU 123 HA GLU 123 0.841 -10.514 6.275 335 HB2 GLU 123 2HB GLU 123 2.005 -12.256 4.921 336 HB3 GLU 123 1HB GLU 123 2.990 -10.983 4.206 337 HG2 GLU 123 2HG GLU 123 3.854 -10.355 6.398 338 HG3 GLU 123 1HG GLU 123 2.804 -11.539 7.177 339 H MET 124 H MET 124 1.907 -8.670 3.443 340 HA MET 124 HA MET 124 3.713 -6.920 4.639 341 HB2 MET 124 2HB MET 124 1.780 -6.462 2.357 342 HB3 MET 124 1HB MET 124 2.953 -5.250 2.866 343 HG2 MET 124 2HG MET 124 3.859 -8.058 2.276 344 HG3 MET 124 1HG MET 124 3.626 -6.899 0.966 345 HE1 MET 124 3HE MET 124 6.176 -8.482 1.958 346 HE2 MET 124 1HE MET 124 7.496 -7.312 1.836 347 HE3 MET 124 2HE MET 124 6.316 -7.451 0.535 348 H ILE 125 H ILE 125 0.327 -5.975 3.894 349 HA ILE 125 HA ILE 125 0.302 -3.703 5.472 350 HB ILE 125 HB ILE 125 -1.902 -5.591 4.637 351 HG12 ILE 125 2HG1 ILE 125 -1.294 -2.750 3.743 352 HG13 ILE 125 1HG1 ILE 125 -0.697 -4.188 2.916 353 HG21 ILE 125 1HG2 ILE 125 -3.328 -3.398 5.279 354 HG22 ILE 125 2HG2 ILE 125 -2.031 -3.234 6.464 355 HG23 ILE 125 3HG2 ILE 125 -3.016 -4.686 6.444 356 HD11 ILE 125 3HD1 ILE 125 -2.736 -3.482 1.786 357 HD12 ILE 125 1HD1 ILE 125 -3.599 -3.402 3.325 358 HD13 ILE 125 2HD1 ILE 125 -3.076 -4.957 2.688 359 H ARG 126 H ARG 126 -0.518 -7.020 6.345 360 HA ARG 126 HA ARG 126 -1.520 -6.641 8.891 361 HB2 ARG 126 2HB ARG 126 0.119 -8.829 7.651 362 HB3 ARG 126 1HB ARG 126 -0.394 -8.947 9.331 363 HG2 ARG 126 2HG ARG 126 -2.433 -8.278 7.208 364 HG3 ARG 126 1HG ARG 126 -1.918 -9.954 7.414 365 HD2 ARG 126 2HD ARG 126 -2.502 -9.819 9.824 366 HD3 ARG 126 1HD ARG 126 -3.080 -8.176 9.584 367 HE ARG 126 HE ARG 126 -4.400 -9.889 7.765 368 HH11 ARG 126 1HH2 ARG 126 -4.129 -9.163 11.128 369 HH12 ARG 126 2HH2 ARG 126 -5.749 -9.641 11.507 370 HH21 ARG 126 1HH1 ARG 126 -6.536 -10.494 8.242 371 HH22 ARG 126 2HH1 ARG 126 -7.114 -10.394 9.870 372 H GLU 127 H GLU 127 1.906 -6.931 7.939 373 HA GLU 127 HA GLU 127 2.856 -6.649 10.624 374 HB2 GLU 127 2HB GLU 127 4.270 -6.408 7.971 375 HB3 GLU 127 1HB GLU 127 5.083 -6.336 9.534 376 HG2 GLU 127 2HG GLU 127 4.216 -8.563 10.103 377 HG3 GLU 127 1HG GLU 127 3.365 -8.636 8.561 378 H ALA 128 H ALA 128 1.263 -4.523 8.816 379 HA ALA 128 HA ALA 128 2.336 -2.245 10.299 380 HB1 ALA 128 1HB ALA 128 2.253 -2.227 7.281 381 HB2 ALA 128 2HB ALA 128 3.711 -2.330 8.270 382 HB3 ALA 128 3HB ALA 128 2.714 -0.882 8.328 383 H ASP 129 H ASP 129 -0.189 -3.621 10.317 384 HA ASP 129 HA ASP 129 -2.022 -1.630 9.113 385 HB2 ASP 129 2HB ASP 129 -2.318 -4.111 8.687 386 HB3 ASP 129 1HB ASP 129 -2.801 -4.249 10.371 387 H ILE 130 H ILE 130 -2.377 -0.005 10.448 388 HA ILE 130 HA ILE 130 -2.369 -0.251 13.323 389 HB ILE 130 HB ILE 130 -3.383 2.027 11.615 390 HG12 ILE 130 2HG1 ILE 130 -1.084 1.517 11.068 391 HG13 ILE 130 1HG1 ILE 130 -1.137 2.995 12.027 392 HG21 ILE 130 1HG2 ILE 130 -4.200 2.465 13.766 393 HG22 ILE 130 2HG2 ILE 130 -2.632 3.267 13.809 394 HG23 ILE 130 3HG2 ILE 130 -2.833 1.685 14.560 395 HD11 ILE 130 3HD1 ILE 130 -0.139 0.270 12.774 396 HD12 ILE 130 1HD1 ILE 130 -0.760 1.325 14.044 397 HD13 ILE 130 2HD1 ILE 130 0.603 1.843 13.049 398 H ASP 131 H ASP 131 -4.336 0.718 14.511 399 HA ASP 131 HA ASP 131 -6.374 0.056 15.395 400 HB2 ASP 131 2HB ASP 131 -7.058 0.964 12.595 401 HB3 ASP 131 1HB ASP 131 -8.263 0.669 13.845 402 H GLY 132 H GLY 132 -4.952 -1.918 13.265 403 HA2 GLY 132 2HA GLY 132 -5.368 -3.990 12.298 404 HA3 GLY 132 1HA GLY 132 -6.155 -4.312 13.844 405 H ASP 133 H ASP 133 -6.838 -2.457 10.848 406 HA ASP 133 HA ASP 133 -9.635 -3.462 10.958 407 HB2 ASP 133 2HB ASP 133 -10.249 -1.430 9.716 408 HB3 ASP 133 1HB ASP 133 -9.493 -1.038 11.261 409 H GLY 134 H GLY 134 -6.739 -3.252 9.047 410 HA2 GLY 134 2HA GLY 134 -6.395 -4.831 7.250 411 HA3 GLY 134 1HA GLY 134 -8.110 -4.743 6.876 412 H GLN 135 H GLN 135 -6.963 -1.673 7.548 413 HA GLN 135 HA GLN 135 -6.150 -1.123 4.778 414 HB2 GLN 135 2HB GLN 135 -8.361 0.274 6.277 415 HB3 GLN 135 1HB GLN 135 -7.569 0.959 4.860 416 HG2 GLN 135 2HG GLN 135 -8.137 -1.134 3.598 417 HG3 GLN 135 1HG GLN 135 -9.066 -1.664 4.997 418 HE21 GLN 135 1HE2 GLN 135 -11.096 -0.593 5.430 419 HE22 GLN 135 2HE2 GLN 135 -11.802 0.468 4.308 420 H VAL 136 H VAL 136 -4.670 0.529 4.541 421 HA VAL 136 HA VAL 136 -3.846 1.929 7.014 422 HB VAL 136 HB VAL 136 -1.643 1.258 6.864 423 HG11 VAL 136 1HG1 VAL 136 -3.246 -0.650 7.334 424 HG12 VAL 136 2HG1 VAL 136 -1.594 -1.072 6.895 425 HG13 VAL 136 3HG1 VAL 136 -2.885 -1.195 5.701 426 HG21 VAL 136 3HG2 VAL 136 -0.730 0.039 4.801 427 HG22 VAL 136 1HG2 VAL 136 -1.057 1.766 4.626 428 HG23 VAL 136 2HG2 VAL 136 -2.201 0.583 3.994 429 H ASN 137 H ASN 137 -3.192 3.982 6.769 430 HA ASN 137 HA ASN 137 -3.743 5.349 4.341 431 HB2 ASN 137 2HB ASN 137 -2.134 6.276 6.732 432 HB3 ASN 137 1HB ASN 137 -2.747 7.311 5.442 433 HD21 ASN 137 1HD2 ASN 137 -3.549 5.909 8.461 434 HD22 ASN 137 2HD2 ASN 137 -5.206 6.273 8.440 435 H TYR 138 H TYR 138 -1.381 7.113 4.370 436 HA TYR 138 HA TYR 138 0.181 5.635 2.469 437 HB2 TYR 138 2HB TYR 138 0.987 8.342 3.487 438 HB3 TYR 138 1HB TYR 138 1.030 7.705 1.842 439 HD1 TYR 138 1HD TYR 138 -1.755 6.595 1.632 440 HD2 TYR 138 2HD TYR 138 -0.315 10.298 3.260 441 HE1 TYR 138 1HE TYR 138 -3.972 7.635 1.218 442 HE2 TYR 138 2HE TYR 138 -2.533 11.342 2.841 443 HH TYR 138 HH TYR 138 -5.164 9.504 1.288 444 H GLU 139 H GLU 139 1.060 7.349 5.494 445 HA GLU 139 HA GLU 139 3.732 6.540 5.642 446 HB2 GLU 139 2HB GLU 139 3.108 6.668 8.286 447 HB3 GLU 139 1HB GLU 139 3.322 8.104 7.282 448 HG2 GLU 139 2HG GLU 139 0.978 8.380 6.978 449 HG3 GLU 139 1HG GLU 139 0.626 6.765 7.577 450 H GLU 140 H GLU 140 1.211 5.176 7.701 451 HA GLU 140 HA GLU 140 2.213 2.929 8.731 452 HB2 GLU 140 2HB GLU 140 -0.430 3.076 7.266 453 HB3 GLU 140 1HB GLU 140 0.035 1.747 8.322 454 HG2 GLU 140 2HG GLU 140 0.167 3.231 10.206 455 HG3 GLU 140 1HG GLU 140 -0.099 4.643 9.192 456 H PHE 141 H PHE 141 1.637 3.508 5.364 457 HA PHE 141 HA PHE 141 2.257 0.794 4.503 458 HB2 PHE 141 2HB PHE 141 0.645 2.660 3.397 459 HB3 PHE 141 1HB PHE 141 2.125 3.069 2.547 460 HD1 PHE 141 2HD PHE 141 3.540 0.863 1.802 461 HD2 PHE 141 1HD PHE 141 -0.709 1.102 2.331 462 HE1 PHE 141 2HE PHE 141 3.238 -1.107 0.324 463 HE2 PHE 141 1HE PHE 141 -1.014 -0.856 0.900 464 HZ PHE 141 HZ PHE 141 0.969 -1.969 -0.137 465 H VAL 142 H VAL 142 3.588 4.059 4.050 466 HA VAL 142 HA VAL 142 5.805 3.710 2.568 467 HB VAL 142 HB VAL 142 5.637 5.261 5.166 468 HG11 VAL 142 1HG1 VAL 142 7.861 5.096 3.116 469 HG12 VAL 142 2HG1 VAL 142 7.982 4.923 4.866 470 HG13 VAL 142 3HG1 VAL 142 7.652 6.504 4.158 471 HG21 VAL 142 3HG2 VAL 142 5.579 6.093 2.251 472 HG22 VAL 142 1HG2 VAL 142 5.389 7.165 3.636 473 HG23 VAL 142 2HG2 VAL 142 4.164 5.949 3.286 474 H GLN 143 H GLN 143 5.924 3.230 6.111 475 HA GLN 143 HA GLN 143 8.402 2.178 6.430 476 HB2 GLN 143 2HB GLN 143 5.825 1.262 7.729 477 HB3 GLN 143 1HB GLN 143 7.428 0.804 8.305 478 HG2 GLN 143 2HG GLN 143 8.009 3.185 8.598 479 HG3 GLN 143 1HG GLN 143 6.411 3.649 8.016 480 HE21 GLN 143 1HE2 GLN 143 6.448 4.685 10.334 481 HE22 GLN 143 2HE2 GLN 143 5.871 3.705 11.594 482 H MET 144 H MET 144 5.974 0.832 4.554 483 HA MET 144 HA MET 144 7.166 -1.873 4.467 484 HB2 MET 144 2HB MET 144 4.583 -1.006 3.152 485 HB3 MET 144 1HB MET 144 5.136 -2.646 3.474 486 HG2 MET 144 2HG MET 144 4.445 -0.564 5.561 487 HG3 MET 144 1HG MET 144 3.485 -1.990 5.163 488 HE1 MET 144 3HE MET 144 5.784 -4.427 4.886 489 HE2 MET 144 1HE MET 144 4.090 -4.215 5.332 490 HE3 MET 144 2HE MET 144 5.215 -4.946 6.470 491 H MET 145 H MET 145 5.954 0.627 2.194 492 HA MET 145 HA MET 145 7.177 -0.614 -0.070 493 HB2 MET 145 2HB MET 145 5.226 0.866 -0.283 494 HB3 MET 145 1HB MET 145 6.195 2.226 0.279 495 HG2 MET 145 2HG MET 145 7.280 0.682 -2.048 496 HG3 MET 145 1HG MET 145 5.867 1.693 -2.346 497 HE1 MET 145 3HE MET 145 5.560 3.821 -1.293 498 HE2 MET 145 1HE MET 145 6.223 4.513 -2.780 499 HE3 MET 145 2HE MET 145 6.754 5.116 -1.212 500 H THR 146 H THR 146 8.537 1.031 2.488 501 HA THR 146 HA THR 146 10.999 1.535 0.936 502 HB THR 146 HB THR 146 10.059 3.498 3.027 503 HG1 THR 146 1HG THR 146 9.630 4.715 0.932 504 HG21 THR 146 3HG2 THR 146 11.713 4.935 2.007 505 HG22 THR 146 1HG2 THR 146 11.957 3.797 0.683 506 HG23 THR 146 2HG2 THR 146 12.479 3.378 2.315 507 H ALA 147 H ALA 147 10.701 -0.712 2.347 508 HA ALA 147 HA ALA 147 11.324 -0.631 5.085 509 HB1 ALA 147 1HB ALA 147 10.567 -2.674 3.946 510 HB2 ALA 147 2HB ALA 147 12.100 -2.949 4.774 511 HB3 ALA 147 3HB ALA 147 12.071 -2.720 3.027 512 H LYS 148 H LYS 148 13.204 -0.389 6.198 513 HA LYS 148 HA LYS 148 15.424 0.837 4.938 514 HB2 LYS 148 2HB LYS 148 16.543 0.585 7.131 515 HB3 LYS 148 1HB LYS 148 14.925 1.264 7.283 516 HG2 LYS 148 2HG LYS 148 14.066 -1.033 7.794 517 HG3 LYS 148 1HG LYS 148 15.730 -1.618 7.770 518 HD2 LYS 148 2HD LYS 148 16.319 -0.066 9.590 519 HD3 LYS 148 1HD LYS 148 14.667 0.553 9.604 520 HE2 LYS 148 2HE LYS 148 13.831 -1.698 10.175 521 HE3 LYS 148 1HE LYS 148 15.484 -2.308 10.176 522 HZ1 LYS 148 3HZ LYS 148 15.902 -0.462 11.873 523 HZ2 LYS 148 1HZ LYS 148 15.065 -1.839 12.394 524 HZ3 LYS 148 2HZ LYS 148 14.213 -0.412 12.048 Start of MODEL 7 1 H1 ASP 78 1HT ASP 78 7.070 24.497 -2.732 2 H2 ASP 78 2HT ASP 78 8.614 24.208 -3.381 3 H3 ASP 78 3HT ASP 78 8.023 23.229 -2.127 4 HA ASP 78 HA ASP 78 6.347 22.300 -3.535 5 HB2 ASP 78 2HB ASP 78 5.954 24.387 -4.829 6 HB3 ASP 78 1HB ASP 78 7.489 24.136 -5.660 7 H THR 79 H THR 79 7.464 20.396 -3.283 8 HA THR 79 HA THR 79 9.400 19.712 -5.349 9 HB THR 79 HB THR 79 10.880 20.620 -3.649 10 HG1 THR 79 1HG THR 79 11.880 18.912 -4.430 11 HG21 THR 79 3HG2 THR 79 9.412 20.487 -1.712 12 HG22 THR 79 1HG2 THR 79 10.902 19.608 -1.367 13 HG23 THR 79 2HG2 THR 79 9.432 18.725 -1.779 14 H ASP 80 H ASP 80 9.785 17.409 -5.475 15 HA ASP 80 HA ASP 80 7.482 15.842 -5.077 16 HB2 ASP 80 2HB ASP 80 10.359 15.051 -5.567 17 HB3 ASP 80 1HB ASP 80 9.020 13.907 -5.568 18 H SER 81 H SER 81 10.644 15.309 -3.496 19 HA SER 81 HA SER 81 11.096 14.132 -1.531 20 HB2 SER 81 2HB SER 81 10.493 15.451 0.386 21 HB3 SER 81 1HB SER 81 10.811 16.557 -0.946 22 HG SER 81 HG SER 81 8.558 16.196 0.471 23 H GLU 82 H GLU 82 9.110 14.335 0.737 24 HA GLU 82 HA GLU 82 8.006 11.760 0.579 25 HB2 GLU 82 2HB GLU 82 8.456 13.039 2.682 26 HB3 GLU 82 1HB GLU 82 7.076 14.066 2.308 27 HG2 GLU 82 2HG GLU 82 5.571 12.142 2.401 28 HG3 GLU 82 1HG GLU 82 6.935 11.057 2.656 29 H GLU 83 H GLU 83 6.987 14.675 -0.876 30 HA GLU 83 HA GLU 83 4.189 14.325 -0.820 31 HB2 GLU 83 2HB GLU 83 5.729 16.348 -1.617 32 HB3 GLU 83 1HB GLU 83 5.475 15.616 -3.200 33 HG2 GLU 83 2HG GLU 83 3.035 15.702 -2.851 34 HG3 GLU 83 1HG GLU 83 3.291 16.450 -1.276 35 H GLU 84 H GLU 84 6.541 13.423 -3.396 36 HA GLU 84 HA GLU 84 4.756 12.308 -5.194 37 HB2 GLU 84 2HB GLU 84 7.171 12.483 -5.665 38 HB3 GLU 84 1HB GLU 84 7.491 11.204 -4.493 39 HG2 GLU 84 2HG GLU 84 6.156 9.623 -5.822 40 HG3 GLU 84 1HG GLU 84 5.762 10.902 -6.970 41 H ILE 85 H ILE 85 6.117 10.883 -2.261 42 HA ILE 85 HA ILE 85 5.070 8.281 -2.592 43 HB ILE 85 HB ILE 85 5.710 9.877 -0.104 44 HG12 ILE 85 2HG1 ILE 85 7.242 7.637 -1.440 45 HG13 ILE 85 1HG1 ILE 85 7.575 9.343 -1.739 46 HG21 ILE 85 1HG2 ILE 85 4.198 8.115 0.547 47 HG22 ILE 85 2HG2 ILE 85 5.829 7.596 0.966 48 HG23 ILE 85 3HG2 ILE 85 5.049 6.957 -0.475 49 HD11 ILE 85 3HD1 ILE 85 9.097 8.871 -0.029 50 HD12 ILE 85 1HD1 ILE 85 8.011 7.729 0.756 51 HD13 ILE 85 2HD1 ILE 85 7.726 9.460 0.906 52 H ARG 86 H ARG 86 3.809 11.188 -0.989 53 HA ARG 86 HA ARG 86 1.435 10.088 0.020 54 HB2 ARG 86 2HB ARG 86 2.108 12.905 -0.849 55 HB3 ARG 86 1HB ARG 86 0.591 12.475 -0.062 56 HG2 ARG 86 2HG ARG 86 1.799 11.612 1.879 57 HG3 ARG 86 1HG ARG 86 3.342 11.927 1.090 58 HD2 ARG 86 2HD ARG 86 2.887 13.742 2.642 59 HD3 ARG 86 1HD ARG 86 2.747 14.356 1.001 60 HE ARG 86 HE ARG 86 0.441 14.611 1.317 61 HH11 ARG 86 1HH2 ARG 86 1.960 12.956 3.955 62 HH12 ARG 86 2HH2 ARG 86 0.566 13.026 4.980 63 HH21 ARG 86 1HH1 ARG 86 -1.389 14.698 2.650 64 HH22 ARG 86 2HH1 ARG 86 -1.332 14.015 4.241 65 H GLU 87 H GLU 87 2.249 11.243 -3.195 66 HA GLU 87 HA GLU 87 -0.463 11.216 -4.176 67 HB2 GLU 87 2HB GLU 87 2.216 11.280 -5.585 68 HB3 GLU 87 1HB GLU 87 0.664 11.373 -6.420 69 HG2 GLU 87 2HG GLU 87 0.073 13.389 -5.195 70 HG3 GLU 87 1HG GLU 87 1.545 13.274 -4.233 71 H ALA 88 H ALA 88 2.323 9.284 -5.179 72 HA ALA 88 HA ALA 88 1.248 7.277 -6.595 73 HB1 ALA 88 1HB ALA 88 3.231 6.776 -4.364 74 HB2 ALA 88 2HB ALA 88 3.639 7.337 -5.985 75 HB3 ALA 88 3HB ALA 88 2.949 5.731 -5.755 76 H PHE 89 H PHE 89 1.229 7.327 -3.025 77 HA PHE 89 HA PHE 89 -0.251 4.925 -2.769 78 HB2 PHE 89 2HB PHE 89 0.559 7.150 -0.956 79 HB3 PHE 89 1HB PHE 89 -0.721 6.059 -0.408 80 HD1 PHE 89 2HD PHE 89 -0.226 3.473 -0.861 81 HD2 PHE 89 1HD PHE 89 2.779 6.513 -0.516 82 HE1 PHE 89 2HE PHE 89 1.475 1.739 -0.358 83 HE2 PHE 89 1HE PHE 89 4.477 4.778 -0.027 84 HZ PHE 89 HZ PHE 89 3.827 2.400 0.046 85 H ARG 90 H ARG 90 -1.236 8.360 -2.933 86 HA ARG 90 HA ARG 90 -3.948 7.946 -2.270 87 HB2 ARG 90 2HB ARG 90 -2.506 10.031 -3.896 88 HB3 ARG 90 1HB ARG 90 -4.257 10.073 -3.730 89 HG2 ARG 90 2HG ARG 90 -2.526 9.811 -1.275 90 HG3 ARG 90 1HG ARG 90 -2.763 11.395 -2.010 91 HD2 ARG 90 2HD ARG 90 -5.272 10.932 -1.869 92 HD3 ARG 90 1HD ARG 90 -4.866 9.537 -0.877 93 HE ARG 90 HE ARG 90 -4.866 12.263 -0.035 94 HH11 ARG 90 1HH2 ARG 90 -3.221 9.235 0.285 95 HH12 ARG 90 2HH2 ARG 90 -2.673 9.551 1.897 96 HH21 ARG 90 1HH1 ARG 90 -4.168 12.672 2.075 97 HH22 ARG 90 2HH1 ARG 90 -3.218 11.491 2.914 98 H VAL 91 H VAL 91 -2.322 7.966 -5.441 99 HA VAL 91 HA VAL 91 -4.691 7.461 -6.941 100 HB VAL 91 HB VAL 91 -3.090 6.832 -8.768 101 HG11 VAL 91 1HG1 VAL 91 -2.316 9.375 -7.311 102 HG12 VAL 91 2HG1 VAL 91 -3.795 9.206 -8.255 103 HG13 VAL 91 3HG1 VAL 91 -2.224 9.070 -9.046 104 HG21 VAL 91 3HG2 VAL 91 -0.683 7.162 -8.301 105 HG22 VAL 91 1HG2 VAL 91 -1.352 5.847 -7.333 106 HG23 VAL 91 2HG2 VAL 91 -1.061 7.426 -6.602 107 H PHE 92 H PHE 92 -2.438 5.421 -5.249 108 HA PHE 92 HA PHE 92 -2.866 2.961 -6.518 109 HB2 PHE 92 2HB PHE 92 -1.833 3.866 -3.950 110 HB3 PHE 92 1HB PHE 92 -2.702 2.357 -3.744 111 HD1 PHE 92 2HD PHE 92 -0.587 3.724 -6.539 112 HD2 PHE 92 1HD PHE 92 -1.167 0.609 -3.637 113 HE1 PHE 92 2HE PHE 92 1.353 2.491 -7.473 114 HE2 PHE 92 1HE PHE 92 0.765 -0.621 -4.570 115 HZ PHE 92 HZ PHE 92 2.027 0.317 -6.488 116 H ASP 93 H ASP 93 -4.677 4.373 -3.785 117 HA ASP 93 HA ASP 93 -6.536 2.311 -3.513 118 HB2 ASP 93 2HB ASP 93 -6.195 4.372 -2.016 119 HB3 ASP 93 1HB ASP 93 -7.232 5.225 -3.156 120 H LYS 94 H LYS 94 -7.029 1.577 -5.633 121 HA LYS 94 HA LYS 94 -7.984 3.118 -7.751 122 HB2 LYS 94 2HB LYS 94 -8.517 0.275 -6.904 123 HB3 LYS 94 1HB LYS 94 -9.287 0.949 -8.340 124 HG2 LYS 94 2HG LYS 94 -7.142 1.427 -9.346 125 HG3 LYS 94 1HG LYS 94 -6.293 0.980 -7.866 126 HD2 LYS 94 2HD LYS 94 -6.701 -1.301 -8.157 127 HD3 LYS 94 1HD LYS 94 -8.107 -1.033 -9.169 128 HE2 LYS 94 2HE LYS 94 -5.462 -0.092 -10.209 129 HE3 LYS 94 1HE LYS 94 -5.803 -1.823 -10.237 130 HZ1 LYS 94 3HZ LYS 94 -8.056 -1.018 -11.222 131 HZ2 LYS 94 1HZ LYS 94 -6.692 -1.157 -12.218 132 HZ3 LYS 94 2HZ LYS 94 -7.166 0.367 -11.639 133 H ASP 95 H ASP 95 -9.906 1.430 -5.259 134 HA ASP 95 HA ASP 95 -12.369 2.611 -6.082 135 HB2 ASP 95 2HB ASP 95 -12.156 0.426 -4.891 136 HB3 ASP 95 1HB ASP 95 -11.663 1.305 -3.443 137 H GLY 96 H GLY 96 -9.940 4.284 -5.219 138 HA2 GLY 96 2HA GLY 96 -9.437 6.040 -3.716 139 HA3 GLY 96 1HA GLY 96 -10.839 6.655 -4.580 140 H ASN 97 H ASN 97 -10.701 4.076 -2.127 141 HA ASN 97 HA ASN 97 -12.950 5.167 -0.751 142 HB2 ASN 97 2HB ASN 97 -12.839 3.285 0.656 143 HB3 ASN 97 1HB ASN 97 -12.273 2.705 -0.906 144 HD21 ASN 97 1HD2 ASN 97 -11.458 1.111 1.070 145 HD22 ASN 97 2HD2 ASN 97 -9.845 1.392 1.516 146 H GLY 98 H GLY 98 -9.698 6.017 -0.712 147 HA2 GLY 98 2HA GLY 98 -8.814 7.832 0.511 148 HA3 GLY 98 1HA GLY 98 -10.095 7.638 1.701 149 H TYR 99 H TYR 99 -8.508 4.783 0.737 150 HA TYR 99 HA TYR 99 -6.397 4.872 2.703 151 HB2 TYR 99 2HB TYR 99 -8.836 3.147 3.176 152 HB3 TYR 99 1HB TYR 99 -7.287 2.912 3.984 153 HD1 TYR 99 2HD TYR 99 -6.371 4.644 5.504 154 HD2 TYR 99 1HD TYR 99 -10.276 5.010 3.751 155 HE1 TYR 99 2HE TYR 99 -6.939 6.417 7.141 156 HE2 TYR 99 1HE TYR 99 -10.844 6.785 5.389 157 HH TYR 99 HH TYR 99 -8.480 7.832 7.852 158 H ILE 100 H ILE 100 -5.775 2.241 2.978 159 HA ILE 100 HA ILE 100 -5.563 1.258 0.172 160 HB ILE 100 HB ILE 100 -3.498 1.160 2.367 161 HG12 ILE 100 2HG1 ILE 100 -3.704 3.390 1.347 162 HG13 ILE 100 1HG1 ILE 100 -2.195 2.634 0.865 163 HG21 ILE 100 1HG2 ILE 100 -2.066 0.318 0.430 164 HG22 ILE 100 2HG2 ILE 100 -3.577 0.018 -0.420 165 HG23 ILE 100 3HG2 ILE 100 -3.233 -0.827 1.093 166 HD11 ILE 100 3HD1 ILE 100 -4.637 3.168 -0.766 167 HD12 ILE 100 1HD1 ILE 100 -3.619 1.798 -1.199 168 HD13 ILE 100 2HD1 ILE 100 -2.943 3.422 -1.173 169 H SER 101 H SER 101 -6.592 -0.608 -0.118 170 HA SER 101 HA SER 101 -6.914 -2.479 2.141 171 HB2 SER 101 2HB SER 101 -8.961 -1.797 0.909 172 HB3 SER 101 1HB SER 101 -8.260 -2.436 -0.572 173 HG SER 101 HG SER 101 -8.023 -4.447 0.762 174 H ALA 102 H ALA 102 -6.614 -4.773 1.682 175 HA ALA 102 HA ALA 102 -4.111 -5.297 0.469 176 HB1 ALA 102 1HB ALA 102 -4.370 -7.504 1.205 177 HB2 ALA 102 2HB ALA 102 -6.130 -7.434 1.086 178 HB3 ALA 102 3HB ALA 102 -5.299 -6.567 2.373 179 H ALA 103 H ALA 103 -7.425 -5.800 -0.682 180 HA ALA 103 HA ALA 103 -6.819 -7.446 -2.847 181 HB1 ALA 103 1HB ALA 103 -9.010 -5.392 -2.942 182 HB2 ALA 103 2HB ALA 103 -9.095 -6.734 -1.802 183 HB3 ALA 103 3HB ALA 103 -9.013 -7.053 -3.528 184 H GLU 104 H GLU 104 -6.725 -3.924 -2.519 185 HA GLU 104 HA GLU 104 -6.441 -3.340 -5.268 186 HB2 GLU 104 2HB GLU 104 -5.485 -1.792 -2.846 187 HB3 GLU 104 1HB GLU 104 -5.684 -1.150 -4.476 188 HG2 GLU 104 2HG GLU 104 -8.064 -1.562 -4.414 189 HG3 GLU 104 1HG GLU 104 -7.914 -2.410 -2.878 190 H LEU 105 H LEU 105 -4.103 -4.141 -2.714 191 HA LEU 105 HA LEU 105 -1.813 -3.335 -4.193 192 HB2 LEU 105 2HB LEU 105 -1.913 -5.528 -2.138 193 HB3 LEU 105 1HB LEU 105 -0.541 -4.513 -2.563 194 HG LEU 105 HG LEU 105 -3.089 -3.649 -1.193 195 HD11 LEU 105 1HD1 LEU 105 -1.687 -3.223 0.693 196 HD12 LEU 105 2HD1 LEU 105 -0.225 -3.426 -0.264 197 HD13 LEU 105 3HD1 LEU 105 -1.236 -4.819 0.110 198 HD21 LEU 105 3HD2 LEU 105 -0.825 -2.069 -2.412 199 HD22 LEU 105 1HD2 LEU 105 -1.789 -1.417 -1.093 200 HD23 LEU 105 2HD2 LEU 105 -2.562 -1.831 -2.613 201 H ARG 106 H ARG 106 -3.217 -6.602 -3.704 202 HA ARG 106 HA ARG 106 -1.371 -7.874 -5.379 203 HB2 ARG 106 2HB ARG 106 -2.980 -9.740 -5.417 204 HB3 ARG 106 1HB ARG 106 -2.767 -9.101 -3.790 205 HG2 ARG 106 2HG ARG 106 -4.813 -7.688 -4.155 206 HG3 ARG 106 1HG ARG 106 -5.067 -8.535 -5.680 207 HD2 ARG 106 2HD ARG 106 -5.096 -10.693 -4.401 208 HD3 ARG 106 1HD ARG 106 -5.017 -9.754 -2.912 209 HE ARG 106 HE ARG 106 -7.176 -8.956 -4.651 210 HH11 ARG 106 1HH2 ARG 106 -6.111 -11.125 -2.169 211 HH12 ARG 106 2HH2 ARG 106 -7.710 -11.473 -1.600 212 HH21 ARG 106 1HH1 ARG 106 -9.267 -9.404 -3.908 213 HH22 ARG 106 2HH1 ARG 106 -9.499 -10.498 -2.586 214 H HIS 107 H HIS 107 -4.592 -6.535 -6.141 215 HA HIS 107 HA HIS 107 -4.570 -7.391 -8.841 216 HB2 HIS 107 2HB HIS 107 -6.052 -5.166 -7.430 217 HB3 HIS 107 1HB HIS 107 -6.354 -5.641 -9.102 218 HD1 HIS 107 1HD HIS 107 -8.077 -6.065 -6.233 219 HD2 HIS 107 2HD HIS 107 -6.345 -8.914 -8.738 220 HE1 HIS 107 1HE HIS 107 -9.299 -8.239 -5.798 221 HE2 HIS 107 2HE HIS 107 -8.258 -9.986 -7.318 222 H VAL 108 H VAL 108 -3.772 -4.281 -7.324 223 HA VAL 108 HA VAL 108 -3.103 -2.958 -9.741 224 HB VAL 108 HB VAL 108 -2.177 -2.370 -6.922 225 HG11 VAL 108 1HG1 VAL 108 -0.782 -1.216 -8.510 226 HG12 VAL 108 2HG1 VAL 108 -1.937 -0.048 -7.872 227 HG13 VAL 108 3HG1 VAL 108 -2.183 -0.746 -9.473 228 HG21 VAL 108 3HG2 VAL 108 -4.350 -0.852 -8.331 229 HG22 VAL 108 1HG2 VAL 108 -4.136 -1.159 -6.609 230 HG23 VAL 108 2HG2 VAL 108 -4.753 -2.430 -7.663 231 H MET 109 H MET 109 -1.080 -4.573 -7.290 232 HA MET 109 HA MET 109 1.424 -4.073 -8.420 233 HB2 MET 109 2HB MET 109 0.368 -6.410 -6.838 234 HB3 MET 109 1HB MET 109 2.048 -6.336 -7.361 235 HG2 MET 109 2HG MET 109 0.714 -4.116 -5.795 236 HG3 MET 109 1HG MET 109 1.613 -5.420 -5.032 237 HE1 MET 109 3HE MET 109 4.202 -6.033 -6.499 238 HE2 MET 109 1HE MET 109 3.891 -5.656 -4.800 239 HE3 MET 109 2HE MET 109 5.190 -4.842 -5.659 240 H THR 110 H THR 110 -0.831 -6.744 -9.049 241 HA THR 110 HA THR 110 0.737 -8.038 -11.018 242 HB THR 110 HB THR 110 -2.261 -8.000 -10.604 243 HG1 THR 110 1HG THR 110 -0.346 -9.966 -9.931 244 HG21 THR 110 3HG2 THR 110 -0.463 -9.652 -12.381 245 HG22 THR 110 1HG2 THR 110 -1.912 -8.752 -12.828 246 HG23 THR 110 2HG2 THR 110 -2.050 -10.224 -11.868 247 H ASN 111 H ASN 111 -1.775 -5.546 -11.180 248 HA ASN 111 HA ASN 111 -1.950 -5.343 -13.989 249 HB2 ASN 111 2HB ASN 111 -3.525 -4.354 -12.274 250 HB3 ASN 111 1HB ASN 111 -2.329 -3.086 -12.017 251 HD21 ASN 111 1HD2 ASN 111 -4.968 -4.036 -13.996 252 HD22 ASN 111 2HD2 ASN 111 -4.770 -2.867 -15.210 253 H LEU 112 H LEU 112 0.121 -3.732 -11.609 254 HA LEU 112 HA LEU 112 1.339 -1.892 -13.340 255 HB2 LEU 112 2HB LEU 112 2.177 -3.212 -10.767 256 HB3 LEU 112 1HB LEU 112 3.254 -2.102 -11.604 257 HG LEU 112 HG LEU 112 0.402 -1.375 -10.871 258 HD11 LEU 112 1HD1 LEU 112 2.964 -1.124 -9.297 259 HD12 LEU 112 2HD1 LEU 112 1.431 -1.797 -8.769 260 HD13 LEU 112 3HD1 LEU 112 1.595 -0.058 -8.999 261 HD21 LEU 112 3HD2 LEU 112 1.133 0.209 -12.448 262 HD22 LEU 112 1HD2 LEU 112 2.814 0.109 -11.927 263 HD23 LEU 112 2HD2 LEU 112 1.635 0.970 -10.944 264 H GLY 113 H GLY 113 2.058 -5.281 -12.566 265 HA2 GLY 113 2HA GLY 113 2.967 -6.629 -14.411 266 HA3 GLY 113 1HA GLY 113 4.064 -5.298 -14.762 267 H GLU 114 H GLU 114 3.960 -5.194 -11.543 268 HA GLU 114 HA GLU 114 6.458 -6.660 -11.261 269 HB2 GLU 114 2HB GLU 114 6.156 -4.404 -10.279 270 HB3 GLU 114 1HB GLU 114 4.903 -5.055 -9.221 271 HG2 GLU 114 2HG GLU 114 6.484 -6.549 -8.164 272 HG3 GLU 114 1HG GLU 114 7.740 -6.107 -9.320 273 H LYS 115 H LYS 115 6.456 -8.752 -10.824 274 HA LYS 115 HA LYS 115 4.232 -10.254 -10.010 275 HB2 LYS 115 2HB LYS 115 5.785 -12.097 -9.732 276 HB3 LYS 115 1HB LYS 115 6.224 -11.174 -11.168 277 HG2 LYS 115 2HG LYS 115 7.920 -9.943 -9.819 278 HG3 LYS 115 1HG LYS 115 7.526 -10.962 -8.436 279 HD2 LYS 115 2HD LYS 115 8.152 -12.967 -9.730 280 HD3 LYS 115 1HD LYS 115 8.571 -11.942 -11.104 281 HE2 LYS 115 2HE LYS 115 10.274 -10.798 -9.750 282 HE3 LYS 115 1HE LYS 115 9.845 -11.791 -8.357 283 HZ1 LYS 115 3HZ LYS 115 10.973 -13.525 -9.153 284 HZ2 LYS 115 1HZ LYS 115 11.744 -12.405 -10.167 285 HZ3 LYS 115 2HZ LYS 115 10.417 -13.297 -10.743 286 H LEU 116 H LEU 116 3.530 -11.045 -8.049 287 HA LEU 116 HA LEU 116 5.028 -10.544 -5.626 288 HB2 LEU 116 2HB LEU 116 3.365 -9.163 -4.546 289 HB3 LEU 116 1HB LEU 116 3.829 -8.387 -6.052 290 HG LEU 116 HG LEU 116 1.462 -8.222 -5.955 291 HD11 LEU 116 1HD1 LEU 116 1.841 -10.667 -7.685 292 HD12 LEU 116 2HD1 LEU 116 2.454 -9.079 -8.152 293 HD13 LEU 116 3HD1 LEU 116 0.728 -9.333 -7.920 294 HD21 LEU 116 3HD2 LEU 116 1.483 -10.429 -4.309 295 HD22 LEU 116 1HD2 LEU 116 0.776 -11.096 -5.776 296 HD23 LEU 116 2HD2 LEU 116 0.039 -9.709 -4.997 297 H THR 117 H THR 117 3.919 -11.522 -3.706 298 HA THR 117 HA THR 117 2.268 -13.839 -4.531 299 HB THR 117 HB THR 117 2.925 -14.661 -2.193 300 HG1 THR 117 1HG THR 117 5.036 -12.836 -2.457 301 HG21 THR 117 3HG2 THR 117 5.103 -15.451 -2.972 302 HG22 THR 117 1HG2 THR 117 5.134 -14.197 -4.213 303 HG23 THR 117 2HG2 THR 117 3.941 -15.491 -4.298 304 H ASP 118 H ASP 118 0.165 -13.810 -4.041 305 HA ASP 118 HA ASP 118 -1.148 -11.680 -2.808 306 HB2 ASP 118 2HB ASP 118 -2.150 -13.506 -4.272 307 HB3 ASP 118 1HB ASP 118 -2.178 -14.517 -2.834 308 H GLU 119 H GLU 119 -0.021 -14.742 -1.457 309 HA GLU 119 HA GLU 119 -1.196 -14.536 1.076 310 HB2 GLU 119 2HB GLU 119 1.474 -15.776 0.373 311 HB3 GLU 119 1HB GLU 119 0.468 -16.162 1.769 312 HG2 GLU 119 2HG GLU 119 -1.365 -16.842 0.193 313 HG3 GLU 119 1HG GLU 119 -0.249 -16.584 -1.144 314 H GLU 120 H GLU 120 1.703 -13.076 -0.264 315 HA GLU 120 HA GLU 120 2.694 -12.098 2.266 316 HB2 GLU 120 2HB GLU 120 4.172 -12.510 0.292 317 HB3 GLU 120 1HB GLU 120 3.386 -11.163 -0.530 318 HG2 GLU 120 2HG GLU 120 5.390 -10.294 0.470 319 HG3 GLU 120 1HG GLU 120 4.047 -9.707 1.445 320 H VAL 121 H VAL 121 0.833 -10.827 -0.459 321 HA VAL 121 HA VAL 121 0.649 -8.145 0.282 322 HB VAL 121 HB VAL 121 -1.304 -9.984 -1.112 323 HG11 VAL 121 1HG1 VAL 121 -2.734 -8.348 -0.202 324 HG12 VAL 121 2HG1 VAL 121 -2.393 -7.775 -1.831 325 HG13 VAL 121 3HG1 VAL 121 -1.559 -7.061 -0.449 326 HG21 VAL 121 3HG2 VAL 121 0.573 -7.782 -2.016 327 HG22 VAL 121 1HG2 VAL 121 -0.610 -8.556 -3.070 328 HG23 VAL 121 2HG2 VAL 121 0.704 -9.501 -2.373 329 H ASP 122 H ASP 122 -1.848 -10.601 0.869 330 HA ASP 122 HA ASP 122 -3.415 -9.238 2.674 331 HB2 ASP 122 2HB ASP 122 -3.753 -11.580 1.688 332 HB3 ASP 122 1HB ASP 122 -2.735 -12.167 3.001 333 H GLU 123 H GLU 123 -0.459 -11.126 3.349 334 HA GLU 123 HA GLU 123 -0.538 -10.694 6.163 335 HB2 GLU 123 2HB GLU 123 0.766 -12.515 5.138 336 HB3 GLU 123 1HB GLU 123 1.835 -11.326 4.394 337 HG2 GLU 123 2HG GLU 123 2.521 -10.507 6.588 338 HG3 GLU 123 1HG GLU 123 1.369 -11.581 7.380 339 H MET 124 H MET 124 0.845 -8.919 3.458 340 HA MET 124 HA MET 124 2.604 -7.194 4.708 341 HB2 MET 124 2HB MET 124 2.104 -7.379 2.227 342 HB3 MET 124 1HB MET 124 0.718 -6.329 2.519 343 HG2 MET 124 2HG MET 124 2.227 -4.621 3.485 344 HG3 MET 124 1HG MET 124 3.608 -5.655 3.119 345 HE1 MET 124 3HE MET 124 4.308 -3.357 2.172 346 HE2 MET 124 1HE MET 124 4.336 -3.188 0.410 347 HE3 MET 124 2HE MET 124 5.040 -4.611 1.175 348 H ILE 125 H ILE 125 -0.760 -6.227 3.873 349 HA ILE 125 HA ILE 125 -0.798 -3.922 5.439 350 HB ILE 125 HB ILE 125 -3.015 -5.773 4.530 351 HG12 ILE 125 2HG1 ILE 125 -1.838 -3.179 3.506 352 HG13 ILE 125 1HG1 ILE 125 -1.953 -4.724 2.667 353 HG21 ILE 125 1HG2 ILE 125 -4.655 -4.198 5.181 354 HG22 ILE 125 2HG2 ILE 125 -3.460 -2.955 5.496 355 HG23 ILE 125 3HG2 ILE 125 -3.625 -4.308 6.597 356 HD11 ILE 125 3HD1 ILE 125 -4.505 -4.459 2.901 357 HD12 ILE 125 1HD1 ILE 125 -3.705 -3.401 1.742 358 HD13 ILE 125 2HD1 ILE 125 -4.174 -2.783 3.322 359 H ARG 126 H ARG 126 -1.709 -7.246 6.248 360 HA ARG 126 HA ARG 126 -2.839 -6.804 8.739 361 HB2 ARG 126 2HB ARG 126 -1.198 -9.102 7.684 362 HB3 ARG 126 1HB ARG 126 -2.028 -9.154 9.235 363 HG2 ARG 126 2HG ARG 126 -3.577 -8.369 6.769 364 HG3 ARG 126 1HG ARG 126 -3.236 -10.072 7.062 365 HD2 ARG 126 2HD ARG 126 -4.630 -8.198 8.997 366 HD3 ARG 126 1HD ARG 126 -5.412 -9.440 8.030 367 HE ARG 126 HE ARG 126 -3.862 -9.845 10.440 368 HH11 ARG 126 1HH2 ARG 126 -5.044 -11.182 7.480 369 HH12 ARG 126 2HH2 ARG 126 -4.970 -12.824 8.028 370 HH21 ARG 126 1HH1 ARG 126 -3.759 -11.989 11.172 371 HH22 ARG 126 2HH1 ARG 126 -4.241 -13.280 10.124 372 H GLU 127 H GLU 127 0.603 -7.237 7.902 373 HA GLU 127 HA GLU 127 1.396 -6.888 10.675 374 HB2 GLU 127 2HB GLU 127 3.030 -7.131 8.140 375 HB3 GLU 127 1HB GLU 127 3.711 -7.021 9.762 376 HG2 GLU 127 2HG GLU 127 1.757 -9.160 8.875 377 HG3 GLU 127 1HG GLU 127 3.505 -9.377 8.944 378 H ALA 128 H ALA 128 1.319 -4.995 7.722 379 HA ALA 128 HA ALA 128 2.822 -2.790 8.737 380 HB1 ALA 128 1HB ALA 128 2.200 -3.366 6.281 381 HB2 ALA 128 2HB ALA 128 2.229 -1.669 6.761 382 HB3 ALA 128 3HB ALA 128 0.692 -2.520 6.623 383 H ASP 129 H ASP 129 -0.671 -3.223 8.217 384 HA ASP 129 HA ASP 129 -1.601 -0.889 9.323 385 HB2 ASP 129 2HB ASP 129 -2.993 -2.629 8.195 386 HB3 ASP 129 1HB ASP 129 -2.901 -3.600 9.663 387 H ILE 130 H ILE 130 -1.881 -0.072 11.301 388 HA ILE 130 HA ILE 130 -0.808 -1.619 13.594 389 HB ILE 130 HB ILE 130 -1.227 1.366 13.329 390 HG12 ILE 130 2HG1 ILE 130 1.262 -0.346 13.108 391 HG13 ILE 130 1HG1 ILE 130 0.501 0.516 11.780 392 HG21 ILE 130 1HG2 ILE 130 0.193 -0.347 15.405 393 HG22 ILE 130 2HG2 ILE 130 -1.302 0.549 15.659 394 HG23 ILE 130 3HG2 ILE 130 0.203 1.415 15.382 395 HD11 ILE 130 3HD1 ILE 130 1.774 1.753 14.238 396 HD12 ILE 130 1HD1 ILE 130 0.872 2.661 13.022 397 HD13 ILE 130 2HD1 ILE 130 2.372 1.844 12.581 398 H ASP 131 H ASP 131 -3.625 -0.048 12.345 399 HA ASP 131 HA ASP 131 -5.033 -0.093 14.910 400 HB2 ASP 131 2HB ASP 131 -5.862 0.742 12.126 401 HB3 ASP 131 1HB ASP 131 -6.942 0.770 13.518 402 H GLY 132 H GLY 132 -4.590 -2.110 12.161 403 HA2 GLY 132 2HA GLY 132 -5.382 -4.220 11.676 404 HA3 GLY 132 1HA GLY 132 -6.030 -4.270 13.315 405 H ASP 133 H ASP 133 -6.830 -1.862 10.863 406 HA ASP 133 HA ASP 133 -9.663 -2.713 10.997 407 HB2 ASP 133 2HB ASP 133 -10.152 -0.436 10.181 408 HB3 ASP 133 1HB ASP 133 -9.221 -0.408 11.679 409 H GLY 134 H GLY 134 -7.862 -4.182 9.343 410 HA2 GLY 134 2HA GLY 134 -7.618 -4.977 7.197 411 HA3 GLY 134 1HA GLY 134 -9.275 -4.425 6.978 412 H GLN 135 H GLN 135 -7.539 -1.753 7.813 413 HA GLN 135 HA GLN 135 -6.753 -1.107 5.036 414 HB2 GLN 135 2HB GLN 135 -8.345 0.637 6.940 415 HB3 GLN 135 1HB GLN 135 -7.740 1.139 5.365 416 HG2 GLN 135 2HG GLN 135 -9.681 -1.136 5.851 417 HG3 GLN 135 1HG GLN 135 -10.115 0.459 5.242 418 HE21 GLN 135 1HE2 GLN 135 -9.527 -2.630 4.189 419 HE22 GLN 135 2HE2 GLN 135 -8.979 -2.296 2.619 420 H VAL 136 H VAL 136 -4.847 -0.050 4.860 421 HA VAL 136 HA VAL 136 -3.535 0.789 7.400 422 HB VAL 136 HB VAL 136 -2.453 -1.149 6.365 423 HG11 VAL 136 1HG1 VAL 136 -3.184 -0.652 4.036 424 HG12 VAL 136 2HG1 VAL 136 -1.451 -0.970 4.149 425 HG13 VAL 136 3HG1 VAL 136 -2.038 0.683 4.014 426 HG21 VAL 136 3HG2 VAL 136 -1.082 0.543 7.516 427 HG22 VAL 136 1HG2 VAL 136 -0.851 1.388 5.984 428 HG23 VAL 136 2HG2 VAL 136 -0.196 -0.234 6.202 429 H ASN 137 H ASN 137 -2.750 2.775 7.563 430 HA ASN 137 HA ASN 137 -3.619 4.779 5.756 431 HB2 ASN 137 2HB ASN 137 -1.495 4.958 7.905 432 HB3 ASN 137 1HB ASN 137 -2.292 6.322 7.123 433 HD21 ASN 137 1HD2 ASN 137 -4.932 4.839 7.053 434 HD22 ASN 137 2HD2 ASN 137 -5.507 4.898 8.649 435 H TYR 138 H TYR 138 -1.329 6.477 5.591 436 HA TYR 138 HA TYR 138 -0.089 5.289 3.249 437 HB2 TYR 138 2HB TYR 138 0.613 7.991 4.363 438 HB3 TYR 138 1HB TYR 138 0.551 7.460 2.682 439 HD1 TYR 138 2HD TYR 138 -1.978 6.255 2.259 440 HD2 TYR 138 1HD TYR 138 -1.037 9.588 4.798 441 HE1 TYR 138 2HE TYR 138 -4.339 7.044 2.099 442 HE2 TYR 138 1HE TYR 138 -3.385 10.375 4.641 443 HH TYR 138 HH TYR 138 -5.557 9.234 2.346 444 H GLU 139 H GLU 139 1.144 6.825 6.249 445 HA GLU 139 HA GLU 139 3.845 6.205 5.847 446 HB2 GLU 139 2HB GLU 139 2.285 6.567 8.402 447 HB3 GLU 139 1HB GLU 139 4.044 6.406 8.344 448 HG2 GLU 139 2HG GLU 139 4.199 8.351 6.858 449 HG3 GLU 139 1HG GLU 139 2.444 8.501 6.843 450 H GLU 140 H GLU 140 1.738 4.580 8.168 451 HA GLU 140 HA GLU 140 3.001 2.345 8.913 452 HB2 GLU 140 2HB GLU 140 0.203 2.433 7.781 453 HB3 GLU 140 1HB GLU 140 0.857 1.053 8.665 454 HG2 GLU 140 2HG GLU 140 1.181 2.428 10.638 455 HG3 GLU 140 1HG GLU 140 0.689 3.875 9.763 456 H PHE 141 H PHE 141 2.026 3.070 5.649 457 HA PHE 141 HA PHE 141 2.752 0.429 4.610 458 HB2 PHE 141 2HB PHE 141 0.791 1.986 3.805 459 HB3 PHE 141 1HB PHE 141 2.052 2.813 2.904 460 HD1 PHE 141 2HD PHE 141 3.803 0.925 1.769 461 HD2 PHE 141 1HD PHE 141 -0.386 0.450 2.522 462 HE1 PHE 141 2HE PHE 141 3.689 -0.815 0.033 463 HE2 PHE 141 1HE PHE 141 -0.498 -1.277 0.789 464 HZ PHE 141 HZ PHE 141 1.537 -1.923 -0.471 465 H VAL 142 H VAL 142 3.678 3.860 4.082 466 HA VAL 142 HA VAL 142 5.712 3.675 2.333 467 HB VAL 142 HB VAL 142 5.727 5.310 4.882 468 HG11 VAL 142 1HG1 VAL 142 7.991 5.234 4.134 469 HG12 VAL 142 2HG1 VAL 142 7.334 6.752 3.525 470 HG13 VAL 142 3HG1 VAL 142 7.510 5.371 2.442 471 HG21 VAL 142 3HG2 VAL 142 4.804 5.797 2.038 472 HG22 VAL 142 1HG2 VAL 142 5.157 7.127 3.137 473 HG23 VAL 142 2HG2 VAL 142 3.881 5.988 3.521 474 H GLN 143 H GLN 143 6.339 3.409 5.856 475 HA GLN 143 HA GLN 143 8.960 2.700 5.831 476 HB2 GLN 143 2HB GLN 143 6.686 1.662 7.518 477 HB3 GLN 143 1HB GLN 143 8.334 1.092 7.782 478 HG2 GLN 143 2HG GLN 143 7.873 3.002 9.245 479 HG3 GLN 143 1HG GLN 143 9.087 3.443 8.046 480 HE21 GLN 143 1HE2 GLN 143 8.621 5.670 7.744 481 HE22 GLN 143 2HE2 GLN 143 7.105 6.252 7.248 482 H MET 144 H MET 144 6.467 0.142 5.863 483 HA MET 144 HA MET 144 7.955 -2.046 5.331 484 HB2 MET 144 2HB MET 144 5.345 -1.451 3.918 485 HB3 MET 144 1HB MET 144 6.028 -3.044 4.245 486 HG2 MET 144 2HG MET 144 5.262 -1.035 6.382 487 HG3 MET 144 1HG MET 144 4.269 -2.397 5.887 488 HE1 MET 144 3HE MET 144 4.345 -4.561 7.567 489 HE2 MET 144 1HE MET 144 5.790 -5.478 7.118 490 HE3 MET 144 2HE MET 144 4.841 -4.662 5.878 491 H MET 145 H MET 145 6.783 0.208 2.805 492 HA MET 145 HA MET 145 7.623 -0.990 0.509 493 HB2 MET 145 2HB MET 145 6.536 1.291 0.790 494 HB3 MET 145 1HB MET 145 8.147 1.936 1.047 495 HG2 MET 145 2HG MET 145 8.635 0.570 -1.224 496 HG3 MET 145 1HG MET 145 6.916 0.882 -1.458 497 HE1 MET 145 3HE MET 145 6.534 4.635 -1.225 498 HE2 MET 145 1HE MET 145 5.962 3.084 -0.594 499 HE3 MET 145 2HE MET 145 6.012 3.365 -2.331 500 H THR 146 H THR 146 9.736 1.622 0.642 501 HA THR 146 HA THR 146 12.096 -0.093 1.156 502 HB THR 146 HB THR 146 13.219 1.050 -0.756 503 HG1 THR 146 1HG THR 146 10.572 1.944 -1.246 504 HG21 THR 146 3HG2 THR 146 12.296 -1.180 -1.063 505 HG22 THR 146 1HG2 THR 146 11.991 -0.227 -2.515 506 HG23 THR 146 2HG2 THR 146 10.693 -0.511 -1.357 507 H ALA 147 H ALA 147 10.588 2.063 2.649 508 HA ALA 147 HA ALA 147 12.682 4.136 2.870 509 HB1 ALA 147 1HB ALA 147 11.071 5.521 3.849 510 HB2 ALA 147 2HB ALA 147 10.064 4.164 4.357 511 HB3 ALA 147 3HB ALA 147 10.133 4.623 2.657 512 H LYS 148 H LYS 148 14.200 2.727 3.931 513 HA LYS 148 HA LYS 148 15.208 1.738 5.756 514 HB2 LYS 148 2HB LYS 148 13.418 3.696 7.221 515 HB3 LYS 148 1HB LYS 148 14.824 2.887 7.907 516 HG2 LYS 148 2HG LYS 148 15.041 4.596 5.423 517 HG3 LYS 148 1HG LYS 148 15.154 5.295 7.035 518 HD2 LYS 148 2HD LYS 148 17.002 3.664 7.543 519 HD3 LYS 148 1HD LYS 148 16.960 3.163 5.854 520 HE2 LYS 148 2HE LYS 148 18.651 4.798 5.894 521 HE3 LYS 148 1HE LYS 148 17.242 5.682 5.308 522 HZ1 LYS 148 3HZ LYS 148 16.960 5.953 7.945 523 HZ2 LYS 148 1HZ LYS 148 17.779 7.074 6.969 524 HZ3 LYS 148 2HZ LYS 148 18.655 5.901 7.828 Start of MODEL 8 1 H1 ASP 78 1HT ASP 78 13.366 20.212 -1.101 2 H2 ASP 78 2HT ASP 78 14.786 19.758 -0.290 3 H3 ASP 78 3HT ASP 78 13.797 18.574 -0.999 4 HA ASP 78 HA ASP 78 15.185 20.704 -2.524 5 HB2 ASP 78 2HB ASP 78 15.974 17.854 -1.896 6 HB3 ASP 78 1HB ASP 78 16.669 18.766 -3.234 7 H THR 79 H THR 79 13.139 17.832 -2.369 8 HA THR 79 HA THR 79 12.224 18.386 -5.111 9 HB THR 79 HB THR 79 13.911 16.600 -5.323 10 HG1 THR 79 1HG THR 79 12.515 15.122 -6.337 11 HG21 THR 79 3HG2 THR 79 13.634 15.725 -2.992 12 HG22 THR 79 1HG2 THR 79 13.612 14.462 -4.221 13 HG23 THR 79 2HG2 THR 79 12.102 15.007 -3.489 14 H ASP 80 H ASP 80 10.597 15.975 -5.171 15 HA ASP 80 HA ASP 80 8.446 16.909 -3.413 16 HB2 ASP 80 2HB ASP 80 7.271 14.959 -4.847 17 HB3 ASP 80 1HB ASP 80 7.489 16.585 -5.483 18 H SER 81 H SER 81 10.168 13.897 -4.179 19 HA SER 81 HA SER 81 10.002 11.791 -3.120 20 HB2 SER 81 2HB SER 81 11.968 12.981 -2.212 21 HB3 SER 81 1HB SER 81 10.969 13.630 -0.917 22 HG SER 81 HG SER 81 11.403 10.877 -1.488 23 H GLU 82 H GLU 82 9.338 13.711 -0.251 24 HA GLU 82 HA GLU 82 7.530 12.033 0.966 25 HB2 GLU 82 2HB GLU 82 8.627 14.092 1.927 26 HB3 GLU 82 1HB GLU 82 7.421 15.048 1.067 27 HG2 GLU 82 2HG GLU 82 5.621 13.918 2.259 28 HG3 GLU 82 1HG GLU 82 6.787 12.867 3.066 29 H GLU 83 H GLU 83 6.833 14.731 -1.270 30 HA GLU 83 HA GLU 83 4.020 14.426 -1.185 31 HB2 GLU 83 2HB GLU 83 5.140 16.496 -1.902 32 HB3 GLU 83 1HB GLU 83 5.715 15.674 -3.342 33 HG2 GLU 83 2HG GLU 83 3.425 15.260 -4.074 34 HG3 GLU 83 1HG GLU 83 2.801 15.983 -2.592 35 H GLU 84 H GLU 84 6.397 13.328 -3.657 36 HA GLU 84 HA GLU 84 4.614 12.114 -5.406 37 HB2 GLU 84 2HB GLU 84 7.068 12.237 -5.801 38 HB3 GLU 84 1HB GLU 84 7.305 10.983 -4.584 39 HG2 GLU 84 2HG GLU 84 5.922 9.422 -5.900 40 HG3 GLU 84 1HG GLU 84 5.645 10.675 -7.109 41 H ILE 85 H ILE 85 6.063 10.787 -2.445 42 HA ILE 85 HA ILE 85 4.963 8.218 -2.519 43 HB ILE 85 HB ILE 85 5.607 10.054 -0.193 44 HG12 ILE 85 2HG1 ILE 85 7.106 7.617 -1.167 45 HG13 ILE 85 1HG1 ILE 85 7.460 9.240 -1.760 46 HG21 ILE 85 1HG2 ILE 85 4.052 8.435 0.660 47 HG22 ILE 85 2HG2 ILE 85 5.662 7.893 1.123 48 HG23 ILE 85 3HG2 ILE 85 4.838 7.142 -0.235 49 HD11 ILE 85 3HD1 ILE 85 8.276 9.958 0.304 50 HD12 ILE 85 1HD1 ILE 85 8.778 8.270 0.317 51 HD13 ILE 85 2HD1 ILE 85 7.343 8.768 1.212 52 H ARG 86 H ARG 86 3.722 11.196 -1.032 53 HA ARG 86 HA ARG 86 1.312 10.179 -0.045 54 HB2 ARG 86 2HB ARG 86 2.165 12.933 -0.937 55 HB3 ARG 86 1HB ARG 86 0.528 12.637 -0.354 56 HG2 ARG 86 2HG ARG 86 1.419 11.767 1.766 57 HG3 ARG 86 1HG ARG 86 3.066 11.975 1.179 58 HD2 ARG 86 2HD ARG 86 1.120 14.281 1.376 59 HD3 ARG 86 1HD ARG 86 2.173 13.823 2.710 60 HE ARG 86 HE ARG 86 3.843 14.079 0.533 61 HH11 ARG 86 1HH2 ARG 86 1.591 16.059 2.272 62 HH12 ARG 86 2HH2 ARG 86 2.375 17.547 1.858 63 HH21 ARG 86 1HH1 ARG 86 4.867 16.028 -0.011 64 HH22 ARG 86 2HH1 ARG 86 4.224 17.530 0.565 65 H GLU 87 H GLU 87 2.183 11.236 -3.281 66 HA GLU 87 HA GLU 87 -0.510 11.144 -4.305 67 HB2 GLU 87 2HB GLU 87 2.186 11.226 -5.665 68 HB3 GLU 87 1HB GLU 87 0.650 11.269 -6.531 69 HG2 GLU 87 2HG GLU 87 1.419 13.236 -4.357 70 HG3 GLU 87 1HG GLU 87 1.623 13.548 -6.081 71 H ALA 88 H ALA 88 2.308 9.199 -5.196 72 HA ALA 88 HA ALA 88 1.283 7.180 -6.621 73 HB1 ALA 88 1HB ALA 88 3.007 5.712 -5.805 74 HB2 ALA 88 2HB ALA 88 3.152 6.632 -4.305 75 HB3 ALA 88 3HB ALA 88 3.660 7.349 -5.835 76 H PHE 89 H PHE 89 1.213 7.199 -3.055 77 HA PHE 89 HA PHE 89 -0.306 4.824 -2.832 78 HB2 PHE 89 2HB PHE 89 0.388 7.067 -0.986 79 HB3 PHE 89 1HB PHE 89 -0.837 5.881 -0.491 80 HD1 PHE 89 2HD PHE 89 -0.147 3.338 -1.019 81 HD2 PHE 89 1HD PHE 89 2.608 6.577 -0.431 82 HE1 PHE 89 2HE PHE 89 1.645 1.715 -0.457 83 HE2 PHE 89 1HE PHE 89 4.398 4.943 0.129 84 HZ PHE 89 HZ PHE 89 3.915 2.530 0.102 85 H ARG 90 H ARG 90 -1.270 8.271 -2.954 86 HA ARG 90 HA ARG 90 -4.000 7.880 -2.391 87 HB2 ARG 90 2HB ARG 90 -2.469 9.950 -3.886 88 HB3 ARG 90 1HB ARG 90 -4.225 9.954 -4.009 89 HG2 ARG 90 2HG ARG 90 -4.412 10.044 -1.567 90 HG3 ARG 90 1HG ARG 90 -2.657 9.990 -1.413 91 HD2 ARG 90 2HD ARG 90 -2.493 12.064 -2.709 92 HD3 ARG 90 1HD ARG 90 -4.244 12.123 -2.833 93 HE ARG 90 HE ARG 90 -3.295 11.980 -0.106 94 HH11 ARG 90 1HH2 ARG 90 -4.022 14.049 -2.797 95 HH12 ARG 90 2HH2 ARG 90 -4.288 15.455 -1.816 96 HH21 ARG 90 1HH1 ARG 90 -3.653 13.822 1.179 97 HH22 ARG 90 2HH1 ARG 90 -4.083 15.324 0.430 98 H VAL 91 H VAL 91 -2.252 7.763 -5.469 99 HA VAL 91 HA VAL 91 -4.476 7.213 -7.133 100 HB VAL 91 HB VAL 91 -1.537 6.553 -7.460 101 HG11 VAL 91 1HG1 VAL 91 -2.721 5.092 -8.937 102 HG12 VAL 91 2HG1 VAL 91 -2.202 6.458 -9.924 103 HG13 VAL 91 3HG1 VAL 91 -3.875 6.353 -9.371 104 HG21 VAL 91 3HG2 VAL 91 -3.199 8.734 -8.745 105 HG22 VAL 91 1HG2 VAL 91 -1.445 8.564 -8.773 106 HG23 VAL 91 2HG2 VAL 91 -2.266 8.984 -7.271 107 H PHE 92 H PHE 92 -2.218 5.126 -5.400 108 HA PHE 92 HA PHE 92 -2.879 2.635 -6.407 109 HB2 PHE 92 2HB PHE 92 -1.891 3.613 -3.781 110 HB3 PHE 92 1HB PHE 92 -2.529 1.991 -3.788 111 HD1 PHE 92 2HD PHE 92 -0.794 3.745 -6.587 112 HD2 PHE 92 1HD PHE 92 -0.567 0.691 -3.575 113 HE1 PHE 92 2HE PHE 92 1.296 2.889 -7.608 114 HE2 PHE 92 1HE PHE 92 1.520 -0.165 -4.594 115 HZ PHE 92 HZ PHE 92 2.452 0.932 -6.615 116 H ASP 93 H ASP 93 -4.469 4.221 -3.594 117 HA ASP 93 HA ASP 93 -6.387 2.345 -3.018 118 HB2 ASP 93 2HB ASP 93 -6.023 4.640 -1.949 119 HB3 ASP 93 1HB ASP 93 -7.042 5.284 -3.231 120 H LYS 94 H LYS 94 -7.177 1.175 -4.734 121 HA LYS 94 HA LYS 94 -7.947 2.131 -7.230 122 HB2 LYS 94 2HB LYS 94 -7.809 -0.329 -6.071 123 HB3 LYS 94 1HB LYS 94 -9.549 -0.116 -6.080 124 HG2 LYS 94 2HG LYS 94 -9.199 -1.104 -8.168 125 HG3 LYS 94 1HG LYS 94 -9.189 0.609 -8.588 126 HD2 LYS 94 2HD LYS 94 -6.748 0.653 -8.544 127 HD3 LYS 94 1HD LYS 94 -6.694 -1.011 -7.973 128 HE2 LYS 94 2HE LYS 94 -6.373 -0.501 -10.535 129 HE3 LYS 94 1HE LYS 94 -7.342 -1.884 -10.033 130 HZ1 LYS 94 3HZ LYS 94 -8.307 -0.263 -11.748 131 HZ2 LYS 94 1HZ LYS 94 -8.583 0.762 -10.426 132 HZ3 LYS 94 2HZ LYS 94 -9.307 -0.775 -10.473 133 H ASP 95 H ASP 95 -10.097 1.306 -4.518 134 HA ASP 95 HA ASP 95 -12.391 2.528 -5.670 135 HB2 ASP 95 2HB ASP 95 -13.369 2.163 -3.413 136 HB3 ASP 95 1HB ASP 95 -12.592 0.717 -4.058 137 H GLY 96 H GLY 96 -9.772 4.058 -5.038 138 HA2 GLY 96 2HA GLY 96 -9.103 6.060 -4.013 139 HA3 GLY 96 1HA GLY 96 -10.433 6.616 -5.016 140 H ASN 97 H ASN 97 -10.354 4.737 -1.967 141 HA ASN 97 HA ASN 97 -12.341 6.615 -0.855 142 HB2 ASN 97 2HB ASN 97 -12.836 4.872 0.780 143 HB3 ASN 97 1HB ASN 97 -12.968 4.247 -0.861 144 HD21 ASN 97 1HD2 ASN 97 -12.660 2.111 0.417 145 HD22 ASN 97 2HD2 ASN 97 -11.062 1.597 0.673 146 H GLY 98 H GLY 98 -9.216 6.720 -0.969 147 HA2 GLY 98 2HA GLY 98 -7.634 7.805 0.326 148 HA3 GLY 98 1HA GLY 98 -8.932 8.211 1.443 149 H TYR 99 H TYR 99 -7.964 4.967 0.483 150 HA TYR 99 HA TYR 99 -6.474 4.478 2.917 151 HB2 TYR 99 2HB TYR 99 -9.257 3.388 2.501 152 HB3 TYR 99 1HB TYR 99 -8.080 2.558 3.512 153 HD1 TYR 99 2HD TYR 99 -6.913 3.929 5.366 154 HD2 TYR 99 1HD TYR 99 -10.494 5.199 3.374 155 HE1 TYR 99 2HE TYR 99 -7.392 5.495 7.231 156 HE2 TYR 99 1HE TYR 99 -10.974 6.771 5.233 157 HH TYR 99 HH TYR 99 -9.304 6.653 8.215 158 H ILE 100 H ILE 100 -5.752 2.098 2.977 159 HA ILE 100 HA ILE 100 -5.465 1.093 0.180 160 HB ILE 100 HB ILE 100 -3.490 0.932 2.448 161 HG12 ILE 100 2HG1 ILE 100 -3.718 3.226 1.630 162 HG13 ILE 100 1HG1 ILE 100 -2.183 2.552 1.108 163 HG21 ILE 100 1HG2 ILE 100 -3.025 -0.918 1.090 164 HG22 ILE 100 2HG2 ILE 100 -1.986 0.336 0.412 165 HG23 ILE 100 3HG2 ILE 100 -3.499 -0.073 -0.386 166 HD11 ILE 100 3HD1 ILE 100 -4.596 3.181 -0.537 167 HD12 ILE 100 1HD1 ILE 100 -3.541 1.874 -1.056 168 HD13 ILE 100 2HD1 ILE 100 -2.900 3.497 -0.871 169 H SER 101 H SER 101 -6.467 -0.787 -0.136 170 HA SER 101 HA SER 101 -6.806 -2.689 2.097 171 HB2 SER 101 2HB SER 101 -8.264 -2.269 -0.505 172 HB3 SER 101 1HB SER 101 -8.388 -3.794 0.365 173 HG SER 101 HG SER 101 -9.765 -2.826 1.596 174 H ALA 102 H ALA 102 -6.368 -4.909 1.714 175 HA ALA 102 HA ALA 102 -3.895 -5.399 0.448 176 HB1 ALA 102 1HB ALA 102 -4.220 -6.906 2.162 177 HB2 ALA 102 2HB ALA 102 -4.792 -7.906 0.836 178 HB3 ALA 102 3HB ALA 102 -5.948 -7.038 1.847 179 H ALA 103 H ALA 103 -7.208 -6.024 -0.623 180 HA ALA 103 HA ALA 103 -6.563 -7.660 -2.807 181 HB1 ALA 103 1HB ALA 103 -8.810 -7.600 -2.086 182 HB2 ALA 103 2HB ALA 103 -8.810 -6.833 -3.674 183 HB3 ALA 103 3HB ALA 103 -8.880 -5.842 -2.215 184 H GLU 104 H GLU 104 -6.671 -4.171 -2.462 185 HA GLU 104 HA GLU 104 -6.513 -3.535 -5.224 186 HB2 GLU 104 2HB GLU 104 -5.580 -1.900 -2.852 187 HB3 GLU 104 1HB GLU 104 -5.931 -1.298 -4.475 188 HG2 GLU 104 2HG GLU 104 -8.255 -1.902 -4.276 189 HG3 GLU 104 1HG GLU 104 -7.954 -2.732 -2.750 190 H LEU 105 H LEU 105 -4.043 -4.128 -2.736 191 HA LEU 105 HA LEU 105 -1.816 -3.177 -4.212 192 HB2 LEU 105 2HB LEU 105 -1.853 -5.414 -2.186 193 HB3 LEU 105 1HB LEU 105 -0.465 -4.430 -2.648 194 HG LEU 105 HG LEU 105 -2.990 -3.389 -1.354 195 HD11 LEU 105 1HD1 LEU 105 -1.401 -4.816 0.058 196 HD12 LEU 105 2HD1 LEU 105 -1.759 -3.215 0.662 197 HD13 LEU 105 3HD1 LEU 105 -0.231 -3.522 -0.145 198 HD21 LEU 105 3HD2 LEU 105 -0.472 -2.077 -2.351 199 HD22 LEU 105 1HD2 LEU 105 -1.393 -1.361 -1.036 200 HD23 LEU 105 2HD2 LEU 105 -2.150 -1.587 -2.598 201 H ARG 106 H ARG 106 -3.157 -6.489 -3.920 202 HA ARG 106 HA ARG 106 -1.197 -7.644 -5.600 203 HB2 ARG 106 2HB ARG 106 -2.805 -9.545 -5.792 204 HB3 ARG 106 1HB ARG 106 -2.467 -9.072 -4.135 205 HG2 ARG 106 2HG ARG 106 -4.550 -7.718 -4.119 206 HG3 ARG 106 1HG ARG 106 -4.905 -8.304 -5.747 207 HD2 ARG 106 2HD ARG 106 -4.421 -10.143 -3.408 208 HD3 ARG 106 1HD ARG 106 -6.015 -9.610 -3.894 209 HE ARG 106 HE ARG 106 -4.902 -10.607 -6.196 210 HH11 ARG 106 1HH2 ARG 106 -5.531 -11.770 -2.988 211 HH12 ARG 106 2HH2 ARG 106 -5.673 -13.428 -3.474 212 HH21 ARG 106 1HH1 ARG 106 -5.086 -12.773 -6.830 213 HH22 ARG 106 2HH1 ARG 106 -5.420 -13.992 -5.646 214 H HIS 107 H HIS 107 -4.508 -6.441 -6.310 215 HA HIS 107 HA HIS 107 -4.578 -7.231 -9.006 216 HB2 HIS 107 2HB HIS 107 -6.514 -6.477 -7.666 217 HB3 HIS 107 1HB HIS 107 -5.864 -4.842 -7.680 218 HD1 HIS 107 1HD HIS 107 -5.928 -3.537 -9.937 219 HD2 HIS 107 2HD HIS 107 -7.686 -7.314 -10.106 220 HE1 HIS 107 1HE HIS 107 -7.257 -3.613 -12.094 221 HE2 HIS 107 2HE HIS 107 -8.336 -5.912 -12.209 222 H VAL 108 H VAL 108 -3.763 -4.050 -7.616 223 HA VAL 108 HA VAL 108 -3.092 -2.877 -10.109 224 HB VAL 108 HB VAL 108 -2.163 -1.053 -8.864 225 HG11 VAL 108 1HG1 VAL 108 -4.046 -0.805 -7.062 226 HG12 VAL 108 2HG1 VAL 108 -4.658 -2.307 -7.746 227 HG13 VAL 108 3HG1 VAL 108 -4.488 -0.887 -8.766 228 HG21 VAL 108 3HG2 VAL 108 -2.087 -1.403 -6.254 229 HG22 VAL 108 1HG2 VAL 108 -0.743 -1.960 -7.247 230 HG23 VAL 108 2HG2 VAL 108 -1.946 -3.104 -6.680 231 H MET 109 H MET 109 -1.115 -4.460 -7.612 232 HA MET 109 HA MET 109 1.397 -3.967 -8.770 233 HB2 MET 109 2HB MET 109 0.350 -6.222 -7.065 234 HB3 MET 109 1HB MET 109 2.018 -6.197 -7.623 235 HG2 MET 109 2HG MET 109 0.842 -3.787 -6.247 236 HG3 MET 109 1HG MET 109 1.482 -5.129 -5.313 237 HE1 MET 109 3HE MET 109 4.347 -2.896 -4.721 238 HE2 MET 109 1HE MET 109 2.726 -3.420 -4.246 239 HE3 MET 109 2HE MET 109 2.934 -1.986 -5.245 240 H THR 110 H THR 110 -0.812 -6.737 -9.226 241 HA THR 110 HA THR 110 0.777 -8.061 -11.165 242 HB THR 110 HB THR 110 -2.210 -8.161 -10.690 243 HG1 THR 110 1HG THR 110 -0.059 -9.113 -9.369 244 HG21 THR 110 3HG2 THR 110 -1.868 -10.468 -11.782 245 HG22 THR 110 1HG2 THR 110 -0.331 -9.833 -12.367 246 HG23 THR 110 2HG2 THR 110 -1.845 -9.067 -12.853 247 H ASN 111 H ASN 111 -1.978 -5.834 -11.437 248 HA ASN 111 HA ASN 111 -2.157 -5.804 -14.254 249 HB2 ASN 111 2HB ASN 111 -3.858 -4.909 -12.629 250 HB3 ASN 111 1HB ASN 111 -2.801 -3.526 -12.368 251 HD21 ASN 111 1HD2 ASN 111 -3.959 -5.324 -15.287 252 HD22 ASN 111 2HD2 ASN 111 -4.404 -3.925 -16.140 253 H LEU 112 H LEU 112 -0.289 -3.922 -11.960 254 HA LEU 112 HA LEU 112 0.809 -2.046 -13.768 255 HB2 LEU 112 2HB LEU 112 1.580 -3.049 -11.035 256 HB3 LEU 112 1HB LEU 112 2.630 -1.938 -11.896 257 HG LEU 112 HG LEU 112 -0.315 -1.333 -11.549 258 HD11 LEU 112 1HD1 LEU 112 0.671 -1.758 -9.305 259 HD12 LEU 112 2HD1 LEU 112 0.223 -0.068 -9.528 260 HD13 LEU 112 3HD1 LEU 112 1.915 -0.554 -9.644 261 HD21 LEU 112 3HD2 LEU 112 0.689 1.045 -11.604 262 HD22 LEU 112 1HD2 LEU 112 0.702 0.148 -13.114 263 HD23 LEU 112 2HD2 LEU 112 2.175 0.286 -12.158 264 H GLY 113 H GLY 113 1.730 -5.288 -12.771 265 HA2 GLY 113 2HA GLY 113 2.910 -6.643 -14.456 266 HA3 GLY 113 1HA GLY 113 3.935 -5.245 -14.765 267 H GLU 114 H GLU 114 3.731 -4.802 -11.685 268 HA GLU 114 HA GLU 114 6.235 -6.013 -11.052 269 HB2 GLU 114 2HB GLU 114 4.177 -4.594 -9.349 270 HB3 GLU 114 1HB GLU 114 5.752 -5.118 -8.753 271 HG2 GLU 114 2HG GLU 114 6.886 -3.733 -10.411 272 HG3 GLU 114 1HG GLU 114 5.341 -3.273 -11.124 273 H LYS 115 H LYS 115 6.634 -7.994 -10.331 274 HA LYS 115 HA LYS 115 4.506 -9.846 -9.776 275 HB2 LYS 115 2HB LYS 115 7.520 -10.083 -9.597 276 HB3 LYS 115 1HB LYS 115 6.420 -11.418 -9.276 277 HG2 LYS 115 2HG LYS 115 6.830 -11.790 -11.533 278 HG3 LYS 115 1HG LYS 115 5.429 -10.740 -11.669 279 HD2 LYS 115 2HD LYS 115 6.921 -8.788 -11.958 280 HD3 LYS 115 1HD LYS 115 8.323 -9.845 -11.818 281 HE2 LYS 115 2HE LYS 115 7.598 -11.093 -13.810 282 HE3 LYS 115 1HE LYS 115 6.170 -10.065 -13.944 283 HZ1 LYS 115 3HZ LYS 115 7.877 -8.163 -13.957 284 HZ2 LYS 115 1HZ LYS 115 7.663 -9.070 -15.374 285 HZ3 LYS 115 2HZ LYS 115 9.001 -9.369 -14.373 286 H LEU 116 H LEU 116 3.724 -10.555 -7.875 287 HA LEU 116 HA LEU 116 5.138 -10.044 -5.384 288 HB2 LEU 116 2HB LEU 116 3.430 -8.090 -6.207 289 HB3 LEU 116 1HB LEU 116 2.298 -9.135 -5.360 290 HG LEU 116 HG LEU 116 3.854 -9.094 -3.372 291 HD11 LEU 116 1HD1 LEU 116 5.404 -7.347 -5.250 292 HD12 LEU 116 2HD1 LEU 116 5.981 -8.435 -3.987 293 HD13 LEU 116 3HD1 LEU 116 5.357 -6.851 -3.560 294 HD21 LEU 116 3HD2 LEU 116 2.938 -7.090 -2.541 295 HD22 LEU 116 1HD2 LEU 116 1.831 -7.491 -3.852 296 HD23 LEU 116 2HD2 LEU 116 3.075 -6.269 -4.095 297 H THR 117 H THR 117 4.237 -11.242 -3.577 298 HA THR 117 HA THR 117 2.722 -13.615 -4.451 299 HB THR 117 HB THR 117 3.385 -14.363 -2.043 300 HG1 THR 117 1HG THR 117 4.913 -13.197 -1.083 301 HG21 THR 117 3HG2 THR 117 5.767 -14.842 -2.874 302 HG22 THR 117 1HG2 THR 117 5.313 -13.959 -4.332 303 HG23 THR 117 2HG2 THR 117 4.443 -15.426 -3.883 304 H ASP 118 H ASP 118 0.612 -13.709 -4.071 305 HA ASP 118 HA ASP 118 -0.925 -11.749 -2.858 306 HB2 ASP 118 2HB ASP 118 -1.462 -14.697 -3.262 307 HB3 ASP 118 1HB ASP 118 -2.679 -13.573 -2.657 308 H GLU 119 H GLU 119 0.369 -14.739 -1.444 309 HA GLU 119 HA GLU 119 -0.844 -14.550 1.078 310 HB2 GLU 119 2HB GLU 119 1.843 -15.720 0.299 311 HB3 GLU 119 1HB GLU 119 1.028 -16.002 1.839 312 HG2 GLU 119 2HG GLU 119 -0.888 -16.990 0.676 313 HG3 GLU 119 1HG GLU 119 -0.145 -16.637 -0.883 314 H GLU 120 H GLU 120 1.900 -12.892 -0.298 315 HA GLU 120 HA GLU 120 2.882 -11.869 2.233 316 HB2 GLU 120 2HB GLU 120 4.412 -12.151 0.311 317 HB3 GLU 120 1HB GLU 120 3.499 -10.938 -0.586 318 HG2 GLU 120 2HG GLU 120 4.023 -9.253 1.129 319 HG3 GLU 120 1HG GLU 120 4.899 -10.468 2.064 320 H VAL 121 H VAL 121 1.000 -10.635 -0.518 321 HA VAL 121 HA VAL 121 0.617 -7.996 0.289 322 HB VAL 121 HB VAL 121 -1.200 -9.931 -1.160 323 HG11 VAL 121 1HG1 VAL 121 -1.631 -7.032 -0.461 324 HG12 VAL 121 2HG1 VAL 121 -2.745 -8.375 -0.257 325 HG13 VAL 121 3HG1 VAL 121 -2.393 -7.759 -1.873 326 HG21 VAL 121 3HG2 VAL 121 0.254 -7.481 -2.162 327 HG22 VAL 121 1HG2 VAL 121 -0.475 -8.766 -3.119 328 HG23 VAL 121 2HG2 VAL 121 0.979 -9.088 -2.182 329 H ASP 122 H ASP 122 -1.804 -10.559 0.744 330 HA ASP 122 HA ASP 122 -3.450 -9.342 2.571 331 HB2 ASP 122 2HB ASP 122 -3.704 -11.625 1.485 332 HB3 ASP 122 1HB ASP 122 -2.630 -12.249 2.732 333 H GLU 123 H GLU 123 -0.471 -11.200 3.276 334 HA GLU 123 HA GLU 123 -0.643 -10.825 6.095 335 HB2 GLU 123 2HB GLU 123 1.614 -11.597 4.256 336 HB3 GLU 123 1HB GLU 123 1.839 -11.427 5.998 337 HG2 GLU 123 2HG GLU 123 0.126 -13.100 6.428 338 HG3 GLU 123 1HG GLU 123 -0.244 -13.215 4.710 339 H MET 124 H MET 124 0.763 -8.952 3.485 340 HA MET 124 HA MET 124 2.516 -7.260 4.803 341 HB2 MET 124 2HB MET 124 1.936 -7.393 2.303 342 HB3 MET 124 1HB MET 124 0.626 -6.280 2.668 343 HG2 MET 124 2HG MET 124 2.422 -4.888 2.022 344 HG3 MET 124 1HG MET 124 2.425 -4.814 3.785 345 HE1 MET 124 3HE MET 124 5.403 -6.803 0.961 346 HE2 MET 124 1HE MET 124 4.447 -5.343 0.680 347 HE3 MET 124 2HE MET 124 3.655 -6.912 0.787 348 H ILE 125 H ILE 125 -0.802 -6.249 3.919 349 HA ILE 125 HA ILE 125 -0.890 -4.014 5.560 350 HB ILE 125 HB ILE 125 -3.042 -5.816 4.441 351 HG12 ILE 125 2HG1 ILE 125 -2.244 -2.930 3.895 352 HG13 ILE 125 1HG1 ILE 125 -1.808 -4.313 2.905 353 HG21 ILE 125 1HG2 ILE 125 -4.591 -3.813 5.201 354 HG22 ILE 125 2HG2 ILE 125 -3.332 -3.540 6.389 355 HG23 ILE 125 3HG2 ILE 125 -4.184 -5.079 6.349 356 HD11 ILE 125 3HD1 ILE 125 -3.686 -3.522 1.780 357 HD12 ILE 125 1HD1 ILE 125 -4.491 -3.017 3.257 358 HD13 ILE 125 2HD1 ILE 125 -4.407 -4.720 2.841 359 H ARG 126 H ARG 126 -1.820 -7.354 6.234 360 HA ARG 126 HA ARG 126 -3.022 -7.016 8.707 361 HB2 ARG 126 2HB ARG 126 -1.364 -9.255 7.590 362 HB3 ARG 126 1HB ARG 126 -2.175 -9.380 9.140 363 HG2 ARG 126 2HG ARG 126 -3.814 -8.463 6.791 364 HG3 ARG 126 1HG ARG 126 -3.359 -10.159 6.843 365 HD2 ARG 126 2HD ARG 126 -5.506 -9.903 7.938 366 HD3 ARG 126 1HD ARG 126 -4.303 -10.300 9.155 367 HE ARG 126 HE ARG 126 -4.757 -7.455 8.779 368 HH11 ARG 126 1HH2 ARG 126 -5.605 -10.372 10.421 369 HH12 ARG 126 2HH2 ARG 126 -6.284 -9.570 11.799 370 HH21 ARG 126 1HH1 ARG 126 -5.636 -6.382 10.587 371 HH22 ARG 126 2HH1 ARG 126 -6.300 -7.308 11.893 372 H GLU 127 H GLU 127 0.451 -7.339 7.971 373 HA GLU 127 HA GLU 127 1.106 -7.119 10.804 374 HB2 GLU 127 2HB GLU 127 2.852 -7.334 8.341 375 HB3 GLU 127 1HB GLU 127 3.466 -7.256 9.995 376 HG2 GLU 127 2HG GLU 127 2.214 -9.291 10.578 377 HG3 GLU 127 1HG GLU 127 1.552 -9.363 8.944 378 H ALA 128 H ALA 128 1.121 -5.126 7.919 379 HA ALA 128 HA ALA 128 2.625 -2.969 9.023 380 HB1 ALA 128 1HB ALA 128 0.557 -2.455 6.915 381 HB2 ALA 128 2HB ALA 128 1.883 -3.542 6.523 382 HB3 ALA 128 3HB ALA 128 2.223 -1.884 7.020 383 H ASP 129 H ASP 129 -0.876 -3.300 8.413 384 HA ASP 129 HA ASP 129 -1.848 -1.007 9.486 385 HB2 ASP 129 2HB ASP 129 -3.225 -2.818 8.517 386 HB3 ASP 129 1HB ASP 129 -3.024 -3.748 9.993 387 H ILE 130 H ILE 130 -1.910 -0.031 11.390 388 HA ILE 130 HA ILE 130 -0.666 -1.340 13.691 389 HB ILE 130 HB ILE 130 -1.654 1.509 13.365 390 HG12 ILE 130 2HG1 ILE 130 1.116 0.297 13.273 391 HG13 ILE 130 1HG1 ILE 130 0.234 0.904 11.880 392 HG21 ILE 130 1HG2 ILE 130 -1.620 0.798 15.731 393 HG22 ILE 130 2HG2 ILE 130 -0.286 1.894 15.427 394 HG23 ILE 130 3HG2 ILE 130 0.010 0.161 15.529 395 HD11 ILE 130 3HD1 ILE 130 0.150 3.156 12.956 396 HD12 ILE 130 1HD1 ILE 130 1.803 2.617 12.647 397 HD13 ILE 130 2HD1 ILE 130 1.139 2.532 14.275 398 H ASP 131 H ASP 131 -3.797 -0.177 12.667 399 HA ASP 131 HA ASP 131 -5.005 -0.751 15.279 400 HB2 ASP 131 2HB ASP 131 -6.147 0.389 12.717 401 HB3 ASP 131 1HB ASP 131 -7.073 0.134 14.196 402 H GLY 132 H GLY 132 -4.196 -2.481 12.567 403 HA2 GLY 132 2HA GLY 132 -4.940 -4.443 11.595 404 HA3 GLY 132 1HA GLY 132 -5.336 -4.881 13.255 405 H ASP 133 H ASP 133 -6.631 -2.814 10.651 406 HA ASP 133 HA ASP 133 -9.352 -3.837 11.266 407 HB2 ASP 133 2HB ASP 133 -10.227 -1.661 10.666 408 HB3 ASP 133 1HB ASP 133 -9.005 -1.464 11.924 409 H GLY 134 H GLY 134 -6.995 -2.962 8.819 410 HA2 GLY 134 2HA GLY 134 -7.070 -4.396 6.786 411 HA3 GLY 134 1HA GLY 134 -8.795 -4.062 6.719 412 H GLN 135 H GLN 135 -7.471 -1.266 7.761 413 HA GLN 135 HA GLN 135 -7.039 -0.214 5.012 414 HB2 GLN 135 2HB GLN 135 -8.291 1.261 7.343 415 HB3 GLN 135 1HB GLN 135 -8.102 1.858 5.701 416 HG2 GLN 135 2HG GLN 135 -9.802 -0.491 6.580 417 HG3 GLN 135 1HG GLN 135 -10.393 1.067 6.012 418 HE21 GLN 135 1HE2 GLN 135 -10.026 -2.041 4.975 419 HE22 GLN 135 2HE2 GLN 135 -9.787 -1.773 3.315 420 H VAL 136 H VAL 136 -5.043 0.468 4.710 421 HA VAL 136 HA VAL 136 -3.450 1.317 7.076 422 HB VAL 136 HB VAL 136 -2.409 0.445 4.377 423 HG11 VAL 136 1HG1 VAL 136 -1.063 0.843 7.050 424 HG12 VAL 136 2HG1 VAL 136 -0.933 1.937 5.669 425 HG13 VAL 136 3HG1 VAL 136 -0.274 0.306 5.569 426 HG21 VAL 136 3HG2 VAL 136 -2.856 -1.068 6.949 427 HG22 VAL 136 1HG2 VAL 136 -1.710 -1.606 5.721 428 HG23 VAL 136 2HG2 VAL 136 -3.428 -1.479 5.331 429 H ASN 137 H ASN 137 -2.906 3.341 7.267 430 HA ASN 137 HA ASN 137 -3.745 5.339 5.434 431 HB2 ASN 137 2HB ASN 137 -1.729 5.524 7.694 432 HB3 ASN 137 1HB ASN 137 -2.466 6.892 6.865 433 HD21 ASN 137 1HD2 ASN 137 -2.831 4.829 9.529 434 HD22 ASN 137 2HD2 ASN 137 -4.458 5.164 9.872 435 H TYR 138 H TYR 138 -1.345 7.005 5.533 436 HA TYR 138 HA TYR 138 -0.057 5.937 3.159 437 HB2 TYR 138 2HB TYR 138 0.336 8.562 4.619 438 HB3 TYR 138 1HB TYR 138 1.019 8.148 3.045 439 HD1 TYR 138 1HD TYR 138 -0.614 7.471 1.177 440 HD2 TYR 138 2HD TYR 138 -1.848 9.482 4.763 441 HE1 TYR 138 1HE TYR 138 -2.712 8.176 0.057 442 HE2 TYR 138 2HE TYR 138 -3.946 10.194 3.643 443 HH TYR 138 HH TYR 138 -4.752 10.566 1.310 444 H GLU 139 H GLU 139 1.109 7.209 6.284 445 HA GLU 139 HA GLU 139 3.790 6.419 5.922 446 HB2 GLU 139 2HB GLU 139 4.000 6.705 8.380 447 HB3 GLU 139 1HB GLU 139 3.245 8.072 7.568 448 HG2 GLU 139 2HG GLU 139 1.008 6.698 8.144 449 HG3 GLU 139 1HG GLU 139 2.033 6.052 9.424 450 H GLU 140 H GLU 140 1.451 4.968 8.139 451 HA GLU 140 HA GLU 140 2.565 2.709 9.051 452 HB2 GLU 140 2HB GLU 140 -0.182 2.862 7.760 453 HB3 GLU 140 1HB GLU 140 0.376 1.504 8.742 454 HG2 GLU 140 2HG GLU 140 0.610 2.917 10.673 455 HG3 GLU 140 1HG GLU 140 0.286 4.363 9.732 456 H PHE 141 H PHE 141 1.732 3.348 5.748 457 HA PHE 141 HA PHE 141 2.403 0.660 4.828 458 HB2 PHE 141 2HB PHE 141 0.545 2.256 3.888 459 HB3 PHE 141 1HB PHE 141 1.875 3.010 3.018 460 HD1 PHE 141 1HD PHE 141 3.574 1.213 1.891 461 HD2 PHE 141 2HD PHE 141 -0.563 0.511 2.814 462 HE1 PHE 141 1HE PHE 141 3.514 -0.618 0.230 463 HE2 PHE 141 2HE PHE 141 -0.613 -1.313 1.154 464 HZ PHE 141 HZ PHE 141 1.419 -1.883 -0.143 465 H VAL 142 H VAL 142 3.530 4.011 4.183 466 HA VAL 142 HA VAL 142 5.632 3.729 2.537 467 HB VAL 142 HB VAL 142 5.581 5.288 5.119 468 HG11 VAL 142 1HG1 VAL 142 7.909 5.054 4.701 469 HG12 VAL 142 2HG1 VAL 142 7.476 6.619 4.023 470 HG13 VAL 142 3HG1 VAL 142 7.692 5.230 2.958 471 HG21 VAL 142 3HG2 VAL 142 5.422 7.194 3.378 472 HG22 VAL 142 1HG2 VAL 142 4.008 6.184 3.580 473 HG23 VAL 142 2HG2 VAL 142 5.064 5.926 2.208 474 H GLN 143 H GLN 143 6.093 3.302 6.071 475 HA GLN 143 HA GLN 143 8.671 2.469 6.160 476 HB2 GLN 143 2HB GLN 143 6.236 1.533 7.657 477 HB3 GLN 143 1HB GLN 143 7.802 0.793 7.987 478 HG2 GLN 143 2HG GLN 143 7.409 2.660 9.526 479 HG3 GLN 143 1HG GLN 143 8.754 3.033 8.449 480 HE21 GLN 143 1HE2 GLN 143 8.538 5.310 8.282 481 HE22 GLN 143 2HE2 GLN 143 7.138 6.077 7.702 482 H MET 144 H MET 144 6.110 -0.006 6.069 483 HA MET 144 HA MET 144 7.589 -2.194 5.428 484 HB2 MET 144 2HB MET 144 4.840 -1.405 4.461 485 HB3 MET 144 1HB MET 144 5.542 -2.979 4.085 486 HG2 MET 144 2HG MET 144 5.261 -1.884 6.898 487 HG3 MET 144 1HG MET 144 4.099 -2.966 6.146 488 HE1 MET 144 3HE MET 144 4.052 -5.242 6.689 489 HE2 MET 144 1HE MET 144 4.487 -4.607 8.282 490 HE3 MET 144 2HE MET 144 5.262 -6.066 7.668 491 H MET 145 H MET 145 6.314 0.159 3.070 492 HA MET 145 HA MET 145 7.470 -1.099 0.799 493 HB2 MET 145 2HB MET 145 5.583 0.495 0.674 494 HB3 MET 145 1HB MET 145 6.659 1.787 1.201 495 HG2 MET 145 2HG MET 145 8.065 1.468 -0.782 496 HG3 MET 145 1HG MET 145 7.061 0.114 -1.293 497 HE1 MET 145 3HE MET 145 7.724 3.752 -1.162 498 HE2 MET 145 1HE MET 145 6.472 3.817 0.086 499 HE3 MET 145 2HE MET 145 6.205 4.588 -1.474 500 H THR 146 H THR 146 9.330 -0.517 -0.386 501 HA THR 146 HA THR 146 11.293 1.230 0.981 502 HB THR 146 HB THR 146 12.086 -0.907 1.579 503 HG1 THR 146 1HG THR 146 13.979 -0.928 0.544 504 HG21 THR 146 3HG2 THR 146 10.614 -2.298 0.271 505 HG22 THR 146 1HG2 THR 146 12.271 -2.753 -0.127 506 HG23 THR 146 2HG2 THR 146 11.344 -1.740 -1.234 507 H ALA 147 H ALA 147 9.514 0.664 -1.721 508 HA ALA 147 HA ALA 147 11.398 1.100 -3.813 509 HB1 ALA 147 1HB ALA 147 9.429 1.584 -5.187 510 HB2 ALA 147 2HB ALA 147 8.432 1.713 -3.738 511 HB3 ALA 147 3HB ALA 147 9.139 0.160 -4.189 512 H LYS 148 H LYS 148 12.206 2.967 -4.651 513 HA LYS 148 HA LYS 148 11.090 5.552 -3.810 514 HB2 LYS 148 2HB LYS 148 13.958 4.680 -3.380 515 HB3 LYS 148 1HB LYS 148 13.440 6.364 -3.342 516 HG2 LYS 148 2HG LYS 148 11.856 5.841 -1.521 517 HG3 LYS 148 1HG LYS 148 12.365 4.153 -1.558 518 HD2 LYS 148 2HD LYS 148 14.660 4.813 -0.958 519 HD3 LYS 148 1HD LYS 148 14.179 6.510 -0.952 520 HE2 LYS 148 2HE LYS 148 12.577 6.057 0.873 521 HE3 LYS 148 1HE LYS 148 13.041 4.357 0.863 522 HZ1 LYS 148 3HZ LYS 148 15.099 4.818 1.741 523 HZ2 LYS 148 1HZ LYS 148 14.152 5.991 2.520 524 HZ3 LYS 148 2HZ LYS 148 15.112 6.423 1.186 Start of MODEL 9 1 H1 ASP 78 1HT ASP 78 10.284 15.983 -6.257 2 H2 ASP 78 2HT ASP 78 11.773 15.167 -6.180 3 H3 ASP 78 3HT ASP 78 10.747 15.206 -4.826 4 HA ASP 78 HA ASP 78 9.062 14.088 -6.440 5 HB2 ASP 78 2HB ASP 78 11.789 13.548 -7.627 6 HB3 ASP 78 1HB ASP 78 10.399 12.505 -7.929 7 H THR 79 H THR 79 12.009 12.195 -6.219 8 HA THR 79 HA THR 79 10.827 10.308 -4.442 9 HB THR 79 HB THR 79 13.755 10.673 -5.130 10 HG1 THR 79 1HG THR 79 11.602 9.772 -6.526 11 HG21 THR 79 3HG2 THR 79 13.723 9.201 -3.301 12 HG22 THR 79 1HG2 THR 79 13.631 8.105 -4.678 13 HG23 THR 79 2HG2 THR 79 12.173 8.498 -3.769 14 H ASP 80 H ASP 80 11.906 13.362 -3.822 15 HA ASP 80 HA ASP 80 12.645 12.700 -1.016 16 HB2 ASP 80 2HB ASP 80 13.895 14.856 -1.029 17 HB3 ASP 80 1HB ASP 80 14.547 13.659 -2.145 18 H SER 81 H SER 81 10.319 14.064 -3.012 19 HA SER 81 HA SER 81 9.383 16.016 -1.018 20 HB2 SER 81 2HB SER 81 9.356 16.840 -3.268 21 HB3 SER 81 1HB SER 81 8.532 15.398 -3.853 22 HG SER 81 HG SER 81 7.486 17.641 -2.865 23 H GLU 82 H GLU 82 8.124 15.274 0.536 24 HA GLU 82 HA GLU 82 6.897 12.844 0.821 25 HB2 GLU 82 2HB GLU 82 7.071 14.609 2.576 26 HB3 GLU 82 1HB GLU 82 5.788 15.503 1.765 27 HG2 GLU 82 2HG GLU 82 4.223 13.672 2.122 28 HG3 GLU 82 1HG GLU 82 5.500 12.673 2.810 29 H GLU 83 H GLU 83 6.083 15.305 -1.395 30 HA GLU 83 HA GLU 83 3.309 14.939 -1.675 31 HB2 GLU 83 2HB GLU 83 4.560 16.846 -2.618 32 HB3 GLU 83 1HB GLU 83 5.310 15.763 -3.792 33 HG2 GLU 83 2HG GLU 83 3.092 15.189 -4.692 34 HG3 GLU 83 1HG GLU 83 2.329 16.232 -3.498 35 H GLU 84 H GLU 84 5.985 13.442 -3.595 36 HA GLU 84 HA GLU 84 4.461 11.899 -5.309 37 HB2 GLU 84 2HB GLU 84 7.063 11.266 -3.912 38 HB3 GLU 84 1HB GLU 84 6.348 10.171 -5.093 39 HG2 GLU 84 2HG GLU 84 6.941 13.082 -5.649 40 HG3 GLU 84 1HG GLU 84 8.049 11.774 -6.050 41 H ILE 85 H ILE 85 5.511 11.052 -2.015 42 HA ILE 85 HA ILE 85 4.291 8.554 -1.783 43 HB ILE 85 HB ILE 85 4.531 10.699 0.355 44 HG12 ILE 85 2HG1 ILE 85 6.442 8.454 -0.365 45 HG13 ILE 85 1HG1 ILE 85 6.688 10.151 -0.782 46 HG21 ILE 85 1HG2 ILE 85 4.341 7.687 0.591 47 HG22 ILE 85 2HG2 ILE 85 3.034 8.808 0.959 48 HG23 ILE 85 3HG2 ILE 85 4.501 8.819 1.928 49 HD11 ILE 85 3HD1 ILE 85 7.917 9.816 1.237 50 HD12 ILE 85 1HD1 ILE 85 6.597 8.905 1.969 51 HD13 ILE 85 2HD1 ILE 85 6.437 10.645 1.724 52 H ARG 86 H ARG 86 2.974 11.777 -1.039 53 HA ARG 86 HA ARG 86 0.408 10.949 -0.255 54 HB2 ARG 86 2HB ARG 86 1.440 13.538 -1.429 55 HB3 ARG 86 1HB ARG 86 -0.227 13.340 -0.893 56 HG2 ARG 86 2HG ARG 86 0.537 12.754 1.357 57 HG3 ARG 86 1HG ARG 86 2.218 12.846 0.838 58 HD2 ARG 86 2HD ARG 86 1.953 15.242 0.356 59 HD3 ARG 86 1HD ARG 86 0.256 15.163 0.819 60 HE ARG 86 HE ARG 86 1.745 14.187 2.974 61 HH11 ARG 86 1HH2 ARG 86 1.284 17.124 1.186 62 HH12 ARG 86 2HH2 ARG 86 1.747 18.153 2.500 63 HH21 ARG 86 1HH1 ARG 86 2.355 15.534 4.693 64 HH22 ARG 86 2HH1 ARG 86 2.352 17.254 4.488 65 H GLU 87 H GLU 87 1.736 11.690 -3.452 66 HA GLU 87 HA GLU 87 -0.801 11.411 -4.800 67 HB2 GLU 87 2HB GLU 87 2.032 11.581 -5.836 68 HB3 GLU 87 1HB GLU 87 0.601 11.531 -6.866 69 HG2 GLU 87 2HG GLU 87 -0.266 13.566 -5.768 70 HG3 GLU 87 1HG GLU 87 1.160 13.617 -4.736 71 H ALA 88 H ALA 88 2.213 9.580 -5.135 72 HA ALA 88 HA ALA 88 1.498 7.432 -6.593 73 HB1 ALA 88 1HB ALA 88 3.068 7.066 -4.042 74 HB2 ALA 88 2HB ALA 88 3.736 7.890 -5.452 75 HB3 ALA 88 3HB ALA 88 3.251 6.195 -5.565 76 H PHE 89 H PHE 89 1.086 7.543 -3.027 77 HA PHE 89 HA PHE 89 -0.337 5.108 -2.891 78 HB2 PHE 89 2HB PHE 89 0.092 7.415 -1.048 79 HB3 PHE 89 1HB PHE 89 -1.132 6.213 -0.625 80 HD1 PHE 89 1HD PHE 89 -0.321 3.678 -1.020 81 HD2 PHE 89 2HD PHE 89 2.275 7.014 -0.280 82 HE1 PHE 89 1HE PHE 89 1.448 2.132 -0.241 83 HE2 PHE 89 2HE PHE 89 4.034 5.458 0.510 84 HZ PHE 89 HZ PHE 89 3.627 3.037 0.522 85 H ARG 90 H ARG 90 -1.468 8.500 -3.093 86 HA ARG 90 HA ARG 90 -4.207 7.994 -2.799 87 HB2 ARG 90 2HB ARG 90 -2.629 10.082 -4.271 88 HB3 ARG 90 1HB ARG 90 -4.381 10.062 -4.414 89 HG2 ARG 90 2HG ARG 90 -3.095 9.958 -1.681 90 HG3 ARG 90 1HG ARG 90 -3.249 11.504 -2.517 91 HD2 ARG 90 2HD ARG 90 -5.704 11.019 -2.791 92 HD3 ARG 90 1HD ARG 90 -5.481 9.598 -1.779 93 HE ARG 90 HE ARG 90 -4.607 12.151 -0.656 94 HH11 ARG 90 1HH2 ARG 90 -7.031 9.685 -0.917 95 HH12 ARG 90 2HH2 ARG 90 -7.821 10.115 0.560 96 HH21 ARG 90 1HH1 ARG 90 -5.676 12.745 1.265 97 HH22 ARG 90 2HH1 ARG 90 -7.064 11.850 1.788 98 H VAL 91 H VAL 91 -2.175 7.909 -5.701 99 HA VAL 91 HA VAL 91 -4.216 7.291 -7.557 100 HB VAL 91 HB VAL 91 -1.254 6.652 -7.602 101 HG11 VAL 91 1HG1 VAL 91 -3.388 6.513 -9.746 102 HG12 VAL 91 2HG1 VAL 91 -2.341 5.207 -9.189 103 HG13 VAL 91 3HG1 VAL 91 -1.662 6.553 -10.103 104 HG21 VAL 91 3HG2 VAL 91 -1.064 8.665 -8.937 105 HG22 VAL 91 1HG2 VAL 91 -1.925 9.075 -7.454 106 HG23 VAL 91 2HG2 VAL 91 -2.816 8.865 -8.963 107 H PHE 92 H PHE 92 -2.057 5.272 -5.618 108 HA PHE 92 HA PHE 92 -2.672 2.755 -6.632 109 HB2 PHE 92 2HB PHE 92 -1.754 3.786 -3.986 110 HB3 PHE 92 1HB PHE 92 -2.277 2.114 -4.040 111 HD1 PHE 92 2HD PHE 92 -0.614 4.083 -6.758 112 HD2 PHE 92 1HD PHE 92 -0.236 0.939 -3.855 113 HE1 PHE 92 2HE PHE 92 1.541 3.419 -7.764 114 HE2 PHE 92 1HE PHE 92 1.925 0.273 -4.868 115 HZ PHE 92 HZ PHE 92 2.814 1.513 -6.823 116 H ASP 93 H ASP 93 -4.291 4.418 -3.899 117 HA ASP 93 HA ASP 93 -6.228 2.510 -3.358 118 HB2 ASP 93 2HB ASP 93 -5.797 4.727 -2.154 119 HB3 ASP 93 1HB ASP 93 -6.808 5.472 -3.389 120 H LYS 94 H LYS 94 -6.843 1.505 -5.325 121 HA LYS 94 HA LYS 94 -7.782 2.747 -7.639 122 HB2 LYS 94 2HB LYS 94 -8.351 0.085 -6.349 123 HB3 LYS 94 1HB LYS 94 -9.131 0.535 -7.864 124 HG2 LYS 94 2HG LYS 94 -7.142 0.499 -9.071 125 HG3 LYS 94 1HG LYS 94 -6.147 0.874 -7.665 126 HD2 LYS 94 2HD LYS 94 -6.150 -1.337 -6.898 127 HD3 LYS 94 1HD LYS 94 -7.615 -1.755 -7.768 128 HE2 LYS 94 2HE LYS 94 -6.476 -1.825 -9.858 129 HE3 LYS 94 1HE LYS 94 -5.046 -1.051 -9.177 130 HZ1 LYS 94 3HZ LYS 94 -4.897 -3.021 -7.659 131 HZ2 LYS 94 1HZ LYS 94 -4.577 -3.340 -9.294 132 HZ3 LYS 94 2HZ LYS 94 -6.078 -3.770 -8.623 133 H ASP 95 H ASP 95 -9.743 1.319 -5.047 134 HA ASP 95 HA ASP 95 -12.185 2.515 -5.924 135 HB2 ASP 95 2HB ASP 95 -11.322 1.098 -3.403 136 HB3 ASP 95 1HB ASP 95 -12.954 1.728 -3.611 137 H GLY 96 H GLY 96 -9.716 4.177 -5.144 138 HA2 GLY 96 2HA GLY 96 -9.172 5.976 -3.717 139 HA3 GLY 96 1HA GLY 96 -10.558 6.592 -4.607 140 H ASN 97 H ASN 97 -10.438 4.128 -2.019 141 HA ASN 97 HA ASN 97 -12.677 5.347 -0.702 142 HB2 ASN 97 2HB ASN 97 -12.598 3.532 0.834 143 HB3 ASN 97 1HB ASN 97 -12.206 2.864 -0.747 144 HD21 ASN 97 1HD2 ASN 97 -9.427 3.980 -0.698 145 HD22 ASN 97 2HD2 ASN 97 -8.572 3.017 0.407 146 H GLY 98 H GLY 98 -9.468 6.186 -0.738 147 HA2 GLY 98 2HA GLY 98 -8.584 8.025 0.466 148 HA3 GLY 98 1HA GLY 98 -9.774 7.750 1.733 149 H TYR 99 H TYR 99 -8.649 4.791 1.041 150 HA TYR 99 HA TYR 99 -6.248 4.924 2.747 151 HB2 TYR 99 2HB TYR 99 -8.527 3.000 3.253 152 HB3 TYR 99 1HB TYR 99 -7.027 3.143 4.172 153 HD1 TYR 99 2HD TYR 99 -6.530 5.306 5.411 154 HD2 TYR 99 1HD TYR 99 -10.370 4.445 3.684 155 HE1 TYR 99 2HE TYR 99 -7.559 7.072 6.816 156 HE2 TYR 99 1HE TYR 99 -11.396 6.211 5.088 157 HH TYR 99 HH TYR 99 -11.029 7.493 6.992 158 H ILE 100 H ILE 100 -5.730 2.224 2.972 159 HA ILE 100 HA ILE 100 -5.649 1.283 0.155 160 HB ILE 100 HB ILE 100 -3.378 1.181 2.150 161 HG12 ILE 100 2HG1 ILE 100 -3.980 3.497 1.172 162 HG13 ILE 100 1HG1 ILE 100 -2.330 2.950 0.906 163 HG21 ILE 100 1HG2 ILE 100 -2.121 0.596 -0.024 164 HG22 ILE 100 2HG2 ILE 100 -3.712 0.266 -0.706 165 HG23 ILE 100 3HG2 ILE 100 -3.141 -0.658 0.685 166 HD11 ILE 100 3HD1 ILE 100 -2.755 2.376 -1.350 167 HD12 ILE 100 1HD1 ILE 100 -3.522 3.941 -1.125 168 HD13 ILE 100 2HD1 ILE 100 -4.496 2.482 -1.150 169 H SER 101 H SER 101 -6.326 -0.698 -0.184 170 HA SER 101 HA SER 101 -6.584 -2.525 2.129 171 HB2 SER 101 2HB SER 101 -8.655 -1.998 0.814 172 HB3 SER 101 1HB SER 101 -7.903 -2.752 -0.585 173 HG SER 101 HG SER 101 -9.268 -4.137 0.781 174 H ALA 102 H ALA 102 -6.290 -4.848 1.604 175 HA ALA 102 HA ALA 102 -3.700 -5.281 0.469 176 HB1 ALA 102 1HB ALA 102 -5.293 -6.569 2.350 177 HB2 ALA 102 2HB ALA 102 -3.764 -7.185 1.731 178 HB3 ALA 102 3HB ALA 102 -5.286 -7.706 1.003 179 H ALA 103 H ALA 103 -6.983 -5.972 -0.614 180 HA ALA 103 HA ALA 103 -6.332 -7.668 -2.726 181 HB1 ALA 103 1HB ALA 103 -8.541 -6.947 -3.653 182 HB2 ALA 103 2HB ALA 103 -8.621 -5.722 -2.386 183 HB3 ALA 103 3HB ALA 103 -8.606 -7.433 -1.958 184 H GLU 104 H GLU 104 -6.375 -4.137 -2.561 185 HA GLU 104 HA GLU 104 -6.164 -3.643 -5.329 186 HB2 GLU 104 2HB GLU 104 -5.168 -1.969 -3.009 187 HB3 GLU 104 1HB GLU 104 -5.447 -1.401 -4.659 188 HG2 GLU 104 2HG GLU 104 -7.823 -1.933 -4.476 189 HG3 GLU 104 1HG GLU 104 -7.565 -2.609 -2.869 190 H LEU 105 H LEU 105 -3.752 -4.374 -2.847 191 HA LEU 105 HA LEU 105 -1.463 -3.541 -4.292 192 HB2 LEU 105 2HB LEU 105 -1.642 -5.786 -2.282 193 HB3 LEU 105 1HB LEU 105 -0.207 -4.858 -2.716 194 HG LEU 105 HG LEU 105 -2.696 -3.790 -1.349 195 HD11 LEU 105 1HD1 LEU 105 0.146 -4.320 -0.455 196 HD12 LEU 105 2HD1 LEU 105 -1.346 -4.943 0.245 197 HD13 LEU 105 3HD1 LEU 105 -0.933 -3.247 0.426 198 HD21 LEU 105 3HD2 LEU 105 -0.283 -2.427 -2.547 199 HD22 LEU 105 1HD2 LEU 105 -1.122 -1.707 -1.175 200 HD23 LEU 105 2HD2 LEU 105 -1.985 -1.985 -2.681 201 H ARG 106 H ARG 106 -2.880 -6.791 -3.958 202 HA ARG 106 HA ARG 106 -1.055 -8.073 -5.667 203 HB2 ARG 106 2HB ARG 106 -2.972 -9.766 -5.965 204 HB3 ARG 106 1HB ARG 106 -2.368 -9.514 -4.338 205 HG2 ARG 106 2HG ARG 106 -4.234 -7.863 -3.966 206 HG3 ARG 106 1HG ARG 106 -4.875 -8.317 -5.546 207 HD2 ARG 106 2HD ARG 106 -6.018 -9.638 -3.904 208 HD3 ARG 106 1HD ARG 106 -4.899 -10.710 -4.731 209 HE ARG 106 HE ARG 106 -3.669 -9.584 -2.441 210 HH11 ARG 106 1HH2 ARG 106 -6.038 -11.933 -3.436 211 HH12 ARG 106 2HH2 ARG 106 -5.874 -12.892 -2.001 212 HH21 ARG 106 1HH1 ARG 106 -3.465 -10.841 -0.576 213 HH22 ARG 106 2HH1 ARG 106 -4.420 -12.273 -0.383 214 H HIS 107 H HIS 107 -4.302 -6.715 -6.389 215 HA HIS 107 HA HIS 107 -4.263 -7.384 -9.127 216 HB2 HIS 107 2HB HIS 107 -5.715 -5.222 -7.597 217 HB3 HIS 107 1HB HIS 107 -6.018 -5.584 -9.295 218 HD1 HIS 107 1HD HIS 107 -6.164 -8.566 -9.417 219 HD2 HIS 107 2HD HIS 107 -7.746 -6.440 -6.196 220 HE1 HIS 107 1HE HIS 107 -7.921 -10.059 -8.361 221 HE2 HIS 107 2HE HIS 107 -8.888 -8.777 -6.395 222 H VAL 108 H VAL 108 -3.584 -4.258 -7.546 223 HA VAL 108 HA VAL 108 -2.881 -2.913 -9.912 224 HB VAL 108 HB VAL 108 -3.396 -1.893 -7.626 225 HG11 VAL 108 1HG1 VAL 108 -1.546 -3.272 -6.542 226 HG12 VAL 108 2HG1 VAL 108 -1.630 -1.576 -6.091 227 HG13 VAL 108 3HG1 VAL 108 -0.414 -2.126 -7.246 228 HG21 VAL 108 3HG2 VAL 108 -1.149 -0.977 -9.425 229 HG22 VAL 108 1HG2 VAL 108 -1.725 0.015 -8.085 230 HG23 VAL 108 2HG2 VAL 108 -2.818 -0.419 -9.399 231 H MET 109 H MET 109 -0.792 -4.489 -7.490 232 HA MET 109 HA MET 109 1.668 -3.960 -8.675 233 HB2 MET 109 2HB MET 109 0.743 -6.371 -7.104 234 HB3 MET 109 1HB MET 109 2.419 -6.058 -7.529 235 HG2 MET 109 2HG MET 109 0.932 -3.824 -6.187 236 HG3 MET 109 1HG MET 109 1.387 -5.206 -5.191 237 HE1 MET 109 3HE MET 109 2.231 -2.696 -4.354 238 HE2 MET 109 1HE MET 109 2.556 -1.778 -5.831 239 HE3 MET 109 2HE MET 109 3.861 -2.117 -4.696 240 H THR 110 H THR 110 -0.542 -6.696 -9.214 241 HA THR 110 HA THR 110 1.072 -7.986 -11.148 242 HB THR 110 HB THR 110 -1.914 -8.124 -10.670 243 HG1 THR 110 1HG THR 110 -1.378 -9.919 -9.478 244 HG21 THR 110 3HG2 THR 110 -0.040 -9.752 -12.398 245 HG22 THR 110 1HG2 THR 110 -1.536 -8.949 -12.877 246 HG23 THR 110 2HG2 THR 110 -1.592 -10.379 -11.848 247 H ASN 111 H ASN 111 -1.614 -5.709 -11.367 248 HA ASN 111 HA ASN 111 -1.812 -5.624 -14.180 249 HB2 ASN 111 2HB ASN 111 -2.524 -3.697 -11.990 250 HB3 ASN 111 1HB ASN 111 -2.738 -3.270 -13.665 251 HD21 ASN 111 1HD2 ASN 111 -4.970 -3.535 -11.886 252 HD22 ASN 111 2HD2 ASN 111 -5.894 -4.866 -12.393 253 H LEU 112 H LEU 112 0.154 -3.850 -11.886 254 HA LEU 112 HA LEU 112 1.281 -1.973 -13.652 255 HB2 LEU 112 2HB LEU 112 2.093 -3.141 -11.006 256 HB3 LEU 112 1HB LEU 112 3.210 -2.080 -11.861 257 HG LEU 112 HG LEU 112 0.345 -1.201 -11.483 258 HD11 LEU 112 1HD1 LEU 112 0.995 -1.835 -9.240 259 HD12 LEU 112 2HD1 LEU 112 1.095 -0.081 -9.357 260 HD13 LEU 112 3HD1 LEU 112 2.565 -1.054 -9.421 261 HD21 LEU 112 3HD2 LEU 112 2.090 0.028 -12.912 262 HD22 LEU 112 1HD2 LEU 112 2.938 0.371 -11.406 263 HD23 LEU 112 2HD2 LEU 112 1.310 0.995 -11.664 264 H GLY 113 H GLY 113 2.206 -5.258 -12.767 265 HA2 GLY 113 2HA GLY 113 3.228 -6.393 -14.849 266 HA3 GLY 113 1HA GLY 113 4.467 -5.155 -14.671 267 H GLU 114 H GLU 114 3.589 -5.659 -11.601 268 HA GLU 114 HA GLU 114 5.657 -7.749 -11.179 269 HB2 GLU 114 2HB GLU 114 4.695 -5.486 -9.405 270 HB3 GLU 114 1HB GLU 114 5.825 -6.740 -8.889 271 HG2 GLU 114 2HG GLU 114 7.189 -4.924 -9.598 272 HG3 GLU 114 1HG GLU 114 7.252 -6.090 -10.916 273 H LYS 115 H LYS 115 4.547 -9.642 -11.129 274 HA LYS 115 HA LYS 115 2.000 -9.879 -9.774 275 HB2 LYS 115 2HB LYS 115 2.745 -11.173 -11.861 276 HB3 LYS 115 1HB LYS 115 3.715 -12.159 -10.766 277 HG2 LYS 115 2HG LYS 115 1.721 -12.785 -9.503 278 HG3 LYS 115 1HG LYS 115 0.727 -11.714 -10.489 279 HD2 LYS 115 2HD LYS 115 1.360 -13.053 -12.505 280 HD3 LYS 115 1HD LYS 115 2.227 -14.168 -11.449 281 HE2 LYS 115 2HE LYS 115 -0.722 -13.514 -11.177 282 HE3 LYS 115 1HE LYS 115 -0.092 -14.941 -11.998 283 HZ1 LYS 115 3HZ LYS 115 -0.344 -15.803 -9.942 284 HZ2 LYS 115 1HZ LYS 115 -0.161 -14.312 -9.154 285 HZ3 LYS 115 2HZ LYS 115 1.207 -15.145 -9.722 286 H LEU 116 H LEU 116 2.463 -9.340 -7.615 287 HA LEU 116 HA LEU 116 4.472 -10.703 -6.065 288 HB2 LEU 116 2HB LEU 116 2.302 -8.708 -5.559 289 HB3 LEU 116 1HB LEU 116 2.842 -9.647 -4.170 290 HG LEU 116 HG LEU 116 5.141 -8.927 -4.527 291 HD11 LEU 116 1HD1 LEU 116 5.435 -7.042 -6.310 292 HD12 LEU 116 2HD1 LEU 116 3.974 -7.715 -7.031 293 HD13 LEU 116 3HD1 LEU 116 5.412 -8.718 -6.857 294 HD21 LEU 116 3HD2 LEU 116 3.561 -7.478 -3.232 295 HD22 LEU 116 1HD2 LEU 116 3.244 -6.564 -4.708 296 HD23 LEU 116 2HD2 LEU 116 4.859 -6.560 -3.999 297 H THR 117 H THR 117 3.343 -11.506 -3.770 298 HA THR 117 HA THR 117 1.599 -13.772 -4.580 299 HB THR 117 HB THR 117 2.479 -14.734 -2.338 300 HG1 THR 117 1HG THR 117 4.809 -13.420 -2.624 301 HG21 THR 117 3HG2 THR 117 4.634 -15.440 -3.467 302 HG22 THR 117 1HG2 THR 117 4.223 -14.336 -4.779 303 HG23 THR 117 2HG2 THR 117 3.173 -15.708 -4.418 304 H ASP 118 H ASP 118 -0.396 -13.867 -3.782 305 HA ASP 118 HA ASP 118 -1.585 -11.768 -2.378 306 HB2 ASP 118 2HB ASP 118 -2.390 -14.618 -2.911 307 HB3 ASP 118 1HB ASP 118 -3.399 -13.589 -1.895 308 H GLU 119 H GLU 119 -0.274 -14.841 -1.223 309 HA GLU 119 HA GLU 119 -1.154 -14.711 1.437 310 HB2 GLU 119 2HB GLU 119 1.365 -15.935 0.272 311 HB3 GLU 119 1HB GLU 119 0.780 -16.227 1.912 312 HG2 GLU 119 2HG GLU 119 -1.314 -17.139 1.029 313 HG3 GLU 119 1HG GLU 119 -0.794 -16.783 -0.615 314 H GLU 120 H GLU 120 1.688 -13.293 -0.131 315 HA GLU 120 HA GLU 120 2.807 -12.270 2.325 316 HB2 GLU 120 2HB GLU 120 3.374 -11.792 -0.593 317 HB3 GLU 120 1HB GLU 120 4.150 -10.823 0.655 318 HG2 GLU 120 2HG GLU 120 5.552 -12.759 0.015 319 HG3 GLU 120 1HG GLU 120 5.056 -12.847 1.702 320 H VAL 121 H VAL 121 0.857 -10.973 -0.321 321 HA VAL 121 HA VAL 121 0.744 -8.281 0.388 322 HB VAL 121 HB VAL 121 -1.300 -10.118 -0.849 323 HG11 VAL 121 1HG1 VAL 121 -2.675 -8.462 0.121 324 HG12 VAL 121 2HG1 VAL 121 -2.426 -7.936 -1.541 325 HG13 VAL 121 3HG1 VAL 121 -1.515 -7.184 -0.236 326 HG21 VAL 121 3HG2 VAL 121 -0.719 -8.932 -2.892 327 HG22 VAL 121 1HG2 VAL 121 0.762 -9.526 -2.141 328 HG23 VAL 121 2HG2 VAL 121 0.318 -7.826 -1.994 329 H ASP 122 H ASP 122 -1.807 -10.648 1.147 330 HA ASP 122 HA ASP 122 -3.211 -9.227 3.022 331 HB2 ASP 122 2HB ASP 122 -3.711 -11.524 2.061 332 HB3 ASP 122 1HB ASP 122 -2.609 -12.179 3.266 333 H GLU 123 H GLU 123 -0.278 -11.197 3.558 334 HA GLU 123 HA GLU 123 -0.232 -10.822 6.386 335 HB2 GLU 123 2HB GLU 123 0.996 -12.623 5.127 336 HB3 GLU 123 1HB GLU 123 2.130 -11.384 4.588 337 HG2 GLU 123 2HG GLU 123 3.096 -12.402 6.537 338 HG3 GLU 123 1HG GLU 123 2.513 -10.816 7.035 339 H MET 124 H MET 124 1.286 -9.083 3.673 340 HA MET 124 HA MET 124 3.043 -7.436 5.013 341 HB2 MET 124 2HB MET 124 1.377 -7.064 2.534 342 HB3 MET 124 1HB MET 124 2.380 -5.745 3.111 343 HG2 MET 124 2HG MET 124 3.583 -8.482 2.802 344 HG3 MET 124 1HG MET 124 3.354 -7.462 1.380 345 HE1 MET 124 3HE MET 124 7.124 -7.392 2.426 346 HE2 MET 124 1HE MET 124 5.848 -8.431 1.778 347 HE3 MET 124 2HE MET 124 6.214 -8.450 3.501 348 H ILE 125 H ILE 125 -0.133 -6.265 3.924 349 HA ILE 125 HA ILE 125 -0.192 -3.970 5.480 350 HB ILE 125 HB ILE 125 -2.384 -5.725 4.371 351 HG12 ILE 125 2HG1 ILE 125 -1.482 -2.891 3.756 352 HG13 ILE 125 1HG1 ILE 125 -1.037 -4.323 2.823 353 HG21 ILE 125 1HG2 ILE 125 -2.628 -3.348 6.201 354 HG22 ILE 125 2HG2 ILE 125 -3.539 -4.847 6.225 355 HG23 ILE 125 3HG2 ILE 125 -3.879 -3.631 4.996 356 HD11 ILE 125 3HD1 ILE 125 -3.617 -4.709 2.648 357 HD12 ILE 125 1HD1 ILE 125 -2.891 -3.467 1.622 358 HD13 ILE 125 2HD1 ILE 125 -3.736 -3.011 3.101 359 H ARG 126 H ARG 126 -1.317 -7.231 6.295 360 HA ARG 126 HA ARG 126 -2.560 -6.734 8.696 361 HB2 ARG 126 2HB ARG 126 -0.971 -9.067 7.676 362 HB3 ARG 126 1HB ARG 126 -1.684 -9.114 9.285 363 HG2 ARG 126 2HG ARG 126 -3.395 -8.313 6.931 364 HG3 ARG 126 1HG ARG 126 -3.056 -10.021 7.206 365 HD2 ARG 126 2HD ARG 126 -3.905 -9.791 9.531 366 HD3 ARG 126 1HD ARG 126 -4.313 -8.111 9.204 367 HE ARG 126 HE ARG 126 -6.136 -8.837 7.958 368 HH11 ARG 126 1HH2 ARG 126 -3.947 -11.405 8.682 369 HH12 ARG 126 2HH2 ARG 126 -5.016 -12.659 8.151 370 HH21 ARG 126 1HH1 ARG 126 -7.549 -10.463 7.234 371 HH22 ARG 126 2HH1 ARG 126 -7.063 -12.124 7.326 372 H GLU 127 H GLU 127 0.929 -7.130 8.130 373 HA GLU 127 HA GLU 127 1.527 -6.893 10.941 374 HB2 GLU 127 2HB GLU 127 3.281 -6.863 8.478 375 HB3 GLU 127 1HB GLU 127 3.904 -6.763 10.125 376 HG2 GLU 127 2HG GLU 127 2.933 -8.923 10.683 377 HG3 GLU 127 1HG GLU 127 2.137 -9.013 9.111 378 H ALA 128 H ALA 128 1.816 -4.769 8.104 379 HA ALA 128 HA ALA 128 2.950 -2.560 9.466 380 HB1 ALA 128 1HB ALA 128 2.081 -3.168 6.826 381 HB2 ALA 128 2HB ALA 128 3.020 -1.768 7.337 382 HB3 ALA 128 3HB ALA 128 1.261 -1.675 7.273 383 H ASP 129 H ASP 129 -0.427 -3.187 8.529 384 HA ASP 129 HA ASP 129 -1.732 -0.995 9.464 385 HB2 ASP 129 2HB ASP 129 -2.825 -2.966 8.438 386 HB3 ASP 129 1HB ASP 129 -2.629 -3.842 9.949 387 H ILE 130 H ILE 130 -1.900 0.033 11.339 388 HA ILE 130 HA ILE 130 -0.793 -1.197 13.764 389 HB ILE 130 HB ILE 130 -1.778 1.639 13.314 390 HG12 ILE 130 2HG1 ILE 130 1.010 0.465 13.274 391 HG13 ILE 130 1HG1 ILE 130 0.135 1.041 11.861 392 HG21 ILE 130 1HG2 ILE 130 -0.010 0.445 15.487 393 HG22 ILE 130 2HG2 ILE 130 -1.711 0.847 15.708 394 HG23 ILE 130 3HG2 ILE 130 -0.543 2.121 15.382 395 HD11 ILE 130 3HD1 ILE 130 1.600 2.829 12.559 396 HD12 ILE 130 1HD1 ILE 130 1.061 2.688 14.233 397 HD13 ILE 130 2HD1 ILE 130 -0.044 3.294 12.998 398 H ASP 131 H ASP 131 -3.834 -0.173 12.427 399 HA ASP 131 HA ASP 131 -5.264 -0.539 14.967 400 HB2 ASP 131 2HB ASP 131 -6.262 0.241 12.215 401 HB3 ASP 131 1HB ASP 131 -7.232 0.217 13.688 402 H GLY 132 H GLY 132 -4.199 -2.472 12.478 403 HA2 GLY 132 2HA GLY 132 -4.819 -4.525 11.609 404 HA3 GLY 132 1HA GLY 132 -5.250 -4.862 13.284 405 H ASP 133 H ASP 133 -6.564 -3.043 10.499 406 HA ASP 133 HA ASP 133 -9.246 -4.179 11.093 407 HB2 ASP 133 2HB ASP 133 -10.217 -2.080 10.392 408 HB3 ASP 133 1HB ASP 133 -9.032 -1.761 11.656 409 H GLY 134 H GLY 134 -6.807 -3.409 8.729 410 HA2 GLY 134 2HA GLY 134 -6.795 -4.924 6.761 411 HA3 GLY 134 1HA GLY 134 -8.513 -4.583 6.589 412 H GLN 135 H GLN 135 -7.149 -1.749 7.582 413 HA GLN 135 HA GLN 135 -6.371 -0.883 4.870 414 HB2 GLN 135 2HB GLN 135 -8.331 0.612 6.632 415 HB3 GLN 135 1HB GLN 135 -7.766 1.102 5.033 416 HG2 GLN 135 2HG GLN 135 -9.344 -1.413 5.652 417 HG3 GLN 135 1HG GLN 135 -9.983 0.035 4.877 418 HE21 GLN 135 1HE2 GLN 135 -9.371 -2.933 3.958 419 HE22 GLN 135 2HE2 GLN 135 -8.612 -2.701 2.459 420 H VAL 136 H VAL 136 -4.766 0.600 4.808 421 HA VAL 136 HA VAL 136 -3.852 1.767 7.385 422 HB VAL 136 HB VAL 136 -1.659 1.055 7.104 423 HG11 VAL 136 1HG1 VAL 136 -3.221 -0.856 7.495 424 HG12 VAL 136 2HG1 VAL 136 -1.694 -1.305 6.729 425 HG13 VAL 136 3HG1 VAL 136 -3.164 -1.172 5.760 426 HG21 VAL 136 3HG2 VAL 136 -1.182 1.798 4.907 427 HG22 VAL 136 1HG2 VAL 136 -2.358 0.698 4.198 428 HG23 VAL 136 2HG2 VAL 136 -0.859 0.068 4.887 429 H ASN 137 H ASN 137 -3.106 3.810 7.275 430 HA ASN 137 HA ASN 137 -3.828 5.396 5.041 431 HB2 ASN 137 2HB ASN 137 -1.993 6.083 7.343 432 HB3 ASN 137 1HB ASN 137 -2.757 7.233 6.246 433 HD21 ASN 137 1HD2 ASN 137 -3.164 5.628 9.214 434 HD22 ASN 137 2HD2 ASN 137 -4.828 5.904 9.409 435 H TYR 138 H TYR 138 -1.496 7.147 5.006 436 HA TYR 138 HA TYR 138 -0.053 5.836 2.888 437 HB2 TYR 138 2HB TYR 138 0.680 8.503 4.076 438 HB3 TYR 138 1HB TYR 138 0.836 7.953 2.408 439 HD1 TYR 138 2HD TYR 138 -1.632 6.929 1.563 440 HD2 TYR 138 1HD TYR 138 -0.959 10.161 4.311 441 HE1 TYR 138 2HE TYR 138 -3.889 7.842 1.044 442 HE2 TYR 138 1HE TYR 138 -3.210 11.073 3.791 443 HH TYR 138 HH TYR 138 -4.828 10.850 1.624 444 H GLU 139 H GLU 139 0.942 7.258 6.039 445 HA GLU 139 HA GLU 139 3.636 6.513 5.906 446 HB2 GLU 139 2HB GLU 139 1.837 6.951 8.283 447 HB3 GLU 139 1HB GLU 139 3.586 6.740 8.398 448 HG2 GLU 139 2HG GLU 139 3.946 8.666 6.928 449 HG3 GLU 139 1HG GLU 139 2.204 8.858 6.726 450 H GLU 140 H GLU 140 1.273 4.984 8.050 451 HA GLU 140 HA GLU 140 2.390 2.706 8.899 452 HB2 GLU 140 2HB GLU 140 -0.309 2.881 7.556 453 HB3 GLU 140 1HB GLU 140 0.214 1.487 8.495 454 HG2 GLU 140 2HG GLU 140 0.460 2.903 10.483 455 HG3 GLU 140 1HG GLU 140 0.019 4.325 9.544 456 H PHE 141 H PHE 141 1.635 3.444 5.572 457 HA PHE 141 HA PHE 141 2.372 0.790 4.600 458 HB2 PHE 141 2HB PHE 141 0.535 2.475 3.667 459 HB3 PHE 141 1HB PHE 141 1.892 3.126 2.772 460 HD1 PHE 141 2HD PHE 141 3.498 1.165 1.769 461 HD2 PHE 141 1HD PHE 141 -0.695 0.819 2.584 462 HE1 PHE 141 2HE PHE 141 3.331 -0.710 0.151 463 HE2 PHE 141 1HE PHE 141 -0.864 -1.044 1.008 464 HZ PHE 141 HZ PHE 141 1.143 -1.819 -0.238 465 H VAL 142 H VAL 142 3.447 4.173 4.045 466 HA VAL 142 HA VAL 142 5.568 4.009 2.447 467 HB VAL 142 HB VAL 142 5.475 5.407 5.117 468 HG11 VAL 142 1HG1 VAL 142 7.578 5.475 2.957 469 HG12 VAL 142 2HG1 VAL 142 7.801 5.248 4.691 470 HG13 VAL 142 3HG1 VAL 142 7.341 6.830 4.061 471 HG21 VAL 142 3HG2 VAL 142 4.650 7.245 3.928 472 HG22 VAL 142 1HG2 VAL 142 3.963 5.936 2.967 473 HG23 VAL 142 2HG2 VAL 142 5.426 6.747 2.426 474 H GLN 143 H GLN 143 6.005 3.426 5.960 475 HA GLN 143 HA GLN 143 8.572 2.552 6.065 476 HB2 GLN 143 2HB GLN 143 6.190 1.228 7.387 477 HB3 GLN 143 1HB GLN 143 7.867 0.993 7.879 478 HG2 GLN 143 2HG GLN 143 6.458 3.678 7.800 479 HG3 GLN 143 1HG GLN 143 6.684 2.711 9.256 480 HE21 GLN 143 1HE2 GLN 143 7.894 5.421 8.139 481 HE22 GLN 143 2HE2 GLN 143 9.550 5.234 8.462 482 H MET 144 H MET 144 5.983 0.104 5.734 483 HA MET 144 HA MET 144 7.462 -2.064 5.002 484 HB2 MET 144 2HB MET 144 4.754 -1.137 4.054 485 HB3 MET 144 1HB MET 144 5.431 -2.666 3.492 486 HG2 MET 144 2HG MET 144 5.150 -1.929 6.413 487 HG3 MET 144 1HG MET 144 3.952 -2.856 5.514 488 HE1 MET 144 3HE MET 144 4.988 -6.185 6.570 489 HE2 MET 144 1HE MET 144 3.851 -5.217 5.621 490 HE3 MET 144 2HE MET 144 4.178 -4.801 7.301 491 H MET 145 H MET 145 6.267 0.430 2.740 492 HA MET 145 HA MET 145 7.353 -0.671 0.402 493 HB2 MET 145 2HB MET 145 5.690 1.195 0.494 494 HB3 MET 145 1HB MET 145 6.986 2.264 1.018 495 HG2 MET 145 2HG MET 145 8.077 2.189 -1.043 496 HG3 MET 145 1HG MET 145 7.336 0.656 -1.502 497 HE1 MET 145 3HE MET 145 5.719 3.937 0.035 498 HE2 MET 145 1HE MET 145 5.396 4.815 -1.463 499 HE3 MET 145 2HE MET 145 7.045 4.393 -1.023 500 H THR 146 H THR 146 9.331 -0.640 -0.532 501 HA THR 146 HA THR 146 11.589 0.105 1.100 502 HB THR 146 HB THR 146 12.949 -0.844 -0.673 503 HG1 THR 146 1HG THR 146 12.239 -0.954 -2.638 504 HG21 THR 146 3HG2 THR 146 12.034 -3.102 -0.689 505 HG22 THR 146 1HG2 THR 146 10.433 -2.487 -0.283 506 HG23 THR 146 2HG2 THR 146 11.746 -2.369 0.888 507 H ALA 147 H ALA 147 10.178 2.382 0.668 508 HA ALA 147 HA ALA 147 11.580 3.874 -1.464 509 HB1 ALA 147 1HB ALA 147 9.292 4.323 -1.618 510 HB2 ALA 147 2HB ALA 147 9.876 5.684 -0.659 511 HB3 ALA 147 3HB ALA 147 9.072 4.327 0.130 512 H LYS 148 H LYS 148 13.602 4.260 -0.578 513 HA LYS 148 HA LYS 148 14.034 5.069 2.122 514 HB2 LYS 148 2HB LYS 148 15.775 4.025 0.672 515 HB3 LYS 148 1HB LYS 148 15.814 5.495 -0.299 516 HG2 LYS 148 2HG LYS 148 16.505 6.797 1.685 517 HG3 LYS 148 1HG LYS 148 16.440 5.336 2.669 518 HD2 LYS 148 2HD LYS 148 18.194 4.302 1.270 519 HD3 LYS 148 1HD LYS 148 18.261 5.753 0.272 520 HE2 LYS 148 2HE LYS 148 20.070 5.821 1.915 521 HE3 LYS 148 1HE LYS 148 18.889 7.074 2.298 522 HZ1 LYS 148 3HZ LYS 148 19.330 4.484 3.636 523 HZ2 LYS 148 1HZ LYS 148 17.856 5.303 3.794 524 HZ3 LYS 148 2HZ LYS 148 19.296 6.039 4.317 Start of MODEL 10 1 H1 ASP 78 1HT ASP 78 14.082 21.238 -3.548 2 H2 ASP 78 2HT ASP 78 12.698 20.317 -3.209 3 H3 ASP 78 3HT ASP 78 12.546 21.837 -3.947 4 HA ASP 78 HA ASP 78 12.488 20.777 -5.877 5 HB2 ASP 78 2HB ASP 78 14.849 21.666 -5.711 6 HB3 ASP 78 1HB ASP 78 15.357 20.046 -5.237 7 H THR 79 H THR 79 13.639 18.820 -3.205 8 HA THR 79 HA THR 79 12.607 16.384 -4.578 9 HB THR 79 HB THR 79 14.225 15.138 -3.065 10 HG1 THR 79 1HG THR 79 14.752 17.732 -2.404 11 HG21 THR 79 3HG2 THR 79 16.229 15.779 -4.531 12 HG22 THR 79 1HG2 THR 79 15.160 16.964 -5.280 13 HG23 THR 79 2HG2 THR 79 14.776 15.246 -5.374 14 H ASP 80 H ASP 80 10.738 17.805 -3.317 15 HA ASP 80 HA ASP 80 10.380 17.605 -0.581 16 HB2 ASP 80 2HB ASP 80 8.398 17.425 -2.856 17 HB3 ASP 80 1HB ASP 80 7.890 17.442 -1.169 18 H SER 81 H SER 81 9.471 15.182 -3.048 19 HA SER 81 HA SER 81 9.264 12.901 -2.928 20 HB2 SER 81 2HB SER 81 10.219 12.930 -0.079 21 HB3 SER 81 1HB SER 81 10.494 11.728 -1.332 22 HG SER 81 HG SER 81 11.683 14.251 -0.964 23 H GLU 82 H GLU 82 8.409 14.483 0.127 24 HA GLU 82 HA GLU 82 6.548 12.826 1.210 25 HB2 GLU 82 2HB GLU 82 7.250 15.010 2.157 26 HB3 GLU 82 1HB GLU 82 6.280 15.832 0.934 27 HG2 GLU 82 2HG GLU 82 4.244 14.795 1.793 28 HG3 GLU 82 1HG GLU 82 5.180 13.863 2.962 29 H GLU 83 H GLU 83 6.049 15.096 -1.472 30 HA GLU 83 HA GLU 83 3.278 14.671 -1.767 31 HB2 GLU 83 2HB GLU 83 5.392 15.703 -3.657 32 HB3 GLU 83 1HB GLU 83 3.679 15.659 -4.061 33 HG2 GLU 83 2HG GLU 83 3.145 17.048 -2.117 34 HG3 GLU 83 1HG GLU 83 4.839 17.042 -1.628 35 H GLU 84 H GLU 84 6.032 13.240 -3.614 36 HA GLU 84 HA GLU 84 4.596 11.670 -5.377 37 HB2 GLU 84 2HB GLU 84 7.118 11.810 -5.242 38 HB3 GLU 84 1HB GLU 84 7.046 10.706 -3.870 39 HG2 GLU 84 2HG GLU 84 7.458 9.363 -5.826 40 HG3 GLU 84 1HG GLU 84 5.788 9.083 -5.350 41 H ILE 85 H ILE 85 5.601 10.814 -2.070 42 HA ILE 85 HA ILE 85 4.430 8.294 -1.855 43 HB ILE 85 HB ILE 85 4.548 10.434 0.299 44 HG12 ILE 85 2HG1 ILE 85 6.576 8.276 -0.366 45 HG13 ILE 85 1HG1 ILE 85 6.751 9.969 -0.831 46 HG21 ILE 85 1HG2 ILE 85 4.505 7.412 0.495 47 HG22 ILE 85 2HG2 ILE 85 3.138 8.461 0.851 48 HG23 ILE 85 3HG2 ILE 85 4.586 8.536 1.846 49 HD11 ILE 85 3HD1 ILE 85 6.437 10.527 1.657 50 HD12 ILE 85 1HD1 ILE 85 7.959 9.755 1.214 51 HD13 ILE 85 2HD1 ILE 85 6.673 8.805 1.957 52 H ARG 86 H ARG 86 3.023 11.472 -1.055 53 HA ARG 86 HA ARG 86 0.463 10.591 -0.351 54 HB2 ARG 86 2HB ARG 86 1.522 13.193 -1.435 55 HB3 ARG 86 1HB ARG 86 -0.194 12.990 -1.095 56 HG2 ARG 86 2HG ARG 86 0.381 12.311 1.234 57 HG3 ARG 86 1HG ARG 86 2.083 12.590 0.876 58 HD2 ARG 86 2HD ARG 86 0.024 14.759 0.493 59 HD3 ARG 86 1HD ARG 86 0.786 14.487 2.058 60 HE ARG 86 HE ARG 86 2.770 14.681 0.038 61 HH11 ARG 86 1HH2 ARG 86 0.518 16.542 1.888 62 HH12 ARG 86 2HH2 ARG 86 1.393 18.028 1.709 63 HH21 ARG 86 1HH1 ARG 86 3.911 16.603 -0.202 64 HH22 ARG 86 2HH1 ARG 86 3.327 18.063 0.521 65 H GLU 87 H GLU 87 1.829 11.336 -3.526 66 HA GLU 87 HA GLU 87 -0.664 11.043 -4.933 67 HB2 GLU 87 2HB GLU 87 2.201 11.139 -5.870 68 HB3 GLU 87 1HB GLU 87 0.816 11.052 -6.958 69 HG2 GLU 87 2HG GLU 87 -0.077 13.139 -6.021 70 HG3 GLU 87 1HG GLU 87 1.266 13.218 -4.881 71 H ALA 88 H ALA 88 2.327 9.159 -5.247 72 HA ALA 88 HA ALA 88 1.559 6.972 -6.622 73 HB1 ALA 88 1HB ALA 88 3.824 7.326 -5.665 74 HB2 ALA 88 2HB ALA 88 3.240 5.681 -5.423 75 HB3 ALA 88 3HB ALA 88 3.210 6.832 -4.086 76 H PHE 89 H PHE 89 1.213 7.172 -3.051 77 HA PHE 89 HA PHE 89 -0.245 4.762 -2.827 78 HB2 PHE 89 2HB PHE 89 0.255 7.100 -1.043 79 HB3 PHE 89 1HB PHE 89 -0.959 5.900 -0.563 80 HD1 PHE 89 1HD PHE 89 -0.223 3.387 -0.743 81 HD2 PHE 89 2HD PHE 89 2.518 6.684 -0.537 82 HE1 PHE 89 1HE PHE 89 1.565 1.857 0.012 83 HE2 PHE 89 2HE PHE 89 4.306 5.144 0.223 84 HZ PHE 89 HZ PHE 89 3.835 2.743 0.498 85 H ARG 90 H ARG 90 -1.296 8.149 -3.196 86 HA ARG 90 HA ARG 90 -4.054 7.755 -2.780 87 HB2 ARG 90 2HB ARG 90 -2.394 9.762 -4.163 88 HB3 ARG 90 1HB ARG 90 -4.082 9.725 -4.629 89 HG2 ARG 90 2HG ARG 90 -4.760 9.960 -2.288 90 HG3 ARG 90 1HG ARG 90 -3.081 9.939 -1.766 91 HD2 ARG 90 2HD ARG 90 -2.674 11.973 -3.106 92 HD3 ARG 90 1HD ARG 90 -4.369 12.003 -3.562 93 HE ARG 90 HE ARG 90 -4.206 11.942 -0.749 94 HH11 ARG 90 1HH2 ARG 90 -3.422 14.002 -3.415 95 HH12 ARG 90 2HH2 ARG 90 -3.642 15.471 -2.519 96 HH21 ARG 90 1HH1 ARG 90 -4.435 13.859 0.437 97 HH22 ARG 90 2HH1 ARG 90 -4.199 15.391 -0.342 98 H VAL 91 H VAL 91 -2.104 7.513 -5.738 99 HA VAL 91 HA VAL 91 -4.198 6.852 -7.515 100 HB VAL 91 HB VAL 91 -1.243 6.179 -7.589 101 HG11 VAL 91 1HG1 VAL 91 -2.355 4.636 -9.058 102 HG12 VAL 91 2HG1 VAL 91 -1.705 5.925 -10.072 103 HG13 VAL 91 3HG1 VAL 91 -3.423 5.899 -9.670 104 HG21 VAL 91 3HG2 VAL 91 -1.730 8.584 -7.600 105 HG22 VAL 91 1HG2 VAL 91 -2.906 8.356 -8.896 106 HG23 VAL 91 2HG2 VAL 91 -1.191 8.075 -9.203 107 H PHE 92 H PHE 92 -2.042 4.874 -5.530 108 HA PHE 92 HA PHE 92 -2.691 2.325 -6.414 109 HB2 PHE 92 2HB PHE 92 -1.779 3.468 -3.822 110 HB3 PHE 92 1HB PHE 92 -2.338 1.817 -3.781 111 HD1 PHE 92 1HD PHE 92 -0.615 3.611 -6.578 112 HD2 PHE 92 2HD PHE 92 -0.337 0.585 -3.545 113 HE1 PHE 92 1HE PHE 92 1.526 2.854 -7.541 114 HE2 PHE 92 2HE PHE 92 1.816 -0.175 -4.510 115 HZ PHE 92 HZ PHE 92 2.749 0.959 -6.508 116 H ASP 93 H ASP 93 -4.305 4.093 -3.737 117 HA ASP 93 HA ASP 93 -6.297 2.234 -3.177 118 HB2 ASP 93 2HB ASP 93 -5.838 4.444 -1.985 119 HB3 ASP 93 1HB ASP 93 -6.760 5.226 -3.265 120 H LYS 94 H LYS 94 -6.856 1.227 -5.178 121 HA LYS 94 HA LYS 94 -7.738 2.423 -7.515 122 HB2 LYS 94 2HB LYS 94 -8.594 -0.152 -6.190 123 HB3 LYS 94 1HB LYS 94 -9.072 0.305 -7.821 124 HG2 LYS 94 2HG LYS 94 -6.762 0.353 -8.561 125 HG3 LYS 94 1HG LYS 94 -6.182 0.138 -6.913 126 HD2 LYS 94 2HD LYS 94 -6.032 -2.043 -7.752 127 HD3 LYS 94 1HD LYS 94 -7.601 -2.079 -6.975 128 HE2 LYS 94 2HE LYS 94 -8.568 -1.398 -9.262 129 HE3 LYS 94 1HE LYS 94 -6.991 -1.806 -9.917 130 HZ1 LYS 94 3HZ LYS 94 -7.520 -3.937 -9.841 131 HZ2 LYS 94 1HZ LYS 94 -9.078 -3.532 -9.308 132 HZ3 LYS 94 2HZ LYS 94 -7.850 -3.844 -8.177 133 H ASP 95 H ASP 95 -9.775 1.195 -4.879 134 HA ASP 95 HA ASP 95 -12.208 2.321 -5.812 135 HB2 ASP 95 2HB ASP 95 -11.292 1.312 -3.114 136 HB3 ASP 95 1HB ASP 95 -12.942 1.853 -3.423 137 H GLY 96 H GLY 96 -9.685 4.054 -5.285 138 HA2 GLY 96 2HA GLY 96 -9.123 6.044 -4.157 139 HA3 GLY 96 1HA GLY 96 -10.522 6.526 -5.108 140 H ASN 97 H ASN 97 -10.323 4.484 -2.173 141 HA ASN 97 HA ASN 97 -12.422 6.154 -0.968 142 HB2 ASN 97 2HB ASN 97 -12.772 4.376 0.587 143 HB3 ASN 97 1HB ASN 97 -12.631 3.648 -1.011 144 HD21 ASN 97 1HD2 ASN 97 -12.171 1.994 1.163 145 HD22 ASN 97 2HD2 ASN 97 -10.515 1.650 1.308 146 H GLY 98 H GLY 98 -9.277 6.560 -1.138 147 HA2 GLY 98 2HA GLY 98 -7.771 7.795 0.131 148 HA3 GLY 98 1HA GLY 98 -9.095 8.135 1.241 149 H TYR 99 H TYR 99 -7.947 4.930 0.375 150 HA TYR 99 HA TYR 99 -6.364 4.595 2.758 151 HB2 TYR 99 2HB TYR 99 -9.095 3.327 2.529 152 HB3 TYR 99 1HB TYR 99 -7.835 2.709 3.587 153 HD1 TYR 99 2HD TYR 99 -6.707 4.457 5.199 154 HD2 TYR 99 1HD TYR 99 -10.514 5.031 3.302 155 HE1 TYR 99 2HE TYR 99 -7.289 6.176 6.888 156 HE2 TYR 99 1HE TYR 99 -11.098 6.754 4.990 157 HH TYR 99 HH TYR 99 -10.460 7.390 7.260 158 H ILE 100 H ILE 100 -5.676 2.181 2.934 159 HA ILE 100 HA ILE 100 -5.370 1.123 0.166 160 HB ILE 100 HB ILE 100 -3.407 0.967 2.454 161 HG12 ILE 100 2HG1 ILE 100 -3.621 3.274 1.621 162 HG13 ILE 100 1HG1 ILE 100 -2.090 2.589 1.095 163 HG21 ILE 100 1HG2 ILE 100 -3.418 -0.012 -0.392 164 HG22 ILE 100 2HG2 ILE 100 -2.959 -0.880 1.074 165 HG23 ILE 100 3HG2 ILE 100 -1.900 0.369 0.413 166 HD11 ILE 100 3HD1 ILE 100 -2.811 3.483 -0.902 167 HD12 ILE 100 1HD1 ILE 100 -4.500 3.201 -0.537 168 HD13 ILE 100 2HD1 ILE 100 -3.482 1.871 -1.049 169 H SER 101 H SER 101 -6.479 -0.691 -0.127 170 HA SER 101 HA SER 101 -6.778 -2.594 2.115 171 HB2 SER 101 2HB SER 101 -8.894 -2.292 1.206 172 HB3 SER 101 1HB SER 101 -8.279 -2.151 -0.439 173 HG SER 101 HG SER 101 -7.989 -4.519 1.071 174 H ALA 102 H ALA 102 -6.478 -4.870 1.666 175 HA ALA 102 HA ALA 102 -3.979 -5.428 0.505 176 HB1 ALA 102 1HB ALA 102 -5.976 -7.621 0.940 177 HB2 ALA 102 2HB ALA 102 -5.430 -6.703 2.330 178 HB3 ALA 102 3HB ALA 102 -4.259 -7.576 1.343 179 H ALA 103 H ALA 103 -7.260 -5.862 -0.726 180 HA ALA 103 HA ALA 103 -6.624 -7.441 -2.943 181 HB1 ALA 103 1HB ALA 103 -8.802 -6.575 -3.854 182 HB2 ALA 103 2HB ALA 103 -8.879 -5.492 -2.463 183 HB3 ALA 103 3HB ALA 103 -8.903 -7.239 -2.222 184 H GLU 104 H GLU 104 -6.572 -3.926 -2.524 185 HA GLU 104 HA GLU 104 -6.291 -3.265 -5.257 186 HB2 GLU 104 2HB GLU 104 -5.299 -1.753 -2.813 187 HB3 GLU 104 1HB GLU 104 -5.570 -1.084 -4.427 188 HG2 GLU 104 2HG GLU 104 -7.956 -1.615 -4.280 189 HG3 GLU 104 1HG GLU 104 -7.703 -2.358 -2.697 190 H LEU 105 H LEU 105 -3.932 -4.060 -2.719 191 HA LEU 105 HA LEU 105 -1.621 -3.271 -4.150 192 HB2 LEU 105 2HB LEU 105 -1.819 -5.468 -2.096 193 HB3 LEU 105 1HB LEU 105 -0.390 -4.533 -2.516 194 HG LEU 105 HG LEU 105 -2.917 -3.420 -1.284 195 HD11 LEU 105 1HD1 LEU 105 -1.431 -4.832 0.206 196 HD12 LEU 105 2HD1 LEU 105 -1.646 -3.178 0.730 197 HD13 LEU 105 3HD1 LEU 105 -0.159 -3.649 -0.074 198 HD21 LEU 105 3HD2 LEU 105 -1.301 -1.413 -0.971 199 HD22 LEU 105 1HD2 LEU 105 -2.019 -1.662 -2.556 200 HD23 LEU 105 2HD2 LEU 105 -0.357 -2.171 -2.250 201 H ARG 106 H ARG 106 -2.967 -6.541 -3.669 202 HA ARG 106 HA ARG 106 -1.161 -7.871 -5.332 203 HB2 ARG 106 2HB ARG 106 -2.811 -9.688 -5.435 204 HB3 ARG 106 1HB ARG 106 -2.678 -9.058 -3.798 205 HG2 ARG 106 2HG ARG 106 -4.687 -7.638 -4.257 206 HG3 ARG 106 1HG ARG 106 -4.870 -8.465 -5.803 207 HD2 ARG 106 2HD ARG 106 -4.980 -10.635 -4.581 208 HD3 ARG 106 1HD ARG 106 -4.922 -9.738 -3.066 209 HE ARG 106 HE ARG 106 -7.131 -9.068 -3.405 210 HH11 ARG 106 1HH2 ARG 106 -5.856 -10.725 -6.162 211 HH12 ARG 106 2HH2 ARG 106 -7.391 -10.847 -6.955 212 HH21 ARG 106 1HH1 ARG 106 -9.116 -9.237 -4.419 213 HH22 ARG 106 2HH1 ARG 106 -9.242 -9.999 -5.969 214 H HIS 107 H HIS 107 -4.373 -6.551 -6.160 215 HA HIS 107 HA HIS 107 -4.291 -7.313 -8.868 216 HB2 HIS 107 2HB HIS 107 -6.305 -6.557 -7.485 217 HB3 HIS 107 1HB HIS 107 -5.754 -4.908 -7.762 218 HD1 HIS 107 1HD HIS 107 -5.237 -4.513 -10.552 219 HD2 HIS 107 2HD HIS 107 -8.102 -7.322 -9.417 220 HE1 HIS 107 1HE HIS 107 -6.746 -4.853 -12.561 221 HE2 HIS 107 2HE HIS 107 -8.492 -6.570 -11.885 222 H VAL 108 H VAL 108 -3.722 -4.107 -7.405 223 HA VAL 108 HA VAL 108 -2.982 -2.861 -9.802 224 HB VAL 108 HB VAL 108 -3.550 -1.777 -7.538 225 HG11 VAL 108 1HG1 VAL 108 -0.554 -1.910 -7.167 226 HG12 VAL 108 2HG1 VAL 108 -1.643 -3.044 -6.409 227 HG13 VAL 108 3HG1 VAL 108 -1.769 -1.347 -6.024 228 HG21 VAL 108 3HG2 VAL 108 -2.018 0.182 -8.065 229 HG22 VAL 108 1HG2 VAL 108 -2.986 -0.394 -9.421 230 HG23 VAL 108 2HG2 VAL 108 -1.282 -0.830 -9.307 231 H MET 109 H MET 109 -0.904 -4.312 -7.299 232 HA MET 109 HA MET 109 1.568 -3.783 -8.471 233 HB2 MET 109 2HB MET 109 0.650 -6.128 -6.796 234 HB3 MET 109 1HB MET 109 2.325 -5.848 -7.240 235 HG2 MET 109 2HG MET 109 0.668 -3.726 -5.863 236 HG3 MET 109 1HG MET 109 1.601 -4.926 -4.965 237 HE1 MET 109 3HE MET 109 2.794 -2.796 -3.829 238 HE2 MET 109 1HE MET 109 4.488 -2.794 -4.338 239 HE3 MET 109 2HE MET 109 3.659 -4.318 -4.026 240 H THR 110 H THR 110 -0.595 -6.582 -8.910 241 HA THR 110 HA THR 110 1.017 -7.926 -10.810 242 HB THR 110 HB THR 110 -1.984 -8.003 -10.399 243 HG1 THR 110 1HG THR 110 -1.468 -9.201 -8.776 244 HG21 THR 110 3HG2 THR 110 -0.099 -9.712 -12.030 245 HG22 THR 110 1HG2 THR 110 -1.562 -8.896 -12.574 246 HG23 THR 110 2HG2 THR 110 -1.677 -10.293 -11.504 247 H ASN 111 H ASN 111 -1.612 -5.585 -11.128 248 HA ASN 111 HA ASN 111 -1.755 -5.571 -13.952 249 HB2 ASN 111 2HB ASN 111 -3.488 -4.598 -12.493 250 HB3 ASN 111 1HB ASN 111 -2.369 -3.329 -12.012 251 HD21 ASN 111 1HD2 ASN 111 -4.854 -2.748 -13.338 252 HD22 ASN 111 2HD2 ASN 111 -4.495 -2.099 -14.867 253 H LEU 112 H LEU 112 0.154 -3.730 -11.651 254 HA LEU 112 HA LEU 112 1.323 -1.900 -13.415 255 HB2 LEU 112 2HB LEU 112 2.103 -3.060 -10.753 256 HB3 LEU 112 1HB LEU 112 3.233 -2.006 -11.597 257 HG LEU 112 HG LEU 112 0.364 -1.115 -11.254 258 HD11 LEU 112 1HD1 LEU 112 2.545 -1.104 -9.165 259 HD12 LEU 112 2HD1 LEU 112 0.882 -1.654 -9.003 260 HD13 LEU 112 3HD1 LEU 112 1.226 0.066 -9.139 261 HD21 LEU 112 3HD2 LEU 112 1.891 0.198 -12.689 262 HD22 LEU 112 1HD2 LEU 112 3.046 0.313 -11.365 263 HD23 LEU 112 2HD2 LEU 112 1.479 1.107 -11.242 264 H GLY 113 H GLY 113 2.183 -5.189 -12.520 265 HA2 GLY 113 2HA GLY 113 3.232 -6.357 -14.561 266 HA3 GLY 113 1HA GLY 113 4.473 -5.114 -14.418 267 H GLU 114 H GLU 114 3.611 -5.558 -11.339 268 HA GLU 114 HA GLU 114 5.789 -7.492 -10.859 269 HB2 GLU 114 2HB GLU 114 4.424 -5.460 -9.079 270 HB3 GLU 114 1HB GLU 114 5.631 -6.610 -8.509 271 HG2 GLU 114 2HG GLU 114 6.099 -4.659 -10.773 272 HG3 GLU 114 1HG GLU 114 6.589 -4.363 -9.106 273 H LYS 115 H LYS 115 4.862 -9.488 -11.086 274 HA LYS 115 HA LYS 115 2.307 -10.148 -9.968 275 HB2 LYS 115 2HB LYS 115 4.519 -11.906 -11.050 276 HB3 LYS 115 1HB LYS 115 2.903 -12.469 -10.622 277 HG2 LYS 115 2HG LYS 115 1.967 -10.787 -12.251 278 HG3 LYS 115 1HG LYS 115 3.617 -10.438 -12.759 279 HD2 LYS 115 2HD LYS 115 2.285 -13.164 -12.881 280 HD3 LYS 115 1HD LYS 115 2.551 -12.093 -14.259 281 HE2 LYS 115 2HE LYS 115 4.428 -13.459 -14.420 282 HE3 LYS 115 1HE LYS 115 5.076 -12.171 -13.406 283 HZ1 LYS 115 3HZ LYS 115 3.924 -13.814 -11.607 284 HZ2 LYS 115 1HZ LYS 115 5.571 -13.827 -12.012 285 HZ3 LYS 115 2HZ LYS 115 4.506 -14.922 -12.755 286 H LEU 116 H LEU 116 2.669 -9.437 -7.758 287 HA LEU 116 HA LEU 116 4.562 -10.796 -6.062 288 HB2 LEU 116 2HB LEU 116 2.393 -8.770 -5.727 289 HB3 LEU 116 1HB LEU 116 2.829 -9.689 -4.291 290 HG LEU 116 HG LEU 116 5.208 -9.054 -4.633 291 HD11 LEU 116 1HD1 LEU 116 4.026 -7.395 -6.873 292 HD12 LEU 116 2HD1 LEU 116 5.224 -8.676 -7.026 293 HD13 LEU 116 3HD1 LEU 116 5.647 -7.163 -6.223 294 HD21 LEU 116 3HD2 LEU 116 4.865 -6.604 -4.086 295 HD22 LEU 116 1HD2 LEU 116 3.913 -7.719 -3.103 296 HD23 LEU 116 2HD2 LEU 116 3.149 -6.839 -4.428 297 H THR 117 H THR 117 3.255 -11.539 -3.822 298 HA THR 117 HA THR 117 1.491 -13.760 -4.724 299 HB THR 117 HB THR 117 2.260 -14.839 -2.550 300 HG1 THR 117 1HG THR 117 4.228 -12.819 -2.807 301 HG21 THR 117 3HG2 THR 117 3.111 -15.515 -4.773 302 HG22 THR 117 1HG2 THR 117 4.368 -15.625 -3.540 303 HG23 THR 117 2HG2 THR 117 4.353 -14.269 -4.669 304 H ASP 118 H ASP 118 -0.534 -13.812 -3.962 305 HA ASP 118 HA ASP 118 -1.696 -11.699 -2.559 306 HB2 ASP 118 2HB ASP 118 -2.592 -14.547 -2.979 307 HB3 ASP 118 1HB ASP 118 -3.594 -13.348 -2.163 308 H GLU 119 H GLU 119 -0.401 -14.772 -1.405 309 HA GLU 119 HA GLU 119 -1.322 -14.642 1.253 310 HB2 GLU 119 2HB GLU 119 1.174 -15.946 0.114 311 HB3 GLU 119 1HB GLU 119 0.538 -16.235 1.733 312 HG2 GLU 119 2HG GLU 119 -1.563 -17.077 0.796 313 HG3 GLU 119 1HG GLU 119 -1.002 -16.710 -0.834 314 H GLU 120 H GLU 120 1.545 -13.282 -0.310 315 HA GLU 120 HA GLU 120 2.696 -12.314 2.154 316 HB2 GLU 120 2HB GLU 120 3.265 -11.655 -0.745 317 HB3 GLU 120 1HB GLU 120 4.171 -10.981 0.609 318 HG2 GLU 120 2HG GLU 120 4.819 -13.242 1.328 319 HG3 GLU 120 1HG GLU 120 3.871 -13.947 0.017 320 H VAL 121 H VAL 121 0.806 -10.931 -0.499 321 HA VAL 121 HA VAL 121 0.745 -8.252 0.306 322 HB VAL 121 HB VAL 121 -1.290 -9.962 -1.127 323 HG11 VAL 121 1HG1 VAL 121 -1.384 -7.037 -0.451 324 HG12 VAL 121 2HG1 VAL 121 -2.619 -8.253 -0.158 325 HG13 VAL 121 3HG1 VAL 121 -2.290 -7.718 -1.802 326 HG21 VAL 121 3HG2 VAL 121 0.795 -9.512 -2.344 327 HG22 VAL 121 1HG2 VAL 121 0.627 -7.788 -2.020 328 HG23 VAL 121 2HG2 VAL 121 -0.524 -8.602 -3.072 329 H ASP 122 H ASP 122 -1.824 -10.656 0.854 330 HA ASP 122 HA ASP 122 -3.386 -9.329 2.672 331 HB2 ASP 122 2HB ASP 122 -3.935 -11.534 1.749 332 HB3 ASP 122 1HB ASP 122 -2.625 -12.270 2.672 333 H GLU 123 H GLU 123 -0.403 -11.181 3.351 334 HA GLU 123 HA GLU 123 -0.505 -10.737 6.171 335 HB2 GLU 123 2HB GLU 123 0.764 -12.593 5.095 336 HB3 GLU 123 1HB GLU 123 1.917 -11.402 4.494 337 HG2 GLU 123 2HG GLU 123 2.838 -12.276 6.535 338 HG3 GLU 123 1HG GLU 123 2.241 -10.664 6.910 339 H MET 124 H MET 124 0.931 -9.028 3.439 340 HA MET 124 HA MET 124 2.728 -7.326 4.642 341 HB2 MET 124 2HB MET 124 2.077 -7.539 2.157 342 HB3 MET 124 1HB MET 124 0.794 -6.389 2.519 343 HG2 MET 124 2HG MET 124 2.471 -4.773 3.344 344 HG3 MET 124 1HG MET 124 3.756 -5.920 2.964 345 HE1 MET 124 3HE MET 124 3.942 -7.051 0.630 346 HE2 MET 124 1HE MET 124 5.072 -5.711 0.863 347 HE3 MET 124 2HE MET 124 4.250 -5.915 -0.681 348 H ILE 125 H ILE 125 -0.580 -6.292 3.824 349 HA ILE 125 HA ILE 125 -0.613 -3.994 5.389 350 HB ILE 125 HB ILE 125 -2.801 -5.838 4.428 351 HG12 ILE 125 2HG1 ILE 125 -2.062 -2.967 3.776 352 HG13 ILE 125 1HG1 ILE 125 -1.636 -4.370 2.798 353 HG21 ILE 125 1HG2 ILE 125 -3.043 -3.413 6.196 354 HG22 ILE 125 2HG2 ILE 125 -3.776 -4.988 6.426 355 HG23 ILE 125 3HG2 ILE 125 -4.381 -3.916 5.179 356 HD11 ILE 125 3HD1 ILE 125 -4.163 -4.866 2.761 357 HD12 ILE 125 1HD1 ILE 125 -3.616 -3.516 1.782 358 HD13 ILE 125 2HD1 ILE 125 -4.372 -3.223 3.341 359 H ARG 126 H ARG 126 -1.604 -7.289 6.253 360 HA ARG 126 HA ARG 126 -2.625 -6.841 8.769 361 HB2 ARG 126 2HB ARG 126 -1.046 -9.156 7.682 362 HB3 ARG 126 1HB ARG 126 -1.822 -9.207 9.252 363 HG2 ARG 126 2HG ARG 126 -3.433 -8.392 6.837 364 HG3 ARG 126 1HG ARG 126 -3.115 -10.101 7.118 365 HD2 ARG 126 2HD ARG 126 -4.135 -9.975 9.320 366 HD3 ARG 126 1HD ARG 126 -4.341 -8.241 9.183 367 HE ARG 126 HE ARG 126 -5.645 -9.388 7.000 368 HH11 ARG 126 1HH2 ARG 126 -5.748 -9.386 10.440 369 HH12 ARG 126 2HH2 ARG 126 -7.461 -9.630 10.536 370 HH21 ARG 126 1HH1 ARG 126 -7.881 -9.748 7.090 371 HH22 ARG 126 2HH1 ARG 126 -8.677 -9.841 8.627 372 H GLU 127 H GLU 127 0.797 -7.253 7.883 373 HA GLU 127 HA GLU 127 1.630 -6.985 10.644 374 HB2 GLU 127 2HB GLU 127 3.208 -7.072 8.063 375 HB3 GLU 127 1HB GLU 127 3.931 -7.023 9.671 376 HG2 GLU 127 2HG GLU 127 1.989 -9.162 8.744 377 HG3 GLU 127 1HG GLU 127 3.742 -9.348 8.738 378 H ALA 128 H ALA 128 1.700 -4.955 7.728 379 HA ALA 128 HA ALA 128 3.063 -2.750 8.883 380 HB1 ALA 128 1HB ALA 128 1.075 -2.861 6.596 381 HB2 ALA 128 2HB ALA 128 2.828 -2.978 6.469 382 HB3 ALA 128 3HB ALA 128 2.085 -1.466 6.983 383 H ASP 129 H ASP 129 -0.425 -3.221 8.281 384 HA ASP 129 HA ASP 129 -1.479 -0.948 9.375 385 HB2 ASP 129 2HB ASP 129 -2.803 -2.780 8.359 386 HB3 ASP 129 1HB ASP 129 -2.562 -3.745 9.803 387 H ILE 130 H ILE 130 -1.633 -0.041 11.346 388 HA ILE 130 HA ILE 130 -0.365 -1.423 13.615 389 HB ILE 130 HB ILE 130 -1.336 1.442 13.395 390 HG12 ILE 130 2HG1 ILE 130 1.411 0.225 13.075 391 HG13 ILE 130 1HG1 ILE 130 0.461 0.962 11.795 392 HG21 ILE 130 1HG2 ILE 130 0.532 0.094 15.381 393 HG22 ILE 130 2HG2 ILE 130 -1.143 0.520 15.724 394 HG23 ILE 130 3HG2 ILE 130 0.033 1.781 15.408 395 HD11 ILE 130 3HD1 ILE 130 1.606 2.342 14.235 396 HD12 ILE 130 1HD1 ILE 130 0.443 3.097 13.146 397 HD13 ILE 130 2HD1 ILE 130 2.038 2.628 12.552 398 H ASP 131 H ASP 131 -3.474 -0.333 12.503 399 HA ASP 131 HA ASP 131 -4.755 -0.877 15.106 400 HB2 ASP 131 2HB ASP 131 -5.257 1.183 13.665 401 HB3 ASP 131 1HB ASP 131 -6.111 0.079 12.587 402 H GLY 132 H GLY 132 -3.899 -2.556 12.367 403 HA2 GLY 132 2HA GLY 132 -4.646 -4.482 11.330 404 HA3 GLY 132 1HA GLY 132 -5.009 -4.982 12.980 405 H ASP 133 H ASP 133 -6.348 -2.901 10.412 406 HA ASP 133 HA ASP 133 -9.061 -3.960 11.033 407 HB2 ASP 133 2HB ASP 133 -9.946 -1.750 10.472 408 HB3 ASP 133 1HB ASP 133 -8.791 -1.634 11.799 409 H GLY 134 H GLY 134 -6.754 -2.891 8.604 410 HA2 GLY 134 2HA GLY 134 -6.808 -4.241 6.509 411 HA3 GLY 134 1HA GLY 134 -8.540 -3.946 6.470 412 H GLN 135 H GLN 135 -7.269 -1.165 7.649 413 HA GLN 135 HA GLN 135 -6.909 0.012 4.928 414 HB2 GLN 135 2HB GLN 135 -8.205 1.317 7.335 415 HB3 GLN 135 1HB GLN 135 -7.991 2.041 5.751 416 HG2 GLN 135 2HG GLN 135 -9.629 -0.439 6.346 417 HG3 GLN 135 1HG GLN 135 -10.280 1.159 6.000 418 HE21 GLN 135 1HE2 GLN 135 -9.232 -1.786 4.559 419 HE22 GLN 135 2HE2 GLN 135 -9.270 -1.266 2.942 420 H VAL 136 H VAL 136 -4.894 0.602 4.628 421 HA VAL 136 HA VAL 136 -3.331 1.535 6.998 422 HB VAL 136 HB VAL 136 -2.232 0.562 4.355 423 HG11 VAL 136 1HG1 VAL 136 -0.133 0.461 5.567 424 HG12 VAL 136 2HG1 VAL 136 -0.950 0.931 7.054 425 HG13 VAL 136 3HG1 VAL 136 -0.811 2.081 5.725 426 HG21 VAL 136 3HG2 VAL 136 -1.673 -1.513 5.565 427 HG22 VAL 136 1HG2 VAL 136 -3.418 -1.265 5.467 428 HG23 VAL 136 2HG2 VAL 136 -2.557 -0.918 6.969 429 H ASN 137 H ASN 137 -2.744 3.569 7.096 430 HA ASN 137 HA ASN 137 -3.546 5.473 5.111 431 HB2 ASN 137 2HB ASN 137 -1.587 5.810 7.397 432 HB3 ASN 137 1HB ASN 137 -2.387 7.109 6.513 433 HD21 ASN 137 1HD2 ASN 137 -2.888 4.549 8.903 434 HD22 ASN 137 2HD2 ASN 137 -4.437 5.057 9.376 435 H TYR 138 H TYR 138 -1.124 7.128 5.243 436 HA TYR 138 HA TYR 138 0.285 5.965 2.976 437 HB2 TYR 138 2HB TYR 138 0.871 8.611 4.306 438 HB3 TYR 138 1HB TYR 138 1.193 8.128 2.639 439 HD1 TYR 138 2HD TYR 138 -0.867 7.449 1.198 440 HD2 TYR 138 1HD TYR 138 -1.132 9.752 4.814 441 HE1 TYR 138 2HE TYR 138 -3.108 8.275 0.509 442 HE2 TYR 138 1HE TYR 138 -3.370 10.577 4.125 443 HH TYR 138 HH TYR 138 -5.270 9.617 2.529 444 H GLU 139 H GLU 139 1.267 7.302 6.161 445 HA GLU 139 HA GLU 139 3.953 6.503 5.989 446 HB2 GLU 139 2HB GLU 139 2.268 7.006 8.431 447 HB3 GLU 139 1HB GLU 139 4.023 6.881 8.422 448 HG2 GLU 139 2HG GLU 139 3.741 9.195 8.230 449 HG3 GLU 139 1HG GLU 139 3.885 8.735 6.540 450 H GLU 140 H GLU 140 1.529 5.107 8.183 451 HA GLU 140 HA GLU 140 2.640 2.852 9.109 452 HB2 GLU 140 2HB GLU 140 -0.078 3.035 7.771 453 HB3 GLU 140 1HB GLU 140 0.444 1.662 8.747 454 HG2 GLU 140 2HG GLU 140 0.683 3.070 10.692 455 HG3 GLU 140 1HG GLU 140 0.341 4.512 9.761 456 H PHE 141 H PHE 141 1.839 3.457 5.747 457 HA PHE 141 HA PHE 141 2.561 0.752 4.920 458 HB2 PHE 141 2HB PHE 141 0.680 2.310 3.939 459 HB3 PHE 141 1HB PHE 141 2.000 3.024 3.021 460 HD1 PHE 141 2HD PHE 141 3.706 1.088 2.057 461 HD2 PHE 141 1HD PHE 141 -0.484 0.617 2.832 462 HE1 PHE 141 2HE PHE 141 3.628 -0.793 0.463 463 HE2 PHE 141 1HE PHE 141 -0.561 -1.257 1.240 464 HZ PHE 141 HZ PHE 141 1.488 -1.973 0.044 465 H VAL 142 H VAL 142 3.634 4.086 4.125 466 HA VAL 142 HA VAL 142 5.724 3.790 2.526 467 HB VAL 142 HB VAL 142 5.639 5.377 5.072 468 HG11 VAL 142 1HG1 VAL 142 7.969 5.149 4.702 469 HG12 VAL 142 2HG1 VAL 142 7.540 6.698 3.979 470 HG13 VAL 142 3HG1 VAL 142 7.771 5.281 2.955 471 HG21 VAL 142 3HG2 VAL 142 5.691 6.556 2.313 472 HG22 VAL 142 1HG2 VAL 142 4.816 7.112 3.740 473 HG23 VAL 142 2HG2 VAL 142 4.213 5.749 2.797 474 H GLN 143 H GLN 143 6.172 3.420 6.056 475 HA GLN 143 HA GLN 143 8.755 2.540 6.179 476 HB2 GLN 143 2HB GLN 143 6.374 1.426 7.685 477 HB3 GLN 143 1HB GLN 143 8.054 1.153 8.144 478 HG2 GLN 143 2HG GLN 143 6.750 3.885 7.887 479 HG3 GLN 143 1HG GLN 143 7.010 3.035 9.409 480 HE21 GLN 143 1HE2 GLN 143 8.322 5.489 7.670 481 HE22 GLN 143 2HE2 GLN 143 9.960 5.305 8.084 482 H MET 144 H MET 144 6.123 0.128 6.158 483 HA MET 144 HA MET 144 7.557 -2.123 5.569 484 HB2 MET 144 2HB MET 144 5.070 -1.997 5.951 485 HB3 MET 144 1HB MET 144 4.896 -1.474 4.277 486 HG2 MET 144 2HG MET 144 4.539 -3.859 4.342 487 HG3 MET 144 1HG MET 144 6.091 -3.571 3.567 488 HE1 MET 144 3HE MET 144 5.250 -6.232 6.992 489 HE2 MET 144 1HE MET 144 4.598 -6.064 5.357 490 HE3 MET 144 2HE MET 144 4.171 -4.896 6.605 491 H MET 145 H MET 145 6.196 0.124 3.133 492 HA MET 145 HA MET 145 7.198 -1.161 0.851 493 HB2 MET 145 2HB MET 145 5.509 0.584 0.716 494 HB3 MET 145 1HB MET 145 6.652 1.773 1.325 495 HG2 MET 145 2HG MET 145 8.032 1.550 -0.642 496 HG3 MET 145 1HG MET 145 7.084 0.180 -1.213 497 HE1 MET 145 3HE MET 145 6.282 3.805 0.269 498 HE2 MET 145 1HE MET 145 6.100 4.635 -1.281 499 HE3 MET 145 2HE MET 145 7.612 3.827 -0.879 500 H THR 146 H THR 146 9.087 -0.994 -0.313 501 HA THR 146 HA THR 146 11.354 0.342 1.070 502 HB THR 146 HB THR 146 12.797 -1.257 -0.074 503 HG1 THR 146 1HG THR 146 11.396 -1.502 -1.908 504 HG21 THR 146 3HG2 THR 146 10.474 -2.717 1.200 505 HG22 THR 146 1HG2 THR 146 11.685 -1.823 2.120 506 HG23 THR 146 2HG2 THR 146 12.163 -3.223 1.160 507 H ALA 147 H ALA 147 9.302 0.657 -1.537 508 HA ALA 147 HA ALA 147 11.029 1.521 -3.604 509 HB1 ALA 147 1HB ALA 147 8.676 0.929 -3.992 510 HB2 ALA 147 2HB ALA 147 8.992 2.576 -4.537 511 HB3 ALA 147 3HB ALA 147 8.160 2.296 -3.008 512 H LYS 148 H LYS 148 11.572 3.672 -4.269 513 HA LYS 148 HA LYS 148 12.377 5.401 -2.196 514 HB2 LYS 148 2HB LYS 148 13.433 5.344 -4.432 515 HB3 LYS 148 1HB LYS 148 11.964 6.001 -5.145 516 HG2 LYS 148 2HG LYS 148 12.211 8.040 -3.754 517 HG3 LYS 148 1HG LYS 148 13.693 7.385 -3.061 518 HD2 LYS 148 2HD LYS 148 13.473 7.581 -6.064 519 HD3 LYS 148 1HD LYS 148 13.798 9.047 -5.141 520 HE2 LYS 148 2HE LYS 148 15.428 6.558 -4.667 521 HE3 LYS 148 1HE LYS 148 15.828 7.659 -5.981 522 HZ1 LYS 148 3HZ LYS 148 17.061 8.395 -4.148 523 HZ2 LYS 148 1HZ LYS 148 15.757 8.224 -3.075 524 HZ3 LYS 148 2HZ LYS 148 15.751 9.468 -4.237 Start of MODEL 11 1 H1 ASP 78 1HT ASP 78 15.234 16.437 -0.792 2 H2 ASP 78 2HT ASP 78 15.268 16.842 0.858 3 H3 ASP 78 3HT ASP 78 14.278 17.711 -0.215 4 HA ASP 78 HA ASP 78 13.336 15.269 -0.635 5 HB2 ASP 78 2HB ASP 78 14.356 15.393 2.215 6 HB3 ASP 78 1HB ASP 78 13.111 14.266 1.681 7 H THR 79 H THR 79 12.304 17.651 -0.993 8 HA THR 79 HA THR 79 10.472 18.283 1.239 9 HB THR 79 HB THR 79 10.942 19.802 -1.337 10 HG1 THR 79 1HG THR 79 12.251 19.708 1.094 11 HG21 THR 79 3HG2 THR 79 9.503 20.446 1.248 12 HG22 THR 79 1HG2 THR 79 8.792 20.322 -0.361 13 HG23 THR 79 2HG2 THR 79 9.890 21.648 0.019 14 H ASP 80 H ASP 80 10.267 18.036 -2.332 15 HA ASP 80 HA ASP 80 7.429 17.545 -2.239 16 HB2 ASP 80 2HB ASP 80 8.703 18.704 -4.121 17 HB3 ASP 80 1HB ASP 80 9.264 17.102 -4.596 18 H SER 81 H SER 81 10.190 15.630 -1.851 19 HA SER 81 HA SER 81 9.462 13.194 -3.048 20 HB2 SER 81 2HB SER 81 11.059 13.761 -0.547 21 HB3 SER 81 1HB SER 81 10.922 12.166 -1.281 22 HG SER 81 HG SER 81 12.305 12.769 -2.736 23 H GLU 82 H GLU 82 9.040 14.215 0.338 24 HA GLU 82 HA GLU 82 7.586 12.049 1.242 25 HB2 GLU 82 2HB GLU 82 8.511 14.133 2.498 26 HB3 GLU 82 1HB GLU 82 6.943 14.851 2.141 27 HG2 GLU 82 2HG GLU 82 6.609 13.859 4.250 28 HG3 GLU 82 1HG GLU 82 5.952 12.661 3.134 29 H GLU 83 H GLU 83 6.508 14.883 -0.541 30 HA GLU 83 HA GLU 83 3.728 14.393 -0.258 31 HB2 GLU 83 2HB GLU 83 5.343 16.030 -2.209 32 HB3 GLU 83 1HB GLU 83 3.580 15.995 -2.204 33 HG2 GLU 83 2HG GLU 83 3.529 16.759 0.115 34 HG3 GLU 83 1HG GLU 83 5.290 16.703 0.196 35 H GLU 84 H GLU 84 5.951 13.743 -3.015 36 HA GLU 84 HA GLU 84 4.122 12.612 -4.756 37 HB2 GLU 84 2HB GLU 84 6.540 12.966 -5.279 38 HB3 GLU 84 1HB GLU 84 6.931 11.569 -4.278 39 HG2 GLU 84 2HG GLU 84 6.829 10.802 -6.563 40 HG3 GLU 84 1HG GLU 84 5.385 10.197 -5.759 41 H ILE 85 H ILE 85 5.723 11.174 -1.965 42 HA ILE 85 HA ILE 85 4.833 8.521 -2.313 43 HB ILE 85 HB ILE 85 5.488 10.085 0.199 44 HG12 ILE 85 2HG1 ILE 85 7.123 8.008 -1.282 45 HG13 ILE 85 1HG1 ILE 85 7.322 9.743 -1.535 46 HG21 ILE 85 1HG2 ILE 85 5.050 7.137 -0.270 47 HG22 ILE 85 2HG2 ILE 85 4.138 8.179 0.823 48 HG23 ILE 85 3HG2 ILE 85 5.817 7.794 1.162 49 HD11 ILE 85 3HD1 ILE 85 8.937 9.365 0.092 50 HD12 ILE 85 1HD1 ILE 85 8.023 8.071 0.851 51 HD13 ILE 85 2HD1 ILE 85 7.565 9.749 1.129 52 H ARG 86 H ARG 86 3.515 11.278 -0.504 53 HA ARG 86 HA ARG 86 1.259 9.996 0.562 54 HB2 ARG 86 2HB ARG 86 1.807 12.885 -0.146 55 HB3 ARG 86 1HB ARG 86 0.316 12.371 0.646 56 HG2 ARG 86 2HG ARG 86 1.585 11.422 2.506 57 HG3 ARG 86 1HG ARG 86 3.105 11.801 1.702 58 HD2 ARG 86 2HD ARG 86 2.580 14.207 1.834 59 HD3 ARG 86 1HD ARG 86 1.046 13.838 2.618 60 HE ARG 86 HE ARG 86 3.335 12.729 3.994 61 HH11 ARG 86 1HH2 ARG 86 1.293 15.491 3.558 62 HH12 ARG 86 2HH2 ARG 86 1.677 16.183 5.098 63 HH21 ARG 86 1HH1 ARG 86 3.832 13.639 6.016 64 HH22 ARG 86 2HH1 ARG 86 3.112 15.144 6.480 65 H GLU 87 H GLU 87 1.827 11.478 -2.557 66 HA GLU 87 HA GLU 87 -0.918 11.295 -3.427 67 HB2 GLU 87 2HB GLU 87 1.661 11.708 -4.951 68 HB3 GLU 87 1HB GLU 87 0.060 11.729 -5.694 69 HG2 GLU 87 2HG GLU 87 -0.627 13.582 -4.275 70 HG3 GLU 87 1HG GLU 87 0.907 13.525 -3.406 71 H ALA 88 H ALA 88 1.951 9.683 -4.798 72 HA ALA 88 HA ALA 88 0.884 7.758 -6.313 73 HB1 ALA 88 1HB ALA 88 3.335 8.016 -5.728 74 HB2 ALA 88 2HB ALA 88 2.768 6.354 -5.897 75 HB3 ALA 88 3HB ALA 88 3.019 7.041 -4.289 76 H PHE 89 H PHE 89 1.092 7.494 -2.765 77 HA PHE 89 HA PHE 89 -0.034 4.932 -2.612 78 HB2 PHE 89 2HB PHE 89 0.631 7.110 -0.759 79 HB3 PHE 89 1HB PHE 89 -0.613 6.000 -0.195 80 HD1 PHE 89 1HD PHE 89 -0.031 3.374 -0.715 81 HD2 PHE 89 2HD PHE 89 2.843 6.533 -0.338 82 HE1 PHE 89 1HE PHE 89 1.762 1.706 -0.292 83 HE2 PHE 89 2HE PHE 89 4.621 4.883 0.078 84 HZ PHE 89 HZ PHE 89 4.089 2.469 0.099 85 H ARG 90 H ARG 90 -1.591 8.077 -1.912 86 HA ARG 90 HA ARG 90 -4.123 7.066 -1.371 87 HB2 ARG 90 2HB ARG 90 -4.874 9.271 -1.408 88 HB3 ARG 90 1HB ARG 90 -3.146 9.461 -1.154 89 HG2 ARG 90 2HG ARG 90 -3.587 10.985 -2.864 90 HG3 ARG 90 1HG ARG 90 -2.961 9.583 -3.695 91 HD2 ARG 90 2HD ARG 90 -4.858 9.437 -4.931 92 HD3 ARG 90 1HD ARG 90 -5.832 9.305 -3.480 93 HE ARG 90 HE ARG 90 -5.213 11.983 -3.672 94 HH11 ARG 90 1HH2 ARG 90 -6.699 9.603 -5.701 95 HH12 ARG 90 2HH2 ARG 90 -7.725 10.741 -6.509 96 HH21 ARG 90 1HH1 ARG 90 -6.576 13.460 -4.680 97 HH22 ARG 90 2HH1 ARG 90 -7.666 12.933 -5.922 98 H VAL 91 H VAL 91 -2.744 7.924 -4.486 99 HA VAL 91 HA VAL 91 -5.148 7.294 -5.944 100 HB VAL 91 HB VAL 91 -3.473 8.950 -6.734 101 HG11 VAL 91 1HG1 VAL 91 -1.444 7.768 -6.029 102 HG12 VAL 91 2HG1 VAL 91 -1.380 8.148 -7.737 103 HG13 VAL 91 3HG1 VAL 91 -1.738 6.508 -7.216 104 HG21 VAL 91 3HG2 VAL 91 -3.601 8.353 -9.034 105 HG22 VAL 91 1HG2 VAL 91 -5.039 7.671 -8.276 106 HG23 VAL 91 2HG2 VAL 91 -3.664 6.632 -8.658 107 H PHE 92 H PHE 92 -2.496 5.550 -4.666 108 HA PHE 92 HA PHE 92 -2.190 3.443 -6.446 109 HB2 PHE 92 2HB PHE 92 -1.099 3.999 -4.078 110 HB3 PHE 92 1HB PHE 92 -2.221 2.796 -3.502 111 HD1 PHE 92 1HD PHE 92 0.154 3.359 -6.348 112 HD2 PHE 92 2HD PHE 92 -1.466 0.571 -3.512 113 HE1 PHE 92 1HE PHE 92 1.696 1.613 -7.187 114 HE2 PHE 92 2HE PHE 92 0.079 -1.177 -4.365 115 HZ PHE 92 HZ PHE 92 1.660 -0.656 -6.192 116 H ASP 93 H ASP 93 -4.487 3.724 -3.733 117 HA ASP 93 HA ASP 93 -5.684 1.248 -3.924 118 HB2 ASP 93 2HB ASP 93 -6.263 2.793 -2.155 119 HB3 ASP 93 1HB ASP 93 -6.960 3.920 -3.301 120 H LYS 94 H LYS 94 -6.226 0.312 -5.733 121 HA LYS 94 HA LYS 94 -6.752 1.305 -8.200 122 HB2 LYS 94 2HB LYS 94 -6.783 -1.172 -7.293 123 HB3 LYS 94 1HB LYS 94 -8.521 -0.924 -7.195 124 HG2 LYS 94 2HG LYS 94 -8.380 -1.731 -9.367 125 HG3 LYS 94 1HG LYS 94 -8.183 -0.011 -9.695 126 HD2 LYS 94 2HD LYS 94 -5.693 -0.337 -9.559 127 HD3 LYS 94 1HD LYS 94 -5.976 -2.071 -9.411 128 HE2 LYS 94 2HE LYS 94 -6.825 -0.321 -11.731 129 HE3 LYS 94 1HE LYS 94 -5.519 -1.501 -11.747 130 HZ1 LYS 94 3HZ LYS 94 -7.109 -2.867 -12.500 131 HZ2 LYS 94 1HZ LYS 94 -8.378 -1.912 -11.900 132 HZ3 LYS 94 2HZ LYS 94 -7.561 -2.984 -10.867 133 H ASP 95 H ASP 95 -9.111 0.912 -5.585 134 HA ASP 95 HA ASP 95 -11.289 2.014 -7.093 135 HB2 ASP 95 2HB ASP 95 -10.896 1.419 -4.156 136 HB3 ASP 95 1HB ASP 95 -12.410 2.012 -4.839 137 H GLY 96 H GLY 96 -8.747 3.259 -5.128 138 HA2 GLY 96 2HA GLY 96 -8.111 5.421 -4.590 139 HA3 GLY 96 1HA GLY 96 -9.182 5.940 -5.879 140 H ASN 97 H ASN 97 -9.669 4.461 -2.620 141 HA ASN 97 HA ASN 97 -11.783 6.493 -2.140 142 HB2 ASN 97 2HB ASN 97 -12.746 4.978 -0.558 143 HB3 ASN 97 1HB ASN 97 -12.449 4.093 -2.050 144 HD21 ASN 97 1HD2 ASN 97 -9.430 4.564 -0.661 145 HD22 ASN 97 2HD2 ASN 97 -9.317 3.116 0.215 146 H GLY 98 H GLY 98 -8.624 6.260 -1.548 147 HA2 GLY 98 2HA GLY 98 -7.352 7.588 -0.111 148 HA3 GLY 98 1HA GLY 98 -8.805 7.954 0.808 149 H TYR 99 H TYR 99 -8.061 4.646 0.127 150 HA TYR 99 HA TYR 99 -6.682 4.213 2.671 151 HB2 TYR 99 2HB TYR 99 -9.408 3.065 2.030 152 HB3 TYR 99 1HB TYR 99 -8.357 2.449 3.301 153 HD1 TYR 99 1HD TYR 99 -7.543 4.065 5.103 154 HD2 TYR 99 2HD TYR 99 -10.765 4.981 2.415 155 HE1 TYR 99 1HE TYR 99 -8.320 5.845 6.644 156 HE2 TYR 99 2HE TYR 99 -11.543 6.763 3.957 157 HH TYR 99 HH TYR 99 -9.971 7.285 7.102 158 H ILE 100 H ILE 100 -5.514 2.222 2.706 159 HA ILE 100 HA ILE 100 -5.314 0.928 0.035 160 HB ILE 100 HB ILE 100 -3.313 0.918 2.287 161 HG12 ILE 100 2HG1 ILE 100 -3.578 3.221 1.567 162 HG13 ILE 100 1HG1 ILE 100 -2.083 2.603 0.873 163 HG21 ILE 100 1HG2 ILE 100 -1.784 0.435 0.263 164 HG22 ILE 100 2HG2 ILE 100 -3.269 0.025 -0.584 165 HG23 ILE 100 3HG2 ILE 100 -2.802 -0.874 0.862 166 HD11 ILE 100 3HD1 ILE 100 -3.538 1.985 -1.182 167 HD12 ILE 100 1HD1 ILE 100 -3.067 3.668 -0.939 168 HD13 ILE 100 2HD1 ILE 100 -4.687 3.137 -0.500 169 H SER 101 H SER 101 -6.310 -0.980 -0.113 170 HA SER 101 HA SER 101 -6.415 -2.776 2.243 171 HB2 SER 101 2HB SER 101 -8.629 -2.442 1.516 172 HB3 SER 101 1HB SER 101 -8.166 -2.444 -0.180 173 HG SER 101 HG SER 101 -8.486 -4.583 1.604 174 H ALA 102 H ALA 102 -6.100 -5.054 1.796 175 HA ALA 102 HA ALA 102 -3.733 -5.597 0.399 176 HB1 ALA 102 1HB ALA 102 -4.681 -8.070 0.693 177 HB2 ALA 102 2HB ALA 102 -5.856 -7.236 1.704 178 HB3 ALA 102 3HB ALA 102 -4.140 -7.133 2.084 179 H ALA 103 H ALA 103 -7.110 -6.106 -0.592 180 HA ALA 103 HA ALA 103 -6.592 -7.640 -2.882 181 HB1 ALA 103 1HB ALA 103 -8.824 -6.918 -3.614 182 HB2 ALA 103 2HB ALA 103 -8.820 -5.661 -2.377 183 HB3 ALA 103 3HB ALA 103 -8.825 -7.360 -1.907 184 H GLU 104 H GLU 104 -6.527 -4.158 -2.346 185 HA GLU 104 HA GLU 104 -6.430 -3.400 -5.070 186 HB2 GLU 104 2HB GLU 104 -5.318 -1.944 -2.657 187 HB3 GLU 104 1HB GLU 104 -5.735 -1.239 -4.219 188 HG2 GLU 104 2HG GLU 104 -8.072 -1.764 -3.912 189 HG3 GLU 104 1HG GLU 104 -7.718 -2.684 -2.450 190 H LEU 105 H LEU 105 -3.918 -4.146 -2.660 191 HA LEU 105 HA LEU 105 -1.705 -3.285 -4.193 192 HB2 LEU 105 2HB LEU 105 -1.712 -5.539 -2.181 193 HB3 LEU 105 1HB LEU 105 -0.344 -4.534 -2.657 194 HG LEU 105 HG LEU 105 -2.839 -3.571 -1.255 195 HD11 LEU 105 1HD1 LEU 105 -1.386 -3.201 0.661 196 HD12 LEU 105 2HD1 LEU 105 0.008 -3.765 -0.252 197 HD13 LEU 105 3HD1 LEU 105 -1.281 -4.884 0.168 198 HD21 LEU 105 3HD2 LEU 105 -0.428 -2.152 -2.349 199 HD22 LEU 105 1HD2 LEU 105 -1.345 -1.473 -1.019 200 HD23 LEU 105 2HD2 LEU 105 -2.130 -1.746 -2.561 201 H ARG 106 H ARG 106 -3.084 -6.580 -3.808 202 HA ARG 106 HA ARG 106 -1.248 -7.768 -5.559 203 HB2 ARG 106 2HB ARG 106 -2.840 -9.644 -5.654 204 HB3 ARG 106 1HB ARG 106 -2.622 -9.078 -4.000 205 HG2 ARG 106 2HG ARG 106 -4.677 -7.692 -4.258 206 HG3 ARG 106 1HG ARG 106 -4.926 -8.411 -5.847 207 HD2 ARG 106 2HD ARG 106 -4.880 -10.667 -4.720 208 HD3 ARG 106 1HD ARG 106 -4.922 -9.810 -3.178 209 HE ARG 106 HE ARG 106 -7.026 -8.836 -4.765 210 HH11 ARG 106 1HH2 ARG 106 -5.995 -11.734 -3.194 211 HH12 ARG 106 2HH2 ARG 106 -7.600 -12.350 -2.976 212 HH21 ARG 106 1HH1 ARG 106 -9.134 -9.650 -4.502 213 HH22 ARG 106 2HH1 ARG 106 -9.373 -11.173 -3.715 214 H HIS 107 H HIS 107 -4.499 -6.385 -6.170 215 HA HIS 107 HA HIS 107 -4.609 -7.141 -8.885 216 HB2 HIS 107 2HB HIS 107 -6.016 -5.156 -7.125 217 HB3 HIS 107 1HB HIS 107 -6.249 -5.030 -8.867 218 HD1 HIS 107 1HD HIS 107 -7.482 -6.765 -5.953 219 HD2 HIS 107 2HD HIS 107 -7.163 -7.667 -10.008 220 HE1 HIS 107 1HE HIS 107 -9.085 -8.674 -6.386 221 HE2 HIS 107 2HE HIS 107 -8.899 -9.241 -8.856 222 H VAL 108 H VAL 108 -3.803 -3.961 -7.429 223 HA VAL 108 HA VAL 108 -3.157 -2.753 -9.886 224 HB VAL 108 HB VAL 108 -3.640 -1.611 -7.659 225 HG11 VAL 108 1HG1 VAL 108 -1.821 -2.997 -6.498 226 HG12 VAL 108 2HG1 VAL 108 -1.848 -1.276 -6.128 227 HG13 VAL 108 3HG1 VAL 108 -0.660 -1.917 -7.261 228 HG21 VAL 108 3HG2 VAL 108 -1.355 -0.821 -9.474 229 HG22 VAL 108 1HG2 VAL 108 -1.948 0.245 -8.201 230 HG23 VAL 108 2HG2 VAL 108 -3.020 -0.249 -9.512 231 H MET 109 H MET 109 -1.063 -4.308 -7.464 232 HA MET 109 HA MET 109 1.377 -3.804 -8.772 233 HB2 MET 109 2HB MET 109 0.588 -6.119 -6.999 234 HB3 MET 109 1HB MET 109 2.236 -5.763 -7.506 235 HG2 MET 109 2HG MET 109 0.560 -3.637 -6.176 236 HG3 MET 109 1HG MET 109 1.444 -4.822 -5.215 237 HE1 MET 109 3HE MET 109 4.313 -2.636 -4.577 238 HE2 MET 109 1HE MET 109 3.673 -4.264 -4.312 239 HE3 MET 109 2HE MET 109 2.643 -2.857 -4.065 240 H THR 110 H THR 110 -0.772 -6.650 -8.966 241 HA THR 110 HA THR 110 0.726 -8.012 -10.914 242 HB THR 110 HB THR 110 -2.247 -8.085 -10.325 243 HG1 THR 110 1HG THR 110 -0.732 -10.201 -9.593 244 HG21 THR 110 3HG2 THR 110 -1.848 -9.009 -12.533 245 HG22 THR 110 1HG2 THR 110 -2.091 -10.350 -11.412 246 HG23 THR 110 2HG2 THR 110 -0.464 -9.928 -11.943 247 H ASN 111 H ASN 111 -1.923 -5.691 -11.157 248 HA ASN 111 HA ASN 111 -2.266 -5.746 -13.960 249 HB2 ASN 111 2HB ASN 111 -3.827 -4.718 -12.269 250 HB3 ASN 111 1HB ASN 111 -2.701 -3.367 -12.150 251 HD21 ASN 111 1HD2 ASN 111 -4.661 -5.183 -14.543 252 HD22 ASN 111 2HD2 ASN 111 -4.886 -3.864 -15.589 253 H LEU 112 H LEU 112 -0.158 -3.903 -11.834 254 HA LEU 112 HA LEU 112 0.853 -2.075 -13.713 255 HB2 LEU 112 2HB LEU 112 1.839 -3.174 -11.094 256 HB3 LEU 112 1HB LEU 112 2.919 -2.175 -12.058 257 HG LEU 112 HG LEU 112 0.112 -1.230 -11.447 258 HD11 LEU 112 1HD1 LEU 112 0.837 -1.601 -9.242 259 HD12 LEU 112 2HD1 LEU 112 1.309 0.071 -9.523 260 HD13 LEU 112 3HD1 LEU 112 2.513 -1.213 -9.619 261 HD21 LEU 112 3HD2 LEU 112 2.760 0.128 -12.086 262 HD22 LEU 112 1HD2 LEU 112 1.322 1.004 -11.572 263 HD23 LEU 112 2HD2 LEU 112 1.308 0.102 -13.083 264 H GLY 113 H GLY 113 1.738 -5.400 -12.882 265 HA2 GLY 113 2HA GLY 113 2.598 -6.535 -15.030 266 HA3 GLY 113 1HA GLY 113 3.877 -5.327 -14.941 267 H GLU 114 H GLU 114 3.107 -5.927 -11.818 268 HA GLU 114 HA GLU 114 5.173 -8.055 -11.560 269 HB2 GLU 114 2HB GLU 114 4.419 -5.985 -9.487 270 HB3 GLU 114 1HB GLU 114 5.816 -7.063 -9.481 271 HG2 GLU 114 2HG GLU 114 5.297 -4.879 -11.521 272 HG3 GLU 114 1HG GLU 114 6.442 -4.773 -10.187 273 H LYS 115 H LYS 115 4.051 -9.913 -11.341 274 HA LYS 115 HA LYS 115 1.568 -10.030 -9.854 275 HB2 LYS 115 2HB LYS 115 1.944 -11.378 -11.910 276 HB3 LYS 115 1HB LYS 115 3.209 -12.269 -11.066 277 HG2 LYS 115 2HG LYS 115 1.588 -13.049 -9.401 278 HG3 LYS 115 1HG LYS 115 0.314 -12.107 -10.174 279 HD2 LYS 115 2HD LYS 115 0.606 -13.425 -12.250 280 HD3 LYS 115 1HD LYS 115 1.864 -14.377 -11.462 281 HE2 LYS 115 2HE LYS 115 0.250 -15.155 -9.782 282 HE3 LYS 115 1HE LYS 115 -1.012 -14.173 -10.523 283 HZ1 LYS 115 3HZ LYS 115 0.399 -15.981 -12.302 284 HZ2 LYS 115 1HZ LYS 115 -1.250 -15.599 -12.230 285 HZ3 LYS 115 2HZ LYS 115 -0.592 -16.722 -11.137 286 H LEU 116 H LEU 116 2.047 -9.559 -7.740 287 HA LEU 116 HA LEU 116 4.137 -10.898 -6.276 288 HB2 LEU 116 2HB LEU 116 1.947 -8.956 -5.611 289 HB3 LEU 116 1HB LEU 116 2.705 -9.842 -4.294 290 HG LEU 116 HG LEU 116 4.913 -9.020 -4.974 291 HD11 LEU 116 1HD1 LEU 116 4.875 -7.137 -6.749 292 HD12 LEU 116 2HD1 LEU 116 3.315 -7.806 -7.227 293 HD13 LEU 116 3HD1 LEU 116 4.765 -8.800 -7.326 294 HD21 LEU 116 3HD2 LEU 116 3.324 -7.671 -3.481 295 HD22 LEU 116 1HD2 LEU 116 2.988 -6.680 -4.902 296 HD23 LEU 116 2HD2 LEU 116 4.624 -6.754 -4.245 297 H THR 117 H THR 117 3.052 -11.649 -3.932 298 HA THR 117 HA THR 117 1.339 -13.960 -4.671 299 HB THR 117 HB THR 117 2.830 -13.927 -2.086 300 HG1 THR 117 1HG THR 117 4.741 -14.120 -2.971 301 HG21 THR 117 3HG2 THR 117 3.109 -16.308 -2.606 302 HG22 THR 117 1HG2 THR 117 2.402 -16.054 -4.200 303 HG23 THR 117 2HG2 THR 117 1.414 -15.844 -2.755 304 H ASP 118 H ASP 118 -0.612 -14.019 -3.892 305 HA ASP 118 HA ASP 118 -1.838 -11.965 -2.476 306 HB2 ASP 118 2HB ASP 118 -2.709 -14.866 -2.557 307 HB3 ASP 118 1HB ASP 118 -3.729 -13.478 -2.182 308 H GLU 119 H GLU 119 -0.323 -14.930 -1.318 309 HA GLU 119 HA GLU 119 -1.195 -14.711 1.372 310 HB2 GLU 119 2HB GLU 119 1.228 -16.085 0.182 311 HB3 GLU 119 1HB GLU 119 0.658 -16.303 1.839 312 HG2 GLU 119 2HG GLU 119 -1.529 -17.071 0.979 313 HG3 GLU 119 1HG GLU 119 -0.939 -16.873 -0.670 314 H GLU 120 H GLU 120 1.546 -13.407 -0.410 315 HA GLU 120 HA GLU 120 2.928 -12.400 1.917 316 HB2 GLU 120 2HB GLU 120 4.102 -12.882 -0.230 317 HB3 GLU 120 1HB GLU 120 3.215 -11.553 -0.981 318 HG2 GLU 120 2HG GLU 120 4.186 -9.973 0.635 319 HG3 GLU 120 1HG GLU 120 5.044 -11.295 1.428 320 H VAL 121 H VAL 121 0.824 -11.032 -0.591 321 HA VAL 121 HA VAL 121 0.840 -8.356 0.258 322 HB VAL 121 HB VAL 121 -1.277 -10.034 -1.114 323 HG11 VAL 121 1HG1 VAL 121 -1.246 -7.080 -0.484 324 HG12 VAL 121 2HG1 VAL 121 -2.486 -8.249 -0.051 325 HG13 VAL 121 3HG1 VAL 121 -2.267 -7.779 -1.733 326 HG21 VAL 121 3HG2 VAL 121 0.724 -7.953 -2.043 327 HG22 VAL 121 1HG2 VAL 121 -0.545 -8.620 -3.064 328 HG23 VAL 121 2HG2 VAL 121 0.721 -9.671 -2.437 329 H ASP 122 H ASP 122 -1.681 -10.785 0.871 330 HA ASP 122 HA ASP 122 -3.187 -9.484 2.754 331 HB2 ASP 122 2HB ASP 122 -3.777 -11.694 1.923 332 HB3 ASP 122 1HB ASP 122 -2.362 -12.404 2.695 333 H GLU 123 H GLU 123 -0.120 -11.225 3.302 334 HA GLU 123 HA GLU 123 -0.145 -10.700 6.131 335 HB2 GLU 123 2HB GLU 123 1.080 -12.612 5.102 336 HB3 GLU 123 1HB GLU 123 2.204 -11.456 4.387 337 HG2 GLU 123 2HG GLU 123 2.806 -10.627 6.616 338 HG3 GLU 123 1HG GLU 123 1.653 -11.740 7.354 339 H MET 124 H MET 124 1.083 -9.066 3.286 340 HA MET 124 HA MET 124 2.998 -7.363 4.316 341 HB2 MET 124 2HB MET 124 2.305 -7.578 1.907 342 HB3 MET 124 1HB MET 124 0.921 -6.556 2.275 343 HG2 MET 124 2HG MET 124 2.293 -4.702 2.821 344 HG3 MET 124 1HG MET 124 3.757 -5.693 2.856 345 HE1 MET 124 3HE MET 124 4.555 -7.073 0.950 346 HE2 MET 124 1HE MET 124 5.413 -5.529 0.849 347 HE3 MET 124 2HE MET 124 4.808 -6.302 -0.615 348 H ILE 125 H ILE 125 -0.435 -6.388 3.828 349 HA ILE 125 HA ILE 125 -0.246 -4.012 5.296 350 HB ILE 125 HB ILE 125 -2.545 -5.804 4.514 351 HG12 ILE 125 2HG1 ILE 125 -1.832 -2.950 3.729 352 HG13 ILE 125 1HG1 ILE 125 -1.385 -4.383 2.810 353 HG21 ILE 125 1HG2 ILE 125 -2.585 -3.485 6.422 354 HG22 ILE 125 2HG2 ILE 125 -3.547 -4.961 6.425 355 HG23 ILE 125 3HG2 ILE 125 -3.939 -3.661 5.303 356 HD11 ILE 125 3HD1 ILE 125 -4.154 -3.276 3.300 357 HD12 ILE 125 1HD1 ILE 125 -3.902 -4.942 2.784 358 HD13 ILE 125 2HD1 ILE 125 -3.370 -3.615 1.758 359 H ARG 126 H ARG 126 -1.309 -7.241 6.264 360 HA ARG 126 HA ARG 126 -2.237 -6.827 8.784 361 HB2 ARG 126 2HB ARG 126 -0.474 -9.042 7.752 362 HB3 ARG 126 1HB ARG 126 -1.235 -9.093 9.339 363 HG2 ARG 126 2HG ARG 126 -2.945 -8.509 6.925 364 HG3 ARG 126 1HG ARG 126 -2.448 -10.172 7.233 365 HD2 ARG 126 2HD ARG 126 -3.934 -8.373 9.173 366 HD3 ARG 126 1HD ARG 126 -4.616 -9.726 8.279 367 HE ARG 126 HE ARG 126 -2.474 -10.778 9.672 368 HH11 ARG 126 1HH2 ARG 126 -5.390 -9.063 10.378 369 HH12 ARG 126 2HH2 ARG 126 -5.594 -9.779 11.941 370 HH21 ARG 126 1HH1 ARG 126 -2.742 -11.734 11.709 371 HH22 ARG 126 2HH1 ARG 126 -4.097 -11.292 12.695 372 H GLU 127 H GLU 127 1.161 -6.829 7.814 373 HA GLU 127 HA GLU 127 2.067 -6.506 10.563 374 HB2 GLU 127 2HB GLU 127 3.506 -6.482 7.909 375 HB3 GLU 127 1HB GLU 127 4.310 -6.238 9.460 376 HG2 GLU 127 2HG GLU 127 3.544 -8.408 10.245 377 HG3 GLU 127 1HG GLU 127 2.598 -8.640 8.773 378 H ALA 128 H ALA 128 1.473 -4.492 7.740 379 HA ALA 128 HA ALA 128 2.554 -2.110 9.085 380 HB1 ALA 128 1HB ALA 128 1.770 -1.049 6.825 381 HB2 ALA 128 2HB ALA 128 1.638 -2.719 6.283 382 HB3 ALA 128 3HB ALA 128 3.190 -2.090 6.835 383 H ASP 129 H ASP 129 0.203 -3.423 10.171 384 HA ASP 129 HA ASP 129 -1.828 -1.283 9.754 385 HB2 ASP 129 2HB ASP 129 -2.276 -3.830 9.173 386 HB3 ASP 129 1HB ASP 129 -2.586 -3.949 10.894 387 H ILE 130 H ILE 130 -1.848 0.062 11.360 388 HA ILE 130 HA ILE 130 -0.918 -0.716 14.035 389 HB ILE 130 HB ILE 130 -1.804 2.009 13.049 390 HG12 ILE 130 2HG1 ILE 130 0.917 0.705 13.273 391 HG13 ILE 130 1HG1 ILE 130 0.136 1.227 11.788 392 HG21 ILE 130 1HG2 ILE 130 -0.159 1.212 15.477 393 HG22 ILE 130 2HG2 ILE 130 -1.873 1.616 15.546 394 HG23 ILE 130 3HG2 ILE 130 -0.701 2.834 15.064 395 HD11 ILE 130 3HD1 ILE 130 0.155 3.580 12.685 396 HD12 ILE 130 1HD1 ILE 130 1.760 2.910 12.399 397 HD13 ILE 130 2HD1 ILE 130 1.126 2.999 14.041 398 H ASP 131 H ASP 131 -3.870 0.268 12.399 399 HA ASP 131 HA ASP 131 -5.393 0.388 14.884 400 HB2 ASP 131 2HB ASP 131 -5.833 1.899 12.929 401 HB3 ASP 131 1HB ASP 131 -6.397 0.491 12.029 402 H GLY 132 H GLY 132 -4.642 -1.917 12.434 403 HA2 GLY 132 2HA GLY 132 -5.153 -4.148 12.207 404 HA3 GLY 132 1HA GLY 132 -5.792 -4.097 13.850 405 H ASP 133 H ASP 133 -6.776 -2.278 10.970 406 HA ASP 133 HA ASP 133 -9.512 -3.389 11.253 407 HB2 ASP 133 2HB ASP 133 -10.246 -1.297 10.175 408 HB3 ASP 133 1HB ASP 133 -9.365 -0.987 11.671 409 H GLY 134 H GLY 134 -6.862 -2.736 9.017 410 HA2 GLY 134 2HA GLY 134 -6.613 -4.332 7.155 411 HA3 GLY 134 1HA GLY 134 -8.346 -4.202 6.887 412 H GLN 135 H GLN 135 -7.014 -1.243 7.749 413 HA GLN 135 HA GLN 135 -6.673 -0.397 4.913 414 HB2 GLN 135 2HB GLN 135 -7.903 1.263 7.125 415 HB3 GLN 135 1HB GLN 135 -7.763 1.693 5.423 416 HG2 GLN 135 2HG GLN 135 -9.410 -0.573 6.575 417 HG3 GLN 135 1HG GLN 135 -10.033 0.920 5.873 418 HE21 GLN 135 1HE2 GLN 135 -9.689 -2.256 5.118 419 HE22 GLN 135 2HE2 GLN 135 -9.468 -2.141 3.438 420 H VAL 136 H VAL 136 -4.748 0.428 4.510 421 HA VAL 136 HA VAL 136 -3.109 1.443 6.778 422 HB VAL 136 HB VAL 136 -2.126 0.374 4.118 423 HG11 VAL 136 1HG1 VAL 136 0.047 0.409 5.157 424 HG12 VAL 136 2HG1 VAL 136 -0.662 0.874 6.696 425 HG13 VAL 136 3HG1 VAL 136 -0.665 2.011 5.350 426 HG21 VAL 136 3HG2 VAL 136 -1.382 -1.568 5.557 427 HG22 VAL 136 1HG2 VAL 136 -3.122 -1.462 5.275 428 HG23 VAL 136 2HG2 VAL 136 -2.442 -0.933 6.815 429 H ASN 137 H ASN 137 -2.559 3.466 6.785 430 HA ASN 137 HA ASN 137 -3.419 5.264 4.714 431 HB2 ASN 137 2HB ASN 137 -1.629 5.799 7.098 432 HB3 ASN 137 1HB ASN 137 -2.437 7.011 6.107 433 HD21 ASN 137 1HD2 ASN 137 -2.729 5.714 9.058 434 HD22 ASN 137 2HD2 ASN 137 -4.418 5.674 9.220 435 H TYR 138 H TYR 138 -1.130 7.066 4.901 436 HA TYR 138 HA TYR 138 0.402 5.900 2.751 437 HB2 TYR 138 2HB TYR 138 1.100 8.520 4.054 438 HB3 TYR 138 1HB TYR 138 1.170 8.059 2.352 439 HD1 TYR 138 2HD TYR 138 -1.366 7.011 1.681 440 HD2 TYR 138 1HD TYR 138 -0.481 10.214 4.376 441 HE1 TYR 138 2HE TYR 138 -3.648 7.921 1.324 442 HE2 TYR 138 1HE TYR 138 -2.765 11.133 4.040 443 HH TYR 138 HH TYR 138 -4.790 10.168 1.538 444 H GLU 139 H GLU 139 1.300 7.351 5.878 445 HA GLU 139 HA GLU 139 3.999 6.566 5.838 446 HB2 GLU 139 2HB GLU 139 2.170 7.129 8.164 447 HB3 GLU 139 1HB GLU 139 3.905 6.853 8.330 448 HG2 GLU 139 2HG GLU 139 4.380 8.713 6.820 449 HG3 GLU 139 1HG GLU 139 2.657 8.972 6.563 450 H GLU 140 H GLU 140 1.499 5.158 7.890 451 HA GLU 140 HA GLU 140 2.590 2.937 8.931 452 HB2 GLU 140 2HB GLU 140 -0.080 2.967 7.484 453 HB3 GLU 140 1HB GLU 140 0.468 1.665 8.539 454 HG2 GLU 140 2HG GLU 140 0.574 3.146 10.423 455 HG3 GLU 140 1HG GLU 140 0.227 4.547 9.414 456 H PHE 141 H PHE 141 1.858 3.432 5.565 457 HA PHE 141 HA PHE 141 2.627 0.755 4.739 458 HB2 PHE 141 2HB PHE 141 0.904 2.456 3.636 459 HB3 PHE 141 1HB PHE 141 2.342 3.056 2.813 460 HD1 PHE 141 1HD PHE 141 3.961 1.062 1.916 461 HD2 PHE 141 2HD PHE 141 -0.279 0.759 2.565 462 HE1 PHE 141 1HE PHE 141 3.855 -0.875 0.369 463 HE2 PHE 141 2HE PHE 141 -0.376 -1.160 1.029 464 HZ PHE 141 HZ PHE 141 1.684 -1.989 -0.078 465 H VAL 142 H VAL 142 3.851 4.051 4.191 466 HA VAL 142 HA VAL 142 6.118 3.677 2.744 467 HB VAL 142 HB VAL 142 5.858 5.387 5.229 468 HG11 VAL 142 1HG1 VAL 142 7.831 6.651 4.185 469 HG12 VAL 142 2HG1 VAL 142 8.108 5.201 3.220 470 HG13 VAL 142 3HG1 VAL 142 8.205 5.120 4.980 471 HG21 VAL 142 3HG2 VAL 142 5.513 5.842 2.261 472 HG22 VAL 142 1HG2 VAL 142 5.822 7.183 3.358 473 HG23 VAL 142 2HG2 VAL 142 4.383 6.201 3.558 474 H GLN 143 H GLN 143 6.224 3.508 6.320 475 HA GLN 143 HA GLN 143 8.732 2.555 6.736 476 HB2 GLN 143 2HB GLN 143 7.052 3.051 8.507 477 HB3 GLN 143 1HB GLN 143 6.262 1.515 8.155 478 HG2 GLN 143 2HG GLN 143 8.278 0.288 8.767 479 HG3 GLN 143 1HG GLN 143 9.161 1.798 8.995 480 HE21 GLN 143 1HE2 GLN 143 9.481 1.892 11.240 481 HE22 GLN 143 2HE2 GLN 143 8.239 1.746 12.387 482 H MET 144 H MET 144 6.292 0.962 5.026 483 HA MET 144 HA MET 144 7.531 -1.700 5.244 484 HB2 MET 144 2HB MET 144 4.997 -1.371 5.427 485 HB3 MET 144 1HB MET 144 5.025 -1.032 3.702 486 HG2 MET 144 2HG MET 144 5.667 -3.201 3.134 487 HG3 MET 144 1HG MET 144 6.305 -3.549 4.739 488 HE1 MET 144 3HE MET 144 4.888 -5.283 6.231 489 HE2 MET 144 1HE MET 144 3.542 -4.392 6.947 490 HE3 MET 144 2HE MET 144 5.107 -3.616 6.756 491 H MET 145 H MET 145 6.435 0.563 2.679 492 HA MET 145 HA MET 145 7.445 -0.823 0.494 493 HB2 MET 145 2HB MET 145 6.013 1.136 0.246 494 HB3 MET 145 1HB MET 145 7.282 2.168 0.898 495 HG2 MET 145 2HG MET 145 8.630 1.939 -1.010 496 HG3 MET 145 1HG MET 145 7.831 0.450 -1.517 497 HE1 MET 145 3HE MET 145 7.957 4.272 -1.654 498 HE2 MET 145 1HE MET 145 6.748 4.030 -0.385 499 HE3 MET 145 2HE MET 145 6.285 4.762 -1.921 500 H THR 146 H THR 146 9.399 -1.147 -0.383 501 HA THR 146 HA THR 146 11.759 -0.097 1.055 502 HB THR 146 HB THR 146 11.714 -2.281 -1.031 503 HG1 THR 146 1HG THR 146 10.920 -2.255 1.612 504 HG21 THR 146 3HG2 THR 146 13.806 -2.928 0.123 505 HG22 THR 146 1HG2 THR 146 13.621 -1.552 1.210 506 HG23 THR 146 2HG2 THR 146 13.899 -1.285 -0.510 507 H ALA 147 H ALA 147 10.171 -0.124 -2.066 508 HA ALA 147 HA ALA 147 12.177 0.711 -3.771 509 HB1 ALA 147 1HB ALA 147 9.282 1.577 -3.672 510 HB2 ALA 147 2HB ALA 147 9.960 0.247 -4.612 511 HB3 ALA 147 3HB ALA 147 10.366 1.914 -5.021 512 H LYS 148 H LYS 148 13.240 2.615 -4.189 513 HA LYS 148 HA LYS 148 13.507 4.545 -2.164 514 HB2 LYS 148 2HB LYS 148 15.228 4.113 -3.892 515 HB3 LYS 148 1HB LYS 148 14.171 4.828 -5.109 516 HG2 LYS 148 2HG LYS 148 14.208 6.975 -3.916 517 HG3 LYS 148 1HG LYS 148 15.210 6.267 -2.646 518 HD2 LYS 148 2HD LYS 148 16.970 5.780 -4.308 519 HD3 LYS 148 1HD LYS 148 15.981 6.514 -5.570 520 HE2 LYS 148 2HE LYS 148 16.921 7.967 -3.081 521 HE3 LYS 148 1HE LYS 148 17.723 8.060 -4.645 522 HZ1 LYS 148 3HZ LYS 148 15.168 9.188 -3.804 523 HZ2 LYS 148 1HZ LYS 148 15.278 8.639 -5.405 524 HZ3 LYS 148 2HZ LYS 148 16.351 9.833 -4.839 Start of MODEL 12 1 H1 ASP 78 1HT ASP 78 18.506 13.581 -0.348 2 H2 ASP 78 2HT ASP 78 17.810 12.899 -1.739 3 H3 ASP 78 3HT ASP 78 18.936 12.011 -0.827 4 HA ASP 78 HA ASP 78 17.219 11.089 0.210 5 HB2 ASP 78 2HB ASP 78 17.999 12.860 1.832 6 HB3 ASP 78 1HB ASP 78 16.691 13.888 1.244 7 H THR 79 H THR 79 14.796 11.145 0.630 8 HA THR 79 HA THR 79 13.449 12.037 -1.828 9 HB THR 79 HB THR 79 11.568 10.613 -0.920 10 HG1 THR 79 1HG THR 79 12.485 10.796 1.279 11 HG21 THR 79 3HG2 THR 79 12.795 8.464 -1.351 12 HG22 THR 79 1HG2 THR 79 14.300 9.382 -1.349 13 HG23 THR 79 2HG2 THR 79 13.076 9.699 -2.578 14 H ASP 80 H ASP 80 13.447 14.291 -1.240 15 HA ASP 80 HA ASP 80 11.838 15.098 1.069 16 HB2 ASP 80 2HB ASP 80 13.336 16.688 -1.027 17 HB3 ASP 80 1HB ASP 80 12.435 17.402 0.309 18 H SER 81 H SER 81 11.038 13.888 -1.791 19 HA SER 81 HA SER 81 9.006 15.868 -2.552 20 HB2 SER 81 2HB SER 81 10.388 14.719 -4.294 21 HB3 SER 81 1HB SER 81 9.654 13.191 -3.813 22 HG SER 81 HG SER 81 7.596 14.483 -4.159 23 H GLU 82 H GLU 82 8.435 14.994 -0.085 24 HA GLU 82 HA GLU 82 7.067 12.685 0.416 25 HB2 GLU 82 2HB GLU 82 7.473 14.594 2.010 26 HB3 GLU 82 1HB GLU 82 6.108 15.428 1.268 27 HG2 GLU 82 2HG GLU 82 4.620 13.572 1.877 28 HG3 GLU 82 1HG GLU 82 5.981 12.701 2.582 29 H GLU 83 H GLU 83 6.207 15.165 -1.806 30 HA GLU 83 HA GLU 83 3.415 14.838 -1.930 31 HB2 GLU 83 2HB GLU 83 5.453 15.744 -3.966 32 HB3 GLU 83 1HB GLU 83 3.720 15.759 -4.274 33 HG2 GLU 83 2HG GLU 83 4.300 17.948 -3.480 34 HG3 GLU 83 1HG GLU 83 3.456 17.139 -2.165 35 H GLU 84 H GLU 84 6.017 13.280 -3.848 36 HA GLU 84 HA GLU 84 4.425 11.786 -5.554 37 HB2 GLU 84 2HB GLU 84 6.915 11.797 -5.654 38 HB3 GLU 84 1HB GLU 84 6.947 10.762 -4.223 39 HG2 GLU 84 2HG GLU 84 5.650 9.042 -5.423 40 HG3 GLU 84 1HG GLU 84 5.579 10.078 -6.845 41 H ILE 85 H ILE 85 5.497 10.921 -2.252 42 HA ILE 85 HA ILE 85 4.279 8.441 -2.048 43 HB ILE 85 HB ILE 85 4.522 10.581 0.087 44 HG12 ILE 85 2HG1 ILE 85 6.453 8.365 -0.656 45 HG13 ILE 85 1HG1 ILE 85 6.648 10.054 -1.129 46 HG21 ILE 85 1HG2 ILE 85 3.067 8.642 0.692 47 HG22 ILE 85 2HG2 ILE 85 4.529 8.727 1.664 48 HG23 ILE 85 3HG2 ILE 85 4.416 7.565 0.346 49 HD11 ILE 85 3HD1 ILE 85 6.672 8.893 1.661 50 HD12 ILE 85 1HD1 ILE 85 6.482 10.619 1.362 51 HD13 ILE 85 2HD1 ILE 85 7.953 9.794 0.849 52 H ARG 86 H ARG 86 2.957 11.650 -1.247 53 HA ARG 86 HA ARG 86 0.395 10.756 -0.490 54 HB2 ARG 86 2HB ARG 86 1.360 13.406 -1.575 55 HB3 ARG 86 1HB ARG 86 -0.318 13.134 -1.104 56 HG2 ARG 86 2HG ARG 86 0.561 12.356 1.159 57 HG3 ARG 86 1HG ARG 86 2.144 12.944 0.657 58 HD2 ARG 86 2HD ARG 86 -0.327 14.686 0.621 59 HD3 ARG 86 1HD ARG 86 0.719 14.565 2.027 60 HE ARG 86 HE ARG 86 1.343 15.889 -0.507 61 HH11 ARG 86 1HH2 ARG 86 2.438 14.633 2.538 62 HH12 ARG 86 2HH2 ARG 86 3.843 15.642 2.604 63 HH21 ARG 86 1HH1 ARG 86 3.188 17.223 -0.410 64 HH22 ARG 86 2HH1 ARG 86 4.269 17.104 0.938 65 H GLU 87 H GLU 87 1.737 11.506 -3.660 66 HA GLU 87 HA GLU 87 -0.806 11.316 -5.022 67 HB2 GLU 87 2HB GLU 87 2.048 11.367 -6.020 68 HB3 GLU 87 1HB GLU 87 0.638 11.324 -7.079 69 HG2 GLU 87 2HG GLU 87 -0.184 13.416 -6.137 70 HG3 GLU 87 1HG GLU 87 1.138 13.444 -4.972 71 H ALA 88 H ALA 88 2.137 9.405 -5.309 72 HA ALA 88 HA ALA 88 1.317 7.264 -6.758 73 HB1 ALA 88 1HB ALA 88 2.911 5.855 -5.364 74 HB2 ALA 88 2HB ALA 88 3.150 7.285 -4.358 75 HB3 ALA 88 3HB ALA 88 3.592 7.324 -6.065 76 H PHE 89 H PHE 89 1.066 7.389 -3.193 77 HA PHE 89 HA PHE 89 -0.428 4.989 -3.016 78 HB2 PHE 89 2HB PHE 89 0.145 7.269 -1.156 79 HB3 PHE 89 1HB PHE 89 -1.030 6.029 -0.694 80 HD1 PHE 89 2HD PHE 89 -0.250 3.540 -1.123 81 HD2 PHE 89 1HD PHE 89 2.417 6.869 -0.666 82 HE1 PHE 89 2HE PHE 89 1.594 1.987 -0.555 83 HE2 PHE 89 1HE PHE 89 4.259 5.314 -0.102 84 HZ PHE 89 HZ PHE 89 3.852 2.882 -0.050 85 H ARG 90 H ARG 90 -1.449 8.413 -3.187 86 HA ARG 90 HA ARG 90 -4.178 7.990 -2.730 87 HB2 ARG 90 2HB ARG 90 -2.612 10.032 -4.276 88 HB3 ARG 90 1HB ARG 90 -4.364 10.028 -4.422 89 HG2 ARG 90 2HG ARG 90 -3.087 9.965 -1.685 90 HG3 ARG 90 1HG ARG 90 -3.232 11.496 -2.552 91 HD2 ARG 90 2HD ARG 90 -5.690 11.022 -2.822 92 HD3 ARG 90 1HD ARG 90 -5.478 9.614 -1.792 93 HE ARG 90 HE ARG 90 -4.560 12.132 -0.656 94 HH11 ARG 90 1HH2 ARG 90 -7.108 9.812 -1.038 95 HH12 ARG 90 2HH2 ARG 90 -7.957 10.304 0.392 96 HH21 ARG 90 1HH1 ARG 90 -5.680 12.786 1.219 97 HH22 ARG 90 2HH1 ARG 90 -7.150 11.984 1.666 98 H VAL 91 H VAL 91 -2.293 7.742 -5.714 99 HA VAL 91 HA VAL 91 -4.462 7.161 -7.440 100 HB VAL 91 HB VAL 91 -1.522 6.482 -7.661 101 HG11 VAL 91 1HG1 VAL 91 -2.120 6.296 -10.135 102 HG12 VAL 91 2HG1 VAL 91 -3.809 6.230 -9.629 103 HG13 VAL 91 3HG1 VAL 91 -2.686 4.972 -9.115 104 HG21 VAL 91 3HG2 VAL 91 -3.266 8.723 -8.723 105 HG22 VAL 91 1HG2 VAL 91 -1.638 8.398 -9.319 106 HG23 VAL 91 2HG2 VAL 91 -1.884 8.865 -7.636 107 H PHE 92 H PHE 92 -2.269 5.079 -5.581 108 HA PHE 92 HA PHE 92 -2.980 2.588 -6.577 109 HB2 PHE 92 2HB PHE 92 -2.006 3.563 -3.921 110 HB3 PHE 92 1HB PHE 92 -2.610 1.914 -3.993 111 HD1 PHE 92 1HD PHE 92 -0.870 3.805 -6.711 112 HD2 PHE 92 2HD PHE 92 -0.612 0.653 -3.801 113 HE1 PHE 92 1HE PHE 92 1.265 3.051 -7.714 114 HE2 PHE 92 2HE PHE 92 1.525 -0.100 -4.807 115 HZ PHE 92 HZ PHE 92 2.463 1.098 -6.764 116 H ASP 93 H ASP 93 -4.543 4.310 -3.848 117 HA ASP 93 HA ASP 93 -6.504 2.468 -3.237 118 HB2 ASP 93 2HB ASP 93 -6.051 4.739 -2.146 119 HB3 ASP 93 1HB ASP 93 -7.067 5.428 -3.409 120 H LYS 94 H LYS 94 -7.253 1.343 -5.015 121 HA LYS 94 HA LYS 94 -8.084 2.408 -7.448 122 HB2 LYS 94 2HB LYS 94 -8.106 -0.142 -6.140 123 HB3 LYS 94 1HB LYS 94 -9.723 0.105 -6.777 124 HG2 LYS 94 2HG LYS 94 -8.589 -0.926 -8.559 125 HG3 LYS 94 1HG LYS 94 -8.516 0.778 -8.990 126 HD2 LYS 94 2HD LYS 94 -6.243 0.879 -7.882 127 HD3 LYS 94 1HD LYS 94 -6.332 -0.870 -7.677 128 HE2 LYS 94 2HE LYS 94 -6.553 0.544 -10.349 129 HE3 LYS 94 1HE LYS 94 -5.074 -0.191 -9.731 130 HZ1 LYS 94 3HZ LYS 94 -7.525 -1.461 -10.691 131 HZ2 LYS 94 1HZ LYS 94 -6.692 -2.224 -9.425 132 HZ3 LYS 94 2HZ LYS 94 -5.905 -1.930 -10.901 133 H ASP 95 H ASP 95 -10.196 1.411 -4.736 134 HA ASP 95 HA ASP 95 -12.496 2.695 -5.860 135 HB2 ASP 95 2HB ASP 95 -11.971 1.569 -3.098 136 HB3 ASP 95 1HB ASP 95 -13.544 2.105 -3.686 137 H GLY 96 H GLY 96 -9.900 4.141 -4.984 138 HA2 GLY 96 2HA GLY 96 -9.278 6.064 -3.784 139 HA3 GLY 96 1HA GLY 96 -10.622 6.691 -4.721 140 H ASN 97 H ASN 97 -10.547 4.476 -1.923 141 HA ASN 97 HA ASN 97 -12.669 6.021 -0.654 142 HB2 ASN 97 2HB ASN 97 -12.739 4.196 0.965 143 HB3 ASN 97 1HB ASN 97 -12.784 3.565 -0.680 144 HD21 ASN 97 1HD2 ASN 97 -11.980 1.591 0.771 145 HD22 ASN 97 2HD2 ASN 97 -10.297 1.427 0.887 146 H GLY 98 H GLY 98 -9.493 6.543 -0.825 147 HA2 GLY 98 2HA GLY 98 -8.145 7.956 0.424 148 HA3 GLY 98 1HA GLY 98 -9.445 8.084 1.602 149 H TYR 99 H TYR 99 -8.265 4.955 0.643 150 HA TYR 99 HA TYR 99 -6.420 4.725 2.882 151 HB2 TYR 99 2HB TYR 99 -8.955 3.066 2.799 152 HB3 TYR 99 1HB TYR 99 -7.633 2.887 3.955 153 HD1 TYR 99 1HD TYR 99 -6.993 4.956 5.367 154 HD2 TYR 99 2HD TYR 99 -10.696 4.605 3.220 155 HE1 TYR 99 1HE TYR 99 -7.981 6.735 6.784 156 HE2 TYR 99 2HE TYR 99 -11.685 6.387 4.637 157 HH TYR 99 HH TYR 99 -10.844 7.249 7.355 158 H ILE 100 H ILE 100 -5.600 2.350 2.982 159 HA ILE 100 HA ILE 100 -5.407 1.288 0.204 160 HB ILE 100 HB ILE 100 -3.275 1.323 2.353 161 HG12 ILE 100 2HG1 ILE 100 -3.653 3.549 1.362 162 HG13 ILE 100 1HG1 ILE 100 -2.113 2.891 0.824 163 HG21 ILE 100 1HG2 ILE 100 -2.863 -0.614 1.097 164 HG22 ILE 100 2HG2 ILE 100 -1.891 0.600 0.263 165 HG23 ILE 100 3HG2 ILE 100 -3.446 0.110 -0.403 166 HD11 ILE 100 3HD1 ILE 100 -2.996 3.664 -1.187 167 HD12 ILE 100 1HD1 ILE 100 -4.651 3.279 -0.733 168 HD13 ILE 100 2HD1 ILE 100 -3.547 1.995 -1.216 169 H SER 101 H SER 101 -6.090 -0.712 -0.078 170 HA SER 101 HA SER 101 -6.390 -2.512 2.249 171 HB2 SER 101 2HB SER 101 -8.437 -1.932 0.895 172 HB3 SER 101 1HB SER 101 -7.676 -2.717 -0.480 173 HG SER 101 HG SER 101 -9.134 -3.920 1.172 174 H ALA 102 H ALA 102 -6.180 -4.887 1.599 175 HA ALA 102 HA ALA 102 -3.546 -5.274 0.509 176 HB1 ALA 102 1HB ALA 102 -3.972 -6.669 2.326 177 HB2 ALA 102 2HB ALA 102 -4.207 -7.761 0.961 178 HB3 ALA 102 3HB ALA 102 -5.600 -7.051 1.774 179 H ALA 103 H ALA 103 -6.830 -5.927 -0.649 180 HA ALA 103 HA ALA 103 -6.137 -7.630 -2.771 181 HB1 ALA 103 1HB ALA 103 -8.332 -6.873 -3.737 182 HB2 ALA 103 2HB ALA 103 -8.442 -5.708 -2.415 183 HB3 ALA 103 3HB ALA 103 -8.431 -7.439 -2.070 184 H GLU 104 H GLU 104 -6.152 -4.115 -2.507 185 HA GLU 104 HA GLU 104 -5.948 -3.543 -5.259 186 HB2 GLU 104 2HB GLU 104 -4.966 -1.958 -2.877 187 HB3 GLU 104 1HB GLU 104 -5.221 -1.331 -4.506 188 HG2 GLU 104 2HG GLU 104 -7.601 -1.867 -4.374 189 HG3 GLU 104 1HG GLU 104 -7.367 -2.592 -2.784 190 H LEU 105 H LEU 105 -3.542 -4.355 -2.796 191 HA LEU 105 HA LEU 105 -1.267 -3.491 -4.259 192 HB2 LEU 105 2HB LEU 105 -1.367 -5.749 -2.278 193 HB3 LEU 105 1HB LEU 105 0.025 -4.763 -2.701 194 HG LEU 105 HG LEU 105 -2.466 -3.890 -1.219 195 HD11 LEU 105 1HD1 LEU 105 -0.736 -5.052 0.096 196 HD12 LEU 105 2HD1 LEU 105 -0.813 -3.358 0.539 197 HD13 LEU 105 3HD1 LEU 105 0.481 -3.931 -0.499 198 HD21 LEU 105 3HD2 LEU 105 -0.250 -2.292 -2.516 199 HD22 LEU 105 1HD2 LEU 105 -1.143 -1.664 -1.140 200 HD23 LEU 105 2HD2 LEU 105 -1.994 -2.039 -2.622 201 H ARG 106 H ARG 106 -2.726 -6.748 -3.931 202 HA ARG 106 HA ARG 106 -0.878 -7.989 -5.638 203 HB2 ARG 106 2HB ARG 106 -2.604 -9.789 -5.811 204 HB3 ARG 106 1HB ARG 106 -2.222 -9.318 -4.157 205 HG2 ARG 106 2HG ARG 106 -4.202 -7.828 -4.144 206 HG3 ARG 106 1HG ARG 106 -4.619 -8.385 -5.765 207 HD2 ARG 106 2HD ARG 106 -4.693 -10.725 -4.861 208 HD3 ARG 106 1HD ARG 106 -4.456 -10.051 -3.249 209 HE ARG 106 HE ARG 106 -6.674 -8.865 -4.655 210 HH11 ARG 106 1HH2 ARG 106 -5.575 -11.497 -2.681 211 HH12 ARG 106 2HH2 ARG 106 -7.145 -11.847 -2.038 212 HH21 ARG 106 1HH1 ARG 106 -8.737 -9.327 -3.815 213 HH22 ARG 106 2HH1 ARG 106 -8.933 -10.621 -2.680 214 H HIS 107 H HIS 107 -4.102 -6.545 -6.355 215 HA HIS 107 HA HIS 107 -4.052 -7.276 -9.093 216 HB2 HIS 107 2HB HIS 107 -6.117 -6.734 -7.918 217 HB3 HIS 107 1HB HIS 107 -5.550 -5.092 -7.633 218 HD1 HIS 107 1HD HIS 107 -4.334 -5.627 -10.856 219 HD2 HIS 107 2HD HIS 107 -8.197 -5.095 -9.384 220 HE1 HIS 107 1HE HIS 107 -5.739 -4.834 -12.806 221 HE2 HIS 107 2HE HIS 107 -8.099 -4.510 -11.926 222 H VAL 108 H VAL 108 -3.350 -4.160 -7.471 223 HA VAL 108 HA VAL 108 -2.709 -2.798 -9.856 224 HB VAL 108 HB VAL 108 -3.196 -1.813 -7.528 225 HG11 VAL 108 1HG1 VAL 108 -1.255 -3.151 -6.514 226 HG12 VAL 108 2HG1 VAL 108 -1.400 -1.463 -6.041 227 HG13 VAL 108 3HG1 VAL 108 -0.198 -1.944 -7.240 228 HG21 VAL 108 3HG2 VAL 108 -1.023 -0.809 -9.376 229 HG22 VAL 108 1HG2 VAL 108 -1.628 0.155 -8.029 230 HG23 VAL 108 2HG2 VAL 108 -2.718 -0.325 -9.329 231 H MET 109 H MET 109 -0.557 -4.403 -7.492 232 HA MET 109 HA MET 109 1.855 -3.827 -8.806 233 HB2 MET 109 2HB MET 109 1.110 -6.198 -7.086 234 HB3 MET 109 1HB MET 109 2.753 -5.798 -7.588 235 HG2 MET 109 2HG MET 109 0.994 -3.803 -6.152 236 HG3 MET 109 1HG MET 109 2.035 -4.931 -5.281 237 HE1 MET 109 3HE MET 109 2.861 -2.841 -4.186 238 HE2 MET 109 1HE MET 109 4.436 -2.208 -4.684 239 HE3 MET 109 2HE MET 109 4.231 -3.931 -4.375 240 H THR 110 H THR 110 -0.339 -6.607 -9.130 241 HA THR 110 HA THR 110 1.182 -8.010 -11.062 242 HB THR 110 HB THR 110 -1.809 -7.978 -10.568 243 HG1 THR 110 1HG THR 110 -1.307 -9.193 -8.955 244 HG21 THR 110 3HG2 THR 110 -1.678 -10.241 -11.683 245 HG22 THR 110 1HG2 THR 110 -0.037 -9.824 -12.186 246 HG23 THR 110 2HG2 THR 110 -1.406 -8.875 -12.764 247 H ASN 111 H ASN 111 -1.384 -5.614 -11.295 248 HA ASN 111 HA ASN 111 -1.613 -5.553 -14.124 249 HB2 ASN 111 2HB ASN 111 -3.325 -4.616 -12.662 250 HB3 ASN 111 1HB ASN 111 -2.194 -3.403 -12.074 251 HD21 ASN 111 1HD2 ASN 111 -2.363 -4.455 -15.473 252 HD22 ASN 111 2HD2 ASN 111 -2.922 -2.969 -16.077 253 H LEU 112 H LEU 112 0.405 -3.869 -11.824 254 HA LEU 112 HA LEU 112 1.533 -1.963 -13.585 255 HB2 LEU 112 2HB LEU 112 2.372 -3.143 -10.955 256 HB3 LEU 112 1HB LEU 112 3.494 -2.119 -11.837 257 HG LEU 112 HG LEU 112 0.660 -1.181 -11.365 258 HD11 LEU 112 1HD1 LEU 112 1.226 -1.618 -9.125 259 HD12 LEU 112 2HD1 LEU 112 1.743 0.052 -9.326 260 HD13 LEU 112 3HD1 LEU 112 2.932 -1.250 -9.380 261 HD21 LEU 112 3HD2 LEU 112 3.353 0.175 -11.766 262 HD22 LEU 112 1HD2 LEU 112 1.881 1.043 -11.350 263 HD23 LEU 112 2HD2 LEU 112 1.986 0.178 -12.878 264 H GLY 113 H GLY 113 2.300 -5.332 -12.855 265 HA2 GLY 113 2HA GLY 113 3.265 -6.408 -14.966 266 HA3 GLY 113 1HA GLY 113 4.558 -5.230 -14.774 267 H GLU 114 H GLU 114 3.661 -5.873 -11.714 268 HA GLU 114 HA GLU 114 5.605 -8.106 -11.421 269 HB2 GLU 114 2HB GLU 114 4.997 -5.771 -9.594 270 HB3 GLU 114 1HB GLU 114 6.000 -7.149 -9.136 271 HG2 GLU 114 2HG GLU 114 7.555 -6.677 -10.950 272 HG3 GLU 114 1HG GLU 114 6.527 -5.369 -11.533 273 H LYS 115 H LYS 115 4.504 -9.932 -11.064 274 HA LYS 115 HA LYS 115 1.959 -9.887 -9.615 275 HB2 LYS 115 2HB LYS 115 2.204 -11.222 -11.690 276 HB3 LYS 115 1HB LYS 115 3.434 -12.201 -10.892 277 HG2 LYS 115 2HG LYS 115 1.810 -12.902 -9.191 278 HG3 LYS 115 1HG LYS 115 0.577 -11.874 -9.925 279 HD2 LYS 115 2HD LYS 115 0.724 -13.177 -12.013 280 HD3 LYS 115 1HD LYS 115 1.961 -14.203 -11.289 281 HE2 LYS 115 2HE LYS 115 -0.198 -15.324 -11.122 282 HE3 LYS 115 1HE LYS 115 0.327 -14.844 -9.508 283 HZ1 LYS 115 3HZ LYS 115 -1.996 -14.296 -9.905 284 HZ2 LYS 115 1HZ LYS 115 -1.559 -13.327 -11.227 285 HZ3 LYS 115 2HZ LYS 115 -1.070 -12.895 -9.658 286 H LEU 116 H LEU 116 2.476 -9.510 -7.493 287 HA LEU 116 HA LEU 116 4.549 -10.956 -6.113 288 HB2 LEU 116 2HB LEU 116 2.348 -9.077 -5.257 289 HB3 LEU 116 1HB LEU 116 3.356 -9.909 -4.072 290 HG LEU 116 HG LEU 116 5.365 -8.912 -4.983 291 HD11 LEU 116 1HD1 LEU 116 4.987 -8.863 -7.325 292 HD12 LEU 116 2HD1 LEU 116 5.038 -7.165 -6.861 293 HD13 LEU 116 3HD1 LEU 116 3.489 -7.953 -7.148 294 HD21 LEU 116 3HD2 LEU 116 4.753 -6.442 -4.733 295 HD22 LEU 116 1HD2 LEU 116 4.276 -7.484 -3.393 296 HD23 LEU 116 2HD2 LEU 116 3.077 -6.966 -4.577 297 H THR 117 H THR 117 3.543 -11.759 -3.776 298 HA THR 117 HA THR 117 1.820 -14.044 -4.520 299 HB THR 117 HB THR 117 2.598 -14.851 -2.183 300 HG1 THR 117 1HG THR 117 4.661 -13.878 -1.670 301 HG21 THR 117 3HG2 THR 117 4.670 -15.739 -3.117 302 HG22 THR 117 1HG2 THR 117 4.659 -14.503 -4.376 303 HG23 THR 117 2HG2 THR 117 3.414 -15.752 -4.354 304 H ASP 118 H ASP 118 -0.239 -14.041 -3.935 305 HA ASP 118 HA ASP 118 -1.525 -11.929 -2.655 306 HB2 ASP 118 2HB ASP 118 -2.556 -13.775 -4.075 307 HB3 ASP 118 1HB ASP 118 -2.526 -14.773 -2.629 308 H GLU 119 H GLU 119 -0.339 -14.985 -1.341 309 HA GLU 119 HA GLU 119 -1.413 -14.701 1.249 310 HB2 GLU 119 2HB GLU 119 1.112 -16.143 0.407 311 HB3 GLU 119 1HB GLU 119 0.199 -16.417 1.890 312 HG2 GLU 119 2HG GLU 119 -1.796 -17.005 0.485 313 HG3 GLU 119 1HG GLU 119 -0.775 -16.863 -0.942 314 H GLU 120 H GLU 120 1.523 -13.468 -0.249 315 HA GLU 120 HA GLU 120 2.677 -12.546 2.235 316 HB2 GLU 120 2HB GLU 120 4.065 -13.092 0.231 317 HB3 GLU 120 1HB GLU 120 3.345 -11.706 -0.593 318 HG2 GLU 120 2HG GLU 120 4.204 -10.196 1.138 319 HG3 GLU 120 1HG GLU 120 4.882 -11.565 2.017 320 H VAL 121 H VAL 121 0.876 -11.135 -0.467 321 HA VAL 121 HA VAL 121 0.942 -8.441 0.313 322 HB VAL 121 HB VAL 121 -0.992 -10.134 -1.266 323 HG11 VAL 121 1HG1 VAL 121 -2.472 -8.534 -0.352 324 HG12 VAL 121 2HG1 VAL 121 -2.051 -7.912 -1.941 325 HG13 VAL 121 3HG1 VAL 121 -1.293 -7.237 -0.497 326 HG21 VAL 121 3HG2 VAL 121 -0.115 -8.905 -3.144 327 HG22 VAL 121 1HG2 VAL 121 1.265 -9.422 -2.175 328 HG23 VAL 121 2HG2 VAL 121 0.696 -7.755 -2.082 329 H ASP 122 H ASP 122 -1.696 -10.766 0.768 330 HA ASP 122 HA ASP 122 -3.276 -9.296 2.498 331 HB2 ASP 122 2HB ASP 122 -3.950 -11.476 1.544 332 HB3 ASP 122 1HB ASP 122 -2.785 -12.288 2.586 333 H GLU 123 H GLU 123 -0.508 -11.399 3.270 334 HA GLU 123 HA GLU 123 -0.690 -10.993 6.086 335 HB2 GLU 123 2HB GLU 123 0.537 -12.883 4.898 336 HB3 GLU 123 1HB GLU 123 1.814 -11.713 4.559 337 HG2 GLU 123 2HG GLU 123 2.433 -12.823 6.594 338 HG3 GLU 123 1HG GLU 123 1.870 -11.215 7.046 339 H MET 124 H MET 124 0.970 -9.332 3.455 340 HA MET 124 HA MET 124 2.805 -7.768 4.806 341 HB2 MET 124 2HB MET 124 2.398 -7.874 2.297 342 HB3 MET 124 1HB MET 124 1.106 -6.702 2.551 343 HG2 MET 124 2HG MET 124 3.048 -5.421 2.014 344 HG3 MET 124 1HG MET 124 2.827 -5.257 3.756 345 HE1 MET 124 3HE MET 124 4.351 -7.072 0.909 346 HE2 MET 124 1HE MET 124 5.989 -7.517 1.403 347 HE3 MET 124 2HE MET 124 5.574 -5.826 1.140 348 H ILE 125 H ILE 125 -0.408 -6.497 3.825 349 HA ILE 125 HA ILE 125 -0.308 -4.231 5.436 350 HB ILE 125 HB ILE 125 -2.617 -5.800 4.273 351 HG12 ILE 125 2HG1 ILE 125 -1.214 -3.203 3.569 352 HG13 ILE 125 1HG1 ILE 125 -1.254 -4.687 2.621 353 HG21 ILE 125 1HG2 ILE 125 -4.103 -3.917 4.835 354 HG22 ILE 125 2HG2 ILE 125 -2.779 -3.114 5.663 355 HG23 ILE 125 3HG2 ILE 125 -3.446 -4.615 6.298 356 HD11 ILE 125 3HD1 ILE 125 -3.836 -4.344 2.636 357 HD12 ILE 125 1HD1 ILE 125 -2.875 -3.328 1.564 358 HD13 ILE 125 2HD1 ILE 125 -3.463 -2.689 3.099 359 H ARG 126 H ARG 126 -1.546 -7.470 6.165 360 HA ARG 126 HA ARG 126 -2.878 -6.992 8.516 361 HB2 ARG 126 2HB ARG 126 -1.206 -9.320 7.604 362 HB3 ARG 126 1HB ARG 126 -2.055 -9.356 9.144 363 HG2 ARG 126 2HG ARG 126 -3.565 -8.585 6.648 364 HG3 ARG 126 1HG ARG 126 -3.236 -10.288 6.963 365 HD2 ARG 126 2HD ARG 126 -4.280 -10.030 9.219 366 HD3 ARG 126 1HD ARG 126 -4.695 -8.372 8.808 367 HE ARG 126 HE ARG 126 -5.667 -10.242 6.859 368 HH11 ARG 126 1HH2 ARG 126 -6.180 -8.829 9.977 369 HH12 ARG 126 2HH2 ARG 126 -7.896 -9.070 9.964 370 HH21 ARG 126 1HH1 ARG 126 -7.928 -10.569 6.830 371 HH22 ARG 126 2HH1 ARG 126 -8.886 -10.055 8.181 372 H GLU 127 H GLU 127 0.661 -7.351 8.120 373 HA GLU 127 HA GLU 127 1.055 -7.098 10.987 374 HB2 GLU 127 2HB GLU 127 3.493 -7.119 10.385 375 HB3 GLU 127 1HB GLU 127 2.589 -8.550 9.895 376 HG2 GLU 127 2HG GLU 127 2.482 -7.818 7.627 377 HG3 GLU 127 1HG GLU 127 3.053 -6.214 8.040 378 H ALA 128 H ALA 128 1.424 -5.061 8.162 379 HA ALA 128 HA ALA 128 2.684 -2.918 9.591 380 HB1 ALA 128 1HB ALA 128 2.874 -1.953 7.522 381 HB2 ALA 128 2HB ALA 128 1.186 -2.265 7.107 382 HB3 ALA 128 3HB ALA 128 2.382 -3.546 6.952 383 H ASP 129 H ASP 129 -0.564 -3.356 8.259 384 HA ASP 129 HA ASP 129 -1.883 -1.124 8.874 385 HB2 ASP 129 2HB ASP 129 -2.948 -3.085 7.932 386 HB3 ASP 129 1HB ASP 129 -2.870 -3.912 9.475 387 H ILE 130 H ILE 130 -2.207 0.147 10.545 388 HA ILE 130 HA ILE 130 -1.452 -0.683 13.205 389 HB ILE 130 HB ILE 130 -2.806 1.871 12.288 390 HG12 ILE 130 2HG1 ILE 130 -0.722 1.533 11.134 391 HG13 ILE 130 1HG1 ILE 130 -0.507 2.785 12.356 392 HG21 ILE 130 1HG2 ILE 130 -1.620 0.931 14.890 393 HG22 ILE 130 2HG2 ILE 130 -3.073 1.894 14.606 394 HG23 ILE 130 3HG2 ILE 130 -1.485 2.635 14.454 395 HD11 ILE 130 3HD1 ILE 130 0.576 -0.010 12.275 396 HD12 ILE 130 1HD1 ILE 130 0.293 0.745 13.843 397 HD13 ILE 130 2HD1 ILE 130 1.394 1.494 12.689 398 H ASP 131 H ASP 131 -3.250 0.172 14.938 399 HA ASP 131 HA ASP 131 -5.024 -0.810 16.096 400 HB2 ASP 131 2HB ASP 131 -5.792 1.279 14.828 401 HB3 ASP 131 1HB ASP 131 -6.581 0.167 13.711 402 H GLY 132 H GLY 132 -4.011 -2.454 13.497 403 HA2 GLY 132 2HA GLY 132 -4.581 -4.404 12.412 404 HA3 GLY 132 1HA GLY 132 -5.210 -4.882 13.990 405 H ASP 133 H ASP 133 -6.170 -2.661 11.331 406 HA ASP 133 HA ASP 133 -8.955 -3.635 11.623 407 HB2 ASP 133 2HB ASP 133 -9.670 -1.516 10.743 408 HB3 ASP 133 1HB ASP 133 -8.535 -1.214 12.058 409 H GLY 134 H GLY 134 -6.284 -3.271 9.381 410 HA2 GLY 134 2HA GLY 134 -6.141 -4.785 7.494 411 HA3 GLY 134 1HA GLY 134 -7.888 -4.677 7.317 412 H GLN 135 H GLN 135 -6.809 -1.627 8.006 413 HA GLN 135 HA GLN 135 -6.295 -0.900 5.178 414 HB2 GLN 135 2HB GLN 135 -8.217 0.450 7.094 415 HB3 GLN 135 1HB GLN 135 -7.711 1.137 5.549 416 HG2 GLN 135 2HG GLN 135 -9.104 -1.536 5.896 417 HG3 GLN 135 1HG GLN 135 -9.889 -0.047 5.371 418 HE21 GLN 135 1HE2 GLN 135 -8.676 -2.856 4.138 419 HE22 GLN 135 2HE2 GLN 135 -8.190 -2.316 2.606 420 H VAL 136 H VAL 136 -4.750 0.681 4.897 421 HA VAL 136 HA VAL 136 -3.745 2.021 7.334 422 HB VAL 136 HB VAL 136 -1.691 1.053 7.256 423 HG11 VAL 136 1HG1 VAL 136 -3.213 -0.904 6.983 424 HG12 VAL 136 2HG1 VAL 136 -1.595 -1.180 6.342 425 HG13 VAL 136 3HG1 VAL 136 -2.930 -0.821 5.246 426 HG21 VAL 136 3HG2 VAL 136 -0.478 0.570 5.089 427 HG22 VAL 136 1HG2 VAL 136 -0.909 2.262 5.324 428 HG23 VAL 136 2HG2 VAL 136 -1.869 1.250 4.253 429 H ASN 137 H ASN 137 -3.095 4.055 7.099 430 HA ASN 137 HA ASN 137 -3.835 5.516 4.777 431 HB2 ASN 137 2HB ASN 137 -2.110 6.326 7.132 432 HB3 ASN 137 1HB ASN 137 -2.744 7.432 5.915 433 HD21 ASN 137 1HD2 ASN 137 -3.525 7.861 8.564 434 HD22 ASN 137 2HD2 ASN 137 -5.153 7.423 8.759 435 H TYR 138 H TYR 138 -1.490 7.315 4.698 436 HA TYR 138 HA TYR 138 -0.026 5.886 2.682 437 HB2 TYR 138 2HB TYR 138 0.781 8.581 3.744 438 HB3 TYR 138 1HB TYR 138 0.864 7.960 2.093 439 HD1 TYR 138 1HD TYR 138 -1.616 7.025 1.314 440 HD2 TYR 138 2HD TYR 138 -0.831 10.247 4.033 441 HE1 TYR 138 1HE TYR 138 -3.857 7.974 0.831 442 HE2 TYR 138 2HE TYR 138 -3.073 11.200 3.555 443 HH TYR 138 HH TYR 138 -4.740 11.063 1.558 444 H GLU 139 H GLU 139 0.950 7.472 5.733 445 HA GLU 139 HA GLU 139 3.642 6.710 5.696 446 HB2 GLU 139 2HB GLU 139 1.828 7.141 8.075 447 HB3 GLU 139 1HB GLU 139 3.589 7.055 8.153 448 HG2 GLU 139 2HG GLU 139 2.034 9.055 6.481 449 HG3 GLU 139 1HG GLU 139 2.748 9.405 8.054 450 H GLU 140 H GLU 140 1.214 5.288 7.804 451 HA GLU 140 HA GLU 140 2.296 3.050 8.777 452 HB2 GLU 140 2HB GLU 140 -0.404 3.133 7.401 453 HB3 GLU 140 1HB GLU 140 0.132 1.834 8.463 454 HG2 GLU 140 2HG GLU 140 0.321 3.381 10.325 455 HG3 GLU 140 1HG GLU 140 -0.063 4.743 9.286 456 H PHE 141 H PHE 141 1.651 3.629 5.420 457 HA PHE 141 HA PHE 141 2.331 0.905 4.591 458 HB2 PHE 141 2HB PHE 141 0.533 2.518 3.522 459 HB3 PHE 141 1HB PHE 141 1.916 3.209 2.686 460 HD1 PHE 141 1HD PHE 141 3.596 1.372 1.654 461 HD2 PHE 141 2HD PHE 141 -0.553 0.732 2.505 462 HE1 PHE 141 1HE PHE 141 3.559 -0.536 0.069 463 HE2 PHE 141 2HE PHE 141 -0.595 -1.150 0.954 464 HZ PHE 141 HZ PHE 141 1.458 -1.809 -0.284 465 H VAL 142 H VAL 142 3.461 4.229 4.002 466 HA VAL 142 HA VAL 142 5.597 4.012 2.422 467 HB VAL 142 HB VAL 142 5.468 5.525 5.028 468 HG11 VAL 142 1HG1 VAL 142 7.360 6.897 3.944 469 HG12 VAL 142 2HG1 VAL 142 7.611 5.496 2.901 470 HG13 VAL 142 3HG1 VAL 142 7.804 5.341 4.647 471 HG21 VAL 142 3HG2 VAL 142 5.452 6.678 2.247 472 HG22 VAL 142 1HG2 VAL 142 4.742 7.337 3.720 473 HG23 VAL 142 2HG2 VAL 142 3.975 5.983 2.894 474 H GLN 143 H GLN 143 5.987 3.523 5.960 475 HA GLN 143 HA GLN 143 8.555 2.701 6.095 476 HB2 GLN 143 2HB GLN 143 6.196 1.386 7.465 477 HB3 GLN 143 1HB GLN 143 7.880 1.134 7.926 478 HG2 GLN 143 2HG GLN 143 8.151 3.523 8.368 479 HG3 GLN 143 1HG GLN 143 6.494 3.827 7.840 480 HE21 GLN 143 1HE2 GLN 143 7.965 4.004 10.606 481 HE22 GLN 143 2HE2 GLN 143 6.898 3.199 11.652 482 H MET 144 H MET 144 6.010 0.216 5.755 483 HA MET 144 HA MET 144 7.551 -1.940 5.105 484 HB2 MET 144 2HB MET 144 4.877 -1.162 3.922 485 HB3 MET 144 1HB MET 144 5.612 -2.751 3.720 486 HG2 MET 144 2HG MET 144 5.012 -1.481 6.404 487 HG3 MET 144 1HG MET 144 3.970 -2.643 5.592 488 HE1 MET 144 3HE MET 144 4.317 -4.302 8.023 489 HE2 MET 144 1HE MET 144 5.030 -2.725 8.387 490 HE3 MET 144 2HE MET 144 5.918 -4.202 8.739 491 H MET 145 H MET 145 6.332 0.490 2.785 492 HA MET 145 HA MET 145 7.447 -0.657 0.477 493 HB2 MET 145 2HB MET 145 5.738 1.182 0.554 494 HB3 MET 145 1HB MET 145 7.034 2.288 1.008 495 HG2 MET 145 2HG MET 145 8.189 1.922 -1.064 496 HG3 MET 145 1HG MET 145 7.127 0.580 -1.489 497 HE1 MET 145 3HE MET 145 7.711 4.253 -1.073 498 HE2 MET 145 1HE MET 145 6.320 4.236 0.019 499 HE3 MET 145 2HE MET 145 6.221 5.071 -1.527 500 H THR 146 H THR 146 9.412 -0.508 -0.505 501 HA THR 146 HA THR 146 11.702 -0.017 1.089 502 HB THR 146 HB THR 146 12.960 -0.311 -1.030 503 HG1 THR 146 1HG THR 146 11.886 0.365 -2.703 504 HG21 THR 146 3HG2 THR 146 12.165 -2.598 -1.490 505 HG22 THR 146 1HG2 THR 146 10.659 -2.245 -0.642 506 HG23 THR 146 2HG2 THR 146 12.183 -2.275 0.244 507 H ALA 147 H ALA 147 10.227 1.837 -1.561 508 HA ALA 147 HA ALA 147 12.126 3.962 -1.462 509 HB1 ALA 147 1HB ALA 147 10.911 3.712 -3.488 510 HB2 ALA 147 2HB ALA 147 10.310 5.200 -2.761 511 HB3 ALA 147 3HB ALA 147 9.360 3.719 -2.648 512 H LYS 148 H LYS 148 12.011 5.965 -0.473 513 HA LYS 148 HA LYS 148 10.173 6.131 1.827 514 HB2 LYS 148 2HB LYS 148 12.723 7.597 1.129 515 HB3 LYS 148 1HB LYS 148 11.710 8.015 2.510 516 HG2 LYS 148 2HG LYS 148 11.956 5.713 3.383 517 HG3 LYS 148 1HG LYS 148 12.992 5.312 2.012 518 HD2 LYS 148 2HD LYS 148 14.624 6.989 2.702 519 HD3 LYS 148 1HD LYS 148 13.574 7.504 4.023 520 HE2 LYS 148 2HE LYS 148 15.117 6.042 5.062 521 HE3 LYS 148 1HE LYS 148 13.688 5.042 4.818 522 HZ1 LYS 148 3HZ LYS 148 14.682 3.851 3.179 523 HZ2 LYS 148 1HZ LYS 148 16.066 4.255 4.073 524 HZ3 LYS 148 2HZ LYS 148 15.673 5.135 2.673 Start of MODEL 13 1 H1 ASP 78 1HT ASP 78 12.625 22.491 3.301 2 H2 ASP 78 2HT ASP 78 11.161 21.961 3.984 3 H3 ASP 78 3HT ASP 78 11.192 23.333 2.980 4 HA ASP 78 HA ASP 78 10.802 22.086 1.216 5 HB2 ASP 78 2HB ASP 78 12.568 20.256 0.713 6 HB3 ASP 78 1HB ASP 78 13.116 21.930 0.788 7 H THR 79 H THR 79 9.144 20.675 0.993 8 HA THR 79 HA THR 79 9.200 18.098 2.370 9 HB THR 79 HB THR 79 8.064 19.271 4.072 10 HG1 THR 79 1HG THR 79 6.765 17.608 3.756 11 HG21 THR 79 3HG2 THR 79 6.543 20.671 1.855 12 HG22 THR 79 1HG2 THR 79 7.749 21.391 2.923 13 HG23 THR 79 2HG2 THR 79 6.201 20.854 3.576 14 H ASP 80 H ASP 80 9.272 19.172 -0.418 15 HA ASP 80 HA ASP 80 6.729 18.448 -1.594 16 HB2 ASP 80 2HB ASP 80 7.962 18.772 -3.752 17 HB3 ASP 80 1HB ASP 80 8.011 20.171 -2.683 18 H SER 81 H SER 81 9.193 16.673 -0.314 19 HA SER 81 HA SER 81 9.340 14.545 -2.271 20 HB2 SER 81 2HB SER 81 10.789 13.464 -0.716 21 HB3 SER 81 1HB SER 81 11.160 15.181 -0.603 22 HG SER 81 HG SER 81 9.601 13.578 1.134 23 H GLU 82 H GLU 82 8.114 14.731 1.070 24 HA GLU 82 HA GLU 82 6.852 12.291 1.263 25 HB2 GLU 82 2HB GLU 82 7.093 13.962 3.101 26 HB3 GLU 82 1HB GLU 82 5.835 14.936 2.344 27 HG2 GLU 82 2HG GLU 82 4.231 13.095 2.600 28 HG3 GLU 82 1HG GLU 82 5.486 12.086 3.315 29 H GLU 83 H GLU 83 6.009 15.004 -0.691 30 HA GLU 83 HA GLU 83 3.237 14.587 -0.978 31 HB2 GLU 83 2HB GLU 83 4.488 16.632 -1.679 32 HB3 GLU 83 1HB GLU 83 5.133 15.719 -3.041 33 HG2 GLU 83 2HG GLU 83 3.221 16.912 -3.858 34 HG3 GLU 83 1HG GLU 83 2.731 15.228 -3.711 35 H GLU 84 H GLU 84 5.917 13.493 -3.154 36 HA GLU 84 HA GLU 84 4.405 12.139 -5.029 37 HB2 GLU 84 2HB GLU 84 6.891 12.308 -5.107 38 HB3 GLU 84 1HB GLU 84 6.988 11.116 -3.812 39 HG2 GLU 84 2HG GLU 84 5.828 9.465 -5.225 40 HG3 GLU 84 1HG GLU 84 5.690 10.656 -6.516 41 H ILE 85 H ILE 85 5.518 10.960 -1.872 42 HA ILE 85 HA ILE 85 4.492 8.357 -1.965 43 HB ILE 85 HB ILE 85 4.550 10.197 0.451 44 HG12 ILE 85 2HG1 ILE 85 6.718 8.379 -0.643 45 HG13 ILE 85 1HG1 ILE 85 6.737 10.143 -0.709 46 HG21 ILE 85 1HG2 ILE 85 4.721 8.163 1.750 47 HG22 ILE 85 2HG2 ILE 85 4.817 7.182 0.289 48 HG23 ILE 85 3HG2 ILE 85 3.321 8.022 0.693 49 HD11 ILE 85 3HD1 ILE 85 6.899 8.360 1.723 50 HD12 ILE 85 1HD1 ILE 85 6.442 10.058 1.858 51 HD13 ILE 85 2HD1 ILE 85 8.024 9.618 1.214 52 H ARG 86 H ARG 86 2.969 11.361 -0.786 53 HA ARG 86 HA ARG 86 0.478 10.260 -0.113 54 HB2 ARG 86 2HB ARG 86 1.268 13.041 -1.011 55 HB3 ARG 86 1HB ARG 86 -0.355 12.647 -0.448 56 HG2 ARG 86 2HG ARG 86 0.865 11.666 1.652 57 HG3 ARG 86 1HG ARG 86 2.243 12.610 1.094 58 HD2 ARG 86 2HD ARG 86 -0.464 13.599 1.960 59 HD3 ARG 86 1HD ARG 86 1.116 14.028 2.605 60 HE ARG 86 HE ARG 86 1.269 14.859 0.029 61 HH11 ARG 86 1HH2 ARG 86 -0.998 15.316 2.628 62 HH12 ARG 86 2HH2 ARG 86 -1.567 16.843 2.040 63 HH21 ARG 86 1HH1 ARG 86 0.510 16.863 -0.738 64 HH22 ARG 86 2HH1 ARG 86 -0.715 17.716 0.139 65 H GLU 87 H GLU 87 1.715 11.394 -3.223 66 HA GLU 87 HA GLU 87 -0.807 11.127 -4.579 67 HB2 GLU 87 2HB GLU 87 2.030 11.443 -5.574 68 HB3 GLU 87 1HB GLU 87 0.621 11.393 -6.635 69 HG2 GLU 87 2HG GLU 87 0.943 13.358 -4.352 70 HG3 GLU 87 1HG GLU 87 1.356 13.724 -6.026 71 H ALA 88 H ALA 88 2.243 9.411 -5.128 72 HA ALA 88 HA ALA 88 1.527 7.349 -6.702 73 HB1 ALA 88 1HB ALA 88 3.208 5.931 -5.457 74 HB2 ALA 88 2HB ALA 88 3.318 7.232 -4.272 75 HB3 ALA 88 3HB ALA 88 3.794 7.523 -5.945 76 H PHE 89 H PHE 89 1.185 7.243 -3.137 77 HA PHE 89 HA PHE 89 -0.146 4.751 -3.114 78 HB2 PHE 89 2HB PHE 89 0.279 6.960 -1.157 79 HB3 PHE 89 1HB PHE 89 -0.939 5.744 -0.773 80 HD1 PHE 89 2HD PHE 89 -0.241 3.261 -0.919 81 HD2 PHE 89 1HD PHE 89 2.575 6.486 -0.834 82 HE1 PHE 89 2HE PHE 89 1.550 1.683 -0.260 83 HE2 PHE 89 1HE PHE 89 4.361 4.926 -0.173 84 HZ PHE 89 HZ PHE 89 3.859 2.519 0.110 85 H ARG 90 H ARG 90 -1.397 8.111 -3.072 86 HA ARG 90 HA ARG 90 -4.111 7.538 -2.752 87 HB2 ARG 90 2HB ARG 90 -2.561 9.738 -3.996 88 HB3 ARG 90 1HB ARG 90 -4.260 9.643 -4.450 89 HG2 ARG 90 2HG ARG 90 -4.893 9.634 -2.051 90 HG3 ARG 90 1HG ARG 90 -3.191 9.752 -1.601 91 HD2 ARG 90 2HD ARG 90 -3.032 11.858 -2.851 92 HD3 ARG 90 1HD ARG 90 -4.736 11.748 -3.255 93 HE ARG 90 HE ARG 90 -3.605 12.504 -0.677 94 HH11 ARG 90 1HH2 ARG 90 -6.355 11.381 -2.470 95 HH12 ARG 90 2HH2 ARG 90 -7.511 11.907 -1.296 96 HH21 ARG 90 1HH1 ARG 90 -5.137 13.228 0.863 97 HH22 ARG 90 2HH1 ARG 90 -6.823 12.956 0.588 98 H VAL 91 H VAL 91 -2.163 7.597 -5.715 99 HA VAL 91 HA VAL 91 -4.233 6.964 -7.526 100 HB VAL 91 HB VAL 91 -1.252 6.459 -7.670 101 HG11 VAL 91 1HG1 VAL 91 -3.441 6.203 -9.743 102 HG12 VAL 91 2HG1 VAL 91 -2.266 4.981 -9.254 103 HG13 VAL 91 3HG1 VAL 91 -1.739 6.392 -10.169 104 HG21 VAL 91 3HG2 VAL 91 -2.913 8.586 -9.039 105 HG22 VAL 91 1HG2 VAL 91 -1.157 8.507 -8.903 106 HG23 VAL 91 2HG2 VAL 91 -2.137 8.849 -7.477 107 H PHE 92 H PHE 92 -1.950 4.958 -5.725 108 HA PHE 92 HA PHE 92 -2.515 2.457 -6.820 109 HB2 PHE 92 2HB PHE 92 -1.509 3.434 -4.195 110 HB3 PHE 92 1HB PHE 92 -2.037 1.759 -4.227 111 HD1 PHE 92 1HD PHE 92 -0.485 3.777 -6.972 112 HD2 PHE 92 2HD PHE 92 -0.003 0.564 -4.162 113 HE1 PHE 92 1HE PHE 92 1.631 3.120 -8.088 114 HE2 PHE 92 2HE PHE 92 2.111 -0.090 -5.272 115 HZ PHE 92 HZ PHE 92 2.928 1.184 -7.237 116 H ASP 93 H ASP 93 -4.096 3.940 -3.961 117 HA ASP 93 HA ASP 93 -5.947 1.931 -3.469 118 HB2 ASP 93 2HB ASP 93 -5.684 3.848 -1.984 119 HB3 ASP 93 1HB ASP 93 -6.299 4.926 -3.227 120 H LYS 94 H LYS 94 -6.633 1.032 -5.433 121 HA LYS 94 HA LYS 94 -7.551 2.169 -7.711 122 HB2 LYS 94 2HB LYS 94 -7.786 -0.366 -6.491 123 HB3 LYS 94 1HB LYS 94 -9.441 0.073 -6.889 124 HG2 LYS 94 2HG LYS 94 -8.694 -1.015 -8.829 125 HG3 LYS 94 1HG LYS 94 -8.473 0.691 -9.231 126 HD2 LYS 94 2HD LYS 94 -6.089 0.476 -8.407 127 HD3 LYS 94 1HD LYS 94 -6.359 -1.264 -8.285 128 HE2 LYS 94 2HE LYS 94 -6.586 0.414 -10.796 129 HE3 LYS 94 1HE LYS 94 -5.324 -0.763 -10.433 130 HZ1 LYS 94 3HZ LYS 94 -7.909 -1.191 -11.506 131 HZ2 LYS 94 1HZ LYS 94 -7.717 -2.079 -10.074 132 HZ3 LYS 94 2HZ LYS 94 -6.617 -2.283 -11.353 133 H ASP 95 H ASP 95 -9.496 1.612 -4.816 134 HA ASP 95 HA ASP 95 -11.858 2.875 -5.781 135 HB2 ASP 95 2HB ASP 95 -10.963 2.416 -2.929 136 HB3 ASP 95 1HB ASP 95 -12.614 2.713 -3.470 137 H GLY 96 H GLY 96 -8.912 4.014 -4.400 138 HA2 GLY 96 2HA GLY 96 -8.143 6.106 -3.818 139 HA3 GLY 96 1HA GLY 96 -9.250 6.683 -5.056 140 H ASN 97 H ASN 97 -9.584 5.297 -1.752 141 HA ASN 97 HA ASN 97 -11.448 7.521 -1.133 142 HB2 ASN 97 2HB ASN 97 -12.316 5.921 0.647 143 HB3 ASN 97 1HB ASN 97 -12.706 5.543 -1.027 144 HD21 ASN 97 1HD2 ASN 97 -9.910 4.887 1.167 145 HD22 ASN 97 2HD2 ASN 97 -9.817 3.240 0.775 146 H GLY 98 H GLY 98 -8.348 7.074 -0.739 147 HA2 GLY 98 2HA GLY 98 -6.922 8.172 0.730 148 HA3 GLY 98 1HA GLY 98 -8.294 8.508 1.778 149 H TYR 99 H TYR 99 -7.464 5.310 0.602 150 HA TYR 99 HA TYR 99 -6.074 4.535 3.010 151 HB2 TYR 99 2HB TYR 99 -8.892 3.579 2.491 152 HB3 TYR 99 1HB TYR 99 -7.781 2.784 3.596 153 HD1 TYR 99 1HD TYR 99 -6.975 3.943 5.630 154 HD2 TYR 99 2HD TYR 99 -9.910 5.709 3.034 155 HE1 TYR 99 1HE TYR 99 -7.559 5.580 7.400 156 HE2 TYR 99 2HE TYR 99 -10.492 7.345 4.803 157 HH TYR 99 HH TYR 99 -10.166 7.961 6.917 158 H ILE 100 H ILE 100 -5.439 2.172 2.907 159 HA ILE 100 HA ILE 100 -5.461 1.167 0.111 160 HB ILE 100 HB ILE 100 -3.124 1.149 2.037 161 HG12 ILE 100 2HG1 ILE 100 -3.805 3.410 0.935 162 HG13 ILE 100 1HG1 ILE 100 -2.139 2.881 0.712 163 HG21 ILE 100 1HG2 ILE 100 -2.869 -0.750 0.671 164 HG22 ILE 100 2HG2 ILE 100 -1.939 0.486 -0.177 165 HG23 ILE 100 3HG2 ILE 100 -3.553 0.056 -0.741 166 HD11 ILE 100 3HD1 ILE 100 -2.494 2.226 -1.507 167 HD12 ILE 100 1HD1 ILE 100 -3.405 3.723 -1.376 168 HD13 ILE 100 2HD1 ILE 100 -4.241 2.174 -1.331 169 H SER 101 H SER 101 -6.156 -0.816 -0.143 170 HA SER 101 HA SER 101 -6.248 -2.616 2.208 171 HB2 SER 101 2HB SER 101 -8.176 -3.579 1.347 172 HB3 SER 101 1HB SER 101 -8.359 -1.925 0.770 173 HG SER 101 HG SER 101 -8.277 -4.113 -0.650 174 H ALA 102 H ALA 102 -5.961 -4.921 1.738 175 HA ALA 102 HA ALA 102 -3.503 -5.400 0.413 176 HB1 ALA 102 1HB ALA 102 -4.494 -7.920 0.814 177 HB2 ALA 102 2HB ALA 102 -5.498 -6.996 1.926 178 HB3 ALA 102 3HB ALA 102 -3.747 -6.961 2.096 179 H ALA 103 H ALA 103 -6.856 -6.032 -0.525 180 HA ALA 103 HA ALA 103 -6.371 -7.649 -2.730 181 HB1 ALA 103 1HB ALA 103 -8.581 -5.609 -2.704 182 HB2 ALA 103 2HB ALA 103 -8.585 -6.945 -1.554 183 HB3 ALA 103 3HB ALA 103 -8.605 -7.272 -3.281 184 H GLU 104 H GLU 104 -6.237 -4.142 -2.412 185 HA GLU 104 HA GLU 104 -6.114 -3.567 -5.193 186 HB2 GLU 104 2HB GLU 104 -5.137 -1.963 -2.817 187 HB3 GLU 104 1HB GLU 104 -5.297 -1.346 -4.463 188 HG2 GLU 104 2HG GLU 104 -7.704 -1.876 -4.424 189 HG3 GLU 104 1HG GLU 104 -7.533 -2.493 -2.784 190 H LEU 105 H LEU 105 -3.661 -4.329 -2.754 191 HA LEU 105 HA LEU 105 -1.396 -3.532 -4.255 192 HB2 LEU 105 2HB LEU 105 -1.531 -5.769 -2.245 193 HB3 LEU 105 1HB LEU 105 -0.115 -4.822 -2.691 194 HG LEU 105 HG LEU 105 -2.587 -3.845 -1.249 195 HD11 LEU 105 1HD1 LEU 105 -1.106 -4.951 0.268 196 HD12 LEU 105 2HD1 LEU 105 -0.813 -3.226 0.471 197 HD13 LEU 105 3HD1 LEU 105 0.312 -4.205 -0.466 198 HD21 LEU 105 3HD2 LEU 105 -2.018 -2.020 -2.635 199 HD22 LEU 105 1HD2 LEU 105 -0.292 -2.351 -2.522 200 HD23 LEU 105 2HD2 LEU 105 -1.155 -1.678 -1.142 201 H ARG 106 H ARG 106 -2.815 -6.794 -3.833 202 HA ARG 106 HA ARG 106 -1.057 -8.061 -5.624 203 HB2 ARG 106 2HB ARG 106 -2.766 -9.853 -5.722 204 HB3 ARG 106 1HB ARG 106 -2.413 -9.351 -4.071 205 HG2 ARG 106 2HG ARG 106 -4.433 -7.864 -4.152 206 HG3 ARG 106 1HG ARG 106 -4.811 -8.525 -5.741 207 HD2 ARG 106 2HD ARG 106 -4.828 -10.814 -4.703 208 HD3 ARG 106 1HD ARG 106 -4.643 -10.037 -3.133 209 HE ARG 106 HE ARG 106 -6.830 -8.859 -4.441 210 HH11 ARG 106 1HH2 ARG 106 -5.837 -11.886 -3.015 211 HH12 ARG 106 2HH2 ARG 106 -7.453 -12.388 -2.643 212 HH21 ARG 106 1HH1 ARG 106 -8.946 -9.536 -3.952 213 HH22 ARG 106 2HH1 ARG 106 -9.208 -11.061 -3.172 214 H HIS 107 H HIS 107 -4.292 -6.639 -6.178 215 HA HIS 107 HA HIS 107 -4.475 -7.336 -8.904 216 HB2 HIS 107 2HB HIS 107 -6.377 -6.590 -7.505 217 HB3 HIS 107 1HB HIS 107 -5.687 -4.969 -7.466 218 HD1 HIS 107 1HD HIS 107 -7.279 -7.442 -9.839 219 HD2 HIS 107 2HD HIS 107 -6.089 -3.447 -9.799 220 HE1 HIS 107 1HE HIS 107 -8.184 -6.401 -11.967 221 HE2 HIS 107 2HE HIS 107 -7.471 -3.966 -11.954 222 H VAL 108 H VAL 108 -3.506 -4.249 -7.396 223 HA VAL 108 HA VAL 108 -2.870 -2.979 -9.843 224 HB VAL 108 HB VAL 108 -3.226 -1.887 -7.534 225 HG11 VAL 108 1HG1 VAL 108 -1.411 -3.306 -6.501 226 HG12 VAL 108 2HG1 VAL 108 -1.321 -1.586 -6.135 227 HG13 VAL 108 3HG1 VAL 108 -0.238 -2.294 -7.336 228 HG21 VAL 108 3HG2 VAL 108 -1.599 -0.042 -8.118 229 HG22 VAL 108 1HG2 VAL 108 -2.659 -0.538 -9.437 230 HG23 VAL 108 2HG2 VAL 108 -0.983 -1.087 -9.398 231 H MET 109 H MET 109 -0.793 -4.690 -7.497 232 HA MET 109 HA MET 109 1.652 -4.267 -8.804 233 HB2 MET 109 2HB MET 109 0.631 -6.512 -7.065 234 HB3 MET 109 1HB MET 109 2.267 -6.503 -7.704 235 HG2 MET 109 2HG MET 109 1.128 -4.186 -6.135 236 HG3 MET 109 1HG MET 109 2.027 -5.493 -5.383 237 HE1 MET 109 3HE MET 109 4.227 -2.314 -5.426 238 HE2 MET 109 1HE MET 109 4.314 -3.850 -4.553 239 HE3 MET 109 2HE MET 109 2.767 -3.029 -4.746 240 H THR 110 H THR 110 -0.667 -6.963 -9.131 241 HA THR 110 HA THR 110 0.722 -8.319 -11.186 242 HB THR 110 HB THR 110 -2.235 -8.274 -10.541 243 HG1 THR 110 1HG THR 110 -0.164 -9.242 -9.252 244 HG21 THR 110 3HG2 THR 110 -0.560 -9.977 -12.390 245 HG22 THR 110 1HG2 THR 110 -2.078 -9.144 -12.738 246 HG23 THR 110 2HG2 THR 110 -2.072 -10.575 -11.708 247 H ASN 111 H ASN 111 -1.788 -5.838 -11.232 248 HA ASN 111 HA ASN 111 -2.178 -5.738 -14.033 249 HB2 ASN 111 2HB ASN 111 -3.633 -4.698 -12.244 250 HB3 ASN 111 1HB ASN 111 -2.438 -3.412 -12.126 251 HD21 ASN 111 1HD2 ASN 111 -3.732 -1.725 -13.049 252 HD22 ASN 111 2HD2 ASN 111 -4.273 -1.757 -14.657 253 H LEU 112 H LEU 112 0.041 -4.087 -11.869 254 HA LEU 112 HA LEU 112 1.153 -2.250 -13.668 255 HB2 LEU 112 2HB LEU 112 2.068 -3.564 -11.132 256 HB3 LEU 112 1HB LEU 112 3.227 -2.601 -12.048 257 HG LEU 112 HG LEU 112 0.501 -1.472 -11.393 258 HD11 LEU 112 1HD1 LEU 112 2.870 -1.757 -9.546 259 HD12 LEU 112 2HD1 LEU 112 1.164 -2.035 -9.208 260 HD13 LEU 112 3HD1 LEU 112 1.766 -0.391 -9.383 261 HD21 LEU 112 3HD2 LEU 112 1.829 -0.166 -12.946 262 HD22 LEU 112 1HD2 LEU 112 3.263 -0.312 -11.928 263 HD23 LEU 112 2HD2 LEU 112 1.893 0.657 -11.389 264 H GLY 113 H GLY 113 1.853 -5.635 -13.026 265 HA2 GLY 113 2HA GLY 113 2.625 -6.706 -15.251 266 HA3 GLY 113 1HA GLY 113 3.982 -5.597 -15.087 267 H GLU 114 H GLU 114 3.115 -6.372 -12.006 268 HA GLU 114 HA GLU 114 4.935 -8.725 -11.901 269 HB2 GLU 114 2HB GLU 114 5.949 -6.589 -11.048 270 HB3 GLU 114 1HB GLU 114 4.693 -6.556 -9.806 271 HG2 GLU 114 2HG GLU 114 5.424 -8.698 -8.946 272 HG3 GLU 114 1HG GLU 114 6.595 -8.869 -10.247 273 H LYS 115 H LYS 115 3.808 -10.454 -11.352 274 HA LYS 115 HA LYS 115 1.295 -10.252 -9.909 275 HB2 LYS 115 2HB LYS 115 1.545 -11.831 -11.780 276 HB3 LYS 115 1HB LYS 115 2.797 -12.694 -10.886 277 HG2 LYS 115 2HG LYS 115 1.188 -13.235 -9.108 278 HG3 LYS 115 1HG LYS 115 -0.063 -12.314 -9.941 279 HD2 LYS 115 2HD LYS 115 0.075 -13.839 -11.864 280 HD3 LYS 115 1HD LYS 115 1.354 -14.751 -11.058 281 HE2 LYS 115 2HE LYS 115 -0.637 -15.970 -10.607 282 HE3 LYS 115 1HE LYS 115 -0.317 -15.066 -9.127 283 HZ1 LYS 115 3HZ LYS 115 -2.552 -14.928 -10.847 284 HZ2 LYS 115 1HZ LYS 115 -1.804 -13.407 -10.765 285 HZ3 LYS 115 2HZ LYS 115 -2.314 -14.180 -9.340 286 H LEU 116 H LEU 116 1.705 -9.646 -7.816 287 HA LEU 116 HA LEU 116 3.712 -10.837 -6.163 288 HB2 LEU 116 2HB LEU 116 1.463 -8.906 -5.816 289 HB3 LEU 116 1HB LEU 116 2.013 -9.724 -4.362 290 HG LEU 116 HG LEU 116 3.115 -7.474 -4.950 291 HD11 LEU 116 1HD1 LEU 116 5.067 -9.748 -4.627 292 HD12 LEU 116 2HD1 LEU 116 3.983 -9.246 -3.328 293 HD13 LEU 116 3HD1 LEU 116 5.170 -8.114 -3.973 294 HD21 LEU 116 3HD2 LEU 116 4.973 -9.017 -6.735 295 HD22 LEU 116 1HD2 LEU 116 4.621 -7.290 -6.705 296 HD23 LEU 116 2HD2 LEU 116 3.474 -8.411 -7.433 297 H THR 117 H THR 117 2.829 -11.668 -3.903 298 HA THR 117 HA THR 117 1.053 -13.958 -4.527 299 HB THR 117 HB THR 117 2.119 -14.982 -2.483 300 HG1 THR 117 1HG THR 117 3.012 -13.339 -1.416 301 HG21 THR 117 3HG2 THR 117 2.888 -15.717 -4.626 302 HG22 THR 117 1HG2 THR 117 4.331 -15.390 -3.668 303 HG23 THR 117 2HG2 THR 117 3.798 -14.228 -4.882 304 H ASP 118 H ASP 118 -0.879 -14.031 -3.593 305 HA ASP 118 HA ASP 118 -1.987 -11.973 -2.084 306 HB2 ASP 118 2HB ASP 118 -3.163 -13.882 -3.335 307 HB3 ASP 118 1HB ASP 118 -2.912 -14.836 -1.879 308 H GLU 119 H GLU 119 -0.399 -14.952 -1.044 309 HA GLU 119 HA GLU 119 -1.046 -14.775 1.706 310 HB2 GLU 119 2HB GLU 119 1.400 -16.037 0.444 311 HB3 GLU 119 1HB GLU 119 0.733 -16.397 2.039 312 HG2 GLU 119 2HG GLU 119 -1.397 -17.118 0.938 313 HG3 GLU 119 1HG GLU 119 -0.641 -16.847 -0.627 314 H GLU 120 H GLU 120 1.615 -13.433 -0.224 315 HA GLU 120 HA GLU 120 3.019 -12.375 2.071 316 HB2 GLU 120 2HB GLU 120 4.160 -12.936 -0.083 317 HB3 GLU 120 1HB GLU 120 3.294 -11.600 -0.841 318 HG2 GLU 120 2HG GLU 120 4.314 -10.017 0.734 319 HG3 GLU 120 1HG GLU 120 5.162 -11.340 1.532 320 H VAL 121 H VAL 121 1.004 -11.022 -0.529 321 HA VAL 121 HA VAL 121 0.979 -8.347 0.294 322 HB VAL 121 HB VAL 121 -1.010 -10.074 -1.177 323 HG11 VAL 121 1HG1 VAL 121 -2.456 -8.519 -0.089 324 HG12 VAL 121 2HG1 VAL 121 -2.203 -7.896 -1.716 325 HG13 VAL 121 3HG1 VAL 121 -1.335 -7.185 -0.355 326 HG21 VAL 121 3HG2 VAL 121 0.542 -7.626 -2.052 327 HG22 VAL 121 1HG2 VAL 121 -0.340 -8.755 -3.083 328 HG23 VAL 121 2HG2 VAL 121 1.129 -9.274 -2.252 329 H ASP 122 H ASP 122 -1.610 -10.728 0.867 330 HA ASP 122 HA ASP 122 -3.123 -9.375 2.707 331 HB2 ASP 122 2HB ASP 122 -3.672 -11.594 1.752 332 HB3 ASP 122 1HB ASP 122 -2.421 -12.323 2.754 333 H GLU 123 H GLU 123 -0.196 -11.320 3.353 334 HA GLU 123 HA GLU 123 -0.262 -10.824 6.175 335 HB2 GLU 123 2HB GLU 123 1.852 -11.903 4.310 336 HB3 GLU 123 1HB GLU 123 2.144 -11.666 6.035 337 HG2 GLU 123 2HG GLU 123 -0.167 -13.283 4.935 338 HG3 GLU 123 1HG GLU 123 1.374 -13.990 5.411 339 H MET 124 H MET 124 1.200 -9.233 3.406 340 HA MET 124 HA MET 124 3.141 -7.640 4.565 341 HB2 MET 124 2HB MET 124 2.512 -7.830 2.098 342 HB3 MET 124 1HB MET 124 1.231 -6.670 2.435 343 HG2 MET 124 2HG MET 124 2.880 -5.039 3.223 344 HG3 MET 124 1HG MET 124 4.179 -6.194 2.928 345 HE1 MET 124 3HE MET 124 5.678 -5.357 0.959 346 HE2 MET 124 1HE MET 124 5.007 -3.972 1.829 347 HE3 MET 124 2HE MET 124 5.075 -3.962 0.067 348 H ILE 125 H ILE 125 -0.107 -6.424 3.760 349 HA ILE 125 HA ILE 125 0.046 -4.101 5.310 350 HB ILE 125 HB ILE 125 -2.274 -5.754 4.310 351 HG12 ILE 125 2HG1 ILE 125 -1.339 -2.939 3.680 352 HG13 ILE 125 1HG1 ILE 125 -0.942 -4.365 2.722 353 HG21 ILE 125 1HG2 ILE 125 -2.346 -3.390 6.179 354 HG22 ILE 125 2HG2 ILE 125 -3.287 -4.876 6.242 355 HG23 ILE 125 3HG2 ILE 125 -3.668 -3.642 5.037 356 HD11 ILE 125 3HD1 ILE 125 -3.613 -3.017 3.091 357 HD12 ILE 125 1HD1 ILE 125 -3.541 -4.714 2.630 358 HD13 ILE 125 2HD1 ILE 125 -2.824 -3.484 1.588 359 H ARG 126 H ARG 126 -1.266 -7.298 6.161 360 HA ARG 126 HA ARG 126 -2.373 -6.842 8.590 361 HB2 ARG 126 2HB ARG 126 -0.685 -9.121 7.604 362 HB3 ARG 126 1HB ARG 126 -1.433 -9.169 9.197 363 HG2 ARG 126 2HG ARG 126 -3.139 -8.462 6.812 364 HG3 ARG 126 1HG ARG 126 -2.723 -10.155 7.088 365 HD2 ARG 126 2HD ARG 126 -4.049 -8.322 9.111 366 HD3 ARG 126 1HD ARG 126 -4.869 -9.565 8.170 367 HE ARG 126 HE ARG 126 -3.135 -9.983 10.465 368 HH11 ARG 126 1HH2 ARG 126 -4.635 -11.277 7.628 369 HH12 ARG 126 2HH2 ARG 126 -4.565 -12.922 8.168 370 HH21 ARG 126 1HH1 ARG 126 -3.045 -12.144 11.195 371 HH22 ARG 126 2HH1 ARG 126 -3.663 -13.412 10.191 372 H GLU 127 H GLU 127 1.109 -6.997 7.931 373 HA GLU 127 HA GLU 127 1.802 -6.853 10.720 374 HB2 GLU 127 2HB GLU 127 3.446 -6.471 8.214 375 HB3 GLU 127 1HB GLU 127 4.111 -6.454 9.847 376 HG2 GLU 127 2HG GLU 127 3.307 -8.733 10.237 377 HG3 GLU 127 1HG GLU 127 2.543 -8.758 8.649 378 H ALA 128 H ALA 128 2.086 -4.538 8.024 379 HA ALA 128 HA ALA 128 2.916 -2.346 9.569 380 HB1 ALA 128 1HB ALA 128 3.069 -1.472 7.495 381 HB2 ALA 128 2HB ALA 128 1.311 -1.380 7.378 382 HB3 ALA 128 3HB ALA 128 2.164 -2.829 6.848 383 H ASP 129 H ASP 129 -0.354 -3.232 8.492 384 HA ASP 129 HA ASP 129 -1.897 -1.212 9.402 385 HB2 ASP 129 2HB ASP 129 -2.484 -3.626 8.498 386 HB3 ASP 129 1HB ASP 129 -2.742 -3.983 10.198 387 H ILE 130 H ILE 130 -2.063 -0.134 11.233 388 HA ILE 130 HA ILE 130 -1.122 -1.394 13.750 389 HB ILE 130 HB ILE 130 -1.613 1.545 13.230 390 HG12 ILE 130 2HG1 ILE 130 0.924 -0.105 12.982 391 HG13 ILE 130 1HG1 ILE 130 0.108 0.737 11.670 392 HG21 ILE 130 1HG2 ILE 130 0.118 0.128 15.288 393 HG22 ILE 130 2HG2 ILE 130 -1.528 0.667 15.613 394 HG23 ILE 130 3HG2 ILE 130 -0.274 1.845 15.237 395 HD11 ILE 130 3HD1 ILE 130 0.466 2.893 12.928 396 HD12 ILE 130 1HD1 ILE 130 1.953 2.128 12.378 397 HD13 ILE 130 2HD1 ILE 130 1.472 2.001 14.069 398 H ASP 131 H ASP 131 -3.882 -0.013 12.180 399 HA ASP 131 HA ASP 131 -5.457 0.152 14.648 400 HB2 ASP 131 2HB ASP 131 -5.632 1.853 12.803 401 HB3 ASP 131 1HB ASP 131 -6.361 0.604 11.797 402 H GLY 132 H GLY 132 -4.967 -1.962 11.958 403 HA2 GLY 132 2HA GLY 132 -5.609 -4.190 11.690 404 HA3 GLY 132 1HA GLY 132 -6.519 -4.074 13.192 405 H ASP 133 H ASP 133 -6.987 -1.712 10.698 406 HA ASP 133 HA ASP 133 -9.758 -2.620 10.332 407 HB2 ASP 133 2HB ASP 133 -10.073 -0.374 9.333 408 HB3 ASP 133 1HB ASP 133 -9.432 -0.301 10.976 409 H GLY 134 H GLY 134 -7.546 -4.039 9.045 410 HA2 GLY 134 2HA GLY 134 -6.939 -4.892 7.001 411 HA3 GLY 134 1HA GLY 134 -8.605 -4.558 6.546 412 H GLN 135 H GLN 135 -6.824 -1.805 7.508 413 HA GLN 135 HA GLN 135 -5.871 -1.212 4.819 414 HB2 GLN 135 2HB GLN 135 -8.077 0.346 6.177 415 HB3 GLN 135 1HB GLN 135 -7.069 1.042 4.908 416 HG2 GLN 135 2HG GLN 135 -7.703 -0.896 3.430 417 HG3 GLN 135 1HG GLN 135 -8.823 -1.422 4.681 418 HE21 GLN 135 1HE2 GLN 135 -10.506 0.359 5.342 419 HE22 GLN 135 2HE2 GLN 135 -11.107 1.325 4.082 420 H VAL 136 H VAL 136 -4.482 0.623 4.718 421 HA VAL 136 HA VAL 136 -3.558 1.670 7.326 422 HB VAL 136 HB VAL 136 -1.353 1.012 7.048 423 HG11 VAL 136 1HG1 VAL 136 -2.897 -0.940 7.327 424 HG12 VAL 136 2HG1 VAL 136 -1.336 -1.331 6.608 425 HG13 VAL 136 3HG1 VAL 136 -2.770 -1.203 5.589 426 HG21 VAL 136 3HG2 VAL 136 -0.840 1.839 4.899 427 HG22 VAL 136 1HG2 VAL 136 -2.007 0.779 4.116 428 HG23 VAL 136 2HG2 VAL 136 -0.519 0.110 4.794 429 H ASN 137 H ASN 137 -2.630 3.679 7.254 430 HA ASN 137 HA ASN 137 -3.427 5.364 5.088 431 HB2 ASN 137 2HB ASN 137 -1.637 5.937 7.457 432 HB3 ASN 137 1HB ASN 137 -2.284 7.149 6.355 433 HD21 ASN 137 1HD2 ASN 137 -2.833 6.527 9.335 434 HD22 ASN 137 2HD2 ASN 137 -4.526 6.454 9.418 435 H TYR 138 H TYR 138 -1.069 7.098 5.125 436 HA TYR 138 HA TYR 138 0.368 5.851 2.965 437 HB2 TYR 138 2HB TYR 138 0.860 8.502 4.338 438 HB3 TYR 138 1HB TYR 138 1.492 8.001 2.769 439 HD1 TYR 138 1HD TYR 138 -0.371 7.126 1.070 440 HD2 TYR 138 2HD TYR 138 -1.110 9.784 4.360 441 HE1 TYR 138 1HE TYR 138 -2.443 7.930 -0.045 442 HE2 TYR 138 2HE TYR 138 -3.180 10.584 3.252 443 HH TYR 138 HH TYR 138 -4.014 10.704 0.785 444 H GLU 139 H GLU 139 1.400 7.157 6.155 445 HA GLU 139 HA GLU 139 4.075 6.309 5.963 446 HB2 GLU 139 2HB GLU 139 2.317 6.853 8.353 447 HB3 GLU 139 1HB GLU 139 4.044 6.504 8.481 448 HG2 GLU 139 2HG GLU 139 4.546 8.396 6.986 449 HG3 GLU 139 1HG GLU 139 2.823 8.741 6.838 450 H GLU 140 H GLU 140 1.636 4.866 8.081 451 HA GLU 140 HA GLU 140 2.661 2.556 8.957 452 HB2 GLU 140 2HB GLU 140 -0.003 2.824 7.569 453 HB3 GLU 140 1HB GLU 140 0.462 1.389 8.472 454 HG2 GLU 140 2HG GLU 140 0.696 2.705 10.508 455 HG3 GLU 140 1HG GLU 140 0.383 4.196 9.619 456 H PHE 141 H PHE 141 1.918 3.278 5.609 457 HA PHE 141 HA PHE 141 2.611 0.630 4.636 458 HB2 PHE 141 2HB PHE 141 0.934 2.448 3.636 459 HB3 PHE 141 1HB PHE 141 2.385 3.012 2.821 460 HD1 PHE 141 1HD PHE 141 3.898 0.988 1.837 461 HD2 PHE 141 2HD PHE 141 -0.331 0.853 2.516 462 HE1 PHE 141 1HE PHE 141 3.690 -0.861 0.198 463 HE2 PHE 141 2HE PHE 141 -0.539 -0.985 0.916 464 HZ PHE 141 HZ PHE 141 1.461 -1.850 -0.272 465 H VAL 142 H VAL 142 3.896 3.939 4.089 466 HA VAL 142 HA VAL 142 6.155 3.549 2.651 467 HB VAL 142 HB VAL 142 5.963 5.148 5.203 468 HG11 VAL 142 1HG1 VAL 142 8.042 5.136 3.003 469 HG12 VAL 142 2HG1 VAL 142 8.314 4.851 4.723 470 HG13 VAL 142 3HG1 VAL 142 7.860 6.458 4.153 471 HG21 VAL 142 3HG2 VAL 142 4.472 5.507 2.994 472 HG22 VAL 142 1HG2 VAL 142 5.938 6.309 2.430 473 HG23 VAL 142 2HG2 VAL 142 5.125 6.878 3.886 474 H GLN 143 H GLN 143 6.272 3.314 6.225 475 HA GLN 143 HA GLN 143 8.744 2.259 6.634 476 HB2 GLN 143 2HB GLN 143 6.111 1.711 7.983 477 HB3 GLN 143 1HB GLN 143 7.557 0.857 8.514 478 HG2 GLN 143 2HG GLN 143 7.064 3.003 9.765 479 HG3 GLN 143 1HG GLN 143 8.672 2.909 9.056 480 HE21 GLN 143 1HE2 GLN 143 5.954 4.913 9.312 481 HE22 GLN 143 2HE2 GLN 143 6.266 5.929 7.991 482 H MET 144 H MET 144 6.304 0.782 4.814 483 HA MET 144 HA MET 144 7.437 -1.921 5.020 484 HB2 MET 144 2HB MET 144 5.017 -1.048 3.433 485 HB3 MET 144 1HB MET 144 5.500 -2.684 3.861 486 HG2 MET 144 2HG MET 144 4.725 -0.524 5.841 487 HG3 MET 144 1HG MET 144 3.724 -1.893 5.357 488 HE1 MET 144 3HE MET 144 3.923 -4.338 7.000 489 HE2 MET 144 1HE MET 144 5.487 -4.953 6.448 490 HE3 MET 144 2HE MET 144 4.413 -4.129 5.319 491 H MET 145 H MET 145 6.600 0.509 2.531 492 HA MET 145 HA MET 145 7.519 -0.717 0.254 493 HB2 MET 145 2HB MET 145 6.552 1.646 0.540 494 HB3 MET 145 1HB MET 145 8.210 2.164 0.831 495 HG2 MET 145 2HG MET 145 8.722 0.864 -1.404 496 HG3 MET 145 1HG MET 145 6.991 1.046 -1.682 497 HE1 MET 145 3HE MET 145 6.323 4.753 -1.691 498 HE2 MET 145 1HE MET 145 6.446 3.898 -0.149 499 HE3 MET 145 2HE MET 145 5.722 3.103 -1.544 500 H THR 146 H THR 146 9.744 1.632 0.083 501 HA THR 146 HA THR 146 11.972 0.067 1.240 502 HB THR 146 HB THR 146 13.244 0.203 -0.807 503 HG1 THR 146 1HG THR 146 11.078 1.125 -2.271 504 HG21 THR 146 3HG2 THR 146 11.963 -1.319 -2.191 505 HG22 THR 146 1HG2 THR 146 10.453 -0.783 -1.454 506 HG23 THR 146 2HG2 THR 146 11.628 -1.690 -0.501 507 H ALA 147 H ALA 147 10.695 2.504 2.107 508 HA ALA 147 HA ALA 147 12.597 4.638 1.433 509 HB1 ALA 147 1HB ALA 147 10.077 4.986 1.653 510 HB2 ALA 147 2HB ALA 147 11.101 6.103 2.558 511 HB3 ALA 147 3HB ALA 147 10.303 4.769 3.389 512 H LYS 148 H LYS 148 14.503 3.976 2.413 513 HA LYS 148 HA LYS 148 14.765 4.535 5.212 514 HB2 LYS 148 2HB LYS 148 13.832 2.103 5.042 515 HB3 LYS 148 1HB LYS 148 15.458 1.685 4.502 516 HG2 LYS 148 2HG LYS 148 16.417 2.574 6.571 517 HG3 LYS 148 1HG LYS 148 14.833 3.148 7.093 518 HD2 LYS 148 2HD LYS 148 13.998 0.829 7.147 519 HD3 LYS 148 1HD LYS 148 15.568 0.241 6.609 520 HE2 LYS 148 2HE LYS 148 16.612 1.172 8.651 521 HE3 LYS 148 1HE LYS 148 15.037 1.755 9.189 522 HZ1 LYS 148 3HZ LYS 148 16.136 -0.726 9.651 523 HZ2 LYS 148 1HZ LYS 148 14.927 -0.999 8.495 524 HZ3 LYS 148 2HZ LYS 148 14.536 -0.243 9.966 Start of MODEL 14 1 H1 ASP 78 1HT ASP 78 6.767 23.471 -0.555 2 H2 ASP 78 2HT ASP 78 5.682 22.786 0.555 3 H3 ASP 78 3HT ASP 78 6.162 21.907 -0.815 4 HA ASP 78 HA ASP 78 8.537 22.451 0.315 5 HB2 ASP 78 2HB ASP 78 8.291 22.031 2.715 6 HB3 ASP 78 1HB ASP 78 7.347 23.446 2.252 7 H THR 79 H THR 79 9.525 20.401 1.245 8 HA THR 79 HA THR 79 9.979 18.178 0.758 9 HB THR 79 HB THR 79 8.499 16.677 1.928 10 HG1 THR 79 1HG THR 79 6.478 18.083 2.674 11 HG21 THR 79 3HG2 THR 79 9.772 18.284 3.330 12 HG22 THR 79 1HG2 THR 79 8.242 17.828 4.075 13 HG23 THR 79 2HG2 THR 79 8.401 19.391 3.276 14 H ASP 80 H ASP 80 9.897 18.597 -1.601 15 HA ASP 80 HA ASP 80 7.559 18.142 -3.140 16 HB2 ASP 80 2HB ASP 80 9.697 19.294 -3.887 17 HB3 ASP 80 1HB ASP 80 10.401 17.688 -4.064 18 H SER 81 H SER 81 10.059 16.020 -1.878 19 HA SER 81 HA SER 81 9.457 13.691 -3.380 20 HB2 SER 81 2HB SER 81 11.514 13.689 -2.209 21 HB3 SER 81 1HB SER 81 10.749 14.162 -0.697 22 HG SER 81 HG SER 81 9.542 11.998 -1.279 23 H GLU 82 H GLU 82 8.570 14.532 -0.035 24 HA GLU 82 HA GLU 82 6.959 12.500 0.733 25 HB2 GLU 82 2HB GLU 82 7.399 14.520 2.085 26 HB3 GLU 82 1HB GLU 82 6.328 15.452 1.039 27 HG2 GLU 82 2HG GLU 82 4.430 14.028 1.677 28 HG3 GLU 82 1HG GLU 82 5.491 13.037 2.674 29 H GLU 83 H GLU 83 6.303 14.821 -1.773 30 HA GLU 83 HA GLU 83 3.510 14.485 -1.984 31 HB2 GLU 83 2HB GLU 83 4.853 16.349 -2.985 32 HB3 GLU 83 1HB GLU 83 5.390 15.217 -4.225 33 HG2 GLU 83 2HG GLU 83 3.043 14.779 -4.846 34 HG3 GLU 83 1HG GLU 83 2.517 15.944 -3.633 35 H GLU 84 H GLU 84 6.156 12.905 -3.866 36 HA GLU 84 HA GLU 84 4.621 11.365 -5.570 37 HB2 GLU 84 2HB GLU 84 7.152 11.399 -5.468 38 HB3 GLU 84 1HB GLU 84 7.043 10.305 -4.088 39 HG2 GLU 84 2HG GLU 84 7.360 8.919 -6.021 40 HG3 GLU 84 1HG GLU 84 5.669 8.755 -5.564 41 H ILE 85 H ILE 85 5.666 10.503 -2.275 42 HA ILE 85 HA ILE 85 4.369 8.049 -1.993 43 HB ILE 85 HB ILE 85 4.627 10.208 0.131 44 HG12 ILE 85 2HG1 ILE 85 6.577 8.010 -0.642 45 HG13 ILE 85 1HG1 ILE 85 6.793 9.722 -1.004 46 HG21 ILE 85 1HG2 ILE 85 4.565 7.190 0.387 47 HG22 ILE 85 2HG2 ILE 85 3.179 8.238 0.689 48 HG23 ILE 85 3HG2 ILE 85 4.605 8.360 1.703 49 HD11 ILE 85 3HD1 ILE 85 7.991 9.566 0.982 50 HD12 ILE 85 1HD1 ILE 85 6.943 8.313 1.632 51 HD13 ILE 85 2HD1 ILE 85 6.409 9.990 1.623 52 H ARG 86 H ARG 86 3.152 11.316 -1.208 53 HA ARG 86 HA ARG 86 0.576 10.602 -0.401 54 HB2 ARG 86 2HB ARG 86 1.655 13.118 -1.677 55 HB3 ARG 86 1HB ARG 86 -0.002 12.985 -1.098 56 HG2 ARG 86 2HG ARG 86 0.800 12.445 1.153 57 HG3 ARG 86 1HG ARG 86 2.465 12.471 0.594 58 HD2 ARG 86 2HD ARG 86 1.984 14.581 1.690 59 HD3 ARG 86 1HD ARG 86 2.159 14.882 -0.037 60 HE ARG 86 HE ARG 86 -0.568 14.383 0.635 61 HH11 ARG 86 1HH2 ARG 86 1.953 16.750 0.749 62 HH12 ARG 86 2HH2 ARG 86 0.869 18.098 0.845 63 HH21 ARG 86 1HH1 ARG 86 -1.989 16.127 0.770 64 HH22 ARG 86 2HH1 ARG 86 -1.373 17.744 0.852 65 H GLU 87 H GLU 87 1.856 11.219 -3.646 66 HA GLU 87 HA GLU 87 -0.699 11.000 -4.948 67 HB2 GLU 87 2HB GLU 87 2.117 10.988 -6.025 68 HB3 GLU 87 1HB GLU 87 0.670 10.988 -7.031 69 HG2 GLU 87 2HG GLU 87 1.273 13.093 -4.936 70 HG3 GLU 87 1HG GLU 87 1.631 13.282 -6.652 71 H ALA 88 H ALA 88 2.218 9.018 -5.328 72 HA ALA 88 HA ALA 88 1.343 6.866 -6.693 73 HB1 ALA 88 1HB ALA 88 2.917 5.476 -5.247 74 HB2 ALA 88 2HB ALA 88 3.167 6.934 -4.285 75 HB3 ALA 88 3HB ALA 88 3.616 6.913 -5.991 76 H PHE 89 H PHE 89 1.120 7.032 -3.109 77 HA PHE 89 HA PHE 89 -0.435 4.685 -2.871 78 HB2 PHE 89 2HB PHE 89 0.198 6.989 -1.079 79 HB3 PHE 89 1HB PHE 89 -1.026 5.806 -0.572 80 HD1 PHE 89 1HD PHE 89 -0.352 3.282 -0.799 81 HD2 PHE 89 2HD PHE 89 2.465 6.516 -0.669 82 HE1 PHE 89 1HE PHE 89 1.434 1.702 -0.123 83 HE2 PHE 89 2HE PHE 89 4.245 4.936 0.014 84 HZ PHE 89 HZ PHE 89 3.735 2.537 0.280 85 H ARG 90 H ARG 90 -1.354 8.117 -3.174 86 HA ARG 90 HA ARG 90 -4.106 7.839 -2.659 87 HB2 ARG 90 2HB ARG 90 -2.415 9.774 -4.095 88 HB3 ARG 90 1HB ARG 90 -4.112 9.810 -4.521 89 HG2 ARG 90 2HG ARG 90 -4.726 10.081 -2.169 90 HG3 ARG 90 1HG ARG 90 -3.039 9.975 -1.681 91 HD2 ARG 90 2HD ARG 90 -2.549 11.990 -2.992 92 HD3 ARG 90 1HD ARG 90 -4.233 12.096 -3.474 93 HE ARG 90 HE ARG 90 -3.923 12.044 -0.618 94 HH11 ARG 90 1HH2 ARG 90 -3.704 14.039 -3.435 95 HH12 ARG 90 2HH2 ARG 90 -4.052 15.511 -2.583 96 HH21 ARG 90 1HH1 ARG 90 -4.321 13.973 0.504 97 HH22 ARG 90 2HH1 ARG 90 -4.387 15.477 -0.359 98 H VAL 91 H VAL 91 -2.296 7.527 -5.700 99 HA VAL 91 HA VAL 91 -4.497 6.974 -7.384 100 HB VAL 91 HB VAL 91 -1.587 6.147 -7.610 101 HG11 VAL 91 1HG1 VAL 91 -2.164 5.988 -10.066 102 HG12 VAL 91 2HG1 VAL 91 -3.863 6.102 -9.610 103 HG13 VAL 91 3HG1 VAL 91 -2.893 4.732 -9.065 104 HG21 VAL 91 3HG2 VAL 91 -1.316 8.119 -8.935 105 HG22 VAL 91 1HG2 VAL 91 -2.198 8.629 -7.496 106 HG23 VAL 91 2HG2 VAL 91 -3.057 8.388 -9.016 107 H PHE 92 H PHE 92 -2.314 4.868 -5.556 108 HA PHE 92 HA PHE 92 -3.099 2.367 -6.415 109 HB2 PHE 92 2HB PHE 92 -2.084 3.457 -3.833 110 HB3 PHE 92 1HB PHE 92 -2.706 1.827 -3.788 111 HD1 PHE 92 1HD PHE 92 -0.963 3.596 -6.592 112 HD2 PHE 92 2HD PHE 92 -0.770 0.492 -3.630 113 HE1 PHE 92 1HE PHE 92 1.130 2.765 -7.609 114 HE2 PHE 92 2HE PHE 92 1.330 -0.341 -4.649 115 HZ PHE 92 HZ PHE 92 2.280 0.796 -6.638 116 H ASP 93 H ASP 93 -4.567 4.139 -3.655 117 HA ASP 93 HA ASP 93 -6.610 2.359 -3.085 118 HB2 ASP 93 2HB ASP 93 -6.032 4.526 -1.867 119 HB3 ASP 93 1HB ASP 93 -6.976 5.353 -3.093 120 H LYS 94 H LYS 94 -7.304 1.398 -5.041 121 HA LYS 94 HA LYS 94 -8.195 2.613 -7.348 122 HB2 LYS 94 2HB LYS 94 -8.637 0.045 -5.979 123 HB3 LYS 94 1HB LYS 94 -10.040 0.504 -6.938 124 HG2 LYS 94 2HG LYS 94 -8.586 -0.784 -8.357 125 HG3 LYS 94 1HG LYS 94 -8.479 0.892 -8.885 126 HD2 LYS 94 2HD LYS 94 -6.374 1.208 -7.736 127 HD3 LYS 94 1HD LYS 94 -6.516 -0.356 -6.938 128 HE2 LYS 94 2HE LYS 94 -5.035 -0.094 -9.113 129 HE3 LYS 94 1HE LYS 94 -6.006 -1.543 -8.877 130 HZ1 LYS 94 3HZ LYS 94 -6.770 0.855 -10.450 131 HZ2 LYS 94 1HZ LYS 94 -7.762 -0.495 -10.187 132 HZ3 LYS 94 2HZ LYS 94 -6.326 -0.659 -11.081 133 H ASP 95 H ASP 95 -10.206 1.751 -4.564 134 HA ASP 95 HA ASP 95 -12.564 3.054 -5.451 135 HB2 ASP 95 2HB ASP 95 -11.579 2.153 -2.740 136 HB3 ASP 95 1HB ASP 95 -13.171 2.875 -2.976 137 H GLY 96 H GLY 96 -9.657 4.360 -4.701 138 HA2 GLY 96 2HA GLY 96 -8.905 6.396 -3.845 139 HA3 GLY 96 1HA GLY 96 -10.183 6.991 -4.894 140 H ASN 97 H ASN 97 -10.186 5.280 -1.729 141 HA ASN 97 HA ASN 97 -12.048 7.365 -0.737 142 HB2 ASN 97 2HB ASN 97 -12.908 5.768 0.802 143 HB3 ASN 97 1HB ASN 97 -12.859 4.990 -0.780 144 HD21 ASN 97 1HD2 ASN 97 -12.538 4.036 2.215 145 HD22 ASN 97 2HD2 ASN 97 -11.189 3.008 2.130 146 H GLY 98 H GLY 98 -8.917 7.142 -0.755 147 HA2 GLY 98 2HA GLY 98 -7.289 8.087 0.593 148 HA3 GLY 98 1HA GLY 98 -8.564 8.570 1.708 149 H TYR 99 H TYR 99 -7.778 5.300 0.625 150 HA TYR 99 HA TYR 99 -6.442 4.611 3.098 151 HB2 TYR 99 2HB TYR 99 -9.211 3.574 2.471 152 HB3 TYR 99 1HB TYR 99 -8.126 2.824 3.632 153 HD1 TYR 99 1HD TYR 99 -7.134 4.363 5.492 154 HD2 TYR 99 2HD TYR 99 -10.599 5.348 3.157 155 HE1 TYR 99 1HE TYR 99 -7.834 6.001 7.218 156 HE2 TYR 99 2HE TYR 99 -11.298 6.991 4.878 157 HH TYR 99 HH TYR 99 -9.896 8.394 6.752 158 H ILE 100 H ILE 100 -5.745 2.275 3.075 159 HA ILE 100 HA ILE 100 -5.476 1.317 0.266 160 HB ILE 100 HB ILE 100 -3.463 1.125 2.512 161 HG12 ILE 100 2HG1 ILE 100 -3.687 3.434 1.681 162 HG13 ILE 100 1HG1 ILE 100 -2.168 2.748 1.121 163 HG21 ILE 100 1HG2 ILE 100 -3.015 -0.713 1.144 164 HG22 ILE 100 2HG2 ILE 100 -2.016 0.539 0.398 165 HG23 ILE 100 3HG2 ILE 100 -3.562 0.110 -0.316 166 HD11 ILE 100 3HD1 ILE 100 -2.914 3.627 -0.863 167 HD12 ILE 100 1HD1 ILE 100 -4.595 3.379 -0.462 168 HD13 ILE 100 2HD1 ILE 100 -3.618 2.029 -0.992 169 H SER 101 H SER 101 -6.437 -0.552 -0.114 170 HA SER 101 HA SER 101 -6.763 -2.488 2.106 171 HB2 SER 101 2HB SER 101 -8.232 -2.159 -0.507 172 HB3 SER 101 1HB SER 101 -8.386 -3.590 0.512 173 HG SER 101 HG SER 101 -9.500 -2.469 1.908 174 H ALA 102 H ALA 102 -6.458 -4.756 1.602 175 HA ALA 102 HA ALA 102 -3.960 -5.288 0.418 176 HB1 ALA 102 1HB ALA 102 -5.927 -7.518 0.762 177 HB2 ALA 102 2HB ALA 102 -5.476 -6.606 2.197 178 HB3 ALA 102 3HB ALA 102 -4.237 -7.424 1.252 179 H ALA 103 H ALA 103 -7.252 -5.703 -0.813 180 HA ALA 103 HA ALA 103 -6.661 -7.207 -3.076 181 HB1 ALA 103 1HB ALA 103 -8.798 -5.090 -3.078 182 HB2 ALA 103 2HB ALA 103 -8.938 -6.505 -2.037 183 HB3 ALA 103 3HB ALA 103 -8.828 -6.702 -3.775 184 H GLU 104 H GLU 104 -6.420 -3.716 -2.536 185 HA GLU 104 HA GLU 104 -6.082 -2.980 -5.253 186 HB2 GLU 104 2HB GLU 104 -5.037 -1.579 -2.765 187 HB3 GLU 104 1HB GLU 104 -5.310 -0.857 -4.357 188 HG2 GLU 104 2HG GLU 104 -7.680 -1.153 -4.191 189 HG3 GLU 104 1HG GLU 104 -7.516 -2.180 -2.768 190 H LEU 105 H LEU 105 -3.829 -4.032 -2.722 191 HA LEU 105 HA LEU 105 -1.440 -3.295 -4.072 192 HB2 LEU 105 2HB LEU 105 -1.773 -5.598 -2.139 193 HB3 LEU 105 1HB LEU 105 -0.317 -4.661 -2.450 194 HG LEU 105 HG LEU 105 -2.861 -3.699 -1.116 195 HD11 LEU 105 1HD1 LEU 105 -1.304 -4.956 0.322 196 HD12 LEU 105 2HD1 LEU 105 -1.324 -3.254 0.764 197 HD13 LEU 105 3HD1 LEU 105 0.016 -3.897 -0.176 198 HD21 LEU 105 3HD2 LEU 105 -0.473 -2.191 -2.188 199 HD22 LEU 105 1HD2 LEU 105 -1.446 -1.547 -0.869 200 HD23 LEU 105 2HD2 LEU 105 -2.189 -1.848 -2.429 201 H ARG 106 H ARG 106 -2.925 -6.529 -3.742 202 HA ARG 106 HA ARG 106 -1.190 -7.838 -5.484 203 HB2 ARG 106 2HB ARG 106 -2.917 -9.572 -5.679 204 HB3 ARG 106 1HB ARG 106 -2.787 -9.026 -4.013 205 HG2 ARG 106 2HG ARG 106 -4.718 -7.476 -4.457 206 HG3 ARG 106 1HG ARG 106 -4.911 -8.253 -6.030 207 HD2 ARG 106 2HD ARG 106 -5.158 -10.446 -4.881 208 HD3 ARG 106 1HD ARG 106 -5.052 -9.612 -3.335 209 HE ARG 106 HE ARG 106 -7.219 -8.799 -3.649 210 HH11 ARG 106 1HH2 ARG 106 -6.040 -10.455 -6.454 211 HH12 ARG 106 2HH2 ARG 106 -7.579 -10.472 -7.246 212 HH21 ARG 106 1HH1 ARG 106 -9.213 -8.835 -4.665 213 HH22 ARG 106 2HH1 ARG 106 -9.382 -9.549 -6.234 214 H HIS 107 H HIS 107 -4.292 -6.252 -6.218 215 HA HIS 107 HA HIS 107 -4.275 -6.844 -8.987 216 HB2 HIS 107 2HB HIS 107 -5.687 -4.903 -7.189 217 HB3 HIS 107 1HB HIS 107 -5.729 -4.566 -8.917 218 HD1 HIS 107 1HD HIS 107 -5.564 -8.159 -8.410 219 HD2 HIS 107 2HD HIS 107 -8.598 -5.302 -8.411 220 HE1 HIS 107 1HE HIS 107 -7.734 -9.419 -8.750 221 HE2 HIS 107 2HE HIS 107 -9.594 -7.689 -8.743 222 H VAL 108 H VAL 108 -3.153 -3.968 -7.183 223 HA VAL 108 HA VAL 108 -2.331 -2.539 -9.474 224 HB VAL 108 HB VAL 108 -1.440 -2.360 -6.585 225 HG11 VAL 108 1HG1 VAL 108 0.356 -1.368 -7.731 226 HG12 VAL 108 2HG1 VAL 108 -0.705 0.002 -7.411 227 HG13 VAL 108 3HG1 VAL 108 -0.680 -0.740 -9.011 228 HG21 VAL 108 3HG2 VAL 108 -3.874 -1.750 -7.549 229 HG22 VAL 108 1HG2 VAL 108 -3.036 -0.273 -8.029 230 HG23 VAL 108 2HG2 VAL 108 -3.087 -0.741 -6.334 231 H MET 109 H MET 109 -0.463 -4.592 -7.225 232 HA MET 109 HA MET 109 2.027 -4.311 -8.481 233 HB2 MET 109 2HB MET 109 0.855 -6.609 -6.909 234 HB3 MET 109 1HB MET 109 2.548 -6.513 -7.395 235 HG2 MET 109 2HG MET 109 1.158 -4.374 -5.766 236 HG3 MET 109 1HG MET 109 2.086 -5.677 -5.046 237 HE1 MET 109 3HE MET 109 4.251 -6.232 -5.355 238 HE2 MET 109 1HE MET 109 5.588 -5.116 -5.624 239 HE3 MET 109 2HE MET 109 4.842 -5.952 -6.982 240 H THR 110 H THR 110 -0.458 -6.838 -8.897 241 HA THR 110 HA THR 110 0.864 -8.228 -10.970 242 HB THR 110 HB THR 110 -2.100 -8.000 -10.378 243 HG1 THR 110 1HG THR 110 -0.001 -9.645 -9.510 244 HG21 THR 110 3HG2 THR 110 -1.847 -8.826 -12.627 245 HG22 THR 110 1HG2 THR 110 -2.150 -10.226 -11.599 246 HG23 THR 110 2HG2 THR 110 -0.511 -9.874 -12.148 247 H ASN 111 H ASN 111 -1.534 -5.621 -11.025 248 HA ASN 111 HA ASN 111 -1.788 -5.448 -13.835 249 HB2 ASN 111 2HB ASN 111 -3.392 -4.429 -12.286 250 HB3 ASN 111 1HB ASN 111 -2.164 -3.302 -11.728 251 HD21 ASN 111 1HD2 ASN 111 -3.794 -4.324 -14.776 252 HD22 ASN 111 2HD2 ASN 111 -3.748 -2.784 -15.493 253 H LEU 112 H LEU 112 0.383 -3.978 -11.530 254 HA LEU 112 HA LEU 112 1.606 -2.100 -13.210 255 HB2 LEU 112 2HB LEU 112 2.353 -3.484 -10.662 256 HB3 LEU 112 1HB LEU 112 3.616 -2.604 -11.501 257 HG LEU 112 HG LEU 112 0.927 -1.397 -10.767 258 HD11 LEU 112 1HD1 LEU 112 2.311 -2.052 -8.772 259 HD12 LEU 112 2HD1 LEU 112 2.069 -0.315 -8.918 260 HD13 LEU 112 3HD1 LEU 112 3.604 -1.038 -9.396 261 HD21 LEU 112 3HD2 LEU 112 1.695 0.059 -12.368 262 HD22 LEU 112 1HD2 LEU 112 3.375 -0.442 -12.203 263 HD23 LEU 112 2HD2 LEU 112 2.671 0.680 -11.050 264 H GLY 113 H GLY 113 2.231 -5.504 -12.662 265 HA2 GLY 113 2HA GLY 113 3.054 -6.658 -14.754 266 HA3 GLY 113 1HA GLY 113 4.317 -5.432 -14.799 267 H GLU 114 H GLU 114 3.843 -5.917 -11.619 268 HA GLU 114 HA GLU 114 6.265 -7.396 -11.286 269 HB2 GLU 114 2HB GLU 114 4.151 -6.497 -9.320 270 HB3 GLU 114 1HB GLU 114 5.662 -7.273 -8.848 271 HG2 GLU 114 2HG GLU 114 5.496 -4.744 -10.510 272 HG3 GLU 114 1HG GLU 114 5.762 -4.761 -8.768 273 H LYS 115 H LYS 115 5.961 -9.132 -9.271 274 HA LYS 115 HA LYS 115 3.893 -11.085 -10.046 275 HB2 LYS 115 2HB LYS 115 6.868 -11.632 -10.055 276 HB3 LYS 115 1HB LYS 115 5.631 -12.887 -10.117 277 HG2 LYS 115 2HG LYS 115 4.713 -11.841 -12.183 278 HG3 LYS 115 1HG LYS 115 6.011 -10.648 -12.134 279 HD2 LYS 115 2HD LYS 115 7.684 -12.451 -12.310 280 HD3 LYS 115 1HD LYS 115 6.391 -13.650 -12.358 281 HE2 LYS 115 2HE LYS 115 7.072 -13.224 -14.636 282 HE3 LYS 115 1HE LYS 115 5.496 -12.469 -14.405 283 HZ1 LYS 115 3HZ LYS 115 7.892 -11.254 -15.170 284 HZ2 LYS 115 1HZ LYS 115 7.475 -10.645 -13.646 285 HZ3 LYS 115 2HZ LYS 115 6.376 -10.526 -14.935 286 H LEU 116 H LEU 116 3.709 -9.728 -7.789 287 HA LEU 116 HA LEU 116 4.973 -10.882 -5.508 288 HB2 LEU 116 2HB LEU 116 3.488 -9.507 -4.199 289 HB3 LEU 116 1HB LEU 116 4.005 -8.560 -5.577 290 HG LEU 116 HG LEU 116 1.663 -8.192 -5.438 291 HD11 LEU 116 1HD1 LEU 116 1.875 -10.425 -7.462 292 HD12 LEU 116 2HD1 LEU 116 2.508 -8.801 -7.732 293 HD13 LEU 116 3HD1 LEU 116 0.801 -9.057 -7.512 294 HD21 LEU 116 3HD2 LEU 116 0.788 -11.039 -5.563 295 HD22 LEU 116 1HD2 LEU 116 0.096 -9.685 -4.713 296 HD23 LEU 116 2HD2 LEU 116 1.464 -10.501 -4.029 297 H THR 117 H THR 117 3.429 -11.756 -3.665 298 HA THR 117 HA THR 117 1.628 -13.807 -4.858 299 HB THR 117 HB THR 117 2.174 -15.144 -2.824 300 HG1 THR 117 1HG THR 117 2.950 -13.779 -1.371 301 HG21 THR 117 3HG2 THR 117 4.599 -15.582 -3.549 302 HG22 THR 117 1HG2 THR 117 4.355 -14.302 -4.738 303 HG23 THR 117 2HG2 THR 117 3.357 -15.757 -4.789 304 H ASP 118 H ASP 118 -0.444 -13.812 -4.221 305 HA ASP 118 HA ASP 118 -1.631 -11.711 -2.848 306 HB2 ASP 118 2HB ASP 118 -2.560 -14.557 -3.268 307 HB3 ASP 118 1HB ASP 118 -3.578 -13.311 -2.547 308 H GLU 119 H GLU 119 -0.406 -14.772 -1.607 309 HA GLU 119 HA GLU 119 -1.467 -14.614 0.998 310 HB2 GLU 119 2HB GLU 119 1.079 -15.938 0.005 311 HB3 GLU 119 1HB GLU 119 0.356 -16.207 1.592 312 HG2 GLU 119 2HG GLU 119 -1.706 -17.035 0.531 313 HG3 GLU 119 1HG GLU 119 -1.025 -16.716 -1.063 314 H GLU 120 H GLU 120 1.383 -13.171 -0.473 315 HA GLU 120 HA GLU 120 2.490 -12.246 2.031 316 HB2 GLU 120 2HB GLU 120 3.098 -11.660 -0.863 317 HB3 GLU 120 1HB GLU 120 3.882 -10.769 0.440 318 HG2 GLU 120 2HG GLU 120 4.756 -12.851 1.384 319 HG3 GLU 120 1HG GLU 120 3.904 -13.798 0.166 320 H VAL 121 H VAL 121 0.674 -10.798 -0.643 321 HA VAL 121 HA VAL 121 0.532 -8.161 0.224 322 HB VAL 121 HB VAL 121 -1.348 -9.921 -1.338 323 HG11 VAL 121 1HG1 VAL 121 -2.942 -8.551 -0.283 324 HG12 VAL 121 2HG1 VAL 121 -2.625 -7.725 -1.800 325 HG13 VAL 121 3HG1 VAL 121 -1.887 -7.140 -0.305 326 HG21 VAL 121 3HG2 VAL 121 0.231 -7.406 -1.969 327 HG22 VAL 121 1HG2 VAL 121 -0.785 -8.269 -3.115 328 HG23 VAL 121 2HG2 VAL 121 0.652 -9.042 -2.459 329 H ASP 122 H ASP 122 -2.073 -10.535 0.682 330 HA ASP 122 HA ASP 122 -3.592 -9.238 2.551 331 HB2 ASP 122 2HB ASP 122 -3.979 -11.503 1.419 332 HB3 ASP 122 1HB ASP 122 -2.993 -12.199 2.700 333 H GLU 123 H GLU 123 -0.703 -11.254 3.166 334 HA GLU 123 HA GLU 123 -0.818 -10.944 5.998 335 HB2 GLU 123 2HB GLU 123 1.343 -11.844 4.096 336 HB3 GLU 123 1HB GLU 123 1.625 -11.714 5.833 337 HG2 GLU 123 2HG GLU 123 -0.643 -13.313 4.617 338 HG3 GLU 123 1HG GLU 123 0.915 -14.013 5.055 339 H MET 124 H MET 124 0.791 -9.173 3.409 340 HA MET 124 HA MET 124 2.597 -7.640 4.794 341 HB2 MET 124 2HB MET 124 1.581 -7.678 2.208 342 HB3 MET 124 1HB MET 124 1.089 -6.093 2.752 343 HG2 MET 124 2HG MET 124 3.409 -5.583 3.388 344 HG3 MET 124 1HG MET 124 3.914 -7.191 2.871 345 HE1 MET 124 3HE MET 124 2.910 -3.521 0.396 346 HE2 MET 124 1HE MET 124 3.476 -3.641 2.066 347 HE3 MET 124 2HE MET 124 1.823 -4.093 1.659 348 H ILE 125 H ILE 125 -0.587 -6.374 3.831 349 HA ILE 125 HA ILE 125 -0.600 -4.149 5.481 350 HB ILE 125 HB ILE 125 -2.837 -5.861 4.392 351 HG12 ILE 125 2HG1 ILE 125 -1.901 -3.037 3.793 352 HG13 ILE 125 1HG1 ILE 125 -1.524 -4.458 2.821 353 HG21 ILE 125 1HG2 ILE 125 -4.308 -3.812 5.098 354 HG22 ILE 125 2HG2 ILE 125 -2.994 -3.463 6.200 355 HG23 ILE 125 3HG2 ILE 125 -3.863 -4.977 6.334 356 HD11 ILE 125 3HD1 ILE 125 -4.066 -4.811 2.661 357 HD12 ILE 125 1HD1 ILE 125 -3.410 -3.453 1.744 358 HD13 ILE 125 2HD1 ILE 125 -4.217 -3.171 3.285 359 H ARG 126 H ARG 126 -1.816 -7.412 6.176 360 HA ARG 126 HA ARG 126 -2.904 -7.001 8.666 361 HB2 ARG 126 2HB ARG 126 -1.424 -9.364 7.531 362 HB3 ARG 126 1HB ARG 126 -2.239 -9.430 9.086 363 HG2 ARG 126 2HG ARG 126 -3.758 -8.420 6.687 364 HG3 ARG 126 1HG ARG 126 -3.528 -10.154 6.873 365 HD2 ARG 126 2HD ARG 126 -4.563 -10.087 9.081 366 HD3 ARG 126 1HD ARG 126 -4.705 -8.341 8.997 367 HE ARG 126 HE ARG 126 -6.020 -9.829 6.861 368 HH11 ARG 126 1HH2 ARG 126 -6.188 -8.293 9.939 369 HH12 ARG 126 2HH2 ARG 126 -7.897 -8.039 9.885 370 HH21 ARG 126 1HH1 ARG 126 -8.267 -9.548 6.776 371 HH22 ARG 126 2HH1 ARG 126 -9.085 -8.758 8.085 372 H GLU 127 H GLU 127 0.522 -7.539 7.888 373 HA GLU 127 HA GLU 127 1.247 -7.422 10.698 374 HB2 GLU 127 2HB GLU 127 2.956 -7.524 8.201 375 HB3 GLU 127 1HB GLU 127 3.571 -7.631 9.851 376 HG2 GLU 127 2HG GLU 127 1.555 -9.546 8.631 377 HG3 GLU 127 1HG GLU 127 3.277 -9.875 8.799 378 H ALA 128 H ALA 128 1.524 -5.325 7.852 379 HA ALA 128 HA ALA 128 2.998 -3.250 9.125 380 HB1 ALA 128 1HB ALA 128 3.009 -3.174 6.778 381 HB2 ALA 128 2HB ALA 128 1.924 -1.854 7.204 382 HB3 ALA 128 3HB ALA 128 1.265 -3.401 6.668 383 H ASP 129 H ASP 129 -0.480 -3.456 8.330 384 HA ASP 129 HA ASP 129 -1.473 -1.164 9.387 385 HB2 ASP 129 2HB ASP 129 -2.841 -2.968 8.392 386 HB3 ASP 129 1HB ASP 129 -2.669 -3.905 9.864 387 H ILE 130 H ILE 130 -1.573 -0.185 11.316 388 HA ILE 130 HA ILE 130 -0.375 -1.512 13.635 389 HB ILE 130 HB ILE 130 -1.379 1.328 13.303 390 HG12 ILE 130 2HG1 ILE 130 1.394 0.132 13.192 391 HG13 ILE 130 1HG1 ILE 130 0.518 0.808 11.828 392 HG21 ILE 130 1HG2 ILE 130 0.330 0.036 15.458 393 HG22 ILE 130 2HG2 ILE 130 -1.338 0.563 15.668 394 HG23 ILE 130 3HG2 ILE 130 -0.080 1.743 15.373 395 HD11 ILE 130 3HD1 ILE 130 0.423 3.000 13.037 396 HD12 ILE 130 1HD1 ILE 130 2.069 2.498 12.651 397 HD13 ILE 130 2HD1 ILE 130 1.455 2.312 14.289 398 H ASP 131 H ASP 131 -3.491 -0.335 12.551 399 HA ASP 131 HA ASP 131 -4.767 -0.929 15.132 400 HB2 ASP 131 2HB ASP 131 -5.791 0.288 12.562 401 HB3 ASP 131 1HB ASP 131 -6.808 -0.022 13.969 402 H GLY 132 H GLY 132 -3.914 -2.622 12.414 403 HA2 GLY 132 2HA GLY 132 -4.669 -4.544 11.371 404 HA3 GLY 132 1HA GLY 132 -5.047 -5.036 13.022 405 H ASP 133 H ASP 133 -6.358 -2.932 10.458 406 HA ASP 133 HA ASP 133 -9.081 -3.981 11.056 407 HB2 ASP 133 2HB ASP 133 -9.935 -1.748 10.462 408 HB3 ASP 133 1HB ASP 133 -8.845 -1.678 11.844 409 H GLY 134 H GLY 134 -6.728 -2.974 8.656 410 HA2 GLY 134 2HA GLY 134 -6.793 -4.285 6.549 411 HA3 GLY 134 1HA GLY 134 -8.523 -3.978 6.499 412 H GLN 135 H GLN 135 -7.266 -1.207 7.702 413 HA GLN 135 HA GLN 135 -6.893 -0.009 4.993 414 HB2 GLN 135 2HB GLN 135 -8.113 1.339 7.412 415 HB3 GLN 135 1HB GLN 135 -7.980 1.992 5.784 416 HG2 GLN 135 2HG GLN 135 -9.606 -0.428 6.610 417 HG3 GLN 135 1HG GLN 135 -10.248 1.141 6.136 418 HE21 GLN 135 1HE2 GLN 135 -9.805 -1.914 4.937 419 HE22 GLN 135 2HE2 GLN 135 -9.651 -1.551 3.283 420 H VAL 136 H VAL 136 -4.889 0.608 4.680 421 HA VAL 136 HA VAL 136 -3.278 1.444 7.050 422 HB VAL 136 HB VAL 136 -2.252 0.551 4.352 423 HG11 VAL 136 1HG1 VAL 136 -0.118 0.383 5.536 424 HG12 VAL 136 2HG1 VAL 136 -0.906 0.901 7.024 425 HG13 VAL 136 3HG1 VAL 136 -0.762 2.019 5.670 426 HG21 VAL 136 3HG2 VAL 136 -3.357 -1.332 5.378 427 HG22 VAL 136 1HG2 VAL 136 -2.589 -0.987 6.928 428 HG23 VAL 136 2HG2 VAL 136 -1.612 -1.536 5.567 429 H ASN 137 H ASN 137 -2.736 3.472 7.232 430 HA ASN 137 HA ASN 137 -3.540 5.455 5.346 431 HB2 ASN 137 2HB ASN 137 -3.068 5.678 7.893 432 HB3 ASN 137 1HB ASN 137 -1.390 5.908 7.409 433 HD21 ASN 137 1HD2 ASN 137 -1.233 8.167 7.860 434 HD22 ASN 137 2HD2 ASN 137 -2.161 9.334 7.052 435 H TYR 138 H TYR 138 -1.085 7.082 5.497 436 HA TYR 138 HA TYR 138 0.242 5.998 3.135 437 HB2 TYR 138 2HB TYR 138 0.643 8.629 4.585 438 HB3 TYR 138 1HB TYR 138 1.302 8.201 3.004 439 HD1 TYR 138 2HD TYR 138 -0.265 7.729 1.095 440 HD2 TYR 138 1HD TYR 138 -1.628 9.362 4.824 441 HE1 TYR 138 2HE TYR 138 -2.376 8.449 0.005 442 HE2 TYR 138 1HE TYR 138 -3.741 10.083 3.736 443 HH TYR 138 HH TYR 138 -4.231 10.588 0.833 444 H GLU 139 H GLU 139 1.339 7.239 6.320 445 HA GLU 139 HA GLU 139 4.016 6.414 6.024 446 HB2 GLU 139 2HB GLU 139 2.423 6.905 8.535 447 HB3 GLU 139 1HB GLU 139 4.175 6.748 8.463 448 HG2 GLU 139 2HG GLU 139 3.923 9.071 8.323 449 HG3 GLU 139 1HG GLU 139 4.012 8.636 6.623 450 H GLU 140 H GLU 140 1.626 5.008 8.251 451 HA GLU 140 HA GLU 140 2.724 2.716 9.115 452 HB2 GLU 140 2HB GLU 140 -0.011 2.967 7.825 453 HB3 GLU 140 1HB GLU 140 0.505 1.560 8.754 454 HG2 GLU 140 2HG GLU 140 0.816 2.935 10.725 455 HG3 GLU 140 1HG GLU 140 0.431 4.392 9.831 456 H PHE 141 H PHE 141 1.916 3.427 5.777 457 HA PHE 141 HA PHE 141 2.559 0.731 4.867 458 HB2 PHE 141 2HB PHE 141 0.742 2.420 3.936 459 HB3 PHE 141 1HB PHE 141 2.092 3.056 3.008 460 HD1 PHE 141 1HD PHE 141 3.664 1.043 2.013 461 HD2 PHE 141 2HD PHE 141 -0.526 0.784 2.856 462 HE1 PHE 141 1HE PHE 141 3.463 -0.839 0.418 463 HE2 PHE 141 2HE PHE 141 -0.727 -1.092 1.281 464 HZ PHE 141 HZ PHE 141 1.256 -1.909 0.044 465 H VAL 142 H VAL 142 3.727 4.056 4.165 466 HA VAL 142 HA VAL 142 5.829 3.718 2.565 467 HB VAL 142 HB VAL 142 5.778 5.296 5.132 468 HG11 VAL 142 1HG1 VAL 142 8.094 5.055 4.706 469 HG12 VAL 142 2HG1 VAL 142 7.666 6.604 3.981 470 HG13 VAL 142 3HG1 VAL 142 7.862 5.177 2.963 471 HG21 VAL 142 3HG2 VAL 142 5.751 6.446 2.355 472 HG22 VAL 142 1HG2 VAL 142 4.987 7.066 3.819 473 HG23 VAL 142 2HG2 VAL 142 4.277 5.708 2.945 474 H GLN 143 H GLN 143 6.243 3.350 6.104 475 HA GLN 143 HA GLN 143 8.809 2.398 6.226 476 HB2 GLN 143 2HB GLN 143 7.346 2.757 8.190 477 HB3 GLN 143 1HB GLN 143 6.460 1.286 7.788 478 HG2 GLN 143 2HG GLN 143 8.526 -0.038 8.041 479 HG3 GLN 143 1HG GLN 143 9.422 1.429 8.427 480 HE21 GLN 143 1HE2 GLN 143 9.887 1.184 10.645 481 HE22 GLN 143 2HE2 GLN 143 8.716 0.860 11.833 482 H MET 144 H MET 144 6.100 0.076 6.297 483 HA MET 144 HA MET 144 7.425 -2.246 5.769 484 HB2 MET 144 2HB MET 144 4.886 -1.831 6.054 485 HB3 MET 144 1HB MET 144 4.856 -1.630 4.303 486 HG2 MET 144 2HG MET 144 4.377 -3.930 4.714 487 HG3 MET 144 1HG MET 144 6.042 -3.876 4.141 488 HE1 MET 144 3HE MET 144 3.747 -5.365 6.468 489 HE2 MET 144 1HE MET 144 4.890 -6.349 7.393 490 HE3 MET 144 2HE MET 144 4.912 -6.383 5.630 491 H MET 145 H MET 145 6.195 -0.004 3.255 492 HA MET 145 HA MET 145 7.243 -1.398 1.036 493 HB2 MET 145 2HB MET 145 5.520 0.337 0.838 494 HB3 MET 145 1HB MET 145 6.688 1.554 1.341 495 HG2 MET 145 2HG MET 145 8.028 1.180 -0.626 496 HG3 MET 145 1HG MET 145 7.068 -0.226 -1.077 497 HE1 MET 145 3HE MET 145 6.023 4.212 -1.380 498 HE2 MET 145 1HE MET 145 7.488 3.438 -0.757 499 HE3 MET 145 2HE MET 145 6.023 3.460 0.214 500 H THR 146 H THR 146 9.115 -1.059 -0.206 501 HA THR 146 HA THR 146 11.250 0.587 1.012 502 HB THR 146 HB THR 146 11.687 -2.243 0.019 503 HG1 THR 146 1HG THR 146 11.441 -1.189 2.639 504 HG21 THR 146 3HG2 THR 146 13.415 -0.152 1.358 505 HG22 THR 146 1HG2 THR 146 13.692 -0.969 -0.180 506 HG23 THR 146 2HG2 THR 146 13.848 -1.860 1.331 507 H ALA 147 H ALA 147 9.487 -0.305 -1.684 508 HA ALA 147 HA ALA 147 11.399 -0.133 -3.763 509 HB1 ALA 147 1HB ALA 147 9.011 -0.990 -3.914 510 HB2 ALA 147 2HB ALA 147 9.510 0.076 -5.227 511 HB3 ALA 147 3HB ALA 147 8.493 0.694 -3.925 512 H LYS 148 H LYS 148 12.407 1.588 -4.657 513 HA LYS 148 HA LYS 148 12.019 4.216 -3.488 514 HB2 LYS 148 2HB LYS 148 14.267 3.285 -4.083 515 HB3 LYS 148 1HB LYS 148 13.824 3.378 -5.783 516 HG2 LYS 148 2HG LYS 148 13.481 5.826 -5.548 517 HG3 LYS 148 1HG LYS 148 13.960 5.725 -3.858 518 HD2 LYS 148 2HD LYS 148 15.759 4.796 -6.114 519 HD3 LYS 148 1HD LYS 148 15.795 6.446 -5.492 520 HE2 LYS 148 2HE LYS 148 16.154 5.396 -3.172 521 HE3 LYS 148 1HE LYS 148 16.489 3.896 -4.031 522 HZ1 LYS 148 3HZ LYS 148 18.078 6.294 -3.844 523 HZ2 LYS 148 1HZ LYS 148 17.998 5.616 -5.398 524 HZ3 LYS 148 2HZ LYS 148 18.560 4.687 -4.088 Start of MODEL 15 1 H1 ASP 78 1HT ASP 78 9.108 21.027 1.740 2 H2 ASP 78 2HT ASP 78 9.271 21.089 0.048 3 H3 ASP 78 3HT ASP 78 9.396 19.605 0.868 4 HA ASP 78 HA ASP 78 7.092 19.721 1.526 5 HB2 ASP 78 2HB ASP 78 7.060 22.218 1.616 6 HB3 ASP 78 1HB ASP 78 7.036 22.245 -0.146 7 H THR 79 H THR 79 8.872 20.247 -1.418 8 HA THR 79 HA THR 79 7.031 18.407 -2.855 9 HB THR 79 HB THR 79 7.488 19.594 -4.928 10 HG1 THR 79 1HG THR 79 9.108 21.170 -3.235 11 HG21 THR 79 3HG2 THR 79 5.584 20.353 -3.565 12 HG22 THR 79 1HG2 THR 79 6.321 21.709 -4.419 13 HG23 THR 79 2HG2 THR 79 6.641 21.471 -2.701 14 H ASP 80 H ASP 80 9.820 18.396 -1.360 15 HA ASP 80 HA ASP 80 11.813 17.696 -3.193 16 HB2 ASP 80 2HB ASP 80 11.317 16.840 -0.339 17 HB3 ASP 80 1HB ASP 80 12.749 16.339 -1.239 18 H SER 81 H SER 81 9.433 15.635 -1.546 19 HA SER 81 HA SER 81 9.244 13.813 -3.740 20 HB2 SER 81 2HB SER 81 10.815 12.919 -1.316 21 HB3 SER 81 1HB SER 81 10.148 11.815 -2.515 22 HG SER 81 HG SER 81 11.464 12.699 -4.044 23 H GLU 82 H GLU 82 8.630 14.722 -0.460 24 HA GLU 82 HA GLU 82 6.906 12.894 0.572 25 HB2 GLU 82 2HB GLU 82 7.550 15.072 1.617 26 HB3 GLU 82 1HB GLU 82 6.418 15.883 0.539 27 HG2 GLU 82 2HG GLU 82 4.559 14.598 1.483 28 HG3 GLU 82 1HG GLU 82 5.673 13.712 2.519 29 H GLU 83 H GLU 83 6.226 15.220 -2.001 30 HA GLU 83 HA GLU 83 3.451 14.805 -2.160 31 HB2 GLU 83 2HB GLU 83 4.705 16.711 -3.179 32 HB3 GLU 83 1HB GLU 83 5.296 15.601 -4.415 33 HG2 GLU 83 2HG GLU 83 3.366 16.696 -5.330 34 HG3 GLU 83 1HG GLU 83 2.872 15.054 -4.936 35 H GLU 84 H GLU 84 6.098 13.319 -4.125 36 HA GLU 84 HA GLU 84 4.577 11.755 -5.815 37 HB2 GLU 84 2HB GLU 84 7.069 11.809 -5.836 38 HB3 GLU 84 1HB GLU 84 7.074 10.822 -4.374 39 HG2 GLU 84 2HG GLU 84 5.889 9.023 -5.555 40 HG3 GLU 84 1HG GLU 84 5.812 10.011 -7.010 41 H ILE 85 H ILE 85 5.632 10.931 -2.522 42 HA ILE 85 HA ILE 85 4.399 8.424 -2.272 43 HB ILE 85 HB ILE 85 4.693 10.542 -0.110 44 HG12 ILE 85 2HG1 ILE 85 6.641 8.364 -0.918 45 HG13 ILE 85 1HG1 ILE 85 6.818 10.061 -1.366 46 HG21 ILE 85 1HG2 ILE 85 4.726 8.651 1.422 47 HG22 ILE 85 2HG2 ILE 85 4.658 7.508 0.082 48 HG23 ILE 85 3HG2 ILE 85 3.271 8.537 0.433 49 HD11 ILE 85 3HD1 ILE 85 8.140 9.708 0.621 50 HD12 ILE 85 1HD1 ILE 85 6.800 8.893 1.428 51 HD13 ILE 85 2HD1 ILE 85 6.710 10.623 1.100 52 H ARG 86 H ARG 86 3.151 11.704 -1.574 53 HA ARG 86 HA ARG 86 0.618 10.921 -0.649 54 HB2 ARG 86 2HB ARG 86 1.589 13.446 -1.998 55 HB3 ARG 86 1HB ARG 86 -0.029 13.285 -1.334 56 HG2 ARG 86 2HG ARG 86 2.344 12.602 0.400 57 HG3 ARG 86 1HG ARG 86 1.918 14.297 0.155 58 HD2 ARG 86 2HD ARG 86 -0.339 13.889 0.984 59 HD3 ARG 86 1HD ARG 86 -0.012 12.170 1.150 60 HE ARG 86 HE ARG 86 0.971 14.316 2.876 61 HH11 ARG 86 1HH2 ARG 86 1.099 10.979 1.903 62 HH12 ARG 86 2HH2 ARG 86 1.719 10.421 3.420 63 HH21 ARG 86 1HH1 ARG 86 1.783 13.576 4.868 64 HH22 ARG 86 2HH1 ARG 86 2.107 11.891 5.097 65 H GLU 87 H GLU 87 1.791 11.532 -3.934 66 HA GLU 87 HA GLU 87 -0.805 11.227 -5.141 67 HB2 GLU 87 2HB GLU 87 1.989 11.311 -6.284 68 HB3 GLU 87 1HB GLU 87 0.535 11.161 -7.273 69 HG2 GLU 87 2HG GLU 87 -0.332 13.266 -6.375 70 HG3 GLU 87 1HG GLU 87 1.062 13.408 -5.307 71 H ALA 88 H ALA 88 2.146 9.323 -5.579 72 HA ALA 88 HA ALA 88 1.281 7.118 -6.870 73 HB1 ALA 88 1HB ALA 88 3.599 7.368 -6.180 74 HB2 ALA 88 2HB ALA 88 2.994 5.801 -5.636 75 HB3 ALA 88 3HB ALA 88 3.150 7.135 -4.491 76 H PHE 89 H PHE 89 1.181 7.372 -3.285 77 HA PHE 89 HA PHE 89 -0.272 4.987 -2.915 78 HB2 PHE 89 2HB PHE 89 0.190 7.430 -1.233 79 HB3 PHE 89 1HB PHE 89 -0.809 6.093 -0.658 80 HD1 PHE 89 2HD PHE 89 2.554 6.770 -2.184 81 HD2 PHE 89 1HD PHE 89 0.241 4.242 0.386 82 HE1 PHE 89 2HE PHE 89 4.589 5.559 -1.573 83 HE2 PHE 89 1HE PHE 89 2.285 3.003 0.943 84 HZ PHE 89 HZ PHE 89 4.458 3.643 0.004 85 H ARG 90 H ARG 90 -1.348 8.402 -3.236 86 HA ARG 90 HA ARG 90 -4.074 7.993 -2.689 87 HB2 ARG 90 2HB ARG 90 -2.500 9.988 -4.215 88 HB3 ARG 90 1HB ARG 90 -4.227 9.940 -4.552 89 HG2 ARG 90 2HG ARG 90 -4.729 10.215 -2.169 90 HG3 ARG 90 1HG ARG 90 -3.011 10.193 -1.772 91 HD2 ARG 90 2HD ARG 90 -2.693 12.175 -3.196 92 HD3 ARG 90 1HD ARG 90 -4.420 12.214 -3.515 93 HE ARG 90 HE ARG 90 -3.086 13.004 -1.039 94 HH11 ARG 90 1HH2 ARG 90 -6.025 12.155 -2.671 95 HH12 ARG 90 2HH2 ARG 90 -7.055 12.908 -1.500 96 HH21 ARG 90 1HH1 ARG 90 -4.442 14.023 0.493 97 HH22 ARG 90 2HH1 ARG 90 -6.161 13.969 0.287 98 H VAL 91 H VAL 91 -2.270 7.689 -5.732 99 HA VAL 91 HA VAL 91 -4.446 7.016 -7.396 100 HB VAL 91 HB VAL 91 -1.501 6.334 -7.595 101 HG11 VAL 91 1HG1 VAL 91 -2.671 4.748 -8.973 102 HG12 VAL 91 2HG1 VAL 91 -2.067 6.008 -10.046 103 HG13 VAL 91 3HG1 VAL 91 -3.766 5.993 -9.576 104 HG21 VAL 91 3HG2 VAL 91 -2.281 8.771 -7.630 105 HG22 VAL 91 1HG2 VAL 91 -3.108 8.382 -9.137 106 HG23 VAL 91 2HG2 VAL 91 -1.354 8.236 -9.031 107 H PHE 92 H PHE 92 -2.194 5.035 -5.520 108 HA PHE 92 HA PHE 92 -2.872 2.492 -6.339 109 HB2 PHE 92 2HB PHE 92 -1.910 3.648 -3.757 110 HB3 PHE 92 1HB PHE 92 -2.481 1.988 -3.709 111 HD1 PHE 92 1HD PHE 92 -0.808 3.733 -6.568 112 HD2 PHE 92 2HD PHE 92 -0.462 0.803 -3.445 113 HE1 PHE 92 1HE PHE 92 1.326 2.956 -7.541 114 HE2 PHE 92 2HE PHE 92 1.677 0.023 -4.424 115 HZ PHE 92 HZ PHE 92 2.570 1.098 -6.472 116 H ASP 93 H ASP 93 -4.447 4.255 -3.638 117 HA ASP 93 HA ASP 93 -6.427 2.351 -3.121 118 HB2 ASP 93 2HB ASP 93 -5.898 4.470 -1.807 119 HB3 ASP 93 1HB ASP 93 -6.867 5.338 -2.992 120 H LYS 94 H LYS 94 -6.968 1.538 -5.248 121 HA LYS 94 HA LYS 94 -7.950 2.918 -7.419 122 HB2 LYS 94 2HB LYS 94 -8.212 0.183 -6.339 123 HB3 LYS 94 1HB LYS 94 -9.580 0.636 -7.349 124 HG2 LYS 94 2HG LYS 94 -7.903 -0.404 -8.743 125 HG3 LYS 94 1HG LYS 94 -7.947 1.318 -9.126 126 HD2 LYS 94 2HD LYS 94 -5.981 1.729 -7.760 127 HD3 LYS 94 1HD LYS 94 -5.978 0.058 -7.192 128 HE2 LYS 94 2HE LYS 94 -4.439 0.844 -9.243 129 HE3 LYS 94 1HE LYS 94 -5.161 -0.766 -9.202 130 HZ1 LYS 94 3HZ LYS 94 -5.673 0.114 -11.292 131 HZ2 LYS 94 1HZ LYS 94 -6.087 1.634 -10.663 132 HZ3 LYS 94 2HZ LYS 94 -7.103 0.299 -10.394 133 H ASP 95 H ASP 95 -9.851 1.618 -4.734 134 HA ASP 95 HA ASP 95 -12.316 2.753 -5.516 135 HB2 ASP 95 2HB ASP 95 -11.969 0.861 -3.895 136 HB3 ASP 95 1HB ASP 95 -11.421 2.048 -2.716 137 H GLY 96 H GLY 96 -9.605 4.338 -4.841 138 HA2 GLY 96 2HA GLY 96 -9.012 6.342 -3.790 139 HA3 GLY 96 1HA GLY 96 -10.358 6.889 -4.784 140 H ASN 97 H ASN 97 -10.227 4.919 -1.783 141 HA ASN 97 HA ASN 97 -12.246 6.733 -0.618 142 HB2 ASN 97 2HB ASN 97 -12.649 4.887 0.994 143 HB3 ASN 97 1HB ASN 97 -12.990 4.456 -0.677 144 HD21 ASN 97 1HD2 ASN 97 -12.651 2.162 -0.145 145 HD22 ASN 97 2HD2 ASN 97 -11.085 1.549 0.080 146 H GLY 98 H GLY 98 -9.082 6.810 -0.677 147 HA2 GLY 98 2HA GLY 98 -7.545 7.845 0.701 148 HA3 GLY 98 1HA GLY 98 -8.866 8.204 1.807 149 H TYR 99 H TYR 99 -7.817 5.018 0.689 150 HA TYR 99 HA TYR 99 -6.427 4.402 3.138 151 HB2 TYR 99 2HB TYR 99 -9.159 3.258 2.563 152 HB3 TYR 99 1HB TYR 99 -8.003 2.494 3.655 153 HD1 TYR 99 2HD TYR 99 -6.964 4.031 5.510 154 HD2 TYR 99 1HD TYR 99 -10.591 4.927 3.396 155 HE1 TYR 99 2HE TYR 99 -7.628 5.597 7.315 156 HE2 TYR 99 1HE TYR 99 -11.256 6.500 5.200 157 HH TYR 99 HH TYR 99 -9.326 6.822 8.155 158 H ILE 100 H ILE 100 -5.682 2.033 3.095 159 HA ILE 100 HA ILE 100 -5.360 1.128 0.275 160 HB ILE 100 HB ILE 100 -3.369 0.985 2.548 161 HG12 ILE 100 2HG1 ILE 100 -3.670 3.279 1.634 162 HG13 ILE 100 1HG1 ILE 100 -2.103 2.627 1.175 163 HG21 ILE 100 1HG2 ILE 100 -2.942 -0.888 1.184 164 HG22 ILE 100 2HG2 ILE 100 -1.865 0.356 0.543 165 HG23 ILE 100 3HG2 ILE 100 -3.367 -0.020 -0.294 166 HD11 ILE 100 3HD1 ILE 100 -3.410 1.832 -0.994 167 HD12 ILE 100 1HD1 ILE 100 -2.800 3.478 -0.843 168 HD13 ILE 100 2HD1 ILE 100 -4.499 3.138 -0.532 169 H SER 101 H SER 101 -6.406 -0.709 -0.090 170 HA SER 101 HA SER 101 -6.686 -2.685 2.083 171 HB2 SER 101 2HB SER 101 -8.563 -3.500 0.989 172 HB3 SER 101 1HB SER 101 -8.624 -1.817 0.476 173 HG SER 101 HG SER 101 -8.567 -3.866 -1.061 174 H ALA 102 H ALA 102 -6.321 -4.941 1.550 175 HA ALA 102 HA ALA 102 -3.790 -5.394 0.402 176 HB1 ALA 102 1HB ALA 102 -4.823 -7.912 0.543 177 HB2 ALA 102 2HB ALA 102 -5.952 -7.057 1.589 178 HB3 ALA 102 3HB ALA 102 -4.233 -7.045 1.962 179 H ALA 103 H ALA 103 -7.053 -5.849 -0.889 180 HA ALA 103 HA ALA 103 -6.386 -7.362 -3.129 181 HB1 ALA 103 1HB ALA 103 -8.696 -6.736 -2.159 182 HB2 ALA 103 2HB ALA 103 -8.545 -6.863 -3.912 183 HB3 ALA 103 3HB ALA 103 -8.556 -5.276 -3.140 184 H GLU 104 H GLU 104 -6.270 -3.845 -2.629 185 HA GLU 104 HA GLU 104 -5.876 -3.157 -5.345 186 HB2 GLU 104 2HB GLU 104 -5.039 -1.706 -2.817 187 HB3 GLU 104 1HB GLU 104 -5.129 -0.995 -4.431 188 HG2 GLU 104 2HG GLU 104 -7.526 -1.454 -4.525 189 HG3 GLU 104 1HG GLU 104 -7.446 -2.254 -2.961 190 H LEU 105 H LEU 105 -3.655 -4.097 -2.735 191 HA LEU 105 HA LEU 105 -1.266 -3.261 -4.029 192 HB2 LEU 105 2HB LEU 105 -1.551 -5.572 -2.114 193 HB3 LEU 105 1HB LEU 105 -0.130 -4.569 -2.378 194 HG LEU 105 HG LEU 105 -2.752 -3.749 -1.112 195 HD11 LEU 105 1HD1 LEU 105 0.075 -3.603 -0.043 196 HD12 LEU 105 2HD1 LEU 105 -1.017 -4.947 0.278 197 HD13 LEU 105 3HD1 LEU 105 -1.419 -3.333 0.845 198 HD21 LEU 105 3HD2 LEU 105 -0.441 -2.090 -2.123 199 HD22 LEU 105 1HD2 LEU 105 -1.487 -1.514 -0.827 200 HD23 LEU 105 2HD2 LEU 105 -2.163 -1.860 -2.416 201 H ARG 106 H ARG 106 -2.666 -6.547 -3.747 202 HA ARG 106 HA ARG 106 -0.820 -7.784 -5.439 203 HB2 ARG 106 2HB ARG 106 -2.488 -9.586 -5.677 204 HB3 ARG 106 1HB ARG 106 -2.355 -9.068 -4.002 205 HG2 ARG 106 2HG ARG 106 -4.354 -7.588 -4.370 206 HG3 ARG 106 1HG ARG 106 -4.533 -8.309 -5.969 207 HD2 ARG 106 2HD ARG 106 -4.686 -10.553 -4.896 208 HD3 ARG 106 1HD ARG 106 -4.594 -9.766 -3.326 209 HE ARG 106 HE ARG 106 -6.783 -9.004 -3.599 210 HH11 ARG 106 1HH2 ARG 106 -5.576 -10.579 -6.458 211 HH12 ARG 106 2HH2 ARG 106 -7.122 -10.646 -7.234 212 HH21 ARG 106 1HH1 ARG 106 -8.813 -9.097 -4.623 213 HH22 ARG 106 2HH1 ARG 106 -8.952 -9.806 -6.198 214 H HIS 107 H HIS 107 -3.995 -6.354 -6.232 215 HA HIS 107 HA HIS 107 -3.933 -6.970 -8.981 216 HB2 HIS 107 2HB HIS 107 -5.949 -6.266 -7.715 217 HB3 HIS 107 1HB HIS 107 -5.278 -4.642 -7.595 218 HD1 HIS 107 1HD HIS 107 -4.115 -4.699 -10.610 219 HD2 HIS 107 2HD HIS 107 -8.044 -5.458 -9.452 220 HE1 HIS 107 1HE HIS 107 -5.567 -4.212 -12.629 221 HE2 HIS 107 2HE HIS 107 -7.964 -4.673 -11.938 222 H VAL 108 H VAL 108 -2.917 -4.056 -7.191 223 HA VAL 108 HA VAL 108 -2.160 -2.575 -9.470 224 HB VAL 108 HB VAL 108 -1.275 -2.417 -6.588 225 HG11 VAL 108 1HG1 VAL 108 -0.514 -0.739 -8.982 226 HG12 VAL 108 2HG1 VAL 108 0.542 -1.430 -7.750 227 HG13 VAL 108 3HG1 VAL 108 -0.502 -0.063 -7.355 228 HG21 VAL 108 3HG2 VAL 108 -2.917 -0.779 -6.347 229 HG22 VAL 108 1HG2 VAL 108 -3.700 -1.830 -7.529 230 HG23 VAL 108 2HG2 VAL 108 -2.892 -0.355 -8.055 231 H MET 109 H MET 109 -0.197 -4.602 -7.267 232 HA MET 109 HA MET 109 2.265 -4.212 -8.561 233 HB2 MET 109 2HB MET 109 1.132 -6.465 -6.918 234 HB3 MET 109 1HB MET 109 2.753 -6.572 -7.601 235 HG2 MET 109 2HG MET 109 1.819 -4.249 -5.893 236 HG3 MET 109 1HG MET 109 2.658 -5.656 -5.242 237 HE1 MET 109 3HE MET 109 3.939 -2.641 -4.888 238 HE2 MET 109 1HE MET 109 5.564 -3.336 -4.962 239 HE3 MET 109 2HE MET 109 4.252 -4.234 -4.202 240 H THR 110 H THR 110 -0.202 -6.730 -9.060 241 HA THR 110 HA THR 110 1.135 -8.053 -11.172 242 HB THR 110 HB THR 110 -1.823 -7.865 -10.562 243 HG1 THR 110 1HG THR 110 -1.464 -9.754 -9.464 244 HG21 THR 110 3HG2 THR 110 -0.223 -9.631 -12.429 245 HG22 THR 110 1HG2 THR 110 -1.612 -8.615 -12.824 246 HG23 THR 110 2HG2 THR 110 -1.831 -10.072 -11.855 247 H ASN 111 H ASN 111 -1.301 -5.450 -11.138 248 HA ASN 111 HA ASN 111 -1.581 -5.193 -13.928 249 HB2 ASN 111 2HB ASN 111 -3.096 -4.239 -12.189 250 HB3 ASN 111 1HB ASN 111 -1.869 -3.029 -11.837 251 HD21 ASN 111 1HD2 ASN 111 -2.981 -1.180 -12.664 252 HD22 ASN 111 2HD2 ASN 111 -3.410 -1.009 -14.297 253 H LEU 112 H LEU 112 0.607 -3.754 -11.612 254 HA LEU 112 HA LEU 112 1.813 -1.828 -13.254 255 HB2 LEU 112 2HB LEU 112 2.637 -3.307 -10.771 256 HB3 LEU 112 1HB LEU 112 3.832 -2.311 -11.602 257 HG LEU 112 HG LEU 112 1.104 -1.313 -10.719 258 HD11 LEU 112 1HD1 LEU 112 2.599 -1.969 -8.810 259 HD12 LEU 112 2HD1 LEU 112 2.238 -0.248 -8.855 260 HD13 LEU 112 3HD1 LEU 112 3.799 -0.833 -9.420 261 HD21 LEU 112 3HD2 LEU 112 1.700 0.273 -12.282 262 HD22 LEU 112 1HD2 LEU 112 3.417 -0.109 -12.195 263 HD23 LEU 112 2HD2 LEU 112 2.671 0.907 -10.959 264 H GLY 113 H GLY 113 2.444 -5.263 -12.796 265 HA2 GLY 113 2HA GLY 113 3.239 -6.235 -15.041 266 HA3 GLY 113 1HA GLY 113 4.593 -5.127 -14.840 267 H GLU 114 H GLU 114 3.648 -6.081 -11.805 268 HA GLU 114 HA GLU 114 5.552 -8.369 -11.764 269 HB2 GLU 114 2HB GLU 114 5.182 -6.191 -9.690 270 HB3 GLU 114 1HB GLU 114 6.237 -7.594 -9.525 271 HG2 GLU 114 2HG GLU 114 7.724 -5.954 -10.305 272 HG3 GLU 114 1HG GLU 114 7.273 -6.781 -11.794 273 H LYS 115 H LYS 115 4.551 -10.182 -11.262 274 HA LYS 115 HA LYS 115 1.989 -10.142 -9.852 275 HB2 LYS 115 2HB LYS 115 2.281 -11.547 -11.867 276 HB3 LYS 115 1HB LYS 115 3.527 -12.472 -11.030 277 HG2 LYS 115 2HG LYS 115 1.916 -13.177 -9.336 278 HG3 LYS 115 1HG LYS 115 0.667 -12.170 -10.067 279 HD2 LYS 115 2HD LYS 115 0.833 -13.502 -12.154 280 HD3 LYS 115 1HD LYS 115 2.048 -14.525 -11.386 281 HE2 LYS 115 2HE LYS 115 -0.781 -14.138 -10.360 282 HE3 LYS 115 1HE LYS 115 -0.226 -15.535 -11.284 283 HZ1 LYS 115 3HZ LYS 115 0.911 -14.653 -8.690 284 HZ2 LYS 115 1HZ LYS 115 1.349 -16.041 -9.560 285 HZ3 LYS 115 2HZ LYS 115 -0.204 -15.919 -8.882 286 H LEU 116 H LEU 116 2.430 -9.689 -7.727 287 HA LEU 116 HA LEU 116 4.482 -11.078 -6.247 288 HB2 LEU 116 2HB LEU 116 2.740 -8.789 -5.843 289 HB3 LEU 116 1HB LEU 116 2.627 -9.841 -4.437 290 HG LEU 116 HG LEU 116 5.189 -9.853 -4.425 291 HD11 LEU 116 1HD1 LEU 116 6.354 -8.194 -5.667 292 HD12 LEU 116 2HD1 LEU 116 4.862 -7.366 -6.112 293 HD13 LEU 116 3HD1 LEU 116 5.249 -8.932 -6.828 294 HD21 LEU 116 3HD2 LEU 116 4.061 -8.588 -2.756 295 HD22 LEU 116 1HD2 LEU 116 3.531 -7.375 -3.922 296 HD23 LEU 116 2HD2 LEU 116 5.232 -7.473 -3.463 297 H THR 117 H THR 117 3.383 -11.750 -3.873 298 HA THR 117 HA THR 117 1.606 -14.019 -4.566 299 HB THR 117 HB THR 117 2.408 -14.906 -2.320 300 HG1 THR 117 1HG THR 117 3.677 -12.497 -2.451 301 HG21 THR 117 3HG2 THR 117 3.323 -15.901 -4.274 302 HG22 THR 117 1HG2 THR 117 4.719 -15.468 -3.287 303 HG23 THR 117 2HG2 THR 117 4.265 -14.461 -4.661 304 H ASP 118 H ASP 118 -0.446 -13.894 -3.949 305 HA ASP 118 HA ASP 118 -1.578 -11.744 -2.579 306 HB2 ASP 118 2HB ASP 118 -2.566 -14.554 -3.055 307 HB3 ASP 118 1HB ASP 118 -3.551 -13.325 -2.264 308 H GLU 119 H GLU 119 -0.359 -14.831 -1.397 309 HA GLU 119 HA GLU 119 -1.410 -14.726 1.219 310 HB2 GLU 119 2HB GLU 119 1.117 -16.025 0.158 311 HB3 GLU 119 1HB GLU 119 0.436 -16.321 1.760 312 HG2 GLU 119 2HG GLU 119 -1.636 -17.144 0.768 313 HG3 GLU 119 1HG GLU 119 -1.042 -16.757 -0.843 314 H GLU 120 H GLU 120 1.494 -13.332 -0.228 315 HA GLU 120 HA GLU 120 2.572 -12.395 2.288 316 HB2 GLU 120 2HB GLU 120 3.242 -11.712 -0.582 317 HB3 GLU 120 1HB GLU 120 4.091 -11.035 0.809 318 HG2 GLU 120 2HG GLU 120 4.718 -13.289 1.550 319 HG3 GLU 120 1HG GLU 120 3.837 -13.994 0.196 320 H VAL 121 H VAL 121 0.797 -10.968 -0.422 321 HA VAL 121 HA VAL 121 0.707 -8.303 0.436 322 HB VAL 121 HB VAL 121 -1.212 -9.994 -1.160 323 HG11 VAL 121 1HG1 VAL 121 -2.668 -8.384 -0.195 324 HG12 VAL 121 2HG1 VAL 121 -2.266 -7.755 -1.792 325 HG13 VAL 121 3HG1 VAL 121 -1.473 -7.104 -0.361 326 HG21 VAL 121 3HG2 VAL 121 0.835 -9.462 -2.319 327 HG22 VAL 121 1HG2 VAL 121 0.748 -7.775 -1.814 328 HG23 VAL 121 2HG2 VAL 121 -0.415 -8.409 -2.971 329 H ASP 122 H ASP 122 -1.889 -10.711 0.806 330 HA ASP 122 HA ASP 122 -3.531 -9.400 2.569 331 HB2 ASP 122 2HB ASP 122 -3.850 -11.679 1.487 332 HB3 ASP 122 1HB ASP 122 -2.855 -12.343 2.780 333 H GLU 123 H GLU 123 -0.614 -11.320 3.339 334 HA GLU 123 HA GLU 123 -0.858 -10.924 6.159 335 HB2 GLU 123 2HB GLU 123 0.396 -12.807 5.400 336 HB3 GLU 123 1HB GLU 123 1.465 -11.787 4.438 337 HG2 GLU 123 2HG GLU 123 1.245 -11.295 7.410 338 HG3 GLU 123 1HG GLU 123 2.239 -12.630 6.829 339 H MET 124 H MET 124 0.741 -9.195 3.541 340 HA MET 124 HA MET 124 2.536 -7.583 4.861 341 HB2 MET 124 2HB MET 124 1.899 -7.744 2.340 342 HB3 MET 124 1HB MET 124 0.760 -6.451 2.703 343 HG2 MET 124 2HG MET 124 2.678 -5.279 2.044 344 HG3 MET 124 1HG MET 124 2.826 -5.281 3.801 345 HE1 MET 124 3HE MET 124 5.788 -4.994 3.589 346 HE2 MET 124 1HE MET 124 4.900 -4.512 2.139 347 HE3 MET 124 2HE MET 124 6.318 -5.550 2.005 348 H ILE 125 H ILE 125 -0.704 -6.449 3.932 349 HA ILE 125 HA ILE 125 -0.721 -4.172 5.541 350 HB ILE 125 HB ILE 125 -2.925 -5.906 4.417 351 HG12 ILE 125 2HG1 ILE 125 -2.098 -3.031 3.898 352 HG13 ILE 125 1HG1 ILE 125 -1.618 -4.413 2.913 353 HG21 ILE 125 1HG2 ILE 125 -3.164 -3.682 6.421 354 HG22 ILE 125 2HG2 ILE 125 -4.114 -5.147 6.280 355 HG23 ILE 125 3HG2 ILE 125 -4.408 -3.801 5.179 356 HD11 ILE 125 3HD1 ILE 125 -4.371 -3.228 3.280 357 HD12 ILE 125 1HD1 ILE 125 -4.164 -4.875 2.693 358 HD13 ILE 125 2HD1 ILE 125 -3.505 -3.521 1.773 359 H ARG 126 H ARG 126 -1.826 -7.462 6.283 360 HA ARG 126 HA ARG 126 -2.984 -7.029 8.749 361 HB2 ARG 126 2HB ARG 126 -1.414 -9.344 7.660 362 HB3 ARG 126 1HB ARG 126 -2.211 -9.421 9.225 363 HG2 ARG 126 2HG ARG 126 -3.796 -8.527 6.816 364 HG3 ARG 126 1HG ARG 126 -3.486 -10.248 7.042 365 HD2 ARG 126 2HD ARG 126 -4.504 -10.178 9.256 366 HD3 ARG 126 1HD ARG 126 -4.736 -8.439 9.133 367 HE ARG 126 HE ARG 126 -5.978 -9.809 6.962 368 HH11 ARG 126 1HH2 ARG 126 -6.199 -9.014 10.325 369 HH12 ARG 126 2HH2 ARG 126 -7.930 -9.072 10.370 370 HH21 ARG 126 1HH1 ARG 126 -8.257 -9.903 7.011 371 HH22 ARG 126 2HH1 ARG 126 -9.096 -9.578 8.491 372 H GLU 127 H GLU 127 0.473 -7.480 8.014 373 HA GLU 127 HA GLU 127 1.174 -7.282 10.819 374 HB2 GLU 127 2HB GLU 127 2.887 -7.369 8.328 375 HB3 GLU 127 1HB GLU 127 3.515 -7.376 9.975 376 HG2 GLU 127 2HG GLU 127 1.599 -9.444 8.849 377 HG3 GLU 127 1HG GLU 127 3.337 -9.671 9.015 378 H ALA 128 H ALA 128 1.418 -5.220 7.949 379 HA ALA 128 HA ALA 128 2.793 -3.076 9.185 380 HB1 ALA 128 1HB ALA 128 2.374 -1.885 7.219 381 HB2 ALA 128 2HB ALA 128 0.777 -2.608 7.000 382 HB3 ALA 128 3HB ALA 128 2.228 -3.552 6.665 383 H ASP 129 H ASP 129 -0.690 -3.474 8.527 384 HA ASP 129 HA ASP 129 -1.734 -1.199 9.616 385 HB2 ASP 129 2HB ASP 129 -3.042 -3.054 8.603 386 HB3 ASP 129 1HB ASP 129 -2.835 -3.975 10.085 387 H ILE 130 H ILE 130 -1.843 -0.263 11.542 388 HA ILE 130 HA ILE 130 -0.578 -1.599 13.826 389 HB ILE 130 HB ILE 130 -1.572 1.256 13.540 390 HG12 ILE 130 2HG1 ILE 130 1.197 0.041 13.378 391 HG13 ILE 130 1HG1 ILE 130 0.302 0.714 12.022 392 HG21 ILE 130 1HG2 ILE 130 -1.461 0.385 15.914 393 HG22 ILE 130 2HG2 ILE 130 -0.294 1.663 15.596 394 HG23 ILE 130 3HG2 ILE 130 0.235 -0.015 15.637 395 HD11 ILE 130 3HD1 ILE 130 1.253 2.240 14.474 396 HD12 ILE 130 1HD1 ILE 130 0.240 2.918 13.200 397 HD13 ILE 130 2HD1 ILE 130 1.882 2.394 12.834 398 H ASP 131 H ASP 131 -3.699 -0.433 12.792 399 HA ASP 131 HA ASP 131 -4.938 -1.016 15.392 400 HB2 ASP 131 2HB ASP 131 -6.042 0.129 12.820 401 HB3 ASP 131 1HB ASP 131 -7.002 -0.148 14.271 402 H GLY 132 H GLY 132 -4.124 -2.708 12.644 403 HA2 GLY 132 2HA GLY 132 -4.849 -4.660 11.648 404 HA3 GLY 132 1HA GLY 132 -5.204 -5.139 13.307 405 H ASP 133 H ASP 133 -6.598 -3.023 10.783 406 HA ASP 133 HA ASP 133 -9.293 -4.081 11.461 407 HB2 ASP 133 2HB ASP 133 -10.118 -1.871 10.634 408 HB3 ASP 133 1HB ASP 133 -9.136 -1.763 12.096 409 H GLY 134 H GLY 134 -6.994 -3.243 8.946 410 HA2 GLY 134 2HA GLY 134 -7.130 -4.732 6.941 411 HA3 GLY 134 1HA GLY 134 -8.846 -4.348 6.895 412 H GLN 135 H GLN 135 -7.528 -1.554 7.858 413 HA GLN 135 HA GLN 135 -7.010 -0.580 5.096 414 HB2 GLN 135 2HB GLN 135 -8.409 0.903 7.349 415 HB3 GLN 135 1HB GLN 135 -8.073 1.536 5.741 416 HG2 GLN 135 2HG GLN 135 -9.811 -0.871 6.351 417 HG3 GLN 135 1HG GLN 135 -10.400 0.724 5.896 418 HE21 GLN 135 1HE2 GLN 135 -9.841 -2.282 4.606 419 HE22 GLN 135 2HE2 GLN 135 -9.550 -1.853 2.990 420 H VAL 136 H VAL 136 -5.050 0.159 4.826 421 HA VAL 136 HA VAL 136 -3.497 1.036 7.213 422 HB VAL 136 HB VAL 136 -2.654 -0.189 4.580 423 HG11 VAL 136 1HG1 VAL 136 -0.290 0.263 5.420 424 HG12 VAL 136 2HG1 VAL 136 -1.028 1.404 6.540 425 HG13 VAL 136 3HG1 VAL 136 -1.187 1.651 4.814 426 HG21 VAL 136 3HG2 VAL 136 -1.616 -0.870 7.326 427 HG22 VAL 136 1HG2 VAL 136 -1.758 -1.898 5.901 428 HG23 VAL 136 2HG2 VAL 136 -3.196 -1.461 6.822 429 H ASN 137 H ASN 137 -2.977 3.058 7.416 430 HA ASN 137 HA ASN 137 -3.858 5.060 5.604 431 HB2 ASN 137 2HB ASN 137 -1.789 5.275 7.793 432 HB3 ASN 137 1HB ASN 137 -2.624 6.622 7.020 433 HD21 ASN 137 1HD2 ASN 137 -2.694 5.030 9.844 434 HD22 ASN 137 2HD2 ASN 137 -4.359 5.046 10.178 435 H TYR 138 H TYR 138 -1.509 6.775 5.631 436 HA TYR 138 HA TYR 138 -0.180 5.695 3.269 437 HB2 TYR 138 2HB TYR 138 0.061 8.397 4.619 438 HB3 TYR 138 1HB TYR 138 0.741 7.960 3.051 439 HD1 TYR 138 2HD TYR 138 -2.365 8.629 4.924 440 HD2 TYR 138 1HD TYR 138 -0.685 7.663 1.090 441 HE1 TYR 138 2HE TYR 138 -4.529 9.177 3.842 442 HE2 TYR 138 1HE TYR 138 -2.853 8.211 0.005 443 HH TYR 138 HH TYR 138 -5.254 9.945 1.470 444 H GLU 139 H GLU 139 0.894 7.138 6.392 445 HA GLU 139 HA GLU 139 3.617 6.521 6.066 446 HB2 GLU 139 2HB GLU 139 2.004 6.898 8.594 447 HB3 GLU 139 1HB GLU 139 3.768 6.870 8.522 448 HG2 GLU 139 2HG GLU 139 2.030 8.777 6.932 449 HG3 GLU 139 1HG GLU 139 2.814 9.193 8.455 450 H GLU 140 H GLU 140 1.395 4.940 8.322 451 HA GLU 140 HA GLU 140 2.642 2.726 9.198 452 HB2 GLU 140 2HB GLU 140 -0.105 2.838 7.973 453 HB3 GLU 140 1HB GLU 140 0.485 1.414 8.822 454 HG2 GLU 140 2HG GLU 140 0.721 2.678 10.850 455 HG3 GLU 140 1HG GLU 140 0.360 4.187 10.027 456 H PHE 141 H PHE 141 1.792 3.390 5.887 457 HA PHE 141 HA PHE 141 2.590 0.746 4.925 458 HB2 PHE 141 2HB PHE 141 0.672 2.284 4.028 459 HB3 PHE 141 1HB PHE 141 1.955 3.078 3.147 460 HD1 PHE 141 2HD PHE 141 3.693 1.306 2.001 461 HD2 PHE 141 1HD PHE 141 -0.436 0.536 2.926 462 HE1 PHE 141 2HE PHE 141 3.665 -0.537 0.360 463 HE2 PHE 141 1HE PHE 141 -0.459 -1.289 1.264 464 HZ PHE 141 HZ PHE 141 1.591 -1.833 -0.019 465 H VAL 142 H VAL 142 3.528 4.173 4.302 466 HA VAL 142 HA VAL 142 5.605 4.048 2.643 467 HB VAL 142 HB VAL 142 5.501 5.512 5.276 468 HG11 VAL 142 1HG1 VAL 142 7.832 5.406 4.864 469 HG12 VAL 142 2HG1 VAL 142 7.329 6.958 4.194 470 HG13 VAL 142 3HG1 VAL 142 7.611 5.584 3.126 471 HG21 VAL 142 3HG2 VAL 142 4.797 7.368 3.955 472 HG22 VAL 142 1HG2 VAL 142 3.921 5.998 3.274 473 HG23 VAL 142 2HG2 VAL 142 5.356 6.616 2.461 474 H GLN 143 H GLN 143 6.119 3.498 6.156 475 HA GLN 143 HA GLN 143 8.730 2.737 6.213 476 HB2 GLN 143 2HB GLN 143 6.456 1.301 7.608 477 HB3 GLN 143 1HB GLN 143 8.152 1.226 8.085 478 HG2 GLN 143 2HG GLN 143 6.477 3.754 7.968 479 HG3 GLN 143 1HG GLN 143 6.887 2.875 9.439 480 HE21 GLN 143 1HE2 GLN 143 7.773 5.594 7.858 481 HE22 GLN 143 2HE2 GLN 143 9.429 5.641 8.227 482 H MET 144 H MET 144 6.194 0.235 5.915 483 HA MET 144 HA MET 144 7.718 -1.908 5.179 484 HB2 MET 144 2HB MET 144 5.012 -1.085 4.108 485 HB3 MET 144 1HB MET 144 5.725 -2.673 3.830 486 HG2 MET 144 2HG MET 144 5.296 -1.485 6.581 487 HG3 MET 144 1HG MET 144 4.151 -2.567 5.793 488 HE1 MET 144 3HE MET 144 5.178 -5.668 7.425 489 HE2 MET 144 1HE MET 144 4.127 -4.961 6.189 490 HE3 MET 144 2HE MET 144 4.246 -4.217 7.780 491 H MET 145 H MET 145 6.394 0.546 2.923 492 HA MET 145 HA MET 145 7.715 -0.571 0.658 493 HB2 MET 145 2HB MET 145 5.615 0.874 0.653 494 HB3 MET 145 1HB MET 145 6.678 2.248 0.937 495 HG2 MET 145 2HG MET 145 7.359 0.424 -1.355 496 HG3 MET 145 1HG MET 145 6.000 1.526 -1.548 497 HE1 MET 145 3HE MET 145 6.679 4.281 -0.190 498 HE2 MET 145 1HE MET 145 5.990 3.794 -1.742 499 HE3 MET 145 2HE MET 145 7.311 4.953 -1.693 500 H THR 146 H THR 146 8.874 1.172 3.255 501 HA THR 146 HA THR 146 11.325 1.881 1.766 502 HB THR 146 HB THR 146 10.237 3.753 3.864 503 HG1 THR 146 1HG THR 146 9.726 3.772 1.076 504 HG21 THR 146 3HG2 THR 146 12.604 3.928 3.146 505 HG22 THR 146 1HG2 THR 146 11.673 5.352 2.681 506 HG23 THR 146 2HG2 THR 146 12.068 4.124 1.478 507 H ALA 147 H ALA 147 10.983 -0.396 3.287 508 HA ALA 147 HA ALA 147 12.163 0.109 5.925 509 HB1 ALA 147 1HB ALA 147 11.632 -2.123 6.429 510 HB2 ALA 147 2HB ALA 147 11.586 -2.594 4.729 511 HB3 ALA 147 3HB ALA 147 10.296 -1.601 5.404 512 H LYS 148 H LYS 148 14.254 -0.343 6.452 513 HA LYS 148 HA LYS 148 16.513 -0.688 6.110 514 HB2 LYS 148 2HB LYS 148 15.503 -2.843 4.229 515 HB3 LYS 148 1HB LYS 148 17.114 -2.755 4.941 516 HG2 LYS 148 2HG LYS 148 14.562 -2.941 6.579 517 HG3 LYS 148 1HG LYS 148 15.534 -4.338 6.130 518 HD2 LYS 148 2HD LYS 148 17.510 -3.077 7.220 519 HD3 LYS 148 1HD LYS 148 16.283 -2.043 7.946 520 HE2 LYS 148 2HE LYS 148 16.694 -3.763 9.545 521 HE3 LYS 148 1HE LYS 148 15.163 -4.184 8.783 522 HZ1 LYS 148 3HZ LYS 148 17.380 -5.767 8.972 523 HZ2 LYS 148 1HZ LYS 148 17.391 -5.248 7.359 524 HZ3 LYS 148 2HZ LYS 148 16.025 -6.043 7.982 Start of MODEL 16 1 H1 ASP 78 1HT ASP 78 6.378 17.994 6.726 2 H2 ASP 78 2HT ASP 78 6.710 19.573 6.201 3 H3 ASP 78 3HT ASP 78 7.608 18.271 5.588 4 HA ASP 78 HA ASP 78 5.284 17.411 4.832 5 HB2 ASP 78 2HB ASP 78 4.947 20.393 5.227 6 HB3 ASP 78 1HB ASP 78 3.912 19.450 4.155 7 H THR 79 H THR 79 7.429 20.185 4.205 8 HA THR 79 HA THR 79 7.257 19.876 1.329 9 HB THR 79 HB THR 79 9.175 21.569 1.383 10 HG1 THR 79 1HG THR 79 9.502 22.548 3.388 11 HG21 THR 79 3HG2 THR 79 6.990 22.408 0.974 12 HG22 THR 79 1HG2 THR 79 7.622 23.397 2.289 13 HG23 THR 79 2HG2 THR 79 6.478 22.101 2.632 14 H ASP 80 H ASP 80 8.230 17.616 3.075 15 HA ASP 80 HA ASP 80 11.038 17.328 2.394 16 HB2 ASP 80 2HB ASP 80 10.057 16.445 4.517 17 HB3 ASP 80 1HB ASP 80 9.130 15.290 3.563 18 H SER 81 H SER 81 8.410 17.228 0.528 19 HA SER 81 HA SER 81 8.251 16.509 -1.684 20 HB2 SER 81 2HB SER 81 9.958 15.316 -2.695 21 HB3 SER 81 1HB SER 81 10.826 15.972 -1.317 22 HG SER 81 HG SER 81 11.212 13.932 -0.926 23 H GLU 82 H GLU 82 7.389 15.186 1.037 24 HA GLU 82 HA GLU 82 6.748 12.504 0.624 25 HB2 GLU 82 2HB GLU 82 6.541 13.862 2.763 26 HB3 GLU 82 1HB GLU 82 5.033 14.496 2.107 27 HG2 GLU 82 2HG GLU 82 4.066 12.280 2.006 28 HG3 GLU 82 1HG GLU 82 5.602 11.539 2.433 29 H GLU 83 H GLU 83 5.840 15.050 -1.240 30 HA GLU 83 HA GLU 83 3.106 14.668 -1.719 31 HB2 GLU 83 2HB GLU 83 5.300 15.804 -3.451 32 HB3 GLU 83 1HB GLU 83 3.594 15.848 -3.887 33 HG2 GLU 83 2HG GLU 83 4.666 16.938 -1.273 34 HG3 GLU 83 1HG GLU 83 4.428 17.934 -2.707 35 H GLU 84 H GLU 84 5.900 13.366 -3.595 36 HA GLU 84 HA GLU 84 4.460 11.944 -5.498 37 HB2 GLU 84 2HB GLU 84 6.986 12.119 -5.361 38 HB3 GLU 84 1HB GLU 84 6.936 10.879 -4.108 39 HG2 GLU 84 2HG GLU 84 7.345 9.742 -6.189 40 HG3 GLU 84 1HG GLU 84 5.676 9.409 -5.742 41 H ILE 85 H ILE 85 5.545 10.809 -2.302 42 HA ILE 85 HA ILE 85 4.402 8.274 -2.285 43 HB ILE 85 HB ILE 85 4.672 10.260 -0.002 44 HG12 ILE 85 2HG1 ILE 85 6.414 7.877 -0.679 45 HG13 ILE 85 1HG1 ILE 85 6.772 9.509 -1.246 46 HG21 ILE 85 1HG2 ILE 85 4.327 7.256 0.129 47 HG22 ILE 85 2HG2 ILE 85 3.034 8.400 0.467 48 HG23 ILE 85 3HG2 ILE 85 4.452 8.362 1.488 49 HD11 ILE 85 3HD1 ILE 85 7.761 8.588 1.060 50 HD12 ILE 85 1HD1 ILE 85 6.214 9.150 1.678 51 HD13 ILE 85 2HD1 ILE 85 7.299 10.271 0.868 52 H ARG 86 H ARG 86 2.971 11.356 -1.228 53 HA ARG 86 HA ARG 86 0.451 10.408 -0.497 54 HB2 ARG 86 2HB ARG 86 1.418 13.076 -1.506 55 HB3 ARG 86 1HB ARG 86 -0.271 12.820 -1.085 56 HG2 ARG 86 2HG ARG 86 0.391 12.115 1.176 57 HG3 ARG 86 1HG ARG 86 2.086 12.299 0.757 58 HD2 ARG 86 2HD ARG 86 1.369 14.263 1.989 59 HD3 ARG 86 1HD ARG 86 1.664 14.729 0.316 60 HE ARG 86 HE ARG 86 -1.086 14.001 0.869 61 HH11 ARG 86 1HH2 ARG 86 1.289 16.503 0.783 62 HH12 ARG 86 2HH2 ARG 86 0.130 17.789 0.743 63 HH21 ARG 86 1HH1 ARG 86 -2.603 15.652 0.825 64 HH22 ARG 86 2HH1 ARG 86 -2.089 17.304 0.759 65 H GLU 87 H GLU 87 1.751 11.184 -3.669 66 HA GLU 87 HA GLU 87 -0.791 11.011 -5.026 67 HB2 GLU 87 2HB GLU 87 2.058 11.085 -6.032 68 HB3 GLU 87 1HB GLU 87 0.645 11.068 -7.086 69 HG2 GLU 87 2HG GLU 87 -0.175 13.144 -6.085 70 HG3 GLU 87 1HG GLU 87 1.168 13.148 -4.942 71 H ALA 88 H ALA 88 2.152 9.082 -5.511 72 HA ALA 88 HA ALA 88 1.280 6.969 -6.929 73 HB1 ALA 88 1HB ALA 88 3.573 7.091 -6.198 74 HB2 ALA 88 2HB ALA 88 2.912 5.553 -5.648 75 HB3 ALA 88 3HB ALA 88 3.100 6.889 -4.510 76 H PHE 89 H PHE 89 1.039 7.077 -3.348 77 HA PHE 89 HA PHE 89 -0.441 4.669 -3.147 78 HB2 PHE 89 2HB PHE 89 0.123 6.965 -1.316 79 HB3 PHE 89 1HB PHE 89 -1.076 5.746 -0.837 80 HD1 PHE 89 1HD PHE 89 -0.346 3.245 -1.086 81 HD2 PHE 89 2HD PHE 89 2.397 6.536 -0.910 82 HE1 PHE 89 1HE PHE 89 1.466 1.696 -0.413 83 HE2 PHE 89 2HE PHE 89 4.214 4.984 -0.237 84 HZ PHE 89 HZ PHE 89 3.748 2.575 0.009 85 H ARG 90 H ARG 90 -1.474 8.081 -3.329 86 HA ARG 90 HA ARG 90 -4.218 7.682 -2.868 87 HB2 ARG 90 2HB ARG 90 -2.580 9.746 -4.223 88 HB3 ARG 90 1HB ARG 90 -4.299 9.737 -4.610 89 HG2 ARG 90 2HG ARG 90 -4.856 9.854 -2.214 90 HG3 ARG 90 1HG ARG 90 -3.149 9.829 -1.795 91 HD2 ARG 90 2HD ARG 90 -2.838 11.928 -3.064 92 HD3 ARG 90 1HD ARG 90 -4.553 11.956 -3.425 93 HE ARG 90 HE ARG 90 -3.302 12.619 -0.877 94 HH11 ARG 90 1HH2 ARG 90 -6.163 11.791 -2.620 95 HH12 ARG 90 2HH2 ARG 90 -7.240 12.425 -1.418 96 HH21 ARG 90 1HH1 ARG 90 -4.700 13.505 0.659 97 HH22 ARG 90 2HH1 ARG 90 -6.415 13.407 0.423 98 H VAL 91 H VAL 91 -2.343 7.520 -5.874 99 HA VAL 91 HA VAL 91 -4.514 6.993 -7.615 100 HB VAL 91 HB VAL 91 -1.567 6.317 -7.834 101 HG11 VAL 91 1HG1 VAL 91 -2.111 6.190 -10.305 102 HG12 VAL 91 2HG1 VAL 91 -3.816 6.167 -9.857 103 HG13 VAL 91 3HG1 VAL 91 -2.751 4.860 -9.342 104 HG21 VAL 91 3HG2 VAL 91 -2.210 8.743 -7.677 105 HG22 VAL 91 1HG2 VAL 91 -3.213 8.524 -9.112 106 HG23 VAL 91 2HG2 VAL 91 -1.463 8.316 -9.216 107 H PHE 92 H PHE 92 -2.277 4.885 -5.868 108 HA PHE 92 HA PHE 92 -2.949 2.405 -6.867 109 HB2 PHE 92 2HB PHE 92 -1.998 3.402 -4.231 110 HB3 PHE 92 1HB PHE 92 -2.573 1.749 -4.264 111 HD1 PHE 92 2HD PHE 92 -0.888 3.661 -7.003 112 HD2 PHE 92 1HD PHE 92 -0.572 0.497 -4.115 113 HE1 PHE 92 2HE PHE 92 1.243 2.937 -8.032 114 HE2 PHE 92 1HE PHE 92 1.560 -0.229 -5.148 115 HZ PHE 92 HZ PHE 92 2.470 0.993 -7.104 116 H ASP 93 H ASP 93 -4.558 4.025 -4.099 117 HA ASP 93 HA ASP 93 -6.502 2.093 -3.604 118 HB2 ASP 93 2HB ASP 93 -6.070 4.187 -2.255 119 HB3 ASP 93 1HB ASP 93 -6.945 5.074 -3.478 120 H LYS 94 H LYS 94 -7.158 1.168 -5.574 121 HA LYS 94 HA LYS 94 -8.007 2.388 -7.868 122 HB2 LYS 94 2HB LYS 94 -8.429 -0.195 -6.564 123 HB3 LYS 94 1HB LYS 94 -9.877 0.266 -7.451 124 HG2 LYS 94 2HG LYS 94 -8.562 -0.912 -9.028 125 HG3 LYS 94 1HG LYS 94 -8.304 0.777 -9.432 126 HD2 LYS 94 2HD LYS 94 -6.223 0.728 -7.988 127 HD3 LYS 94 1HD LYS 94 -6.459 -1.009 -7.820 128 HE2 LYS 94 2HE LYS 94 -6.089 0.473 -10.441 129 HE3 LYS 94 1HE LYS 94 -4.872 -0.520 -9.638 130 HZ1 LYS 94 3HZ LYS 94 -6.544 -2.371 -9.752 131 HZ2 LYS 94 1HZ LYS 94 -5.885 -1.890 -11.239 132 HZ3 LYS 94 2HZ LYS 94 -7.449 -1.391 -10.805 133 H ASP 95 H ASP 95 -10.088 1.540 -5.136 134 HA ASP 95 HA ASP 95 -12.403 2.887 -6.163 135 HB2 ASP 95 2HB ASP 95 -11.678 1.778 -3.442 136 HB3 ASP 95 1HB ASP 95 -13.256 2.469 -3.816 137 H GLY 96 H GLY 96 -9.697 3.766 -4.160 138 HA2 GLY 96 2HA GLY 96 -8.965 5.878 -3.512 139 HA3 GLY 96 1HA GLY 96 -10.319 6.564 -4.351 140 H ASN 97 H ASN 97 -10.129 4.282 -1.589 141 HA ASN 97 HA ASN 97 -12.218 5.760 -0.231 142 HB2 ASN 97 2HB ASN 97 -10.589 3.448 0.861 143 HB3 ASN 97 1HB ASN 97 -12.138 4.039 1.451 144 HD21 ASN 97 1HD2 ASN 97 -13.585 4.326 -0.942 145 HD22 ASN 97 2HD2 ASN 97 -13.768 2.804 -1.671 146 H GLY 98 H GLY 98 -9.059 6.463 -0.572 147 HA2 GLY 98 2HA GLY 98 -7.912 8.207 0.522 148 HA3 GLY 98 1HA GLY 98 -9.017 8.056 1.884 149 H TYR 99 H TYR 99 -8.179 5.000 1.250 150 HA TYR 99 HA TYR 99 -5.659 5.032 2.787 151 HB2 TYR 99 2HB TYR 99 -7.921 3.148 3.415 152 HB3 TYR 99 1HB TYR 99 -6.441 3.397 4.330 153 HD1 TYR 99 2HD TYR 99 -6.067 5.582 5.522 154 HD2 TYR 99 1HD TYR 99 -9.816 4.594 3.672 155 HE1 TYR 99 2HE TYR 99 -7.180 7.383 6.814 156 HE2 TYR 99 1HE TYR 99 -10.928 6.395 4.964 157 HH TYR 99 HH TYR 99 -10.547 7.652 7.065 158 H ILE 100 H ILE 100 -5.260 2.322 2.996 159 HA ILE 100 HA ILE 100 -5.312 1.392 0.169 160 HB ILE 100 HB ILE 100 -3.009 1.223 2.136 161 HG12 ILE 100 2HG1 ILE 100 -3.406 3.493 1.142 162 HG13 ILE 100 1HG1 ILE 100 -1.900 2.774 0.579 163 HG21 ILE 100 1HG2 ILE 100 -3.463 0.149 -0.651 164 HG22 ILE 100 2HG2 ILE 100 -2.906 -0.717 0.776 165 HG23 ILE 100 3HG2 ILE 100 -1.841 0.443 -0.033 166 HD11 ILE 100 3HD1 ILE 100 -2.725 3.400 -1.459 167 HD12 ILE 100 1HD1 ILE 100 -4.387 3.325 -0.926 168 HD13 ILE 100 2HD1 ILE 100 -3.549 1.863 -1.369 169 H SER 101 H SER 101 -6.154 -0.556 -0.133 170 HA SER 101 HA SER 101 -6.410 -2.392 2.170 171 HB2 SER 101 2HB SER 101 -8.492 -1.900 0.992 172 HB3 SER 101 1HB SER 101 -7.778 -2.446 -0.523 173 HG SER 101 HG SER 101 -7.565 -4.501 0.377 174 H ALA 102 H ALA 102 -6.202 -4.738 1.619 175 HA ALA 102 HA ALA 102 -3.613 -5.235 0.520 176 HB1 ALA 102 1HB ALA 102 -5.483 -7.496 1.080 177 HB2 ALA 102 2HB ALA 102 -5.037 -6.460 2.430 178 HB3 ALA 102 3HB ALA 102 -3.784 -7.308 1.522 179 H ALA 103 H ALA 103 -6.901 -5.753 -0.622 180 HA ALA 103 HA ALA 103 -6.320 -7.467 -2.759 181 HB1 ALA 103 1HB ALA 103 -8.500 -6.767 -3.650 182 HB2 ALA 103 2HB ALA 103 -8.528 -5.411 -2.522 183 HB3 ALA 103 3HB ALA 103 -8.591 -7.064 -1.912 184 H GLU 104 H GLU 104 -6.140 -3.946 -2.519 185 HA GLU 104 HA GLU 104 -5.913 -3.426 -5.294 186 HB2 GLU 104 2HB GLU 104 -4.830 -1.806 -2.964 187 HB3 GLU 104 1HB GLU 104 -5.139 -1.221 -4.603 188 HG2 GLU 104 2HG GLU 104 -7.504 -1.537 -4.368 189 HG3 GLU 104 1HG GLU 104 -7.296 -2.442 -2.867 190 H LEU 105 H LEU 105 -3.557 -4.274 -2.798 191 HA LEU 105 HA LEU 105 -1.227 -3.550 -4.230 192 HB2 LEU 105 2HB LEU 105 -1.463 -5.795 -2.226 193 HB3 LEU 105 1HB LEU 105 -0.032 -4.849 -2.610 194 HG LEU 105 HG LEU 105 -2.557 -3.851 -1.265 195 HD11 LEU 105 1HD1 LEU 105 -0.946 -3.339 0.570 196 HD12 LEU 105 2HD1 LEU 105 0.314 -4.148 -0.347 197 HD13 LEU 105 3HD1 LEU 105 -1.075 -5.054 0.243 198 HD21 LEU 105 3HD2 LEU 105 -0.156 -2.408 -2.391 199 HD22 LEU 105 1HD2 LEU 105 -1.097 -1.721 -1.080 200 HD23 LEU 105 2HD2 LEU 105 -1.866 -2.037 -2.616 201 H ARG 106 H ARG 106 -2.714 -6.771 -3.825 202 HA ARG 106 HA ARG 106 -0.947 -8.115 -5.537 203 HB2 ARG 106 2HB ARG 106 -2.527 -9.933 -5.542 204 HB3 ARG 106 1HB ARG 106 -2.570 -9.200 -3.942 205 HG2 ARG 106 2HG ARG 106 -4.547 -7.857 -4.720 206 HG3 ARG 106 1HG ARG 106 -4.575 -8.837 -6.180 207 HD2 ARG 106 2HD ARG 106 -4.778 -10.870 -4.781 208 HD3 ARG 106 1HD ARG 106 -4.826 -9.857 -3.338 209 HE ARG 106 HE ARG 106 -6.839 -8.977 -5.087 210 HH11 ARG 106 1HH2 ARG 106 -6.023 -11.725 -3.155 211 HH12 ARG 106 2HH2 ARG 106 -7.667 -12.233 -2.964 212 HH21 ARG 106 1HH1 ARG 106 -8.948 -9.617 -4.831 213 HH22 ARG 106 2HH1 ARG 106 -9.332 -11.038 -3.919 214 H HIS 107 H HIS 107 -4.142 -6.654 -6.262 215 HA HIS 107 HA HIS 107 -4.154 -7.384 -8.981 216 HB2 HIS 107 2HB HIS 107 -6.175 -6.689 -7.741 217 HB3 HIS 107 1HB HIS 107 -5.518 -5.065 -7.575 218 HD1 HIS 107 1HD HIS 107 -7.390 -7.236 -9.912 219 HD2 HIS 107 2HD HIS 107 -5.281 -3.648 -10.125 220 HE1 HIS 107 1HE HIS 107 -8.002 -6.175 -12.132 221 HE2 HIS 107 2HE HIS 107 -6.733 -3.981 -12.270 222 H VAL 108 H VAL 108 -3.396 -4.241 -7.465 223 HA VAL 108 HA VAL 108 -2.688 -2.964 -9.859 224 HB VAL 108 HB VAL 108 -3.118 -1.919 -7.544 225 HG11 VAL 108 1HG1 VAL 108 -1.248 -3.290 -6.500 226 HG12 VAL 108 2HG1 VAL 108 -1.253 -1.590 -6.103 227 HG13 VAL 108 3HG1 VAL 108 -0.121 -2.221 -7.300 228 HG21 VAL 108 3HG2 VAL 108 -2.534 -0.545 -9.456 229 HG22 VAL 108 1HG2 VAL 108 -0.838 -1.005 -9.318 230 HG23 VAL 108 2HG2 VAL 108 -1.581 -0.001 -8.075 231 H MET 109 H MET 109 -0.588 -4.561 -7.459 232 HA MET 109 HA MET 109 1.855 -4.122 -8.752 233 HB2 MET 109 2HB MET 109 0.935 -6.410 -7.002 234 HB3 MET 109 1HB MET 109 2.596 -6.188 -7.528 235 HG2 MET 109 2HG MET 109 1.047 -4.043 -6.060 236 HG3 MET 109 1HG MET 109 2.064 -5.228 -5.241 237 HE1 MET 109 3HE MET 109 3.429 -3.512 -4.146 238 HE2 MET 109 1HE MET 109 4.993 -3.112 -4.869 239 HE3 MET 109 2HE MET 109 4.482 -4.793 -4.739 240 H THR 110 H THR 110 -0.431 -6.838 -9.046 241 HA THR 110 HA THR 110 1.043 -8.270 -10.996 242 HB THR 110 HB THR 110 -1.938 -8.246 -10.448 243 HG1 THR 110 1HG THR 110 -1.490 -9.779 -9.026 244 HG21 THR 110 3HG2 THR 110 -0.173 -10.067 -12.096 245 HG22 THR 110 1HG2 THR 110 -1.612 -9.195 -12.624 246 HG23 THR 110 2HG2 THR 110 -1.764 -10.557 -11.512 247 H ASN 111 H ASN 111 -1.517 -5.859 -11.232 248 HA ASN 111 HA ASN 111 -1.770 -5.887 -14.057 249 HB2 ASN 111 2HB ASN 111 -3.467 -4.888 -12.570 250 HB3 ASN 111 1HB ASN 111 -2.326 -3.628 -12.115 251 HD21 ASN 111 1HD2 ASN 111 -4.180 -4.918 -14.881 252 HD22 ASN 111 2HD2 ASN 111 -4.124 -3.484 -15.790 253 H LEU 112 H LEU 112 0.257 -4.106 -11.828 254 HA LEU 112 HA LEU 112 1.375 -2.269 -13.635 255 HB2 LEU 112 2HB LEU 112 2.242 -3.421 -10.998 256 HB3 LEU 112 1HB LEU 112 3.328 -2.363 -11.886 257 HG LEU 112 HG LEU 112 0.461 -1.561 -11.327 258 HD11 LEU 112 1HD1 LEU 112 1.310 -1.931 -9.137 259 HD12 LEU 112 2HD1 LEU 112 1.526 -0.211 -9.416 260 HD13 LEU 112 3HD1 LEU 112 2.902 -1.305 -9.559 261 HD21 LEU 112 3HD2 LEU 112 1.471 -0.136 -12.945 262 HD22 LEU 112 1HD2 LEU 112 3.023 -0.147 -12.117 263 HD23 LEU 112 2HD2 LEU 112 1.665 0.732 -11.436 264 H GLY 113 H GLY 113 2.144 -5.583 -12.852 265 HA2 GLY 113 2HA GLY 113 3.148 -6.699 -14.953 266 HA3 GLY 113 1HA GLY 113 4.446 -5.529 -14.731 267 H GLU 114 H GLU 114 3.515 -6.104 -11.691 268 HA GLU 114 HA GLU 114 5.404 -8.376 -11.348 269 HB2 GLU 114 2HB GLU 114 4.853 -5.994 -9.562 270 HB3 GLU 114 1HB GLU 114 5.841 -7.380 -9.097 271 HG2 GLU 114 2HG GLU 114 6.371 -5.692 -11.558 272 HG3 GLU 114 1HG GLU 114 7.170 -5.438 -10.008 273 H LYS 115 H LYS 115 4.236 -10.164 -11.022 274 HA LYS 115 HA LYS 115 1.720 -10.052 -9.532 275 HB2 LYS 115 2HB LYS 115 1.912 -11.390 -11.618 276 HB3 LYS 115 1HB LYS 115 3.096 -12.421 -10.817 277 HG2 LYS 115 2HG LYS 115 1.450 -13.067 -9.130 278 HG3 LYS 115 1HG LYS 115 0.266 -11.963 -9.829 279 HD2 LYS 115 2HD LYS 115 0.317 -13.245 -11.944 280 HD3 LYS 115 1HD LYS 115 1.488 -14.358 -11.238 281 HE2 LYS 115 2HE LYS 115 -0.140 -15.003 -9.514 282 HE3 LYS 115 1HE LYS 115 -1.309 -13.860 -10.174 283 HZ1 LYS 115 3HZ LYS 115 -0.195 -15.703 -12.100 284 HZ2 LYS 115 1HZ LYS 115 -1.802 -15.214 -11.872 285 HZ3 LYS 115 2HZ LYS 115 -1.141 -16.437 -10.896 286 H LEU 116 H LEU 116 2.233 -9.714 -7.402 287 HA LEU 116 HA LEU 116 4.269 -11.221 -6.015 288 HB2 LEU 116 2HB LEU 116 2.246 -9.139 -5.297 289 HB3 LEU 116 1HB LEU 116 2.909 -10.112 -3.990 290 HG LEU 116 HG LEU 116 5.189 -9.486 -4.637 291 HD11 LEU 116 1HD1 LEU 116 3.732 -8.083 -6.868 292 HD12 LEU 116 2HD1 LEU 116 5.121 -9.156 -6.967 293 HD13 LEU 116 3HD1 LEU 116 5.316 -7.523 -6.336 294 HD21 LEU 116 3HD2 LEU 116 3.703 -8.040 -3.116 295 HD22 LEU 116 1HD2 LEU 116 3.511 -6.971 -4.507 296 HD23 LEU 116 2HD2 LEU 116 5.112 -7.247 -3.822 297 H THR 117 H THR 117 3.138 -11.916 -3.623 298 HA THR 117 HA THR 117 1.346 -14.149 -4.407 299 HB THR 117 HB THR 117 2.095 -15.012 -2.073 300 HG1 THR 117 1HG THR 117 4.261 -13.293 -2.622 301 HG21 THR 117 3HG2 THR 117 2.835 -15.984 -4.221 302 HG22 THR 117 1HG2 THR 117 4.138 -15.975 -3.033 303 HG23 THR 117 2HG2 THR 117 4.114 -14.772 -4.321 304 H ASP 118 H ASP 118 -0.710 -14.140 -3.741 305 HA ASP 118 HA ASP 118 -1.910 -11.979 -2.443 306 HB2 ASP 118 2HB ASP 118 -2.811 -14.840 -2.800 307 HB3 ASP 118 1HB ASP 118 -3.836 -13.600 -2.081 308 H GLU 119 H GLU 119 -0.804 -15.080 -1.142 309 HA GLU 119 HA GLU 119 -1.769 -14.759 1.489 310 HB2 GLU 119 2HB GLU 119 0.631 -16.321 0.471 311 HB3 GLU 119 1HB GLU 119 -0.073 -16.486 2.080 312 HG2 GLU 119 2HG GLU 119 -2.219 -17.176 1.103 313 HG3 GLU 119 1HG GLU 119 -1.570 -16.950 -0.519 314 H GLU 120 H GLU 120 1.171 -13.639 -0.101 315 HA GLU 120 HA GLU 120 2.398 -12.706 2.347 316 HB2 GLU 120 2HB GLU 120 3.720 -13.340 0.317 317 HB3 GLU 120 1HB GLU 120 3.046 -11.931 -0.506 318 HG2 GLU 120 2HG GLU 120 4.013 -10.452 1.216 319 HG3 GLU 120 1HG GLU 120 4.685 -11.854 2.048 320 H VAL 121 H VAL 121 0.590 -11.282 -0.341 321 HA VAL 121 HA VAL 121 0.742 -8.577 0.410 322 HB VAL 121 HB VAL 121 -1.310 -10.185 -1.107 323 HG11 VAL 121 1HG1 VAL 121 -2.678 -8.504 -0.148 324 HG12 VAL 121 2HG1 VAL 121 -2.264 -7.901 -1.746 325 HG13 VAL 121 3HG1 VAL 121 -1.426 -7.278 -0.326 326 HG21 VAL 121 3HG2 VAL 121 0.879 -9.653 -2.170 327 HG22 VAL 121 1HG2 VAL 121 0.563 -7.938 -1.910 328 HG23 VAL 121 2HG2 VAL 121 -0.465 -8.868 -2.999 329 H ASP 122 H ASP 122 -1.960 -10.824 0.968 330 HA ASP 122 HA ASP 122 -3.495 -9.340 2.705 331 HB2 ASP 122 2HB ASP 122 -4.003 -11.628 1.754 332 HB3 ASP 122 1HB ASP 122 -2.943 -12.315 2.981 333 H GLU 123 H GLU 123 -0.671 -11.388 3.516 334 HA GLU 123 HA GLU 123 -0.802 -10.787 6.318 335 HB2 GLU 123 2HB GLU 123 0.258 -12.844 5.499 336 HB3 GLU 123 1HB GLU 123 1.494 -11.886 4.686 337 HG2 GLU 123 2HG GLU 123 2.255 -10.983 6.828 338 HG3 GLU 123 1HG GLU 123 0.963 -11.830 7.673 339 H MET 124 H MET 124 0.795 -9.375 3.527 340 HA MET 124 HA MET 124 2.788 -7.833 4.648 341 HB2 MET 124 2HB MET 124 2.137 -8.056 2.185 342 HB3 MET 124 1HB MET 124 0.932 -6.813 2.487 343 HG2 MET 124 2HG MET 124 2.869 -5.693 1.648 344 HG3 MET 124 1HG MET 124 2.804 -5.360 3.376 345 HE1 MET 124 3HE MET 124 5.036 -5.952 0.673 346 HE2 MET 124 1HE MET 124 4.314 -7.564 0.568 347 HE3 MET 124 2HE MET 124 6.016 -7.383 0.986 348 H ILE 125 H ILE 125 -0.365 -6.432 3.777 349 HA ILE 125 HA ILE 125 -0.116 -4.102 5.264 350 HB ILE 125 HB ILE 125 -2.500 -5.678 4.314 351 HG12 ILE 125 2HG1 ILE 125 -1.413 -2.921 3.663 352 HG13 ILE 125 1HG1 ILE 125 -1.175 -4.369 2.684 353 HG21 ILE 125 1HG2 ILE 125 -2.479 -3.242 6.086 354 HG22 ILE 125 2HG2 ILE 125 -3.418 -4.720 6.277 355 HG23 ILE 125 3HG2 ILE 125 -3.845 -3.570 5.031 356 HD11 ILE 125 3HD1 ILE 125 -3.781 -4.519 2.710 357 HD12 ILE 125 1HD1 ILE 125 -3.020 -3.334 1.647 358 HD13 ILE 125 2HD1 ILE 125 -3.708 -2.827 3.188 359 H ARG 126 H ARG 126 -1.481 -7.221 6.238 360 HA ARG 126 HA ARG 126 -2.538 -6.625 8.683 361 HB2 ARG 126 2HB ARG 126 -1.014 -9.054 7.798 362 HB3 ARG 126 1HB ARG 126 -1.850 -8.984 9.330 363 HG2 ARG 126 2HG ARG 126 -3.329 -8.225 6.821 364 HG3 ARG 126 1HG ARG 126 -3.084 -9.933 7.180 365 HD2 ARG 126 2HD ARG 126 -4.157 -9.640 9.361 366 HD3 ARG 126 1HD ARG 126 -4.350 -7.922 9.075 367 HE ARG 126 HE ARG 126 -5.957 -10.049 7.946 368 HH11 ARG 126 1HH2 ARG 126 -4.839 -6.809 7.742 369 HH12 ARG 126 2HH2 ARG 126 -6.169 -6.252 6.784 370 HH21 ARG 126 1HH1 ARG 126 -7.731 -9.353 6.730 371 HH22 ARG 126 2HH1 ARG 126 -7.824 -7.703 6.208 372 H GLU 127 H GLU 127 0.901 -7.050 7.939 373 HA GLU 127 HA GLU 127 1.641 -6.734 10.726 374 HB2 GLU 127 2HB GLU 127 3.292 -6.902 8.200 375 HB3 GLU 127 1HB GLU 127 3.972 -6.772 9.823 376 HG2 GLU 127 2HG GLU 127 2.884 -8.861 10.492 377 HG3 GLU 127 1HG GLU 127 2.097 -8.981 8.917 378 H ALA 128 H ALA 128 1.533 -4.747 7.820 379 HA ALA 128 HA ALA 128 2.930 -2.506 8.935 380 HB1 ALA 128 1HB ALA 128 0.915 -2.058 6.773 381 HB2 ALA 128 2HB ALA 128 2.215 -3.186 6.421 382 HB3 ALA 128 3HB ALA 128 2.593 -1.522 6.880 383 H ASP 129 H ASP 129 -0.534 -3.048 8.256 384 HA ASP 129 HA ASP 129 -1.679 -0.785 9.241 385 HB2 ASP 129 2HB ASP 129 -2.798 -2.919 8.343 386 HB3 ASP 129 1HB ASP 129 -2.776 -3.490 10.002 387 H ILE 130 H ILE 130 -1.637 0.278 11.106 388 HA ILE 130 HA ILE 130 -0.452 -0.982 13.478 389 HB ILE 130 HB ILE 130 -1.374 1.881 13.109 390 HG12 ILE 130 2HG1 ILE 130 0.323 1.241 11.437 391 HG13 ILE 130 1HG1 ILE 130 0.965 2.373 12.620 392 HG21 ILE 130 1HG2 ILE 130 -1.096 1.301 15.452 393 HG22 ILE 130 2HG2 ILE 130 0.317 2.232 14.959 394 HG23 ILE 130 3HG2 ILE 130 0.426 0.480 15.108 395 HD11 ILE 130 3HD1 ILE 130 1.786 0.253 13.890 396 HD12 ILE 130 1HD1 ILE 130 2.649 0.721 12.439 397 HD13 ILE 130 2HD1 ILE 130 1.481 -0.584 12.382 398 H ASP 131 H ASP 131 -3.529 0.286 12.384 399 HA ASP 131 HA ASP 131 -4.762 -0.151 15.021 400 HB2 ASP 131 2HB ASP 131 -5.798 1.051 12.442 401 HB3 ASP 131 1HB ASP 131 -6.765 0.870 13.905 402 H GLY 132 H GLY 132 -4.159 -1.904 12.237 403 HA2 GLY 132 2HA GLY 132 -4.911 -3.915 11.423 404 HA3 GLY 132 1HA GLY 132 -5.613 -4.179 13.016 405 H ASP 133 H ASP 133 -6.344 -1.608 10.715 406 HA ASP 133 HA ASP 133 -9.189 -2.391 10.745 407 HB2 ASP 133 2HB ASP 133 -9.571 -0.100 9.910 408 HB3 ASP 133 1HB ASP 133 -8.665 -0.104 11.420 409 H GLY 134 H GLY 134 -7.356 -3.902 9.145 410 HA2 GLY 134 2HA GLY 134 -7.075 -4.722 7.010 411 HA3 GLY 134 1HA GLY 134 -8.733 -4.194 6.764 412 H GLN 135 H GLN 135 -6.931 -1.517 7.605 413 HA GLN 135 HA GLN 135 -5.982 -0.953 4.896 414 HB2 GLN 135 2HB GLN 135 -8.061 0.737 6.301 415 HB3 GLN 135 1HB GLN 135 -7.197 1.218 4.835 416 HG2 GLN 135 2HG GLN 135 -8.064 -0.849 3.710 417 HG3 GLN 135 1HG GLN 135 -9.024 -1.187 5.145 418 HE21 GLN 135 1HE2 GLN 135 -11.142 -0.468 4.973 419 HE22 GLN 135 2HE2 GLN 135 -11.645 0.862 4.044 420 H VAL 136 H VAL 136 -4.508 0.795 4.778 421 HA VAL 136 HA VAL 136 -3.604 1.903 7.374 422 HB VAL 136 HB VAL 136 -1.427 1.131 7.174 423 HG11 VAL 136 1HG1 VAL 136 -2.829 -1.048 5.665 424 HG12 VAL 136 2HG1 VAL 136 -3.088 -0.772 7.387 425 HG13 VAL 136 3HG1 VAL 136 -1.485 -1.222 6.797 426 HG21 VAL 136 3HG2 VAL 136 -0.570 0.166 4.932 427 HG22 VAL 136 1HG2 VAL 136 -0.783 1.913 5.051 428 HG23 VAL 136 2HG2 VAL 136 -2.003 0.937 4.237 429 H ASN 137 H ASN 137 -2.647 3.897 7.239 430 HA ASN 137 HA ASN 137 -3.376 5.514 5.015 431 HB2 ASN 137 2HB ASN 137 -2.341 7.316 6.193 432 HB3 ASN 137 1HB ASN 137 -3.083 6.275 7.406 433 HD21 ASN 137 1HD2 ASN 137 -0.665 4.341 6.616 434 HD22 ASN 137 2HD2 ASN 137 0.580 4.930 7.607 435 H TYR 138 H TYR 138 -0.973 7.139 4.880 436 HA TYR 138 HA TYR 138 0.355 5.721 2.744 437 HB2 TYR 138 2HB TYR 138 1.128 8.421 3.845 438 HB3 TYR 138 1HB TYR 138 1.359 7.804 2.211 439 HD1 TYR 138 1HD TYR 138 -1.062 6.791 1.249 440 HD2 TYR 138 2HD TYR 138 -0.527 10.066 3.975 441 HE1 TYR 138 1HE TYR 138 -3.268 7.711 0.580 442 HE2 TYR 138 2HE TYR 138 -2.727 10.983 3.307 443 HH TYR 138 HH TYR 138 -4.865 10.101 2.329 444 H GLU 139 H GLU 139 1.486 7.195 5.809 445 HA GLU 139 HA GLU 139 4.153 6.388 5.617 446 HB2 GLU 139 2HB GLU 139 2.438 6.909 8.033 447 HB3 GLU 139 1HB GLU 139 4.184 6.664 8.101 448 HG2 GLU 139 2HG GLU 139 4.539 8.564 6.594 449 HG3 GLU 139 1HG GLU 139 2.797 8.792 6.443 450 H GLU 140 H GLU 140 1.888 4.936 7.938 451 HA GLU 140 HA GLU 140 3.040 2.664 8.724 452 HB2 GLU 140 2HB GLU 140 0.254 2.751 7.513 453 HB3 GLU 140 1HB GLU 140 0.853 1.499 8.596 454 HG2 GLU 140 2HG GLU 140 1.114 3.107 10.394 455 HG3 GLU 140 1HG GLU 140 0.700 4.435 9.333 456 H PHE 141 H PHE 141 2.149 3.391 5.430 457 HA PHE 141 HA PHE 141 2.775 0.700 4.486 458 HB2 PHE 141 2HB PHE 141 0.897 2.369 3.634 459 HB3 PHE 141 1HB PHE 141 2.189 3.000 2.641 460 HD1 PHE 141 1HD PHE 141 3.731 0.965 1.625 461 HD2 PHE 141 2HD PHE 141 -0.425 0.733 2.609 462 HE1 PHE 141 1HE PHE 141 3.470 -0.935 0.060 463 HE2 PHE 141 2HE PHE 141 -0.685 -1.158 1.081 464 HZ PHE 141 HZ PHE 141 1.251 -2.005 -0.221 465 H VAL 142 H VAL 142 3.839 4.039 3.726 466 HA VAL 142 HA VAL 142 5.866 3.761 2.035 467 HB VAL 142 HB VAL 142 5.918 5.319 4.618 468 HG11 VAL 142 1HG1 VAL 142 8.215 5.118 4.046 469 HG12 VAL 142 2HG1 VAL 142 7.714 6.670 3.376 470 HG13 VAL 142 3HG1 VAL 142 7.871 5.262 2.321 471 HG21 VAL 142 3HG2 VAL 142 5.695 6.448 1.837 472 HG22 VAL 142 1HG2 VAL 142 5.064 7.095 3.354 473 HG23 VAL 142 2HG2 VAL 142 4.274 5.730 2.571 474 H GLN 143 H GLN 143 6.465 3.374 5.543 475 HA GLN 143 HA GLN 143 9.035 2.497 5.592 476 HB2 GLN 143 2HB GLN 143 7.535 2.666 7.577 477 HB3 GLN 143 1HB GLN 143 6.772 1.151 7.098 478 HG2 GLN 143 2HG GLN 143 8.464 0.682 8.787 479 HG3 GLN 143 1HG GLN 143 9.001 0.024 7.246 480 HE21 GLN 143 1HE2 GLN 143 11.284 0.214 7.624 481 HE22 GLN 143 2HE2 GLN 143 12.054 1.712 7.832 482 H MET 144 H MET 144 6.402 0.073 5.470 483 HA MET 144 HA MET 144 7.927 -2.123 4.785 484 HB2 MET 144 2HB MET 144 5.134 -1.512 3.763 485 HB3 MET 144 1HB MET 144 5.875 -3.108 3.890 486 HG2 MET 144 2HG MET 144 5.410 -1.250 6.239 487 HG3 MET 144 1HG MET 144 4.358 -2.588 5.801 488 HE1 MET 144 3HE MET 144 4.615 -4.782 7.323 489 HE2 MET 144 1HE MET 144 5.980 -5.722 6.698 490 HE3 MET 144 2HE MET 144 4.918 -4.860 5.587 491 H MET 145 H MET 145 6.314 0.129 2.511 492 HA MET 145 HA MET 145 6.917 -0.966 0.102 493 HB2 MET 145 2HB MET 145 5.753 1.256 0.601 494 HB3 MET 145 1HB MET 145 7.357 1.965 0.621 495 HG2 MET 145 2HG MET 145 7.757 1.392 -1.653 496 HG3 MET 145 1HG MET 145 6.354 0.324 -1.708 497 HE1 MET 145 3HE MET 145 7.800 3.736 -1.484 498 HE2 MET 145 1HE MET 145 6.685 4.026 -0.142 499 HE3 MET 145 2HE MET 145 6.474 4.887 -1.664 500 H THR 146 H THR 146 8.693 -1.541 -0.977 501 HA THR 146 HA THR 146 11.258 -0.203 -0.361 502 HB THR 146 HB THR 146 12.287 -2.578 -0.655 503 HG1 THR 146 1HG THR 146 9.815 -3.357 0.417 504 HG21 THR 146 3HG2 THR 146 12.539 -1.511 1.434 505 HG22 THR 146 1HG2 THR 146 11.768 -3.051 1.822 506 HG23 THR 146 2HG2 THR 146 10.808 -1.573 1.773 507 H ALA 147 H ALA 147 9.970 0.646 -2.469 508 HA ALA 147 HA ALA 147 10.558 -0.891 -4.854 509 HB1 ALA 147 1HB ALA 147 8.565 0.387 -4.968 510 HB2 ALA 147 2HB ALA 147 9.723 1.278 -5.959 511 HB3 ALA 147 3HB ALA 147 9.357 1.824 -4.322 512 H LYS 148 H LYS 148 11.894 0.003 -6.615 513 HA LYS 148 HA LYS 148 14.486 0.677 -5.759 514 HB2 LYS 148 2HB LYS 148 14.974 1.026 -8.144 515 HB3 LYS 148 1HB LYS 148 14.002 -0.425 -7.919 516 HG2 LYS 148 2HG LYS 148 11.956 0.878 -8.481 517 HG3 LYS 148 1HG LYS 148 12.961 2.295 -8.782 518 HD2 LYS 148 2HD LYS 148 14.185 1.016 -10.551 519 HD3 LYS 148 1HD LYS 148 13.094 -0.345 -10.282 520 HE2 LYS 148 2HE LYS 148 12.234 2.433 -11.149 521 HE3 LYS 148 1HE LYS 148 12.358 1.031 -12.208 522 HZ1 LYS 148 3HZ LYS 148 10.097 1.274 -11.499 523 HZ2 LYS 148 1HZ LYS 148 10.558 1.335 -9.865 524 HZ3 LYS 148 2HZ LYS 148 10.742 -0.105 -10.749 Start of MODEL 17 1 H1 ASP 78 1HT ASP 78 18.276 14.040 -2.654 2 H2 ASP 78 2HT ASP 78 16.903 14.012 -1.648 3 H3 ASP 78 3HT ASP 78 18.457 14.192 -0.977 4 HA ASP 78 HA ASP 78 18.538 16.368 -1.354 5 HB2 ASP 78 2HB ASP 78 17.208 15.655 -3.968 6 HB3 ASP 78 1HB ASP 78 17.526 17.325 -3.501 7 H THR 79 H THR 79 15.382 15.559 -2.847 8 HA THR 79 HA THR 79 14.026 16.818 -0.521 9 HB THR 79 HB THR 79 13.200 17.184 -3.412 10 HG1 THR 79 1HG THR 79 13.843 19.460 -2.470 11 HG21 THR 79 3HG2 THR 79 12.235 18.316 -0.775 12 HG22 THR 79 1HG2 THR 79 11.318 17.338 -1.920 13 HG23 THR 79 2HG2 THR 79 11.782 18.986 -2.343 14 H ASP 80 H ASP 80 12.679 15.412 0.402 15 HA ASP 80 HA ASP 80 11.979 12.930 -0.863 16 HB2 ASP 80 2HB ASP 80 11.302 14.238 1.766 17 HB3 ASP 80 1HB ASP 80 10.483 12.762 1.263 18 H SER 81 H SER 81 10.159 15.828 0.088 19 HA SER 81 HA SER 81 8.137 16.665 -0.612 20 HB2 SER 81 2HB SER 81 7.631 16.515 -2.905 21 HB3 SER 81 1HB SER 81 9.386 16.381 -2.835 22 HG SER 81 HG SER 81 7.818 14.734 -3.996 23 H GLU 82 H GLU 82 7.113 15.502 1.119 24 HA GLU 82 HA GLU 82 6.096 12.935 1.094 25 HB2 GLU 82 2HB GLU 82 6.001 14.509 3.018 26 HB3 GLU 82 1HB GLU 82 4.738 15.415 2.191 27 HG2 GLU 82 2HG GLU 82 3.262 13.478 2.225 28 HG3 GLU 82 1HG GLU 82 4.535 12.477 2.916 29 H GLU 83 H GLU 83 5.264 15.541 -0.937 30 HA GLU 83 HA GLU 83 2.565 14.970 -1.477 31 HB2 GLU 83 2HB GLU 83 4.688 16.328 -3.144 32 HB3 GLU 83 1HB GLU 83 2.976 16.296 -3.556 33 HG2 GLU 83 2HG GLU 83 3.142 18.327 -2.393 34 HG3 GLU 83 1HG GLU 83 2.634 17.230 -1.112 35 H GLU 84 H GLU 84 5.503 13.998 -3.324 36 HA GLU 84 HA GLU 84 4.224 12.537 -5.316 37 HB2 GLU 84 2HB GLU 84 6.718 12.933 -5.128 38 HB3 GLU 84 1HB GLU 84 6.759 11.648 -3.923 39 HG2 GLU 84 2HG GLU 84 7.319 10.654 -6.044 40 HG3 GLU 84 1HG GLU 84 5.691 10.122 -5.628 41 H ILE 85 H ILE 85 5.309 11.418 -2.110 42 HA ILE 85 HA ILE 85 4.405 8.771 -2.238 43 HB ILE 85 HB ILE 85 4.470 10.667 0.137 44 HG12 ILE 85 2HG1 ILE 85 6.478 8.574 -0.757 45 HG13 ILE 85 1HG1 ILE 85 6.652 10.305 -1.053 46 HG21 ILE 85 1HG2 ILE 85 3.059 8.678 0.582 47 HG22 ILE 85 2HG2 ILE 85 4.556 8.610 1.501 48 HG23 ILE 85 3HG2 ILE 85 4.377 7.636 0.048 49 HD11 ILE 85 3HD1 ILE 85 7.897 9.861 0.941 50 HD12 ILE 85 1HD1 ILE 85 6.597 8.874 1.610 51 HD13 ILE 85 2HD1 ILE 85 6.393 10.620 1.472 52 H ARG 86 H ARG 86 2.734 11.690 -1.056 53 HA ARG 86 HA ARG 86 0.301 10.518 -0.375 54 HB2 ARG 86 2HB ARG 86 0.987 13.285 -1.375 55 HB3 ARG 86 1HB ARG 86 -0.628 12.856 -0.821 56 HG2 ARG 86 2HG ARG 86 1.728 12.230 0.959 57 HG3 ARG 86 1HG ARG 86 1.150 13.893 0.875 58 HD2 ARG 86 2HD ARG 86 -0.605 11.502 1.516 59 HD3 ARG 86 1HD ARG 86 0.088 12.587 2.720 60 HE ARG 86 HE ARG 86 -1.261 14.186 0.890 61 HH11 ARG 86 1HH2 ARG 86 -1.926 11.645 3.164 62 HH12 ARG 86 2HH2 ARG 86 -3.569 12.128 3.425 63 HH21 ARG 86 1HH1 ARG 86 -3.419 14.814 1.230 64 HH22 ARG 86 2HH1 ARG 86 -4.413 13.919 2.331 65 H GLU 87 H GLU 87 1.522 11.524 -3.527 66 HA GLU 87 HA GLU 87 -0.991 11.186 -4.887 67 HB2 GLU 87 2HB GLU 87 1.858 11.418 -5.878 68 HB3 GLU 87 1HB GLU 87 0.454 11.333 -6.941 69 HG2 GLU 87 2HG GLU 87 -0.480 13.353 -5.931 70 HG3 GLU 87 1HG GLU 87 0.851 13.419 -4.776 71 H ALA 88 H ALA 88 2.053 9.436 -5.353 72 HA ALA 88 HA ALA 88 1.361 7.277 -6.786 73 HB1 ALA 88 1HB ALA 88 3.591 7.741 -5.640 74 HB2 ALA 88 2HB ALA 88 3.129 6.043 -5.783 75 HB3 ALA 88 3HB ALA 88 2.936 6.888 -4.245 76 H PHE 89 H PHE 89 0.878 7.422 -3.240 77 HA PHE 89 HA PHE 89 -0.468 4.953 -3.067 78 HB2 PHE 89 2HB PHE 89 -0.167 7.342 -1.304 79 HB3 PHE 89 1HB PHE 89 -1.401 6.152 -0.885 80 HD1 PHE 89 1HD PHE 89 -0.606 3.625 -0.985 81 HD2 PHE 89 2HD PHE 89 2.028 6.979 -0.556 82 HE1 PHE 89 1HE PHE 89 1.147 2.138 -0.062 83 HE2 PHE 89 2HE PHE 89 3.770 5.485 0.376 84 HZ PHE 89 HZ PHE 89 3.331 3.091 0.614 85 H ARG 90 H ARG 90 -1.714 8.293 -3.434 86 HA ARG 90 HA ARG 90 -4.441 7.715 -3.216 87 HB2 ARG 90 2HB ARG 90 -2.909 9.777 -4.785 88 HB3 ARG 90 1HB ARG 90 -4.660 9.686 -4.911 89 HG2 ARG 90 2HG ARG 90 -3.377 9.749 -2.182 90 HG3 ARG 90 1HG ARG 90 -3.540 11.251 -3.088 91 HD2 ARG 90 2HD ARG 90 -5.993 10.720 -3.353 92 HD3 ARG 90 1HD ARG 90 -5.751 9.367 -2.251 93 HE ARG 90 HE ARG 90 -5.490 10.884 -0.487 94 HH11 ARG 90 1HH2 ARG 90 -5.667 12.467 -3.571 95 HH12 ARG 90 2HH2 ARG 90 -5.890 14.046 -2.902 96 HH21 ARG 90 1HH1 ARG 90 -5.763 12.972 0.397 97 HH22 ARG 90 2HH1 ARG 90 -5.940 14.334 -0.657 98 H VAL 91 H VAL 91 -2.322 7.560 -6.054 99 HA VAL 91 HA VAL 91 -4.262 6.777 -7.941 100 HB VAL 91 HB VAL 91 -1.288 6.219 -7.807 101 HG11 VAL 91 1HG1 VAL 91 -2.176 4.596 -9.311 102 HG12 VAL 91 2HG1 VAL 91 -1.607 5.916 -10.333 103 HG13 VAL 91 3HG1 VAL 91 -3.328 5.746 -9.989 104 HG21 VAL 91 3HG2 VAL 91 -2.009 8.612 -7.915 105 HG22 VAL 91 1HG2 VAL 91 -2.880 8.248 -9.405 106 HG23 VAL 91 2HG2 VAL 91 -1.123 8.099 -9.351 107 H PHE 92 H PHE 92 -2.168 4.918 -5.784 108 HA PHE 92 HA PHE 92 -2.782 2.332 -6.688 109 HB2 PHE 92 2HB PHE 92 -1.770 3.504 -4.141 110 HB3 PHE 92 1HB PHE 92 -2.341 1.843 -4.061 111 HD1 PHE 92 1HD PHE 92 -0.608 3.727 -6.810 112 HD2 PHE 92 2HD PHE 92 -0.433 0.490 -3.993 113 HE1 PHE 92 1HE PHE 92 1.500 2.941 -7.847 114 HE2 PHE 92 2HE PHE 92 1.675 -0.295 -5.025 115 HZ PHE 92 HZ PHE 92 2.643 0.929 -6.954 116 H ASP 93 H ASP 93 -4.321 4.147 -4.000 117 HA ASP 93 HA ASP 93 -6.237 2.267 -3.298 118 HB2 ASP 93 2HB ASP 93 -5.849 4.406 -2.099 119 HB3 ASP 93 1HB ASP 93 -6.611 5.265 -3.424 120 H LYS 94 H LYS 94 -6.870 1.195 -5.225 121 HA LYS 94 HA LYS 94 -7.794 2.172 -7.578 122 HB2 LYS 94 2HB LYS 94 -7.980 -0.297 -6.182 123 HB3 LYS 94 1HB LYS 94 -9.621 0.062 -6.698 124 HG2 LYS 94 2HG LYS 94 -8.732 -1.132 -8.513 125 HG3 LYS 94 1HG LYS 94 -8.544 0.547 -9.023 126 HD2 LYS 94 2HD LYS 94 -6.203 0.519 -8.180 127 HD3 LYS 94 1HD LYS 94 -6.406 -1.174 -7.729 128 HE2 LYS 94 2HE LYS 94 -5.339 -1.178 -9.870 129 HE3 LYS 94 1HE LYS 94 -7.021 -1.628 -10.153 130 HZ1 LYS 94 3HZ LYS 94 -5.893 1.103 -10.454 131 HZ2 LYS 94 1HZ LYS 94 -7.503 0.655 -10.748 132 HZ3 LYS 94 2HZ LYS 94 -6.258 0.041 -11.728 133 H ASP 95 H ASP 95 -9.778 1.636 -4.704 134 HA ASP 95 HA ASP 95 -12.152 2.794 -5.754 135 HB2 ASP 95 2HB ASP 95 -11.910 1.188 -3.791 136 HB3 ASP 95 1HB ASP 95 -11.401 2.579 -2.840 137 H GLY 96 H GLY 96 -9.278 4.076 -4.337 138 HA2 GLY 96 2HA GLY 96 -8.575 6.223 -3.908 139 HA3 GLY 96 1HA GLY 96 -9.805 6.734 -5.049 140 H ASN 97 H ASN 97 -9.840 5.310 -1.739 141 HA ASN 97 HA ASN 97 -11.691 7.490 -0.951 142 HB2 ASN 97 2HB ASN 97 -12.715 5.979 0.621 143 HB3 ASN 97 1HB ASN 97 -12.737 5.254 -0.982 144 HD21 ASN 97 1HD2 ASN 97 -12.821 3.854 1.645 145 HD22 ASN 97 2HD2 ASN 97 -11.470 2.824 1.665 146 H GLY 98 H GLY 98 -8.589 7.027 -0.752 147 HA2 GLY 98 2HA GLY 98 -7.036 7.993 0.673 148 HA3 GLY 98 1HA GLY 98 -8.354 8.439 1.750 149 H TYR 99 H TYR 99 -7.553 5.207 0.580 150 HA TYR 99 HA TYR 99 -6.292 4.422 3.062 151 HB2 TYR 99 2HB TYR 99 -9.074 3.459 2.369 152 HB3 TYR 99 1HB TYR 99 -8.017 2.652 3.527 153 HD1 TYR 99 1HD TYR 99 -7.168 3.936 5.539 154 HD2 TYR 99 2HD TYR 99 -10.269 5.427 2.971 155 HE1 TYR 99 1HE TYR 99 -7.848 5.549 7.297 156 HE2 TYR 99 2HE TYR 99 -10.949 7.043 4.725 157 HH TYR 99 HH TYR 99 -9.025 7.676 7.487 158 H ILE 100 H ILE 100 -5.569 2.106 2.964 159 HA ILE 100 HA ILE 100 -5.403 1.133 0.147 160 HB ILE 100 HB ILE 100 -3.253 1.112 2.263 161 HG12 ILE 100 2HG1 ILE 100 -3.682 3.351 1.238 162 HG13 ILE 100 1HG1 ILE 100 -2.106 2.716 0.777 163 HG21 ILE 100 1HG2 ILE 100 -2.834 -0.811 0.995 164 HG22 ILE 100 2HG2 ILE 100 -1.892 0.418 0.149 165 HG23 ILE 100 3HG2 ILE 100 -3.453 -0.083 -0.489 166 HD11 ILE 100 3HD1 ILE 100 -4.580 3.021 -0.881 167 HD12 ILE 100 1HD1 ILE 100 -3.438 1.753 -1.309 168 HD13 ILE 100 2HD1 ILE 100 -2.920 3.435 -1.281 169 H SER 101 H SER 101 -6.341 -0.765 -0.100 170 HA SER 101 HA SER 101 -6.509 -2.643 2.160 171 HB2 SER 101 2HB SER 101 -7.892 -2.839 -0.524 172 HB3 SER 101 1HB SER 101 -8.246 -3.754 0.935 173 HG SER 101 HG SER 101 -8.705 -1.667 1.913 174 H ALA 102 H ALA 102 -6.147 -4.924 1.688 175 HA ALA 102 HA ALA 102 -3.630 -5.377 0.459 176 HB1 ALA 102 1HB ALA 102 -5.537 -6.871 2.089 177 HB2 ALA 102 2HB ALA 102 -3.785 -7.030 2.021 178 HB3 ALA 102 3HB ALA 102 -4.796 -7.903 0.867 179 H ALA 103 H ALA 103 -6.941 -6.001 -0.577 180 HA ALA 103 HA ALA 103 -6.382 -7.671 -2.728 181 HB1 ALA 103 1HB ALA 103 -8.572 -6.860 -3.620 182 HB2 ALA 103 2HB ALA 103 -8.591 -5.648 -2.339 183 HB3 ALA 103 3HB ALA 103 -8.635 -7.363 -1.932 184 H GLU 104 H GLU 104 -6.320 -4.131 -2.533 185 HA GLU 104 HA GLU 104 -6.083 -3.653 -5.306 186 HB2 GLU 104 2HB GLU 104 -5.120 -1.982 -2.973 187 HB3 GLU 104 1HB GLU 104 -5.354 -1.413 -4.628 188 HG2 GLU 104 2HG GLU 104 -7.752 -2.025 -4.473 189 HG3 GLU 104 1HG GLU 104 -7.494 -2.540 -2.808 190 H LEU 105 H LEU 105 -3.711 -4.403 -2.782 191 HA LEU 105 HA LEU 105 -1.393 -3.591 -4.195 192 HB2 LEU 105 2HB LEU 105 -1.573 -5.874 -2.239 193 HB3 LEU 105 1HB LEU 105 -0.174 -4.860 -2.586 194 HG LEU 105 HG LEU 105 -2.742 -4.046 -1.210 195 HD11 LEU 105 1HD1 LEU 105 -1.153 -5.090 0.286 196 HD12 LEU 105 2HD1 LEU 105 -1.098 -3.358 0.575 197 HD13 LEU 105 3HD1 LEU 105 0.170 -4.130 -0.371 198 HD21 LEU 105 3HD2 LEU 105 -1.526 -1.782 -1.039 199 HD22 LEU 105 1HD2 LEU 105 -2.254 -2.181 -2.593 200 HD23 LEU 105 2HD2 LEU 105 -0.516 -2.360 -2.362 201 H ARG 106 H ARG 106 -2.830 -6.851 -3.868 202 HA ARG 106 HA ARG 106 -1.017 -8.105 -5.612 203 HB2 ARG 106 2HB ARG 106 -2.890 -9.822 -5.874 204 HB3 ARG 106 1HB ARG 106 -2.317 -9.537 -4.239 205 HG2 ARG 106 2HG ARG 106 -4.227 -7.864 -3.986 206 HG3 ARG 106 1HG ARG 106 -4.847 -8.484 -5.515 207 HD2 ARG 106 2HD ARG 106 -5.935 -9.701 -3.758 208 HD3 ARG 106 1HD ARG 106 -4.772 -10.794 -4.496 209 HE ARG 106 HE ARG 106 -3.563 -9.431 -2.336 210 HH11 ARG 106 1HH2 ARG 106 -5.920 -11.901 -3.060 211 HH12 ARG 106 2HH2 ARG 106 -5.724 -12.712 -1.540 212 HH21 ARG 106 1HH1 ARG 106 -3.322 -10.505 -0.347 213 HH22 ARG 106 2HH1 ARG 106 -4.258 -11.921 -0.010 214 H HIS 107 H HIS 107 -4.249 -6.700 -6.252 215 HA HIS 107 HA HIS 107 -4.328 -7.362 -8.998 216 HB2 HIS 107 2HB HIS 107 -6.259 -6.635 -7.580 217 HB3 HIS 107 1HB HIS 107 -5.613 -4.996 -7.630 218 HD1 HIS 107 1HD HIS 107 -4.700 -5.808 -10.809 219 HD2 HIS 107 2HD HIS 107 -8.487 -5.437 -9.106 220 HE1 HIS 107 1HE HIS 107 -6.307 -5.352 -12.716 221 HE2 HIS 107 2HE HIS 107 -8.618 -5.126 -11.693 222 H VAL 108 H VAL 108 -3.446 -4.293 -7.404 223 HA VAL 108 HA VAL 108 -2.773 -2.955 -9.804 224 HB VAL 108 HB VAL 108 -3.170 -1.937 -7.462 225 HG11 VAL 108 1HG1 VAL 108 -1.288 -1.639 -6.043 226 HG12 VAL 108 2HG1 VAL 108 -0.181 -2.297 -7.253 227 HG13 VAL 108 3HG1 VAL 108 -1.341 -3.349 -6.452 228 HG21 VAL 108 3HG2 VAL 108 -2.564 -0.593 -9.410 229 HG22 VAL 108 1HG2 VAL 108 -0.864 -1.007 -9.190 230 HG23 VAL 108 2HG2 VAL 108 -1.692 -0.014 -7.990 231 H MET 109 H MET 109 -0.700 -4.665 -7.451 232 HA MET 109 HA MET 109 1.751 -4.213 -8.707 233 HB2 MET 109 2HB MET 109 0.716 -6.516 -7.056 234 HB3 MET 109 1HB MET 109 2.370 -6.480 -7.651 235 HG2 MET 109 2HG MET 109 1.136 -4.239 -6.027 236 HG3 MET 109 1HG MET 109 2.083 -5.548 -5.321 237 HE1 MET 109 3HE MET 109 4.668 -5.346 -5.013 238 HE2 MET 109 1HE MET 109 3.658 -4.113 -4.248 239 HE3 MET 109 2HE MET 109 5.175 -3.658 -5.019 240 H THR 110 H THR 110 -0.566 -6.883 -9.161 241 HA THR 110 HA THR 110 0.891 -8.180 -11.218 242 HB THR 110 HB THR 110 -2.030 -8.228 -10.441 243 HG1 THR 110 1HG THR 110 -1.285 -10.442 -9.949 244 HG21 THR 110 3HG2 THR 110 -1.900 -10.399 -11.955 245 HG22 THR 110 1HG2 THR 110 -0.630 -9.496 -12.782 246 HG23 THR 110 2HG2 THR 110 -2.261 -8.836 -12.680 247 H ASN 111 H ASN 111 -1.708 -5.764 -11.259 248 HA ASN 111 HA ASN 111 -2.071 -5.620 -14.044 249 HB2 ASN 111 2HB ASN 111 -3.549 -4.628 -12.271 250 HB3 ASN 111 1HB ASN 111 -2.357 -3.350 -12.069 251 HD21 ASN 111 1HD2 ASN 111 -3.797 -1.679 -12.898 252 HD22 ASN 111 2HD2 ASN 111 -4.222 -1.606 -14.538 253 H LEU 112 H LEU 112 0.131 -3.986 -11.862 254 HA LEU 112 HA LEU 112 1.232 -2.129 -13.657 255 HB2 LEU 112 2HB LEU 112 2.186 -3.435 -11.123 256 HB3 LEU 112 1HB LEU 112 3.281 -2.397 -12.032 257 HG LEU 112 HG LEU 112 0.501 -1.490 -11.252 258 HD11 LEU 112 1HD1 LEU 112 1.423 -1.937 -9.126 259 HD12 LEU 112 2HD1 LEU 112 1.817 -0.239 -9.382 260 HD13 LEU 112 3HD1 LEU 112 3.049 -1.476 -9.629 261 HD21 LEU 112 3HD2 LEU 112 1.412 -0.011 -12.875 262 HD22 LEU 112 1HD2 LEU 112 3.040 -0.137 -12.208 263 HD23 LEU 112 2HD2 LEU 112 1.799 0.769 -11.346 264 H GLY 113 H GLY 113 1.995 -5.496 -12.967 265 HA2 GLY 113 2HA GLY 113 2.777 -6.609 -15.155 266 HA3 GLY 113 1HA GLY 113 4.091 -5.438 -15.072 267 H GLU 114 H GLU 114 3.319 -6.147 -11.947 268 HA GLU 114 HA GLU 114 5.306 -8.356 -11.793 269 HB2 GLU 114 2HB GLU 114 6.156 -6.185 -10.939 270 HB3 GLU 114 1HB GLU 114 4.830 -6.148 -9.776 271 HG2 GLU 114 2HG GLU 114 5.613 -8.257 -8.792 272 HG3 GLU 114 1HG GLU 114 6.915 -8.336 -9.978 273 H LYS 115 H LYS 115 4.294 -10.180 -11.285 274 HA LYS 115 HA LYS 115 1.802 -10.155 -9.766 275 HB2 LYS 115 2HB LYS 115 3.380 -12.383 -11.074 276 HB3 LYS 115 1HB LYS 115 1.867 -12.627 -10.203 277 HG2 LYS 115 2HG LYS 115 0.727 -11.067 -11.735 278 HG3 LYS 115 1HG LYS 115 2.235 -10.820 -12.613 279 HD2 LYS 115 2HD LYS 115 2.301 -13.231 -13.168 280 HD3 LYS 115 1HD LYS 115 0.779 -13.463 -12.308 281 HE2 LYS 115 2HE LYS 115 -0.367 -11.955 -13.860 282 HE3 LYS 115 1HE LYS 115 1.152 -11.622 -14.694 283 HZ1 LYS 115 3HZ LYS 115 -0.020 -14.334 -14.424 284 HZ2 LYS 115 1HZ LYS 115 1.291 -13.873 -15.395 285 HZ3 LYS 115 2HZ LYS 115 -0.275 -13.330 -15.772 286 H LEU 116 H LEU 116 2.323 -9.614 -7.672 287 HA LEU 116 HA LEU 116 4.464 -10.870 -6.219 288 HB2 LEU 116 2HB LEU 116 3.087 -8.538 -5.897 289 HB3 LEU 116 1HB LEU 116 2.239 -9.544 -4.727 290 HG LEU 116 HG LEU 116 4.663 -10.210 -3.937 291 HD11 LEU 116 1HD1 LEU 116 6.257 -8.286 -4.221 292 HD12 LEU 116 2HD1 LEU 116 5.148 -7.600 -5.405 293 HD13 LEU 116 3HD1 LEU 116 5.926 -9.149 -5.724 294 HD21 LEU 116 3HD2 LEU 116 4.665 -8.297 -2.373 295 HD22 LEU 116 1HD2 LEU 116 3.031 -8.919 -2.599 296 HD23 LEU 116 2HD2 LEU 116 3.532 -7.441 -3.418 297 H THR 117 H THR 117 3.498 -11.571 -3.804 298 HA THR 117 HA THR 117 1.828 -13.944 -4.397 299 HB THR 117 HB THR 117 2.729 -14.647 -2.068 300 HG1 THR 117 1HG THR 117 4.996 -13.361 -2.294 301 HG21 THR 117 3HG2 THR 117 3.542 -15.818 -3.961 302 HG22 THR 117 1HG2 THR 117 4.991 -15.249 -3.134 303 HG23 THR 117 2HG2 THR 117 4.405 -14.405 -4.568 304 H ASP 118 H ASP 118 -0.208 -13.947 -3.739 305 HA ASP 118 HA ASP 118 -1.441 -11.825 -2.398 306 HB2 ASP 118 2HB ASP 118 -2.289 -14.685 -2.834 307 HB3 ASP 118 1HB ASP 118 -3.328 -13.501 -2.043 308 H GLU 119 H GLU 119 -0.216 -14.923 -1.189 309 HA GLU 119 HA GLU 119 -1.204 -14.782 1.431 310 HB2 GLU 119 2HB GLU 119 1.361 -16.026 0.400 311 HB3 GLU 119 1HB GLU 119 0.652 -16.343 1.984 312 HG2 GLU 119 2HG GLU 119 -1.400 -17.176 0.904 313 HG3 GLU 119 1HG GLU 119 -0.705 -16.839 -0.678 314 H GLU 120 H GLU 120 1.700 -13.384 -0.032 315 HA GLU 120 HA GLU 120 2.751 -12.378 2.461 316 HB2 GLU 120 2HB GLU 120 3.404 -11.694 -0.413 317 HB3 GLU 120 1HB GLU 120 4.259 -11.033 0.981 318 HG2 GLU 120 2HG GLU 120 4.878 -13.300 1.702 319 HG3 GLU 120 1HG GLU 120 4.006 -13.986 0.333 320 H VAL 121 H VAL 121 0.837 -11.101 -0.217 321 HA VAL 121 HA VAL 121 0.727 -8.396 0.482 322 HB VAL 121 HB VAL 121 -1.309 -10.217 -0.802 323 HG11 VAL 121 1HG1 VAL 121 -1.453 -7.253 -0.307 324 HG12 VAL 121 2HG1 VAL 121 -2.641 -8.476 0.134 325 HG13 VAL 121 3HG1 VAL 121 -2.391 -8.055 -1.559 326 HG21 VAL 121 3HG2 VAL 121 0.288 -7.950 -2.002 327 HG22 VAL 121 1HG2 VAL 121 -0.584 -9.228 -2.844 328 HG23 VAL 121 2HG2 VAL 121 0.888 -9.606 -1.952 329 H ASP 122 H ASP 122 -1.803 -10.805 1.181 330 HA ASP 122 HA ASP 122 -3.303 -9.401 3.001 331 HB2 ASP 122 2HB ASP 122 -3.754 -11.699 2.056 332 HB3 ASP 122 1HB ASP 122 -2.630 -12.340 3.251 333 H GLU 123 H GLU 123 -0.348 -11.315 3.636 334 HA GLU 123 HA GLU 123 -0.389 -10.860 6.453 335 HB2 GLU 123 2HB GLU 123 0.854 -12.717 5.422 336 HB3 GLU 123 1HB GLU 123 1.958 -11.558 4.683 337 HG2 GLU 123 2HG GLU 123 2.639 -10.754 6.902 338 HG3 GLU 123 1HG GLU 123 1.484 -11.844 7.669 339 H MET 124 H MET 124 1.108 -9.188 3.713 340 HA MET 124 HA MET 124 2.898 -7.489 4.942 341 HB2 MET 124 2HB MET 124 2.419 -7.708 2.463 342 HB3 MET 124 1HB MET 124 1.029 -6.658 2.718 343 HG2 MET 124 2HG MET 124 2.544 -4.922 3.656 344 HG3 MET 124 1HG MET 124 3.921 -5.959 3.279 345 HE1 MET 124 3HE MET 124 4.369 -6.935 0.926 346 HE2 MET 124 1HE MET 124 5.281 -5.461 1.266 347 HE3 MET 124 2HE MET 124 4.568 -5.713 -0.327 348 H ILE 125 H ILE 125 -0.366 -6.433 4.004 349 HA ILE 125 HA ILE 125 -0.375 -4.088 5.539 350 HB ILE 125 HB ILE 125 -2.582 -5.834 4.442 351 HG12 ILE 125 2HG1 ILE 125 -1.694 -2.989 3.857 352 HG13 ILE 125 1HG1 ILE 125 -1.243 -4.406 2.907 353 HG21 ILE 125 1HG2 ILE 125 -2.824 -3.432 6.255 354 HG22 ILE 125 2HG2 ILE 125 -3.660 -4.973 6.375 355 HG23 ILE 125 3HG2 ILE 125 -4.105 -3.823 5.111 356 HD11 ILE 125 3HD1 ILE 125 -3.953 -3.119 3.206 357 HD12 ILE 125 1HD1 ILE 125 -3.812 -4.802 2.709 358 HD13 ILE 125 2HD1 ILE 125 -3.098 -3.527 1.720 359 H ARG 126 H ARG 126 -1.353 -7.379 6.387 360 HA ARG 126 HA ARG 126 -2.633 -6.904 8.789 361 HB2 ARG 126 2HB ARG 126 -0.972 -9.174 7.776 362 HB3 ARG 126 1HB ARG 126 -1.670 -9.247 9.387 363 HG2 ARG 126 2HG ARG 126 -3.434 -8.522 7.048 364 HG3 ARG 126 1HG ARG 126 -3.011 -10.217 7.311 365 HD2 ARG 126 2HD ARG 126 -3.842 -10.030 9.646 366 HD3 ARG 126 1HD ARG 126 -4.333 -8.370 9.316 367 HE ARG 126 HE ARG 126 -5.496 -9.973 7.360 368 HH11 ARG 126 1HH2 ARG 126 -5.489 -9.553 10.795 369 HH12 ARG 126 2HH2 ARG 126 -7.129 -10.066 11.003 370 HH21 ARG 126 1HH1 ARG 126 -7.654 -10.662 7.620 371 HH22 ARG 126 2HH1 ARG 126 -8.357 -10.696 9.202 372 H GLU 127 H GLU 127 0.874 -7.239 8.226 373 HA GLU 127 HA GLU 127 1.407 -6.848 11.056 374 HB2 GLU 127 2HB GLU 127 3.793 -6.985 10.385 375 HB3 GLU 127 1HB GLU 127 2.848 -8.367 9.838 376 HG2 GLU 127 2HG GLU 127 2.726 -7.513 7.611 377 HG3 GLU 127 1HG GLU 127 3.387 -5.962 8.091 378 H ALA 128 H ALA 128 1.546 -4.967 8.097 379 HA ALA 128 HA ALA 128 2.923 -2.732 9.186 380 HB1 ALA 128 1HB ALA 128 2.322 -3.425 6.688 381 HB2 ALA 128 2HB ALA 128 2.574 -1.735 7.119 382 HB3 ALA 128 3HB ALA 128 0.935 -2.374 6.968 383 H ASP 129 H ASP 129 -0.533 -3.211 8.474 384 HA ASP 129 HA ASP 129 -1.638 -0.907 9.400 385 HB2 ASP 129 2HB ASP 129 -2.803 -3.000 8.509 386 HB3 ASP 129 1HB ASP 129 -2.791 -3.580 10.170 387 H ILE 130 H ILE 130 -1.879 0.124 11.294 388 HA ILE 130 HA ILE 130 -0.622 -1.046 13.670 389 HB ILE 130 HB ILE 130 -1.733 1.738 13.247 390 HG12 ILE 130 2HG1 ILE 130 0.278 0.918 11.793 391 HG13 ILE 130 1HG1 ILE 130 0.393 2.454 12.645 392 HG21 ILE 130 1HG2 ILE 130 -0.156 0.415 15.464 393 HG22 ILE 130 2HG2 ILE 130 -1.612 1.401 15.596 394 HG23 ILE 130 3HG2 ILE 130 -0.066 2.159 15.212 395 HD11 ILE 130 3HD1 ILE 130 1.871 1.632 14.243 396 HD12 ILE 130 1HD1 ILE 130 2.396 0.772 12.799 397 HD13 ILE 130 2HD1 ILE 130 1.385 -0.042 13.996 398 H ASP 131 H ASP 131 -3.752 -0.127 12.478 399 HA ASP 131 HA ASP 131 -4.991 -0.783 15.091 400 HB2 ASP 131 2HB ASP 131 -5.497 1.418 14.002 401 HB3 ASP 131 1HB ASP 131 -6.253 0.532 12.680 402 H GLY 132 H GLY 132 -4.290 -2.159 12.110 403 HA2 GLY 132 2HA GLY 132 -4.957 -4.083 11.055 404 HA3 GLY 132 1HA GLY 132 -5.649 -4.570 12.599 405 H ASP 133 H ASP 133 -6.525 -1.734 10.682 406 HA ASP 133 HA ASP 133 -9.323 -2.574 10.696 407 HB2 ASP 133 2HB ASP 133 -9.685 -0.267 9.770 408 HB3 ASP 133 1HB ASP 133 -8.890 -0.300 11.345 409 H GLY 134 H GLY 134 -7.516 -4.067 9.024 410 HA2 GLY 134 2HA GLY 134 -7.427 -4.966 6.912 411 HA3 GLY 134 1HA GLY 134 -9.023 -4.268 6.670 412 H GLN 135 H GLN 135 -7.064 -1.751 7.483 413 HA GLN 135 HA GLN 135 -5.934 -1.328 4.824 414 HB2 GLN 135 2HB GLN 135 -8.075 0.437 6.021 415 HB3 GLN 135 1HB GLN 135 -7.026 0.941 4.695 416 HG2 GLN 135 2HG GLN 135 -7.789 -1.106 3.425 417 HG3 GLN 135 1HG GLN 135 -8.963 -1.391 4.704 418 HE21 GLN 135 1HE2 GLN 135 -10.786 0.125 4.886 419 HE22 GLN 135 2HE2 GLN 135 -11.167 1.186 3.616 420 H VAL 136 H VAL 136 -4.483 0.491 4.732 421 HA VAL 136 HA VAL 136 -3.616 1.512 7.377 422 HB VAL 136 HB VAL 136 -1.413 0.855 7.110 423 HG11 VAL 136 1HG1 VAL 136 -2.707 -1.287 5.454 424 HG12 VAL 136 2HG1 VAL 136 -3.015 -1.109 7.181 425 HG13 VAL 136 3HG1 VAL 136 -1.381 -1.449 6.606 426 HG21 VAL 136 3HG2 VAL 136 -0.520 0.111 4.820 427 HG22 VAL 136 1HG2 VAL 136 -0.862 1.828 5.034 428 HG23 VAL 136 2HG2 VAL 136 -2.000 0.807 4.163 429 H ASN 137 H ASN 137 -2.747 3.542 7.385 430 HA ASN 137 HA ASN 137 -3.597 5.294 5.315 431 HB2 ASN 137 2HB ASN 137 -1.641 5.835 7.557 432 HB3 ASN 137 1HB ASN 137 -2.497 7.043 6.599 433 HD21 ASN 137 1HD2 ASN 137 -2.624 5.881 9.596 434 HD22 ASN 137 2HD2 ASN 137 -4.300 5.823 9.861 435 H TYR 138 H TYR 138 -1.297 7.055 5.261 436 HA TYR 138 HA TYR 138 0.074 5.861 3.025 437 HB2 TYR 138 2HB TYR 138 0.557 8.525 4.379 438 HB3 TYR 138 1HB TYR 138 1.116 8.043 2.778 439 HD1 TYR 138 1HD TYR 138 -0.617 7.476 0.992 440 HD2 TYR 138 2HD TYR 138 -1.636 9.391 4.700 441 HE1 TYR 138 1HE TYR 138 -2.775 8.223 0.016 442 HE2 TYR 138 2HE TYR 138 -3.792 10.137 3.726 443 HH TYR 138 HH TYR 138 -5.153 8.865 1.083 444 H GLU 139 H GLU 139 1.168 7.144 6.195 445 HA GLU 139 HA GLU 139 3.869 6.451 5.890 446 HB2 GLU 139 2HB GLU 139 2.185 6.821 8.362 447 HB3 GLU 139 1HB GLU 139 3.935 6.571 8.404 448 HG2 GLU 139 2HG GLU 139 4.290 8.530 6.993 449 HG3 GLU 139 1HG GLU 139 2.549 8.761 6.831 450 H GLU 140 H GLU 140 1.603 4.812 8.056 451 HA GLU 140 HA GLU 140 2.771 2.550 8.835 452 HB2 GLU 140 2HB GLU 140 0.057 2.649 7.504 453 HB3 GLU 140 1HB GLU 140 0.632 1.286 8.459 454 HG2 GLU 140 2HG GLU 140 0.834 2.717 10.427 455 HG3 GLU 140 1HG GLU 140 0.361 4.127 9.484 456 H PHE 141 H PHE 141 1.909 3.311 5.537 457 HA PHE 141 HA PHE 141 2.719 0.703 4.504 458 HB2 PHE 141 2HB PHE 141 0.808 2.327 3.633 459 HB3 PHE 141 1HB PHE 141 2.128 3.055 2.730 460 HD1 PHE 141 1HD PHE 141 3.799 1.171 1.660 461 HD2 PHE 141 2HD PHE 141 -0.370 0.652 2.540 462 HE1 PHE 141 1HE PHE 141 3.677 -0.678 0.019 463 HE2 PHE 141 2HE PHE 141 -0.483 -1.190 0.916 464 HZ PHE 141 HZ PHE 141 1.531 -1.863 -0.358 465 H VAL 142 H VAL 142 3.683 4.131 4.005 466 HA VAL 142 HA VAL 142 5.779 4.048 2.355 467 HB VAL 142 HB VAL 142 5.677 5.424 5.034 468 HG11 VAL 142 1HG1 VAL 142 8.005 5.335 4.593 469 HG12 VAL 142 2HG1 VAL 142 7.489 6.909 3.985 470 HG13 VAL 142 3HG1 VAL 142 7.764 5.577 2.863 471 HG21 VAL 142 3HG2 VAL 142 5.560 6.737 2.330 472 HG22 VAL 142 1HG2 VAL 142 4.834 7.264 3.844 473 HG23 VAL 142 2HG2 VAL 142 4.121 5.929 2.940 474 H GLN 143 H GLN 143 6.323 3.489 5.860 475 HA GLN 143 HA GLN 143 8.918 2.679 5.860 476 HB2 GLN 143 2HB GLN 143 7.419 2.750 7.848 477 HB3 GLN 143 1HB GLN 143 6.708 1.225 7.328 478 HG2 GLN 143 2HG GLN 143 8.397 0.756 8.996 479 HG3 GLN 143 1HG GLN 143 8.992 0.190 7.437 480 HE21 GLN 143 1HE2 GLN 143 11.248 0.498 7.762 481 HE22 GLN 143 2HE2 GLN 143 11.947 2.011 8.080 482 H MET 144 H MET 144 6.362 0.184 5.729 483 HA MET 144 HA MET 144 7.834 -1.982 4.994 484 HB2 MET 144 2HB MET 144 5.095 -1.179 3.994 485 HB3 MET 144 1HB MET 144 5.793 -2.779 3.747 486 HG2 MET 144 2HG MET 144 5.467 -1.495 6.471 487 HG3 MET 144 1HG MET 144 4.290 -2.600 5.765 488 HE1 MET 144 3HE MET 144 5.784 -3.361 8.669 489 HE2 MET 144 1HE MET 144 5.577 -5.057 8.219 490 HE3 MET 144 2HE MET 144 4.367 -3.867 7.753 491 H MET 145 H MET 145 6.448 0.391 2.720 492 HA MET 145 HA MET 145 7.174 -0.602 0.306 493 HB2 MET 145 2HB MET 145 6.139 1.715 0.950 494 HB3 MET 145 1HB MET 145 7.805 2.284 0.882 495 HG2 MET 145 2HG MET 145 7.799 1.003 -1.455 496 HG3 MET 145 1HG MET 145 6.059 1.267 -1.335 497 HE1 MET 145 3HE MET 145 5.514 3.784 0.048 498 HE2 MET 145 1HE MET 145 4.863 3.423 -1.557 499 HE3 MET 145 2HE MET 145 5.563 5.006 -1.221 500 H THR 146 H THR 146 9.317 1.734 1.957 501 HA THR 146 HA THR 146 11.648 0.312 0.777 502 HB THR 146 HB THR 146 11.673 3.209 1.615 503 HG1 THR 146 1HG THR 146 11.405 3.427 -0.799 504 HG21 THR 146 3HG2 THR 146 13.549 3.304 0.061 505 HG22 THR 146 1HG2 THR 146 13.252 1.642 -0.445 506 HG23 THR 146 2HG2 THR 146 13.809 1.977 1.194 507 H ALA 147 H ALA 147 10.727 -0.724 3.078 508 HA ALA 147 HA ALA 147 11.721 0.392 5.475 509 HB1 ALA 147 1HB ALA 147 11.064 -2.427 4.628 510 HB2 ALA 147 2HB ALA 147 10.124 -1.352 5.662 511 HB3 ALA 147 3HB ALA 147 11.632 -2.046 6.254 512 H LYS 148 H LYS 148 13.673 0.175 6.534 513 HA LYS 148 HA LYS 148 15.968 -0.014 6.678 514 HB2 LYS 148 2HB LYS 148 15.285 -2.649 5.347 515 HB3 LYS 148 1HB LYS 148 16.882 -2.260 5.989 516 HG2 LYS 148 2HG LYS 148 15.772 -1.796 8.219 517 HG3 LYS 148 1HG LYS 148 14.281 -2.437 7.537 518 HD2 LYS 148 2HD LYS 148 16.872 -4.005 7.563 519 HD3 LYS 148 1HD LYS 148 15.695 -4.099 8.867 520 HE2 LYS 148 2HE LYS 148 13.967 -4.696 7.065 521 HE3 LYS 148 1HE LYS 148 15.338 -4.918 5.976 522 HZ1 LYS 148 3HZ LYS 148 15.473 -6.959 6.797 523 HZ2 LYS 148 1HZ LYS 148 14.387 -6.626 8.056 524 HZ3 LYS 148 2HZ LYS 148 16.038 -6.271 8.246 Start of MODEL 18 1 H1 ASP 78 1HT ASP 78 17.536 11.265 -0.616 2 H2 ASP 78 2HT ASP 78 19.202 11.566 -0.472 3 H3 ASP 78 3HT ASP 78 18.593 10.766 -1.842 4 HA ASP 78 HA ASP 78 19.041 13.470 -1.546 5 HB2 ASP 78 2HB ASP 78 17.568 11.790 -3.590 6 HB3 ASP 78 1HB ASP 78 17.921 13.501 -3.832 7 H THR 79 H THR 79 15.974 12.756 -3.019 8 HA THR 79 HA THR 79 14.513 14.128 -0.835 9 HB THR 79 HB THR 79 14.215 14.737 -3.790 10 HG1 THR 79 1HG THR 79 15.060 16.756 -3.141 11 HG21 THR 79 3HG2 THR 79 12.841 15.792 -1.305 12 HG22 THR 79 1HG2 THR 79 12.091 14.947 -2.660 13 HG23 THR 79 2HG2 THR 79 12.739 16.572 -2.884 14 H ASP 80 H ASP 80 12.800 12.970 -0.205 15 HA ASP 80 HA ASP 80 11.887 10.728 -1.861 16 HB2 ASP 80 2HB ASP 80 11.164 11.558 0.961 17 HB3 ASP 80 1HB ASP 80 10.598 10.096 0.156 18 H SER 81 H SER 81 11.111 13.935 -1.442 19 HA SER 81 HA SER 81 9.245 15.231 -1.862 20 HB2 SER 81 2HB SER 81 9.755 14.425 -4.122 21 HB3 SER 81 1HB SER 81 8.771 12.990 -3.842 22 HG SER 81 HG SER 81 7.073 14.143 -4.270 23 H GLU 82 H GLU 82 8.300 14.837 0.219 24 HA GLU 82 HA GLU 82 6.671 12.802 1.053 25 HB2 GLU 82 2HB GLU 82 7.274 14.790 2.407 26 HB3 GLU 82 1HB GLU 82 6.160 15.763 1.448 27 HG2 GLU 82 2HG GLU 82 4.282 14.332 2.173 28 HG3 GLU 82 1HG GLU 82 5.397 13.360 3.134 29 H GLU 83 H GLU 83 5.937 15.325 -1.278 30 HA GLU 83 HA GLU 83 3.140 14.891 -1.391 31 HB2 GLU 83 2HB GLU 83 5.064 16.113 -3.374 32 HB3 GLU 83 1HB GLU 83 3.310 16.161 -3.529 33 HG2 GLU 83 2HG GLU 83 4.834 17.219 -1.132 34 HG3 GLU 83 1HG GLU 83 4.262 18.224 -2.462 35 H GLU 84 H GLU 84 5.802 13.664 -3.465 36 HA GLU 84 HA GLU 84 4.262 12.292 -5.330 37 HB2 GLU 84 2HB GLU 84 6.764 12.458 -5.384 38 HB3 GLU 84 1HB GLU 84 6.827 11.241 -4.110 39 HG2 GLU 84 2HG GLU 84 7.110 10.090 -6.210 40 HG3 GLU 84 1HG GLU 84 5.493 9.709 -5.628 41 H ILE 85 H ILE 85 5.411 11.166 -2.144 42 HA ILE 85 HA ILE 85 4.288 8.602 -2.178 43 HB ILE 85 HB ILE 85 4.606 10.523 0.156 44 HG12 ILE 85 2HG1 ILE 85 6.483 8.362 -0.842 45 HG13 ILE 85 1HG1 ILE 85 6.695 10.086 -1.151 46 HG21 ILE 85 1HG2 ILE 85 3.138 8.573 0.651 47 HG22 ILE 85 2HG2 ILE 85 4.643 8.525 1.553 48 HG23 ILE 85 3HG2 ILE 85 4.438 7.496 0.140 49 HD11 ILE 85 3HD1 ILE 85 6.676 8.704 1.545 50 HD12 ILE 85 1HD1 ILE 85 6.651 10.456 1.345 51 HD13 ILE 85 2HD1 ILE 85 8.036 9.524 0.779 52 H ARG 86 H ARG 86 2.954 11.717 -1.078 53 HA ARG 86 HA ARG 86 0.454 10.754 -0.230 54 HB2 ARG 86 2HB ARG 86 1.281 13.461 -1.308 55 HB3 ARG 86 1HB ARG 86 -0.286 13.140 -0.571 56 HG2 ARG 86 2HG ARG 86 2.218 12.387 0.929 57 HG3 ARG 86 1HG ARG 86 1.714 14.074 0.899 58 HD2 ARG 86 2HD ARG 86 -0.497 13.435 1.782 59 HD3 ARG 86 1HD ARG 86 -0.004 11.745 1.815 60 HE ARG 86 HE ARG 86 1.259 12.194 3.725 61 HH11 ARG 86 1HH2 ARG 86 0.194 15.111 2.185 62 HH12 ARG 86 2HH2 ARG 86 0.741 16.145 3.463 63 HH21 ARG 86 1HH1 ARG 86 1.974 13.550 5.399 64 HH22 ARG 86 2HH1 ARG 86 1.751 15.265 5.277 65 H GLU 87 H GLU 87 1.635 11.659 -3.419 66 HA GLU 87 HA GLU 87 -0.969 11.525 -4.671 67 HB2 GLU 87 2HB GLU 87 1.832 11.616 -5.800 68 HB3 GLU 87 1HB GLU 87 0.373 11.616 -6.792 69 HG2 GLU 87 2HG GLU 87 -0.407 13.662 -5.701 70 HG3 GLU 87 1HG GLU 87 0.993 13.648 -4.631 71 H ALA 88 H ALA 88 1.949 9.623 -5.262 72 HA ALA 88 HA ALA 88 1.034 7.542 -6.710 73 HB1 ALA 88 1HB ALA 88 2.922 7.300 -4.351 74 HB2 ALA 88 2HB ALA 88 3.366 7.683 -6.016 75 HB3 ALA 88 3HB ALA 88 2.722 6.090 -5.621 76 H PHE 89 H PHE 89 0.889 7.618 -3.150 77 HA PHE 89 HA PHE 89 -0.563 5.202 -2.930 78 HB2 PHE 89 2HB PHE 89 0.090 7.462 -1.099 79 HB3 PHE 89 1HB PHE 89 -1.170 6.327 -0.605 80 HD1 PHE 89 2HD PHE 89 -0.602 3.787 -0.831 81 HD2 PHE 89 1HD PHE 89 2.352 6.889 -0.729 82 HE1 PHE 89 2HE PHE 89 1.126 2.125 -0.194 83 HE2 PHE 89 1HE PHE 89 4.073 5.236 -0.094 84 HZ PHE 89 HZ PHE 89 3.467 2.859 0.161 85 H ARG 90 H ARG 90 -1.631 8.608 -3.075 86 HA ARG 90 HA ARG 90 -4.357 8.132 -2.569 87 HB2 ARG 90 2HB ARG 90 -2.842 10.249 -4.072 88 HB3 ARG 90 1HB ARG 90 -4.601 10.253 -4.105 89 HG2 ARG 90 2HG ARG 90 -3.164 10.032 -1.459 90 HG3 ARG 90 1HG ARG 90 -3.321 11.610 -2.232 91 HD2 ARG 90 2HD ARG 90 -5.807 11.183 -2.388 92 HD3 ARG 90 1HD ARG 90 -5.558 9.738 -1.417 93 HE ARG 90 HE ARG 90 -4.444 12.074 -0.176 94 HH11 ARG 90 1HH2 ARG 90 -7.349 10.302 -0.801 95 HH12 ARG 90 2HH2 ARG 90 -8.183 10.909 0.592 96 HH21 ARG 90 1HH1 ARG 90 -5.522 12.862 1.658 97 HH22 ARG 90 2HH1 ARG 90 -7.146 12.355 1.987 98 H VAL 91 H VAL 91 -2.519 8.096 -5.597 99 HA VAL 91 HA VAL 91 -4.714 7.577 -7.318 100 HB VAL 91 HB VAL 91 -1.771 6.944 -7.642 101 HG11 VAL 91 1HG1 VAL 91 -2.418 7.001 -10.108 102 HG12 VAL 91 2HG1 VAL 91 -4.096 6.894 -9.579 103 HG13 VAL 91 3HG1 VAL 91 -2.970 5.588 -9.209 104 HG21 VAL 91 3HG2 VAL 91 -1.787 9.017 -9.005 105 HG22 VAL 91 1HG2 VAL 91 -2.251 9.337 -7.333 106 HG23 VAL 91 2HG2 VAL 91 -3.485 9.263 -8.592 107 H PHE 92 H PHE 92 -2.427 5.496 -5.610 108 HA PHE 92 HA PHE 92 -3.068 3.025 -6.698 109 HB2 PHE 92 2HB PHE 92 -2.043 3.942 -4.052 110 HB3 PHE 92 1HB PHE 92 -2.593 2.280 -4.144 111 HD1 PHE 92 1HD PHE 92 -1.035 4.268 -6.898 112 HD2 PHE 92 2HD PHE 92 -0.533 1.103 -4.036 113 HE1 PHE 92 1HE PHE 92 1.077 3.597 -8.007 114 HE2 PHE 92 2HE PHE 92 1.578 0.436 -5.145 115 HZ PHE 92 HZ PHE 92 2.384 1.679 -7.132 116 H ASP 93 H ASP 93 -4.648 4.603 -3.882 117 HA ASP 93 HA ASP 93 -6.511 2.713 -3.208 118 HB2 ASP 93 2HB ASP 93 -6.235 5.009 -2.202 119 HB3 ASP 93 1HB ASP 93 -7.204 5.626 -3.540 120 H LYS 94 H LYS 94 -7.414 1.414 -4.684 121 HA LYS 94 HA LYS 94 -8.688 2.421 -7.078 122 HB2 LYS 94 2HB LYS 94 -8.689 -0.444 -6.148 123 HB3 LYS 94 1HB LYS 94 -8.754 0.203 -7.783 124 HG2 LYS 94 2HG LYS 94 -6.435 1.067 -7.490 125 HG3 LYS 94 1HG LYS 94 -6.393 0.292 -5.907 126 HD2 LYS 94 2HD LYS 94 -5.361 -1.278 -7.311 127 HD3 LYS 94 1HD LYS 94 -7.004 -1.879 -7.142 128 HE2 LYS 94 2HE LYS 94 -7.617 -1.089 -9.319 129 HE3 LYS 94 1HE LYS 94 -6.162 -0.101 -9.450 130 HZ1 LYS 94 3HZ LYS 94 -5.821 -2.968 -9.021 131 HZ2 LYS 94 1HZ LYS 94 -4.874 -1.888 -9.922 132 HZ3 LYS 94 2HZ LYS 94 -6.341 -2.465 -10.557 133 H ASP 95 H ASP 95 -9.585 2.657 -4.104 134 HA ASP 95 HA ASP 95 -12.365 1.727 -4.531 135 HB2 ASP 95 2HB ASP 95 -10.737 1.663 -1.983 136 HB3 ASP 95 1HB ASP 95 -12.479 1.382 -2.064 137 H GLY 96 H GLY 96 -10.623 4.381 -4.652 138 HA2 GLY 96 2HA GLY 96 -10.884 6.608 -4.016 139 HA3 GLY 96 1HA GLY 96 -12.564 6.249 -4.388 140 H ASN 97 H ASN 97 -11.235 4.485 -1.741 141 HA ASN 97 HA ASN 97 -13.012 5.892 0.086 142 HB2 ASN 97 2HB ASN 97 -12.508 4.125 1.659 143 HB3 ASN 97 1HB ASN 97 -12.868 3.422 0.085 144 HD21 ASN 97 1HD2 ASN 97 -11.502 1.717 1.615 145 HD22 ASN 97 2HD2 ASN 97 -9.851 1.668 1.226 146 H GLY 98 H GLY 98 -9.826 6.298 -0.885 147 HA2 GLY 98 2HA GLY 98 -8.278 7.859 -0.136 148 HA3 GLY 98 1HA GLY 98 -9.344 8.217 1.218 149 H TYR 99 H TYR 99 -8.457 4.948 0.580 150 HA TYR 99 HA TYR 99 -6.289 4.961 2.568 151 HB2 TYR 99 2HB TYR 99 -8.809 3.312 2.829 152 HB3 TYR 99 1HB TYR 99 -7.350 3.071 3.789 153 HD1 TYR 99 2HD TYR 99 -6.472 5.011 5.192 154 HD2 TYR 99 1HD TYR 99 -10.374 4.998 3.399 155 HE1 TYR 99 2HE TYR 99 -7.190 6.812 6.739 156 HE2 TYR 99 1HE TYR 99 -11.092 6.801 4.943 157 HH TYR 99 HH TYR 99 -10.508 8.124 6.619 158 H ILE 100 H ILE 100 -5.541 2.473 2.787 159 HA ILE 100 HA ILE 100 -5.372 1.412 0.001 160 HB ILE 100 HB ILE 100 -3.263 1.342 2.160 161 HG12 ILE 100 2HG1 ILE 100 -3.663 3.627 1.286 162 HG13 ILE 100 1HG1 ILE 100 -2.102 3.010 0.764 163 HG21 ILE 100 1HG2 ILE 100 -1.855 0.703 0.115 164 HG22 ILE 100 2HG2 ILE 100 -3.384 0.377 -0.699 165 HG23 ILE 100 3HG2 ILE 100 -2.947 -0.530 0.751 166 HD11 ILE 100 3HD1 ILE 100 -3.410 2.231 -1.374 167 HD12 ILE 100 1HD1 ILE 100 -2.939 3.914 -1.205 168 HD13 ILE 100 2HD1 ILE 100 -4.590 3.428 -0.856 169 H SER 101 H SER 101 -6.218 -0.536 -0.256 170 HA SER 101 HA SER 101 -6.486 -2.362 2.047 171 HB2 SER 101 2HB SER 101 -8.569 -1.956 0.860 172 HB3 SER 101 1HB SER 101 -7.804 -2.347 -0.675 173 HG SER 101 HG SER 101 -7.524 -4.261 1.284 174 H ALA 102 H ALA 102 -6.200 -4.686 1.527 175 HA ALA 102 HA ALA 102 -3.599 -5.123 0.408 176 HB1 ALA 102 1HB ALA 102 -3.671 -7.112 1.556 177 HB2 ALA 102 2HB ALA 102 -5.327 -7.458 1.055 178 HB3 ALA 102 3HB ALA 102 -5.022 -6.328 2.371 179 H ALA 103 H ALA 103 -6.887 -5.816 -0.680 180 HA ALA 103 HA ALA 103 -6.238 -7.556 -2.767 181 HB1 ALA 103 1HB ALA 103 -8.505 -7.372 -2.140 182 HB2 ALA 103 2HB ALA 103 -8.423 -6.662 -3.752 183 HB3 ALA 103 3HB ALA 103 -8.498 -5.620 -2.330 184 H GLU 104 H GLU 104 -6.184 -4.024 -2.614 185 HA GLU 104 HA GLU 104 -5.946 -3.568 -5.389 186 HB2 GLU 104 2HB GLU 104 -4.960 -1.901 -3.061 187 HB3 GLU 104 1HB GLU 104 -5.160 -1.342 -4.725 188 HG2 GLU 104 2HG GLU 104 -7.562 -1.850 -4.620 189 HG3 GLU 104 1HG GLU 104 -7.367 -2.436 -2.968 190 H LEU 105 H LEU 105 -3.582 -4.359 -2.879 191 HA LEU 105 HA LEU 105 -1.269 -3.582 -4.323 192 HB2 LEU 105 2HB LEU 105 -1.492 -5.789 -2.284 193 HB3 LEU 105 1HB LEU 105 -0.037 -4.905 -2.736 194 HG LEU 105 HG LEU 105 -2.499 -3.758 -1.394 195 HD11 LEU 105 1HD1 LEU 105 -0.667 -3.246 0.370 196 HD12 LEU 105 2HD1 LEU 105 0.288 -4.458 -0.469 197 HD13 LEU 105 3HD1 LEU 105 -1.261 -4.896 0.250 198 HD21 LEU 105 3HD2 LEU 105 -0.042 -2.468 -2.586 199 HD22 LEU 105 1HD2 LEU 105 -0.864 -1.717 -1.221 200 HD23 LEU 105 2HD2 LEU 105 -1.731 -1.976 -2.726 201 H ARG 106 H ARG 106 -2.784 -6.821 -3.952 202 HA ARG 106 HA ARG 106 -0.958 -8.117 -5.641 203 HB2 ARG 106 2HB ARG 106 -2.773 -9.858 -5.848 204 HB3 ARG 106 1HB ARG 106 -2.331 -9.443 -4.194 205 HG2 ARG 106 2HG ARG 106 -4.246 -7.860 -4.112 206 HG3 ARG 106 1HG ARG 106 -4.719 -8.381 -5.728 207 HD2 ARG 106 2HD ARG 106 -4.873 -10.723 -4.869 208 HD3 ARG 106 1HD ARG 106 -4.559 -10.103 -3.248 209 HE ARG 106 HE ARG 106 -6.710 -8.643 -4.255 210 HH11 ARG 106 1HH2 ARG 106 -5.923 -11.926 -3.480 211 HH12 ARG 106 2HH2 ARG 106 -7.560 -12.374 -3.128 212 HH21 ARG 106 1HH1 ARG 106 -8.849 -9.230 -3.798 213 HH22 ARG 106 2HH1 ARG 106 -9.211 -10.852 -3.306 214 H HIS 107 H HIS 107 -4.142 -6.635 -6.372 215 HA HIS 107 HA HIS 107 -4.140 -7.383 -9.107 216 HB2 HIS 107 2HB HIS 107 -6.170 -6.771 -7.893 217 HB3 HIS 107 1HB HIS 107 -5.556 -5.135 -7.667 218 HD1 HIS 107 1HD HIS 107 -5.164 -7.017 -10.921 219 HD2 HIS 107 2HD HIS 107 -7.453 -3.911 -9.342 220 HE1 HIS 107 1HE HIS 107 -6.386 -5.960 -12.874 221 HE2 HIS 107 2HE HIS 107 -7.773 -4.056 -11.927 222 H VAL 108 H VAL 108 -3.384 -4.254 -7.533 223 HA VAL 108 HA VAL 108 -2.729 -2.918 -9.921 224 HB VAL 108 HB VAL 108 -3.157 -1.922 -7.582 225 HG11 VAL 108 1HG1 VAL 108 -1.290 -1.584 -6.149 226 HG12 VAL 108 2HG1 VAL 108 -0.159 -2.171 -7.364 227 HG13 VAL 108 3HG1 VAL 108 -1.256 -3.292 -6.576 228 HG21 VAL 108 3HG2 VAL 108 -0.950 -0.954 -9.411 229 HG22 VAL 108 1HG2 VAL 108 -1.618 0.024 -8.105 230 HG23 VAL 108 2HG2 VAL 108 -2.648 -0.485 -9.442 231 H MET 109 H MET 109 -0.599 -4.537 -7.565 232 HA MET 109 HA MET 109 1.819 -4.016 -8.878 233 HB2 MET 109 2HB MET 109 0.995 -6.360 -7.156 234 HB3 MET 109 1HB MET 109 2.649 -6.061 -7.681 235 HG2 MET 109 2HG MET 109 1.015 -3.978 -6.213 236 HG3 MET 109 1HG MET 109 2.032 -5.142 -5.373 237 HE1 MET 109 3HE MET 109 4.365 -4.796 -4.836 238 HE2 MET 109 1HE MET 109 3.515 -3.368 -4.230 239 HE3 MET 109 2HE MET 109 5.084 -3.197 -5.010 240 H THR 110 H THR 110 -0.423 -6.749 -9.204 241 HA THR 110 HA THR 110 1.075 -8.150 -11.155 242 HB THR 110 HB THR 110 -1.907 -8.149 -10.619 243 HG1 THR 110 1HG THR 110 -0.247 -10.228 -9.869 244 HG21 THR 110 3HG2 THR 110 -0.126 -10.053 -12.166 245 HG22 THR 110 1HG2 THR 110 -1.440 -9.075 -12.821 246 HG23 THR 110 2HG2 THR 110 -1.794 -10.400 -11.714 247 H ASN 111 H ASN 111 -1.529 -5.776 -11.363 248 HA ASN 111 HA ASN 111 -1.803 -5.753 -14.185 249 HB2 ASN 111 2HB ASN 111 -3.476 -4.795 -12.655 250 HB3 ASN 111 1HB ASN 111 -2.341 -3.531 -12.202 251 HD21 ASN 111 1HD2 ASN 111 -4.022 -1.988 -13.106 252 HD22 ASN 111 2HD2 ASN 111 -4.071 -1.737 -14.785 253 H LEU 112 H LEU 112 0.226 -3.989 -11.946 254 HA LEU 112 HA LEU 112 1.332 -2.122 -13.747 255 HB2 LEU 112 2HB LEU 112 2.192 -3.269 -11.101 256 HB3 LEU 112 1HB LEU 112 3.271 -2.192 -11.984 257 HG LEU 112 HG LEU 112 0.392 -1.443 -11.413 258 HD11 LEU 112 1HD1 LEU 112 1.236 -1.790 -9.230 259 HD12 LEU 112 2HD1 LEU 112 1.454 -0.064 -9.506 260 HD13 LEU 112 3HD1 LEU 112 2.829 -1.161 -9.649 261 HD21 LEU 112 3HD2 LEU 112 1.547 0.890 -11.498 262 HD22 LEU 112 1HD2 LEU 112 1.308 0.041 -13.019 263 HD23 LEU 112 2HD2 LEU 112 2.893 0.045 -12.252 264 H GLY 113 H GLY 113 2.150 -5.449 -12.917 265 HA2 GLY 113 2HA GLY 113 3.133 -6.731 -14.819 266 HA3 GLY 113 1HA GLY 113 4.276 -5.405 -15.002 267 H GLU 114 H GLU 114 3.957 -5.434 -11.820 268 HA GLU 114 HA GLU 114 6.301 -7.164 -11.425 269 HB2 GLU 114 2HB GLU 114 4.991 -5.041 -9.716 270 HB3 GLU 114 1HB GLU 114 6.343 -6.034 -9.168 271 HG2 GLU 114 2HG GLU 114 7.735 -5.225 -10.996 272 HG3 GLU 114 1HG GLU 114 6.379 -4.325 -11.673 273 H LYS 115 H LYS 115 5.737 -9.233 -11.109 274 HA LYS 115 HA LYS 115 3.343 -10.209 -10.035 275 HB2 LYS 115 2HB LYS 115 4.543 -12.340 -9.761 276 HB3 LYS 115 1HB LYS 115 4.890 -11.604 -11.325 277 HG2 LYS 115 2HG LYS 115 6.988 -10.651 -10.385 278 HG3 LYS 115 1HG LYS 115 6.653 -11.477 -8.860 279 HD2 LYS 115 2HD LYS 115 6.686 -13.650 -10.019 280 HD3 LYS 115 1HD LYS 115 7.008 -12.834 -11.550 281 HE2 LYS 115 2HE LYS 115 9.111 -11.925 -10.613 282 HE3 LYS 115 1HE LYS 115 8.795 -12.775 -9.099 283 HZ1 LYS 115 3HZ LYS 115 9.570 -13.852 -11.711 284 HZ2 LYS 115 1HZ LYS 115 8.578 -14.803 -10.717 285 HZ3 LYS 115 2HZ LYS 115 10.099 -14.292 -10.157 286 H LEU 116 H LEU 116 2.840 -11.139 -7.985 287 HA LEU 116 HA LEU 116 4.620 -10.654 -5.742 288 HB2 LEU 116 2HB LEU 116 2.718 -8.685 -6.421 289 HB3 LEU 116 1HB LEU 116 1.971 -9.560 -5.091 290 HG LEU 116 HG LEU 116 4.246 -9.300 -3.883 291 HD11 LEU 116 1HD1 LEU 116 4.561 -7.343 -6.172 292 HD12 LEU 116 2HD1 LEU 116 5.695 -8.572 -5.613 293 HD13 LEU 116 3HD1 LEU 116 5.406 -7.132 -4.640 294 HD21 LEU 116 3HD2 LEU 116 2.584 -8.060 -2.884 295 HD22 LEU 116 1HD2 LEU 116 2.145 -7.218 -4.366 296 HD23 LEU 116 2HD2 LEU 116 3.580 -6.732 -3.463 297 H THR 117 H THR 117 3.763 -11.635 -3.717 298 HA THR 117 HA THR 117 2.082 -13.983 -4.315 299 HB THR 117 HB THR 117 2.893 -14.603 -1.917 300 HG1 THR 117 1HG THR 117 4.610 -12.474 -2.640 301 HG21 THR 117 3HG2 THR 117 5.122 -15.339 -2.846 302 HG22 THR 117 1HG2 THR 117 4.753 -14.408 -4.298 303 HG23 THR 117 2HG2 THR 117 3.737 -15.776 -3.847 304 H ASP 118 H ASP 118 0.013 -13.949 -3.760 305 HA ASP 118 HA ASP 118 -1.278 -11.795 -2.535 306 HB2 ASP 118 2HB ASP 118 -2.181 -14.677 -2.730 307 HB3 ASP 118 1HB ASP 118 -3.220 -13.305 -2.354 308 H GLU 119 H GLU 119 -0.201 -14.894 -1.179 309 HA GLU 119 HA GLU 119 -1.295 -14.646 1.379 310 HB2 GLU 119 2HB GLU 119 1.281 -15.983 0.493 311 HB3 GLU 119 1HB GLU 119 0.514 -16.224 2.064 312 HG2 GLU 119 2HG GLU 119 -1.521 -17.050 0.963 313 HG3 GLU 119 1HG GLU 119 -0.785 -16.776 -0.614 314 H GLU 120 H GLU 120 1.612 -13.264 -0.031 315 HA GLU 120 HA GLU 120 2.617 -12.260 2.492 316 HB2 GLU 120 2HB GLU 120 3.389 -11.641 -0.366 317 HB3 GLU 120 1HB GLU 120 4.169 -10.919 1.039 318 HG2 GLU 120 2HG GLU 120 4.738 -13.180 1.874 319 HG3 GLU 120 1HG GLU 120 4.005 -13.885 0.433 320 H VAL 121 H VAL 121 0.782 -10.998 -0.257 321 HA VAL 121 HA VAL 121 0.714 -8.279 0.450 322 HB VAL 121 HB VAL 121 -1.238 -10.083 -0.976 323 HG11 VAL 121 1HG1 VAL 121 -2.677 -8.412 -0.092 324 HG12 VAL 121 2HG1 VAL 121 -2.313 -7.897 -1.735 325 HG13 VAL 121 3HG1 VAL 121 -1.491 -7.138 -0.372 326 HG21 VAL 121 3HG2 VAL 121 -0.460 -8.872 -2.943 327 HG22 VAL 121 1HG2 VAL 121 0.932 -9.493 -2.058 328 HG23 VAL 121 2HG2 VAL 121 0.492 -7.790 -1.930 329 H ASP 122 H ASP 122 -1.800 -10.707 1.053 330 HA ASP 122 HA ASP 122 -3.397 -9.239 2.780 331 HB2 ASP 122 2HB ASP 122 -3.947 -11.472 1.808 332 HB3 ASP 122 1HB ASP 122 -2.828 -12.211 2.948 333 H GLU 123 H GLU 123 -0.618 -11.341 3.583 334 HA GLU 123 HA GLU 123 -0.782 -10.860 6.392 335 HB2 GLU 123 2HB GLU 123 0.345 -12.835 5.408 336 HB3 GLU 123 1HB GLU 123 1.600 -11.775 4.770 337 HG2 GLU 123 2HG GLU 123 2.173 -11.048 7.047 338 HG3 GLU 123 1HG GLU 123 0.887 -12.057 7.704 339 H MET 124 H MET 124 0.996 -9.336 3.762 340 HA MET 124 HA MET 124 2.858 -7.819 5.148 341 HB2 MET 124 2HB MET 124 1.444 -7.540 2.546 342 HB3 MET 124 1HB MET 124 2.206 -6.079 3.150 343 HG2 MET 124 2HG MET 124 4.359 -7.187 3.267 344 HG3 MET 124 1HG MET 124 3.637 -8.740 2.856 345 HE1 MET 124 3HE MET 124 5.792 -8.360 1.573 346 HE2 MET 124 1HE MET 124 6.072 -6.757 0.881 347 HE3 MET 124 2HE MET 124 5.684 -8.117 -0.167 348 H ILE 125 H ILE 125 -0.208 -6.416 3.941 349 HA ILE 125 HA ILE 125 -0.095 -4.106 5.457 350 HB ILE 125 HB ILE 125 -2.405 -5.671 4.305 351 HG12 ILE 125 2HG1 ILE 125 -1.194 -2.943 3.685 352 HG13 ILE 125 1HG1 ILE 125 -0.929 -4.418 2.759 353 HG21 ILE 125 1HG2 ILE 125 -3.459 -4.685 6.179 354 HG22 ILE 125 2HG2 ILE 125 -3.753 -3.516 4.900 355 HG23 ILE 125 3HG2 ILE 125 -2.475 -3.234 6.073 356 HD11 ILE 125 3HD1 ILE 125 -3.431 -2.758 2.985 357 HD12 ILE 125 1HD1 ILE 125 -3.542 -4.467 2.575 358 HD13 ILE 125 2HD1 ILE 125 -2.639 -3.366 1.534 359 H ARG 126 H ARG 126 -1.462 -7.258 6.291 360 HA ARG 126 HA ARG 126 -2.744 -6.587 8.645 361 HB2 ARG 126 2HB ARG 126 -1.309 -9.091 7.795 362 HB3 ARG 126 1HB ARG 126 -2.204 -8.995 9.308 363 HG2 ARG 126 2HG ARG 126 -3.565 -8.115 6.764 364 HG3 ARG 126 1HG ARG 126 -3.399 -9.840 7.085 365 HD2 ARG 126 2HD ARG 126 -4.549 -7.929 9.122 366 HD3 ARG 126 1HD ARG 126 -5.543 -8.755 7.930 367 HE ARG 126 HE ARG 126 -3.969 -10.694 9.189 368 HH11 ARG 126 1HH2 ARG 126 -6.415 -8.380 9.940 369 HH12 ARG 126 2HH2 ARG 126 -7.098 -9.312 11.230 370 HH21 ARG 126 1HH1 ARG 126 -4.859 -11.934 10.866 371 HH22 ARG 126 2HH1 ARG 126 -6.217 -11.328 11.756 372 H GLU 127 H GLU 127 0.707 -7.278 8.142 373 HA GLU 127 HA GLU 127 1.280 -7.048 10.971 374 HB2 GLU 127 2HB GLU 127 3.065 -7.254 8.551 375 HB3 GLU 127 1HB GLU 127 3.669 -7.149 10.205 376 HG2 GLU 127 2HG GLU 127 2.436 -9.177 10.811 377 HG3 GLU 127 1HG GLU 127 1.751 -9.269 9.189 378 H ALA 128 H ALA 128 1.814 -5.041 8.094 379 HA ALA 128 HA ALA 128 3.126 -2.916 9.435 380 HB1 ALA 128 1HB ALA 128 2.194 -1.570 7.396 381 HB2 ALA 128 2HB ALA 128 1.652 -3.149 6.825 382 HB3 ALA 128 3HB ALA 128 3.367 -2.856 7.112 383 H ASP 129 H ASP 129 -0.282 -3.291 8.462 384 HA ASP 129 HA ASP 129 -1.387 -0.957 9.293 385 HB2 ASP 129 2HB ASP 129 -2.607 -2.928 8.330 386 HB3 ASP 129 1HB ASP 129 -2.602 -3.649 9.932 387 H ILE 130 H ILE 130 -1.611 0.136 11.131 388 HA ILE 130 HA ILE 130 -0.581 -1.037 13.617 389 HB ILE 130 HB ILE 130 -1.530 1.793 13.148 390 HG12 ILE 130 2HG1 ILE 130 0.206 1.177 11.499 391 HG13 ILE 130 1HG1 ILE 130 0.779 2.362 12.656 392 HG21 ILE 130 1HG2 ILE 130 -1.292 1.263 15.487 393 HG22 ILE 130 2HG2 ILE 130 0.120 2.209 15.019 394 HG23 ILE 130 3HG2 ILE 130 0.253 0.461 15.205 395 HD11 ILE 130 3HD1 ILE 130 1.825 0.428 13.953 396 HD12 ILE 130 1HD1 ILE 130 2.534 0.752 12.376 397 HD13 ILE 130 2HD1 ILE 130 1.423 -0.595 12.580 398 H ASP 131 H ASP 131 -3.579 0.122 12.221 399 HA ASP 131 HA ASP 131 -5.001 -0.222 14.779 400 HB2 ASP 131 2HB ASP 131 -5.368 1.799 13.322 401 HB3 ASP 131 1HB ASP 131 -6.078 0.731 12.117 402 H GLY 132 H GLY 132 -4.235 -2.015 11.994 403 HA2 GLY 132 2HA GLY 132 -4.951 -4.043 11.176 404 HA3 GLY 132 1HA GLY 132 -5.622 -4.317 12.782 405 H ASP 133 H ASP 133 -6.434 -1.864 10.336 406 HA ASP 133 HA ASP 133 -9.260 -2.743 10.470 407 HB2 ASP 133 2HB ASP 133 -9.804 -0.483 9.730 408 HB3 ASP 133 1HB ASP 133 -8.778 -0.418 11.162 409 H GLY 134 H GLY 134 -7.393 -4.154 8.853 410 HA2 GLY 134 2HA GLY 134 -7.151 -4.991 6.724 411 HA3 GLY 134 1HA GLY 134 -8.792 -4.415 6.468 412 H GLN 135 H GLN 135 -6.963 -1.803 7.348 413 HA GLN 135 HA GLN 135 -5.896 -1.239 4.698 414 HB2 GLN 135 2HB GLN 135 -8.062 0.459 5.949 415 HB3 GLN 135 1HB GLN 135 -7.151 0.877 4.499 416 HG2 GLN 135 2HG GLN 135 -7.962 -1.325 3.508 417 HG3 GLN 135 1HG GLN 135 -9.058 -1.439 4.879 418 HE21 GLN 135 1HE2 GLN 135 -11.104 -0.709 4.346 419 HE22 GLN 135 2HE2 GLN 135 -11.437 0.565 3.272 420 H VAL 136 H VAL 136 -4.617 0.730 4.655 421 HA VAL 136 HA VAL 136 -3.875 1.811 7.293 422 HB VAL 136 HB VAL 136 -1.640 1.201 7.196 423 HG11 VAL 136 1HG1 VAL 136 -3.025 -1.067 5.785 424 HG12 VAL 136 2HG1 VAL 136 -3.073 -0.776 7.523 425 HG13 VAL 136 3HG1 VAL 136 -1.548 -1.193 6.738 426 HG21 VAL 136 3HG2 VAL 136 -2.076 0.860 4.244 427 HG22 VAL 136 1HG2 VAL 136 -0.636 0.216 5.036 428 HG23 VAL 136 2HG2 VAL 136 -0.961 1.949 5.065 429 H ASN 137 H ASN 137 -2.865 3.815 7.236 430 HA ASN 137 HA ASN 137 -3.624 5.497 5.063 431 HB2 ASN 137 2HB ASN 137 -1.668 6.101 7.292 432 HB3 ASN 137 1HB ASN 137 -2.489 7.278 6.269 433 HD21 ASN 137 1HD2 ASN 137 -2.674 5.913 9.288 434 HD22 ASN 137 2HD2 ASN 137 -4.341 6.070 9.561 435 H TYR 138 H TYR 138 -1.240 7.170 4.974 436 HA TYR 138 HA TYR 138 0.125 5.764 2.849 437 HB2 TYR 138 2HB TYR 138 0.908 8.467 3.911 438 HB3 TYR 138 1HB TYR 138 1.014 7.850 2.262 439 HD1 TYR 138 1HD TYR 138 -1.555 6.769 1.635 440 HD2 TYR 138 2HD TYR 138 -0.634 10.224 4.011 441 HE1 TYR 138 1HE TYR 138 -3.797 7.705 1.138 442 HE2 TYR 138 2HE TYR 138 -2.878 11.163 3.516 443 HH TYR 138 HH TYR 138 -4.809 10.861 2.461 444 H GLU 139 H GLU 139 1.185 7.299 5.913 445 HA GLU 139 HA GLU 139 3.872 6.550 5.749 446 HB2 GLU 139 2HB GLU 139 2.110 7.031 8.144 447 HB3 GLU 139 1HB GLU 139 3.852 6.767 8.263 448 HG2 GLU 139 2HG GLU 139 4.273 8.664 6.785 449 HG3 GLU 139 1HG GLU 139 2.541 8.907 6.564 450 H GLU 140 H GLU 140 1.564 5.053 7.943 451 HA GLU 140 HA GLU 140 2.711 2.808 8.807 452 HB2 GLU 140 2HB GLU 140 -0.058 2.876 7.558 453 HB3 GLU 140 1HB GLU 140 0.539 1.581 8.593 454 HG2 GLU 140 2HG GLU 140 0.816 3.149 10.443 455 HG3 GLU 140 1HG GLU 140 0.323 4.489 9.420 456 H PHE 141 H PHE 141 1.880 3.465 5.523 457 HA PHE 141 HA PHE 141 2.518 0.787 4.552 458 HB2 PHE 141 2HB PHE 141 0.706 2.506 3.624 459 HB3 PHE 141 1HB PHE 141 2.072 3.143 2.729 460 HD1 PHE 141 1HD PHE 141 3.649 1.194 1.676 461 HD2 PHE 141 2HD PHE 141 -0.532 0.838 2.566 462 HE1 PHE 141 1HE PHE 141 3.463 -0.685 0.073 463 HE2 PHE 141 2HE PHE 141 -0.714 -1.037 0.988 464 HZ PHE 141 HZ PHE 141 1.278 -1.805 -0.274 465 H VAL 142 H VAL 142 3.637 4.133 3.927 466 HA VAL 142 HA VAL 142 5.757 3.873 2.311 467 HB VAL 142 HB VAL 142 5.668 5.469 4.874 468 HG11 VAL 142 1HG1 VAL 142 8.006 5.248 4.450 469 HG12 VAL 142 2HG1 VAL 142 7.547 6.803 3.757 470 HG13 VAL 142 3HG1 VAL 142 7.778 5.404 2.709 471 HG21 VAL 142 3HG2 VAL 142 5.574 6.464 2.028 472 HG22 VAL 142 1HG2 VAL 142 5.005 7.269 3.489 473 HG23 VAL 142 2HG2 VAL 142 4.115 5.896 2.830 474 H GLN 143 H GLN 143 6.194 3.520 5.849 475 HA GLN 143 HA GLN 143 8.759 2.615 5.943 476 HB2 GLN 143 2HB GLN 143 7.356 2.925 7.931 477 HB3 GLN 143 1HB GLN 143 6.430 1.484 7.511 478 HG2 GLN 143 2HG GLN 143 8.373 0.071 7.789 479 HG3 GLN 143 1HG GLN 143 9.420 1.474 7.999 480 HE21 GLN 143 1HE2 GLN 143 10.046 1.308 10.185 481 HE22 GLN 143 2HE2 GLN 143 8.949 1.206 11.476 482 H MET 144 H MET 144 6.044 0.298 5.915 483 HA MET 144 HA MET 144 7.400 -2.018 5.420 484 HB2 MET 144 2HB MET 144 4.843 -1.592 5.655 485 HB3 MET 144 1HB MET 144 4.856 -1.454 3.896 486 HG2 MET 144 2HG MET 144 4.410 -3.740 4.270 487 HG3 MET 144 1HG MET 144 6.138 -3.712 3.935 488 HE1 MET 144 3HE MET 144 4.620 -6.126 5.491 489 HE2 MET 144 1HE MET 144 3.458 -4.916 6.040 490 HE3 MET 144 2HE MET 144 4.356 -5.869 7.213 491 H MET 145 H MET 145 6.169 0.197 2.899 492 HA MET 145 HA MET 145 6.845 -0.954 0.575 493 HB2 MET 145 2HB MET 145 6.107 1.514 1.088 494 HB3 MET 145 1HB MET 145 7.830 1.864 1.002 495 HG2 MET 145 2HG MET 145 7.650 0.455 -1.265 496 HG3 MET 145 1HG MET 145 5.968 0.980 -1.172 497 HE1 MET 145 3HE MET 145 5.695 3.568 -0.026 498 HE2 MET 145 1HE MET 145 5.113 3.309 -1.677 499 HE3 MET 145 2HE MET 145 6.033 4.763 -1.283 500 H THR 146 H THR 146 8.561 -2.125 -0.012 501 HA THR 146 HA THR 146 11.215 -1.536 1.101 502 HB THR 146 HB THR 146 11.856 -3.680 0.370 503 HG1 THR 146 1HG THR 146 11.011 -4.633 -1.341 504 HG21 THR 146 3HG2 THR 146 10.239 -5.113 1.351 505 HG22 THR 146 1HG2 THR 146 8.904 -4.073 0.857 506 HG23 THR 146 2HG2 THR 146 9.994 -3.556 2.143 507 H ALA 147 H ALA 147 9.560 -1.710 -2.030 508 HA ALA 147 HA ALA 147 11.698 -1.288 -3.746 509 HB1 ALA 147 1HB ALA 147 10.084 -0.397 -5.322 510 HB2 ALA 147 2HB ALA 147 8.943 -0.063 -4.018 511 HB3 ALA 147 3HB ALA 147 9.337 -1.728 -4.439 512 H LYS 148 H LYS 148 13.098 0.343 -4.040 513 HA LYS 148 HA LYS 148 12.415 3.084 -3.857 514 HB2 LYS 148 2HB LYS 148 12.600 2.155 -1.368 515 HB3 LYS 148 1HB LYS 148 14.325 2.336 -1.660 516 HG2 LYS 148 2HG LYS 148 14.049 4.699 -2.162 517 HG3 LYS 148 1HG LYS 148 12.295 4.556 -2.082 518 HD2 LYS 148 2HD LYS 148 12.912 5.458 0.024 519 HD3 LYS 148 1HD LYS 148 12.628 3.748 0.337 520 HE2 LYS 148 2HE LYS 148 14.992 3.276 0.347 521 HE3 LYS 148 1HE LYS 148 15.375 4.891 -0.251 522 HZ1 LYS 148 3HZ LYS 148 13.910 4.509 2.284 523 HZ2 LYS 148 1HZ LYS 148 14.791 5.859 1.762 524 HZ3 LYS 148 2HZ LYS 148 15.607 4.446 2.238 Start of MODEL 19 1 H1 ASP 78 1HT ASP 78 5.322 23.015 1.954 2 H2 ASP 78 2HT ASP 78 6.936 23.078 2.486 3 H3 ASP 78 3HT ASP 78 6.087 21.607 2.504 4 HA ASP 78 HA ASP 78 5.943 22.540 -0.092 5 HB2 ASP 78 2HB ASP 78 7.807 24.042 0.529 6 HB3 ASP 78 1HB ASP 78 8.751 22.643 1.035 7 H THR 79 H THR 79 8.507 20.738 1.669 8 HA THR 79 HA THR 79 9.271 18.577 1.294 9 HB THR 79 HB THR 79 7.693 16.928 2.017 10 HG1 THR 79 1HG THR 79 5.484 18.564 1.869 11 HG21 THR 79 3HG2 THR 79 8.301 18.863 3.606 12 HG22 THR 79 1HG2 THR 79 6.897 17.886 4.032 13 HG23 THR 79 2HG2 THR 79 6.675 19.469 3.289 14 H ASP 80 H ASP 80 9.775 19.135 -0.998 15 HA ASP 80 HA ASP 80 7.927 18.336 -3.057 16 HB2 ASP 80 2HB ASP 80 9.685 18.899 -4.607 17 HB3 ASP 80 1HB ASP 80 9.632 20.135 -3.353 18 H SER 81 H SER 81 9.075 16.411 -0.935 19 HA SER 81 HA SER 81 9.871 14.257 -2.825 20 HB2 SER 81 2HB SER 81 11.302 13.343 -1.127 21 HB3 SER 81 1HB SER 81 11.705 15.049 -1.285 22 HG SER 81 HG SER 81 10.780 13.698 0.850 23 H GLU 82 H GLU 82 8.816 14.559 0.557 24 HA GLU 82 HA GLU 82 7.549 12.152 0.901 25 HB2 GLU 82 2HB GLU 82 7.875 13.880 2.660 26 HB3 GLU 82 1HB GLU 82 6.584 14.833 1.934 27 HG2 GLU 82 2HG GLU 82 4.962 13.086 2.373 28 HG3 GLU 82 1HG GLU 82 6.229 11.995 2.936 29 H GLU 83 H GLU 83 6.661 14.647 -1.244 30 HA GLU 83 HA GLU 83 3.860 14.313 -1.347 31 HB2 GLU 83 2HB GLU 83 3.987 15.557 -3.412 32 HB3 GLU 83 1HB GLU 83 5.127 16.252 -2.265 33 HG2 GLU 83 2HG GLU 83 6.874 14.684 -3.352 34 HG3 GLU 83 1HG GLU 83 5.701 14.507 -4.655 35 H GLU 84 H GLU 84 6.415 12.922 -3.495 36 HA GLU 84 HA GLU 84 4.789 11.453 -5.179 37 HB2 GLU 84 2HB GLU 84 7.269 11.531 -5.383 38 HB3 GLU 84 1HB GLU 84 7.400 10.487 -3.968 39 HG2 GLU 84 2HG GLU 84 6.179 8.710 -5.119 40 HG3 GLU 84 1HG GLU 84 5.927 9.754 -6.515 41 H ILE 85 H ILE 85 6.057 10.491 -1.999 42 HA ILE 85 HA ILE 85 4.896 7.958 -1.788 43 HB ILE 85 HB ILE 85 5.330 10.054 0.373 44 HG12 ILE 85 2HG1 ILE 85 7.039 7.688 -0.463 45 HG13 ILE 85 1HG1 ILE 85 7.372 9.365 -0.894 46 HG21 ILE 85 1HG2 ILE 85 5.012 7.058 0.657 47 HG22 ILE 85 2HG2 ILE 85 3.747 8.218 1.047 48 HG23 ILE 85 3HG2 ILE 85 5.248 8.216 1.955 49 HD11 ILE 85 3HD1 ILE 85 7.327 9.880 1.608 50 HD12 ILE 85 1HD1 ILE 85 8.695 8.915 1.050 51 HD13 ILE 85 2HD1 ILE 85 7.341 8.137 1.869 52 H ARG 86 H ARG 86 3.603 11.110 -0.726 53 HA ARG 86 HA ARG 86 1.116 10.240 0.185 54 HB2 ARG 86 2HB ARG 86 2.020 12.874 -0.997 55 HB3 ARG 86 1HB ARG 86 0.402 12.634 -0.334 56 HG2 ARG 86 2HG ARG 86 1.336 12.016 1.833 57 HG3 ARG 86 1HG ARG 86 2.971 12.106 1.192 58 HD2 ARG 86 2HD ARG 86 2.445 14.140 2.447 59 HD3 ARG 86 1HD ARG 86 2.647 14.520 0.740 60 HE ARG 86 HE ARG 86 -0.079 14.010 1.676 61 HH11 ARG 86 1HH2 ARG 86 2.397 16.265 0.755 62 HH12 ARG 86 2HH2 ARG 86 1.304 17.594 0.582 63 HH21 ARG 86 1HH1 ARG 86 -1.505 15.752 1.456 64 HH22 ARG 86 2HH1 ARG 86 -0.906 17.307 0.978 65 H GLU 87 H GLU 87 2.173 11.092 -3.086 66 HA GLU 87 HA GLU 87 -0.443 10.865 -4.253 67 HB2 GLU 87 2HB GLU 87 2.325 10.972 -5.454 68 HB3 GLU 87 1HB GLU 87 0.844 10.924 -6.412 69 HG2 GLU 87 2HG GLU 87 0.058 12.991 -5.399 70 HG3 GLU 87 1HG GLU 87 1.435 13.016 -4.298 71 H ALA 88 H ALA 88 2.469 8.960 -4.926 72 HA ALA 88 HA ALA 88 1.540 6.854 -6.316 73 HB1 ALA 88 1HB ALA 88 3.290 5.466 -5.314 74 HB2 ALA 88 2HB ALA 88 3.412 6.579 -3.950 75 HB3 ALA 88 3HB ALA 88 3.887 7.108 -5.563 76 H PHE 89 H PHE 89 1.451 6.944 -2.733 77 HA PHE 89 HA PHE 89 -0.011 4.537 -2.502 78 HB2 PHE 89 2HB PHE 89 0.639 6.790 -0.659 79 HB3 PHE 89 1HB PHE 89 -0.529 5.563 -0.151 80 HD1 PHE 89 1HD PHE 89 0.280 3.042 -0.762 81 HD2 PHE 89 2HD PHE 89 2.882 6.385 -0.095 82 HE1 PHE 89 1HE PHE 89 2.118 1.487 -0.230 83 HE2 PHE 89 2HE PHE 89 4.730 4.812 0.442 84 HZ PHE 89 HZ PHE 89 4.350 2.378 0.376 85 H ARG 90 H ARG 90 -1.023 7.955 -2.636 86 HA ARG 90 HA ARG 90 -3.764 7.507 -2.059 87 HB2 ARG 90 2HB ARG 90 -2.188 9.676 -3.337 88 HB3 ARG 90 1HB ARG 90 -3.928 9.689 -3.602 89 HG2 ARG 90 2HG ARG 90 -4.306 9.602 -1.164 90 HG3 ARG 90 1HG ARG 90 -2.566 9.588 -0.884 91 HD2 ARG 90 2HD ARG 90 -2.390 11.760 -2.014 92 HD3 ARG 90 1HD ARG 90 -4.131 11.782 -2.250 93 HE ARG 90 HE ARG 90 -3.537 11.418 0.502 94 HH11 ARG 90 1HH2 ARG 90 -3.440 13.791 -2.025 95 HH12 ARG 90 2HH2 ARG 90 -3.650 15.135 -0.952 96 HH21 ARG 90 1HH1 ARG 90 -3.765 13.190 1.910 97 HH22 ARG 90 2HH1 ARG 90 -3.823 14.799 1.269 98 H VAL 91 H VAL 91 -2.007 7.719 -5.141 99 HA VAL 91 HA VAL 91 -4.213 7.234 -6.840 100 HB VAL 91 HB VAL 91 -1.279 6.627 -7.306 101 HG11 VAL 91 1HG1 VAL 91 -3.641 6.957 -9.175 102 HG12 VAL 91 2HG1 VAL 91 -2.628 5.526 -8.977 103 HG13 VAL 91 3HG1 VAL 91 -1.961 6.984 -9.712 104 HG21 VAL 91 3HG2 VAL 91 -1.764 8.989 -6.652 105 HG22 VAL 91 1HG2 VAL 91 -2.903 9.095 -7.993 106 HG23 VAL 91 2HG2 VAL 91 -1.187 8.849 -8.312 107 H PHE 92 H PHE 92 -2.241 5.182 -4.886 108 HA PHE 92 HA PHE 92 -2.658 2.718 -6.235 109 HB2 PHE 92 2HB PHE 92 -1.544 3.625 -3.736 110 HB3 PHE 92 1HB PHE 92 -2.432 2.151 -3.451 111 HD1 PHE 92 2HD PHE 92 -0.354 3.457 -6.299 112 HD2 PHE 92 1HD PHE 92 -0.967 0.346 -3.405 113 HE1 PHE 92 2HE PHE 92 1.514 2.170 -7.292 114 HE2 PHE 92 1HE PHE 92 0.892 -0.945 -4.399 115 HZ PHE 92 HZ PHE 92 2.136 -0.035 -6.343 116 H ASP 93 H ASP 93 -4.414 4.134 -3.458 117 HA ASP 93 HA ASP 93 -6.301 2.116 -3.113 118 HB2 ASP 93 2HB ASP 93 -5.933 4.336 -1.789 119 HB3 ASP 93 1HB ASP 93 -7.074 5.025 -2.942 120 H LYS 94 H LYS 94 -6.818 1.236 -5.142 121 HA LYS 94 HA LYS 94 -7.729 2.596 -7.399 122 HB2 LYS 94 2HB LYS 94 -8.446 -0.141 -6.328 123 HB3 LYS 94 1HB LYS 94 -8.909 0.434 -7.929 124 HG2 LYS 94 2HG LYS 94 -6.584 0.701 -8.571 125 HG3 LYS 94 1HG LYS 94 -6.047 0.329 -6.935 126 HD2 LYS 94 2HD LYS 94 -5.753 -1.710 -8.097 127 HD3 LYS 94 1HD LYS 94 -7.278 -1.932 -7.248 128 HE2 LYS 94 2HE LYS 94 -8.537 -1.445 -9.249 129 HE3 LYS 94 1HE LYS 94 -7.081 -0.966 -10.114 130 HZ1 LYS 94 3HZ LYS 94 -7.425 -3.666 -8.964 131 HZ2 LYS 94 1HZ LYS 94 -6.294 -3.154 -10.119 132 HZ3 LYS 94 2HZ LYS 94 -7.936 -3.281 -10.537 133 H ASP 95 H ASP 95 -9.710 0.966 -4.937 134 HA ASP 95 HA ASP 95 -12.189 2.078 -5.801 135 HB2 ASP 95 2HB ASP 95 -11.294 0.712 -3.260 136 HB3 ASP 95 1HB ASP 95 -12.961 1.223 -3.530 137 H GLY 96 H GLY 96 -9.960 3.987 -5.193 138 HA2 GLY 96 2HA GLY 96 -9.500 5.870 -3.888 139 HA3 GLY 96 1HA GLY 96 -11.106 6.252 -4.496 140 H ASN 97 H ASN 97 -10.360 3.714 -2.130 141 HA ASN 97 HA ASN 97 -12.390 4.666 -0.364 142 HB2 ASN 97 2HB ASN 97 -10.221 2.602 0.109 143 HB3 ASN 97 1HB ASN 97 -11.595 2.893 1.170 144 HD21 ASN 97 1HD2 ASN 97 -13.477 3.363 -1.115 145 HD22 ASN 97 2HD2 ASN 97 -13.767 1.828 -1.782 146 H GLY 98 H GLY 98 -9.337 5.849 -0.912 147 HA2 GLY 98 2HA GLY 98 -8.240 7.605 0.182 148 HA3 GLY 98 1HA GLY 98 -9.394 7.454 1.504 149 H TYR 99 H TYR 99 -8.413 4.418 1.049 150 HA TYR 99 HA TYR 99 -5.862 4.581 2.492 151 HB2 TYR 99 2HB TYR 99 -8.231 3.056 3.562 152 HB3 TYR 99 1HB TYR 99 -6.609 3.099 4.252 153 HD1 TYR 99 1HD TYR 99 -5.714 5.237 5.195 154 HD2 TYR 99 2HD TYR 99 -9.786 4.857 3.896 155 HE1 TYR 99 1HE TYR 99 -6.302 7.298 6.443 156 HE2 TYR 99 2HE TYR 99 -10.377 6.917 5.143 157 HH TYR 99 HH TYR 99 -9.663 8.484 6.541 158 H ILE 100 H ILE 100 -4.618 2.677 2.298 159 HA ILE 100 HA ILE 100 -5.177 1.225 -0.114 160 HB ILE 100 HB ILE 100 -2.903 1.132 1.872 161 HG12 ILE 100 2HG1 ILE 100 -1.678 2.177 0.022 162 HG13 ILE 100 1HG1 ILE 100 -3.117 2.110 -0.985 163 HG21 ILE 100 1HG2 ILE 100 -1.817 -0.136 -0.150 164 HG22 ILE 100 2HG2 ILE 100 -3.474 -0.562 -0.549 165 HG23 ILE 100 3HG2 ILE 100 -2.794 -1.032 1.008 166 HD11 ILE 100 3HD1 ILE 100 -2.530 4.327 0.227 167 HD12 ILE 100 1HD1 ILE 100 -3.179 3.511 1.650 168 HD13 ILE 100 2HD1 ILE 100 -4.201 3.764 0.232 169 H SER 101 H SER 101 -6.137 -0.722 -0.366 170 HA SER 101 HA SER 101 -6.385 -2.473 2.005 171 HB2 SER 101 2HB SER 101 -8.552 -1.956 1.161 172 HB3 SER 101 1HB SER 101 -8.047 -2.243 -0.503 173 HG SER 101 HG SER 101 -7.479 -4.446 0.414 174 H ALA 102 H ALA 102 -6.128 -4.760 1.608 175 HA ALA 102 HA ALA 102 -3.767 -5.391 0.230 176 HB1 ALA 102 1HB ALA 102 -5.328 -6.602 2.150 177 HB2 ALA 102 2HB ALA 102 -3.934 -7.352 1.381 178 HB3 ALA 102 3HB ALA 102 -5.555 -7.682 0.776 179 H ALA 103 H ALA 103 -7.142 -5.859 -0.701 180 HA ALA 103 HA ALA 103 -6.714 -7.503 -2.910 181 HB1 ALA 103 1HB ALA 103 -8.927 -7.157 -2.008 182 HB2 ALA 103 2HB ALA 103 -8.921 -6.619 -3.687 183 HB3 ALA 103 3HB ALA 103 -8.860 -5.436 -2.380 184 H GLU 104 H GLU 104 -6.484 -3.987 -2.596 185 HA GLU 104 HA GLU 104 -6.336 -3.440 -5.385 186 HB2 GLU 104 2HB GLU 104 -5.226 -1.805 -3.083 187 HB3 GLU 104 1HB GLU 104 -5.638 -1.224 -4.701 188 HG2 GLU 104 2HG GLU 104 -7.987 -1.725 -4.343 189 HG3 GLU 104 1HG GLU 104 -7.625 -2.475 -2.790 190 H LEU 105 H LEU 105 -3.925 -4.200 -2.900 191 HA LEU 105 HA LEU 105 -1.628 -3.455 -4.358 192 HB2 LEU 105 2HB LEU 105 -1.928 -5.622 -2.270 193 HB3 LEU 105 1HB LEU 105 -0.410 -4.897 -2.795 194 HG LEU 105 HG LEU 105 -2.708 -3.419 -1.478 195 HD11 LEU 105 1HD1 LEU 105 -1.128 -3.169 0.407 196 HD12 LEU 105 2HD1 LEU 105 0.045 -4.166 -0.452 197 HD13 LEU 105 3HD1 LEU 105 -1.479 -4.867 0.090 198 HD21 LEU 105 3HD2 LEU 105 -1.715 -1.762 -2.753 199 HD22 LEU 105 1HD2 LEU 105 -0.140 -2.542 -2.758 200 HD23 LEU 105 2HD2 LEU 105 -0.688 -1.686 -1.329 201 H ARG 106 H ARG 106 -3.091 -6.691 -3.953 202 HA ARG 106 HA ARG 106 -1.326 -7.994 -5.714 203 HB2 ARG 106 2HB ARG 106 -3.016 -9.789 -5.787 204 HB3 ARG 106 1HB ARG 106 -2.736 -9.234 -4.140 205 HG2 ARG 106 2HG ARG 106 -4.758 -7.752 -4.384 206 HG3 ARG 106 1HG ARG 106 -5.074 -8.522 -5.937 207 HD2 ARG 106 2HD ARG 106 -5.138 -10.730 -4.788 208 HD3 ARG 106 1HD ARG 106 -4.941 -9.893 -3.249 209 HE ARG 106 HE ARG 106 -7.155 -8.871 -4.750 210 HH11 ARG 106 1HH2 ARG 106 -6.088 -11.416 -2.629 211 HH12 ARG 106 2HH2 ARG 106 -7.686 -11.797 -2.079 212 HH21 ARG 106 1HH1 ARG 106 -9.229 -9.374 -4.024 213 HH22 ARG 106 2HH1 ARG 106 -9.463 -10.644 -2.871 214 H HIS 107 H HIS 107 -4.559 -6.579 -6.302 215 HA HIS 107 HA HIS 107 -4.699 -7.283 -9.025 216 HB2 HIS 107 2HB HIS 107 -5.991 -5.100 -7.394 217 HB3 HIS 107 1HB HIS 107 -6.347 -5.325 -9.105 218 HD1 HIS 107 1HD HIS 107 -6.261 -8.512 -9.016 219 HD2 HIS 107 2HD HIS 107 -8.458 -6.070 -6.448 220 HE1 HIS 107 1HE HIS 107 -8.183 -9.922 -8.150 221 HE2 HIS 107 2HE HIS 107 -9.525 -8.447 -6.579 222 H VAL 108 H VAL 108 -3.764 -4.182 -7.521 223 HA VAL 108 HA VAL 108 -3.110 -2.919 -9.953 224 HB VAL 108 HB VAL 108 -3.473 -1.851 -7.628 225 HG11 VAL 108 1HG1 VAL 108 -1.618 -3.231 -6.612 226 HG12 VAL 108 2HG1 VAL 108 -1.545 -1.517 -6.253 227 HG13 VAL 108 3HG1 VAL 108 -0.473 -2.216 -7.469 228 HG21 VAL 108 3HG2 VAL 108 -1.164 -0.938 -9.367 229 HG22 VAL 108 1HG2 VAL 108 -2.070 0.075 -8.242 230 HG23 VAL 108 2HG2 VAL 108 -2.867 -0.593 -9.666 231 H MET 109 H MET 109 -1.024 -4.574 -7.583 232 HA MET 109 HA MET 109 1.420 -4.187 -8.861 233 HB2 MET 109 2HB MET 109 0.409 -6.520 -7.216 234 HB3 MET 109 1HB MET 109 2.082 -6.324 -7.722 235 HG2 MET 109 2HG MET 109 2.438 -4.496 -6.323 236 HG3 MET 109 1HG MET 109 0.747 -4.041 -6.314 237 HE1 MET 109 3HE MET 109 2.085 -4.990 -2.649 238 HE2 MET 109 1HE MET 109 1.652 -3.650 -3.718 239 HE3 MET 109 2HE MET 109 3.134 -4.555 -3.996 240 H THR 110 H THR 110 -0.912 -6.862 -9.229 241 HA THR 110 HA THR 110 0.519 -8.224 -11.261 242 HB THR 110 HB THR 110 -2.447 -8.194 -10.645 243 HG1 THR 110 1HG THR 110 -0.218 -9.523 -9.666 244 HG21 THR 110 3HG2 THR 110 -2.101 -9.026 -12.906 245 HG22 THR 110 1HG2 THR 110 -2.406 -10.406 -11.850 246 HG23 THR 110 2HG2 THR 110 -0.761 -10.037 -12.366 247 H ASN 111 H ASN 111 -2.062 -5.807 -11.362 248 HA ASN 111 HA ASN 111 -2.404 -5.722 -14.159 249 HB2 ASN 111 2HB ASN 111 -3.946 -4.689 -12.516 250 HB3 ASN 111 1HB ASN 111 -2.734 -3.459 -12.180 251 HD21 ASN 111 1HD2 ASN 111 -5.499 -3.254 -13.494 252 HD22 ASN 111 2HD2 ASN 111 -5.204 -2.450 -14.961 253 H LEU 112 H LEU 112 -0.239 -4.003 -12.000 254 HA LEU 112 HA LEU 112 0.888 -2.221 -13.847 255 HB2 LEU 112 2HB LEU 112 1.818 -3.411 -11.241 256 HB3 LEU 112 1HB LEU 112 2.891 -2.368 -12.169 257 HG LEU 112 HG LEU 112 0.069 -1.546 -11.425 258 HD11 LEU 112 1HD1 LEU 112 1.165 -1.916 -9.322 259 HD12 LEU 112 2HD1 LEU 112 1.233 -0.180 -9.623 260 HD13 LEU 112 3HD1 LEU 112 2.660 -1.179 -9.902 261 HD21 LEU 112 3HD2 LEU 112 2.507 -0.167 -12.575 262 HD22 LEU 112 1HD2 LEU 112 1.331 0.763 -11.650 263 HD23 LEU 112 2HD2 LEU 112 0.832 -0.081 -13.105 264 H GLY 113 H GLY 113 1.655 -5.541 -12.990 265 HA2 GLY 113 2HA GLY 113 2.505 -6.777 -15.071 266 HA3 GLY 113 1HA GLY 113 3.795 -5.577 -15.058 267 H GLU 114 H GLU 114 3.120 -5.966 -11.902 268 HA GLU 114 HA GLU 114 5.199 -8.070 -11.572 269 HB2 GLU 114 2HB GLU 114 4.419 -5.754 -9.783 270 HB3 GLU 114 1HB GLU 114 5.603 -6.994 -9.367 271 HG2 GLU 114 2HG GLU 114 6.969 -6.387 -11.306 272 HG3 GLU 114 1HG GLU 114 5.768 -5.193 -11.801 273 H LYS 115 H LYS 115 4.076 -9.945 -11.332 274 HA LYS 115 HA LYS 115 1.676 -10.052 -9.673 275 HB2 LYS 115 2HB LYS 115 1.844 -11.320 -11.811 276 HB3 LYS 115 1HB LYS 115 3.129 -12.292 -11.097 277 HG2 LYS 115 2HG LYS 115 1.619 -13.085 -9.353 278 HG3 LYS 115 1HG LYS 115 0.334 -12.033 -9.948 279 HD2 LYS 115 2HD LYS 115 0.352 -13.247 -12.107 280 HD3 LYS 115 1HD LYS 115 1.616 -14.311 -11.491 281 HE2 LYS 115 2HE LYS 115 0.115 -15.104 -9.719 282 HE3 LYS 115 1HE LYS 115 -1.144 -14.002 -10.270 283 HZ1 LYS 115 3HZ LYS 115 -1.558 -16.156 -11.177 284 HZ2 LYS 115 1HZ LYS 115 0.023 -16.274 -11.783 285 HZ3 LYS 115 2HZ LYS 115 -1.058 -15.141 -12.444 286 H LEU 116 H LEU 116 2.379 -9.661 -7.593 287 HA LEU 116 HA LEU 116 4.549 -11.116 -6.373 288 HB2 LEU 116 2HB LEU 116 2.420 -9.600 -4.873 289 HB3 LEU 116 1HB LEU 116 4.108 -9.863 -4.433 290 HG LEU 116 HG LEU 116 3.024 -8.092 -6.617 291 HD11 LEU 116 1HD1 LEU 116 3.212 -7.379 -4.118 292 HD12 LEU 116 2HD1 LEU 116 3.882 -6.303 -5.348 293 HD13 LEU 116 3HD1 LEU 116 4.952 -7.350 -4.418 294 HD21 LEU 116 3HD2 LEU 116 4.946 -9.104 -7.606 295 HD22 LEU 116 1HD2 LEU 116 5.847 -9.022 -6.092 296 HD23 LEU 116 2HD2 LEU 116 5.486 -7.544 -6.986 297 H THR 117 H THR 117 3.595 -11.811 -3.893 298 HA THR 117 HA THR 117 1.848 -14.126 -4.532 299 HB THR 117 HB THR 117 2.707 -14.972 -2.295 300 HG1 THR 117 1HG THR 117 4.847 -13.234 -2.594 301 HG21 THR 117 3HG2 THR 117 4.600 -14.440 -4.596 302 HG22 THR 117 1HG2 THR 117 3.626 -15.886 -4.323 303 HG23 THR 117 2HG2 THR 117 4.983 -15.522 -3.256 304 H ASP 118 H ASP 118 -0.210 -14.032 -3.901 305 HA ASP 118 HA ASP 118 -1.434 -11.919 -2.596 306 HB2 ASP 118 2HB ASP 118 -2.179 -14.805 -3.010 307 HB3 ASP 118 1HB ASP 118 -3.205 -13.796 -1.992 308 H GLU 119 H GLU 119 0.019 -14.826 -1.224 309 HA GLU 119 HA GLU 119 -0.928 -14.521 1.421 310 HB2 GLU 119 2HB GLU 119 1.630 -15.807 0.408 311 HB3 GLU 119 1HB GLU 119 0.959 -16.015 2.028 312 HG2 GLU 119 2HG GLU 119 -1.092 -16.981 1.072 313 HG3 GLU 119 1HG GLU 119 -0.466 -16.725 -0.555 314 H GLU 120 H GLU 120 1.766 -13.075 -0.324 315 HA GLU 120 HA GLU 120 2.994 -11.933 2.034 316 HB2 GLU 120 2HB GLU 120 4.290 -12.410 -0.033 317 HB3 GLU 120 1HB GLU 120 3.362 -11.170 -0.874 318 HG2 GLU 120 2HG GLU 120 4.197 -9.455 0.611 319 HG3 GLU 120 1HG GLU 120 4.995 -10.653 1.629 320 H VAL 121 H VAL 121 1.003 -10.706 -0.645 321 HA VAL 121 HA VAL 121 0.763 -8.040 0.086 322 HB VAL 121 HB VAL 121 -1.159 -9.976 -1.219 323 HG11 VAL 121 1HG1 VAL 121 -2.473 -7.837 -1.821 324 HG12 VAL 121 2HG1 VAL 121 -1.638 -7.103 -0.453 325 HG13 VAL 121 3HG1 VAL 121 -2.685 -8.492 -0.199 326 HG21 VAL 121 3HG2 VAL 121 -0.701 -8.540 -3.190 327 HG22 VAL 121 1HG2 VAL 121 0.787 -9.218 -2.527 328 HG23 VAL 121 2HG2 VAL 121 0.362 -7.539 -2.201 329 H ASP 122 H ASP 122 -1.736 -10.465 0.799 330 HA ASP 122 HA ASP 122 -3.195 -9.138 2.686 331 HB2 ASP 122 2HB ASP 122 -3.686 -11.408 1.788 332 HB3 ASP 122 1HB ASP 122 -2.404 -12.059 2.801 333 H GLU 123 H GLU 123 -0.182 -10.976 3.257 334 HA GLU 123 HA GLU 123 -0.153 -10.551 6.067 335 HB2 GLU 123 2HB GLU 123 1.944 -11.355 4.058 336 HB3 GLU 123 1HB GLU 123 2.353 -11.095 5.756 337 HG2 GLU 123 2HG GLU 123 0.134 -12.944 4.848 338 HG3 GLU 123 1HG GLU 123 1.784 -13.488 5.149 339 H MET 124 H MET 124 1.207 -8.739 3.334 340 HA MET 124 HA MET 124 2.922 -7.017 4.634 341 HB2 MET 124 2HB MET 124 1.192 -6.740 2.191 342 HB3 MET 124 1HB MET 124 2.092 -5.355 2.757 343 HG2 MET 124 2HG MET 124 3.354 -8.047 2.238 344 HG3 MET 124 1HG MET 124 3.261 -6.777 1.020 345 HE1 MET 124 3HE MET 124 5.417 -4.856 0.922 346 HE2 MET 124 1HE MET 124 5.087 -3.868 2.347 347 HE3 MET 124 2HE MET 124 3.755 -4.519 1.397 348 H ILE 125 H ILE 125 -0.340 -6.000 3.643 349 HA ILE 125 HA ILE 125 -0.468 -3.727 5.226 350 HB ILE 125 HB ILE 125 -2.593 -5.592 4.175 351 HG12 ILE 125 2HG1 ILE 125 -1.908 -2.705 3.527 352 HG13 ILE 125 1HG1 ILE 125 -1.322 -4.095 2.612 353 HG21 ILE 125 1HG2 ILE 125 -3.855 -4.774 5.954 354 HG22 ILE 125 2HG2 ILE 125 -4.113 -3.438 4.834 355 HG23 ILE 125 3HG2 ILE 125 -2.902 -3.315 6.099 356 HD11 ILE 125 3HD1 ILE 125 -3.232 -3.453 1.392 357 HD12 ILE 125 1HD1 ILE 125 -4.123 -3.019 2.849 358 HD13 ILE 125 2HD1 ILE 125 -3.871 -4.716 2.447 359 H ARG 126 H ARG 126 -1.439 -7.042 6.023 360 HA ARG 126 HA ARG 126 -2.590 -6.636 8.491 361 HB2 ARG 126 2HB ARG 126 -0.945 -8.888 7.381 362 HB3 ARG 126 1HB ARG 126 -1.639 -8.990 8.994 363 HG2 ARG 126 2HG ARG 126 -3.406 -8.202 6.676 364 HG3 ARG 126 1HG ARG 126 -3.003 -9.903 6.907 365 HD2 ARG 126 2HD ARG 126 -3.896 -9.852 9.174 366 HD3 ARG 126 1HD ARG 126 -4.194 -8.126 9.063 367 HE ARG 126 HE ARG 126 -6.054 -8.550 7.717 368 HH11 ARG 126 1HH2 ARG 126 -4.153 -11.374 8.296 369 HH12 ARG 126 2HH2 ARG 126 -5.354 -12.476 7.709 370 HH21 ARG 126 1HH1 ARG 126 -7.632 -9.976 6.915 371 HH22 ARG 126 2HH1 ARG 126 -7.329 -11.682 6.921 372 H GLU 127 H GLU 127 0.878 -6.908 7.742 373 HA GLU 127 HA GLU 127 1.594 -6.631 10.530 374 HB2 GLU 127 2HB GLU 127 3.267 -6.644 8.017 375 HB3 GLU 127 1HB GLU 127 3.928 -6.546 9.648 376 HG2 GLU 127 2HG GLU 127 2.880 -8.696 10.225 377 HG3 GLU 127 1HG GLU 127 2.169 -8.791 8.615 378 H ALA 128 H ALA 128 1.542 -4.568 7.665 379 HA ALA 128 HA ALA 128 2.823 -2.328 8.850 380 HB1 ALA 128 1HB ALA 128 2.598 -1.481 6.742 381 HB2 ALA 128 2HB ALA 128 0.840 -1.608 6.798 382 HB3 ALA 128 3HB ALA 128 1.807 -2.994 6.320 383 H ASP 129 H ASP 129 -0.634 -2.912 8.205 384 HA ASP 129 HA ASP 129 -1.759 -0.680 9.348 385 HB2 ASP 129 2HB ASP 129 -2.966 -2.581 8.221 386 HB3 ASP 129 1HB ASP 129 -2.851 -3.471 9.730 387 H ILE 130 H ILE 130 -2.016 0.136 11.323 388 HA ILE 130 HA ILE 130 -0.706 -1.247 13.565 389 HB ILE 130 HB ILE 130 -1.808 1.576 13.360 390 HG12 ILE 130 2HG1 ILE 130 1.021 0.530 13.322 391 HG13 ILE 130 1HG1 ILE 130 0.151 1.083 11.901 392 HG21 ILE 130 1HG2 ILE 130 -1.788 0.760 15.693 393 HG22 ILE 130 2HG2 ILE 130 -0.478 1.907 15.465 394 HG23 ILE 130 3HG2 ILE 130 -0.136 0.179 15.492 395 HD11 ILE 130 3HD1 ILE 130 -0.129 3.314 12.938 396 HD12 ILE 130 1HD1 ILE 130 1.576 2.896 12.775 397 HD13 ILE 130 2HD1 ILE 130 0.784 2.772 14.345 398 H ASP 131 H ASP 131 -3.848 -0.466 12.401 399 HA ASP 131 HA ASP 131 -5.094 -1.295 14.973 400 HB2 ASP 131 2HB ASP 131 -6.151 0.416 12.717 401 HB3 ASP 131 1HB ASP 131 -7.136 -0.159 14.061 402 H GLY 132 H GLY 132 -4.308 -2.442 11.950 403 HA2 GLY 132 2HA GLY 132 -4.993 -4.213 10.670 404 HA3 GLY 132 1HA GLY 132 -5.639 -4.873 12.171 405 H ASP 133 H ASP 133 -6.479 -2.103 10.096 406 HA ASP 133 HA ASP 133 -9.310 -3.012 10.094 407 HB2 ASP 133 2HB ASP 133 -9.852 -0.619 9.742 408 HB3 ASP 133 1HB ASP 133 -9.001 -0.903 11.260 409 H GLY 134 H GLY 134 -7.259 -3.924 8.237 410 HA2 GLY 134 2HA GLY 134 -6.859 -4.136 5.968 411 HA3 GLY 134 1HA GLY 134 -8.601 -3.929 5.839 412 H GLN 135 H GLN 135 -7.243 -1.190 7.238 413 HA GLN 135 HA GLN 135 -6.979 0.181 4.618 414 HB2 GLN 135 2HB GLN 135 -8.359 1.180 7.136 415 HB3 GLN 135 1HB GLN 135 -8.070 2.145 5.697 416 HG2 GLN 135 2HG GLN 135 -9.555 -0.475 5.551 417 HG3 GLN 135 1HG GLN 135 -10.387 1.034 5.910 418 HE21 GLN 135 1HE2 GLN 135 -10.934 2.361 4.136 419 HE22 GLN 135 2HE2 GLN 135 -10.425 2.069 2.543 420 H VAL 136 H VAL 136 -4.935 0.744 4.385 421 HA VAL 136 HA VAL 136 -3.444 1.655 6.813 422 HB VAL 136 HB VAL 136 -2.437 0.411 4.232 423 HG11 VAL 136 1HG1 VAL 136 -0.972 1.624 6.575 424 HG12 VAL 136 2HG1 VAL 136 -0.894 2.139 4.899 425 HG13 VAL 136 3HG1 VAL 136 -0.198 0.599 5.375 426 HG21 VAL 136 3HG2 VAL 136 -2.070 -0.510 7.086 427 HG22 VAL 136 1HG2 VAL 136 -1.718 -1.401 5.608 428 HG23 VAL 136 2HG2 VAL 136 -3.391 -1.077 6.072 429 H ASN 137 H ASN 137 -2.693 3.638 6.866 430 HA ASN 137 HA ASN 137 -3.441 5.538 4.839 431 HB2 ASN 137 2HB ASN 137 -1.551 5.923 7.160 432 HB3 ASN 137 1HB ASN 137 -2.379 7.188 6.251 433 HD21 ASN 137 1HD2 ASN 137 -2.951 7.352 8.866 434 HD22 ASN 137 2HD2 ASN 137 -4.464 6.681 9.242 435 H TYR 138 H TYR 138 -0.994 7.153 5.068 436 HA TYR 138 HA TYR 138 0.503 5.898 2.884 437 HB2 TYR 138 2HB TYR 138 1.174 8.574 4.083 438 HB3 TYR 138 1HB TYR 138 1.314 8.038 2.407 439 HD1 TYR 138 1HD TYR 138 -1.269 6.896 1.773 440 HD2 TYR 138 2HD TYR 138 -0.350 10.344 4.158 441 HE1 TYR 138 1HE TYR 138 -3.533 7.831 1.287 442 HE2 TYR 138 2HE TYR 138 -2.599 11.283 3.671 443 HH TYR 138 HH TYR 138 -4.582 10.906 2.743 444 H GLU 139 H GLU 139 1.386 7.456 6.022 445 HA GLU 139 HA GLU 139 4.049 6.592 6.040 446 HB2 GLU 139 2HB GLU 139 2.216 7.212 8.356 447 HB3 GLU 139 1HB GLU 139 3.972 7.067 8.468 448 HG2 GLU 139 2HG GLU 139 2.530 9.008 6.640 449 HG3 GLU 139 1HG GLU 139 3.201 9.439 8.212 450 H GLU 140 H GLU 140 1.501 5.332 8.165 451 HA GLU 140 HA GLU 140 2.460 3.062 9.233 452 HB2 GLU 140 2HB GLU 140 -0.138 3.394 7.746 453 HB3 GLU 140 1HB GLU 140 0.233 1.901 8.606 454 HG2 GLU 140 2HG GLU 140 0.429 3.114 10.686 455 HG3 GLU 140 1HG GLU 140 0.240 4.656 9.869 456 H PHE 141 H PHE 141 1.888 3.569 5.797 457 HA PHE 141 HA PHE 141 2.587 0.853 5.051 458 HB2 PHE 141 2HB PHE 141 1.007 2.659 3.850 459 HB3 PHE 141 1HB PHE 141 2.501 3.079 3.038 460 HD1 PHE 141 1HD PHE 141 3.934 0.997 2.210 461 HD2 PHE 141 2HD PHE 141 -0.295 0.943 2.945 462 HE1 PHE 141 1HE PHE 141 3.694 -0.995 0.735 463 HE2 PHE 141 2HE PHE 141 -0.534 -1.020 1.489 464 HZ PHE 141 HZ PHE 141 1.455 -2.005 0.370 465 H VAL 142 H VAL 142 3.971 4.114 4.472 466 HA VAL 142 HA VAL 142 6.304 3.597 3.176 467 HB VAL 142 HB VAL 142 5.930 5.409 5.562 468 HG11 VAL 142 1HG1 VAL 142 8.202 5.150 3.599 469 HG12 VAL 142 2HG1 VAL 142 8.283 5.100 5.361 470 HG13 VAL 142 3HG1 VAL 142 7.919 6.617 4.535 471 HG21 VAL 142 3HG2 VAL 142 6.131 6.219 2.665 472 HG22 VAL 142 1HG2 VAL 142 5.350 7.074 3.995 473 HG23 VAL 142 2HG2 VAL 142 4.592 5.642 3.296 474 H GLN 143 H GLN 143 6.213 3.715 6.757 475 HA GLN 143 HA GLN 143 8.647 2.625 7.356 476 HB2 GLN 143 2HB GLN 143 6.813 3.414 8.959 477 HB3 GLN 143 1HB GLN 143 6.154 1.786 8.836 478 HG2 GLN 143 2HG GLN 143 7.588 1.871 10.781 479 HG3 GLN 143 1HG GLN 143 8.395 0.897 9.559 480 HE21 GLN 143 1HE2 GLN 143 10.603 1.354 9.784 481 HE22 GLN 143 2HE2 GLN 143 11.257 2.919 9.874 482 H MET 144 H MET 144 6.169 1.075 5.656 483 HA MET 144 HA MET 144 7.227 -1.615 6.225 484 HB2 MET 144 2HB MET 144 4.612 -0.687 5.923 485 HB3 MET 144 1HB MET 144 4.922 -1.491 4.388 486 HG2 MET 144 2HG MET 144 5.235 -2.674 7.161 487 HG3 MET 144 1HG MET 144 4.051 -3.130 5.943 488 HE1 MET 144 3HE MET 144 6.429 -6.097 6.456 489 HE2 MET 144 1HE MET 144 4.884 -5.926 5.616 490 HE3 MET 144 2HE MET 144 5.131 -5.147 7.179 491 H MET 145 H MET 145 6.327 0.421 3.420 492 HA MET 145 HA MET 145 7.460 -1.275 1.470 493 HB2 MET 145 2HB MET 145 5.841 0.418 0.849 494 HB3 MET 145 1HB MET 145 6.905 1.696 1.434 495 HG2 MET 145 2HG MET 145 8.517 1.263 -0.295 496 HG3 MET 145 1HG MET 145 7.692 -0.221 -0.774 497 HE1 MET 145 3HE MET 145 8.154 3.459 -1.223 498 HE2 MET 145 1HE MET 145 6.884 3.525 0.006 499 HE3 MET 145 2HE MET 145 6.572 4.126 -1.622 500 H THR 146 H THR 146 9.414 -1.068 0.285 501 HA THR 146 HA THR 146 11.597 0.302 1.773 502 HB THR 146 HB THR 146 13.096 -1.404 0.831 503 HG1 THR 146 1HG THR 146 10.666 -2.376 -0.246 504 HG21 THR 146 3HG2 THR 146 12.158 -1.839 3.021 505 HG22 THR 146 1HG2 THR 146 12.168 -3.350 2.115 506 HG23 THR 146 2HG2 THR 146 10.665 -2.448 2.307 507 H ALA 147 H ALA 147 9.814 0.253 -1.098 508 HA ALA 147 HA ALA 147 11.731 1.000 -3.025 509 HB1 ALA 147 1HB ALA 147 8.894 2.027 -2.983 510 HB2 ALA 147 2HB ALA 147 9.258 0.339 -3.337 511 HB3 ALA 147 3HB ALA 147 9.892 1.612 -4.378 512 H LYS 148 H LYS 148 12.414 3.046 -3.762 513 HA LYS 148 HA LYS 148 13.013 4.994 -1.891 514 HB2 LYS 148 2HB LYS 148 14.068 4.845 -4.121 515 HB3 LYS 148 1HB LYS 148 12.567 5.385 -4.868 516 HG2 LYS 148 2HG LYS 148 12.720 7.532 -3.685 517 HG3 LYS 148 1HG LYS 148 14.177 6.993 -2.852 518 HD2 LYS 148 2HD LYS 148 15.344 6.779 -5.027 519 HD3 LYS 148 1HD LYS 148 13.889 7.329 -5.860 520 HE2 LYS 148 2HE LYS 148 15.463 9.200 -5.568 521 HE3 LYS 148 1HE LYS 148 14.004 9.476 -4.617 522 HZ1 LYS 148 3HZ LYS 148 16.134 9.900 -3.428 523 HZ2 LYS 148 1HZ LYS 148 16.464 8.241 -3.513 524 HZ3 LYS 148 2HZ LYS 148 15.105 8.792 -2.654
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