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NMR Restraints Grid |
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Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
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645538 |
6ns8 ![]() ![]() |
30494 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H GLY 1 1H GLY 1 2.664 -4.317 16.737 2 HA2 GLY 1 2HA GLY 1 1.996 -3.455 14.607 3 HA3 GLY 1 3HA GLY 1 3.659 -3.586 14.045 4 H SER 2 H SER 2 1.643 -4.812 12.653 5 HA SER 2 HA SER 2 1.427 -7.621 13.394 6 HB2 SER 2 2HB SER 2 0.379 -6.113 10.953 7 HB3 SER 2 3HB SER 2 -0.102 -7.736 11.453 8 HG SER 2 HG SER 2 -1.229 -5.515 12.144 9 H VAL 3 H VAL 3 2.023 -9.346 11.891 10 HA VAL 3 HA VAL 3 4.552 -9.178 10.601 11 HB VAL 3 HB VAL 3 3.651 -11.292 11.542 12 HG11 VAL 3 1HG1 VAL 3 1.660 -11.302 9.245 13 HG12 VAL 3 2HG1 VAL 3 1.277 -11.036 10.946 14 HG13 VAL 3 3HG1 VAL 3 1.900 -12.600 10.419 15 HG21 VAL 3 1HG2 VAL 3 4.337 -12.844 9.743 16 HG22 VAL 3 2HG2 VAL 3 5.428 -11.460 9.848 17 HG23 VAL 3 3HG2 VAL 3 4.223 -11.535 8.562 18 H VAL 4 H VAL 4 1.437 -8.329 9.653 19 HA VAL 4 HA VAL 4 1.375 -8.445 6.851 20 HB VAL 4 HB VAL 4 0.221 -6.248 8.645 21 HG11 VAL 4 1HG1 VAL 4 -0.645 -7.192 5.894 22 HG12 VAL 4 2HG1 VAL 4 0.121 -5.654 6.279 23 HG13 VAL 4 3HG1 VAL 4 -1.501 -6.001 6.877 24 HG21 VAL 4 1HG2 VAL 4 -1.055 -8.903 7.878 25 HG22 VAL 4 2HG2 VAL 4 -1.832 -7.611 8.800 26 HG23 VAL 4 3HG2 VAL 4 -0.447 -8.470 9.478 27 H LYS 5 H LYS 5 2.678 -6.093 9.131 28 HA LYS 5 HA LYS 5 3.362 -3.980 7.496 29 HB2 LYS 5 2HB LYS 5 3.469 -3.993 10.021 30 HB3 LYS 5 3HB LYS 5 4.993 -4.873 9.908 31 HG2 LYS 5 2HG LYS 5 5.984 -2.969 8.647 32 HG3 LYS 5 3HG LYS 5 4.448 -2.102 8.781 33 HD2 LYS 5 2HD LYS 5 4.690 -2.147 11.273 34 HD3 LYS 5 3HD LYS 5 6.266 -2.922 11.076 35 HE2 LYS 5 2HE LYS 5 5.477 -0.139 10.146 36 HE3 LYS 5 3HE LYS 5 6.599 -0.548 11.442 37 HZ1 LYS 5 1HZ LYS 5 6.977 -1.052 8.544 38 HZ2 LYS 5 2HZ LYS 5 8.017 -1.618 9.749 39 HZ3 LYS 5 3HZ LYS 5 7.831 0.044 9.512 40 H GLU 6 H GLU 6 5.152 -7.020 7.986 41 HA GLU 6 HA GLU 6 7.647 -6.198 6.942 42 HB2 GLU 6 2HB GLU 6 7.481 -8.119 8.432 43 HB3 GLU 6 3HB GLU 6 6.368 -8.936 7.339 44 HG2 GLU 6 2HG GLU 6 8.151 -9.143 5.664 45 HG3 GLU 6 3HG GLU 6 9.286 -8.331 6.746 46 H LYS 7 H LYS 7 4.971 -8.143 5.586 47 HA LYS 7 HA LYS 7 5.908 -8.441 2.947 48 HB2 LYS 7 2HB LYS 7 3.015 -8.230 3.894 49 HB3 LYS 7 3HB LYS 7 3.530 -8.855 2.327 50 HG2 LYS 7 2HG LYS 7 4.735 -10.698 3.468 51 HG3 LYS 7 3HG LYS 7 4.173 -10.083 5.028 52 HD2 LYS 7 2HD LYS 7 1.834 -10.480 4.362 53 HD3 LYS 7 3HD LYS 7 2.358 -11.024 2.766 54 HE2 LYS 7 2HE LYS 7 3.024 -12.390 5.398 55 HE3 LYS 7 3HE LYS 7 1.781 -12.909 4.258 56 HZ1 LYS 7 1HZ LYS 7 4.690 -12.749 3.659 57 HZ2 LYS 7 2HZ LYS 7 3.486 -13.301 2.610 58 HZ3 LYS 7 3HZ LYS 7 3.838 -14.165 4.017 59 H LEU 8 H LEU 8 4.148 -5.818 4.490 60 HA LEU 8 HA LEU 8 3.618 -4.240 2.176 61 HB2 LEU 8 2HB LEU 8 3.694 -3.570 5.136 62 HB3 LEU 8 3HB LEU 8 3.210 -2.419 3.905 63 HG LEU 8 HG LEU 8 1.770 -5.039 4.490 64 HD11 LEU 8 1HD1 LEU 8 0.962 -2.214 5.226 65 HD12 LEU 8 2HD1 LEU 8 1.517 -3.469 6.337 66 HD13 LEU 8 3HD1 LEU 8 -0.002 -3.676 5.472 67 HD21 LEU 8 1HD2 LEU 8 0.959 -2.752 2.668 68 HD22 LEU 8 2HD2 LEU 8 -0.007 -4.185 3.039 69 HD23 LEU 8 3HD2 LEU 8 1.507 -4.349 2.157 70 H GLU 9 H GLU 9 6.362 -4.463 4.420 71 HA GLU 9 HA GLU 9 7.707 -2.074 3.566 72 HB2 GLU 9 2HB GLU 9 8.814 -4.518 5.027 73 HB3 GLU 9 3HB GLU 9 9.712 -3.026 4.753 74 HG2 GLU 9 2HG GLU 9 7.297 -3.441 6.518 75 HG3 GLU 9 3HG GLU 9 8.920 -3.007 7.017 76 H LYS 10 H LYS 10 7.864 -5.518 2.715 77 HA LYS 10 HA LYS 10 10.012 -5.424 0.899 78 HB2 LYS 10 2HB LYS 10 7.592 -7.283 0.785 79 HB3 LYS 10 3HB LYS 10 9.143 -7.552 -0.011 80 HG2 LYS 10 2HG LYS 10 8.592 -7.545 2.970 81 HG3 LYS 10 3HG LYS 10 8.989 -8.945 1.974 82 HD2 LYS 10 2HD LYS 10 11.264 -8.068 1.607 83 HD3 LYS 10 3HD LYS 10 10.864 -6.592 2.491 84 HE2 LYS 10 2HE LYS 10 10.545 -7.903 4.554 85 HE3 LYS 10 3HE LYS 10 10.921 -9.390 3.679 86 HZ1 LYS 10 1HZ LYS 10 12.778 -7.096 4.006 87 HZ2 LYS 10 2HZ LYS 10 13.133 -8.574 3.269 88 HZ3 LYS 10 3HZ LYS 10 12.817 -8.514 4.928 89 H ALA 11 H ALA 11 6.519 -5.001 0.512 90 HA ALA 11 HA ALA 11 6.354 -4.740 -2.270 91 HB1 ALA 11 1HB ALA 11 4.142 -3.745 -1.853 92 HB2 ALA 11 2HB ALA 11 4.544 -3.540 -0.144 93 HB3 ALA 11 3HB ALA 11 4.401 -5.160 -0.829 94 H LEU 12 H LEU 12 6.632 -2.235 0.289 95 HA LEU 12 HA LEU 12 6.589 0.120 -1.081 96 HB2 LEU 12 2HB LEU 12 8.275 -0.731 1.288 97 HB3 LEU 12 3HB LEU 12 8.416 0.897 0.651 98 HG LEU 12 HG LEU 12 5.841 -0.301 1.756 99 HD11 LEU 12 1HD1 LEU 12 7.735 1.704 3.026 100 HD12 LEU 12 2HD1 LEU 12 7.558 0.014 3.501 101 HD13 LEU 12 3HD1 LEU 12 6.212 1.125 3.703 102 HD21 LEU 12 1HD2 LEU 12 6.476 2.555 0.915 103 HD22 LEU 12 2HD2 LEU 12 4.971 1.999 1.650 104 HD23 LEU 12 3HD2 LEU 12 5.425 1.431 0.047 105 H ILE 13 H ILE 13 9.524 -1.890 -0.604 106 HA ILE 13 HA ILE 13 11.326 -0.172 -1.952 107 HB ILE 13 HB ILE 13 11.589 -3.164 -1.377 108 HG12 ILE 13 2HG1 ILE 13 12.569 -0.778 0.273 109 HG13 ILE 13 3HG1 ILE 13 11.175 -1.776 0.671 110 HG21 ILE 13 1HG2 ILE 13 14.040 -2.824 -1.572 111 HG22 ILE 13 2HG2 ILE 13 13.773 -1.142 -2.032 112 HG23 ILE 13 3HG2 ILE 13 13.219 -2.444 -3.087 113 HD11 ILE 13 1HD1 ILE 13 12.653 -3.711 0.961 114 HD12 ILE 13 2HD1 ILE 13 13.080 -2.373 2.025 115 HD13 ILE 13 3HD1 ILE 13 14.049 -2.695 0.587 116 H GLU 14 H GLU 14 9.586 -3.130 -3.006 117 HA GLU 14 HA GLU 14 10.865 -3.446 -5.496 118 HB2 GLU 14 2HB GLU 14 8.055 -4.357 -4.738 119 HB3 GLU 14 3HB GLU 14 9.026 -4.982 -6.071 120 HG2 GLU 14 2HG GLU 14 9.529 -5.315 -3.104 121 HG3 GLU 14 3HG GLU 14 9.084 -6.564 -4.256 122 H VAL 15 H VAL 15 7.903 -1.665 -4.601 123 HA VAL 15 HA VAL 15 7.365 -0.957 -7.398 124 HB VAL 15 HB VAL 15 5.229 -0.115 -6.650 125 HG11 VAL 15 1HG1 VAL 15 5.830 -2.749 -5.251 126 HG12 VAL 15 2HG1 VAL 15 5.363 -2.546 -6.940 127 HG13 VAL 15 3HG1 VAL 15 4.218 -2.148 -5.660 128 HG21 VAL 15 1HG2 VAL 15 4.526 -0.099 -4.254 129 HG22 VAL 15 2HG2 VAL 15 5.848 1.022 -4.574 130 HG23 VAL 15 3HG2 VAL 15 6.180 -0.518 -3.785 131 H ARG 16 H ARG 16 9.155 0.256 -4.844 132 HA ARG 16 HA ARG 16 8.690 2.947 -4.612 133 HB2 ARG 16 2HB ARG 16 10.342 1.736 -3.257 134 HB3 ARG 16 3HB ARG 16 11.418 1.622 -4.642 135 HG2 ARG 16 2HG ARG 16 11.724 4.069 -4.643 136 HG3 ARG 16 3HG ARG 16 10.600 4.217 -3.285 137 HD2 ARG 16 2HD ARG 16 12.131 2.901 -1.866 138 HD3 ARG 16 3HD ARG 16 13.245 2.709 -3.227 139 HE ARG 16 HE ARG 16 12.605 5.287 -1.906 140 HH11 ARG 16 1HH1 ARG 16 14.890 3.270 -3.676 141 HH12 ARG 16 2HH1 ARG 16 16.173 4.436 -3.572 142 HH21 ARG 16 1HH2 ARG 16 14.296 6.774 -1.750 143 HH22 ARG 16 2HH2 ARG 16 15.834 6.427 -2.475 144 HA PRO 17 HA PRO 17 11.409 4.168 -8.523 145 HB2 PRO 17 2HB PRO 17 11.747 2.295 -10.530 146 HB3 PRO 17 3HB PRO 17 12.900 2.497 -9.190 147 HG2 PRO 17 2HG PRO 17 10.686 0.481 -9.470 148 HG3 PRO 17 3HG PRO 17 12.372 0.235 -8.951 149 HD2 PRO 17 2HD PRO 17 10.378 0.411 -7.149 150 HD3 PRO 17 3HD PRO 17 11.987 1.065 -6.809 151 H TYR 18 H TYR 18 8.570 2.173 -8.629 152 HA TYR 18 HA TYR 18 7.496 3.307 -11.097 153 HB2 TYR 18 2HB TYR 18 6.334 1.323 -9.092 154 HB3 TYR 18 3HB TYR 18 5.483 1.853 -10.539 155 HD1 TYR 18 HD1 TYR 18 8.336 -0.178 -9.281 156 HD2 TYR 18 HD2 TYR 18 6.094 1.001 -12.727 157 HE1 TYR 18 HE1 TYR 18 9.389 -1.978 -10.592 158 HE2 TYR 18 HE2 TYR 18 7.144 -0.787 -14.029 159 HH TYR 18 HH TYR 18 9.153 -2.145 -14.000 160 H VAL 19 H VAL 19 7.038 3.681 -7.582 161 HA VAL 19 HA VAL 19 4.514 5.120 -7.993 162 HB VAL 19 HB VAL 19 4.174 5.004 -5.553 163 HG11 VAL 19 1HG1 VAL 19 3.824 2.574 -5.369 164 HG12 VAL 19 2HG1 VAL 19 4.871 2.307 -6.767 165 HG13 VAL 19 3HG1 VAL 19 3.348 3.179 -6.958 166 HG21 VAL 19 1HG2 VAL 19 6.492 5.091 -4.743 167 HG22 VAL 19 2HG2 VAL 19 6.810 3.489 -5.411 168 HG23 VAL 19 3HG2 VAL 19 5.659 3.681 -4.082 169 H GLU 20 H GLU 20 4.468 7.223 -8.168 170 HA GLU 20 HA GLU 20 6.338 9.039 -6.863 171 HB2 GLU 20 2HB GLU 20 5.376 9.589 -9.104 172 HB3 GLU 20 3HB GLU 20 3.763 9.604 -8.404 173 HG2 GLU 20 2HG GLU 20 4.598 11.884 -8.721 174 HG3 GLU 20 3HG GLU 20 4.357 11.540 -7.011 175 H TYR 21 H TYR 21 5.762 10.412 -5.125 176 HA TYR 21 HA TYR 21 4.973 10.925 -3.088 177 HB2 TYR 21 2HB TYR 21 2.329 9.670 -3.955 178 HB3 TYR 21 3HB TYR 21 2.565 10.655 -2.511 179 HD1 TYR 21 HD1 TYR 21 4.347 12.823 -3.735 180 HD2 TYR 21 HD2 TYR 21 0.732 11.011 -5.120 181 HE1 TYR 21 HE1 TYR 21 3.821 14.847 -5.016 182 HE2 TYR 21 HE2 TYR 21 0.207 13.036 -6.402 183 HH TYR 21 HH TYR 21 2.475 15.489 -6.982 184 H TYR 22 H TYR 22 6.491 8.702 -3.477 185 HA TYR 22 HA TYR 22 5.756 6.337 -2.185 186 HB2 TYR 22 2HB TYR 22 7.849 6.521 -3.465 187 HB3 TYR 22 3HB TYR 22 8.496 7.680 -2.309 188 HD1 TYR 22 HD1 TYR 22 7.260 4.131 -2.531 189 HD2 TYR 22 HD2 TYR 22 9.850 6.867 -0.497 190 HE1 TYR 22 HE1 TYR 22 8.230 2.276 -1.251 191 HE2 TYR 22 HE2 TYR 22 10.812 5.002 0.782 192 HH TYR 22 HH TYR 22 10.231 2.728 1.471 193 H ASN 23 H ASN 23 6.912 9.429 -0.831 194 HA ASN 23 HA ASN 23 7.222 8.661 1.860 195 HB2 ASN 23 2HB ASN 23 6.483 11.380 0.690 196 HB3 ASN 23 3HB ASN 23 6.929 11.116 2.376 197 HD21 ASN 23 1HD2 ASN 23 8.093 11.299 -0.893 198 HD22 ASN 23 2HD2 ASN 23 9.775 11.314 -0.492 199 H GLU 24 H GLU 24 4.415 9.789 0.056 200 HA GLU 24 HA GLU 24 2.669 10.128 2.287 201 HB2 GLU 24 2HB GLU 24 2.242 10.018 -0.718 202 HB3 GLU 24 3HB GLU 24 0.878 10.093 0.391 203 HG2 GLU 24 2HG GLU 24 1.445 12.310 -0.479 204 HG3 GLU 24 3HG GLU 24 1.626 12.227 1.269 205 H LEU 25 H LEU 25 2.981 7.572 -0.219 206 HA LEU 25 HA LEU 25 1.210 5.670 0.770 207 HB2 LEU 25 2HB LEU 25 2.421 5.599 -1.419 208 HB3 LEU 25 3HB LEU 25 3.902 5.214 -0.574 209 HG LEU 25 HG LEU 25 2.993 3.022 0.106 210 HD11 LEU 25 1HD1 LEU 25 0.454 3.792 -1.372 211 HD12 LEU 25 2HD1 LEU 25 0.627 3.587 0.374 212 HD13 LEU 25 3HD1 LEU 25 0.818 2.199 -0.694 213 HD21 LEU 25 1HD2 LEU 25 2.882 1.964 -2.114 214 HD22 LEU 25 2HD2 LEU 25 4.158 3.176 -2.043 215 HD23 LEU 25 3HD2 LEU 25 2.638 3.544 -2.864 216 H LYS 26 H LYS 26 4.578 6.313 1.561 217 HA LYS 26 HA LYS 26 5.094 4.164 3.291 218 HB2 LYS 26 2HB LYS 26 6.828 5.609 2.257 219 HB3 LYS 26 3HB LYS 26 6.350 6.931 3.310 220 HG2 LYS 26 2HG LYS 26 7.127 5.683 5.277 221 HG3 LYS 26 3HG LYS 26 7.505 4.289 4.258 222 HD2 LYS 26 2HD LYS 26 9.536 5.591 4.804 223 HD3 LYS 26 3HD LYS 26 9.220 5.574 3.066 224 HE2 LYS 26 2HE LYS 26 9.919 7.813 3.832 225 HE3 LYS 26 3HE LYS 26 8.271 7.855 3.211 226 HZ1 LYS 26 1HZ LYS 26 8.467 9.121 5.243 227 HZ2 LYS 26 2HZ LYS 26 9.062 7.776 6.074 228 HZ3 LYS 26 3HZ LYS 26 7.472 7.781 5.506 229 H ALA 27 H ALA 27 3.543 7.331 3.947 230 HA ALA 27 HA ALA 27 3.518 6.975 6.827 231 HB1 ALA 27 1HB ALA 27 3.614 9.235 5.846 232 HB2 ALA 27 2HB ALA 27 2.162 9.044 6.830 233 HB3 ALA 27 3HB ALA 27 2.048 8.980 5.069 234 H LEU 28 H LEU 28 1.416 6.347 4.100 235 HA LEU 28 HA LEU 28 -1.036 5.904 5.487 236 HB2 LEU 28 2HB LEU 28 -0.973 6.537 3.123 237 HB3 LEU 28 3HB LEU 28 -0.041 5.105 2.724 238 HG LEU 28 HG LEU 28 -1.995 3.667 3.239 239 HD11 LEU 28 1HD1 LEU 28 -4.213 4.650 3.666 240 HD12 LEU 28 2HD1 LEU 28 -3.488 6.256 3.780 241 HD13 LEU 28 3HD1 LEU 28 -3.077 5.011 4.964 242 HD21 LEU 28 1HD2 LEU 28 -1.662 4.465 0.941 243 HD22 LEU 28 2HD2 LEU 28 -2.645 5.894 1.275 244 HD23 LEU 28 3HD2 LEU 28 -3.377 4.287 1.311 245 H VAL 29 H VAL 29 1.563 3.859 4.312 246 HA VAL 29 HA VAL 29 0.350 1.357 4.948 247 HB VAL 29 HB VAL 29 2.060 1.842 3.082 248 HG11 VAL 29 1HG1 VAL 29 3.742 3.024 4.415 249 HG12 VAL 29 2HG1 VAL 29 4.441 1.611 3.625 250 HG13 VAL 29 3HG1 VAL 29 4.063 1.560 5.348 251 HG21 VAL 29 1HG2 VAL 29 1.304 -0.423 3.637 252 HG22 VAL 29 2HG2 VAL 29 2.576 -0.558 4.854 253 HG23 VAL 29 3HG2 VAL 29 3.003 -0.414 3.146 254 H SER 30 H SER 30 2.687 3.519 6.472 255 HA SER 30 HA SER 30 3.407 1.951 8.712 256 HB2 SER 30 2HB SER 30 3.281 4.952 8.275 257 HB3 SER 30 3HB SER 30 3.918 4.237 9.759 258 HG SER 30 HG SER 30 5.249 4.705 7.610 259 H LYS 31 H LYS 31 0.624 4.028 8.073 260 HA LYS 31 HA LYS 31 -0.555 3.931 10.653 261 HB2 LYS 31 2HB LYS 31 -1.143 5.702 9.073 262 HB3 LYS 31 3HB LYS 31 -1.704 4.522 7.893 263 HG2 LYS 31 2HG LYS 31 -3.547 3.883 9.448 264 HG3 LYS 31 3HG LYS 31 -3.005 5.136 10.570 265 HD2 LYS 31 2HD LYS 31 -3.478 6.871 8.864 266 HD3 LYS 31 3HD LYS 31 -3.985 5.617 7.724 267 HE2 LYS 31 2HE LYS 31 -5.845 4.999 9.206 268 HE3 LYS 31 3HE LYS 31 -5.322 6.199 10.390 269 HZ1 LYS 31 1HZ LYS 31 -7.177 6.933 8.968 270 HZ2 LYS 31 2HZ LYS 31 -6.155 6.850 7.622 271 HZ3 LYS 31 3HZ LYS 31 -5.820 7.937 8.865 272 H ILE 32 H ILE 32 -1.331 2.168 7.592 273 HA ILE 32 HA ILE 32 -3.581 0.860 8.721 274 HB ILE 32 HB ILE 32 -3.797 -0.431 6.650 275 HG12 ILE 32 2HG1 ILE 32 -1.139 0.746 5.717 276 HG13 ILE 32 3HG1 ILE 32 -1.317 -0.895 6.319 277 HG21 ILE 32 1HG2 ILE 32 -4.001 1.430 5.029 278 HG22 ILE 32 2HG2 ILE 32 -3.023 2.456 6.079 279 HG23 ILE 32 3HG2 ILE 32 -4.603 1.889 6.624 280 HD11 ILE 32 1HD1 ILE 32 -2.636 0.234 3.849 281 HD12 ILE 32 2HD1 ILE 32 -2.828 -1.411 4.468 282 HD13 ILE 32 3HD1 ILE 32 -1.252 -0.859 3.910 283 H SER 33 H SER 33 -0.234 -0.265 8.190 284 HA SER 33 HA SER 33 -0.622 -2.974 8.811 285 HB2 SER 33 2HB SER 33 1.839 -3.024 9.209 286 HB3 SER 33 3HB SER 33 1.400 -2.198 7.716 287 HG SER 33 HG SER 33 2.497 -0.597 8.461 288 H SER 34 H SER 34 -0.571 -0.247 10.949 289 HA SER 34 HA SER 34 -0.181 -1.873 13.363 290 HB2 SER 34 2HB SER 34 0.875 0.385 13.210 291 HB3 SER 34 3HB SER 34 -0.721 1.121 13.062 292 HG SER 34 HG SER 34 -1.195 0.279 15.155 293 H SER 35 H SER 35 -2.691 -1.175 11.297 294 HA SER 35 HA SER 35 -4.815 -1.062 13.353 295 HB2 SER 35 2HB SER 35 -4.893 -0.217 10.417 296 HB3 SER 35 3HB SER 35 -6.222 -0.054 11.572 297 HG SER 35 HG SER 35 -3.790 1.061 12.324 298 H VAL 36 H VAL 36 -3.700 -2.745 10.452 299 HA VAL 36 HA VAL 36 -6.034 -4.503 10.337 300 HB VAL 36 HB VAL 36 -5.247 -5.236 8.145 301 HG11 VAL 36 1HG1 VAL 36 -5.062 -2.206 8.366 302 HG12 VAL 36 2HG1 VAL 36 -6.540 -3.154 8.180 303 HG13 VAL 36 3HG1 VAL 36 -5.354 -3.112 6.875 304 HG21 VAL 36 1HG2 VAL 36 -2.834 -5.314 8.509 305 HG22 VAL 36 2HG2 VAL 36 -2.758 -3.556 8.615 306 HG23 VAL 36 3HG2 VAL 36 -3.180 -4.330 7.085 307 H ASN 37 H ASN 37 -5.922 -6.683 10.566 308 HA ASN 37 HA ASN 37 -3.642 -7.755 12.084 309 HB2 ASN 37 2HB ASN 37 -6.457 -8.862 11.665 310 HB3 ASN 37 3HB ASN 37 -5.213 -9.630 12.650 311 HD21 ASN 37 1HD2 ASN 37 -7.486 -7.011 12.455 312 HD22 ASN 37 2HD2 ASN 37 -7.334 -6.482 14.092 313 H ASP 38 H ASP 38 -5.062 -8.039 8.940 314 HA ASP 38 HA ASP 38 -3.409 -10.418 8.282 315 HB2 ASP 38 2HB ASP 38 -6.208 -9.877 7.167 316 HB3 ASP 38 3HB ASP 38 -5.171 -11.240 6.759 317 H LEU 39 H LEU 39 -2.680 -10.476 6.068 318 HA LEU 39 HA LEU 39 -1.993 -7.961 4.927 319 HB2 LEU 39 2HB LEU 39 -0.663 -10.137 4.779 320 HB3 LEU 39 3HB LEU 39 -1.827 -10.705 3.604 321 HG LEU 39 HG LEU 39 0.409 -9.839 2.693 322 HD11 LEU 39 1HD1 LEU 39 -0.476 -8.789 0.713 323 HD12 LEU 39 2HD1 LEU 39 -2.020 -8.501 1.522 324 HD13 LEU 39 3HD1 LEU 39 -1.485 -10.151 1.200 325 HD21 LEU 39 1HD2 LEU 39 0.746 -7.435 2.433 326 HD22 LEU 39 2HD2 LEU 39 0.649 -7.864 4.140 327 HD23 LEU 39 3HD2 LEU 39 -0.732 -7.106 3.343 328 H GLU 40 H GLU 40 -4.521 -10.332 4.375 329 HA GLU 40 HA GLU 40 -5.681 -9.257 2.017 330 HB2 GLU 40 2HB GLU 40 -6.059 -11.584 3.000 331 HB3 GLU 40 3HB GLU 40 -7.100 -10.836 4.210 332 HG2 GLU 40 2HG GLU 40 -8.541 -9.969 2.344 333 HG3 GLU 40 3HG GLU 40 -7.541 -10.873 1.205 334 H GLU 41 H GLU 41 -5.985 -8.463 5.466 335 HA GLU 41 HA GLU 41 -8.236 -6.689 5.242 336 HB2 GLU 41 2HB GLU 41 -6.074 -6.938 7.375 337 HB3 GLU 41 3HB GLU 41 -7.436 -5.834 7.504 338 HG2 GLU 41 2HG GLU 41 -7.652 -8.850 7.317 339 HG3 GLU 41 3HG GLU 41 -7.716 -7.918 8.810 340 H ALA 42 H ALA 42 -4.758 -6.402 4.882 341 HA ALA 42 HA ALA 42 -4.585 -3.533 4.863 342 HB1 ALA 42 1HB ALA 42 -2.626 -4.937 5.376 343 HB2 ALA 42 2HB ALA 42 -2.304 -3.891 3.994 344 HB3 ALA 42 3HB ALA 42 -2.655 -5.605 3.741 345 H ILE 43 H ILE 43 -4.801 -6.081 2.426 346 HA ILE 43 HA ILE 43 -4.617 -4.613 0.066 347 HB ILE 43 HB ILE 43 -6.071 -7.210 0.715 348 HG12 ILE 43 2HG1 ILE 43 -3.497 -6.708 -0.857 349 HG13 ILE 43 3HG1 ILE 43 -3.567 -7.217 0.825 350 HG21 ILE 43 1HG2 ILE 43 -5.736 -6.026 -2.064 351 HG22 ILE 43 2HG2 ILE 43 -7.260 -6.252 -1.203 352 HG23 ILE 43 3HG2 ILE 43 -6.320 -7.655 -1.709 353 HD11 ILE 43 1HD1 ILE 43 -3.065 -9.103 -0.536 354 HD12 ILE 43 2HD1 ILE 43 -4.452 -8.800 -1.583 355 HD13 ILE 43 3HD1 ILE 43 -4.700 -9.305 0.093 356 H VAL 44 H VAL 44 -7.787 -5.857 1.360 357 HA VAL 44 HA VAL 44 -9.468 -4.311 -0.103 358 HB VAL 44 HB VAL 44 -10.144 -6.211 1.332 359 HG11 VAL 44 1HG1 VAL 44 -10.085 -4.277 3.667 360 HG12 VAL 44 2HG1 VAL 44 -8.989 -5.638 3.416 361 HG13 VAL 44 3HG1 VAL 44 -10.707 -5.930 3.700 362 HG21 VAL 44 1HG2 VAL 44 -11.870 -4.779 0.333 363 HG22 VAL 44 2HG2 VAL 44 -11.858 -3.744 1.764 364 HG23 VAL 44 3HG2 VAL 44 -12.399 -5.421 1.891 365 H VAL 45 H VAL 45 -8.063 -3.281 3.072 366 HA VAL 45 HA VAL 45 -9.293 -0.756 3.261 367 HB VAL 45 HB VAL 45 -6.611 -1.769 4.289 368 HG11 VAL 45 1HG1 VAL 45 -7.736 1.019 4.784 369 HG12 VAL 45 2HG1 VAL 45 -6.245 0.639 3.921 370 HG13 VAL 45 3HG1 VAL 45 -6.370 0.304 5.649 371 HG21 VAL 45 1HG2 VAL 45 -9.193 -0.972 5.693 372 HG22 VAL 45 2HG2 VAL 45 -7.748 -1.598 6.494 373 HG23 VAL 45 3HG2 VAL 45 -8.653 -2.623 5.376 374 H LEU 46 H LEU 46 -6.301 -1.676 1.501 375 HA LEU 46 HA LEU 46 -5.744 0.963 0.532 376 HB2 LEU 46 2HB LEU 46 -4.708 -1.752 -0.294 377 HB3 LEU 46 3HB LEU 46 -4.207 -0.283 -1.122 378 HG LEU 46 HG LEU 46 -3.766 -0.840 1.838 379 HD11 LEU 46 1HD1 LEU 46 -1.777 -0.963 -0.443 380 HD12 LEU 46 2HD1 LEU 46 -2.435 -2.343 0.441 381 HD13 LEU 46 3HD1 LEU 46 -1.419 -1.171 1.275 382 HD21 LEU 46 1HD2 LEU 46 -2.285 1.133 1.776 383 HD22 LEU 46 2HD2 LEU 46 -3.948 1.557 1.389 384 HD23 LEU 46 3HD2 LEU 46 -2.752 1.437 0.097 385 H ARG 47 H ARG 47 -7.776 -1.650 -0.653 386 HA ARG 47 HA ARG 47 -8.278 -0.589 -3.236 387 HB2 ARG 47 2HB ARG 47 -9.980 -2.420 -1.498 388 HB3 ARG 47 3HB ARG 47 -10.375 -2.010 -3.166 389 HG2 ARG 47 2HG ARG 47 -8.253 -3.067 -3.909 390 HG3 ARG 47 3HG ARG 47 -7.897 -3.508 -2.235 391 HD2 ARG 47 2HD ARG 47 -9.950 -4.893 -2.174 392 HD3 ARG 47 3HD ARG 47 -10.295 -4.455 -3.851 393 HE ARG 47 HE ARG 47 -7.710 -5.597 -3.686 394 HH11 ARG 47 1HH1 ARG 47 -11.102 -6.572 -3.504 395 HH12 ARG 47 2HH1 ARG 47 -10.775 -8.192 -4.031 396 HH21 ARG 47 1HH2 ARG 47 -7.343 -7.738 -4.326 397 HH22 ARG 47 2HH2 ARG 47 -8.665 -8.847 -4.493 398 H GLU 48 H GLU 48 -9.406 0.315 -0.064 399 HA GLU 48 HA GLU 48 -11.470 2.122 -1.094 400 HB2 GLU 48 2HB GLU 48 -10.407 1.675 1.728 401 HB3 GLU 48 3HB GLU 48 -11.627 2.883 1.332 402 HG2 GLU 48 2HG GLU 48 -11.903 -0.124 1.035 403 HG3 GLU 48 3HG GLU 48 -12.655 0.891 2.268 404 H GLU 49 H GLU 49 -8.170 2.185 0.172 405 HA GLU 49 HA GLU 49 -7.893 4.965 0.556 406 HB2 GLU 49 2HB GLU 49 -5.709 2.962 -0.159 407 HB3 GLU 49 3HB GLU 49 -5.425 4.595 0.429 408 HG2 GLU 49 2HG GLU 49 -6.543 2.229 1.928 409 HG3 GLU 49 3HG GLU 49 -5.094 3.166 2.282 410 H GLU 50 H GLU 50 -7.116 2.928 -2.210 411 HA GLU 50 HA GLU 50 -6.325 4.676 -4.163 412 HB2 GLU 50 2HB GLU 50 -6.425 2.271 -4.515 413 HB3 GLU 50 3HB GLU 50 -8.178 2.272 -4.358 414 HG2 GLU 50 2HG GLU 50 -8.338 3.615 -6.446 415 HG3 GLU 50 3HG GLU 50 -6.582 3.541 -6.602 416 H LYS 51 H LYS 51 -9.759 3.760 -3.558 417 HA LYS 51 HA LYS 51 -11.067 5.489 -5.292 418 HB2 LYS 51 2HB LYS 51 -11.975 4.452 -2.579 419 HB3 LYS 51 3HB LYS 51 -13.048 5.176 -3.776 420 HG2 LYS 51 2HG LYS 51 -12.786 3.341 -5.278 421 HG3 LYS 51 3HG LYS 51 -11.406 2.699 -4.380 422 HD2 LYS 51 2HD LYS 51 -13.512 1.401 -3.996 423 HD3 LYS 51 3HD LYS 51 -12.827 2.069 -2.514 424 HE2 LYS 51 2HE LYS 51 -14.484 3.933 -2.632 425 HE3 LYS 51 3HE LYS 51 -15.188 3.185 -4.066 426 HZ1 LYS 51 1HZ LYS 51 -15.014 1.901 -1.396 427 HZ2 LYS 51 2HZ LYS 51 -15.784 1.276 -2.763 428 HZ3 LYS 51 3HZ LYS 51 -16.389 2.664 -2.015 429 H LYS 52 H LYS 52 -9.986 6.052 -1.976 430 HA LYS 52 HA LYS 52 -11.247 8.602 -1.576 431 HB2 LYS 52 2HB LYS 52 -8.981 7.205 -0.075 432 HB3 LYS 52 3HB LYS 52 -9.819 8.649 0.492 433 HG2 LYS 52 2HG LYS 52 -11.819 7.481 0.945 434 HG3 LYS 52 3HG LYS 52 -11.385 6.132 -0.107 435 HD2 LYS 52 2HD LYS 52 -11.223 5.415 2.216 436 HD3 LYS 52 3HD LYS 52 -9.611 5.454 1.500 437 HE2 LYS 52 2HE LYS 52 -9.297 7.720 2.592 438 HE3 LYS 52 3HE LYS 52 -10.828 7.449 3.425 439 HZ1 LYS 52 1HZ LYS 52 -9.865 5.437 4.396 440 HZ2 LYS 52 2HZ LYS 52 -8.993 6.818 4.824 441 HZ3 LYS 52 3HZ LYS 52 -8.391 5.772 3.644 442 H ALA 53 H ALA 53 -8.148 7.472 -2.755 443 HA ALA 53 HA ALA 53 -6.833 10.027 -2.802 444 HB1 ALA 53 1HB ALA 53 -5.547 7.940 -2.540 445 HB2 ALA 53 2HB ALA 53 -5.032 8.812 -3.985 446 HB3 ALA 53 3HB ALA 53 -6.076 7.395 -4.135 447 H SER 54 H SER 54 -5.827 10.719 -4.836 448 HA SER 54 HA SER 54 -7.403 10.452 -7.294 449 HB2 SER 54 2HB SER 54 -8.146 12.531 -6.049 450 HB3 SER 54 3HB SER 54 -6.489 13.128 -6.113 451 HG SER 54 HG SER 54 -8.367 13.437 -7.910 452 H GLU 55 H GLU 55 -6.053 11.023 -9.195 453 HA GLU 55 HA GLU 55 -3.508 9.772 -8.955 454 HB2 GLU 55 2HB GLU 55 -4.824 11.179 -11.308 455 HB3 GLU 55 3HB GLU 55 -3.289 10.316 -11.427 456 HG2 GLU 55 2HG GLU 55 -4.443 8.235 -10.668 457 HG3 GLU 55 3HG GLU 55 -5.974 9.112 -10.678 458 HA PRO 56 HA PRO 56 -1.550 9.619 -10.006 459 HB2 PRO 56 2HB PRO 56 1.108 9.770 -9.607 460 HB3 PRO 56 3HB PRO 56 0.331 10.633 -10.956 461 HG2 PRO 56 2HG PRO 56 1.265 11.716 -8.317 462 HG3 PRO 56 3HG PRO 56 1.405 12.427 -9.941 463 HD2 PRO 56 2HD PRO 56 -0.586 13.082 -8.074 464 HD3 PRO 56 3HD PRO 56 -0.687 13.394 -9.820 465 H PHE 57 H PHE 57 -1.807 10.880 -6.855 466 HA PHE 57 HA PHE 57 -0.471 8.842 -5.376 467 HB2 PHE 57 2HB PHE 57 -1.238 11.018 -4.381 468 HB3 PHE 57 3HB PHE 57 -2.903 10.455 -4.485 469 HD1 PHE 57 HD1 PHE 57 0.284 8.816 -3.297 470 HD2 PHE 57 HD2 PHE 57 -3.696 10.035 -2.283 471 HE1 PHE 57 HE1 PHE 57 0.528 7.798 -1.072 472 HE2 PHE 57 HE2 PHE 57 -3.433 9.008 -0.060 473 HZ PHE 57 HZ PHE 57 -1.323 7.890 0.546 474 H LYS 58 H LYS 58 -3.622 8.899 -6.967 475 HA LYS 58 HA LYS 58 -4.555 6.412 -5.915 476 HB2 LYS 58 2HB LYS 58 -5.963 8.204 -7.079 477 HB3 LYS 58 3HB LYS 58 -5.352 7.584 -8.610 478 HG2 LYS 58 2HG LYS 58 -6.380 5.402 -8.172 479 HG3 LYS 58 3HG LYS 58 -6.868 5.933 -6.564 480 HD2 LYS 58 2HD LYS 58 -8.820 6.044 -7.943 481 HD3 LYS 58 3HD LYS 58 -8.301 7.709 -7.668 482 HE2 LYS 58 2HE LYS 58 -8.977 7.328 -10.012 483 HE3 LYS 58 3HE LYS 58 -7.269 7.765 -9.903 484 HZ1 LYS 58 1HZ LYS 58 -7.637 5.929 -11.429 485 HZ2 LYS 58 2HZ LYS 58 -8.329 5.000 -10.204 486 HZ3 LYS 58 3HZ LYS 58 -6.697 5.426 -10.122 487 H THR 59 H THR 59 -2.317 7.235 -8.458 488 HA THR 59 HA THR 59 -2.175 4.609 -9.643 489 HB THR 59 HB THR 59 -0.261 6.981 -9.899 490 HG1 THR 59 HG1 THR 59 -2.374 6.164 -11.640 491 HG21 THR 59 1HG2 THR 59 0.466 5.924 -12.020 492 HG22 THR 59 2HG2 THR 59 -0.576 4.536 -11.699 493 HG23 THR 59 3HG2 THR 59 0.802 4.867 -10.646 494 H ASP 60 H ASP 60 -0.558 6.415 -7.159 495 HA ASP 60 HA ASP 60 1.749 4.890 -6.711 496 HB2 ASP 60 2HB ASP 60 1.658 7.086 -5.833 497 HB3 ASP 60 3HB ASP 60 0.068 6.853 -5.133 498 H ILE 61 H ILE 61 -1.285 4.973 -4.899 499 HA ILE 61 HA ILE 61 -0.910 2.797 -3.228 500 HB ILE 61 HB ILE 61 -3.519 3.966 -4.288 501 HG12 ILE 61 2HG1 ILE 61 -2.027 4.471 -1.662 502 HG13 ILE 61 3HG1 ILE 61 -1.983 5.540 -3.057 503 HG21 ILE 61 1HG2 ILE 61 -4.640 2.929 -2.326 504 HG22 ILE 61 2HG2 ILE 61 -3.131 2.116 -1.896 505 HG23 ILE 61 3HG2 ILE 61 -3.955 1.706 -3.401 506 HD11 ILE 61 1HD1 ILE 61 -4.394 5.927 -2.808 507 HD12 ILE 61 2HD1 ILE 61 -3.464 6.400 -1.388 508 HD13 ILE 61 3HD1 ILE 61 -4.393 4.902 -1.370 509 H ARG 62 H ARG 62 -2.688 2.782 -6.440 510 HA ARG 62 HA ARG 62 -3.437 0.117 -6.329 511 HB2 ARG 62 2HB ARG 62 -3.967 0.211 -8.669 512 HB3 ARG 62 3HB ARG 62 -4.363 1.749 -7.933 513 HG2 ARG 62 2HG ARG 62 -3.456 2.475 -9.922 514 HG3 ARG 62 3HG ARG 62 -2.018 2.501 -8.908 515 HD2 ARG 62 2HD ARG 62 -1.284 0.356 -9.851 516 HD3 ARG 62 3HD ARG 62 -2.774 0.234 -10.789 517 HE ARG 62 HE ARG 62 -1.537 2.622 -11.517 518 HH11 ARG 62 1HH1 ARG 62 -0.831 -0.826 -11.756 519 HH12 ARG 62 2HH1 ARG 62 0.104 -0.645 -13.206 520 HH21 ARG 62 1HH2 ARG 62 -0.320 2.799 -13.443 521 HH22 ARG 62 2HH2 ARG 62 0.389 1.378 -14.145 522 H ILE 63 H ILE 63 -0.340 1.403 -7.560 523 HA ILE 63 HA ILE 63 0.643 -0.963 -8.721 524 HB ILE 63 HB ILE 63 2.271 1.302 -7.482 525 HG12 ILE 63 2HG1 ILE 63 1.611 0.826 -10.431 526 HG13 ILE 63 3HG1 ILE 63 0.704 1.921 -9.400 527 HG21 ILE 63 1HG2 ILE 63 3.194 -0.859 -9.425 528 HG22 ILE 63 2HG2 ILE 63 3.646 -0.742 -7.724 529 HG23 ILE 63 3HG2 ILE 63 4.165 0.503 -8.856 530 HD11 ILE 63 1HD1 ILE 63 3.630 2.201 -10.085 531 HD12 ILE 63 2HD1 ILE 63 2.683 3.307 -9.087 532 HD13 ILE 63 3HD1 ILE 63 2.298 3.112 -10.796 533 H LEU 64 H LEU 64 1.045 0.227 -5.353 534 HA LEU 64 HA LEU 64 2.639 -2.003 -4.499 535 HB2 LEU 64 2HB LEU 64 2.759 0.173 -3.391 536 HB3 LEU 64 3HB LEU 64 1.082 0.056 -2.901 537 HG LEU 64 HG LEU 64 2.762 -2.210 -1.913 538 HD11 LEU 64 1HD1 LEU 64 3.924 -0.998 -0.162 539 HD12 LEU 64 2HD1 LEU 64 3.351 0.541 -0.809 540 HD13 LEU 64 3HD1 LEU 64 4.455 -0.460 -1.753 541 HD21 LEU 64 1HD2 LEU 64 1.602 -1.808 0.206 542 HD22 LEU 64 2HD2 LEU 64 0.450 -1.866 -1.125 543 HD23 LEU 64 3HD2 LEU 64 0.911 -0.310 -0.432 544 H LEU 65 H LEU 65 -0.750 -1.119 -4.267 545 HA LEU 65 HA LEU 65 -1.825 -3.084 -2.664 546 HB2 LEU 65 2HB LEU 65 -3.083 -1.144 -3.289 547 HB3 LEU 65 3HB LEU 65 -2.917 -1.492 -4.999 548 HG LEU 65 HG LEU 65 -4.489 -3.395 -4.781 549 HD11 LEU 65 1HD1 LEU 65 -5.781 -3.765 -2.754 550 HD12 LEU 65 2HD1 LEU 65 -4.829 -2.555 -1.900 551 HD13 LEU 65 3HD1 LEU 65 -4.065 -4.039 -2.466 552 HD21 LEU 65 1HD2 LEU 65 -5.341 -1.179 -5.406 553 HD22 LEU 65 2HD2 LEU 65 -5.613 -0.787 -3.704 554 HD23 LEU 65 3HD2 LEU 65 -6.532 -2.085 -4.474 555 H ASP 66 H ASP 66 -2.299 -3.185 -6.237 556 HA ASP 66 HA ASP 66 -2.737 -5.740 -6.835 557 HB2 ASP 66 2HB ASP 66 -2.670 -4.274 -8.663 558 HB3 ASP 66 3HB ASP 66 -1.132 -3.573 -8.192 559 H PHE 67 H PHE 67 0.639 -4.484 -6.468 560 HA PHE 67 HA PHE 67 2.055 -6.826 -6.913 561 HB2 PHE 67 2HB PHE 67 3.157 -4.612 -6.647 562 HB3 PHE 67 3HB PHE 67 2.818 -4.644 -4.921 563 HD1 PHE 67 HD1 PHE 67 4.686 -6.418 -7.627 564 HD2 PHE 67 HD2 PHE 67 4.328 -5.764 -3.407 565 HE1 PHE 67 HE1 PHE 67 6.771 -7.663 -7.245 566 HE2 PHE 67 HE2 PHE 67 6.417 -7.011 -3.043 567 HZ PHE 67 HZ PHE 67 7.636 -7.959 -4.961 568 H LEU 68 H LEU 68 0.612 -5.758 -3.796 569 HA LEU 68 HA LEU 68 1.466 -7.862 -2.122 570 HB2 LEU 68 2HB LEU 68 -1.181 -6.362 -2.072 571 HB3 LEU 68 3HB LEU 68 -0.600 -7.389 -0.768 572 HG LEU 68 HG LEU 68 0.812 -4.862 -1.703 573 HD11 LEU 68 1HD1 LEU 68 -1.391 -4.327 -0.776 574 HD12 LEU 68 2HD1 LEU 68 -0.099 -3.789 0.291 575 HD13 LEU 68 3HD1 LEU 68 -1.016 -5.247 0.688 576 HD21 LEU 68 1HD2 LEU 68 2.090 -5.083 0.388 577 HD22 LEU 68 2HD2 LEU 68 2.319 -6.492 -0.642 578 HD23 LEU 68 3HD2 LEU 68 1.250 -6.594 0.760 579 H GLU 69 H GLU 69 -1.422 -7.511 -4.150 580 HA GLU 69 HA GLU 69 -2.675 -9.979 -3.517 581 HB2 GLU 69 2HB GLU 69 -3.022 -8.206 -5.975 582 HB3 GLU 69 3HB GLU 69 -4.145 -9.462 -5.449 583 HG2 GLU 69 2HG GLU 69 -4.607 -8.189 -3.392 584 HG3 GLU 69 3HG GLU 69 -3.462 -6.948 -3.893 585 H SER 70 H SER 70 -0.188 -9.071 -5.756 586 HA SER 70 HA SER 70 1.339 -10.226 -6.916 587 HB2 SER 70 2HB SER 70 0.100 -12.721 -5.679 588 HB3 SER 70 3HB SER 70 1.641 -12.664 -6.540 589 HG SER 70 HG SER 70 1.129 -11.017 -4.287 590 H LYS 71 H LYS 71 -1.327 -9.514 -7.968 591 HA LYS 71 HA LYS 71 -2.252 -11.442 -9.839 592 HB2 LYS 71 2HB LYS 71 -2.525 -8.404 -9.873 593 HB3 LYS 71 3HB LYS 71 -3.421 -9.500 -10.920 594 HG2 LYS 71 2HG LYS 71 -4.561 -10.466 -8.970 595 HG3 LYS 71 3HG LYS 71 -3.633 -9.425 -7.889 596 HD2 LYS 71 2HD LYS 71 -5.595 -8.443 -10.018 597 HD3 LYS 71 3HD LYS 71 -5.945 -8.570 -8.292 598 HE2 LYS 71 2HE LYS 71 -4.119 -6.928 -7.835 599 HE3 LYS 71 3HE LYS 71 -3.866 -6.758 -9.573 600 HZ1 LYS 71 1HZ LYS 71 -6.378 -6.103 -8.129 601 HZ2 LYS 71 2HZ LYS 71 -6.099 -5.903 -9.786 602 HZ3 LYS 71 3HZ LYS 71 -5.230 -4.985 -8.669 603 HA PRO 72 HA PRO 72 1.193 -10.868 -12.837 604 HB2 PRO 72 2HB PRO 72 -0.302 -12.861 -14.486 605 HB3 PRO 72 3HB PRO 72 1.338 -12.966 -13.815 606 HG2 PRO 72 2HG PRO 72 -0.647 -14.471 -12.826 607 HG3 PRO 72 3HG PRO 72 0.607 -13.783 -11.765 608 HD2 PRO 72 2HD PRO 72 -2.197 -12.746 -12.264 609 HD3 PRO 72 3HD PRO 72 -1.343 -12.980 -10.716 Start of MODEL 2 1 H GLY 1 1H GLY 1 7.558 -4.264 14.866 2 HA2 GLY 1 2HA GLY 1 5.427 -5.092 15.576 3 HA3 GLY 1 3HA GLY 1 5.275 -4.017 14.195 4 H SER 2 H SER 2 3.520 -4.788 13.135 5 HA SER 2 HA SER 2 2.577 -7.423 13.114 6 HB2 SER 2 2HB SER 2 2.016 -5.180 11.121 7 HB3 SER 2 3HB SER 2 1.009 -6.611 11.379 8 HG SER 2 HG SER 2 0.218 -4.830 12.546 9 H VAL 3 H VAL 3 2.668 -9.103 11.610 10 HA VAL 3 HA VAL 3 4.823 -9.337 9.764 11 HB VAL 3 HB VAL 3 3.740 -11.281 10.928 12 HG11 VAL 3 1HG1 VAL 3 1.645 -12.253 10.120 13 HG12 VAL 3 2HG1 VAL 3 1.439 -10.917 8.986 14 HG13 VAL 3 3HG1 VAL 3 1.384 -10.614 10.723 15 HG21 VAL 3 1HG2 VAL 3 5.173 -11.710 8.988 16 HG22 VAL 3 2HG2 VAL 3 3.798 -11.535 7.900 17 HG23 VAL 3 3HG2 VAL 3 3.852 -12.879 9.041 18 H VAL 4 H VAL 4 1.580 -8.145 9.560 19 HA VAL 4 HA VAL 4 1.100 -7.867 6.821 20 HB VAL 4 HB VAL 4 0.561 -5.698 8.922 21 HG11 VAL 4 1HG1 VAL 4 -0.906 -6.294 6.326 22 HG12 VAL 4 2HG1 VAL 4 0.179 -4.934 6.619 23 HG13 VAL 4 3HG1 VAL 4 -1.344 -5.049 7.500 24 HG21 VAL 4 1HG2 VAL 4 -1.190 -8.092 8.266 25 HG22 VAL 4 2HG2 VAL 4 -1.638 -6.750 9.322 26 HG23 VAL 4 3HG2 VAL 4 -0.309 -7.818 9.770 27 H LYS 5 H LYS 5 2.998 -5.911 9.072 28 HA LYS 5 HA LYS 5 3.523 -3.765 7.326 29 HB2 LYS 5 2HB LYS 5 3.751 -3.478 9.765 30 HB3 LYS 5 3HB LYS 5 5.189 -4.500 9.763 31 HG2 LYS 5 2HG LYS 5 6.478 -2.897 8.566 32 HG3 LYS 5 3HG LYS 5 5.049 -2.021 8.021 33 HD2 LYS 5 2HD LYS 5 4.660 -1.285 10.390 34 HD3 LYS 5 3HD LYS 5 6.175 -2.076 10.842 35 HE2 LYS 5 2HE LYS 5 6.434 0.370 10.481 36 HE3 LYS 5 3HE LYS 5 7.441 -0.583 9.390 37 HZ1 LYS 5 1HZ LYS 5 5.877 -0.215 7.621 38 HZ2 LYS 5 2HZ LYS 5 6.306 1.280 8.280 39 HZ3 LYS 5 3HZ LYS 5 4.810 0.591 8.653 40 H GLU 6 H GLU 6 5.770 -6.516 8.193 41 HA GLU 6 HA GLU 6 7.959 -5.730 6.694 42 HB2 GLU 6 2HB GLU 6 8.704 -8.071 6.763 43 HB3 GLU 6 3HB GLU 6 8.001 -7.611 8.307 44 HG2 GLU 6 2HG GLU 6 5.915 -8.804 7.724 45 HG3 GLU 6 3HG GLU 6 6.596 -9.235 6.162 46 H LYS 7 H LYS 7 5.145 -7.592 5.615 47 HA LYS 7 HA LYS 7 5.877 -8.080 2.941 48 HB2 LYS 7 2HB LYS 7 3.094 -7.652 4.101 49 HB3 LYS 7 3HB LYS 7 3.451 -8.425 2.560 50 HG2 LYS 7 2HG LYS 7 4.501 -10.299 3.638 51 HG3 LYS 7 3HG LYS 7 4.454 -9.493 5.210 52 HD2 LYS 7 2HD LYS 7 1.965 -9.571 5.156 53 HD3 LYS 7 3HD LYS 7 2.033 -10.417 3.607 54 HE2 LYS 7 2HE LYS 7 3.134 -11.435 6.242 55 HE3 LYS 7 3HE LYS 7 1.650 -11.975 5.460 56 HZ1 LYS 7 1HZ LYS 7 4.420 -12.322 4.467 57 HZ2 LYS 7 2HZ LYS 7 3.048 -12.675 3.551 58 HZ3 LYS 7 3HZ LYS 7 3.354 -13.535 4.978 59 H LEU 8 H LEU 8 4.174 -5.351 4.421 60 HA LEU 8 HA LEU 8 3.692 -3.837 2.053 61 HB2 LEU 8 2HB LEU 8 3.896 -2.983 4.966 62 HB3 LEU 8 3HB LEU 8 3.326 -1.942 3.674 63 HG LEU 8 HG LEU 8 1.940 -4.525 4.491 64 HD11 LEU 8 1HD1 LEU 8 1.219 -1.680 5.265 65 HD12 LEU 8 2HD1 LEU 8 1.893 -2.907 6.340 66 HD13 LEU 8 3HD1 LEU 8 0.291 -3.136 5.645 67 HD21 LEU 8 1HD2 LEU 8 0.049 -3.660 3.182 68 HD22 LEU 8 2HD2 LEU 8 1.481 -3.868 2.177 69 HD23 LEU 8 3HD2 LEU 8 1.006 -2.252 2.709 70 H GLU 9 H GLU 9 6.428 -4.084 4.278 71 HA GLU 9 HA GLU 9 7.861 -1.774 3.403 72 HB2 GLU 9 2HB GLU 9 8.940 -4.287 4.764 73 HB3 GLU 9 3HB GLU 9 9.817 -2.775 4.573 74 HG2 GLU 9 2HG GLU 9 7.326 -3.199 6.231 75 HG3 GLU 9 3HG GLU 9 8.963 -3.021 6.845 76 H LYS 10 H LYS 10 7.984 -5.235 2.550 77 HA LYS 10 HA LYS 10 10.029 -5.157 0.633 78 HB2 LYS 10 2HB LYS 10 7.569 -6.960 0.781 79 HB3 LYS 10 3HB LYS 10 8.925 -7.236 -0.307 80 HG2 LYS 10 2HG LYS 10 9.097 -7.221 2.722 81 HG3 LYS 10 3HG LYS 10 8.998 -8.667 1.715 82 HD2 LYS 10 2HD LYS 10 11.150 -8.101 0.658 83 HD3 LYS 10 3HD LYS 10 11.246 -6.614 1.603 84 HE2 LYS 10 2HE LYS 10 11.453 -7.891 3.670 85 HE3 LYS 10 3HE LYS 10 11.204 -9.407 2.796 86 HZ1 LYS 10 1HZ LYS 10 13.557 -8.931 3.282 87 HZ2 LYS 10 2HZ LYS 10 13.472 -7.552 2.311 88 HZ3 LYS 10 3HZ LYS 10 13.252 -9.079 1.625 89 H ALA 11 H ALA 11 6.500 -4.904 0.286 90 HA ALA 11 HA ALA 11 6.241 -4.471 -2.425 91 HB1 ALA 11 1HB ALA 11 4.054 -3.476 -1.894 92 HB2 ALA 11 2HB ALA 11 4.531 -3.304 -0.202 93 HB3 ALA 11 3HB ALA 11 4.352 -4.910 -0.910 94 H LEU 12 H LEU 12 6.617 -2.033 0.163 95 HA LEU 12 HA LEU 12 6.613 0.333 -1.238 96 HB2 LEU 12 2HB LEU 12 8.144 -0.523 1.229 97 HB3 LEU 12 3HB LEU 12 8.402 1.081 0.569 98 HG LEU 12 HG LEU 12 5.741 0.007 1.590 99 HD11 LEU 12 1HD1 LEU 12 7.614 2.068 2.807 100 HD12 LEU 12 2HD1 LEU 12 7.354 0.424 3.396 101 HD13 LEU 12 3HD1 LEU 12 6.035 1.589 3.441 102 HD21 LEU 12 1HD2 LEU 12 5.389 1.600 -0.249 103 HD22 LEU 12 2HD2 LEU 12 6.431 2.783 0.545 104 HD23 LEU 12 3HD2 LEU 12 4.901 2.312 1.289 105 H ILE 13 H ILE 13 9.484 -1.705 -0.600 106 HA ILE 13 HA ILE 13 11.402 -0.172 -1.968 107 HB ILE 13 HB ILE 13 11.415 -3.204 -1.520 108 HG12 ILE 13 2HG1 ILE 13 12.635 -1.024 0.246 109 HG13 ILE 13 3HG1 ILE 13 11.137 -1.872 0.599 110 HG21 ILE 13 1HG2 ILE 13 13.891 -3.042 -1.697 111 HG22 ILE 13 2HG2 ILE 13 13.750 -1.327 -2.085 112 HG23 ILE 13 3HG2 ILE 13 13.098 -2.535 -3.190 113 HD11 ILE 13 1HD1 ILE 13 13.877 -3.115 0.430 114 HD12 ILE 13 2HD1 ILE 13 12.373 -3.982 0.754 115 HD13 ILE 13 3HD1 ILE 13 12.957 -2.772 1.895 116 H GLU 14 H GLU 14 9.515 -3.029 -3.072 117 HA GLU 14 HA GLU 14 10.785 -3.328 -5.556 118 HB2 GLU 14 2HB GLU 14 8.004 -4.292 -4.782 119 HB3 GLU 14 3HB GLU 14 8.982 -4.905 -6.111 120 HG2 GLU 14 2HG GLU 14 9.563 -5.171 -3.155 121 HG3 GLU 14 3HG GLU 14 9.062 -6.450 -4.246 122 H VAL 15 H VAL 15 7.831 -1.593 -4.647 123 HA VAL 15 HA VAL 15 7.316 -0.827 -7.427 124 HB VAL 15 HB VAL 15 5.176 -0.017 -6.729 125 HG11 VAL 15 1HG1 VAL 15 5.714 -2.582 -5.181 126 HG12 VAL 15 2HG1 VAL 15 5.312 -2.462 -6.895 127 HG13 VAL 15 3HG1 VAL 15 4.126 -1.987 -5.680 128 HG21 VAL 15 1HG2 VAL 15 6.061 -0.264 -3.828 129 HG22 VAL 15 2HG2 VAL 15 4.426 0.133 -4.360 130 HG23 VAL 15 3HG2 VAL 15 5.758 1.230 -4.718 131 H ARG 16 H ARG 16 9.049 0.389 -4.786 132 HA ARG 16 HA ARG 16 8.679 3.142 -4.862 133 HB2 ARG 16 2HB ARG 16 10.252 2.101 -3.281 134 HB3 ARG 16 3HB ARG 16 11.388 1.779 -4.586 135 HG2 ARG 16 2HG ARG 16 11.632 4.231 -4.950 136 HG3 ARG 16 3HG ARG 16 10.519 4.525 -3.612 137 HD2 ARG 16 2HD ARG 16 12.094 3.428 -2.061 138 HD3 ARG 16 3HD ARG 16 13.209 3.133 -3.404 139 HE ARG 16 HE ARG 16 12.464 5.906 -3.041 140 HH11 ARG 16 1HH1 ARG 16 14.809 3.440 -2.107 141 HH12 ARG 16 2HH1 ARG 16 16.015 4.609 -1.657 142 HH21 ARG 16 1HH2 ARG 16 14.049 7.402 -2.466 143 HH22 ARG 16 2HH2 ARG 16 15.583 6.852 -1.859 144 HA PRO 17 HA PRO 17 11.655 3.675 -8.800 145 HB2 PRO 17 2HB PRO 17 11.301 1.029 -10.170 146 HB3 PRO 17 3HB PRO 17 12.767 2.012 -9.970 147 HG2 PRO 17 2HG PRO 17 12.397 -0.252 -8.590 148 HG3 PRO 17 3HG PRO 17 13.239 1.145 -7.874 149 HD2 PRO 17 2HD PRO 17 10.429 0.174 -7.435 150 HD3 PRO 17 3HD PRO 17 11.595 0.843 -6.270 151 H TYR 18 H TYR 18 8.610 2.120 -8.559 152 HA TYR 18 HA TYR 18 7.673 2.964 -11.228 153 HB2 TYR 18 2HB TYR 18 6.389 1.112 -9.157 154 HB3 TYR 18 3HB TYR 18 5.706 1.492 -10.734 155 HD1 TYR 18 HD1 TYR 18 8.730 -0.075 -9.127 156 HD2 TYR 18 HD2 TYR 18 6.254 0.117 -12.615 157 HE1 TYR 18 HE1 TYR 18 9.938 -1.984 -10.094 158 HE2 TYR 18 HE2 TYR 18 7.469 -1.796 -13.570 159 HH TYR 18 HH TYR 18 9.703 -2.878 -13.333 160 H VAL 19 H VAL 19 7.232 3.634 -7.773 161 HA VAL 19 HA VAL 19 4.753 5.154 -8.316 162 HB VAL 19 HB VAL 19 4.228 5.078 -5.930 163 HG11 VAL 19 1HG1 VAL 19 3.745 2.683 -5.690 164 HG12 VAL 19 2HG1 VAL 19 4.893 2.310 -6.980 165 HG13 VAL 19 3HG1 VAL 19 3.435 3.239 -7.337 166 HG21 VAL 19 1HG2 VAL 19 5.541 3.753 -4.293 167 HG22 VAL 19 2HG2 VAL 19 6.476 5.106 -4.930 168 HG23 VAL 19 3HG2 VAL 19 6.784 3.473 -5.517 169 H GLU 20 H GLU 20 4.617 7.262 -8.025 170 HA GLU 20 HA GLU 20 6.726 8.883 -6.850 171 HB2 GLU 20 2HB GLU 20 3.926 9.615 -7.819 172 HB3 GLU 20 3HB GLU 20 5.126 10.770 -7.244 173 HG2 GLU 20 2HG GLU 20 6.636 9.984 -9.122 174 HG3 GLU 20 3HG GLU 20 5.263 9.064 -9.727 175 H TYR 21 H TYR 21 6.214 10.313 -4.999 176 HA TYR 21 HA TYR 21 5.500 10.812 -2.922 177 HB2 TYR 21 2HB TYR 21 2.910 9.605 -3.984 178 HB3 TYR 21 3HB TYR 21 3.018 10.410 -2.415 179 HD1 TYR 21 HD1 TYR 21 3.756 12.839 -2.326 180 HD2 TYR 21 HD2 TYR 21 2.717 10.934 -6.009 181 HE1 TYR 21 HE1 TYR 21 3.542 15.033 -3.400 182 HE2 TYR 21 HE2 TYR 21 2.506 13.136 -7.074 183 HH TYR 21 HH TYR 21 2.128 15.438 -6.487 184 H TYR 22 H TYR 22 7.020 8.638 -3.175 185 HA TYR 22 HA TYR 22 6.349 6.251 -1.995 186 HB2 TYR 22 2HB TYR 22 8.526 6.573 -3.063 187 HB3 TYR 22 3HB TYR 22 9.011 7.732 -1.825 188 HD1 TYR 22 HD1 TYR 22 7.906 4.146 -2.186 189 HD2 TYR 22 HD2 TYR 22 10.272 6.929 0.047 190 HE1 TYR 22 HE1 TYR 22 8.780 2.322 -0.813 191 HE2 TYR 22 HE2 TYR 22 11.145 5.078 1.416 192 HH TYR 22 HH TYR 22 10.421 2.784 2.079 193 H ASN 23 H ASN 23 7.233 9.283 -0.334 194 HA ASN 23 HA ASN 23 7.364 8.153 2.299 195 HB2 ASN 23 2HB ASN 23 7.129 11.042 1.356 196 HB3 ASN 23 3HB ASN 23 7.205 10.610 3.061 197 HD21 ASN 23 1HD2 ASN 23 9.017 10.880 0.108 198 HD22 ASN 23 2HD2 ASN 23 10.572 10.590 0.801 199 H GLU 24 H GLU 24 4.772 9.633 0.407 200 HA GLU 24 HA GLU 24 2.814 9.891 2.444 201 HB2 GLU 24 2HB GLU 24 2.659 9.692 -0.598 202 HB3 GLU 24 3HB GLU 24 1.214 9.864 0.387 203 HG2 GLU 24 2HG GLU 24 2.021 11.991 -0.639 204 HG3 GLU 24 3HG GLU 24 1.847 12.053 1.110 205 H LEU 25 H LEU 25 3.292 7.472 -0.109 206 HA LEU 25 HA LEU 25 1.409 5.560 0.593 207 HB2 LEU 25 2HB LEU 25 2.697 5.768 -1.558 208 HB3 LEU 25 3HB LEU 25 4.126 5.165 -0.733 209 HG LEU 25 HG LEU 25 3.008 2.973 -0.394 210 HD11 LEU 25 1HD1 LEU 25 0.668 3.717 -0.252 211 HD12 LEU 25 2HD1 LEU 25 0.858 2.462 -1.471 212 HD13 LEU 25 3HD1 LEU 25 0.682 4.146 -1.967 213 HD21 LEU 25 1HD2 LEU 25 3.079 2.233 -2.736 214 HD22 LEU 25 2HD2 LEU 25 4.390 3.361 -2.408 215 HD23 LEU 25 3HD2 LEU 25 2.961 3.904 -3.292 216 H LYS 26 H LYS 26 4.789 5.847 1.495 217 HA LYS 26 HA LYS 26 5.151 3.669 3.199 218 HB2 LYS 26 2HB LYS 26 6.940 5.240 2.388 219 HB3 LYS 26 3HB LYS 26 6.375 6.436 3.547 220 HG2 LYS 26 2HG LYS 26 6.992 4.925 5.408 221 HG3 LYS 26 3HG LYS 26 7.529 3.712 4.242 222 HD2 LYS 26 2HD LYS 26 9.457 4.937 5.125 223 HD3 LYS 26 3HD LYS 26 9.260 5.275 3.404 224 HE2 LYS 26 2HE LYS 26 9.811 7.321 4.637 225 HE3 LYS 26 3HE LYS 26 8.190 7.437 3.953 226 HZ1 LYS 26 1HZ LYS 26 8.839 6.770 6.777 227 HZ2 LYS 26 2HZ LYS 26 7.281 6.884 6.134 228 HZ3 LYS 26 3HZ LYS 26 8.261 8.258 6.222 229 H ALA 27 H ALA 27 3.682 6.847 3.923 230 HA ALA 27 HA ALA 27 3.387 6.457 6.742 231 HB1 ALA 27 1HB ALA 27 1.934 8.453 6.648 232 HB2 ALA 27 2HB ALA 27 1.933 8.376 4.883 233 HB3 ALA 27 3HB ALA 27 3.432 8.707 5.751 234 H LEU 28 H LEU 28 1.287 5.982 3.915 235 HA LEU 28 HA LEU 28 -1.088 5.231 5.202 236 HB2 LEU 28 2HB LEU 28 -0.920 5.897 2.824 237 HB3 LEU 28 3HB LEU 28 -0.015 4.437 2.466 238 HG LEU 28 HG LEU 28 -1.993 3.051 2.930 239 HD11 LEU 28 1HD1 LEU 28 -3.054 4.353 4.704 240 HD12 LEU 28 2HD1 LEU 28 -4.200 4.027 3.408 241 HD13 LEU 28 3HD1 LEU 28 -3.473 5.629 3.556 242 HD21 LEU 28 1HD2 LEU 28 -1.681 3.904 0.649 243 HD22 LEU 28 2HD2 LEU 28 -2.643 5.335 1.034 244 HD23 LEU 28 3HD2 LEU 28 -3.393 3.737 1.035 245 H VAL 29 H VAL 29 1.573 3.292 3.922 246 HA VAL 29 HA VAL 29 0.890 0.720 4.608 247 HB VAL 29 HB VAL 29 3.460 2.215 4.156 248 HG11 VAL 29 1HG1 VAL 29 3.521 -0.563 5.373 249 HG12 VAL 29 2HG1 VAL 29 4.170 0.920 6.091 250 HG13 VAL 29 3HG1 VAL 29 4.902 0.248 4.625 251 HG21 VAL 29 1HG2 VAL 29 2.327 -0.330 2.950 252 HG22 VAL 29 2HG2 VAL 29 3.788 0.495 2.407 253 HG23 VAL 29 3HG2 VAL 29 2.221 1.292 2.258 254 H SER 30 H SER 30 2.563 3.125 6.575 255 HA SER 30 HA SER 30 2.926 1.362 8.830 256 HB2 SER 30 2HB SER 30 3.330 4.353 8.520 257 HB3 SER 30 3HB SER 30 3.799 3.434 9.951 258 HG SER 30 HG SER 30 5.573 3.547 8.633 259 H LYS 31 H LYS 31 0.453 3.597 7.854 260 HA LYS 31 HA LYS 31 -0.989 3.852 10.288 261 HB2 LYS 31 2HB LYS 31 -1.261 5.427 8.406 262 HB3 LYS 31 3HB LYS 31 -1.863 4.139 7.372 263 HG2 LYS 31 2HG LYS 31 -3.887 3.945 8.755 264 HG3 LYS 31 3HG LYS 31 -3.268 5.180 9.857 265 HD2 LYS 31 2HD LYS 31 -3.290 6.838 8.002 266 HD3 LYS 31 3HD LYS 31 -3.932 5.608 6.910 267 HE2 LYS 31 2HE LYS 31 -5.337 6.620 9.407 268 HE3 LYS 31 3HE LYS 31 -5.668 7.172 7.766 269 HZ1 LYS 31 1HZ LYS 31 -7.270 5.539 8.425 270 HZ2 LYS 31 2HZ LYS 31 -6.063 4.425 8.813 271 HZ3 LYS 31 3HZ LYS 31 -6.302 4.888 7.203 272 H ILE 32 H ILE 32 -1.443 1.775 7.396 273 HA ILE 32 HA ILE 32 -3.689 0.374 8.474 274 HB ILE 32 HB ILE 32 -3.544 -1.121 6.496 275 HG12 ILE 32 2HG1 ILE 32 -0.987 0.419 5.858 276 HG13 ILE 32 3HG1 ILE 32 -1.103 -1.289 6.247 277 HG21 ILE 32 1HG2 ILE 32 -3.985 0.589 4.771 278 HG22 ILE 32 2HG2 ILE 32 -3.235 1.823 5.786 279 HG23 ILE 32 3HG2 ILE 32 -4.725 1.037 6.310 280 HD11 ILE 32 1HD1 ILE 32 -2.199 0.027 3.767 281 HD12 ILE 32 2HD1 ILE 32 -2.277 -1.696 4.152 282 HD13 ILE 32 3HD1 ILE 32 -0.715 -0.917 3.891 283 H SER 33 H SER 33 -0.223 -0.462 8.193 284 HA SER 33 HA SER 33 0.026 -2.976 9.144 285 HB2 SER 33 2HB SER 33 1.640 -0.565 10.068 286 HB3 SER 33 3HB SER 33 2.112 -2.234 10.386 287 HG SER 33 HG SER 33 1.551 -1.467 7.756 288 H SER 34 H SER 34 -0.673 -0.159 11.176 289 HA SER 34 HA SER 34 -0.774 -1.684 13.654 290 HB2 SER 34 2HB SER 34 0.234 0.579 13.612 291 HB3 SER 34 3HB SER 34 -1.306 1.273 13.103 292 HG SER 34 HG SER 34 -1.229 -0.280 15.440 293 H SER 35 H SER 35 -2.991 -0.445 11.259 294 HA SER 35 HA SER 35 -5.290 -0.242 13.028 295 HB2 SER 35 2HB SER 35 -4.822 1.380 11.158 296 HB3 SER 35 3HB SER 35 -5.163 0.100 9.996 297 HG SER 35 HG SER 35 -7.280 -0.014 10.876 298 H VAL 36 H VAL 36 -4.182 -2.436 10.472 299 HA VAL 36 HA VAL 36 -6.615 -4.081 10.664 300 HB VAL 36 HB VAL 36 -6.053 -5.058 8.563 301 HG11 VAL 36 1HG1 VAL 36 -5.515 -2.081 8.364 302 HG12 VAL 36 2HG1 VAL 36 -7.094 -2.872 8.369 303 HG13 VAL 36 3HG1 VAL 36 -5.986 -3.132 7.023 304 HG21 VAL 36 1HG2 VAL 36 -3.346 -3.676 8.622 305 HG22 VAL 36 2HG2 VAL 36 -3.990 -4.607 7.271 306 HG23 VAL 36 3HG2 VAL 36 -3.640 -5.405 8.801 307 H ASN 37 H ASN 37 -6.390 -6.435 10.735 308 HA ASN 37 HA ASN 37 -4.246 -7.271 12.554 309 HB2 ASN 37 2HB ASN 37 -5.595 -9.302 12.959 310 HB3 ASN 37 3HB ASN 37 -6.552 -7.844 13.199 311 HD21 ASN 37 1HD2 ASN 37 -8.271 -7.426 11.793 312 HD22 ASN 37 2HD2 ASN 37 -8.873 -8.607 10.684 313 H ASP 38 H ASP 38 -5.188 -7.795 9.190 314 HA ASP 38 HA ASP 38 -2.958 -9.692 8.807 315 HB2 ASP 38 2HB ASP 38 -5.058 -11.011 9.147 316 HB3 ASP 38 3HB ASP 38 -5.802 -10.162 7.796 317 H LEU 39 H LEU 39 -2.310 -9.919 6.552 318 HA LEU 39 HA LEU 39 -2.022 -7.472 5.205 319 HB2 LEU 39 2HB LEU 39 -0.486 -9.504 5.151 320 HB3 LEU 39 3HB LEU 39 -1.591 -10.243 4.015 321 HG LEU 39 HG LEU 39 0.541 -9.185 3.052 322 HD11 LEU 39 1HD1 LEU 39 -2.029 -8.210 1.824 323 HD12 LEU 39 2HD1 LEU 39 -1.296 -9.795 1.586 324 HD13 LEU 39 3HD1 LEU 39 -0.463 -8.350 1.019 325 HD21 LEU 39 1HD2 LEU 39 -0.893 -6.565 3.589 326 HD22 LEU 39 2HD2 LEU 39 0.601 -6.765 2.668 327 HD23 LEU 39 3HD2 LEU 39 0.576 -7.128 4.392 328 H GLU 40 H GLU 40 -4.321 -10.136 4.728 329 HA GLU 40 HA GLU 40 -5.532 -9.209 2.323 330 HB2 GLU 40 2HB GLU 40 -5.795 -11.513 3.167 331 HB3 GLU 40 3HB GLU 40 -6.699 -10.925 4.558 332 HG2 GLU 40 2HG GLU 40 -8.494 -10.132 3.044 333 HG3 GLU 40 3HG GLU 40 -7.580 -10.723 1.657 334 H GLU 41 H GLU 41 -6.087 -8.490 5.737 335 HA GLU 41 HA GLU 41 -8.416 -6.858 5.447 336 HB2 GLU 41 2HB GLU 41 -6.234 -6.830 7.565 337 HB3 GLU 41 3HB GLU 41 -7.726 -5.912 7.682 338 HG2 GLU 41 2HG GLU 41 -7.658 -8.923 7.456 339 HG3 GLU 41 3HG GLU 41 -7.611 -8.062 8.993 340 H ALA 42 H ALA 42 -4.949 -6.260 5.250 341 HA ALA 42 HA ALA 42 -5.025 -3.425 5.000 342 HB1 ALA 42 1HB ALA 42 -2.700 -3.621 4.180 343 HB2 ALA 42 2HB ALA 42 -2.889 -5.374 4.053 344 HB3 ALA 42 3HB ALA 42 -2.961 -4.590 5.631 345 H ILE 43 H ILE 43 -5.163 -6.106 2.702 346 HA ILE 43 HA ILE 43 -4.828 -4.695 0.293 347 HB ILE 43 HB ILE 43 -6.159 -7.355 0.953 348 HG12 ILE 43 2HG1 ILE 43 -3.618 -6.717 -0.624 349 HG13 ILE 43 3HG1 ILE 43 -3.655 -7.171 1.074 350 HG21 ILE 43 1HG2 ILE 43 -7.391 -6.513 -1.002 351 HG22 ILE 43 2HG2 ILE 43 -6.372 -7.878 -1.452 352 HG23 ILE 43 3HG2 ILE 43 -5.873 -6.236 -1.862 353 HD11 ILE 43 1HD1 ILE 43 -4.665 -9.351 0.388 354 HD12 ILE 43 2HD1 ILE 43 -3.019 -9.070 -0.176 355 HD13 ILE 43 3HD1 ILE 43 -4.376 -8.886 -1.293 356 H VAL 44 H VAL 44 -8.026 -6.027 1.421 357 HA VAL 44 HA VAL 44 -9.818 -4.593 0.051 358 HB VAL 44 HB VAL 44 -10.041 -5.093 3.057 359 HG11 VAL 44 1HG1 VAL 44 -12.232 -4.695 0.977 360 HG12 VAL 44 2HG1 VAL 44 -11.817 -3.590 2.289 361 HG13 VAL 44 3HG1 VAL 44 -12.499 -5.174 2.656 362 HG21 VAL 44 1HG2 VAL 44 -9.438 -7.161 1.855 363 HG22 VAL 44 2HG2 VAL 44 -10.801 -6.941 0.756 364 HG23 VAL 44 3HG2 VAL 44 -11.091 -7.253 2.469 365 H VAL 45 H VAL 45 -8.423 -3.372 3.150 366 HA VAL 45 HA VAL 45 -9.613 -0.833 3.209 367 HB VAL 45 HB VAL 45 -6.890 -1.721 4.267 368 HG11 VAL 45 1HG1 VAL 45 -6.802 0.386 5.595 369 HG12 VAL 45 2HG1 VAL 45 -8.218 0.983 4.726 370 HG13 VAL 45 3HG1 VAL 45 -6.709 0.695 3.860 371 HG21 VAL 45 1HG2 VAL 45 -8.004 -1.614 6.473 372 HG22 VAL 45 2HG2 VAL 45 -8.864 -2.702 5.384 373 HG23 VAL 45 3HG2 VAL 45 -9.504 -1.088 5.699 374 H LEU 46 H LEU 46 -6.605 -1.831 1.548 375 HA LEU 46 HA LEU 46 -5.932 0.771 0.552 376 HB2 LEU 46 2HB LEU 46 -4.960 -1.993 -0.201 377 HB3 LEU 46 3HB LEU 46 -4.386 -0.558 -1.037 378 HG LEU 46 HG LEU 46 -4.020 -1.131 1.929 379 HD11 LEU 46 1HD1 LEU 46 -2.658 -2.599 0.509 380 HD12 LEU 46 2HD1 LEU 46 -1.659 -1.457 1.402 381 HD13 LEU 46 3HD1 LEU 46 -1.977 -1.192 -0.315 382 HD21 LEU 46 1HD2 LEU 46 -4.208 1.272 1.530 383 HD22 LEU 46 2HD2 LEU 46 -2.977 1.187 0.267 384 HD23 LEU 46 3HD2 LEU 46 -2.551 0.843 1.946 385 H ARG 47 H ARG 47 -8.012 -1.779 -0.692 386 HA ARG 47 HA ARG 47 -8.266 -0.808 -3.363 387 HB2 ARG 47 2HB ARG 47 -10.213 -2.430 -1.665 388 HB3 ARG 47 3HB ARG 47 -10.387 -2.146 -3.396 389 HG2 ARG 47 2HG ARG 47 -8.308 -3.382 -3.831 390 HG3 ARG 47 3HG ARG 47 -8.088 -3.646 -2.099 391 HD2 ARG 47 2HD ARG 47 -10.121 -4.982 -1.998 392 HD3 ARG 47 3HD ARG 47 -10.478 -4.629 -3.694 393 HE ARG 47 HE ARG 47 -7.962 -5.814 -3.643 394 HH11 ARG 47 1HH1 ARG 47 -11.242 -6.741 -2.751 395 HH12 ARG 47 2HH1 ARG 47 -10.981 -8.426 -3.090 396 HH21 ARG 47 1HH2 ARG 47 -7.676 -8.007 -4.151 397 HH22 ARG 47 2HH2 ARG 47 -8.967 -9.136 -3.879 398 H GLU 48 H GLU 48 -9.635 0.080 -0.317 399 HA GLU 48 HA GLU 48 -11.682 1.873 -1.361 400 HB2 GLU 48 2HB GLU 48 -10.647 1.428 1.478 401 HB3 GLU 48 3HB GLU 48 -12.076 2.364 1.052 402 HG2 GLU 48 2HG GLU 48 -13.253 0.396 0.322 403 HG3 GLU 48 3HG GLU 48 -11.798 -0.589 0.419 404 H GLU 49 H GLU 49 -8.456 1.971 0.029 405 HA GLU 49 HA GLU 49 -8.173 4.763 0.364 406 HB2 GLU 49 2HB GLU 49 -6.012 2.673 -0.146 407 HB3 GLU 49 3HB GLU 49 -5.693 4.337 0.327 408 HG2 GLU 49 2HG GLU 49 -7.019 2.172 1.955 409 HG3 GLU 49 3HG GLU 49 -5.494 2.983 2.279 410 H GLU 50 H GLU 50 -7.345 2.626 -2.321 411 HA GLU 50 HA GLU 50 -6.274 4.461 -4.130 412 HB2 GLU 50 2HB GLU 50 -6.194 2.001 -4.413 413 HB3 GLU 50 3HB GLU 50 -7.922 1.956 -4.726 414 HG2 GLU 50 2HG GLU 50 -6.094 3.580 -6.499 415 HG3 GLU 50 3HG GLU 50 -6.217 1.849 -6.724 416 H LYS 51 H LYS 51 -9.693 3.348 -3.913 417 HA LYS 51 HA LYS 51 -10.806 4.910 -5.915 418 HB2 LYS 51 2HB LYS 51 -12.069 3.853 -3.352 419 HB3 LYS 51 3HB LYS 51 -12.994 4.542 -4.684 420 HG2 LYS 51 2HG LYS 51 -12.365 2.739 -6.164 421 HG3 LYS 51 3HG LYS 51 -11.183 2.128 -5.004 422 HD2 LYS 51 2HD LYS 51 -13.129 0.691 -4.922 423 HD3 LYS 51 3HD LYS 51 -13.059 1.611 -3.421 424 HE2 LYS 51 2HE LYS 51 -15.350 1.562 -4.125 425 HE3 LYS 51 3HE LYS 51 -14.766 3.197 -4.433 426 HZ1 LYS 51 1HZ LYS 51 -14.426 2.543 -6.767 427 HZ2 LYS 51 2HZ LYS 51 -16.042 2.424 -6.294 428 HZ3 LYS 51 3HZ LYS 51 -15.095 1.027 -6.436 429 H LYS 52 H LYS 52 -10.260 5.744 -2.496 430 HA LYS 52 HA LYS 52 -11.709 8.273 -2.707 431 HB2 LYS 52 2HB LYS 52 -11.337 8.556 -0.352 432 HB3 LYS 52 3HB LYS 52 -11.746 6.865 -0.603 433 HG2 LYS 52 2HG LYS 52 -9.317 6.292 -0.455 434 HG3 LYS 52 3HG LYS 52 -8.967 7.987 -0.121 435 HD2 LYS 52 2HD LYS 52 -8.980 6.706 1.964 436 HD3 LYS 52 3HD LYS 52 -10.318 7.856 1.957 437 HE2 LYS 52 2HE LYS 52 -11.910 6.095 1.482 438 HE3 LYS 52 3HE LYS 52 -10.613 4.925 1.222 439 HZ1 LYS 52 1HZ LYS 52 -10.031 5.038 3.523 440 HZ2 LYS 52 2HZ LYS 52 -11.690 4.734 3.411 441 HZ3 LYS 52 3HZ LYS 52 -11.141 6.279 3.811 442 H ALA 53 H ALA 53 -8.451 7.146 -3.060 443 HA ALA 53 HA ALA 53 -7.034 9.569 -2.557 444 HB1 ALA 53 1HB ALA 53 -5.130 8.477 -3.678 445 HB2 ALA 53 2HB ALA 53 -6.196 7.188 -4.256 446 HB3 ALA 53 3HB ALA 53 -5.903 7.385 -2.527 447 H SER 54 H SER 54 -6.104 11.010 -4.003 448 HA SER 54 HA SER 54 -7.304 11.205 -6.705 449 HB2 SER 54 2HB SER 54 -7.777 13.116 -5.144 450 HB3 SER 54 3HB SER 54 -6.043 13.401 -4.988 451 HG SER 54 HG SER 54 -7.644 13.633 -7.323 452 H GLU 55 H GLU 55 -5.801 12.094 -8.368 453 HA GLU 55 HA GLU 55 -3.557 10.288 -8.477 454 HB2 GLU 55 2HB GLU 55 -4.569 12.296 -10.538 455 HB3 GLU 55 3HB GLU 55 -3.407 11.005 -10.845 456 HG2 GLU 55 2HG GLU 55 -5.107 9.314 -10.332 457 HG3 GLU 55 3HG GLU 55 -6.274 10.578 -9.951 458 HA PRO 56 HA PRO 56 -1.648 10.123 -9.912 459 HB2 PRO 56 2HB PRO 56 1.015 9.783 -9.627 460 HB3 PRO 56 3HB PRO 56 0.358 11.026 -10.715 461 HG2 PRO 56 2HG PRO 56 1.444 11.348 -7.938 462 HG3 PRO 56 3HG PRO 56 1.745 12.337 -9.386 463 HD2 PRO 56 2HD PRO 56 -0.089 13.013 -7.431 464 HD3 PRO 56 3HD PRO 56 -0.202 13.555 -9.120 465 H PHE 57 H PHE 57 -1.365 10.775 -6.567 466 HA PHE 57 HA PHE 57 -0.238 8.438 -5.537 467 HB2 PHE 57 2HB PHE 57 -0.641 10.553 -4.257 468 HB3 PHE 57 3HB PHE 57 -2.360 10.174 -4.204 469 HD1 PHE 57 HD1 PHE 57 0.820 8.249 -3.545 470 HD2 PHE 57 HD2 PHE 57 -3.004 9.466 -2.050 471 HE1 PHE 57 HE1 PHE 57 1.210 6.981 -1.487 472 HE2 PHE 57 HE2 PHE 57 -2.595 8.185 0.012 473 HZ PHE 57 HZ PHE 57 -0.487 6.941 0.296 474 H LYS 58 H LYS 58 -3.454 8.969 -6.771 475 HA LYS 58 HA LYS 58 -4.839 6.755 -5.796 476 HB2 LYS 58 2HB LYS 58 -5.672 8.693 -7.302 477 HB3 LYS 58 3HB LYS 58 -5.119 7.725 -8.666 478 HG2 LYS 58 2HG LYS 58 -6.626 5.867 -7.879 479 HG3 LYS 58 3HG LYS 58 -7.213 6.952 -6.619 480 HD2 LYS 58 2HD LYS 58 -8.830 7.052 -8.350 481 HD3 LYS 58 3HD LYS 58 -7.912 8.555 -8.475 482 HE2 LYS 58 2HE LYS 58 -8.323 7.581 -10.688 483 HE3 LYS 58 3HE LYS 58 -6.595 7.582 -10.329 484 HZ1 LYS 58 1HZ LYS 58 -8.365 5.231 -9.929 485 HZ2 LYS 58 2HZ LYS 58 -6.679 5.266 -9.831 486 HZ3 LYS 58 3HZ LYS 58 -7.444 5.488 -11.322 487 H THR 59 H THR 59 -2.498 6.949 -8.413 488 HA THR 59 HA THR 59 -2.833 4.165 -9.218 489 HB THR 59 HB THR 59 -0.880 6.281 -10.227 490 HG1 THR 59 HG1 THR 59 -2.494 6.940 -11.429 491 HG21 THR 59 1HG2 THR 59 -0.093 3.982 -10.757 492 HG22 THR 59 2HG2 THR 59 -0.618 4.824 -12.214 493 HG23 THR 59 3HG2 THR 59 -1.662 3.608 -11.476 494 H ASP 60 H ASP 60 -0.535 6.217 -7.538 495 HA ASP 60 HA ASP 60 1.558 4.407 -7.133 496 HB2 ASP 60 2HB ASP 60 0.649 6.650 -5.277 497 HB3 ASP 60 3HB ASP 60 2.222 5.854 -5.218 498 H ILE 61 H ILE 61 -1.457 4.815 -5.303 499 HA ILE 61 HA ILE 61 -0.919 2.822 -3.329 500 HB ILE 61 HB ILE 61 -3.597 3.907 -4.323 501 HG12 ILE 61 2HG1 ILE 61 -2.019 4.453 -1.763 502 HG13 ILE 61 3HG1 ILE 61 -2.165 5.558 -3.125 503 HG21 ILE 61 1HG2 ILE 61 -3.088 2.043 -1.958 504 HG22 ILE 61 2HG2 ILE 61 -3.964 1.633 -3.433 505 HG23 ILE 61 3HG2 ILE 61 -4.630 2.826 -2.318 506 HD11 ILE 61 1HD1 ILE 61 -3.604 6.212 -1.311 507 HD12 ILE 61 2HD1 ILE 61 -4.402 4.642 -1.334 508 HD13 ILE 61 3HD1 ILE 61 -4.565 5.736 -2.709 509 H ARG 62 H ARG 62 -2.732 2.706 -6.509 510 HA ARG 62 HA ARG 62 -3.454 -0.002 -6.155 511 HB2 ARG 62 2HB ARG 62 -4.313 -0.037 -8.357 512 HB3 ARG 62 3HB ARG 62 -4.580 1.579 -7.751 513 HG2 ARG 62 2HG ARG 62 -3.995 1.958 -9.958 514 HG3 ARG 62 3HG ARG 62 -2.462 2.207 -9.131 515 HD2 ARG 62 2HD ARG 62 -2.365 0.873 -11.294 516 HD3 ARG 62 3HD ARG 62 -1.605 0.103 -9.898 517 HE ARG 62 HE ARG 62 -4.383 -0.624 -10.444 518 HH11 ARG 62 1HH1 ARG 62 -0.997 -1.537 -10.863 519 HH12 ARG 62 2HH1 ARG 62 -1.376 -3.202 -11.176 520 HH21 ARG 62 1HH2 ARG 62 -4.834 -2.828 -10.805 521 HH22 ARG 62 2HH2 ARG 62 -3.531 -3.928 -11.142 522 H ILE 63 H ILE 63 -0.427 1.313 -7.467 523 HA ILE 63 HA ILE 63 0.549 -1.130 -8.600 524 HB ILE 63 HB ILE 63 2.192 1.223 -7.536 525 HG12 ILE 63 2HG1 ILE 63 1.324 0.734 -10.429 526 HG13 ILE 63 3HG1 ILE 63 0.505 1.843 -9.341 527 HG21 ILE 63 1HG2 ILE 63 3.560 -0.811 -7.842 528 HG22 ILE 63 2HG2 ILE 63 3.994 0.414 -9.031 529 HG23 ILE 63 3HG2 ILE 63 2.994 -0.960 -9.507 530 HD11 ILE 63 1HD1 ILE 63 3.366 2.075 -10.272 531 HD12 ILE 63 2HD1 ILE 63 2.549 3.183 -9.166 532 HD13 ILE 63 3HD1 ILE 63 1.992 3.030 -10.830 533 H LEU 64 H LEU 64 0.956 0.405 -5.413 534 HA LEU 64 HA LEU 64 2.615 -1.462 -4.108 535 HB2 LEU 64 2HB LEU 64 1.913 0.889 -3.369 536 HB3 LEU 64 3HB LEU 64 0.367 0.230 -2.897 537 HG LEU 64 HG LEU 64 1.873 0.693 -0.975 538 HD11 LEU 64 1HD1 LEU 64 0.162 -1.011 -0.652 539 HD12 LEU 64 2HD1 LEU 64 1.603 -1.356 0.300 540 HD13 LEU 64 3HD1 LEU 64 1.285 -2.266 -1.180 541 HD21 LEU 64 1HD2 LEU 64 4.022 0.263 -2.031 542 HD22 LEU 64 2HD2 LEU 64 3.679 -1.468 -2.082 543 HD23 LEU 64 3HD2 LEU 64 3.863 -0.646 -0.531 544 H LEU 65 H LEU 65 -0.867 -1.089 -4.076 545 HA LEU 65 HA LEU 65 -1.696 -3.225 -2.527 546 HB2 LEU 65 2HB LEU 65 -3.159 -1.384 -2.984 547 HB3 LEU 65 3HB LEU 65 -3.013 -1.600 -4.719 548 HG LEU 65 HG LEU 65 -4.353 -3.682 -4.580 549 HD11 LEU 65 1HD1 LEU 65 -4.608 -3.065 -1.625 550 HD12 LEU 65 2HD1 LEU 65 -3.823 -4.464 -2.360 551 HD13 LEU 65 3HD1 LEU 65 -5.564 -4.258 -2.507 552 HD21 LEU 65 1HD2 LEU 65 -6.523 -2.620 -4.136 553 HD22 LEU 65 2HD2 LEU 65 -5.470 -1.556 -5.062 554 HD23 LEU 65 3HD2 LEU 65 -5.715 -1.269 -3.336 555 H ASP 66 H ASP 66 -2.110 -3.100 -6.119 556 HA ASP 66 HA ASP 66 -2.601 -5.577 -6.917 557 HB2 ASP 66 2HB ASP 66 -2.195 -3.643 -8.407 558 HB3 ASP 66 3HB ASP 66 -0.474 -3.707 -8.076 559 H PHE 67 H PHE 67 0.765 -4.463 -6.353 560 HA PHE 67 HA PHE 67 2.154 -6.821 -6.782 561 HB2 PHE 67 2HB PHE 67 3.241 -4.628 -6.440 562 HB3 PHE 67 3HB PHE 67 2.798 -4.655 -4.736 563 HD1 PHE 67 HD1 PHE 67 4.913 -6.314 -7.318 564 HD2 PHE 67 HD2 PHE 67 4.146 -5.869 -3.134 565 HE1 PHE 67 HE1 PHE 67 6.985 -7.532 -6.799 566 HE2 PHE 67 HE2 PHE 67 6.222 -7.083 -2.628 567 HZ PHE 67 HZ PHE 67 7.639 -7.915 -4.459 568 H LEU 68 H LEU 68 0.565 -5.803 -3.732 569 HA LEU 68 HA LEU 68 1.395 -7.959 -2.071 570 HB2 LEU 68 2HB LEU 68 -1.162 -6.319 -1.918 571 HB3 LEU 68 3HB LEU 68 -0.565 -7.362 -0.639 572 HG LEU 68 HG LEU 68 0.899 -4.889 -1.641 573 HD11 LEU 68 1HD1 LEU 68 0.123 -3.781 0.393 574 HD12 LEU 68 2HD1 LEU 68 -0.809 -5.208 0.851 575 HD13 LEU 68 3HD1 LEU 68 -1.247 -4.290 -0.593 576 HD21 LEU 68 1HD2 LEU 68 2.261 -5.148 0.403 577 HD22 LEU 68 2HD2 LEU 68 2.414 -6.549 -0.653 578 HD23 LEU 68 3HD2 LEU 68 1.405 -6.644 0.794 579 H GLU 69 H GLU 69 -1.323 -7.593 -4.314 580 HA GLU 69 HA GLU 69 -2.530 -10.162 -3.660 581 HB2 GLU 69 2HB GLU 69 -3.126 -8.185 -5.899 582 HB3 GLU 69 3HB GLU 69 -4.120 -9.574 -5.477 583 HG2 GLU 69 2HG GLU 69 -4.585 -8.531 -3.261 584 HG3 GLU 69 3HG GLU 69 -3.625 -7.132 -3.748 585 H SER 70 H SER 70 -0.110 -8.949 -5.752 586 HA SER 70 HA SER 70 1.246 -9.704 -7.355 587 HB2 SER 70 2HB SER 70 1.818 -12.114 -7.483 588 HB3 SER 70 3HB SER 70 1.768 -11.564 -5.812 589 HG SER 70 HG SER 70 -0.365 -12.899 -7.114 590 H LYS 71 H LYS 71 -1.057 -8.720 -8.255 591 HA LYS 71 HA LYS 71 -2.605 -10.482 -9.917 592 HB2 LYS 71 2HB LYS 71 -2.498 -7.455 -10.231 593 HB3 LYS 71 3HB LYS 71 -3.836 -8.540 -10.598 594 HG2 LYS 71 2HG LYS 71 -4.177 -8.940 -8.189 595 HG3 LYS 71 3HG LYS 71 -2.809 -7.888 -7.822 596 HD2 LYS 71 2HD LYS 71 -4.765 -6.573 -7.460 597 HD3 LYS 71 3HD LYS 71 -4.082 -6.003 -8.984 598 HE2 LYS 71 2HE LYS 71 -6.519 -6.207 -9.135 599 HE3 LYS 71 3HE LYS 71 -5.745 -7.366 -10.219 600 HZ1 LYS 71 1HZ LYS 71 -6.787 -8.000 -7.507 601 HZ2 LYS 71 2HZ LYS 71 -6.136 -9.104 -8.613 602 HZ3 LYS 71 3HZ LYS 71 -7.598 -8.328 -8.956 603 HA PRO 72 HA PRO 72 0.230 -10.254 -13.504 604 HB2 PRO 72 2HB PRO 72 -1.379 -11.454 -15.386 605 HB3 PRO 72 3HB PRO 72 -0.570 -12.369 -14.097 606 HG2 PRO 72 2HG PRO 72 -3.415 -11.428 -14.235 607 HG3 PRO 72 3HG PRO 72 -2.774 -12.999 -13.700 608 HD2 PRO 72 2HD PRO 72 -3.514 -11.032 -11.949 609 HD3 PRO 72 3HD PRO 72 -2.233 -12.208 -11.584 Start of MODEL 3 1 H GLY 1 1H GLY 1 6.568 -7.062 16.364 2 HA2 GLY 1 2HA GLY 1 4.217 -6.565 16.586 3 HA3 GLY 1 3HA GLY 1 4.957 -5.698 15.244 4 H SER 2 H SER 2 3.590 -5.624 13.547 5 HA SER 2 HA SER 2 1.688 -7.782 13.009 6 HB2 SER 2 2HB SER 2 2.094 -5.085 11.654 7 HB3 SER 2 3HB SER 2 0.775 -6.206 11.316 8 HG SER 2 HG SER 2 -0.126 -4.963 12.805 9 H VAL 3 H VAL 3 2.220 -9.410 11.656 10 HA VAL 3 HA VAL 3 4.367 -9.575 9.868 11 HB VAL 3 HB VAL 3 2.951 -11.501 10.738 12 HG11 VAL 3 1HG1 VAL 3 0.942 -12.204 9.504 13 HG12 VAL 3 2HG1 VAL 3 1.014 -10.737 8.527 14 HG13 VAL 3 3HG1 VAL 3 0.712 -10.626 10.260 15 HG21 VAL 3 1HG2 VAL 3 3.519 -11.449 7.758 16 HG22 VAL 3 2HG2 VAL 3 3.212 -12.910 8.696 17 HG23 VAL 3 3HG2 VAL 3 4.632 -11.923 9.040 18 H VAL 4 H VAL 4 1.368 -7.974 9.593 19 HA VAL 4 HA VAL 4 0.870 -7.633 6.867 20 HB VAL 4 HB VAL 4 0.644 -5.366 8.912 21 HG11 VAL 4 1HG1 VAL 4 0.171 -4.747 6.589 22 HG12 VAL 4 2HG1 VAL 4 -1.277 -4.645 7.585 23 HG13 VAL 4 3HG1 VAL 4 -1.062 -6.008 6.486 24 HG21 VAL 4 1HG2 VAL 4 -1.320 -7.660 8.583 25 HG22 VAL 4 2HG2 VAL 4 -1.598 -6.208 9.545 26 HG23 VAL 4 3HG2 VAL 4 -0.313 -7.330 9.992 27 H LYS 5 H LYS 5 2.930 -5.836 9.099 28 HA LYS 5 HA LYS 5 3.404 -3.627 7.434 29 HB2 LYS 5 2HB LYS 5 3.652 -3.597 9.931 30 HB3 LYS 5 3HB LYS 5 5.163 -4.490 9.764 31 HG2 LYS 5 2HG LYS 5 6.110 -2.626 8.439 32 HG3 LYS 5 3HG LYS 5 4.592 -1.742 8.614 33 HD2 LYS 5 2HD LYS 5 4.922 -1.626 11.056 34 HD3 LYS 5 3HD LYS 5 6.414 -2.562 10.905 35 HE2 LYS 5 2HE LYS 5 5.905 0.193 9.739 36 HE3 LYS 5 3HE LYS 5 6.919 -0.186 11.130 37 HZ1 LYS 5 1HZ LYS 5 8.256 0.119 9.176 38 HZ2 LYS 5 2HZ LYS 5 7.382 -1.057 8.337 39 HZ3 LYS 5 3HZ LYS 5 8.340 -1.501 9.659 40 H GLU 6 H GLU 6 5.706 -6.268 8.280 41 HA GLU 6 HA GLU 6 7.877 -5.547 6.763 42 HB2 GLU 6 2HB GLU 6 8.568 -7.920 6.985 43 HB3 GLU 6 3HB GLU 6 7.926 -7.279 8.491 44 HG2 GLU 6 2HG GLU 6 5.735 -8.387 7.982 45 HG3 GLU 6 3HG GLU 6 6.464 -9.083 6.542 46 H LYS 7 H LYS 7 5.144 -7.611 5.731 47 HA LYS 7 HA LYS 7 6.025 -8.233 3.133 48 HB2 LYS 7 2HB LYS 7 3.168 -7.886 4.125 49 HB3 LYS 7 3HB LYS 7 3.628 -8.667 2.618 50 HG2 LYS 7 2HG LYS 7 4.833 -10.411 3.891 51 HG3 LYS 7 3HG LYS 7 4.324 -9.641 5.399 52 HD2 LYS 7 2HD LYS 7 1.943 -10.006 4.753 53 HD3 LYS 7 3HD LYS 7 2.475 -10.824 3.283 54 HE2 LYS 7 2HE LYS 7 2.976 -11.728 6.125 55 HE3 LYS 7 3HE LYS 7 1.829 -12.436 4.996 56 HZ1 LYS 7 1HZ LYS 7 4.781 -12.412 4.715 57 HZ2 LYS 7 2HZ LYS 7 3.707 -13.025 3.569 58 HZ3 LYS 7 3HZ LYS 7 3.819 -13.749 5.087 59 H LEU 8 H LEU 8 4.082 -5.522 4.324 60 HA LEU 8 HA LEU 8 3.663 -4.193 1.859 61 HB2 LEU 8 2HB LEU 8 3.723 -3.130 4.710 62 HB3 LEU 8 3HB LEU 8 3.223 -2.174 3.326 63 HG LEU 8 HG LEU 8 1.799 -4.677 4.310 64 HD11 LEU 8 1HD1 LEU 8 1.587 -2.807 5.892 65 HD12 LEU 8 2HD1 LEU 8 0.048 -3.183 5.125 66 HD13 LEU 8 3HD1 LEU 8 0.974 -1.772 4.601 67 HD21 LEU 8 1HD2 LEU 8 0.992 -2.697 2.157 68 HD22 LEU 8 2HD2 LEU 8 0.015 -4.044 2.750 69 HD23 LEU 8 3HD2 LEU 8 1.525 -4.361 1.903 70 H GLU 9 H GLU 9 6.309 -4.115 4.240 71 HA GLU 9 HA GLU 9 7.701 -1.849 3.273 72 HB2 GLU 9 2HB GLU 9 8.874 -4.265 4.722 73 HB3 GLU 9 3HB GLU 9 9.686 -2.724 4.487 74 HG2 GLU 9 2HG GLU 9 7.258 -3.264 6.192 75 HG3 GLU 9 3HG GLU 9 8.877 -2.875 6.747 76 H LYS 10 H LYS 10 8.037 -5.323 2.536 77 HA LYS 10 HA LYS 10 10.167 -5.243 0.712 78 HB2 LYS 10 2HB LYS 10 7.768 -7.136 0.745 79 HB3 LYS 10 3HB LYS 10 9.248 -7.409 -0.166 80 HG2 LYS 10 2HG LYS 10 9.002 -7.309 2.851 81 HG3 LYS 10 3HG LYS 10 9.191 -8.761 1.869 82 HD2 LYS 10 2HD LYS 10 11.429 -7.973 1.143 83 HD3 LYS 10 3HD LYS 10 11.236 -6.517 2.123 84 HE2 LYS 10 2HE LYS 10 11.369 -9.371 3.159 85 HE3 LYS 10 3HE LYS 10 12.633 -8.147 3.295 86 HZ1 LYS 10 1HZ LYS 10 11.099 -6.813 4.631 87 HZ2 LYS 10 2HZ LYS 10 11.417 -8.311 5.340 88 HZ3 LYS 10 3HZ LYS 10 9.947 -8.047 4.551 89 H ALA 11 H ALA 11 6.673 -5.157 0.195 90 HA ALA 11 HA ALA 11 6.555 -4.919 -2.575 91 HB1 ALA 11 1HB ALA 11 4.244 -4.143 -2.209 92 HB2 ALA 11 2HB ALA 11 4.603 -3.864 -0.502 93 HB3 ALA 11 3HB ALA 11 4.639 -5.501 -1.155 94 H LEU 12 H LEU 12 6.595 -2.393 -0.073 95 HA LEU 12 HA LEU 12 6.340 -0.070 -1.534 96 HB2 LEU 12 2HB LEU 12 7.785 -0.708 1.045 97 HB3 LEU 12 3HB LEU 12 7.901 0.909 0.377 98 HG LEU 12 HG LEU 12 5.270 -0.426 1.117 99 HD11 LEU 12 1HD1 LEU 12 6.909 1.582 2.703 100 HD12 LEU 12 2HD1 LEU 12 6.615 -0.107 3.125 101 HD13 LEU 12 3HD1 LEU 12 5.277 1.037 3.108 102 HD21 LEU 12 1HD2 LEU 12 4.320 1.848 0.916 103 HD22 LEU 12 2HD2 LEU 12 5.010 1.300 -0.608 104 HD23 LEU 12 3HD2 LEU 12 5.890 2.464 0.386 105 H ILE 13 H ILE 13 9.365 -1.764 -0.688 106 HA ILE 13 HA ILE 13 11.145 -0.005 -1.994 107 HB ILE 13 HB ILE 13 11.544 -2.960 -1.323 108 HG12 ILE 13 2HG1 ILE 13 12.340 -0.513 0.330 109 HG13 ILE 13 3HG1 ILE 13 10.918 -1.496 0.644 110 HG21 ILE 13 1HG2 ILE 13 13.972 -2.477 -1.359 111 HG22 ILE 13 2HG2 ILE 13 13.644 -0.821 -1.869 112 HG23 ILE 13 3HG2 ILE 13 13.239 -2.166 -2.934 113 HD11 ILE 13 1HD1 ILE 13 12.695 -2.074 2.157 114 HD12 ILE 13 2HD1 ILE 13 13.782 -2.415 0.811 115 HD13 ILE 13 3HD1 ILE 13 12.363 -3.430 1.079 116 H GLU 14 H GLU 14 9.663 -3.092 -3.054 117 HA GLU 14 HA GLU 14 10.925 -3.412 -5.519 118 HB2 GLU 14 2HB GLU 14 8.159 -4.312 -4.609 119 HB3 GLU 14 3HB GLU 14 8.905 -4.840 -6.114 120 HG2 GLU 14 2HG GLU 14 9.962 -5.356 -3.322 121 HG3 GLU 14 3HG GLU 14 9.157 -6.527 -4.366 122 H VAL 15 H VAL 15 7.981 -1.594 -4.708 123 HA VAL 15 HA VAL 15 7.559 -0.797 -7.488 124 HB VAL 15 HB VAL 15 5.407 0.065 -6.779 125 HG11 VAL 15 1HG1 VAL 15 5.894 -2.671 -5.541 126 HG12 VAL 15 2HG1 VAL 15 5.533 -2.341 -7.237 127 HG13 VAL 15 3HG1 VAL 15 4.322 -2.007 -6.000 128 HG21 VAL 15 1HG2 VAL 15 6.232 -0.538 -3.909 129 HG22 VAL 15 2HG2 VAL 15 4.612 -0.054 -4.413 130 HG23 VAL 15 3HG2 VAL 15 5.966 1.056 -4.617 131 H ARG 16 H ARG 16 9.185 0.369 -4.758 132 HA ARG 16 HA ARG 16 8.764 3.046 -4.520 133 HB2 ARG 16 2HB ARG 16 10.411 1.906 -3.124 134 HB3 ARG 16 3HB ARG 16 11.524 1.759 -4.484 135 HG2 ARG 16 2HG ARG 16 11.751 4.215 -4.567 136 HG3 ARG 16 3HG ARG 16 10.608 4.375 -3.236 137 HD2 ARG 16 2HD ARG 16 12.201 3.097 -1.787 138 HD3 ARG 16 3HD ARG 16 13.363 3.107 -3.124 139 HE ARG 16 HE ARG 16 12.381 5.730 -2.417 140 HH11 ARG 16 1HH1 ARG 16 14.861 3.346 -1.627 141 HH12 ARG 16 2HH1 ARG 16 15.930 4.527 -0.936 142 HH21 ARG 16 1HH2 ARG 16 13.766 7.241 -1.488 143 HH22 ARG 16 2HH2 ARG 16 15.305 6.743 -0.858 144 HA PRO 17 HA PRO 17 11.694 4.468 -8.179 145 HB2 PRO 17 2HB PRO 17 12.206 2.698 -10.225 146 HB3 PRO 17 3HB PRO 17 13.251 2.859 -8.799 147 HG2 PRO 17 2HG PRO 17 11.099 0.826 -9.324 148 HG3 PRO 17 3HG PRO 17 12.747 0.578 -8.703 149 HD2 PRO 17 2HD PRO 17 10.627 0.632 -7.048 150 HD3 PRO 17 3HD PRO 17 12.196 1.316 -6.564 151 H TYR 18 H TYR 18 8.835 2.589 -8.477 152 HA TYR 18 HA TYR 18 8.006 3.784 -11.042 153 HB2 TYR 18 2HB TYR 18 6.685 1.584 -9.389 154 HB3 TYR 18 3HB TYR 18 6.165 2.123 -10.984 155 HD1 TYR 18 HD1 TYR 18 7.784 1.806 -12.959 156 HD2 TYR 18 HD2 TYR 18 8.374 -0.122 -9.185 157 HE1 TYR 18 HE1 TYR 18 9.298 0.186 -14.018 158 HE2 TYR 18 HE2 TYR 18 9.894 -1.736 -10.256 159 HH TYR 18 HH TYR 18 11.121 -1.307 -13.401 160 H VAL 19 H VAL 19 7.183 3.786 -7.598 161 HA VAL 19 HA VAL 19 4.606 5.073 -8.067 162 HB VAL 19 HB VAL 19 4.210 4.849 -5.649 163 HG11 VAL 19 1HG1 VAL 19 5.134 2.267 -6.940 164 HG12 VAL 19 2HG1 VAL 19 3.554 3.028 -7.137 165 HG13 VAL 19 3HG1 VAL 19 4.036 2.397 -5.562 166 HG21 VAL 19 1HG2 VAL 19 6.958 3.557 -5.468 167 HG22 VAL 19 2HG2 VAL 19 5.760 3.602 -4.170 168 HG23 VAL 19 3HG2 VAL 19 6.481 5.101 -4.756 169 H GLU 20 H GLU 20 4.203 7.162 -7.893 170 HA GLU 20 HA GLU 20 6.111 9.119 -6.956 171 HB2 GLU 20 2HB GLU 20 4.513 9.631 -8.779 172 HB3 GLU 20 3HB GLU 20 3.159 9.353 -7.689 173 HG2 GLU 20 2HG GLU 20 3.555 11.752 -8.055 174 HG3 GLU 20 3HG GLU 20 3.772 11.309 -6.364 175 H TYR 21 H TYR 21 5.824 10.441 -5.055 176 HA TYR 21 HA TYR 21 5.493 10.850 -2.865 177 HB2 TYR 21 2HB TYR 21 2.700 9.910 -3.602 178 HB3 TYR 21 3HB TYR 21 3.096 10.624 -2.044 179 HD1 TYR 21 HD1 TYR 21 4.910 12.815 -2.733 180 HD2 TYR 21 HD2 TYR 21 1.350 11.526 -4.723 181 HE1 TYR 21 HE1 TYR 21 4.612 15.068 -3.653 182 HE2 TYR 21 HE2 TYR 21 1.062 13.788 -5.640 183 HH TYR 21 HH TYR 21 3.481 16.112 -5.618 184 H TYR 22 H TYR 22 6.877 8.656 -3.233 185 HA TYR 22 HA TYR 22 6.134 6.259 -2.083 186 HB2 TYR 22 2HB TYR 22 8.308 6.552 -3.215 187 HB3 TYR 22 3HB TYR 22 8.878 7.580 -1.900 188 HD1 TYR 22 HD1 TYR 22 7.380 4.155 -2.382 189 HD2 TYR 22 HD2 TYR 22 10.233 6.516 -0.233 190 HE1 TYR 22 HE1 TYR 22 8.107 2.175 -1.151 191 HE2 TYR 22 HE2 TYR 22 10.948 4.501 1.006 192 HH TYR 22 HH TYR 22 9.878 2.250 1.635 193 H ASN 23 H ASN 23 7.146 9.215 -0.444 194 HA ASN 23 HA ASN 23 7.334 8.102 2.192 195 HB2 ASN 23 2HB ASN 23 7.111 10.991 1.258 196 HB3 ASN 23 3HB ASN 23 7.380 10.527 2.938 197 HD21 ASN 23 1HD2 ASN 23 9.399 9.605 3.515 198 HD22 ASN 23 2HD2 ASN 23 10.791 9.745 2.503 199 H GLU 24 H GLU 24 4.681 9.577 0.347 200 HA GLU 24 HA GLU 24 2.859 9.866 2.525 201 HB2 GLU 24 2HB GLU 24 2.318 9.641 -0.470 202 HB3 GLU 24 3HB GLU 24 1.117 10.093 0.736 203 HG2 GLU 24 2HG GLU 24 3.641 11.645 0.123 204 HG3 GLU 24 3HG GLU 24 2.032 12.041 -0.474 205 H LEU 25 H LEU 25 3.055 7.470 -0.131 206 HA LEU 25 HA LEU 25 1.103 5.691 0.700 207 HB2 LEU 25 2HB LEU 25 2.151 5.705 -1.543 208 HB3 LEU 25 3HB LEU 25 3.664 5.142 -0.848 209 HG LEU 25 HG LEU 25 2.526 3.010 -0.183 210 HD11 LEU 25 1HD1 LEU 25 0.146 4.099 -1.726 211 HD12 LEU 25 2HD1 LEU 25 0.223 3.743 0.002 212 HD13 LEU 25 3HD1 LEU 25 0.329 2.432 -1.166 213 HD21 LEU 25 1HD2 LEU 25 3.839 3.157 -2.267 214 HD22 LEU 25 2HD2 LEU 25 2.380 3.603 -3.157 215 HD23 LEU 25 3HD2 LEU 25 2.508 2.012 -2.408 216 H LYS 26 H LYS 26 4.608 5.599 1.303 217 HA LYS 26 HA LYS 26 4.791 3.376 2.970 218 HB2 LYS 26 2HB LYS 26 6.746 4.687 2.064 219 HB3 LYS 26 3HB LYS 26 6.454 5.911 3.295 220 HG2 LYS 26 2HG LYS 26 6.934 4.250 5.064 221 HG3 LYS 26 3HG LYS 26 7.181 3.009 3.836 222 HD2 LYS 26 2HD LYS 26 9.353 3.784 4.559 223 HD3 LYS 26 3HD LYS 26 9.084 4.363 2.914 224 HE2 LYS 26 2HE LYS 26 10.088 6.131 4.261 225 HE3 LYS 26 3HE LYS 26 8.441 6.587 3.830 226 HZ1 LYS 26 1HZ LYS 26 7.714 5.953 6.033 227 HZ2 LYS 26 2HZ LYS 26 8.980 7.068 6.156 228 HZ3 LYS 26 3HZ LYS 26 9.269 5.426 6.435 229 H ALA 27 H ALA 27 3.720 6.670 3.824 230 HA ALA 27 HA ALA 27 3.580 6.239 6.658 231 HB1 ALA 27 1HB ALA 27 2.361 8.376 6.712 232 HB2 ALA 27 2HB ALA 27 2.219 8.353 4.950 233 HB3 ALA 27 3HB ALA 27 3.805 8.498 5.706 234 H LEU 28 H LEU 28 1.270 5.980 3.953 235 HA LEU 28 HA LEU 28 -1.062 5.447 5.446 236 HB2 LEU 28 2HB LEU 28 -1.050 6.145 3.058 237 HB3 LEU 28 3HB LEU 28 -0.359 4.596 2.606 238 HG LEU 28 HG LEU 28 -2.437 3.447 3.317 239 HD11 LEU 28 1HD1 LEU 28 -4.466 4.690 3.933 240 HD12 LEU 28 2HD1 LEU 28 -3.555 6.201 3.944 241 HD13 LEU 28 3HD1 LEU 28 -3.179 4.932 5.112 242 HD21 LEU 28 1HD2 LEU 28 -3.908 4.235 1.505 243 HD22 LEU 28 2HD2 LEU 28 -2.230 4.171 0.978 244 HD23 LEU 28 3HD2 LEU 28 -2.969 5.726 1.372 245 H VAL 29 H VAL 29 1.381 3.290 4.019 246 HA VAL 29 HA VAL 29 0.537 0.794 4.918 247 HB VAL 29 HB VAL 29 3.250 1.982 4.286 248 HG11 VAL 29 1HG1 VAL 29 2.871 -0.847 5.338 249 HG12 VAL 29 2HG1 VAL 29 3.832 0.445 6.068 250 HG13 VAL 29 3HG1 VAL 29 4.326 -0.258 4.527 251 HG21 VAL 29 1HG2 VAL 29 1.629 -0.240 2.987 252 HG22 VAL 29 2HG2 VAL 29 3.186 0.364 2.412 253 HG23 VAL 29 3HG2 VAL 29 1.778 1.424 2.412 254 H SER 30 H SER 30 2.550 3.197 6.529 255 HA SER 30 HA SER 30 3.150 1.718 8.874 256 HB2 SER 30 2HB SER 30 4.465 3.670 8.118 257 HB3 SER 30 3HB SER 30 3.107 4.740 8.477 258 HG SER 30 HG SER 30 4.308 3.072 10.439 259 H LYS 31 H LYS 31 0.480 3.774 7.989 260 HA LYS 31 HA LYS 31 -0.841 3.953 10.498 261 HB2 LYS 31 2HB LYS 31 -1.255 5.550 8.664 262 HB3 LYS 31 3HB LYS 31 -1.865 4.258 7.640 263 HG2 LYS 31 2HG LYS 31 -3.747 3.934 9.264 264 HG3 LYS 31 3HG LYS 31 -3.156 5.337 10.162 265 HD2 LYS 31 2HD LYS 31 -3.463 6.729 8.099 266 HD3 LYS 31 3HD LYS 31 -4.137 5.315 7.281 267 HE2 LYS 31 2HE LYS 31 -5.932 6.762 8.072 268 HE3 LYS 31 3HE LYS 31 -5.964 5.239 8.968 269 HZ1 LYS 31 1HZ LYS 31 -4.899 7.848 9.915 270 HZ2 LYS 31 2HZ LYS 31 -4.726 6.399 10.760 271 HZ3 LYS 31 3HZ LYS 31 -6.267 7.037 10.489 272 H ILE 32 H ILE 32 -1.426 1.927 7.577 273 HA ILE 32 HA ILE 32 -3.755 0.703 8.655 274 HB ILE 32 HB ILE 32 -3.791 -0.748 6.657 275 HG12 ILE 32 2HG1 ILE 32 -1.101 0.509 5.955 276 HG13 ILE 32 3HG1 ILE 32 -1.372 -1.172 6.388 277 HG21 ILE 32 1HG2 ILE 32 -3.188 2.159 5.988 278 HG22 ILE 32 2HG2 ILE 32 -4.748 1.512 6.492 279 HG23 ILE 32 3HG2 ILE 32 -4.055 1.027 4.946 280 HD11 ILE 32 1HD1 ILE 32 -1.037 -0.887 4.005 281 HD12 ILE 32 2HD1 ILE 32 -2.427 0.193 3.914 282 HD13 ILE 32 3HD1 ILE 32 -2.653 -1.504 4.348 283 H SER 33 H SER 33 -0.419 -0.535 8.226 284 HA SER 33 HA SER 33 -0.617 -3.089 9.187 285 HB2 SER 33 2HB SER 33 1.621 -1.112 9.780 286 HB3 SER 33 3HB SER 33 1.751 -2.875 9.889 287 HG SER 33 HG SER 33 2.046 -1.319 7.747 288 H SER 34 H SER 34 -0.511 -0.131 11.096 289 HA SER 34 HA SER 34 -0.304 -1.357 13.691 290 HB2 SER 34 2HB SER 34 0.538 0.940 13.184 291 HB3 SER 34 3HB SER 34 -1.116 1.483 12.915 292 HG SER 34 HG SER 34 0.238 1.259 15.228 293 H SER 35 H SER 35 -2.867 -0.611 11.530 294 HA SER 35 HA SER 35 -4.983 -0.543 13.553 295 HB2 SER 35 2HB SER 35 -5.054 -0.153 10.532 296 HB3 SER 35 3HB SER 35 -6.412 0.116 11.633 297 HG SER 35 HG SER 35 -3.911 1.479 11.760 298 H VAL 36 H VAL 36 -3.921 -2.574 10.827 299 HA VAL 36 HA VAL 36 -6.269 -4.309 11.060 300 HB VAL 36 HB VAL 36 -5.810 -5.138 8.848 301 HG11 VAL 36 1HG1 VAL 36 -6.012 -3.098 7.469 302 HG12 VAL 36 2HG1 VAL 36 -5.502 -2.119 8.849 303 HG13 VAL 36 3HG1 VAL 36 -7.017 -3.022 8.918 304 HG21 VAL 36 1HG2 VAL 36 -3.210 -3.558 8.848 305 HG22 VAL 36 2HG2 VAL 36 -3.878 -4.421 7.463 306 HG23 VAL 36 3HG2 VAL 36 -3.371 -5.313 8.894 307 H ASN 37 H ASN 37 -6.017 -6.587 10.999 308 HA ASN 37 HA ASN 37 -3.913 -7.458 12.810 309 HB2 ASN 37 2HB ASN 37 -6.346 -8.949 11.740 310 HB3 ASN 37 3HB ASN 37 -5.268 -9.542 12.999 311 HD21 ASN 37 1HD2 ASN 37 -8.137 -9.034 13.117 312 HD22 ASN 37 2HD2 ASN 37 -8.385 -7.895 14.389 313 H ASP 38 H ASP 38 -4.822 -7.963 9.402 314 HA ASP 38 HA ASP 38 -2.437 -9.592 8.969 315 HB2 ASP 38 2HB ASP 38 -5.251 -10.522 8.292 316 HB3 ASP 38 3HB ASP 38 -3.821 -11.193 7.516 317 H LEU 39 H LEU 39 -2.087 -10.005 6.600 318 HA LEU 39 HA LEU 39 -1.724 -7.473 5.384 319 HB2 LEU 39 2HB LEU 39 -0.239 -9.551 5.218 320 HB3 LEU 39 3HB LEU 39 -1.373 -10.191 4.053 321 HG LEU 39 HG LEU 39 0.770 -9.164 3.112 322 HD11 LEU 39 1HD1 LEU 39 -1.767 -7.969 2.004 323 HD12 LEU 39 2HD1 LEU 39 -1.124 -9.571 1.643 324 HD13 LEU 39 3HD1 LEU 39 -0.222 -8.136 1.161 325 HD21 LEU 39 1HD2 LEU 39 0.917 -7.219 4.601 326 HD22 LEU 39 2HD2 LEU 39 -0.516 -6.520 3.842 327 HD23 LEU 39 3HD2 LEU 39 0.963 -6.744 2.904 328 H GLU 40 H GLU 40 -4.001 -10.126 4.771 329 HA GLU 40 HA GLU 40 -5.203 -9.169 2.407 330 HB2 GLU 40 2HB GLU 40 -5.487 -11.469 3.256 331 HB3 GLU 40 3HB GLU 40 -6.406 -10.864 4.629 332 HG2 GLU 40 2HG GLU 40 -8.119 -9.990 3.014 333 HG3 GLU 40 3HG GLU 40 -7.221 -10.767 1.712 334 H GLU 41 H GLU 41 -5.748 -8.366 5.798 335 HA GLU 41 HA GLU 41 -8.188 -6.895 5.463 336 HB2 GLU 41 2HB GLU 41 -6.154 -6.539 7.706 337 HB3 GLU 41 3HB GLU 41 -7.868 -6.155 7.756 338 HG2 GLU 41 2HG GLU 41 -6.653 -8.918 7.598 339 HG3 GLU 41 3HG GLU 41 -7.366 -8.174 9.028 340 H ALA 42 H ALA 42 -4.780 -6.152 5.356 341 HA ALA 42 HA ALA 42 -4.926 -3.301 5.192 342 HB1 ALA 42 1HB ALA 42 -2.722 -5.177 4.255 343 HB2 ALA 42 2HB ALA 42 -2.849 -4.424 5.843 344 HB3 ALA 42 3HB ALA 42 -2.577 -3.422 4.420 345 H ILE 43 H ILE 43 -4.846 -5.932 2.844 346 HA ILE 43 HA ILE 43 -4.535 -4.530 0.438 347 HB ILE 43 HB ILE 43 -5.852 -7.193 1.101 348 HG12 ILE 43 2HG1 ILE 43 -3.298 -6.519 -0.433 349 HG13 ILE 43 3HG1 ILE 43 -3.376 -7.071 1.235 350 HG21 ILE 43 1HG2 ILE 43 -7.102 -6.380 -0.842 351 HG22 ILE 43 2HG2 ILE 43 -6.069 -7.730 -1.301 352 HG23 ILE 43 3HG2 ILE 43 -5.599 -6.081 -1.715 353 HD11 ILE 43 1HD1 ILE 43 -2.725 -8.902 -0.122 354 HD12 ILE 43 2HD1 ILE 43 -4.064 -8.640 -1.240 355 HD13 ILE 43 3HD1 ILE 43 -4.383 -9.200 0.405 356 H VAL 44 H VAL 44 -7.666 -5.924 1.582 357 HA VAL 44 HA VAL 44 -9.515 -4.636 0.146 358 HB VAL 44 HB VAL 44 -9.746 -5.110 3.153 359 HG11 VAL 44 1HG1 VAL 44 -12.166 -5.404 2.762 360 HG12 VAL 44 2HG1 VAL 44 -11.950 -4.984 1.061 361 HG13 VAL 44 3HG1 VAL 44 -11.632 -3.782 2.312 362 HG21 VAL 44 1HG2 VAL 44 -10.601 -7.365 2.589 363 HG22 VAL 44 2HG2 VAL 44 -8.950 -7.141 2.019 364 HG23 VAL 44 3HG2 VAL 44 -10.290 -7.059 0.878 365 H VAL 45 H VAL 45 -8.242 -3.251 3.252 366 HA VAL 45 HA VAL 45 -9.561 -0.772 3.205 367 HB VAL 45 HB VAL 45 -6.765 -1.388 4.273 368 HG11 VAL 45 1HG1 VAL 45 -6.942 0.685 5.634 369 HG12 VAL 45 2HG1 VAL 45 -8.449 1.096 4.811 370 HG13 VAL 45 3HG1 VAL 45 -6.937 1.043 3.905 371 HG21 VAL 45 1HG2 VAL 45 -9.424 -1.155 5.736 372 HG22 VAL 45 2HG2 VAL 45 -7.862 -1.527 6.471 373 HG23 VAL 45 3HG2 VAL 45 -8.598 -2.664 5.343 374 H LEU 46 H LEU 46 -6.461 -1.639 1.620 375 HA LEU 46 HA LEU 46 -5.900 0.962 0.538 376 HB2 LEU 46 2HB LEU 46 -4.834 -1.782 -0.207 377 HB3 LEU 46 3HB LEU 46 -4.285 -0.311 -0.995 378 HG LEU 46 HG LEU 46 -3.960 -0.941 1.960 379 HD11 LEU 46 1HD1 LEU 46 -1.864 -0.941 -0.238 380 HD12 LEU 46 2HD1 LEU 46 -2.545 -2.369 0.545 381 HD13 LEU 46 3HD1 LEU 46 -1.581 -1.232 1.482 382 HD21 LEU 46 1HD2 LEU 46 -4.188 1.467 1.598 383 HD22 LEU 46 2HD2 LEU 46 -2.923 1.429 0.367 384 HD23 LEU 46 3HD2 LEU 46 -2.533 1.067 2.051 385 H ARG 47 H ARG 47 -7.845 -1.741 -0.615 386 HA ARG 47 HA ARG 47 -8.088 -0.879 -3.326 387 HB2 ARG 47 2HB ARG 47 -9.901 -2.740 -1.721 388 HB3 ARG 47 3HB ARG 47 -9.996 -2.495 -3.463 389 HG2 ARG 47 2HG ARG 47 -7.561 -3.299 -3.547 390 HG3 ARG 47 3HG ARG 47 -7.780 -3.815 -1.885 391 HD2 ARG 47 2HD ARG 47 -9.436 -4.765 -4.236 392 HD3 ARG 47 3HD ARG 47 -8.063 -5.636 -3.552 393 HE ARG 47 HE ARG 47 -10.364 -4.998 -1.828 394 HH11 ARG 47 1HH1 ARG 47 -8.396 -7.453 -3.452 395 HH12 ARG 47 2HH1 ARG 47 -9.132 -8.771 -2.595 396 HH21 ARG 47 1HH2 ARG 47 -11.387 -6.761 -0.810 397 HH22 ARG 47 2HH2 ARG 47 -10.826 -8.376 -1.097 398 H GLU 48 H GLU 48 -9.584 0.054 -0.378 399 HA GLU 48 HA GLU 48 -11.700 1.623 -1.639 400 HB2 GLU 48 2HB GLU 48 -10.794 1.569 1.274 401 HB3 GLU 48 3HB GLU 48 -12.295 2.256 0.655 402 HG2 GLU 48 2HG GLU 48 -13.036 0.001 -0.049 403 HG3 GLU 48 3HG GLU 48 -11.540 -0.684 0.583 404 H GLU 49 H GLU 49 -8.655 2.155 0.125 405 HA GLU 49 HA GLU 49 -8.630 4.960 0.227 406 HB2 GLU 49 2HB GLU 49 -6.264 3.041 0.111 407 HB3 GLU 49 3HB GLU 49 -6.119 4.757 0.476 408 HG2 GLU 49 2HG GLU 49 -7.586 2.688 2.125 409 HG3 GLU 49 3HG GLU 49 -6.050 3.452 2.523 410 H GLU 50 H GLU 50 -7.368 2.778 -2.214 411 HA GLU 50 HA GLU 50 -6.161 4.445 -4.060 412 HB2 GLU 50 2HB GLU 50 -6.242 1.925 -4.163 413 HB3 GLU 50 3HB GLU 50 -7.922 2.026 -4.676 414 HG2 GLU 50 2HG GLU 50 -6.972 3.470 -6.655 415 HG3 GLU 50 3HG GLU 50 -5.424 2.757 -6.201 416 H LYS 51 H LYS 51 -9.599 3.461 -3.951 417 HA LYS 51 HA LYS 51 -10.400 4.965 -6.233 418 HB2 LYS 51 2HB LYS 51 -12.109 3.664 -4.064 419 HB3 LYS 51 3HB LYS 51 -12.690 4.236 -5.626 420 HG2 LYS 51 2HG LYS 51 -11.273 2.547 -6.767 421 HG3 LYS 51 3HG LYS 51 -10.716 1.968 -5.196 422 HD2 LYS 51 2HD LYS 51 -12.462 0.474 -6.006 423 HD3 LYS 51 3HD LYS 51 -13.080 1.365 -4.614 424 HE2 LYS 51 2HE LYS 51 -14.258 2.917 -6.153 425 HE3 LYS 51 3HE LYS 51 -13.658 1.995 -7.529 426 HZ1 LYS 51 1HZ LYS 51 -14.876 0.073 -6.709 427 HZ2 LYS 51 2HZ LYS 51 -15.908 1.374 -6.999 428 HZ3 LYS 51 3HZ LYS 51 -15.476 0.975 -5.413 429 H LYS 52 H LYS 52 -10.204 5.689 -2.816 430 HA LYS 52 HA LYS 52 -11.859 8.066 -2.868 431 HB2 LYS 52 2HB LYS 52 -9.757 7.145 -0.856 432 HB3 LYS 52 3HB LYS 52 -10.890 8.470 -0.599 433 HG2 LYS 52 2HG LYS 52 -12.766 6.959 -0.538 434 HG3 LYS 52 3HG LYS 52 -11.765 5.610 -1.080 435 HD2 LYS 52 2HD LYS 52 -10.433 5.825 1.051 436 HD3 LYS 52 3HD LYS 52 -11.588 7.046 1.595 437 HE2 LYS 52 2HE LYS 52 -13.392 5.407 1.564 438 HE3 LYS 52 3HE LYS 52 -12.316 4.191 0.866 439 HZ1 LYS 52 1HZ LYS 52 -10.946 4.366 2.900 440 HZ2 LYS 52 2HZ LYS 52 -12.512 3.807 3.198 441 HZ3 LYS 52 3HZ LYS 52 -12.104 5.400 3.571 442 H ALA 53 H ALA 53 -8.518 7.273 -3.446 443 HA ALA 53 HA ALA 53 -7.511 9.995 -3.289 444 HB1 ALA 53 1HB ALA 53 -5.346 8.969 -3.858 445 HB2 ALA 53 2HB ALA 53 -6.147 7.423 -4.159 446 HB3 ALA 53 3HB ALA 53 -6.125 8.103 -2.530 447 H SER 54 H SER 54 -6.920 11.284 -4.997 448 HA SER 54 HA SER 54 -7.424 10.404 -7.766 449 HB2 SER 54 2HB SER 54 -6.654 13.146 -6.655 450 HB3 SER 54 3HB SER 54 -7.022 12.798 -8.347 451 HG SER 54 HG SER 54 -9.100 11.910 -7.252 452 H GLU 55 H GLU 55 -5.746 10.404 -9.316 453 HA GLU 55 HA GLU 55 -3.151 9.619 -8.473 454 HB2 GLU 55 2HB GLU 55 -4.200 10.457 -11.217 455 HB3 GLU 55 3HB GLU 55 -2.584 9.797 -10.951 456 HG2 GLU 55 2HG GLU 55 -3.563 7.724 -10.064 457 HG3 GLU 55 3HG GLU 55 -5.176 8.375 -10.306 458 HA PRO 56 HA PRO 56 -0.914 9.776 -9.398 459 HB2 PRO 56 2HB PRO 56 1.501 10.415 -8.420 460 HB3 PRO 56 3HB PRO 56 0.918 11.123 -9.938 461 HG2 PRO 56 2HG PRO 56 0.929 12.324 -7.190 462 HG3 PRO 56 3HG PRO 56 1.424 13.051 -8.736 463 HD2 PRO 56 2HD PRO 56 -1.053 13.464 -7.596 464 HD3 PRO 56 3HD PRO 56 -0.743 13.569 -9.343 465 H PHE 57 H PHE 57 -1.886 11.051 -6.304 466 HA PHE 57 HA PHE 57 -0.632 9.132 -4.654 467 HB2 PHE 57 2HB PHE 57 -1.853 11.168 -3.773 468 HB3 PHE 57 3HB PHE 57 -3.376 10.329 -4.074 469 HD1 PHE 57 HD1 PHE 57 -0.081 9.231 -2.582 470 HD2 PHE 57 HD2 PHE 57 -4.297 9.658 -1.985 471 HE1 PHE 57 HE1 PHE 57 0.116 8.134 -0.390 472 HE2 PHE 57 HE2 PHE 57 -4.084 8.561 0.211 473 HZ PHE 57 HZ PHE 57 -1.879 7.794 1.007 474 H LYS 58 H LYS 58 -3.574 8.912 -6.596 475 HA LYS 58 HA LYS 58 -4.231 6.234 -5.779 476 HB2 LYS 58 2HB LYS 58 -5.961 7.642 -6.737 477 HB3 LYS 58 3HB LYS 58 -5.071 7.811 -8.244 478 HG2 LYS 58 2HG LYS 58 -5.457 5.472 -8.797 479 HG3 LYS 58 3HG LYS 58 -6.163 5.170 -7.208 480 HD2 LYS 58 2HD LYS 58 -7.905 5.347 -8.956 481 HD3 LYS 58 3HD LYS 58 -8.073 6.616 -7.744 482 HE2 LYS 58 2HE LYS 58 -7.001 8.223 -9.275 483 HE3 LYS 58 3HE LYS 58 -6.804 6.954 -10.484 484 HZ1 LYS 58 1HZ LYS 58 -9.212 6.743 -10.584 485 HZ2 LYS 58 2HZ LYS 58 -8.722 8.313 -10.966 486 HZ3 LYS 58 3HZ LYS 58 -9.393 7.985 -9.450 487 H THR 59 H THR 59 -1.943 7.570 -8.054 488 HA THR 59 HA THR 59 -1.515 5.242 -9.630 489 HB THR 59 HB THR 59 0.493 7.487 -9.102 490 HG1 THR 59 HG1 THR 59 -1.608 7.229 -11.013 491 HG21 THR 59 1HG2 THR 59 1.527 5.517 -10.202 492 HG22 THR 59 2HG2 THR 59 1.447 6.895 -11.299 493 HG23 THR 59 3HG2 THR 59 0.294 5.567 -11.465 494 H ASP 60 H ASP 60 -0.048 6.411 -6.584 495 HA ASP 60 HA ASP 60 1.924 4.316 -6.590 496 HB2 ASP 60 2HB ASP 60 2.492 5.068 -4.274 497 HB3 ASP 60 3HB ASP 60 2.599 6.309 -5.502 498 H ILE 61 H ILE 61 -1.210 4.798 -5.013 499 HA ILE 61 HA ILE 61 -1.013 2.660 -3.174 500 HB ILE 61 HB ILE 61 -3.591 3.823 -4.348 501 HG12 ILE 61 2HG1 ILE 61 -2.220 4.440 -1.678 502 HG13 ILE 61 3HG1 ILE 61 -2.142 5.478 -3.094 503 HG21 ILE 61 1HG2 ILE 61 -3.218 2.077 -1.874 504 HG22 ILE 61 2HG2 ILE 61 -3.999 1.585 -3.376 505 HG23 ILE 61 3HG2 ILE 61 -4.736 2.831 -2.372 506 HD11 ILE 61 1HD1 ILE 61 -3.745 6.298 -1.470 507 HD12 ILE 61 2HD1 ILE 61 -4.639 4.781 -1.559 508 HD13 ILE 61 3HD1 ILE 61 -4.550 5.838 -2.969 509 H ARG 62 H ARG 62 -2.649 2.753 -6.417 510 HA ARG 62 HA ARG 62 -3.466 0.102 -6.498 511 HB2 ARG 62 2HB ARG 62 -3.589 0.325 -8.964 512 HB3 ARG 62 3HB ARG 62 -4.286 1.709 -8.138 513 HG2 ARG 62 2HG ARG 62 -2.506 3.129 -8.745 514 HG3 ARG 62 3HG ARG 62 -1.445 1.793 -9.150 515 HD2 ARG 62 2HD ARG 62 -2.130 2.761 -11.223 516 HD3 ARG 62 3HD ARG 62 -3.060 1.272 -11.065 517 HE ARG 62 HE ARG 62 -4.960 2.708 -10.293 518 HH11 ARG 62 1HH1 ARG 62 -2.436 4.112 -12.320 519 HH12 ARG 62 2HH1 ARG 62 -3.469 5.366 -12.936 520 HH21 ARG 62 1HH2 ARG 62 -6.292 4.396 -11.102 521 HH22 ARG 62 2HH2 ARG 62 -5.638 5.522 -12.250 522 H ILE 63 H ILE 63 -0.296 1.409 -7.634 523 HA ILE 63 HA ILE 63 0.659 -1.002 -8.791 524 HB ILE 63 HB ILE 63 2.257 1.381 -7.751 525 HG12 ILE 63 2HG1 ILE 63 1.347 0.706 -10.593 526 HG13 ILE 63 3HG1 ILE 63 0.600 1.913 -9.556 527 HG21 ILE 63 1HG2 ILE 63 4.120 0.610 -9.194 528 HG22 ILE 63 2HG2 ILE 63 3.201 -0.836 -9.616 529 HG23 ILE 63 3HG2 ILE 63 3.735 -0.586 -7.955 530 HD11 ILE 63 1HD1 ILE 63 2.642 3.235 -9.594 531 HD12 ILE 63 2HD1 ILE 63 2.047 2.920 -11.223 532 HD13 ILE 63 3HD1 ILE 63 3.426 2.016 -10.602 533 H LEU 64 H LEU 64 1.100 0.337 -5.502 534 HA LEU 64 HA LEU 64 2.731 -1.689 -4.393 535 HB2 LEU 64 2HB LEU 64 2.212 0.480 -3.262 536 HB3 LEU 64 3HB LEU 64 0.543 -0.024 -3.068 537 HG LEU 64 HG LEU 64 1.458 -1.988 -1.654 538 HD11 LEU 64 1HD1 LEU 64 3.782 -1.879 -2.337 539 HD12 LEU 64 2HD1 LEU 64 3.644 -1.661 -0.595 540 HD13 LEU 64 3HD1 LEU 64 3.946 -0.266 -1.635 541 HD21 LEU 64 1HD2 LEU 64 1.769 0.820 -0.541 542 HD22 LEU 64 2HD2 LEU 64 1.564 -0.657 0.403 543 HD23 LEU 64 3HD2 LEU 64 0.263 -0.096 -0.643 544 H LEU 65 H LEU 65 -0.734 -1.219 -4.418 545 HA LEU 65 HA LEU 65 -1.616 -3.335 -2.847 546 HB2 LEU 65 2HB LEU 65 -2.943 -1.367 -3.308 547 HB3 LEU 65 3HB LEU 65 -2.907 -1.684 -5.033 548 HG LEU 65 HG LEU 65 -4.334 -3.689 -4.671 549 HD11 LEU 65 1HD1 LEU 65 -5.481 -4.059 -2.559 550 HD12 LEU 65 2HD1 LEU 65 -4.568 -2.756 -1.798 551 HD13 LEU 65 3HD1 LEU 65 -3.739 -4.212 -2.352 552 HD21 LEU 65 1HD2 LEU 65 -5.233 -1.445 -5.298 553 HD22 LEU 65 2HD2 LEU 65 -5.583 -1.141 -3.594 554 HD23 LEU 65 3HD2 LEU 65 -6.388 -2.457 -4.447 555 H ASP 66 H ASP 66 -2.167 -3.103 -6.396 556 HA ASP 66 HA ASP 66 -2.659 -5.539 -7.275 557 HB2 ASP 66 2HB ASP 66 -2.481 -3.839 -8.892 558 HB3 ASP 66 3HB ASP 66 -0.895 -3.327 -8.342 559 H PHE 67 H PHE 67 0.786 -4.499 -6.871 560 HA PHE 67 HA PHE 67 2.115 -6.888 -7.280 561 HB2 PHE 67 2HB PHE 67 3.263 -4.728 -6.881 562 HB3 PHE 67 3HB PHE 67 2.790 -4.770 -5.187 563 HD1 PHE 67 HD1 PHE 67 5.063 -6.211 -7.726 564 HD2 PHE 67 HD2 PHE 67 3.977 -6.235 -3.586 565 HE1 PHE 67 HE1 PHE 67 7.134 -7.429 -7.181 566 HE2 PHE 67 HE2 PHE 67 6.053 -7.455 -3.057 567 HZ PHE 67 HZ PHE 67 7.628 -8.049 -4.850 568 H LEU 68 H LEU 68 0.725 -5.809 -4.136 569 HA LEU 68 HA LEU 68 1.487 -7.945 -2.468 570 HB2 LEU 68 2HB LEU 68 -1.036 -6.243 -2.351 571 HB3 LEU 68 3HB LEU 68 -0.501 -7.291 -1.050 572 HG LEU 68 HG LEU 68 1.183 -4.982 -2.064 573 HD11 LEU 68 1HD1 LEU 68 -0.800 -4.900 0.237 574 HD12 LEU 68 2HD1 LEU 68 -0.976 -4.079 -1.315 575 HD13 LEU 68 3HD1 LEU 68 0.324 -3.616 -0.223 576 HD21 LEU 68 1HD2 LEU 68 2.310 -5.198 0.122 577 HD22 LEU 68 2HD2 LEU 68 2.409 -6.691 -0.806 578 HD23 LEU 68 3HD2 LEU 68 1.266 -6.563 0.534 579 H GLU 69 H GLU 69 -1.434 -7.503 -4.449 580 HA GLU 69 HA GLU 69 -2.748 -9.912 -3.552 581 HB2 GLU 69 2HB GLU 69 -3.418 -8.077 -5.889 582 HB3 GLU 69 3HB GLU 69 -4.474 -9.298 -5.185 583 HG2 GLU 69 2HG GLU 69 -4.500 -8.005 -3.059 584 HG3 GLU 69 3HG GLU 69 -3.507 -6.769 -3.835 585 H SER 70 H SER 70 -0.615 -8.949 -6.072 586 HA SER 70 HA SER 70 0.443 -9.937 -7.797 587 HB2 SER 70 2HB SER 70 -0.453 -12.608 -6.630 588 HB3 SER 70 3HB SER 70 0.908 -12.328 -7.721 589 HG SER 70 HG SER 70 1.089 -10.750 -5.535 590 H LYS 71 H LYS 71 -2.383 -9.126 -7.979 591 HA LYS 71 HA LYS 71 -3.687 -10.973 -9.799 592 HB2 LYS 71 2HB LYS 71 -5.503 -9.161 -9.809 593 HB3 LYS 71 3HB LYS 71 -5.171 -9.932 -8.273 594 HG2 LYS 71 2HG LYS 71 -5.495 -7.662 -7.750 595 HG3 LYS 71 3HG LYS 71 -3.754 -7.909 -7.677 596 HD2 LYS 71 2HD LYS 71 -4.174 -5.788 -8.727 597 HD3 LYS 71 3HD LYS 71 -3.562 -6.887 -9.957 598 HE2 LYS 71 2HE LYS 71 -5.886 -7.221 -10.772 599 HE3 LYS 71 3HE LYS 71 -6.462 -6.074 -9.555 600 HZ1 LYS 71 1HZ LYS 71 -4.998 -4.389 -10.583 601 HZ2 LYS 71 2HZ LYS 71 -6.188 -4.952 -11.645 602 HZ3 LYS 71 3HZ LYS 71 -4.594 -5.499 -11.796 603 HA PRO 72 HA PRO 72 -2.453 -8.911 -13.636 604 HB2 PRO 72 2HB PRO 72 -5.169 -9.241 -14.816 605 HB3 PRO 72 3HB PRO 72 -3.644 -10.021 -15.278 606 HG2 PRO 72 2HG PRO 72 -5.631 -11.406 -14.095 607 HG3 PRO 72 3HG PRO 72 -3.915 -11.780 -13.809 608 HD2 PRO 72 2HD PRO 72 -5.811 -10.196 -12.066 609 HD3 PRO 72 3HD PRO 72 -4.646 -11.459 -11.602 Start of MODEL 4 1 H GLY 1 1H GLY 1 5.478 -5.163 14.044 2 HA2 GLY 1 2HA GLY 1 4.265 -5.910 15.988 3 HA3 GLY 1 3HA GLY 1 2.832 -5.085 15.391 4 H SER 2 H SER 2 1.852 -5.852 13.416 5 HA SER 2 HA SER 2 1.608 -8.665 13.254 6 HB2 SER 2 2HB SER 2 0.632 -6.508 11.323 7 HB3 SER 2 3HB SER 2 0.059 -8.179 11.364 8 HG SER 2 HG SER 2 -1.354 -6.883 12.518 9 H VAL 3 H VAL 3 2.229 -10.120 11.660 10 HA VAL 3 HA VAL 3 4.554 -9.865 10.106 11 HB VAL 3 HB VAL 3 3.599 -12.031 10.835 12 HG11 VAL 3 1HG1 VAL 3 1.663 -13.063 9.709 13 HG12 VAL 3 2HG1 VAL 3 1.406 -11.589 8.775 14 HG13 VAL 3 3HG1 VAL 3 1.210 -11.565 10.529 15 HG21 VAL 3 1HG2 VAL 3 5.211 -12.068 8.969 16 HG22 VAL 3 2HG2 VAL 3 3.894 -11.913 7.805 17 HG23 VAL 3 3HG2 VAL 3 4.024 -13.366 8.800 18 H VAL 4 H VAL 4 1.365 -8.856 9.471 19 HA VAL 4 HA VAL 4 1.213 -8.533 6.697 20 HB VAL 4 HB VAL 4 0.161 -6.558 8.781 21 HG11 VAL 4 1HG1 VAL 4 -0.853 -7.213 5.994 22 HG12 VAL 4 2HG1 VAL 4 -0.026 -5.734 6.481 23 HG13 VAL 4 3HG1 VAL 4 -1.626 -6.101 7.127 24 HG21 VAL 4 1HG2 VAL 4 -0.488 -8.853 9.417 25 HG22 VAL 4 2HG2 VAL 4 -1.182 -9.114 7.815 26 HG23 VAL 4 3HG2 VAL 4 -1.897 -7.919 8.903 27 H LYS 5 H LYS 5 2.615 -6.526 9.210 28 HA LYS 5 HA LYS 5 3.192 -4.145 7.964 29 HB2 LYS 5 2HB LYS 5 3.456 -4.463 10.365 30 HB3 LYS 5 3HB LYS 5 4.779 -5.594 10.116 31 HG2 LYS 5 2HG LYS 5 6.161 -3.742 9.190 32 HG3 LYS 5 3HG LYS 5 4.831 -2.617 9.505 33 HD2 LYS 5 2HD LYS 5 4.975 -3.071 11.913 34 HD3 LYS 5 3HD LYS 5 6.225 -4.288 11.637 35 HE2 LYS 5 2HE LYS 5 6.529 -1.335 10.984 36 HE3 LYS 5 3HE LYS 5 7.120 -2.098 12.463 37 HZ1 LYS 5 1HZ LYS 5 8.500 -3.547 11.068 38 HZ2 LYS 5 2HZ LYS 5 8.884 -1.915 10.890 39 HZ3 LYS 5 3HZ LYS 5 7.988 -2.707 9.694 40 H GLU 6 H GLU 6 5.552 -6.881 8.272 41 HA GLU 6 HA GLU 6 7.646 -5.759 6.835 42 HB2 GLU 6 2HB GLU 6 8.579 -8.041 6.700 43 HB3 GLU 6 3HB GLU 6 7.939 -7.716 8.307 44 HG2 GLU 6 2HG GLU 6 5.907 -9.021 7.764 45 HG3 GLU 6 3HG GLU 6 6.536 -9.338 6.154 46 H LYS 7 H LYS 7 4.966 -7.801 5.721 47 HA LYS 7 HA LYS 7 5.744 -8.266 3.064 48 HB2 LYS 7 2HB LYS 7 2.924 -7.942 4.181 49 HB3 LYS 7 3HB LYS 7 3.326 -8.683 2.634 50 HG2 LYS 7 2HG LYS 7 4.511 -10.496 3.750 51 HG3 LYS 7 3HG LYS 7 4.253 -9.730 5.325 52 HD2 LYS 7 2HD LYS 7 1.813 -10.023 5.082 53 HD3 LYS 7 3HD LYS 7 2.046 -10.739 3.485 54 HE2 LYS 7 2HE LYS 7 3.059 -11.894 6.102 55 HE3 LYS 7 3HE LYS 7 1.647 -12.458 5.206 56 HZ1 LYS 7 1HZ LYS 7 4.467 -12.528 4.279 57 HZ2 LYS 7 2HZ LYS 7 3.137 -12.981 3.341 58 HZ3 LYS 7 3HZ LYS 7 3.521 -13.850 4.737 59 H LEU 8 H LEU 8 3.838 -5.626 4.470 60 HA LEU 8 HA LEU 8 3.287 -4.170 2.110 61 HB2 LEU 8 2HB LEU 8 3.547 -3.125 4.960 62 HB3 LEU 8 3HB LEU 8 2.721 -2.311 3.641 63 HG LEU 8 HG LEU 8 1.846 -4.963 4.858 64 HD11 LEU 8 1HD1 LEU 8 0.652 -2.221 5.292 65 HD12 LEU 8 2HD1 LEU 8 1.542 -3.181 6.472 66 HD13 LEU 8 3HD1 LEU 8 -0.014 -3.750 5.876 67 HD21 LEU 8 1HD2 LEU 8 1.168 -4.791 2.526 68 HD22 LEU 8 2HD2 LEU 8 0.424 -3.218 2.831 69 HD23 LEU 8 3HD2 LEU 8 -0.231 -4.674 3.589 70 H GLU 9 H GLU 9 5.997 -4.149 4.395 71 HA GLU 9 HA GLU 9 7.362 -1.849 3.439 72 HB2 GLU 9 2HB GLU 9 8.432 -4.234 5.005 73 HB3 GLU 9 3HB GLU 9 9.325 -2.738 4.726 74 HG2 GLU 9 2HG GLU 9 7.584 -1.480 5.966 75 HG3 GLU 9 3HG GLU 9 6.727 -2.993 6.264 76 H LYS 10 H LYS 10 7.704 -5.323 2.655 77 HA LYS 10 HA LYS 10 9.938 -5.166 0.961 78 HB2 LYS 10 2HB LYS 10 7.610 -7.118 0.680 79 HB3 LYS 10 3HB LYS 10 9.219 -7.325 -0.006 80 HG2 LYS 10 2HG LYS 10 8.448 -7.382 2.919 81 HG3 LYS 10 3HG LYS 10 9.008 -8.733 1.938 82 HD2 LYS 10 2HD LYS 10 11.245 -7.704 1.759 83 HD3 LYS 10 3HD LYS 10 10.686 -6.287 2.657 84 HE2 LYS 10 2HE LYS 10 10.300 -7.674 4.643 85 HE3 LYS 10 3HE LYS 10 10.789 -9.117 3.753 86 HZ1 LYS 10 1HZ LYS 10 12.991 -8.207 3.521 87 HZ2 LYS 10 2HZ LYS 10 12.558 -8.244 5.157 88 HZ3 LYS 10 3HZ LYS 10 12.529 -6.784 4.304 89 H ALA 11 H ALA 11 6.482 -5.026 0.240 90 HA ALA 11 HA ALA 11 6.574 -4.641 -2.526 91 HB1 ALA 11 1HB ALA 11 4.519 -5.229 -1.330 92 HB2 ALA 11 2HB ALA 11 4.276 -3.782 -2.308 93 HB3 ALA 11 3HB ALA 11 4.491 -3.641 -0.559 94 H LEU 12 H LEU 12 6.627 -2.253 0.143 95 HA LEU 12 HA LEU 12 6.585 0.138 -1.247 96 HB2 LEU 12 2HB LEU 12 7.981 -0.631 1.328 97 HB3 LEU 12 3HB LEU 12 8.100 1.005 0.700 98 HG LEU 12 HG LEU 12 5.484 -0.366 1.428 99 HD11 LEU 12 1HD1 LEU 12 5.452 1.097 3.390 100 HD12 LEU 12 2HD1 LEU 12 7.047 1.725 2.968 101 HD13 LEU 12 3HD1 LEU 12 6.854 0.028 3.419 102 HD21 LEU 12 1HD2 LEU 12 6.063 2.513 0.635 103 HD22 LEU 12 2HD2 LEU 12 4.502 1.888 1.175 104 HD23 LEU 12 3HD2 LEU 12 5.200 1.315 -0.337 105 H ILE 13 H ILE 13 9.500 -1.809 -0.426 106 HA ILE 13 HA ILE 13 11.434 -0.171 -1.646 107 HB ILE 13 HB ILE 13 11.559 -3.215 -1.373 108 HG12 ILE 13 2HG1 ILE 13 12.536 -1.119 0.628 109 HG13 ILE 13 3HG1 ILE 13 11.061 -2.059 0.816 110 HG21 ILE 13 1HG2 ILE 13 13.806 -1.171 -1.629 111 HG22 ILE 13 2HG2 ILE 13 13.301 -2.313 -2.875 112 HG23 ILE 13 3HG2 ILE 13 14.025 -2.907 -1.381 113 HD11 ILE 13 1HD1 ILE 13 12.385 -4.115 0.933 114 HD12 ILE 13 2HD1 ILE 13 12.854 -2.954 2.172 115 HD13 ILE 13 3HD1 ILE 13 13.868 -3.173 0.747 116 H GLU 14 H GLU 14 9.735 -3.053 -2.882 117 HA GLU 14 HA GLU 14 10.919 -3.333 -5.370 118 HB2 GLU 14 2HB GLU 14 8.059 -4.001 -4.547 119 HB3 GLU 14 3HB GLU 14 8.848 -4.616 -5.997 120 HG2 GLU 14 2HG GLU 14 9.796 -5.151 -3.164 121 HG3 GLU 14 3HG GLU 14 8.784 -6.243 -4.100 122 H VAL 15 H VAL 15 8.008 -1.448 -4.529 123 HA VAL 15 HA VAL 15 7.668 -0.569 -7.306 124 HB VAL 15 HB VAL 15 5.486 0.245 -6.690 125 HG11 VAL 15 1HG1 VAL 15 4.385 -1.809 -5.848 126 HG12 VAL 15 2HG1 VAL 15 5.947 -2.433 -5.316 127 HG13 VAL 15 3HG1 VAL 15 5.640 -2.187 -7.036 128 HG21 VAL 15 1HG2 VAL 15 4.593 0.202 -4.362 129 HG22 VAL 15 2HG2 VAL 15 5.949 1.316 -4.531 130 HG23 VAL 15 3HG2 VAL 15 6.197 -0.255 -3.768 131 H ARG 16 H ARG 16 9.262 0.504 -4.539 132 HA ARG 16 HA ARG 16 8.901 3.172 -4.190 133 HB2 ARG 16 2HB ARG 16 10.542 1.970 -2.875 134 HB3 ARG 16 3HB ARG 16 11.582 1.748 -4.276 135 HG2 ARG 16 2HG ARG 16 11.997 4.193 -4.360 136 HG3 ARG 16 3HG ARG 16 10.957 4.413 -2.951 137 HD2 ARG 16 2HD ARG 16 13.324 4.444 -2.306 138 HD3 ARG 16 3HD ARG 16 12.498 3.055 -1.594 139 HE ARG 16 HE ARG 16 13.616 2.215 -4.007 140 HH11 ARG 16 1HH1 ARG 16 14.825 3.367 -0.897 141 HH12 ARG 16 2HH1 ARG 16 16.312 2.484 -1.026 142 HH21 ARG 16 1HH2 ARG 16 15.564 1.078 -4.141 143 HH22 ARG 16 2HH2 ARG 16 16.726 1.195 -2.859 144 HA PRO 17 HA PRO 17 11.706 4.737 -7.816 145 HB2 PRO 17 2HB PRO 17 12.472 3.108 -9.871 146 HB3 PRO 17 3HB PRO 17 13.382 3.178 -8.345 147 HG2 PRO 17 2HG PRO 17 11.338 1.145 -9.214 148 HG3 PRO 17 3HG PRO 17 12.932 0.888 -8.465 149 HD2 PRO 17 2HD PRO 17 10.627 0.827 -7.010 150 HD3 PRO 17 3HD PRO 17 12.168 1.381 -6.328 151 H TYR 18 H TYR 18 9.073 2.569 -8.340 152 HA TYR 18 HA TYR 18 8.244 3.697 -10.904 153 HB2 TYR 18 2HB TYR 18 6.923 1.554 -9.176 154 HB3 TYR 18 3HB TYR 18 6.439 1.995 -10.812 155 HD1 TYR 18 HD1 TYR 18 8.063 1.548 -12.742 156 HD2 TYR 18 HD2 TYR 18 8.693 -0.056 -8.822 157 HE1 TYR 18 HE1 TYR 18 9.618 -0.119 -13.664 158 HE2 TYR 18 HE2 TYR 18 10.242 -1.719 -9.748 159 HH TYR 18 HH TYR 18 10.664 -2.826 -11.929 160 H VAL 19 H VAL 19 7.474 4.032 -7.491 161 HA VAL 19 HA VAL 19 4.981 5.503 -8.135 162 HB VAL 19 HB VAL 19 4.215 5.139 -5.840 163 HG11 VAL 19 1HG1 VAL 19 3.814 2.710 -5.944 164 HG12 VAL 19 2HG1 VAL 19 5.098 2.540 -7.144 165 HG13 VAL 19 3HG1 VAL 19 3.644 3.465 -7.532 166 HG21 VAL 19 1HG2 VAL 19 6.784 3.576 -5.339 167 HG22 VAL 19 2HG2 VAL 19 5.402 3.647 -4.241 168 HG23 VAL 19 3HG2 VAL 19 6.327 5.108 -4.589 169 H GLU 20 H GLU 20 4.933 7.599 -7.910 170 HA GLU 20 HA GLU 20 6.869 9.091 -6.297 171 HB2 GLU 20 2HB GLU 20 5.838 11.107 -7.196 172 HB3 GLU 20 3HB GLU 20 6.210 10.009 -8.518 173 HG2 GLU 20 2HG GLU 20 3.862 9.354 -8.678 174 HG3 GLU 20 3HG GLU 20 3.461 10.361 -7.290 175 H TYR 21 H TYR 21 5.852 10.834 -4.851 176 HA TYR 21 HA TYR 21 5.010 11.213 -2.786 177 HB2 TYR 21 2HB TYR 21 2.575 9.508 -3.455 178 HB3 TYR 21 3HB TYR 21 2.674 10.819 -2.300 179 HD1 TYR 21 HD1 TYR 21 3.283 13.203 -3.400 180 HD2 TYR 21 HD2 TYR 21 1.494 9.943 -5.497 181 HE1 TYR 21 HE1 TYR 21 2.364 14.764 -5.052 182 HE2 TYR 21 HE2 TYR 21 0.581 11.497 -7.155 183 HH TYR 21 HH TYR 21 1.629 14.658 -7.479 184 H TYR 22 H TYR 22 6.647 8.856 -3.373 185 HA TYR 22 HA TYR 22 5.878 6.473 -2.207 186 HB2 TYR 22 2HB TYR 22 7.898 6.476 -3.503 187 HB3 TYR 22 3HB TYR 22 8.641 7.705 -2.480 188 HD1 TYR 22 HD1 TYR 22 7.234 4.203 -2.188 189 HD2 TYR 22 HD2 TYR 22 10.235 6.971 -0.877 190 HE1 TYR 22 HE1 TYR 22 8.233 2.461 -0.774 191 HE2 TYR 22 HE2 TYR 22 11.213 5.223 0.538 192 HH TYR 22 HH TYR 22 10.390 1.942 0.279 193 H ASN 23 H ASN 23 7.254 9.330 -0.585 194 HA ASN 23 HA ASN 23 7.598 8.082 1.969 195 HB2 ASN 23 2HB ASN 23 7.451 11.017 1.198 196 HB3 ASN 23 3HB ASN 23 7.734 10.479 2.851 197 HD21 ASN 23 1HD2 ASN 23 9.472 12.060 1.215 198 HD22 ASN 23 2HD2 ASN 23 10.955 11.186 1.071 199 H GLU 24 H GLU 24 4.901 9.809 0.469 200 HA GLU 24 HA GLU 24 3.302 10.068 2.816 201 HB2 GLU 24 2HB GLU 24 2.517 10.204 -0.130 202 HB3 GLU 24 3HB GLU 24 1.426 10.562 1.203 203 HG2 GLU 24 2HG GLU 24 2.107 12.683 0.558 204 HG3 GLU 24 3HG GLU 24 3.180 12.335 1.897 205 H LEU 25 H LEU 25 3.071 7.905 -0.021 206 HA LEU 25 HA LEU 25 1.102 6.155 0.809 207 HB2 LEU 25 2HB LEU 25 2.016 6.240 -1.476 208 HB3 LEU 25 3HB LEU 25 3.563 5.642 -0.901 209 HG LEU 25 HG LEU 25 2.511 3.458 -0.329 210 HD11 LEU 25 1HD1 LEU 25 0.233 4.169 0.146 211 HD12 LEU 25 2HD1 LEU 25 0.236 2.914 -1.089 212 HD13 LEU 25 3HD1 LEU 25 -0.018 4.599 -1.548 213 HD21 LEU 25 1HD2 LEU 25 3.584 3.746 -2.510 214 HD22 LEU 25 2HD2 LEU 25 2.057 4.300 -3.206 215 HD23 LEU 25 3HD2 LEU 25 2.214 2.642 -2.618 216 H LYS 26 H LYS 26 4.617 5.822 1.174 217 HA LYS 26 HA LYS 26 4.847 3.548 2.707 218 HB2 LYS 26 2HB LYS 26 6.802 4.664 1.839 219 HB3 LYS 26 3HB LYS 26 6.496 6.091 2.816 220 HG2 LYS 26 2HG LYS 26 7.108 4.912 4.848 221 HG3 LYS 26 3HG LYS 26 7.209 3.378 3.976 222 HD2 LYS 26 2HD LYS 26 9.454 4.393 4.444 223 HD3 LYS 26 3HD LYS 26 9.150 4.143 2.724 224 HE2 LYS 26 2HE LYS 26 8.589 6.545 2.480 225 HE3 LYS 26 3HE LYS 26 8.880 6.789 4.201 226 HZ1 LYS 26 1HZ LYS 26 10.924 5.868 2.259 227 HZ2 LYS 26 2HZ LYS 26 11.177 6.235 3.887 228 HZ3 LYS 26 3HZ LYS 26 10.754 7.462 2.801 229 H ALA 27 H ALA 27 4.112 6.867 3.916 230 HA ALA 27 HA ALA 27 4.178 6.144 6.695 231 HB1 ALA 27 1HB ALA 27 2.942 8.568 5.340 232 HB2 ALA 27 2HB ALA 27 4.603 8.450 5.931 233 HB3 ALA 27 3HB ALA 27 3.254 8.397 7.067 234 H LEU 28 H LEU 28 1.668 6.416 4.233 235 HA LEU 28 HA LEU 28 -0.650 6.154 5.784 236 HB2 LEU 28 2HB LEU 28 -0.771 6.940 3.498 237 HB3 LEU 28 3HB LEU 28 -0.000 5.484 2.895 238 HG LEU 28 HG LEU 28 -2.046 4.166 3.525 239 HD11 LEU 28 1HD1 LEU 28 -2.931 5.534 5.316 240 HD12 LEU 28 2HD1 LEU 28 -4.144 5.337 4.054 241 HD13 LEU 28 3HD1 LEU 28 -3.260 6.858 4.194 242 HD21 LEU 28 1HD2 LEU 28 -2.533 6.465 1.605 243 HD22 LEU 28 2HD2 LEU 28 -3.465 4.968 1.680 244 HD23 LEU 28 3HD2 LEU 28 -1.763 4.919 1.227 245 H VAL 29 H VAL 29 1.068 3.677 3.860 246 HA VAL 29 HA VAL 29 -0.493 1.516 4.760 247 HB VAL 29 HB VAL 29 0.753 1.691 2.552 248 HG11 VAL 29 1HG1 VAL 29 3.079 0.924 2.410 249 HG12 VAL 29 2HG1 VAL 29 3.170 0.832 4.170 250 HG13 VAL 29 3HG1 VAL 29 2.953 2.395 3.381 251 HG21 VAL 29 1HG2 VAL 29 -0.327 -0.394 3.262 252 HG22 VAL 29 2HG2 VAL 29 1.145 -0.878 4.107 253 HG23 VAL 29 3HG2 VAL 29 1.152 -0.725 2.351 254 H SER 30 H SER 30 2.596 2.845 5.829 255 HA SER 30 HA SER 30 3.241 0.875 7.784 256 HB2 SER 30 2HB SER 30 4.869 2.609 7.058 257 HB3 SER 30 3HB SER 30 3.915 3.848 7.872 258 HG SER 30 HG SER 30 5.380 1.708 8.999 259 H LYS 31 H LYS 31 1.069 3.662 7.895 260 HA LYS 31 HA LYS 31 0.485 3.583 10.673 261 HB2 LYS 31 2HB LYS 31 0.095 5.585 9.224 262 HB3 LYS 31 3HB LYS 31 -1.184 4.714 8.384 263 HG2 LYS 31 2HG LYS 31 -2.470 4.585 10.502 264 HG3 LYS 31 3HG LYS 31 -1.192 5.491 11.319 265 HD2 LYS 31 2HD LYS 31 -1.615 7.429 9.822 266 HD3 LYS 31 3HD LYS 31 -2.889 6.515 9.005 267 HE2 LYS 31 2HE LYS 31 -2.893 7.329 11.933 268 HE3 LYS 31 3HE LYS 31 -3.829 8.093 10.648 269 HZ1 LYS 31 1HZ LYS 31 -5.071 6.082 10.346 270 HZ2 LYS 31 2HZ LYS 31 -5.116 6.501 11.984 271 HZ3 LYS 31 3HZ LYS 31 -4.112 5.249 11.460 272 H ILE 32 H ILE 32 -1.068 2.143 7.774 273 HA ILE 32 HA ILE 32 -3.256 1.034 9.286 274 HB ILE 32 HB ILE 32 -4.114 0.028 7.298 275 HG12 ILE 32 2HG1 ILE 32 -1.483 0.594 5.866 276 HG13 ILE 32 3HG1 ILE 32 -1.974 -0.988 6.446 277 HG21 ILE 32 1HG2 ILE 32 -4.367 2.466 7.411 278 HG22 ILE 32 2HG2 ILE 32 -4.238 1.935 5.736 279 HG23 ILE 32 3HG2 ILE 32 -2.852 2.685 6.531 280 HD11 ILE 32 1HD1 ILE 32 -3.355 0.623 4.300 281 HD12 ILE 32 2HD1 ILE 32 -3.884 -0.950 4.909 282 HD13 ILE 32 3HD1 ILE 32 -2.339 -0.802 4.074 283 H SER 33 H SER 33 -0.090 -0.200 8.253 284 HA SER 33 HA SER 33 -0.131 -2.840 8.920 285 HB2 SER 33 2HB SER 33 1.970 -0.865 9.912 286 HB3 SER 33 3HB SER 33 2.178 -2.614 9.818 287 HG SER 33 HG SER 33 1.385 -1.431 7.479 288 H SER 34 H SER 34 -0.251 -0.130 11.135 289 HA SER 34 HA SER 34 -0.117 -1.647 13.592 290 HB2 SER 34 2HB SER 34 0.853 0.608 13.497 291 HB3 SER 34 3HB SER 34 -0.699 1.302 13.033 292 HG SER 34 HG SER 34 -0.871 -0.137 15.339 293 H SER 35 H SER 35 -2.599 -0.467 11.447 294 HA SER 35 HA SER 35 -4.792 -0.555 13.338 295 HB2 SER 35 2HB SER 35 -4.743 1.120 11.511 296 HB3 SER 35 3HB SER 35 -4.755 -0.166 10.305 297 HG SER 35 HG SER 35 -6.808 -0.491 12.012 298 H VAL 36 H VAL 36 -3.606 -2.581 10.652 299 HA VAL 36 HA VAL 36 -5.904 -4.397 10.892 300 HB VAL 36 HB VAL 36 -5.287 -5.334 8.731 301 HG11 VAL 36 1HG1 VAL 36 -6.626 -3.285 8.666 302 HG12 VAL 36 2HG1 VAL 36 -5.555 -3.356 7.266 303 HG13 VAL 36 3HG1 VAL 36 -5.163 -2.295 8.624 304 HG21 VAL 36 1HG2 VAL 36 -3.337 -4.538 7.414 305 HG22 VAL 36 2HG2 VAL 36 -2.840 -5.318 8.914 306 HG23 VAL 36 3HG2 VAL 36 -2.813 -3.561 8.788 307 H ASN 37 H ASN 37 -5.632 -6.617 11.021 308 HA ASN 37 HA ASN 37 -3.148 -7.552 12.350 309 HB2 ASN 37 2HB ASN 37 -6.023 -8.525 12.711 310 HB3 ASN 37 3HB ASN 37 -4.613 -9.226 13.505 311 HD21 ASN 37 1HD2 ASN 37 -7.041 -7.848 14.569 312 HD22 ASN 37 2HD2 ASN 37 -6.437 -6.602 15.601 313 H ASP 38 H ASP 38 -5.034 -7.867 9.551 314 HA ASP 38 HA ASP 38 -3.722 -10.412 8.790 315 HB2 ASP 38 2HB ASP 38 -6.648 -9.682 8.314 316 HB3 ASP 38 3HB ASP 38 -5.836 -11.017 7.504 317 H LEU 39 H LEU 39 -3.221 -10.611 6.593 318 HA LEU 39 HA LEU 39 -2.370 -8.222 5.326 319 HB2 LEU 39 2HB LEU 39 -1.200 -10.465 5.258 320 HB3 LEU 39 3HB LEU 39 -2.457 -11.056 4.200 321 HG LEU 39 HG LEU 39 -0.210 -10.425 3.116 322 HD11 LEU 39 1HD1 LEU 39 -2.202 -10.792 1.750 323 HD12 LEU 39 2HD1 LEU 39 -1.133 -9.569 1.067 324 HD13 LEU 39 3HD1 LEU 39 -2.612 -9.081 1.896 325 HD21 LEU 39 1HD2 LEU 39 0.190 -8.324 4.336 326 HD22 LEU 39 2HD2 LEU 39 -1.181 -7.578 3.510 327 HD23 LEU 39 3HD2 LEU 39 0.238 -8.086 2.590 328 H GLU 40 H GLU 40 -5.074 -10.466 4.765 329 HA GLU 40 HA GLU 40 -6.123 -9.321 2.401 330 HB2 GLU 40 2HB GLU 40 -6.773 -11.566 3.275 331 HB3 GLU 40 3HB GLU 40 -7.614 -10.798 4.620 332 HG2 GLU 40 2HG GLU 40 -9.178 -9.723 3.045 333 HG3 GLU 40 3HG GLU 40 -8.322 -10.444 1.684 334 H GLU 41 H GLU 41 -6.380 -8.423 5.779 335 HA GLU 41 HA GLU 41 -8.532 -6.532 5.472 336 HB2 GLU 41 2HB GLU 41 -6.553 -7.010 7.735 337 HB3 GLU 41 3HB GLU 41 -7.866 -5.842 7.819 338 HG2 GLU 41 2HG GLU 41 -8.229 -8.830 7.428 339 HG3 GLU 41 3HG GLU 41 -8.370 -7.982 8.968 340 H ALA 42 H ALA 42 -5.034 -6.441 5.265 341 HA ALA 42 HA ALA 42 -4.720 -3.585 5.163 342 HB1 ALA 42 1HB ALA 42 -2.474 -4.078 4.239 343 HB2 ALA 42 2HB ALA 42 -2.915 -5.783 4.082 344 HB3 ALA 42 3HB ALA 42 -2.809 -5.040 5.679 345 H ILE 43 H ILE 43 -5.217 -6.172 2.828 346 HA ILE 43 HA ILE 43 -4.929 -4.758 0.419 347 HB ILE 43 HB ILE 43 -6.541 -7.244 1.114 348 HG12 ILE 43 2HG1 ILE 43 -3.925 -6.908 -0.424 349 HG13 ILE 43 3HG1 ILE 43 -4.052 -7.417 1.254 350 HG21 ILE 43 1HG2 ILE 43 -7.647 -6.222 -0.831 351 HG22 ILE 43 2HG2 ILE 43 -6.820 -7.709 -1.295 352 HG23 ILE 43 3HG2 ILE 43 -6.103 -6.146 -1.684 353 HD11 ILE 43 1HD1 ILE 43 -3.642 -9.335 -0.062 354 HD12 ILE 43 2HD1 ILE 43 -4.931 -8.928 -1.195 355 HD13 ILE 43 3HD1 ILE 43 -5.328 -9.421 0.454 356 H VAL 44 H VAL 44 -8.132 -5.769 1.779 357 HA VAL 44 HA VAL 44 -9.908 -4.162 0.585 358 HB VAL 44 HB VAL 44 -9.795 -4.901 3.543 359 HG11 VAL 44 1HG1 VAL 44 -12.250 -4.520 3.638 360 HG12 VAL 44 2HG1 VAL 44 -12.200 -3.847 2.007 361 HG13 VAL 44 3HG1 VAL 44 -11.366 -3.026 3.327 362 HG21 VAL 44 1HG2 VAL 44 -9.815 -6.832 2.005 363 HG22 VAL 44 2HG2 VAL 44 -11.261 -6.205 1.212 364 HG23 VAL 44 3HG2 VAL 44 -11.339 -6.735 2.893 365 H VAL 45 H VAL 45 -8.082 -3.085 3.509 366 HA VAL 45 HA VAL 45 -9.084 -0.445 3.608 367 HB VAL 45 HB VAL 45 -6.455 -1.586 4.639 368 HG11 VAL 45 1HG1 VAL 45 -6.054 0.810 4.266 369 HG12 VAL 45 2HG1 VAL 45 -6.202 0.501 5.996 370 HG13 VAL 45 3HG1 VAL 45 -7.549 1.218 5.110 371 HG21 VAL 45 1HG2 VAL 45 -8.499 -2.412 5.744 372 HG22 VAL 45 2HG2 VAL 45 -9.021 -0.757 6.057 373 HG23 VAL 45 3HG2 VAL 45 -7.578 -1.390 6.850 374 H LEU 46 H LEU 46 -6.243 -1.705 1.841 375 HA LEU 46 HA LEU 46 -5.436 0.825 0.769 376 HB2 LEU 46 2HB LEU 46 -4.778 -2.024 -0.033 377 HB3 LEU 46 3HB LEU 46 -4.157 -0.650 -0.933 378 HG LEU 46 HG LEU 46 -3.603 -1.129 2.021 379 HD11 LEU 46 1HD1 LEU 46 -1.363 -1.857 1.368 380 HD12 LEU 46 2HD1 LEU 46 -1.790 -1.709 -0.340 381 HD13 LEU 46 3HD1 LEU 46 -2.594 -2.911 0.672 382 HD21 LEU 46 1HD2 LEU 46 -2.353 0.847 0.075 383 HD22 LEU 46 2HD2 LEU 46 -1.862 0.593 1.752 384 HD23 LEU 46 3HD2 LEU 46 -3.461 1.240 1.394 385 H ARG 47 H ARG 47 -7.872 -1.535 -0.212 386 HA ARG 47 HA ARG 47 -8.295 -0.551 -2.869 387 HB2 ARG 47 2HB ARG 47 -10.075 -2.193 -1.021 388 HB3 ARG 47 3HB ARG 47 -10.511 -1.790 -2.681 389 HG2 ARG 47 2HG ARG 47 -8.587 -3.048 -3.518 390 HG3 ARG 47 3HG ARG 47 -8.087 -3.420 -1.863 391 HD2 ARG 47 2HD ARG 47 -10.134 -4.684 -1.490 392 HD3 ARG 47 3HD ARG 47 -10.742 -4.239 -3.088 393 HE ARG 47 HE ARG 47 -8.304 -5.520 -3.469 394 HH11 ARG 47 1HH1 ARG 47 -11.479 -6.357 -2.180 395 HH12 ARG 47 2HH1 ARG 47 -11.349 -8.020 -2.643 396 HH21 ARG 47 1HH2 ARG 47 -8.201 -7.678 -4.098 397 HH22 ARG 47 2HH2 ARG 47 -9.500 -8.755 -3.727 398 H GLU 48 H GLU 48 -9.376 0.388 0.317 399 HA GLU 48 HA GLU 48 -11.494 2.151 -0.487 400 HB2 GLU 48 2HB GLU 48 -9.780 2.294 2.047 401 HB3 GLU 48 3HB GLU 48 -11.312 3.129 1.788 402 HG2 GLU 48 2HG GLU 48 -12.470 0.946 1.653 403 HG3 GLU 48 3HG GLU 48 -10.939 0.122 1.938 404 H GLU 49 H GLU 49 -8.085 2.430 0.331 405 HA GLU 49 HA GLU 49 -7.829 5.237 0.137 406 HB2 GLU 49 2HB GLU 49 -5.747 3.020 0.009 407 HB3 GLU 49 3HB GLU 49 -5.328 4.731 0.033 408 HG2 GLU 49 2HG GLU 49 -6.770 3.186 2.208 409 HG3 GLU 49 3HG GLU 49 -5.127 3.831 2.271 410 H GLU 50 H GLU 50 -7.031 2.681 -2.120 411 HA GLU 50 HA GLU 50 -5.954 3.924 -4.294 412 HB2 GLU 50 2HB GLU 50 -6.206 1.513 -4.092 413 HB3 GLU 50 3HB GLU 50 -7.959 1.642 -4.106 414 HG2 GLU 50 2HG GLU 50 -7.768 2.489 -6.496 415 HG3 GLU 50 3HG GLU 50 -6.057 2.059 -6.433 416 H LYS 51 H LYS 51 -9.486 3.346 -3.872 417 HA LYS 51 HA LYS 51 -10.204 4.697 -6.269 418 HB2 LYS 51 2HB LYS 51 -11.962 3.650 -4.018 419 HB3 LYS 51 3HB LYS 51 -12.506 4.080 -5.640 420 HG2 LYS 51 2HG LYS 51 -11.196 2.258 -6.610 421 HG3 LYS 51 3HG LYS 51 -10.518 1.864 -5.025 422 HD2 LYS 51 2HD LYS 51 -12.822 1.318 -4.219 423 HD3 LYS 51 3HD LYS 51 -13.444 1.635 -5.843 424 HE2 LYS 51 2HE LYS 51 -11.458 -0.532 -5.067 425 HE3 LYS 51 3HE LYS 51 -13.154 -0.775 -5.488 426 HZ1 LYS 51 1HZ LYS 51 -10.961 0.124 -7.264 427 HZ2 LYS 51 2HZ LYS 51 -12.591 0.205 -7.704 428 HZ3 LYS 51 3HZ LYS 51 -11.878 -1.291 -7.385 429 H LYS 52 H LYS 52 -10.139 5.612 -2.850 430 HA LYS 52 HA LYS 52 -11.823 7.978 -3.263 431 HB2 LYS 52 2HB LYS 52 -11.624 8.381 -0.865 432 HB3 LYS 52 3HB LYS 52 -12.014 6.688 -1.140 433 HG2 LYS 52 2HG LYS 52 -9.550 6.181 -0.869 434 HG3 LYS 52 3HG LYS 52 -9.326 7.846 -0.349 435 HD2 LYS 52 2HD LYS 52 -11.423 6.221 1.080 436 HD3 LYS 52 3HD LYS 52 -9.739 5.806 1.380 437 HE2 LYS 52 2HE LYS 52 -10.908 8.580 1.752 438 HE3 LYS 52 3HE LYS 52 -10.671 7.401 3.045 439 HZ1 LYS 52 1HZ LYS 52 -8.518 8.550 1.343 440 HZ2 LYS 52 2HZ LYS 52 -8.293 7.413 2.576 441 HZ3 LYS 52 3HZ LYS 52 -8.841 8.973 2.948 442 H ALA 53 H ALA 53 -8.482 7.178 -3.407 443 HA ALA 53 HA ALA 53 -7.432 9.848 -3.094 444 HB1 ALA 53 1HB ALA 53 -6.162 7.403 -4.393 445 HB2 ALA 53 2HB ALA 53 -5.985 7.884 -2.705 446 HB3 ALA 53 3HB ALA 53 -5.323 8.905 -3.984 447 H SER 54 H SER 54 -6.247 10.849 -4.899 448 HA SER 54 HA SER 54 -7.724 10.770 -7.459 449 HB2 SER 54 2HB SER 54 -8.140 12.847 -6.155 450 HB3 SER 54 3HB SER 54 -6.408 13.140 -6.030 451 HG SER 54 HG SER 54 -7.019 14.351 -7.701 452 H GLU 55 H GLU 55 -6.472 11.195 -9.347 453 HA GLU 55 HA GLU 55 -3.992 9.856 -9.504 454 HB2 GLU 55 2HB GLU 55 -5.294 11.766 -11.495 455 HB3 GLU 55 3HB GLU 55 -3.955 10.678 -11.866 456 HG2 GLU 55 2HG GLU 55 -5.415 8.732 -11.355 457 HG3 GLU 55 3HG GLU 55 -6.754 9.839 -11.032 458 HA PRO 56 HA PRO 56 -2.012 9.850 -10.707 459 HB2 PRO 56 2HB PRO 56 0.717 10.149 -9.715 460 HB3 PRO 56 3HB PRO 56 0.127 10.320 -11.377 461 HG2 PRO 56 2HG PRO 56 1.105 12.414 -9.882 462 HG3 PRO 56 3HG PRO 56 -0.035 12.598 -11.235 463 HD2 PRO 56 2HD PRO 56 -0.610 12.555 -8.278 464 HD3 PRO 56 3HD PRO 56 -1.276 13.619 -9.541 465 H PHE 57 H PHE 57 -1.996 10.717 -7.394 466 HA PHE 57 HA PHE 57 -0.679 8.564 -6.177 467 HB2 PHE 57 2HB PHE 57 -1.339 10.812 -5.155 468 HB3 PHE 57 3HB PHE 57 -2.959 10.160 -4.947 469 HD1 PHE 57 HD1 PHE 57 0.347 8.447 -4.387 470 HD2 PHE 57 HD2 PHE 57 -3.180 10.074 -2.572 471 HE1 PHE 57 HE1 PHE 57 1.063 7.579 -2.206 472 HE2 PHE 57 HE2 PHE 57 -2.447 9.192 -0.399 473 HZ PHE 57 HZ PHE 57 -0.332 7.944 -0.210 474 H LYS 58 H LYS 58 -3.917 8.735 -7.494 475 HA LYS 58 HA LYS 58 -5.101 6.459 -6.382 476 HB2 LYS 58 2HB LYS 58 -6.365 7.962 -7.828 477 HB3 LYS 58 3HB LYS 58 -5.334 7.578 -9.206 478 HG2 LYS 58 2HG LYS 58 -6.185 5.277 -9.233 479 HG3 LYS 58 3HG LYS 58 -7.172 5.596 -7.809 480 HD2 LYS 58 2HD LYS 58 -7.490 7.022 -10.479 481 HD3 LYS 58 3HD LYS 58 -8.443 5.627 -9.973 482 HE2 LYS 58 2HE LYS 58 -9.258 6.953 -8.009 483 HE3 LYS 58 3HE LYS 58 -8.390 8.356 -8.638 484 HZ1 LYS 58 1HZ LYS 58 -9.743 8.261 -10.628 485 HZ2 LYS 58 2HZ LYS 58 -10.724 8.384 -9.255 486 HZ3 LYS 58 3HZ LYS 58 -10.563 6.900 -10.051 487 H THR 59 H THR 59 -2.627 6.700 -8.877 488 HA THR 59 HA THR 59 -2.702 3.866 -9.511 489 HB THR 59 HB THR 59 -0.895 6.067 -10.595 490 HG1 THR 59 HG1 THR 59 -3.013 6.395 -11.239 491 HG21 THR 59 1HG2 THR 59 -0.361 4.453 -12.423 492 HG22 THR 59 2HG2 THR 59 -1.313 3.211 -11.605 493 HG23 THR 59 3HG2 THR 59 0.162 3.825 -10.857 494 H ASP 60 H ASP 60 -0.593 6.234 -7.898 495 HA ASP 60 HA ASP 60 1.596 4.564 -7.345 496 HB2 ASP 60 2HB ASP 60 0.506 6.874 -5.679 497 HB3 ASP 60 3HB ASP 60 2.104 6.156 -5.471 498 H ILE 61 H ILE 61 -1.406 5.010 -5.477 499 HA ILE 61 HA ILE 61 -0.755 3.218 -3.353 500 HB ILE 61 HB ILE 61 -3.503 4.153 -4.305 501 HG12 ILE 61 2HG1 ILE 61 -1.803 5.056 -1.934 502 HG13 ILE 61 3HG1 ILE 61 -2.064 5.972 -3.411 503 HG21 ILE 61 1HG2 ILE 61 -2.833 2.624 -1.752 504 HG22 ILE 61 2HG2 ILE 61 -3.753 2.000 -3.121 505 HG23 ILE 61 3HG2 ILE 61 -4.412 3.312 -2.148 506 HD11 ILE 61 1HD1 ILE 61 -4.448 6.154 -2.860 507 HD12 ILE 61 2HD1 ILE 61 -3.409 6.839 -1.614 508 HD13 ILE 61 3HD1 ILE 61 -4.162 5.268 -1.360 509 H ARG 62 H ARG 62 -2.658 2.813 -6.427 510 HA ARG 62 HA ARG 62 -3.392 0.151 -5.897 511 HB2 ARG 62 2HB ARG 62 -4.388 0.077 -8.004 512 HB3 ARG 62 3HB ARG 62 -4.411 1.785 -7.625 513 HG2 ARG 62 2HG ARG 62 -3.752 1.905 -9.823 514 HG3 ARG 62 3HG ARG 62 -2.168 1.799 -9.064 515 HD2 ARG 62 2HD ARG 62 -2.144 -0.656 -9.519 516 HD3 ARG 62 3HD ARG 62 -3.704 -0.505 -10.325 517 HE ARG 62 HE ARG 62 -2.512 1.066 -11.905 518 HH11 ARG 62 1HH1 ARG 62 -0.744 -1.514 -10.279 519 HH12 ARG 62 2HH1 ARG 62 0.463 -1.623 -11.513 520 HH21 ARG 62 1HH2 ARG 62 -0.903 0.904 -13.505 521 HH22 ARG 62 2HH2 ARG 62 0.374 -0.258 -13.333 522 H ILE 63 H ILE 63 -0.398 1.417 -7.364 523 HA ILE 63 HA ILE 63 0.500 -1.031 -8.500 524 HB ILE 63 HB ILE 63 2.139 1.401 -7.652 525 HG12 ILE 63 2HG1 ILE 63 1.190 0.440 -10.384 526 HG13 ILE 63 3HG1 ILE 63 0.615 1.861 -9.529 527 HG21 ILE 63 1HG2 ILE 63 4.034 0.473 -8.945 528 HG22 ILE 63 2HG2 ILE 63 3.106 -0.994 -9.262 529 HG23 ILE 63 3HG2 ILE 63 3.595 -0.600 -7.615 530 HD11 ILE 63 1HD1 ILE 63 2.084 2.513 -11.307 531 HD12 ILE 63 2HD1 ILE 63 3.365 1.463 -10.702 532 HD13 ILE 63 3HD1 ILE 63 2.856 2.869 -9.763 533 H LEU 64 H LEU 64 0.980 0.459 -5.304 534 HA LEU 64 HA LEU 64 2.633 -1.486 -4.130 535 HB2 LEU 64 2HB LEU 64 2.102 0.753 -3.150 536 HB3 LEU 64 3HB LEU 64 0.459 0.214 -2.846 537 HG LEU 64 HG LEU 64 1.450 -1.587 -1.306 538 HD11 LEU 64 1HD1 LEU 64 3.736 -1.583 -2.146 539 HD12 LEU 64 2HD1 LEU 64 3.700 -1.230 -0.422 540 HD13 LEU 64 3HD1 LEU 64 3.966 0.075 -1.581 541 HD21 LEU 64 1HD2 LEU 64 1.723 -0.071 0.596 542 HD22 LEU 64 2HD2 LEU 64 0.356 0.405 -0.410 543 HD23 LEU 64 3HD2 LEU 64 1.873 1.303 -0.504 544 H LEU 65 H LEU 65 -0.884 -1.110 -4.094 545 HA LEU 65 HA LEU 65 -1.567 -3.316 -2.491 546 HB2 LEU 65 2HB LEU 65 -3.077 -1.482 -2.719 547 HB3 LEU 65 3HB LEU 65 -3.085 -1.608 -4.469 548 HG LEU 65 HG LEU 65 -4.396 -3.709 -4.329 549 HD11 LEU 65 1HD1 LEU 65 -3.646 -4.587 -2.200 550 HD12 LEU 65 2HD1 LEU 65 -5.402 -4.457 -2.230 551 HD13 LEU 65 3HD1 LEU 65 -4.448 -3.270 -1.338 552 HD21 LEU 65 1HD2 LEU 65 -5.677 -1.414 -2.824 553 HD22 LEU 65 2HD2 LEU 65 -6.519 -2.719 -3.663 554 HD23 LEU 65 3HD2 LEU 65 -5.555 -1.567 -4.579 555 H ASP 66 H ASP 66 -2.334 -3.032 -5.990 556 HA ASP 66 HA ASP 66 -2.924 -5.501 -6.810 557 HB2 ASP 66 2HB ASP 66 -2.934 -3.510 -8.220 558 HB3 ASP 66 3HB ASP 66 -1.186 -3.404 -8.163 559 H PHE 67 H PHE 67 0.463 -4.271 -6.752 560 HA PHE 67 HA PHE 67 1.888 -6.542 -7.442 561 HB2 PHE 67 2HB PHE 67 2.924 -4.314 -7.088 562 HB3 PHE 67 3HB PHE 67 2.670 -4.453 -5.354 563 HD1 PHE 67 HD1 PHE 67 4.530 -5.914 -8.241 564 HD2 PHE 67 HD2 PHE 67 4.281 -5.603 -3.972 565 HE1 PHE 67 HE1 PHE 67 6.711 -7.023 -8.022 566 HE2 PHE 67 HE2 PHE 67 6.462 -6.710 -3.774 567 HZ PHE 67 HZ PHE 67 7.674 -7.424 -5.796 568 H LEU 68 H LEU 68 0.841 -5.646 -4.109 569 HA LEU 68 HA LEU 68 1.851 -7.868 -2.702 570 HB2 LEU 68 2HB LEU 68 -0.502 -6.038 -2.183 571 HB3 LEU 68 3HB LEU 68 -0.099 -7.327 -1.062 572 HG LEU 68 HG LEU 68 1.919 -5.184 -1.815 573 HD11 LEU 68 1HD1 LEU 68 -0.047 -4.047 -0.901 574 HD12 LEU 68 2HD1 LEU 68 1.310 -3.976 0.220 575 HD13 LEU 68 3HD1 LEU 68 -0.017 -5.104 0.514 576 HD21 LEU 68 1HD2 LEU 68 2.984 -5.861 0.312 577 HD22 LEU 68 2HD2 LEU 68 2.856 -7.215 -0.808 578 HD23 LEU 68 3HD2 LEU 68 1.736 -7.091 0.551 579 H GLU 69 H GLU 69 -1.086 -7.505 -4.598 580 HA GLU 69 HA GLU 69 -2.273 -10.019 -3.722 581 HB2 GLU 69 2HB GLU 69 -3.125 -8.108 -5.934 582 HB3 GLU 69 3HB GLU 69 -4.099 -9.411 -5.248 583 HG2 GLU 69 2HG GLU 69 -4.162 -8.253 -3.083 584 HG3 GLU 69 3HG GLU 69 -3.137 -6.965 -3.724 585 H SER 70 H SER 70 -0.121 -8.897 -6.162 586 HA SER 70 HA SER 70 1.147 -9.914 -7.731 587 HB2 SER 70 2HB SER 70 1.536 -11.662 -6.006 588 HB3 SER 70 3HB SER 70 0.115 -12.533 -6.566 589 HG SER 70 HG SER 70 2.267 -11.912 -8.292 590 H LYS 71 H LYS 71 -1.382 -8.940 -8.427 591 HA LYS 71 HA LYS 71 -2.969 -10.736 -9.966 592 HB2 LYS 71 2HB LYS 71 -2.828 -7.696 -9.958 593 HB3 LYS 71 3HB LYS 71 -4.097 -8.643 -10.732 594 HG2 LYS 71 2HG LYS 71 -4.872 -9.474 -8.593 595 HG3 LYS 71 3HG LYS 71 -3.510 -8.726 -7.756 596 HD2 LYS 71 2HD LYS 71 -5.616 -7.424 -7.485 597 HD3 LYS 71 3HD LYS 71 -4.348 -6.492 -8.281 598 HE2 LYS 71 2HE LYS 71 -5.427 -6.972 -10.483 599 HE3 LYS 71 3HE LYS 71 -6.716 -7.835 -9.637 600 HZ1 LYS 71 1HZ LYS 71 -7.336 -5.815 -8.532 601 HZ2 LYS 71 2HZ LYS 71 -7.287 -5.532 -10.201 602 HZ3 LYS 71 3HZ LYS 71 -6.030 -4.985 -9.213 603 HA PRO 72 HA PRO 72 -0.672 -10.318 -13.964 604 HB2 PRO 72 2HB PRO 72 -2.881 -12.058 -14.986 605 HB3 PRO 72 3HB PRO 72 -1.129 -12.338 -15.020 606 HG2 PRO 72 2HG PRO 72 -2.742 -13.760 -13.406 607 HG3 PRO 72 3HG PRO 72 -1.089 -13.308 -12.923 608 HD2 PRO 72 2HD PRO 72 -3.698 -12.024 -12.114 609 HD3 PRO 72 3HD PRO 72 -2.282 -12.418 -11.114 Start of MODEL 5 1 H GLY 1 1H GLY 1 8.627 -5.897 13.302 2 HA2 GLY 1 2HA GLY 1 6.871 -4.882 14.603 3 HA3 GLY 1 3HA GLY 1 6.320 -4.052 13.153 4 H SER 2 H SER 2 4.449 -4.960 12.611 5 HA SER 2 HA SER 2 3.682 -7.665 13.145 6 HB2 SER 2 2HB SER 2 2.347 -5.503 11.458 7 HB3 SER 2 3HB SER 2 1.576 -6.989 12.018 8 HG SER 2 HG SER 2 1.172 -5.115 13.339 9 H VAL 3 H VAL 3 3.084 -9.295 11.557 10 HA VAL 3 HA VAL 3 5.012 -9.665 9.514 11 HB VAL 3 HB VAL 3 3.871 -11.521 10.828 12 HG11 VAL 3 1HG1 VAL 3 1.532 -10.816 10.651 13 HG12 VAL 3 2HG1 VAL 3 1.726 -12.447 10.014 14 HG13 VAL 3 3HG1 VAL 3 1.554 -11.085 8.905 15 HG21 VAL 3 1HG2 VAL 3 5.266 -12.028 8.861 16 HG22 VAL 3 2HG2 VAL 3 3.864 -11.854 7.803 17 HG23 VAL 3 3HG2 VAL 3 3.921 -13.163 8.985 18 H VAL 4 H VAL 4 1.799 -8.333 9.526 19 HA VAL 4 HA VAL 4 1.311 -8.123 6.727 20 HB VAL 4 HB VAL 4 0.435 -6.260 8.991 21 HG11 VAL 4 1HG1 VAL 4 0.147 -5.148 6.815 22 HG12 VAL 4 2HG1 VAL 4 -1.426 -5.561 7.497 23 HG13 VAL 4 3HG1 VAL 4 -0.744 -6.539 6.196 24 HG21 VAL 4 1HG2 VAL 4 -1.666 -7.555 9.016 25 HG22 VAL 4 2HG2 VAL 4 -0.278 -8.582 9.377 26 HG23 VAL 4 3HG2 VAL 4 -1.021 -8.636 7.777 27 H LYS 5 H LYS 5 2.930 -6.054 9.084 28 HA LYS 5 HA LYS 5 3.127 -3.719 7.516 29 HB2 LYS 5 2HB LYS 5 3.362 -3.745 9.994 30 HB3 LYS 5 3HB LYS 5 4.934 -4.529 9.835 31 HG2 LYS 5 2HG LYS 5 5.844 -2.571 8.697 32 HG3 LYS 5 3HG LYS 5 4.256 -1.795 8.691 33 HD2 LYS 5 2HD LYS 5 4.286 -1.662 11.139 34 HD3 LYS 5 3HD LYS 5 5.837 -2.510 11.190 35 HE2 LYS 5 2HE LYS 5 5.418 0.163 9.804 36 HE3 LYS 5 3HE LYS 5 5.994 0.001 11.462 37 HZ1 LYS 5 1HZ LYS 5 7.347 -1.084 9.054 38 HZ2 LYS 5 2HZ LYS 5 7.900 -1.229 10.642 39 HZ3 LYS 5 3HZ LYS 5 7.812 0.296 9.912 40 H GLU 6 H GLU 6 5.660 -6.171 8.210 41 HA GLU 6 HA GLU 6 7.715 -5.157 6.651 42 HB2 GLU 6 2HB GLU 6 8.690 -7.430 6.809 43 HB3 GLU 6 3HB GLU 6 8.031 -6.900 8.355 44 HG2 GLU 6 2HG GLU 6 5.969 -8.255 7.881 45 HG3 GLU 6 3HG GLU 6 6.747 -8.866 6.425 46 H LYS 7 H LYS 7 5.081 -7.405 5.748 47 HA LYS 7 HA LYS 7 5.887 -7.987 3.105 48 HB2 LYS 7 2HB LYS 7 3.082 -7.845 4.275 49 HB3 LYS 7 3HB LYS 7 3.451 -8.492 2.681 50 HG2 LYS 7 2HG LYS 7 4.822 -10.258 3.692 51 HG3 LYS 7 3HG LYS 7 4.479 -9.606 5.299 52 HD2 LYS 7 2HD LYS 7 2.037 -10.021 4.903 53 HD3 LYS 7 3HD LYS 7 2.443 -10.745 3.343 54 HE2 LYS 7 2HE LYS 7 3.307 -11.772 6.065 55 HE3 LYS 7 3HE LYS 7 2.045 -12.460 5.042 56 HZ1 LYS 7 1HZ LYS 7 4.085 -13.694 4.817 57 HZ2 LYS 7 2HZ LYS 7 4.936 -12.306 4.374 58 HZ3 LYS 7 3HZ LYS 7 3.733 -12.920 3.358 59 H LEU 8 H LEU 8 3.837 -5.375 4.370 60 HA LEU 8 HA LEU 8 3.193 -4.100 1.930 61 HB2 LEU 8 2HB LEU 8 3.510 -2.921 4.715 62 HB3 LEU 8 3HB LEU 8 2.771 -2.079 3.366 63 HG LEU 8 HG LEU 8 1.665 -4.607 4.654 64 HD11 LEU 8 1HD1 LEU 8 1.527 -2.694 6.178 65 HD12 LEU 8 2HD1 LEU 8 -0.066 -3.190 5.616 66 HD13 LEU 8 3HD1 LEU 8 0.698 -1.748 4.937 67 HD21 LEU 8 1HD2 LEU 8 -0.367 -4.168 3.346 68 HD22 LEU 8 2HD2 LEU 8 1.020 -4.435 2.297 69 HD23 LEU 8 3HD2 LEU 8 0.422 -2.795 2.559 70 H GLU 9 H GLU 9 6.006 -3.936 4.051 71 HA GLU 9 HA GLU 9 7.172 -1.602 2.797 72 HB2 GLU 9 2HB GLU 9 8.201 -3.438 4.977 73 HB3 GLU 9 3HB GLU 9 9.045 -1.986 4.424 74 HG2 GLU 9 2HG GLU 9 7.095 -0.619 5.095 75 HG3 GLU 9 3HG GLU 9 6.280 -2.069 5.675 76 H LYS 10 H LYS 10 7.759 -5.113 2.618 77 HA LYS 10 HA LYS 10 10.016 -5.044 0.933 78 HB2 LYS 10 2HB LYS 10 7.770 -7.096 1.166 79 HB3 LYS 10 3HB LYS 10 9.179 -7.340 0.134 80 HG2 LYS 10 2HG LYS 10 9.276 -6.954 3.149 81 HG3 LYS 10 3HG LYS 10 9.336 -8.517 2.322 82 HD2 LYS 10 2HD LYS 10 11.443 -7.799 1.175 83 HD3 LYS 10 3HD LYS 10 11.387 -6.269 2.058 84 HE2 LYS 10 2HE LYS 10 11.615 -7.480 4.187 85 HE3 LYS 10 3HE LYS 10 11.624 -9.021 3.326 86 HZ1 LYS 10 1HZ LYS 10 13.850 -8.243 3.929 87 HZ2 LYS 10 2HZ LYS 10 13.633 -6.873 2.965 88 HZ3 LYS 10 3HZ LYS 10 13.661 -8.405 2.254 89 H ALA 11 H ALA 11 6.564 -5.142 0.296 90 HA ALA 11 HA ALA 11 6.585 -4.969 -2.506 91 HB1 ALA 11 1HB ALA 11 4.230 -4.250 -2.296 92 HB2 ALA 11 2HB ALA 11 4.464 -3.998 -0.564 93 HB3 ALA 11 3HB ALA 11 4.585 -5.622 -1.240 94 H LEU 12 H LEU 12 6.559 -2.404 -0.002 95 HA LEU 12 HA LEU 12 6.397 -0.101 -1.511 96 HB2 LEU 12 2HB LEU 12 7.964 -0.681 1.010 97 HB3 LEU 12 3HB LEU 12 8.108 0.889 0.245 98 HG LEU 12 HG LEU 12 5.542 -0.304 1.358 99 HD11 LEU 12 1HD1 LEU 12 7.224 1.999 2.385 100 HD12 LEU 12 2HD1 LEU 12 7.113 0.393 3.113 101 HD13 LEU 12 3HD1 LEU 12 5.692 1.433 3.063 102 HD21 LEU 12 1HD2 LEU 12 5.060 1.104 -0.590 103 HD22 LEU 12 2HD2 LEU 12 6.010 2.421 0.106 104 HD23 LEU 12 3HD2 LEU 12 4.524 1.885 0.897 105 H ILE 13 H ILE 13 9.402 -1.924 -0.781 106 HA ILE 13 HA ILE 13 11.193 -0.318 -2.257 107 HB ILE 13 HB ILE 13 11.451 -3.298 -1.630 108 HG12 ILE 13 2HG1 ILE 13 12.479 -0.894 -0.040 109 HG13 ILE 13 3HG1 ILE 13 11.108 -1.901 0.415 110 HG21 ILE 13 1HG2 ILE 13 13.619 -1.280 -2.353 111 HG22 ILE 13 2HG2 ILE 13 13.035 -2.585 -3.382 112 HG23 ILE 13 3HG2 ILE 13 13.893 -2.964 -1.892 113 HD11 ILE 13 1HD1 ILE 13 13.977 -2.823 0.206 114 HD12 ILE 13 2HD1 ILE 13 12.599 -3.819 0.684 115 HD13 ILE 13 3HD1 ILE 13 13.096 -2.459 1.688 116 H GLU 14 H GLU 14 9.407 -3.280 -3.159 117 HA GLU 14 HA GLU 14 10.398 -3.749 -5.713 118 HB2 GLU 14 2HB GLU 14 7.551 -4.218 -4.706 119 HB3 GLU 14 3HB GLU 14 8.256 -4.965 -6.140 120 HG2 GLU 14 2HG GLU 14 9.098 -5.397 -3.262 121 HG3 GLU 14 3HG GLU 14 8.246 -6.537 -4.293 122 H VAL 15 H VAL 15 7.718 -1.696 -4.707 123 HA VAL 15 HA VAL 15 7.128 -0.837 -7.441 124 HB VAL 15 HB VAL 15 5.085 0.083 -6.546 125 HG11 VAL 15 1HG1 VAL 15 5.131 -2.367 -6.854 126 HG12 VAL 15 2HG1 VAL 15 4.046 -1.916 -5.548 127 HG13 VAL 15 3HG1 VAL 15 5.635 -2.579 -5.176 128 HG21 VAL 15 1HG2 VAL 15 6.187 -0.416 -3.746 129 HG22 VAL 15 2HG2 VAL 15 4.539 0.096 -4.107 130 HG23 VAL 15 3HG2 VAL 15 5.893 1.161 -4.487 131 H ARG 16 H ARG 16 9.108 0.149 -4.928 132 HA ARG 16 HA ARG 16 8.933 2.852 -4.594 133 HB2 ARG 16 2HB ARG 16 10.570 1.524 -3.405 134 HB3 ARG 16 3HB ARG 16 11.455 1.196 -4.884 135 HG2 ARG 16 2HG ARG 16 12.051 3.631 -5.022 136 HG3 ARG 16 3HG ARG 16 11.245 3.882 -3.469 137 HD2 ARG 16 2HD ARG 16 13.680 3.652 -3.176 138 HD3 ARG 16 3HD ARG 16 12.827 2.315 -2.396 139 HE ARG 16 HE ARG 16 13.809 1.866 -5.118 140 HH11 ARG 16 1HH1 ARG 16 14.373 1.326 -1.686 141 HH12 ARG 16 2HH1 ARG 16 15.495 0.036 -1.957 142 HH21 ARG 16 1HH2 ARG 16 15.299 0.174 -5.428 143 HH22 ARG 16 2HH2 ARG 16 16.013 -0.610 -4.056 144 HA PRO 17 HA PRO 17 11.461 4.054 -8.554 145 HB2 PRO 17 2HB PRO 17 12.041 2.276 -10.525 146 HB3 PRO 17 3HB PRO 17 13.014 2.347 -9.039 147 HG2 PRO 17 2HG PRO 17 10.797 0.433 -9.746 148 HG3 PRO 17 3HG PRO 17 12.406 0.089 -9.062 149 HD2 PRO 17 2HD PRO 17 10.165 0.276 -7.502 150 HD3 PRO 17 3HD PRO 17 11.783 0.712 -6.910 151 H TYR 18 H TYR 18 8.469 2.759 -8.382 152 HA TYR 18 HA TYR 18 7.594 3.680 -11.054 153 HB2 TYR 18 2HB TYR 18 6.472 1.399 -9.374 154 HB3 TYR 18 3HB TYR 18 5.736 1.993 -10.861 155 HD1 TYR 18 HD1 TYR 18 7.214 1.944 -13.013 156 HD2 TYR 18 HD2 TYR 18 8.120 -0.348 -9.514 157 HE1 TYR 18 HE1 TYR 18 8.633 0.461 -14.355 158 HE2 TYR 18 HE2 TYR 18 9.546 -1.831 -10.859 159 HH TYR 18 HH TYR 18 9.793 -2.515 -13.235 160 H VAL 19 H VAL 19 6.887 3.652 -7.580 161 HA VAL 19 HA VAL 19 4.328 5.006 -7.963 162 HB VAL 19 HB VAL 19 4.008 4.829 -5.526 163 HG11 VAL 19 1HG1 VAL 19 3.305 2.983 -6.971 164 HG12 VAL 19 2HG1 VAL 19 3.831 2.378 -5.400 165 HG13 VAL 19 3HG1 VAL 19 4.891 2.220 -6.805 166 HG21 VAL 19 1HG2 VAL 19 6.750 3.490 -5.430 167 HG22 VAL 19 2HG2 VAL 19 5.607 3.594 -4.088 168 HG23 VAL 19 3HG2 VAL 19 6.339 5.061 -4.734 169 H GLU 20 H GLU 20 3.913 7.082 -7.607 170 HA GLU 20 HA GLU 20 6.046 8.915 -6.729 171 HB2 GLU 20 2HB GLU 20 4.865 9.458 -8.854 172 HB3 GLU 20 3HB GLU 20 3.328 9.505 -8.001 173 HG2 GLU 20 2HG GLU 20 4.162 11.768 -8.430 174 HG3 GLU 20 3HG GLU 20 4.081 11.456 -6.698 175 H TYR 21 H TYR 21 5.820 10.170 -4.887 176 HA TYR 21 HA TYR 21 5.207 10.850 -2.838 177 HB2 TYR 21 2HB TYR 21 2.401 9.744 -3.265 178 HB3 TYR 21 3HB TYR 21 2.892 10.958 -2.089 179 HD1 TYR 21 HD1 TYR 21 4.224 13.058 -3.407 180 HD2 TYR 21 HD2 TYR 21 1.112 10.601 -5.011 181 HE1 TYR 21 HE1 TYR 21 3.639 14.837 -4.999 182 HE2 TYR 21 HE2 TYR 21 0.527 12.367 -6.604 183 HH TYR 21 HH TYR 21 2.524 15.033 -7.221 184 H TYR 22 H TYR 22 6.466 8.487 -3.266 185 HA TYR 22 HA TYR 22 5.752 6.194 -1.901 186 HB2 TYR 22 2HB TYR 22 7.826 6.396 -3.229 187 HB3 TYR 22 3HB TYR 22 8.514 7.477 -2.031 188 HD1 TYR 22 HD1 TYR 22 9.372 6.559 0.152 189 HD2 TYR 22 HD2 TYR 22 7.753 3.969 -2.843 190 HE1 TYR 22 HE1 TYR 22 10.380 4.631 1.278 191 HE2 TYR 22 HE2 TYR 22 8.768 2.048 -1.713 192 HH TYR 22 HH TYR 22 10.032 2.176 1.418 193 H ASN 23 H ASN 23 6.968 9.233 -0.504 194 HA ASN 23 HA ASN 23 7.479 8.345 2.138 195 HB2 ASN 23 2HB ASN 23 6.696 11.118 1.139 196 HB3 ASN 23 3HB ASN 23 7.267 10.785 2.769 197 HD21 ASN 23 1HD2 ASN 23 9.450 10.303 3.094 198 HD22 ASN 23 2HD2 ASN 23 10.647 10.630 1.895 199 H GLU 24 H GLU 24 4.570 9.658 0.597 200 HA GLU 24 HA GLU 24 2.939 9.776 2.929 201 HB2 GLU 24 2HB GLU 24 2.167 9.742 -0.016 202 HB3 GLU 24 3HB GLU 24 1.045 10.058 1.310 203 HG2 GLU 24 2HG GLU 24 2.471 12.028 1.941 204 HG3 GLU 24 3HG GLU 24 3.408 11.754 0.468 205 H LEU 25 H LEU 25 3.089 7.453 0.179 206 HA LEU 25 HA LEU 25 1.215 5.598 1.062 207 HB2 LEU 25 2HB LEU 25 2.314 5.629 -1.188 208 HB3 LEU 25 3HB LEU 25 3.783 5.014 -0.457 209 HG LEU 25 HG LEU 25 2.589 2.900 0.153 210 HD11 LEU 25 1HD1 LEU 25 0.229 4.084 -1.343 211 HD12 LEU 25 2HD1 LEU 25 0.315 3.740 0.387 212 HD13 LEU 25 3HD1 LEU 25 0.354 2.415 -0.772 213 HD21 LEU 25 1HD2 LEU 25 3.842 3.029 -1.962 214 HD22 LEU 25 2HD2 LEU 25 2.389 3.581 -2.802 215 HD23 LEU 25 3HD2 LEU 25 2.449 1.961 -2.102 216 H LYS 26 H LYS 26 4.688 5.686 1.655 217 HA LYS 26 HA LYS 26 5.070 3.543 3.351 218 HB2 LYS 26 2HB LYS 26 6.903 5.038 2.585 219 HB3 LYS 26 3HB LYS 26 6.330 6.295 3.681 220 HG2 LYS 26 2HG LYS 26 6.735 4.625 5.586 221 HG3 LYS 26 3HG LYS 26 7.566 3.616 4.402 222 HD2 LYS 26 2HD LYS 26 9.200 4.911 5.626 223 HD3 LYS 26 3HD LYS 26 9.146 5.503 3.963 224 HE2 LYS 26 2HE LYS 26 7.757 7.417 4.691 225 HE3 LYS 26 3HE LYS 26 7.767 6.799 6.344 226 HZ1 LYS 26 1HZ LYS 26 10.150 7.686 4.817 227 HZ2 LYS 26 2HZ LYS 26 10.164 7.092 6.399 228 HZ3 LYS 26 3HZ LYS 26 9.386 8.552 6.051 229 H ALA 27 H ALA 27 3.768 6.773 4.235 230 HA ALA 27 HA ALA 27 3.541 6.243 7.044 231 HB1 ALA 27 1HB ALA 27 2.308 8.380 7.117 232 HB2 ALA 27 2HB ALA 27 2.242 8.409 5.351 233 HB3 ALA 27 3HB ALA 27 3.795 8.533 6.177 234 H LEU 28 H LEU 28 1.366 5.965 4.256 235 HA LEU 28 HA LEU 28 -1.040 5.402 5.600 236 HB2 LEU 28 2HB LEU 28 -0.822 6.064 3.203 237 HB3 LEU 28 3HB LEU 28 -0.073 4.518 2.855 238 HG LEU 28 HG LEU 28 -2.184 3.339 3.350 239 HD11 LEU 28 1HD1 LEU 28 -4.274 4.547 3.783 240 HD12 LEU 28 2HD1 LEU 28 -3.386 6.071 3.881 241 HD13 LEU 28 3HD1 LEU 28 -3.104 4.801 5.075 242 HD21 LEU 28 1HD2 LEU 28 -2.593 5.638 1.405 243 HD22 LEU 28 2HD2 LEU 28 -3.509 4.128 1.441 244 HD23 LEU 28 3HD2 LEU 28 -1.793 4.103 1.049 245 H VAL 29 H VAL 29 1.313 3.193 4.075 246 HA VAL 29 HA VAL 29 0.692 0.703 4.997 247 HB VAL 29 HB VAL 29 3.331 2.088 4.437 248 HG11 VAL 29 1HG1 VAL 29 3.988 0.529 6.177 249 HG12 VAL 29 2HG1 VAL 29 4.568 -0.070 4.619 250 HG13 VAL 29 3HG1 VAL 29 3.142 -0.797 5.368 251 HG21 VAL 29 1HG2 VAL 29 1.915 1.475 2.522 252 HG22 VAL 29 2HG2 VAL 29 1.912 -0.212 3.040 253 HG23 VAL 29 3HG2 VAL 29 3.416 0.544 2.503 254 H SER 30 H SER 30 2.574 3.159 6.660 255 HA SER 30 HA SER 30 3.317 1.656 8.929 256 HB2 SER 30 2HB SER 30 4.518 3.675 8.290 257 HB3 SER 30 3HB SER 30 3.085 4.668 8.563 258 HG SER 30 HG SER 30 3.532 4.718 10.609 259 H LYS 31 H LYS 31 0.468 3.642 8.274 260 HA LYS 31 HA LYS 31 -0.551 3.479 10.978 261 HB2 LYS 31 2HB LYS 31 -0.752 5.510 9.443 262 HB3 LYS 31 3HB LYS 31 -1.963 4.609 8.529 263 HG2 LYS 31 2HG LYS 31 -3.415 4.493 10.488 264 HG3 LYS 31 3HG LYS 31 -2.174 5.251 11.491 265 HD2 LYS 31 2HD LYS 31 -2.353 7.307 10.030 266 HD3 LYS 31 3HD LYS 31 -3.712 6.532 9.201 267 HE2 LYS 31 2HE LYS 31 -3.574 7.301 12.141 268 HE3 LYS 31 3HE LYS 31 -4.560 8.064 10.893 269 HZ1 LYS 31 1HZ LYS 31 -5.938 6.617 12.147 270 HZ2 LYS 31 2HZ LYS 31 -4.872 5.316 11.985 271 HZ3 LYS 31 3HZ LYS 31 -5.716 5.891 10.637 272 H ILE 32 H ILE 32 -1.262 1.908 7.857 273 HA ILE 32 HA ILE 32 -3.789 0.820 8.731 274 HB ILE 32 HB ILE 32 -3.903 -0.417 6.611 275 HG12 ILE 32 2HG1 ILE 32 -1.105 0.665 6.010 276 HG13 ILE 32 3HG1 ILE 32 -1.484 -1.012 6.369 277 HG21 ILE 32 1HG2 ILE 32 -4.640 1.922 6.640 278 HG22 ILE 32 2HG2 ILE 32 -3.978 1.498 5.064 279 HG23 ILE 32 3HG2 ILE 32 -3.019 2.462 6.190 280 HD11 ILE 32 1HD1 ILE 32 -2.447 0.523 3.958 281 HD12 ILE 32 2HD1 ILE 32 -2.771 -1.178 4.310 282 HD13 ILE 32 3HD1 ILE 32 -1.120 -0.637 3.998 283 H SER 33 H SER 33 -0.523 -0.557 8.201 284 HA SER 33 HA SER 33 -0.694 -3.086 9.150 285 HB2 SER 33 2HB SER 33 1.375 -1.046 10.055 286 HB3 SER 33 3HB SER 33 1.559 -2.800 10.166 287 HG SER 33 HG SER 33 2.101 -1.219 8.123 288 H SER 34 H SER 34 -0.956 -0.175 11.125 289 HA SER 34 HA SER 34 -1.060 -1.535 13.679 290 HB2 SER 34 2HB SER 34 -0.120 0.764 13.432 291 HB3 SER 34 3HB SER 34 -1.712 1.358 12.960 292 HG SER 34 HG SER 34 -2.109 0.105 15.202 293 H SER 35 H SER 35 -3.333 -0.395 11.263 294 HA SER 35 HA SER 35 -5.653 -0.328 12.974 295 HB2 SER 35 2HB SER 35 -5.340 1.199 11.003 296 HB3 SER 35 3HB SER 35 -5.488 -0.191 9.930 297 HG SER 35 HG SER 35 -7.536 -0.015 11.725 298 H VAL 36 H VAL 36 -4.363 -2.509 10.498 299 HA VAL 36 HA VAL 36 -6.554 -4.437 10.906 300 HB VAL 36 HB VAL 36 -6.007 -5.400 8.770 301 HG11 VAL 36 1HG1 VAL 36 -5.925 -2.373 8.505 302 HG12 VAL 36 2HG1 VAL 36 -7.372 -3.377 8.636 303 HG13 VAL 36 3HG1 VAL 36 -6.336 -3.508 7.213 304 HG21 VAL 36 1HG2 VAL 36 -4.128 -4.652 7.337 305 HG22 VAL 36 2HG2 VAL 36 -3.554 -5.360 8.845 306 HG23 VAL 36 3HG2 VAL 36 -3.549 -3.608 8.637 307 H ASN 37 H ASN 37 -5.831 -6.758 10.628 308 HA ASN 37 HA ASN 37 -3.279 -7.332 12.041 309 HB2 ASN 37 2HB ASN 37 -5.868 -8.941 12.254 310 HB3 ASN 37 3HB ASN 37 -4.353 -9.287 13.085 311 HD21 ASN 37 1HD2 ASN 37 -7.165 -7.242 12.980 312 HD22 ASN 37 2HD2 ASN 37 -6.933 -6.500 14.520 313 H ASP 38 H ASP 38 -4.978 -7.685 9.157 314 HA ASP 38 HA ASP 38 -3.447 -10.098 8.340 315 HB2 ASP 38 2HB ASP 38 -6.303 -9.395 7.519 316 HB3 ASP 38 3HB ASP 38 -5.360 -10.714 6.838 317 H LEU 39 H LEU 39 -2.527 -10.026 6.323 318 HA LEU 39 HA LEU 39 -2.002 -7.560 5.024 319 HB2 LEU 39 2HB LEU 39 -0.616 -9.756 5.022 320 HB3 LEU 39 3HB LEU 39 -1.707 -10.336 3.786 321 HG LEU 39 HG LEU 39 0.534 -9.473 2.970 322 HD11 LEU 39 1HD1 LEU 39 -1.308 -9.690 1.401 323 HD12 LEU 39 2HD1 LEU 39 -0.253 -8.338 1.001 324 HD13 LEU 39 3HD1 LEU 39 -1.818 -8.038 1.761 325 HD21 LEU 39 1HD2 LEU 39 -0.573 -6.748 3.686 326 HD22 LEU 39 2HD2 LEU 39 0.930 -7.074 2.816 327 HD23 LEU 39 3HD2 LEU 39 0.762 -7.574 4.496 328 H GLU 40 H GLU 40 -4.346 -10.135 4.541 329 HA GLU 40 HA GLU 40 -5.554 -9.335 2.126 330 HB2 GLU 40 2HB GLU 40 -5.864 -11.553 3.227 331 HB3 GLU 40 3HB GLU 40 -6.780 -10.776 4.514 332 HG2 GLU 40 2HG GLU 40 -8.490 -10.083 2.846 333 HG3 GLU 40 3HG GLU 40 -7.580 -10.916 1.588 334 H GLU 41 H GLU 41 -6.044 -8.299 5.467 335 HA GLU 41 HA GLU 41 -8.386 -6.673 4.966 336 HB2 GLU 41 2HB GLU 41 -6.494 -6.886 7.342 337 HB3 GLU 41 3HB GLU 41 -7.875 -5.792 7.320 338 HG2 GLU 41 2HG GLU 41 -8.094 -8.799 6.987 339 HG3 GLU 41 3HG GLU 41 -8.230 -7.971 8.535 340 H ALA 42 H ALA 42 -4.920 -6.217 5.001 341 HA ALA 42 HA ALA 42 -4.875 -3.342 4.980 342 HB1 ALA 42 1HB ALA 42 -2.756 -5.323 4.060 343 HB2 ALA 42 2HB ALA 42 -2.916 -4.668 5.691 344 HB3 ALA 42 3HB ALA 42 -2.496 -3.600 4.348 345 H ILE 43 H ILE 43 -4.850 -5.874 2.556 346 HA ILE 43 HA ILE 43 -4.516 -4.431 0.191 347 HB ILE 43 HB ILE 43 -5.928 -7.039 0.845 348 HG12 ILE 43 2HG1 ILE 43 -3.432 -6.502 -0.831 349 HG13 ILE 43 3HG1 ILE 43 -3.406 -6.898 0.883 350 HG21 ILE 43 1HG2 ILE 43 -6.202 -7.541 -1.567 351 HG22 ILE 43 2HG2 ILE 43 -5.711 -5.893 -1.962 352 HG23 ILE 43 3HG2 ILE 43 -7.197 -6.177 -1.057 353 HD11 ILE 43 1HD1 ILE 43 -4.322 -8.679 -1.374 354 HD12 ILE 43 2HD1 ILE 43 -4.455 -9.088 0.339 355 HD13 ILE 43 3HD1 ILE 43 -2.867 -8.844 -0.389 356 H VAL 44 H VAL 44 -7.723 -5.632 1.364 357 HA VAL 44 HA VAL 44 -9.407 -4.128 -0.169 358 HB VAL 44 HB VAL 44 -9.864 -5.022 2.716 359 HG11 VAL 44 1HG1 VAL 44 -12.302 -4.900 2.191 360 HG12 VAL 44 2HG1 VAL 44 -11.919 -4.176 0.628 361 HG13 VAL 44 3HG1 VAL 44 -11.537 -3.311 2.117 362 HG21 VAL 44 1HG2 VAL 44 -9.288 -6.869 1.181 363 HG22 VAL 44 2HG2 VAL 44 -10.561 -6.360 0.066 364 HG23 VAL 44 3HG2 VAL 44 -10.984 -6.976 1.666 365 H VAL 45 H VAL 45 -8.030 -3.098 2.989 366 HA VAL 45 HA VAL 45 -9.241 -0.573 3.207 367 HB VAL 45 HB VAL 45 -6.483 -1.496 4.152 368 HG11 VAL 45 1HG1 VAL 45 -6.266 0.930 3.777 369 HG12 VAL 45 2HG1 VAL 45 -6.334 0.609 5.508 370 HG13 VAL 45 3HG1 VAL 45 -7.758 1.233 4.672 371 HG21 VAL 45 1HG2 VAL 45 -9.049 -0.833 5.668 372 HG22 VAL 45 2HG2 VAL 45 -7.536 -1.377 6.399 373 HG23 VAL 45 3HG2 VAL 45 -8.435 -2.453 5.331 374 H LEU 46 H LEU 46 -6.237 -1.472 1.460 375 HA LEU 46 HA LEU 46 -5.674 1.127 0.436 376 HB2 LEU 46 2HB LEU 46 -4.750 -1.605 -0.484 377 HB3 LEU 46 3HB LEU 46 -4.164 -0.107 -1.195 378 HG LEU 46 HG LEU 46 -3.806 -0.916 1.719 379 HD11 LEU 46 1HD1 LEU 46 -2.475 -2.309 0.200 380 HD12 LEU 46 2HD1 LEU 46 -1.464 -1.257 1.188 381 HD13 LEU 46 3HD1 LEU 46 -1.758 -0.857 -0.508 382 HD21 LEU 46 1HD2 LEU 46 -2.709 1.485 0.213 383 HD22 LEU 46 2HD2 LEU 46 -2.289 1.021 1.863 384 HD23 LEU 46 3HD2 LEU 46 -3.934 1.517 1.485 385 H ARG 47 H ARG 47 -7.745 -1.467 -0.739 386 HA ARG 47 HA ARG 47 -8.147 -0.447 -3.380 387 HB2 ARG 47 2HB ARG 47 -9.828 -2.372 -1.714 388 HB3 ARG 47 3HB ARG 47 -10.079 -2.052 -3.432 389 HG2 ARG 47 2HG ARG 47 -7.860 -2.968 -3.940 390 HG3 ARG 47 3HG ARG 47 -7.555 -3.236 -2.228 391 HD2 ARG 47 2HD ARG 47 -8.143 -5.331 -3.290 392 HD3 ARG 47 3HD ARG 47 -9.431 -4.859 -2.179 393 HE ARG 47 HE ARG 47 -10.712 -4.105 -4.128 394 HH11 ARG 47 1HH1 ARG 47 -8.063 -6.358 -4.797 395 HH12 ARG 47 2HH1 ARG 47 -8.777 -6.909 -6.277 396 HH21 ARG 47 1HH2 ARG 47 -11.600 -4.846 -6.061 397 HH22 ARG 47 2HH2 ARG 47 -10.776 -6.056 -6.994 398 H GLU 48 H GLU 48 -9.412 0.297 -0.255 399 HA GLU 48 HA GLU 48 -11.578 2.017 -1.208 400 HB2 GLU 48 2HB GLU 48 -10.490 1.465 1.579 401 HB3 GLU 48 3HB GLU 48 -11.865 2.516 1.246 402 HG2 GLU 48 2HG GLU 48 -11.722 -0.457 0.635 403 HG3 GLU 48 3HG GLU 48 -12.548 0.264 2.015 404 H GLU 49 H GLU 49 -8.310 2.245 0.061 405 HA GLU 49 HA GLU 49 -8.183 5.035 0.515 406 HB2 GLU 49 2HB GLU 49 -5.884 3.170 -0.198 407 HB3 GLU 49 3HB GLU 49 -5.698 4.821 0.387 408 HG2 GLU 49 2HG GLU 49 -6.645 2.384 1.888 409 HG3 GLU 49 3HG GLU 49 -5.273 3.422 2.248 410 H GLU 50 H GLU 50 -7.382 3.066 -2.268 411 HA GLU 50 HA GLU 50 -6.535 4.947 -4.110 412 HB2 GLU 50 2HB GLU 50 -6.554 2.488 -4.486 413 HB3 GLU 50 3HB GLU 50 -8.307 2.536 -4.667 414 HG2 GLU 50 2HG GLU 50 -7.968 4.098 -6.626 415 HG3 GLU 50 3HG GLU 50 -6.236 3.810 -6.489 416 H LYS 51 H LYS 51 -9.922 3.904 -3.488 417 HA LYS 51 HA LYS 51 -11.316 5.443 -5.318 418 HB2 LYS 51 2HB LYS 51 -12.120 4.500 -2.539 419 HB3 LYS 51 3HB LYS 51 -13.260 5.171 -3.704 420 HG2 LYS 51 2HG LYS 51 -13.002 3.322 -5.180 421 HG3 LYS 51 3HG LYS 51 -11.575 2.739 -4.320 422 HD2 LYS 51 2HD LYS 51 -13.561 1.364 -3.825 423 HD3 LYS 51 3HD LYS 51 -12.921 2.136 -2.380 424 HE2 LYS 51 2HE LYS 51 -14.714 3.827 -2.482 425 HE3 LYS 51 3HE LYS 51 -15.340 3.081 -3.956 426 HZ1 LYS 51 1HZ LYS 51 -15.745 1.051 -2.688 427 HZ2 LYS 51 2HZ LYS 51 -16.582 2.362 -2.033 428 HZ3 LYS 51 3HZ LYS 51 -15.177 1.798 -1.283 429 H LYS 52 H LYS 52 -10.347 6.305 -1.981 430 HA LYS 52 HA LYS 52 -11.736 8.865 -2.074 431 HB2 LYS 52 2HB LYS 52 -11.036 9.151 0.229 432 HB3 LYS 52 3HB LYS 52 -11.606 7.500 0.023 433 HG2 LYS 52 2HG LYS 52 -9.178 6.793 -0.200 434 HG3 LYS 52 3HG LYS 52 -8.726 8.434 0.257 435 HD2 LYS 52 2HD LYS 52 -8.594 7.022 2.215 436 HD3 LYS 52 3HD LYS 52 -9.958 8.123 2.423 437 HE2 LYS 52 2HE LYS 52 -11.537 6.341 1.898 438 HE3 LYS 52 3HE LYS 52 -10.222 5.253 1.447 439 HZ1 LYS 52 1HZ LYS 52 -9.441 5.316 3.730 440 HZ2 LYS 52 2HZ LYS 52 -11.036 4.754 3.643 441 HZ3 LYS 52 3HZ LYS 52 -10.723 6.333 4.163 442 H ALA 53 H ALA 53 -8.510 7.650 -2.623 443 HA ALA 53 HA ALA 53 -7.112 10.154 -2.543 444 HB1 ALA 53 1HB ALA 53 -5.224 8.882 -3.496 445 HB2 ALA 53 2HB ALA 53 -6.294 7.506 -3.790 446 HB3 ALA 53 3HB ALA 53 -5.953 8.015 -2.138 447 H SER 54 H SER 54 -5.887 10.894 -4.468 448 HA SER 54 HA SER 54 -7.423 10.755 -6.991 449 HB2 SER 54 2HB SER 54 -6.647 13.211 -7.276 450 HB3 SER 54 3HB SER 54 -7.913 12.920 -6.083 451 HG SER 54 HG SER 54 -5.150 13.361 -5.603 452 H GLU 55 H GLU 55 -6.190 10.795 -8.889 453 HA GLU 55 HA GLU 55 -3.655 9.552 -8.913 454 HB2 GLU 55 2HB GLU 55 -5.137 11.023 -11.146 455 HB3 GLU 55 3HB GLU 55 -3.785 9.914 -11.390 456 HG2 GLU 55 2HG GLU 55 -5.135 8.064 -10.489 457 HG3 GLU 55 3HG GLU 55 -6.476 9.168 -10.197 458 HA PRO 56 HA PRO 56 -1.725 9.436 -10.086 459 HB2 PRO 56 2HB PRO 56 0.944 9.714 -9.905 460 HB3 PRO 56 3HB PRO 56 0.029 10.554 -11.177 461 HG2 PRO 56 2HG PRO 56 1.156 11.661 -8.627 462 HG3 PRO 56 3HG PRO 56 1.075 12.403 -10.240 463 HD2 PRO 56 2HD PRO 56 -0.751 12.848 -8.120 464 HD3 PRO 56 3HD PRO 56 -1.003 13.302 -9.819 465 H PHE 57 H PHE 57 -1.886 10.673 -6.954 466 HA PHE 57 HA PHE 57 -0.414 8.684 -5.540 467 HB2 PHE 57 2HB PHE 57 -1.337 10.838 -4.531 468 HB3 PHE 57 3HB PHE 57 -2.924 10.078 -4.516 469 HD1 PHE 57 HD1 PHE 57 0.581 9.552 -3.291 470 HD2 PHE 57 HD2 PHE 57 -3.567 8.832 -2.567 471 HE1 PHE 57 HE1 PHE 57 1.128 8.567 -1.111 472 HE2 PHE 57 HE2 PHE 57 -3.008 7.845 -0.386 473 HZ PHE 57 HZ PHE 57 -0.661 7.711 0.347 474 H LYS 58 H LYS 58 -3.562 8.602 -7.126 475 HA LYS 58 HA LYS 58 -4.357 6.030 -6.167 476 HB2 LYS 58 2HB LYS 58 -5.029 7.488 -8.732 477 HB3 LYS 58 3HB LYS 58 -5.674 5.891 -8.365 478 HG2 LYS 58 2HG LYS 58 -6.666 6.849 -6.268 479 HG3 LYS 58 3HG LYS 58 -6.137 8.443 -6.806 480 HD2 LYS 58 2HD LYS 58 -8.490 8.110 -7.384 481 HD3 LYS 58 3HD LYS 58 -7.524 8.210 -8.858 482 HE2 LYS 58 2HE LYS 58 -7.547 5.719 -9.003 483 HE3 LYS 58 3HE LYS 58 -8.562 5.663 -7.560 484 HZ1 LYS 58 1HZ LYS 58 -9.263 6.870 -10.175 485 HZ2 LYS 58 2HZ LYS 58 -10.229 6.952 -8.794 486 HZ3 LYS 58 3HZ LYS 58 -9.905 5.455 -9.508 487 H THR 59 H THR 59 -2.024 6.982 -8.602 488 HA THR 59 HA THR 59 -1.716 4.357 -9.751 489 HB THR 59 HB THR 59 0.260 6.680 -9.930 490 HG1 THR 59 HG1 THR 59 -2.104 6.137 -11.425 491 HG21 THR 59 1HG2 THR 59 0.870 5.643 -12.105 492 HG22 THR 59 2HG2 THR 59 -0.285 4.344 -11.811 493 HG23 THR 59 3HG2 THR 59 1.134 4.512 -10.775 494 H ASP 60 H ASP 60 -0.158 6.303 -7.338 495 HA ASP 60 HA ASP 60 2.023 4.788 -6.548 496 HB2 ASP 60 2HB ASP 60 1.762 7.009 -5.752 497 HB3 ASP 60 3HB ASP 60 0.134 6.711 -5.172 498 H ILE 61 H ILE 61 -1.163 4.854 -4.977 499 HA ILE 61 HA ILE 61 -0.920 2.663 -3.315 500 HB ILE 61 HB ILE 61 -3.436 3.774 -4.622 501 HG12 ILE 61 2HG1 ILE 61 -2.244 4.246 -1.842 502 HG13 ILE 61 3HG1 ILE 61 -2.130 5.364 -3.197 503 HG21 ILE 61 1HG2 ILE 61 -4.730 2.653 -2.822 504 HG22 ILE 61 2HG2 ILE 61 -3.262 1.851 -2.261 505 HG23 ILE 61 3HG2 ILE 61 -3.914 1.484 -3.859 506 HD11 ILE 61 1HD1 ILE 61 -4.668 4.541 -1.791 507 HD12 ILE 61 2HD1 ILE 61 -4.560 5.649 -3.162 508 HD13 ILE 61 3HD1 ILE 61 -3.811 6.072 -1.626 509 H ARG 62 H ARG 62 -2.482 2.557 -6.631 510 HA ARG 62 HA ARG 62 -3.180 -0.138 -6.468 511 HB2 ARG 62 2HB ARG 62 -3.703 -0.066 -8.842 512 HB3 ARG 62 3HB ARG 62 -4.244 1.390 -8.042 513 HG2 ARG 62 2HG ARG 62 -3.412 2.306 -9.980 514 HG3 ARG 62 3HG ARG 62 -1.969 2.399 -8.972 515 HD2 ARG 62 2HD ARG 62 -1.451 1.573 -11.236 516 HD3 ARG 62 3HD ARG 62 -1.088 0.358 -10.006 517 HE ARG 62 HE ARG 62 -3.681 0.228 -11.392 518 HH11 ARG 62 1HH1 ARG 62 -0.489 -1.190 -10.932 519 HH12 ARG 62 2HH1 ARG 62 -0.900 -2.669 -11.733 520 HH21 ARG 62 1HH2 ARG 62 -4.178 -1.681 -12.477 521 HH22 ARG 62 2HH2 ARG 62 -2.998 -2.946 -12.611 522 H ILE 63 H ILE 63 -0.121 1.226 -7.766 523 HA ILE 63 HA ILE 63 0.876 -1.218 -8.834 524 HB ILE 63 HB ILE 63 2.515 1.153 -7.799 525 HG12 ILE 63 2HG1 ILE 63 1.624 0.511 -10.659 526 HG13 ILE 63 3HG1 ILE 63 0.907 1.749 -9.637 527 HG21 ILE 63 1HG2 ILE 63 4.356 0.302 -9.218 528 HG22 ILE 63 2HG2 ILE 63 3.380 -1.096 -9.676 529 HG23 ILE 63 3HG2 ILE 63 3.901 -0.891 -8.005 530 HD11 ILE 63 1HD1 ILE 63 2.422 2.714 -11.266 531 HD12 ILE 63 2HD1 ILE 63 3.754 1.735 -10.654 532 HD13 ILE 63 3HD1 ILE 63 3.027 2.978 -9.631 533 H LEU 64 H LEU 64 1.197 0.229 -5.552 534 HA LEU 64 HA LEU 64 2.758 -1.797 -4.325 535 HB2 LEU 64 2HB LEU 64 2.252 0.409 -3.272 536 HB3 LEU 64 3HB LEU 64 0.573 -0.068 -3.097 537 HG LEU 64 HG LEU 64 1.473 -2.039 -1.640 538 HD11 LEU 64 1HD1 LEU 64 3.603 -1.681 -0.510 539 HD12 LEU 64 2HD1 LEU 64 3.914 -0.263 -1.518 540 HD13 LEU 64 3HD1 LEU 64 3.817 -1.866 -2.251 541 HD21 LEU 64 1HD2 LEU 64 1.693 0.769 -0.531 542 HD22 LEU 64 2HD2 LEU 64 1.479 -0.713 0.403 543 HD23 LEU 64 3HD2 LEU 64 0.209 -0.171 -0.689 544 H LEU 65 H LEU 65 -0.673 -1.276 -4.484 545 HA LEU 65 HA LEU 65 -1.726 -3.440 -3.110 546 HB2 LEU 65 2HB LEU 65 -2.927 -1.373 -3.670 547 HB3 LEU 65 3HB LEU 65 -2.822 -1.750 -5.381 548 HG LEU 65 HG LEU 65 -4.304 -3.746 -4.980 549 HD11 LEU 65 1HD1 LEU 65 -4.700 -2.579 -2.211 550 HD12 LEU 65 2HD1 LEU 65 -3.844 -4.077 -2.586 551 HD13 LEU 65 3HD1 LEU 65 -5.567 -3.945 -2.919 552 HD21 LEU 65 1HD2 LEU 65 -6.361 -2.464 -4.865 553 HD22 LEU 65 2HD2 LEU 65 -5.176 -1.611 -5.845 554 HD23 LEU 65 3HD2 LEU 65 -5.505 -1.073 -4.194 555 H ASP 66 H ASP 66 -0.519 -3.207 -6.411 556 HA ASP 66 HA ASP 66 -1.802 -5.498 -7.454 557 HB2 ASP 66 2HB ASP 66 -0.895 -3.588 -8.793 558 HB3 ASP 66 3HB ASP 66 0.740 -4.086 -8.378 559 H PHE 67 H PHE 67 1.634 -4.934 -6.645 560 HA PHE 67 HA PHE 67 2.530 -7.581 -6.737 561 HB2 PHE 67 2HB PHE 67 4.017 -5.550 -6.619 562 HB3 PHE 67 3HB PHE 67 3.605 -5.368 -4.920 563 HD1 PHE 67 HD1 PHE 67 5.403 -7.490 -7.380 564 HD2 PHE 67 HD2 PHE 67 4.661 -6.795 -3.219 565 HE1 PHE 67 HE1 PHE 67 7.219 -9.036 -6.789 566 HE2 PHE 67 HE2 PHE 67 6.476 -8.342 -2.642 567 HZ PHE 67 HZ PHE 67 7.755 -9.471 -4.422 568 H LEU 68 H LEU 68 0.899 -5.874 -4.061 569 HA LEU 68 HA LEU 68 1.392 -7.710 -1.972 570 HB2 LEU 68 2HB LEU 68 -0.839 -5.713 -2.428 571 HB3 LEU 68 3HB LEU 68 -0.786 -6.713 -0.980 572 HG LEU 68 HG LEU 68 1.418 -4.783 -1.805 573 HD11 LEU 68 1HD1 LEU 68 0.612 -3.346 0.002 574 HD12 LEU 68 2HD1 LEU 68 -0.749 -4.438 0.277 575 HD13 LEU 68 3HD1 LEU 68 -0.609 -3.561 -1.251 576 HD21 LEU 68 1HD2 LEU 68 2.273 -5.149 0.489 577 HD22 LEU 68 2HD2 LEU 68 2.269 -6.639 -0.448 578 HD23 LEU 68 3HD2 LEU 68 1.016 -6.362 0.766 579 H GLU 69 H GLU 69 -1.453 -7.455 -4.158 580 HA GLU 69 HA GLU 69 -2.611 -9.941 -3.241 581 HB2 GLU 69 2HB GLU 69 -3.203 -8.344 -5.764 582 HB3 GLU 69 3HB GLU 69 -4.222 -9.606 -5.071 583 HG2 GLU 69 2HG GLU 69 -4.566 -8.165 -3.071 584 HG3 GLU 69 3HG GLU 69 -3.610 -6.898 -3.840 585 H SER 70 H SER 70 -0.212 -8.992 -5.494 586 HA SER 70 HA SER 70 1.247 -10.025 -6.855 587 HB2 SER 70 2HB SER 70 1.324 -11.805 -5.032 588 HB3 SER 70 3HB SER 70 0.097 -12.700 -5.925 589 HG SER 70 HG SER 70 2.718 -12.025 -6.797 590 H LYS 71 H LYS 71 -1.255 -9.058 -7.652 591 HA LYS 71 HA LYS 71 -3.007 -10.499 -9.120 592 HB2 LYS 71 2HB LYS 71 -2.005 -7.660 -9.525 593 HB3 LYS 71 3HB LYS 71 -3.400 -8.305 -10.381 594 HG2 LYS 71 2HG LYS 71 -4.622 -8.603 -8.326 595 HG3 LYS 71 3HG LYS 71 -3.202 -8.214 -7.366 596 HD2 LYS 71 2HD LYS 71 -4.776 -6.347 -7.373 597 HD3 LYS 71 3HD LYS 71 -3.271 -5.885 -8.160 598 HE2 LYS 71 2HE LYS 71 -5.667 -6.803 -9.766 599 HE3 LYS 71 3HE LYS 71 -5.509 -5.136 -9.234 600 HZ1 LYS 71 1HZ LYS 71 -3.665 -6.612 -11.026 601 HZ2 LYS 71 2HZ LYS 71 -3.342 -5.078 -10.408 602 HZ3 LYS 71 3HZ LYS 71 -4.668 -5.317 -11.431 603 HA PRO 72 HA PRO 72 -0.967 -11.807 -12.957 604 HB2 PRO 72 2HB PRO 72 -3.705 -12.066 -14.112 605 HB3 PRO 72 3HB PRO 72 -2.498 -13.328 -13.793 606 HG2 PRO 72 2HG PRO 72 -4.741 -13.147 -12.324 607 HG3 PRO 72 3HG PRO 72 -3.191 -13.647 -11.606 608 HD2 PRO 72 2HD PRO 72 -4.507 -10.927 -11.519 609 HD3 PRO 72 3HD PRO 72 -3.754 -11.853 -10.200 Start of MODEL 6 1 H GLY 1 1H GLY 1 3.898 -6.157 16.315 2 HA2 GLY 1 2HA GLY 1 5.688 -6.456 14.699 3 HA3 GLY 1 3HA GLY 1 5.996 -8.041 15.394 4 H SER 2 H SER 2 3.948 -6.174 13.314 5 HA SER 2 HA SER 2 1.968 -8.223 12.825 6 HB2 SER 2 2HB SER 2 2.564 -5.624 11.330 7 HB3 SER 2 3HB SER 2 1.114 -6.615 11.146 8 HG SER 2 HG SER 2 0.470 -5.172 12.593 9 H VAL 3 H VAL 3 2.358 -9.940 11.498 10 HA VAL 3 HA VAL 3 4.512 -10.286 9.728 11 HB VAL 3 HB VAL 3 3.165 -12.161 10.669 12 HG11 VAL 3 1HG1 VAL 3 0.911 -11.241 10.456 13 HG12 VAL 3 2HG1 VAL 3 1.008 -12.829 9.694 14 HG13 VAL 3 3HG1 VAL 3 0.997 -11.371 8.697 15 HG21 VAL 3 1HG2 VAL 3 3.288 -12.241 7.631 16 HG22 VAL 3 2HG2 VAL 3 3.192 -13.642 8.703 17 HG23 VAL 3 3HG2 VAL 3 4.618 -12.603 8.733 18 H VAL 4 H VAL 4 1.493 -8.663 9.317 19 HA VAL 4 HA VAL 4 1.380 -8.424 6.474 20 HB VAL 4 HB VAL 4 0.260 -6.514 8.581 21 HG11 VAL 4 1HG1 VAL 4 -1.407 -5.879 6.858 22 HG12 VAL 4 2HG1 VAL 4 -0.582 -6.911 5.688 23 HG13 VAL 4 3HG1 VAL 4 0.241 -5.498 6.351 24 HG21 VAL 4 1HG2 VAL 4 -1.080 -8.925 7.315 25 HG22 VAL 4 2HG2 VAL 4 -1.834 -7.798 8.447 26 HG23 VAL 4 3HG2 VAL 4 -0.498 -8.822 8.977 27 H LYS 5 H LYS 5 2.960 -6.607 9.061 28 HA LYS 5 HA LYS 5 3.483 -4.194 7.774 29 HB2 LYS 5 2HB LYS 5 3.857 -4.508 10.220 30 HB3 LYS 5 3HB LYS 5 5.283 -5.484 9.872 31 HG2 LYS 5 2HG LYS 5 6.291 -3.477 8.709 32 HG3 LYS 5 3HG LYS 5 4.894 -2.536 9.231 33 HD2 LYS 5 2HD LYS 5 6.734 -2.103 10.750 34 HD3 LYS 5 3HD LYS 5 5.500 -3.023 11.612 35 HE2 LYS 5 2HE LYS 5 6.820 -5.089 11.292 36 HE3 LYS 5 3HE LYS 5 8.043 -4.172 10.409 37 HZ1 LYS 5 1HZ LYS 5 8.372 -2.836 12.445 38 HZ2 LYS 5 2HZ LYS 5 8.774 -4.465 12.645 39 HZ3 LYS 5 3HZ LYS 5 7.321 -3.867 13.273 40 H GLU 6 H GLU 6 5.751 -7.009 8.057 41 HA GLU 6 HA GLU 6 7.855 -6.040 6.537 42 HB2 GLU 6 2HB GLU 6 8.608 -8.372 6.340 43 HB3 GLU 6 3HB GLU 6 7.990 -8.068 7.960 44 HG2 GLU 6 2HG GLU 6 5.865 -9.179 7.362 45 HG3 GLU 6 3HG GLU 6 6.479 -9.485 5.741 46 H LYS 7 H LYS 7 4.941 -7.724 5.485 47 HA LYS 7 HA LYS 7 5.608 -8.152 2.777 48 HB2 LYS 7 2HB LYS 7 2.841 -7.729 3.994 49 HB3 LYS 7 3HB LYS 7 3.167 -8.426 2.406 50 HG2 LYS 7 2HG LYS 7 4.371 -10.294 3.468 51 HG3 LYS 7 3HG LYS 7 4.041 -9.605 5.060 52 HD2 LYS 7 2HD LYS 7 1.628 -9.938 4.729 53 HD3 LYS 7 3HD LYS 7 1.912 -10.529 3.086 54 HE2 LYS 7 2HE LYS 7 2.839 -11.859 5.656 55 HE3 LYS 7 3HE LYS 7 1.529 -12.401 4.606 56 HZ1 LYS 7 1HZ LYS 7 3.141 -12.776 2.840 57 HZ2 LYS 7 2HZ LYS 7 3.563 -13.655 4.220 58 HZ3 LYS 7 3HZ LYS 7 4.398 -12.242 3.837 59 H LEU 8 H LEU 8 4.070 -5.449 4.427 60 HA LEU 8 HA LEU 8 3.563 -3.823 2.135 61 HB2 LEU 8 2HB LEU 8 3.828 -3.070 5.070 62 HB3 LEU 8 3HB LEU 8 3.154 -2.039 3.821 63 HG LEU 8 HG LEU 8 1.925 -4.686 4.686 64 HD11 LEU 8 1HD1 LEU 8 1.878 -3.092 6.530 65 HD12 LEU 8 2HD1 LEU 8 0.259 -3.359 5.893 66 HD13 LEU 8 3HD1 LEU 8 1.131 -1.874 5.492 67 HD21 LEU 8 1HD2 LEU 8 0.786 -2.469 2.955 68 HD22 LEU 8 2HD2 LEU 8 -0.064 -3.928 3.477 69 HD23 LEU 8 3HD2 LEU 8 1.321 -4.058 2.399 70 H GLU 9 H GLU 9 6.234 -4.088 4.479 71 HA GLU 9 HA GLU 9 7.657 -1.733 3.844 72 HB2 GLU 9 2HB GLU 9 8.606 -4.353 5.096 73 HB3 GLU 9 3HB GLU 9 9.590 -2.894 5.017 74 HG2 GLU 9 2HG GLU 9 6.937 -3.105 6.462 75 HG3 GLU 9 3HG GLU 9 8.509 -3.284 7.229 76 H LYS 10 H LYS 10 8.150 -5.121 2.872 77 HA LYS 10 HA LYS 10 10.280 -4.711 1.092 78 HB2 LYS 10 2HB LYS 10 8.205 -6.941 1.188 79 HB3 LYS 10 3HB LYS 10 9.646 -6.986 0.178 80 HG2 LYS 10 2HG LYS 10 9.589 -6.900 3.211 81 HG3 LYS 10 3HG LYS 10 9.952 -8.311 2.216 82 HD2 LYS 10 2HD LYS 10 11.971 -7.120 1.326 83 HD3 LYS 10 3HD LYS 10 11.609 -5.761 2.394 84 HE2 LYS 10 2HE LYS 10 11.871 -7.272 4.358 85 HE3 LYS 10 3HE LYS 10 12.310 -8.589 3.264 86 HZ1 LYS 10 1HZ LYS 10 14.184 -7.206 2.496 87 HZ2 LYS 10 2HZ LYS 10 14.286 -7.582 4.141 88 HZ3 LYS 10 3HZ LYS 10 13.786 -6.040 3.654 89 H ALA 11 H ALA 11 6.766 -4.869 0.601 90 HA ALA 11 HA ALA 11 6.646 -4.702 -2.184 91 HB1 ALA 11 1HB ALA 11 4.701 -5.266 -0.784 92 HB2 ALA 11 2HB ALA 11 4.331 -3.930 -1.876 93 HB3 ALA 11 3HB ALA 11 4.653 -3.612 -0.168 94 H LEU 12 H LEU 12 6.621 -2.106 0.265 95 HA LEU 12 HA LEU 12 6.457 0.183 -1.234 96 HB2 LEU 12 2HB LEU 12 8.006 -0.453 1.283 97 HB3 LEU 12 3HB LEU 12 8.162 1.138 0.563 98 HG LEU 12 HG LEU 12 5.558 -0.078 1.565 99 HD11 LEU 12 1HD1 LEU 12 7.064 0.436 3.406 100 HD12 LEU 12 2HD1 LEU 12 5.735 1.591 3.371 101 HD13 LEU 12 3HD1 LEU 12 7.329 2.065 2.777 102 HD21 LEU 12 1HD2 LEU 12 6.131 2.711 0.496 103 HD22 LEU 12 2HD2 LEU 12 4.608 2.168 1.207 104 HD23 LEU 12 3HD2 LEU 12 5.170 1.463 -0.306 105 H ILE 13 H ILE 13 9.439 -1.617 -0.482 106 HA ILE 13 HA ILE 13 11.229 0.114 -1.832 107 HB ILE 13 HB ILE 13 11.671 -2.830 -1.113 108 HG12 ILE 13 2HG1 ILE 13 12.188 -0.353 0.613 109 HG13 ILE 13 3HG1 ILE 13 10.869 -1.486 0.850 110 HG21 ILE 13 1HG2 ILE 13 14.070 -2.248 -1.018 111 HG22 ILE 13 2HG2 ILE 13 13.701 -0.587 -1.486 112 HG23 ILE 13 3HG2 ILE 13 13.411 -1.907 -2.619 113 HD11 ILE 13 1HD1 ILE 13 12.647 -1.863 2.438 114 HD12 ILE 13 2HD1 ILE 13 13.803 -2.119 1.132 115 HD13 ILE 13 3HD1 ILE 13 12.470 -3.254 1.369 116 H GLU 14 H GLU 14 9.655 -2.950 -2.789 117 HA GLU 14 HA GLU 14 10.888 -3.339 -5.279 118 HB2 GLU 14 2HB GLU 14 8.129 -4.203 -4.316 119 HB3 GLU 14 3HB GLU 14 8.922 -4.830 -5.758 120 HG2 GLU 14 2HG GLU 14 9.875 -5.159 -2.902 121 HG3 GLU 14 3HG GLU 14 9.111 -6.396 -3.890 122 H VAL 15 H VAL 15 7.873 -1.621 -4.425 123 HA VAL 15 HA VAL 15 7.334 -0.888 -7.192 124 HB VAL 15 HB VAL 15 5.241 0.024 -6.440 125 HG11 VAL 15 1HG1 VAL 15 5.773 -2.566 -4.940 126 HG12 VAL 15 2HG1 VAL 15 5.300 -2.412 -6.633 127 HG13 VAL 15 3HG1 VAL 15 4.179 -1.928 -5.362 128 HG21 VAL 15 1HG2 VAL 15 5.917 1.235 -4.433 129 HG22 VAL 15 2HG2 VAL 15 6.203 -0.276 -3.569 130 HG23 VAL 15 3HG2 VAL 15 4.562 0.171 -4.050 131 H ARG 16 H ARG 16 9.177 0.330 -4.670 132 HA ARG 16 HA ARG 16 8.783 3.045 -4.542 133 HB2 ARG 16 2HB ARG 16 10.435 1.883 -3.157 134 HB3 ARG 16 3HB ARG 16 11.482 1.643 -4.551 135 HG2 ARG 16 2HG ARG 16 11.820 4.091 -4.720 136 HG3 ARG 16 3HG ARG 16 10.766 4.332 -3.323 137 HD2 ARG 16 2HD ARG 16 12.357 2.967 -1.954 138 HD3 ARG 16 3HD ARG 16 13.435 2.880 -3.353 139 HE ARG 16 HE ARG 16 12.941 5.568 -2.945 140 HH11 ARG 16 1HH1 ARG 16 14.390 2.970 -1.067 141 HH12 ARG 16 2HH1 ARG 16 15.443 4.030 -0.188 142 HH21 ARG 16 1HH2 ARG 16 14.302 6.952 -1.741 143 HH22 ARG 16 2HH2 ARG 16 15.386 6.276 -0.572 144 HA PRO 17 HA PRO 17 11.558 4.074 -8.461 145 HB2 PRO 17 2HB PRO 17 11.839 2.138 -10.411 146 HB3 PRO 17 3HB PRO 17 12.992 2.336 -9.073 147 HG2 PRO 17 2HG PRO 17 10.691 0.409 -9.290 148 HG3 PRO 17 3HG PRO 17 12.374 0.094 -8.801 149 HD2 PRO 17 2HD PRO 17 10.442 0.385 -6.961 150 HD3 PRO 17 3HD PRO 17 12.071 1.035 -6.676 151 H TYR 18 H TYR 18 8.661 2.157 -8.538 152 HA TYR 18 HA TYR 18 7.681 3.224 -11.083 153 HB2 TYR 18 2HB TYR 18 6.324 1.366 -9.076 154 HB3 TYR 18 3HB TYR 18 5.715 1.759 -10.679 155 HD1 TYR 18 HD1 TYR 18 6.821 0.809 -12.710 156 HD2 TYR 18 HD2 TYR 18 8.131 -0.258 -8.782 157 HE1 TYR 18 HE1 TYR 18 8.032 -1.124 -13.634 158 HE2 TYR 18 HE2 TYR 18 9.334 -2.188 -9.702 159 HH TYR 18 HH TYR 18 9.166 -3.655 -11.755 160 H VAL 19 H VAL 19 7.115 3.672 -7.601 161 HA VAL 19 HA VAL 19 4.635 5.186 -8.103 162 HB VAL 19 HB VAL 19 4.222 5.100 -5.679 163 HG11 VAL 19 1HG1 VAL 19 3.410 3.255 -7.063 164 HG12 VAL 19 2HG1 VAL 19 3.818 2.693 -5.443 165 HG13 VAL 19 3HG1 VAL 19 4.910 2.360 -6.793 166 HG21 VAL 19 1HG2 VAL 19 6.511 5.180 -4.799 167 HG22 VAL 19 2HG2 VAL 19 6.833 3.559 -5.415 168 HG23 VAL 19 3HG2 VAL 19 5.644 3.796 -4.130 169 H GLU 20 H GLU 20 4.452 7.325 -7.882 170 HA GLU 20 HA GLU 20 6.605 8.941 -6.675 171 HB2 GLU 20 2HB GLU 20 4.091 9.762 -8.202 172 HB3 GLU 20 3HB GLU 20 5.195 10.907 -7.439 173 HG2 GLU 20 2HG GLU 20 7.024 10.038 -8.905 174 HG3 GLU 20 3HG GLU 20 5.837 9.030 -9.720 175 H TYR 21 H TYR 21 6.064 10.465 -5.031 176 HA TYR 21 HA TYR 21 5.369 11.061 -2.998 177 HB2 TYR 21 2HB TYR 21 2.614 9.964 -3.724 178 HB3 TYR 21 3HB TYR 21 2.975 11.162 -2.480 179 HD1 TYR 21 HD1 TYR 21 4.132 13.391 -3.306 180 HD2 TYR 21 HD2 TYR 21 2.034 10.723 -5.903 181 HE1 TYR 21 HE1 TYR 21 3.939 15.177 -4.988 182 HE2 TYR 21 HE2 TYR 21 1.846 12.500 -7.575 183 HH TYR 21 HH TYR 21 3.618 15.394 -7.434 184 H TYR 22 H TYR 22 6.660 8.719 -3.396 185 HA TYR 22 HA TYR 22 5.909 6.417 -2.090 186 HB2 TYR 22 2HB TYR 22 7.982 6.562 -3.379 187 HB3 TYR 22 3HB TYR 22 8.666 7.711 -2.232 188 HD1 TYR 22 HD1 TYR 22 7.317 4.208 -2.389 189 HD2 TYR 22 HD2 TYR 22 10.073 6.871 -0.487 190 HE1 TYR 22 HE1 TYR 22 8.242 2.346 -1.102 191 HE2 TYR 22 HE2 TYR 22 10.994 4.991 0.804 192 HH TYR 22 HH TYR 22 10.204 2.726 1.583 193 H ASN 23 H ASN 23 7.103 9.429 -0.612 194 HA ASN 23 HA ASN 23 7.458 8.542 2.047 195 HB2 ASN 23 2HB ASN 23 6.740 11.288 0.927 196 HB3 ASN 23 3HB ASN 23 7.078 11.017 2.636 197 HD21 ASN 23 1HD2 ASN 23 8.483 12.570 0.458 198 HD22 ASN 23 2HD2 ASN 23 10.127 12.051 0.571 199 H GLU 24 H GLU 24 4.621 9.757 0.339 200 HA GLU 24 HA GLU 24 2.863 9.880 2.569 201 HB2 GLU 24 2HB GLU 24 2.131 9.675 -0.384 202 HB3 GLU 24 3HB GLU 24 1.119 10.306 0.911 203 HG2 GLU 24 2HG GLU 24 3.666 11.547 -0.172 204 HG3 GLU 24 3HG GLU 24 2.024 12.139 -0.415 205 H LEU 25 H LEU 25 3.235 7.500 -0.114 206 HA LEU 25 HA LEU 25 1.386 5.581 0.698 207 HB2 LEU 25 2HB LEU 25 2.653 5.691 -1.494 208 HB3 LEU 25 3HB LEU 25 4.062 5.064 -0.661 209 HG LEU 25 HG LEU 25 2.828 2.945 -0.181 210 HD11 LEU 25 1HD1 LEU 25 0.676 2.473 -1.277 211 HD12 LEU 25 2HD1 LEU 25 0.577 4.150 -1.820 212 HD13 LEU 25 3HD1 LEU 25 0.542 3.773 -0.095 213 HD21 LEU 25 1HD2 LEU 25 2.856 2.050 -2.468 214 HD22 LEU 25 2HD2 LEU 25 4.241 3.100 -2.187 215 HD23 LEU 25 3HD2 LEU 25 2.868 3.688 -3.128 216 H LYS 26 H LYS 26 4.826 5.828 1.421 217 HA LYS 26 HA LYS 26 5.216 3.657 3.112 218 HB2 LYS 26 2HB LYS 26 7.006 5.151 2.146 219 HB3 LYS 26 3HB LYS 26 6.603 6.361 3.354 220 HG2 LYS 26 2HG LYS 26 7.360 4.874 5.150 221 HG3 LYS 26 3HG LYS 26 7.625 3.570 3.990 222 HD2 LYS 26 2HD LYS 26 9.773 4.552 4.512 223 HD3 LYS 26 3HD LYS 26 9.360 4.989 2.853 224 HE2 LYS 26 2HE LYS 26 10.321 6.913 3.993 225 HE3 LYS 26 3HE LYS 26 8.615 7.233 3.679 226 HZ1 LYS 26 1HZ LYS 26 8.143 6.605 5.995 227 HZ2 LYS 26 2HZ LYS 26 9.216 7.907 5.907 228 HZ3 LYS 26 3HZ LYS 26 9.794 6.364 6.271 229 H ALA 27 H ALA 27 3.770 6.810 3.858 230 HA ALA 27 HA ALA 27 3.616 6.423 6.703 231 HB1 ALA 27 1HB ALA 27 3.708 8.677 5.720 232 HB2 ALA 27 2HB ALA 27 2.244 8.469 6.686 233 HB3 ALA 27 3HB ALA 27 2.156 8.407 4.924 234 H LEU 28 H LEU 28 1.432 5.962 3.941 235 HA LEU 28 HA LEU 28 -0.933 5.344 5.353 236 HB2 LEU 28 2HB LEU 28 -0.828 6.019 2.960 237 HB3 LEU 28 3HB LEU 28 -0.040 4.503 2.565 238 HG LEU 28 HG LEU 28 -2.078 3.246 3.066 239 HD11 LEU 28 1HD1 LEU 28 -2.957 4.533 4.941 240 HD12 LEU 28 2HD1 LEU 28 -4.187 4.316 3.701 241 HD13 LEU 28 3HD1 LEU 28 -3.369 5.872 3.864 242 HD21 LEU 28 1HD2 LEU 28 -1.849 4.151 0.800 243 HD22 LEU 28 2HD2 LEU 28 -2.678 5.635 1.284 244 HD23 LEU 28 3HD2 LEU 28 -3.543 4.095 1.285 245 H VAL 29 H VAL 29 1.633 3.316 4.013 246 HA VAL 29 HA VAL 29 0.902 0.784 4.890 247 HB VAL 29 HB VAL 29 3.503 2.127 4.152 248 HG11 VAL 29 1HG1 VAL 29 3.407 -0.654 5.348 249 HG12 VAL 29 2HG1 VAL 29 4.298 0.739 5.968 250 HG13 VAL 29 3HG1 VAL 29 4.774 -0.007 4.438 251 HG21 VAL 29 1HG2 VAL 29 2.050 -0.288 3.032 252 HG22 VAL 29 2HG2 VAL 29 3.514 0.429 2.354 253 HG23 VAL 29 3HG2 VAL 29 2.007 1.350 2.373 254 H SER 30 H SER 30 2.833 3.272 6.502 255 HA SER 30 HA SER 30 3.484 1.808 8.834 256 HB2 SER 30 2HB SER 30 4.714 3.825 8.135 257 HB3 SER 30 3HB SER 30 3.300 4.828 8.467 258 HG SER 30 HG SER 30 3.486 4.241 10.668 259 H LYS 31 H LYS 31 0.690 3.707 7.969 260 HA LYS 31 HA LYS 31 -0.598 3.733 10.505 261 HB2 LYS 31 2HB LYS 31 -1.002 5.391 8.666 262 HB3 LYS 31 3HB LYS 31 -1.781 4.122 7.726 263 HG2 LYS 31 2HG LYS 31 -3.521 3.903 9.470 264 HG3 LYS 31 3HG LYS 31 -2.733 5.181 10.406 265 HD2 LYS 31 2HD LYS 31 -3.097 6.747 8.467 266 HD3 LYS 31 3HD LYS 31 -3.987 5.458 7.648 267 HE2 LYS 31 2HE LYS 31 -4.753 6.734 10.296 268 HE3 LYS 31 3HE LYS 31 -5.515 7.042 8.735 269 HZ1 LYS 31 1HZ LYS 31 -5.487 4.435 10.163 270 HZ2 LYS 31 2HZ LYS 31 -6.190 4.718 8.656 271 HZ3 LYS 31 3HZ LYS 31 -6.805 5.485 10.026 272 H ILE 32 H ILE 32 -1.155 1.797 7.507 273 HA ILE 32 HA ILE 32 -3.393 0.405 8.589 274 HB ILE 32 HB ILE 32 -3.362 -1.027 6.554 275 HG12 ILE 32 2HG1 ILE 32 -0.844 0.503 5.765 276 HG13 ILE 32 3HG1 ILE 32 -0.887 -1.181 6.259 277 HG21 ILE 32 1HG2 ILE 32 -3.022 1.932 5.938 278 HG22 ILE 32 2HG2 ILE 32 -4.509 1.142 6.465 279 HG23 ILE 32 3HG2 ILE 32 -3.814 0.746 4.895 280 HD11 ILE 32 1HD1 ILE 32 -2.181 -0.047 3.781 281 HD12 ILE 32 2HD1 ILE 32 -2.191 -1.741 4.281 282 HD13 ILE 32 3HD1 ILE 32 -0.670 -0.952 3.864 283 H SER 33 H SER 33 0.001 -0.630 8.062 284 HA SER 33 HA SER 33 0.015 -3.232 8.834 285 HB2 SER 33 2HB SER 33 2.350 -2.832 9.694 286 HB3 SER 33 3HB SER 33 2.045 -2.100 8.120 287 HG SER 33 HG SER 33 2.642 -0.305 8.999 288 H SER 34 H SER 34 -0.169 -0.476 11.011 289 HA SER 34 HA SER 34 0.061 -2.049 13.441 290 HB2 SER 34 2HB SER 34 1.066 0.229 13.243 291 HB3 SER 34 3HB SER 34 -0.548 0.918 13.085 292 HG SER 34 HG SER 34 -0.979 -0.036 15.196 293 H SER 35 H SER 35 -2.477 -0.825 11.413 294 HA SER 35 HA SER 35 -4.574 -0.889 13.440 295 HB2 SER 35 2HB SER 35 -4.556 0.901 11.728 296 HB3 SER 35 3HB SER 35 -4.705 -0.300 10.445 297 HG SER 35 HG SER 35 -6.656 -0.617 12.309 298 H VAL 36 H VAL 36 -3.628 -2.768 10.588 299 HA VAL 36 HA VAL 36 -6.061 -4.373 10.661 300 HB VAL 36 HB VAL 36 -5.567 -5.127 8.437 301 HG11 VAL 36 1HG1 VAL 36 -6.537 -2.885 8.541 302 HG12 VAL 36 2HG1 VAL 36 -5.483 -3.035 7.135 303 HG13 VAL 36 3HG1 VAL 36 -4.926 -2.160 8.565 304 HG21 VAL 36 1HG2 VAL 36 -3.168 -5.568 8.595 305 HG22 VAL 36 2HG2 VAL 36 -2.819 -3.840 8.629 306 HG23 VAL 36 3HG2 VAL 36 -3.505 -4.574 7.176 307 H ASN 37 H ASN 37 -5.988 -6.635 10.552 308 HA ASN 37 HA ASN 37 -3.842 -7.829 12.159 309 HB2 ASN 37 2HB ASN 37 -6.615 -8.871 11.435 310 HB3 ASN 37 3HB ASN 37 -5.471 -9.696 12.491 311 HD21 ASN 37 1HD2 ASN 37 -8.200 -8.570 12.937 312 HD22 ASN 37 2HD2 ASN 37 -8.042 -7.558 14.327 313 H ASP 38 H ASP 38 -5.174 -7.893 8.932 314 HA ASP 38 HA ASP 38 -3.492 -10.207 8.163 315 HB2 ASP 38 2HB ASP 38 -6.383 -9.832 7.241 316 HB3 ASP 38 3HB ASP 38 -5.307 -11.150 6.796 317 H LEU 39 H LEU 39 -2.866 -10.254 5.949 318 HA LEU 39 HA LEU 39 -2.292 -7.768 4.727 319 HB2 LEU 39 2HB LEU 39 -1.011 -9.989 4.512 320 HB3 LEU 39 3HB LEU 39 -2.236 -10.508 3.379 321 HG LEU 39 HG LEU 39 -0.016 -9.695 2.386 322 HD11 LEU 39 1HD1 LEU 39 -1.969 -9.930 0.965 323 HD12 LEU 39 2HD1 LEU 39 -0.949 -8.586 0.457 324 HD13 LEU 39 3HD1 LEU 39 -2.450 -8.272 1.333 325 HD21 LEU 39 1HD2 LEU 39 -1.039 -6.939 3.125 326 HD22 LEU 39 2HD2 LEU 39 0.390 -7.301 2.151 327 HD23 LEU 39 3HD2 LEU 39 0.347 -7.758 3.852 328 H GLU 40 H GLU 40 -4.878 -10.131 4.315 329 HA GLU 40 HA GLU 40 -6.182 -9.080 2.048 330 HB2 GLU 40 2HB GLU 40 -6.656 -11.318 3.027 331 HB3 GLU 40 3HB GLU 40 -7.387 -10.548 4.433 332 HG2 GLU 40 2HG GLU 40 -9.155 -9.589 3.014 333 HG3 GLU 40 3HG GLU 40 -8.408 -10.294 1.581 334 H GLU 41 H GLU 41 -6.362 -8.237 5.497 335 HA GLU 41 HA GLU 41 -8.544 -6.405 5.351 336 HB2 GLU 41 2HB GLU 41 -6.264 -6.562 7.366 337 HB3 GLU 41 3HB GLU 41 -7.737 -5.627 7.583 338 HG2 GLU 41 2HG GLU 41 -7.621 -8.639 7.318 339 HG3 GLU 41 3HG GLU 41 -7.687 -7.769 8.850 340 H ALA 42 H ALA 42 -5.093 -6.196 4.857 341 HA ALA 42 HA ALA 42 -4.817 -3.346 4.860 342 HB1 ALA 42 1HB ALA 42 -2.586 -3.772 3.898 343 HB2 ALA 42 2HB ALA 42 -3.010 -5.467 3.631 344 HB3 ALA 42 3HB ALA 42 -2.896 -4.832 5.275 345 H ILE 43 H ILE 43 -5.203 -5.825 2.336 346 HA ILE 43 HA ILE 43 -4.979 -4.261 0.014 347 HB ILE 43 HB ILE 43 -6.626 -6.789 0.507 348 HG12 ILE 43 2HG1 ILE 43 -3.934 -6.487 -0.905 349 HG13 ILE 43 3HG1 ILE 43 -4.124 -6.985 0.771 350 HG21 ILE 43 1HG2 ILE 43 -6.758 -7.126 -1.936 351 HG22 ILE 43 2HG2 ILE 43 -5.980 -5.567 -2.199 352 HG23 ILE 43 3HG2 ILE 43 -7.576 -5.638 -1.455 353 HD11 ILE 43 1HD1 ILE 43 -5.067 -8.488 -1.668 354 HD12 ILE 43 2HD1 ILE 43 -5.386 -8.967 0.004 355 HD13 ILE 43 3HD1 ILE 43 -3.728 -8.905 -0.593 356 H VAL 44 H VAL 44 -8.132 -5.453 1.324 357 HA VAL 44 HA VAL 44 -9.968 -3.915 0.092 358 HB VAL 44 HB VAL 44 -10.012 -4.730 3.034 359 HG11 VAL 44 1HG1 VAL 44 -11.796 -3.095 2.595 360 HG12 VAL 44 2HG1 VAL 44 -12.481 -4.697 2.869 361 HG13 VAL 44 3HG1 VAL 44 -12.366 -4.057 1.227 362 HG21 VAL 44 1HG2 VAL 44 -11.017 -6.244 0.585 363 HG22 VAL 44 2HG2 VAL 44 -11.170 -6.778 2.262 364 HG23 VAL 44 3HG2 VAL 44 -9.573 -6.637 1.525 365 H VAL 45 H VAL 45 -8.417 -2.904 3.205 366 HA VAL 45 HA VAL 45 -9.609 -0.363 3.423 367 HB VAL 45 HB VAL 45 -6.934 -1.374 4.485 368 HG11 VAL 45 1HG1 VAL 45 -8.236 1.307 5.130 369 HG12 VAL 45 2HG1 VAL 45 -6.710 1.071 4.277 370 HG13 VAL 45 3HG1 VAL 45 -6.846 0.618 5.976 371 HG21 VAL 45 1HG2 VAL 45 -8.134 -1.428 6.660 372 HG22 VAL 45 2HG2 VAL 45 -8.949 -2.421 5.451 373 HG23 VAL 45 3HG2 VAL 45 -9.598 -0.835 5.867 374 H LEU 46 H LEU 46 -6.588 -1.295 1.755 375 HA LEU 46 HA LEU 46 -5.880 1.315 0.850 376 HB2 LEU 46 2HB LEU 46 -5.077 -1.425 -0.182 377 HB3 LEU 46 3HB LEU 46 -4.440 0.065 -0.860 378 HG LEU 46 HG LEU 46 -4.031 -0.907 1.992 379 HD11 LEU 46 1HD1 LEU 46 -2.054 -0.718 -0.300 380 HD12 LEU 46 2HD1 LEU 46 -2.758 -2.202 0.347 381 HD13 LEU 46 3HD1 LEU 46 -1.695 -1.224 1.355 382 HD21 LEU 46 1HD2 LEU 46 -2.497 0.993 2.248 383 HD22 LEU 46 2HD2 LEU 46 -4.143 1.533 1.944 384 HD23 LEU 46 3HD2 LEU 46 -2.945 1.588 0.647 385 H ARG 47 H ARG 47 -8.159 -1.065 -0.360 386 HA ARG 47 HA ARG 47 -8.420 0.036 -2.988 387 HB2 ARG 47 2HB ARG 47 -10.212 -1.867 -1.421 388 HB3 ARG 47 3HB ARG 47 -10.576 -1.332 -3.063 389 HG2 ARG 47 2HG ARG 47 -8.188 -2.200 -3.635 390 HG3 ARG 47 3HG ARG 47 -8.303 -3.075 -2.110 391 HD2 ARG 47 2HD ARG 47 -10.080 -4.435 -2.907 392 HD3 ARG 47 3HD ARG 47 -10.450 -3.331 -4.237 393 HE ARG 47 HE ARG 47 -8.499 -5.432 -4.205 394 HH11 ARG 47 1HH1 ARG 47 -9.243 -2.305 -5.696 395 HH12 ARG 47 2HH1 ARG 47 -8.279 -2.633 -7.103 396 HH21 ARG 47 1HH2 ARG 47 -7.236 -5.792 -6.052 397 HH22 ARG 47 2HH2 ARG 47 -7.155 -4.587 -7.301 398 H GLU 48 H GLU 48 -9.694 0.876 0.111 399 HA GLU 48 HA GLU 48 -11.764 2.639 -0.950 400 HB2 GLU 48 2HB GLU 48 -10.751 2.126 1.880 401 HB3 GLU 48 3HB GLU 48 -12.015 3.293 1.502 402 HG2 GLU 48 2HG GLU 48 -12.136 0.299 1.040 403 HG3 GLU 48 3HG GLU 48 -13.006 1.210 2.274 404 H GLU 49 H GLU 49 -8.520 2.786 0.336 405 HA GLU 49 HA GLU 49 -8.222 5.602 0.469 406 HB2 GLU 49 2HB GLU 49 -6.113 3.465 -0.069 407 HB3 GLU 49 3HB GLU 49 -5.768 5.137 0.357 408 HG2 GLU 49 2HG GLU 49 -7.100 3.050 2.097 409 HG3 GLU 49 3HG GLU 49 -5.495 3.748 2.309 410 H GLU 50 H GLU 50 -7.512 3.249 -2.036 411 HA GLU 50 HA GLU 50 -6.532 4.836 -4.092 412 HB2 GLU 50 2HB GLU 50 -6.585 2.309 -3.950 413 HB3 GLU 50 3HB GLU 50 -8.298 2.364 -4.346 414 HG2 GLU 50 2HG GLU 50 -7.645 3.510 -6.521 415 HG3 GLU 50 3HG GLU 50 -5.965 3.140 -6.115 416 H LYS 51 H LYS 51 -9.907 3.703 -3.640 417 HA LYS 51 HA LYS 51 -11.156 5.032 -5.708 418 HB2 LYS 51 2HB LYS 51 -12.129 3.904 -3.072 419 HB3 LYS 51 3HB LYS 51 -13.259 4.686 -4.171 420 HG2 LYS 51 2HG LYS 51 -12.891 3.051 -5.880 421 HG3 LYS 51 3HG LYS 51 -11.485 2.388 -5.050 422 HD2 LYS 51 2HD LYS 51 -13.451 0.899 -4.883 423 HD3 LYS 51 3HD LYS 51 -12.907 1.446 -3.300 424 HE2 LYS 51 2HE LYS 51 -15.169 2.884 -4.695 425 HE3 LYS 51 3HE LYS 51 -15.470 1.367 -3.855 426 HZ1 LYS 51 1HZ LYS 51 -14.341 3.828 -2.629 427 HZ2 LYS 51 2HZ LYS 51 -14.582 2.359 -1.829 428 HZ3 LYS 51 3HZ LYS 51 -15.906 3.226 -2.415 429 H LYS 52 H LYS 52 -10.654 6.197 -2.345 430 HA LYS 52 HA LYS 52 -12.241 8.596 -2.774 431 HB2 LYS 52 2HB LYS 52 -11.643 9.250 -0.508 432 HB3 LYS 52 3HB LYS 52 -12.092 7.549 -0.515 433 HG2 LYS 52 2HG LYS 52 -9.687 6.931 -0.464 434 HG3 LYS 52 3HG LYS 52 -9.263 8.638 -0.417 435 HD2 LYS 52 2HD LYS 52 -9.090 7.705 1.812 436 HD3 LYS 52 3HD LYS 52 -10.426 8.850 1.774 437 HE2 LYS 52 2HE LYS 52 -10.806 5.844 1.538 438 HE3 LYS 52 3HE LYS 52 -10.827 6.703 3.075 439 HZ1 LYS 52 1HZ LYS 52 -13.042 6.503 2.451 440 HZ2 LYS 52 2HZ LYS 52 -12.752 6.906 0.841 441 HZ3 LYS 52 3HZ LYS 52 -12.660 8.096 2.038 442 H ALA 53 H ALA 53 -8.906 7.671 -3.127 443 HA ALA 53 HA ALA 53 -7.838 10.359 -3.287 444 HB1 ALA 53 1HB ALA 53 -6.426 8.517 -2.458 445 HB2 ALA 53 2HB ALA 53 -5.721 9.244 -3.903 446 HB3 ALA 53 3HB ALA 53 -6.562 7.694 -4.013 447 H SER 54 H SER 54 -6.457 10.822 -5.241 448 HA SER 54 HA SER 54 -7.681 10.088 -7.826 449 HB2 SER 54 2HB SER 54 -7.389 12.599 -8.421 450 HB3 SER 54 3HB SER 54 -8.727 12.197 -7.345 451 HG SER 54 HG SER 54 -7.725 13.129 -5.699 452 H GLU 55 H GLU 55 -6.184 10.884 -9.642 453 HA GLU 55 HA GLU 55 -3.646 9.662 -9.317 454 HB2 GLU 55 2HB GLU 55 -4.567 11.497 -11.586 455 HB3 GLU 55 3HB GLU 55 -3.179 10.423 -11.641 456 HG2 GLU 55 2HG GLU 55 -4.858 9.349 -12.903 457 HG3 GLU 55 3HG GLU 55 -4.807 8.480 -11.372 458 HA PRO 56 HA PRO 56 -1.513 9.711 -10.101 459 HB2 PRO 56 2HB PRO 56 1.111 10.367 -9.010 460 HB3 PRO 56 3HB PRO 56 0.591 10.426 -10.704 461 HG2 PRO 56 2HG PRO 56 1.261 12.665 -9.247 462 HG3 PRO 56 3HG PRO 56 0.164 12.684 -10.646 463 HD2 PRO 56 2HD PRO 56 -0.537 12.589 -7.708 464 HD3 PRO 56 3HD PRO 56 -1.215 13.623 -8.993 465 H PHE 57 H PHE 57 -2.021 10.760 -6.921 466 HA PHE 57 HA PHE 57 -0.658 8.781 -5.422 467 HB2 PHE 57 2HB PHE 57 -1.622 10.943 -4.518 468 HB3 PHE 57 3HB PHE 57 -3.225 10.222 -4.630 469 HD1 PHE 57 HD1 PHE 57 0.143 9.161 -3.280 470 HD2 PHE 57 HD2 PHE 57 -4.054 9.531 -2.521 471 HE1 PHE 57 HE1 PHE 57 0.462 8.232 -1.023 472 HE2 PHE 57 HE2 PHE 57 -3.718 8.598 -0.272 473 HZ PHE 57 HZ PHE 57 -1.463 7.945 0.483 474 H LYS 58 H LYS 58 -3.738 8.695 -7.154 475 HA LYS 58 HA LYS 58 -4.707 6.230 -6.116 476 HB2 LYS 58 2HB LYS 58 -6.114 7.808 -7.445 477 HB3 LYS 58 3HB LYS 58 -5.196 7.389 -8.890 478 HG2 LYS 58 2HG LYS 58 -5.961 5.018 -8.652 479 HG3 LYS 58 3HG LYS 58 -6.923 5.492 -7.251 480 HD2 LYS 58 2HD LYS 58 -7.284 6.516 -10.089 481 HD3 LYS 58 3HD LYS 58 -8.303 5.320 -9.287 482 HE2 LYS 58 2HE LYS 58 -9.038 6.993 -7.660 483 HE3 LYS 58 3HE LYS 58 -7.952 8.193 -8.368 484 HZ1 LYS 58 1HZ LYS 58 -9.202 8.033 -10.438 485 HZ2 LYS 58 2HZ LYS 58 -10.197 8.499 -9.153 486 HZ3 LYS 58 3HZ LYS 58 -10.258 6.911 -9.734 487 H THR 59 H THR 59 -2.289 7.001 -8.524 488 HA THR 59 HA THR 59 -2.068 4.322 -9.582 489 HB THR 59 HB THR 59 -0.086 6.625 -9.927 490 HG1 THR 59 HG1 THR 59 -1.354 7.148 -11.781 491 HG21 THR 59 1HG2 THR 59 -0.733 4.241 -11.721 492 HG22 THR 59 2HG2 THR 59 0.727 4.433 -10.746 493 HG23 THR 59 3HG2 THR 59 0.416 5.531 -12.087 494 H ASP 60 H ASP 60 -0.350 6.392 -7.356 495 HA ASP 60 HA ASP 60 1.859 4.878 -6.627 496 HB2 ASP 60 2HB ASP 60 1.727 7.155 -5.939 497 HB3 ASP 60 3HB ASP 60 0.135 6.951 -5.229 498 H ILE 61 H ILE 61 -1.287 5.018 -4.926 499 HA ILE 61 HA ILE 61 -0.996 2.881 -3.191 500 HB ILE 61 HB ILE 61 -3.567 3.920 -4.457 501 HG12 ILE 61 2HG1 ILE 61 -2.322 4.550 -1.733 502 HG13 ILE 61 3HG1 ILE 61 -2.211 5.595 -3.142 503 HG21 ILE 61 1HG2 ILE 61 -3.261 2.141 -2.003 504 HG22 ILE 61 2HG2 ILE 61 -3.969 1.664 -3.547 505 HG23 ILE 61 3HG2 ILE 61 -4.772 2.876 -2.546 506 HD11 ILE 61 1HD1 ILE 61 -4.626 5.904 -3.118 507 HD12 ILE 61 2HD1 ILE 61 -3.895 6.365 -1.582 508 HD13 ILE 61 3HD1 ILE 61 -4.757 4.835 -1.719 509 H ARG 62 H ARG 62 -2.621 2.696 -6.484 510 HA ARG 62 HA ARG 62 -3.322 -0.006 -6.166 511 HB2 ARG 62 2HB ARG 62 -3.947 -0.060 -8.537 512 HB3 ARG 62 3HB ARG 62 -4.543 1.377 -7.735 513 HG2 ARG 62 2HG ARG 62 -3.897 2.182 -9.806 514 HG3 ARG 62 3HG ARG 62 -2.509 2.577 -8.798 515 HD2 ARG 62 2HD ARG 62 -1.836 1.720 -11.000 516 HD3 ARG 62 3HD ARG 62 -1.282 0.658 -9.706 517 HE ARG 62 HE ARG 62 -3.788 -0.218 -10.739 518 HH11 ARG 62 1HH1 ARG 62 -0.367 -0.183 -11.591 519 HH12 ARG 62 2HH1 ARG 62 -0.482 -1.598 -12.587 520 HH21 ARG 62 1HH2 ARG 62 -3.901 -2.100 -12.024 521 HH22 ARG 62 2HH2 ARG 62 -2.471 -2.678 -12.828 522 H ILE 63 H ILE 63 -0.365 1.371 -7.545 523 HA ILE 63 HA ILE 63 0.709 -0.980 -8.674 524 HB ILE 63 HB ILE 63 2.149 1.454 -7.535 525 HG12 ILE 63 2HG1 ILE 63 1.590 0.659 -10.435 526 HG13 ILE 63 3HG1 ILE 63 0.712 1.890 -9.538 527 HG21 ILE 63 1HG2 ILE 63 4.181 0.705 -8.723 528 HG22 ILE 63 2HG2 ILE 63 3.358 -0.783 -9.195 529 HG23 ILE 63 3HG2 ILE 63 3.691 -0.463 -7.495 530 HD11 ILE 63 1HD1 ILE 63 3.634 2.004 -10.298 531 HD12 ILE 63 2HD1 ILE 63 2.759 3.232 -9.378 532 HD13 ILE 63 3HD1 ILE 63 2.309 2.893 -11.049 533 H LEU 64 H LEU 64 1.005 0.367 -5.367 534 HA LEU 64 HA LEU 64 2.625 -1.668 -4.236 535 HB2 LEU 64 2HB LEU 64 2.215 0.556 -3.161 536 HB3 LEU 64 3HB LEU 64 0.539 0.112 -2.913 537 HG LEU 64 HG LEU 64 1.563 -1.913 -1.521 538 HD11 LEU 64 1HD1 LEU 64 3.646 -1.394 -0.375 539 HD12 LEU 64 2HD1 LEU 64 3.856 0.052 -1.365 540 HD13 LEU 64 3HD1 LEU 64 3.887 -1.549 -2.113 541 HD21 LEU 64 1HD2 LEU 64 1.434 -0.634 0.543 542 HD22 LEU 64 2HD2 LEU 64 0.135 -0.168 -0.553 543 HD23 LEU 64 3HD2 LEU 64 1.540 0.882 -0.355 544 H LEU 65 H LEU 65 -0.844 -1.139 -4.413 545 HA LEU 65 HA LEU 65 -1.773 -3.076 -2.636 546 HB2 LEU 65 2HB LEU 65 -2.886 -0.976 -3.649 547 HB3 LEU 65 3HB LEU 65 -3.261 -1.962 -5.045 548 HG LEU 65 HG LEU 65 -4.327 -2.463 -2.229 549 HD11 LEU 65 1HD1 LEU 65 -5.687 -1.162 -4.609 550 HD12 LEU 65 2HD1 LEU 65 -5.164 -0.352 -3.129 551 HD13 LEU 65 3HD1 LEU 65 -6.447 -1.553 -3.063 552 HD21 LEU 65 1HD2 LEU 65 -5.157 -3.714 -4.869 553 HD22 LEU 65 2HD2 LEU 65 -5.980 -3.938 -3.320 554 HD23 LEU 65 3HD2 LEU 65 -4.333 -4.525 -3.533 555 H ASP 66 H ASP 66 -2.284 -3.194 -6.189 556 HA ASP 66 HA ASP 66 -2.793 -5.770 -6.728 557 HB2 ASP 66 2HB ASP 66 -2.661 -3.883 -8.356 558 HB3 ASP 66 3HB ASP 66 -0.907 -3.931 -8.278 559 H PHE 67 H PHE 67 0.524 -4.437 -6.395 560 HA PHE 67 HA PHE 67 2.001 -6.788 -6.787 561 HB2 PHE 67 2HB PHE 67 3.027 -4.527 -6.702 562 HB3 PHE 67 3HB PHE 67 2.711 -4.437 -4.974 563 HD1 PHE 67 HD1 PHE 67 4.730 -6.133 -7.586 564 HD2 PHE 67 HD2 PHE 67 4.157 -5.589 -3.381 565 HE1 PHE 67 HE1 PHE 67 6.855 -7.280 -7.134 566 HE2 PHE 67 HE2 PHE 67 6.283 -6.738 -2.946 567 HZ PHE 67 HZ PHE 67 7.629 -7.585 -4.821 568 H LEU 68 H LEU 68 0.537 -5.547 -3.750 569 HA LEU 68 HA LEU 68 1.536 -7.502 -1.951 570 HB2 LEU 68 2HB LEU 68 -1.025 -5.867 -1.870 571 HB3 LEU 68 3HB LEU 68 -0.501 -6.883 -0.537 572 HG LEU 68 HG LEU 68 1.176 -4.582 -1.605 573 HD11 LEU 68 1HD1 LEU 68 -0.758 -4.529 0.728 574 HD12 LEU 68 2HD1 LEU 68 -0.956 -3.688 -0.811 575 HD13 LEU 68 3HD1 LEU 68 0.361 -3.241 0.269 576 HD21 LEU 68 1HD2 LEU 68 2.446 -6.268 -0.370 577 HD22 LEU 68 2HD2 LEU 68 1.320 -6.163 0.986 578 HD23 LEU 68 3HD2 LEU 68 2.332 -4.779 0.565 579 H GLU 69 H GLU 69 -1.181 -7.495 -4.168 580 HA GLU 69 HA GLU 69 -2.323 -9.989 -3.316 581 HB2 GLU 69 2HB GLU 69 -2.687 -8.506 -5.954 582 HB3 GLU 69 3HB GLU 69 -3.729 -9.773 -5.313 583 HG2 GLU 69 2HG GLU 69 -4.339 -8.279 -3.410 584 HG3 GLU 69 3HG GLU 69 -3.345 -6.998 -4.114 585 H SER 70 H SER 70 0.210 -8.977 -5.423 586 HA SER 70 HA SER 70 1.569 -9.883 -6.960 587 HB2 SER 70 2HB SER 70 2.760 -11.944 -6.265 588 HB3 SER 70 3HB SER 70 2.565 -10.829 -4.917 589 HG SER 70 HG SER 70 0.853 -13.031 -5.428 590 H LYS 71 H LYS 71 -0.679 -9.882 -8.122 591 HA LYS 71 HA LYS 71 -1.722 -12.335 -9.137 592 HB2 LYS 71 2HB LYS 71 -1.710 -9.601 -10.501 593 HB3 LYS 71 3HB LYS 71 -2.781 -10.951 -10.879 594 HG2 LYS 71 2HG LYS 71 -3.804 -10.741 -8.612 595 HG3 LYS 71 3HG LYS 71 -2.760 -9.346 -8.298 596 HD2 LYS 71 2HD LYS 71 -3.783 -8.226 -10.329 597 HD3 LYS 71 3HD LYS 71 -4.912 -9.578 -10.434 598 HE2 LYS 71 2HE LYS 71 -4.654 -7.683 -8.080 599 HE3 LYS 71 3HE LYS 71 -5.906 -7.616 -9.318 600 HZ1 LYS 71 1HZ LYS 71 -5.472 -9.848 -7.405 601 HZ2 LYS 71 2HZ LYS 71 -6.651 -9.813 -8.612 602 HZ3 LYS 71 3HZ LYS 71 -6.715 -8.704 -7.340 603 HA PRO 72 HA PRO 72 1.502 -13.476 -12.177 604 HB2 PRO 72 2HB PRO 72 -0.812 -14.276 -13.944 605 HB3 PRO 72 3HB PRO 72 0.601 -15.229 -13.441 606 HG2 PRO 72 2HG PRO 72 -1.760 -15.724 -12.353 607 HG3 PRO 72 3HG PRO 72 -0.301 -15.713 -11.332 608 HD2 PRO 72 2HD PRO 72 -2.401 -13.561 -11.630 609 HD3 PRO 72 3HD PRO 72 -1.614 -14.170 -10.154 Start of MODEL 7 1 H GLY 1 1H GLY 1 2.662 -6.395 16.024 2 HA2 GLY 1 2HA GLY 1 4.454 -6.092 14.420 3 HA3 GLY 1 3HA GLY 1 5.316 -7.412 15.194 4 H SER 2 H SER 2 2.681 -6.543 13.091 5 HA SER 2 HA SER 2 1.665 -9.228 12.710 6 HB2 SER 2 2HB SER 2 1.141 -6.642 11.165 7 HB3 SER 2 3HB SER 2 0.235 -8.141 10.979 8 HG SER 2 HG SER 2 -0.761 -6.574 12.373 9 H VAL 3 H VAL 3 2.186 -10.618 11.062 10 HA VAL 3 HA VAL 3 4.444 -10.462 9.406 11 HB VAL 3 HB VAL 3 3.159 -12.553 9.994 12 HG11 VAL 3 1HG1 VAL 3 0.869 -11.792 9.561 13 HG12 VAL 3 2HG1 VAL 3 1.220 -13.259 8.648 14 HG13 VAL 3 3HG1 VAL 3 1.205 -11.696 7.828 15 HG21 VAL 3 1HG2 VAL 3 4.892 -12.654 8.260 16 HG22 VAL 3 2HG2 VAL 3 3.711 -12.214 7.022 17 HG23 VAL 3 3HG2 VAL 3 3.568 -13.755 7.875 18 H VAL 4 H VAL 4 1.439 -8.939 9.069 19 HA VAL 4 HA VAL 4 1.179 -8.424 6.314 20 HB VAL 4 HB VAL 4 0.393 -6.509 8.560 21 HG11 VAL 4 1HG1 VAL 4 -0.811 -6.962 5.807 22 HG12 VAL 4 2HG1 VAL 4 0.168 -5.582 6.301 23 HG13 VAL 4 3HG1 VAL 4 -1.422 -5.833 7.015 24 HG21 VAL 4 1HG2 VAL 4 -0.430 -8.742 9.161 25 HG22 VAL 4 2HG2 VAL 4 -1.186 -8.916 7.576 26 HG23 VAL 4 3HG2 VAL 4 -1.776 -7.694 8.705 27 H LYS 5 H LYS 5 2.856 -6.730 8.937 28 HA LYS 5 HA LYS 5 3.384 -4.301 7.673 29 HB2 LYS 5 2HB LYS 5 3.677 -4.521 10.103 30 HB3 LYS 5 3HB LYS 5 5.041 -5.618 9.867 31 HG2 LYS 5 2HG LYS 5 6.260 -3.761 8.685 32 HG3 LYS 5 3HG LYS 5 4.928 -2.676 9.094 33 HD2 LYS 5 2HD LYS 5 5.406 -2.969 11.488 34 HD3 LYS 5 3HD LYS 5 6.680 -4.137 11.116 35 HE2 LYS 5 2HE LYS 5 7.946 -2.380 9.933 36 HE3 LYS 5 3HE LYS 5 6.671 -1.212 10.287 37 HZ1 LYS 5 1HZ LYS 5 8.324 -2.621 12.315 38 HZ2 LYS 5 2HZ LYS 5 7.136 -1.461 12.633 39 HZ3 LYS 5 3HZ LYS 5 8.545 -1.023 11.809 40 H GLU 6 H GLU 6 5.652 -7.097 7.980 41 HA GLU 6 HA GLU 6 7.785 -6.044 6.528 42 HB2 GLU 6 2HB GLU 6 8.596 -8.378 6.389 43 HB3 GLU 6 3HB GLU 6 7.996 -8.000 8.002 44 HG2 GLU 6 2HG GLU 6 5.810 -9.115 7.321 45 HG3 GLU 6 3HG GLU 6 6.637 -9.682 5.872 46 H LYS 7 H LYS 7 4.945 -7.861 5.417 47 HA LYS 7 HA LYS 7 5.683 -8.137 2.689 48 HB2 LYS 7 2HB LYS 7 2.915 -7.987 3.958 49 HB3 LYS 7 3HB LYS 7 3.223 -8.480 2.292 50 HG2 LYS 7 2HG LYS 7 4.512 -10.420 3.076 51 HG3 LYS 7 3HG LYS 7 4.288 -9.909 4.755 52 HD2 LYS 7 2HD LYS 7 1.831 -10.210 4.502 53 HD3 LYS 7 3HD LYS 7 2.074 -10.733 2.833 54 HE2 LYS 7 2HE LYS 7 3.092 -12.160 5.316 55 HE3 LYS 7 3HE LYS 7 1.728 -12.659 4.315 56 HZ1 LYS 7 1HZ LYS 7 4.574 -12.523 3.462 57 HZ2 LYS 7 2HZ LYS 7 3.278 -12.925 2.452 58 HZ3 LYS 7 3HZ LYS 7 3.674 -13.927 3.753 59 H LEU 8 H LEU 8 4.140 -5.518 4.477 60 HA LEU 8 HA LEU 8 3.570 -3.847 2.196 61 HB2 LEU 8 2HB LEU 8 3.679 -3.238 5.169 62 HB3 LEU 8 3HB LEU 8 3.150 -2.085 3.953 63 HG LEU 8 HG LEU 8 1.765 -4.719 4.593 64 HD11 LEU 8 1HD1 LEU 8 -0.001 -3.365 5.593 65 HD12 LEU 8 2HD1 LEU 8 0.932 -1.893 5.298 66 HD13 LEU 8 3HD1 LEU 8 1.535 -3.118 6.420 67 HD21 LEU 8 1HD2 LEU 8 1.448 -4.088 2.248 68 HD22 LEU 8 2HD2 LEU 8 0.892 -2.482 2.733 69 HD23 LEU 8 3HD2 LEU 8 -0.051 -3.915 3.158 70 H GLU 9 H GLU 9 6.251 -4.219 4.462 71 HA GLU 9 HA GLU 9 7.726 -1.897 3.749 72 HB2 GLU 9 2HB GLU 9 8.637 -4.502 5.042 73 HB3 GLU 9 3HB GLU 9 9.637 -3.052 4.912 74 HG2 GLU 9 2HG GLU 9 7.051 -3.325 6.489 75 HG3 GLU 9 3HG GLU 9 8.680 -3.283 7.154 76 H LYS 10 H LYS 10 7.871 -5.308 2.758 77 HA LYS 10 HA LYS 10 9.813 -5.204 0.767 78 HB2 LYS 10 2HB LYS 10 7.294 -6.910 0.964 79 HB3 LYS 10 3HB LYS 10 8.493 -7.136 -0.309 80 HG2 LYS 10 2HG LYS 10 9.030 -7.403 2.672 81 HG3 LYS 10 3HG LYS 10 8.747 -8.751 1.561 82 HD2 LYS 10 2HD LYS 10 10.774 -8.143 0.292 83 HD3 LYS 10 3HD LYS 10 11.038 -6.750 1.345 84 HE2 LYS 10 2HE LYS 10 11.425 -8.230 3.249 85 HE3 LYS 10 3HE LYS 10 11.068 -9.647 2.259 86 HZ1 LYS 10 1HZ LYS 10 13.443 -9.305 2.477 87 HZ2 LYS 10 2HZ LYS 10 13.310 -7.752 1.827 88 HZ3 LYS 10 3HZ LYS 10 12.961 -9.097 0.869 89 H ALA 11 H ALA 11 6.300 -4.773 0.565 90 HA ALA 11 HA ALA 11 5.961 -4.320 -2.121 91 HB1 ALA 11 1HB ALA 11 3.836 -3.247 -1.539 92 HB2 ALA 11 2HB ALA 11 4.377 -3.054 0.132 93 HB3 ALA 11 3HB ALA 11 4.115 -4.669 -0.527 94 H LEU 12 H LEU 12 6.316 -1.794 0.394 95 HA LEU 12 HA LEU 12 6.488 0.527 -1.019 96 HB2 LEU 12 2HB LEU 12 7.986 -0.389 1.445 97 HB3 LEU 12 3HB LEU 12 8.278 1.213 0.787 98 HG LEU 12 HG LEU 12 5.566 0.217 1.747 99 HD11 LEU 12 1HD1 LEU 12 7.544 2.060 3.118 100 HD12 LEU 12 2HD1 LEU 12 7.125 0.417 3.616 101 HD13 LEU 12 3HD1 LEU 12 5.909 1.690 3.677 102 HD21 LEU 12 1HD2 LEU 12 5.398 1.942 -0.005 103 HD22 LEU 12 2HD2 LEU 12 6.462 3.003 0.924 104 HD23 LEU 12 3HD2 LEU 12 4.874 2.561 1.559 105 H ILE 13 H ILE 13 9.330 -1.542 -0.284 106 HA ILE 13 HA ILE 13 11.219 0.084 -1.634 107 HB ILE 13 HB ILE 13 11.425 -2.828 -0.749 108 HG12 ILE 13 2HG1 ILE 13 12.345 -0.289 0.692 109 HG13 ILE 13 3HG1 ILE 13 10.865 -1.167 1.064 110 HG21 ILE 13 1HG2 ILE 13 13.885 -2.513 -0.779 111 HG22 ILE 13 2HG2 ILE 13 13.671 -0.900 -1.465 112 HG23 ILE 13 3HG2 ILE 13 13.187 -2.325 -2.387 113 HD11 ILE 13 1HD1 ILE 13 13.671 -2.232 1.370 114 HD12 ILE 13 2HD1 ILE 13 12.182 -3.112 1.734 115 HD13 ILE 13 3HD1 ILE 13 12.604 -1.671 2.656 116 H GLU 14 H GLU 14 9.629 -2.990 -2.597 117 HA GLU 14 HA GLU 14 10.948 -3.379 -5.031 118 HB2 GLU 14 2HB GLU 14 8.124 -4.303 -4.363 119 HB3 GLU 14 3HB GLU 14 9.184 -4.982 -5.595 120 HG2 GLU 14 2HG GLU 14 9.419 -5.204 -2.587 121 HG3 GLU 14 3HG GLU 14 9.175 -6.496 -3.747 122 H VAL 15 H VAL 15 8.020 -1.527 -4.264 123 HA VAL 15 HA VAL 15 7.614 -0.815 -7.088 124 HB VAL 15 HB VAL 15 5.473 0.076 -6.482 125 HG11 VAL 15 1HG1 VAL 15 4.335 -1.854 -5.444 126 HG12 VAL 15 2HG1 VAL 15 5.892 -2.484 -4.903 127 HG13 VAL 15 3HG1 VAL 15 5.540 -2.371 -6.628 128 HG21 VAL 15 1HG2 VAL 15 4.653 0.238 -4.126 129 HG22 VAL 15 2HG2 VAL 15 6.003 1.323 -4.454 130 HG23 VAL 15 3HG2 VAL 15 6.277 -0.170 -3.560 131 H ARG 16 H ARG 16 9.335 0.378 -4.478 132 HA ARG 16 HA ARG 16 9.039 3.062 -4.253 133 HB2 ARG 16 2HB ARG 16 10.755 1.898 -2.978 134 HB3 ARG 16 3HB ARG 16 11.715 1.631 -4.427 135 HG2 ARG 16 2HG ARG 16 11.922 4.169 -4.622 136 HG3 ARG 16 3HG ARG 16 11.199 4.272 -3.017 137 HD2 ARG 16 2HD ARG 16 13.094 3.043 -2.066 138 HD3 ARG 16 3HD ARG 16 13.783 2.802 -3.679 139 HE ARG 16 HE ARG 16 13.317 5.542 -2.709 140 HH11 ARG 16 1HH1 ARG 16 15.682 3.091 -3.618 141 HH12 ARG 16 2HH1 ARG 16 16.990 4.221 -3.681 142 HH21 ARG 16 1HH2 ARG 16 15.040 6.990 -2.828 143 HH22 ARG 16 2HH2 ARG 16 16.628 6.424 -3.237 144 HA PRO 17 HA PRO 17 11.626 4.330 -8.210 145 HB2 PRO 17 2HB PRO 17 12.025 2.494 -10.231 146 HB3 PRO 17 3HB PRO 17 13.167 2.702 -8.887 147 HG2 PRO 17 2HG PRO 17 10.992 0.646 -9.205 148 HG3 PRO 17 3HG PRO 17 12.684 0.422 -8.698 149 HD2 PRO 17 2HD PRO 17 10.693 0.541 -6.877 150 HD3 PRO 17 3HD PRO 17 12.293 1.235 -6.535 151 H TYR 18 H TYR 18 8.869 2.197 -8.388 152 HA TYR 18 HA TYR 18 7.825 3.183 -10.916 153 HB2 TYR 18 2HB TYR 18 6.503 1.424 -8.795 154 HB3 TYR 18 3HB TYR 18 5.846 1.744 -10.397 155 HD1 TYR 18 HD1 TYR 18 8.768 0.198 -8.647 156 HD2 TYR 18 HD2 TYR 18 6.422 0.318 -12.209 157 HE1 TYR 18 HE1 TYR 18 9.930 -1.797 -9.469 158 HE2 TYR 18 HE2 TYR 18 7.584 -1.674 -13.048 159 HH TYR 18 HH TYR 18 9.680 -2.881 -12.719 160 H VAL 19 H VAL 19 7.312 3.789 -7.473 161 HA VAL 19 HA VAL 19 4.756 5.146 -7.969 162 HB VAL 19 HB VAL 19 4.452 5.172 -5.517 163 HG11 VAL 19 1HG1 VAL 19 4.176 2.746 -5.191 164 HG12 VAL 19 2HG1 VAL 19 5.204 2.434 -6.594 165 HG13 VAL 19 3HG1 VAL 19 3.650 3.249 -6.801 166 HG21 VAL 19 1HG2 VAL 19 6.014 3.986 -4.008 167 HG22 VAL 19 2HG2 VAL 19 6.784 5.381 -4.763 168 HG23 VAL 19 3HG2 VAL 19 7.142 3.755 -5.349 169 H GLU 20 H GLU 20 4.326 7.229 -7.572 170 HA GLU 20 HA GLU 20 6.444 9.097 -6.725 171 HB2 GLU 20 2HB GLU 20 5.062 9.626 -8.781 172 HB3 GLU 20 3HB GLU 20 3.624 9.677 -7.773 173 HG2 GLU 20 2HG GLU 20 4.479 11.938 -8.311 174 HG3 GLU 20 3HG GLU 20 4.462 11.629 -6.574 175 H TYR 21 H TYR 21 5.835 10.664 -4.952 176 HA TYR 21 HA TYR 21 5.181 11.156 -2.836 177 HB2 TYR 21 2HB TYR 21 2.630 9.632 -3.544 178 HB3 TYR 21 3HB TYR 21 2.810 10.717 -2.172 179 HD1 TYR 21 HD1 TYR 21 3.677 13.187 -2.875 180 HD2 TYR 21 HD2 TYR 21 1.567 10.501 -5.452 181 HE1 TYR 21 HE1 TYR 21 2.947 15.081 -4.253 182 HE2 TYR 21 HE2 TYR 21 0.844 12.395 -6.827 183 HH TYR 21 HH TYR 21 2.227 15.406 -6.708 184 H TYR 22 H TYR 22 6.793 8.892 -3.249 185 HA TYR 22 HA TYR 22 6.173 6.511 -2.024 186 HB2 TYR 22 2HB TYR 22 8.307 6.854 -3.205 187 HB3 TYR 22 3HB TYR 22 8.866 7.938 -1.935 188 HD1 TYR 22 HD1 TYR 22 7.753 4.407 -2.505 189 HD2 TYR 22 HD2 TYR 22 10.097 7.030 -0.075 190 HE1 TYR 22 HE1 TYR 22 8.649 2.481 -1.287 191 HE2 TYR 22 HE2 TYR 22 10.990 5.097 1.149 192 HH TYR 22 HH TYR 22 10.278 2.734 1.647 193 H ASN 23 H ASN 23 7.179 9.514 -0.411 194 HA ASN 23 HA ASN 23 7.428 8.491 2.237 195 HB2 ASN 23 2HB ASN 23 6.922 11.316 1.238 196 HB3 ASN 23 3HB ASN 23 7.235 10.930 2.927 197 HD21 ASN 23 1HD2 ASN 23 8.733 12.555 0.939 198 HD22 ASN 23 2HD2 ASN 23 10.341 11.927 0.969 199 H GLU 24 H GLU 24 4.726 9.900 0.443 200 HA GLU 24 HA GLU 24 2.951 10.201 2.653 201 HB2 GLU 24 2HB GLU 24 2.240 10.054 -0.302 202 HB3 GLU 24 3HB GLU 24 1.273 10.775 0.986 203 HG2 GLU 24 2HG GLU 24 3.911 11.782 -0.126 204 HG3 GLU 24 3HG GLU 24 2.326 12.530 -0.306 205 H LEU 25 H LEU 25 3.012 7.872 -0.080 206 HA LEU 25 HA LEU 25 1.110 6.054 0.816 207 HB2 LEU 25 2HB LEU 25 2.071 6.110 -1.466 208 HB3 LEU 25 3HB LEU 25 3.619 5.583 -0.831 209 HG LEU 25 HG LEU 25 2.598 3.398 -0.178 210 HD11 LEU 25 1HD1 LEU 25 0.383 2.760 -1.029 211 HD12 LEU 25 2HD1 LEU 25 0.112 4.418 -1.577 212 HD13 LEU 25 3HD1 LEU 25 0.289 4.070 0.146 213 HD21 LEU 25 1HD2 LEU 25 2.296 4.112 -3.110 214 HD22 LEU 25 2HD2 LEU 25 2.424 2.479 -2.450 215 HD23 LEU 25 3HD2 LEU 25 3.779 3.593 -2.300 216 H LYS 26 H LYS 26 4.609 6.162 1.430 217 HA LYS 26 HA LYS 26 4.961 3.964 3.111 218 HB2 LYS 26 2HB LYS 26 6.805 5.426 2.300 219 HB3 LYS 26 3HB LYS 26 6.304 6.677 3.426 220 HG2 LYS 26 2HG LYS 26 6.889 5.206 5.322 221 HG3 LYS 26 3HG LYS 26 7.352 3.930 4.193 222 HD2 LYS 26 2HD LYS 26 9.353 5.063 4.982 223 HD3 LYS 26 3HD LYS 26 9.125 5.418 3.268 224 HE2 LYS 26 2HE LYS 26 9.804 7.440 4.446 225 HE3 LYS 26 3HE LYS 26 8.140 7.630 3.895 226 HZ1 LYS 26 1HZ LYS 26 7.400 7.037 6.149 227 HZ2 LYS 26 2HZ LYS 26 8.371 8.418 6.143 228 HZ3 LYS 26 3HZ LYS 26 9.013 6.941 6.654 229 H ALA 27 H ALA 27 3.660 7.187 3.978 230 HA ALA 27 HA ALA 27 3.445 6.748 6.786 231 HB1 ALA 27 1HB ALA 27 1.948 8.717 5.020 232 HB2 ALA 27 2HB ALA 27 3.504 9.011 5.799 233 HB3 ALA 27 3HB ALA 27 2.055 8.785 6.781 234 H LEU 28 H LEU 28 1.255 6.291 4.036 235 HA LEU 28 HA LEU 28 -1.089 5.600 5.456 236 HB2 LEU 28 2HB LEU 28 -1.056 6.297 3.081 237 HB3 LEU 28 3HB LEU 28 -0.179 4.837 2.656 238 HG LEU 28 HG LEU 28 -2.137 3.451 3.248 239 HD11 LEU 28 1HD1 LEU 28 -3.107 4.792 5.026 240 HD12 LEU 28 2HD1 LEU 28 -4.311 4.466 3.783 241 HD13 LEU 28 3HD1 LEU 28 -3.548 6.057 3.875 242 HD21 LEU 28 1HD2 LEU 28 -3.617 4.123 1.403 243 HD22 LEU 28 2HD2 LEU 28 -1.921 4.229 0.941 244 HD23 LEU 28 3HD2 LEU 28 -2.821 5.699 1.326 245 H VAL 29 H VAL 29 1.475 3.603 4.002 246 HA VAL 29 HA VAL 29 0.696 1.057 4.808 247 HB VAL 29 HB VAL 29 3.335 2.328 4.066 248 HG11 VAL 29 1HG1 VAL 29 3.096 -0.523 5.080 249 HG12 VAL 29 2HG1 VAL 29 4.071 0.780 5.776 250 HG13 VAL 29 3HG1 VAL 29 4.489 0.111 4.194 251 HG21 VAL 29 1HG2 VAL 29 1.723 0.062 2.832 252 HG22 VAL 29 2HG2 VAL 29 3.207 0.748 2.160 253 HG23 VAL 29 3HG2 VAL 29 1.754 1.740 2.281 254 H SER 30 H SER 30 2.651 3.467 6.447 255 HA SER 30 HA SER 30 3.375 1.921 8.709 256 HB2 SER 30 2HB SER 30 4.582 3.956 7.947 257 HB3 SER 30 3HB SER 30 3.226 4.953 8.483 258 HG SER 30 HG SER 30 4.799 3.243 10.122 259 H LYS 31 H LYS 31 0.638 4.012 8.027 260 HA LYS 31 HA LYS 31 -0.617 3.982 10.554 261 HB2 LYS 31 2HB LYS 31 -1.192 5.641 8.842 262 HB3 LYS 31 3HB LYS 31 -1.753 4.372 7.755 263 HG2 LYS 31 2HG LYS 31 -3.605 3.856 9.306 264 HG3 LYS 31 3HG LYS 31 -3.038 5.114 10.410 265 HD2 LYS 31 2HD LYS 31 -3.462 6.830 8.682 266 HD3 LYS 31 3HD LYS 31 -4.006 5.582 7.554 267 HE2 LYS 31 2HE LYS 31 -5.911 6.757 8.608 268 HE3 LYS 31 3HE LYS 31 -5.891 5.045 9.035 269 HZ1 LYS 31 1HZ LYS 31 -4.872 7.246 10.759 270 HZ2 LYS 31 2HZ LYS 31 -4.936 5.611 11.177 271 HZ3 LYS 31 3HZ LYS 31 -6.367 6.483 10.948 272 H ILE 32 H ILE 32 -1.160 1.990 7.613 273 HA ILE 32 HA ILE 32 -3.378 0.605 8.771 274 HB ILE 32 HB ILE 32 -3.491 -0.733 6.703 275 HG12 ILE 32 2HG1 ILE 32 -0.938 0.712 5.844 276 HG13 ILE 32 3HG1 ILE 32 -1.023 -0.980 6.307 277 HG21 ILE 32 1HG2 ILE 32 -3.928 1.112 5.121 278 HG22 ILE 32 2HG2 ILE 32 -3.028 2.224 6.154 279 HG23 ILE 32 3HG2 ILE 32 -4.527 1.497 6.737 280 HD11 ILE 32 1HD1 ILE 32 -2.392 0.249 3.917 281 HD12 ILE 32 2HD1 ILE 32 -2.424 -1.457 4.374 282 HD13 ILE 32 3HD1 ILE 32 -0.903 -0.697 3.901 283 H SER 33 H SER 33 0.007 -0.412 8.073 284 HA SER 33 HA SER 33 -0.031 -3.040 8.874 285 HB2 SER 33 2HB SER 33 2.397 -2.730 9.482 286 HB3 SER 33 3HB SER 33 1.969 -2.049 7.913 287 HG SER 33 HG SER 33 2.722 -0.245 8.640 288 H SER 34 H SER 34 0.133 -0.188 10.932 289 HA SER 34 HA SER 34 0.496 -1.578 13.420 290 HB2 SER 34 2HB SER 34 1.289 0.764 13.026 291 HB3 SER 34 3HB SER 34 -0.385 1.300 12.906 292 HG SER 34 HG SER 34 -0.405 0.128 15.153 293 H SER 35 H SER 35 -2.204 -0.843 11.426 294 HA SER 35 HA SER 35 -4.189 -0.917 13.589 295 HB2 SER 35 2HB SER 35 -4.218 0.930 11.892 296 HB3 SER 35 3HB SER 35 -4.547 -0.266 10.636 297 HG SER 35 HG SER 35 -6.512 -0.712 11.622 298 H VAL 36 H VAL 36 -3.200 -2.811 10.741 299 HA VAL 36 HA VAL 36 -5.670 -4.386 10.785 300 HB VAL 36 HB VAL 36 -5.046 -5.265 8.589 301 HG11 VAL 36 1HG1 VAL 36 -5.130 -3.192 7.251 302 HG12 VAL 36 2HG1 VAL 36 -4.708 -2.244 8.681 303 HG13 VAL 36 3HG1 VAL 36 -6.237 -3.126 8.625 304 HG21 VAL 36 1HG2 VAL 36 -2.619 -5.444 8.831 305 HG22 VAL 36 2HG2 VAL 36 -2.459 -3.686 8.846 306 HG23 VAL 36 3HG2 VAL 36 -3.013 -4.512 7.386 307 H ASN 37 H ASN 37 -5.685 -6.638 10.772 308 HA ASN 37 HA ASN 37 -3.500 -7.881 12.315 309 HB2 ASN 37 2HB ASN 37 -5.387 -9.701 12.690 310 HB3 ASN 37 3HB ASN 37 -5.424 -8.192 13.587 311 HD21 ASN 37 1HD2 ASN 37 -6.833 -9.903 10.855 312 HD22 ASN 37 2HD2 ASN 37 -8.314 -9.017 10.820 313 H ASP 38 H ASP 38 -5.121 -8.102 9.222 314 HA ASP 38 HA ASP 38 -3.397 -10.393 8.461 315 HB2 ASP 38 2HB ASP 38 -6.365 -10.116 7.778 316 HB3 ASP 38 3HB ASP 38 -5.281 -11.229 6.951 317 H LEU 39 H LEU 39 -2.980 -10.522 6.135 318 HA LEU 39 HA LEU 39 -2.200 -7.967 5.110 319 HB2 LEU 39 2HB LEU 39 -0.916 -10.134 4.878 320 HB3 LEU 39 3HB LEU 39 -2.122 -10.691 3.745 321 HG LEU 39 HG LEU 39 0.116 -9.857 2.791 322 HD11 LEU 39 1HD1 LEU 39 -2.349 -8.593 1.624 323 HD12 LEU 39 2HD1 LEU 39 -1.786 -10.242 1.343 324 HD13 LEU 39 3HD1 LEU 39 -0.812 -8.877 0.799 325 HD21 LEU 39 1HD2 LEU 39 0.361 -7.848 4.171 326 HD22 LEU 39 2HD2 LEU 39 -1.031 -7.116 3.365 327 HD23 LEU 39 3HD2 LEU 39 0.438 -7.474 2.450 328 H GLU 40 H GLU 40 -4.837 -10.207 4.477 329 HA GLU 40 HA GLU 40 -5.994 -9.024 2.203 330 HB2 GLU 40 2HB GLU 40 -6.621 -11.258 3.051 331 HB3 GLU 40 3HB GLU 40 -7.305 -10.534 4.502 332 HG2 GLU 40 2HG GLU 40 -9.044 -9.433 3.165 333 HG3 GLU 40 3HG GLU 40 -8.342 -10.077 1.682 334 H GLU 41 H GLU 41 -6.171 -8.217 5.643 335 HA GLU 41 HA GLU 41 -8.302 -6.318 5.477 336 HB2 GLU 41 2HB GLU 41 -6.090 -6.457 7.569 337 HB3 GLU 41 3HB GLU 41 -7.629 -5.612 7.731 338 HG2 GLU 41 2HG GLU 41 -7.238 -8.614 7.531 339 HG3 GLU 41 3HG GLU 41 -7.593 -7.707 9.004 340 H ALA 42 H ALA 42 -4.813 -6.191 5.083 341 HA ALA 42 HA ALA 42 -4.515 -3.339 5.064 342 HB1 ALA 42 1HB ALA 42 -2.269 -3.790 4.130 343 HB2 ALA 42 2HB ALA 42 -2.710 -5.485 3.899 344 HB3 ALA 42 3HB ALA 42 -2.612 -4.815 5.529 345 H ILE 43 H ILE 43 -4.841 -5.821 2.561 346 HA ILE 43 HA ILE 43 -4.596 -4.198 0.273 347 HB ILE 43 HB ILE 43 -5.997 -6.870 0.691 348 HG12 ILE 43 2HG1 ILE 43 -3.325 -6.137 -0.599 349 HG13 ILE 43 3HG1 ILE 43 -3.553 -6.948 0.946 350 HG21 ILE 43 1HG2 ILE 43 -6.116 -7.151 -1.757 351 HG22 ILE 43 2HG2 ILE 43 -5.511 -5.511 -1.979 352 HG23 ILE 43 3HG2 ILE 43 -7.082 -5.775 -1.227 353 HD11 ILE 43 1HD1 ILE 43 -2.858 -8.525 -0.725 354 HD12 ILE 43 2HD1 ILE 43 -4.191 -8.068 -1.786 355 HD13 ILE 43 3HD1 ILE 43 -4.521 -8.884 -0.256 356 H VAL 44 H VAL 44 -7.736 -5.597 1.455 357 HA VAL 44 HA VAL 44 -9.611 -4.096 0.251 358 HB VAL 44 HB VAL 44 -9.609 -4.967 3.179 359 HG11 VAL 44 1HG1 VAL 44 -12.083 -4.872 3.091 360 HG12 VAL 44 2HG1 VAL 44 -11.997 -4.172 1.472 361 HG13 VAL 44 3HG1 VAL 44 -11.367 -3.276 2.855 362 HG21 VAL 44 1HG2 VAL 44 -10.744 -6.350 0.707 363 HG22 VAL 44 2HG2 VAL 44 -10.873 -6.943 2.367 364 HG23 VAL 44 3HG2 VAL 44 -9.292 -6.835 1.593 365 H VAL 45 H VAL 45 -8.112 -3.007 3.372 366 HA VAL 45 HA VAL 45 -9.323 -0.467 3.545 367 HB VAL 45 HB VAL 45 -6.632 -1.439 4.612 368 HG11 VAL 45 1HG1 VAL 45 -6.539 0.573 6.069 369 HG12 VAL 45 2HG1 VAL 45 -7.938 1.244 5.232 370 HG13 VAL 45 3HG1 VAL 45 -6.422 1.009 4.363 371 HG21 VAL 45 1HG2 VAL 45 -9.287 -0.872 6.000 372 HG22 VAL 45 2HG2 VAL 45 -7.821 -1.455 6.793 373 HG23 VAL 45 3HG2 VAL 45 -8.644 -2.469 5.610 374 H LEU 46 H LEU 46 -6.342 -1.405 1.830 375 HA LEU 46 HA LEU 46 -5.640 1.194 0.882 376 HB2 LEU 46 2HB LEU 46 -4.895 -1.584 -0.066 377 HB3 LEU 46 3HB LEU 46 -4.326 -0.154 -0.910 378 HG LEU 46 HG LEU 46 -3.718 -0.801 1.997 379 HD11 LEU 46 1HD1 LEU 46 -1.451 -1.329 1.251 380 HD12 LEU 46 2HD1 LEU 46 -1.923 -1.071 -0.431 381 HD13 LEU 46 3HD1 LEU 46 -2.629 -2.400 0.495 382 HD21 LEU 46 1HD2 LEU 46 -3.720 1.613 1.575 383 HD22 LEU 46 2HD2 LEU 46 -2.619 1.397 0.211 384 HD23 LEU 46 3HD2 LEU 46 -2.082 1.029 1.852 385 H ARG 47 H ARG 47 -7.883 -1.271 -0.329 386 HA ARG 47 HA ARG 47 -8.263 -0.212 -2.946 387 HB2 ARG 47 2HB ARG 47 -10.108 -1.954 -1.265 388 HB3 ARG 47 3HB ARG 47 -10.386 -1.562 -2.961 389 HG2 ARG 47 2HG ARG 47 -8.244 -2.738 -3.527 390 HG3 ARG 47 3HG ARG 47 -8.095 -3.205 -1.827 391 HD2 ARG 47 2HD ARG 47 -10.341 -4.326 -2.013 392 HD3 ARG 47 3HD ARG 47 -10.323 -3.977 -3.742 393 HE ARG 47 HE ARG 47 -8.102 -5.346 -3.619 394 HH11 ARG 47 1HH1 ARG 47 -11.089 -6.036 -1.882 395 HH12 ARG 47 2HH1 ARG 47 -10.802 -7.742 -1.816 396 HH21 ARG 47 1HH2 ARG 47 -7.748 -7.608 -3.512 397 HH22 ARG 47 2HH2 ARG 47 -8.914 -8.629 -2.735 398 H GLU 48 H GLU 48 -9.492 0.623 0.198 399 HA GLU 48 HA GLU 48 -11.683 2.273 -0.688 400 HB2 GLU 48 2HB GLU 48 -10.198 2.168 1.973 401 HB3 GLU 48 3HB GLU 48 -11.651 3.126 1.689 402 HG2 GLU 48 2HG GLU 48 -11.472 0.091 1.512 403 HG3 GLU 48 3HG GLU 48 -12.116 1.006 2.879 404 H GLU 49 H GLU 49 -8.377 2.765 0.396 405 HA GLU 49 HA GLU 49 -8.297 5.602 0.281 406 HB2 GLU 49 2HB GLU 49 -5.994 3.628 -0.024 407 HB3 GLU 49 3HB GLU 49 -5.837 5.337 0.391 408 HG2 GLU 49 2HG GLU 49 -7.126 3.161 2.076 409 HG3 GLU 49 3HG GLU 49 -5.580 3.950 2.379 410 H GLU 50 H GLU 50 -7.500 3.117 -2.068 411 HA GLU 50 HA GLU 50 -6.446 4.648 -4.147 412 HB2 GLU 50 2HB GLU 50 -6.266 2.193 -4.011 413 HB3 GLU 50 3HB GLU 50 -7.994 2.033 -4.271 414 HG2 GLU 50 2HG GLU 50 -6.805 3.559 -6.456 415 HG3 GLU 50 3HG GLU 50 -5.916 2.059 -6.232 416 H LYS 51 H LYS 51 -9.860 3.499 -3.752 417 HA LYS 51 HA LYS 51 -11.041 4.876 -5.856 418 HB2 LYS 51 2HB LYS 51 -12.209 4.102 -3.156 419 HB3 LYS 51 3HB LYS 51 -13.173 4.603 -4.544 420 HG2 LYS 51 2HG LYS 51 -12.464 2.630 -5.797 421 HG3 LYS 51 3HG LYS 51 -11.357 2.167 -4.503 422 HD2 LYS 51 2HD LYS 51 -13.328 0.784 -4.325 423 HD3 LYS 51 3HD LYS 51 -13.324 1.908 -2.966 424 HE2 LYS 51 2HE LYS 51 -15.577 1.702 -3.881 425 HE3 LYS 51 3HE LYS 51 -14.974 3.335 -4.172 426 HZ1 LYS 51 1HZ LYS 51 -15.063 1.116 -6.146 427 HZ2 LYS 51 2HZ LYS 51 -14.432 2.653 -6.445 428 HZ3 LYS 51 3HZ LYS 51 -16.076 2.470 -6.112 429 H LYS 52 H LYS 52 -10.335 5.994 -2.537 430 HA LYS 52 HA LYS 52 -11.817 8.451 -2.695 431 HB2 LYS 52 2HB LYS 52 -9.533 7.664 -0.837 432 HB3 LYS 52 3HB LYS 52 -10.523 9.112 -0.648 433 HG2 LYS 52 2HG LYS 52 -12.505 7.749 -0.238 434 HG3 LYS 52 3HG LYS 52 -11.586 6.271 -0.537 435 HD2 LYS 52 2HD LYS 52 -10.087 6.958 1.429 436 HD3 LYS 52 3HD LYS 52 -11.275 8.220 1.774 437 HE2 LYS 52 2HE LYS 52 -11.780 5.221 1.779 438 HE3 LYS 52 3HE LYS 52 -11.663 6.265 3.195 439 HZ1 LYS 52 1HZ LYS 52 -13.949 5.824 2.685 440 HZ2 LYS 52 2HZ LYS 52 -13.767 6.377 1.099 441 HZ3 LYS 52 3HZ LYS 52 -13.636 7.459 2.394 442 H ALA 53 H ALA 53 -8.610 7.452 -3.615 443 HA ALA 53 HA ALA 53 -7.595 10.172 -3.997 444 HB1 ALA 53 1HB ALA 53 -6.112 8.498 -2.956 445 HB2 ALA 53 2HB ALA 53 -5.445 9.047 -4.495 446 HB3 ALA 53 3HB ALA 53 -6.242 7.471 -4.387 447 H SER 54 H SER 54 -7.388 11.112 -5.978 448 HA SER 54 HA SER 54 -7.785 9.533 -8.441 449 HB2 SER 54 2HB SER 54 -7.673 11.841 -9.541 450 HB3 SER 54 3HB SER 54 -9.052 11.577 -8.472 451 HG SER 54 HG SER 54 -8.297 13.003 -7.106 452 H GLU 55 H GLU 55 -6.166 10.020 -10.224 453 HA GLU 55 HA GLU 55 -3.601 9.185 -9.304 454 HB2 GLU 55 2HB GLU 55 -4.534 10.011 -12.083 455 HB3 GLU 55 3HB GLU 55 -3.007 9.199 -11.735 456 HG2 GLU 55 2HG GLU 55 -4.322 7.273 -10.789 457 HG3 GLU 55 3HG GLU 55 -5.800 8.079 -11.314 458 HA PRO 56 HA PRO 56 -1.431 9.172 -10.199 459 HB2 PRO 56 2HB PRO 56 1.101 9.783 -9.531 460 HB3 PRO 56 3HB PRO 56 0.387 10.383 -11.046 461 HG2 PRO 56 2HG PRO 56 0.837 11.844 -8.473 462 HG3 PRO 56 3HG PRO 56 1.024 12.421 -10.138 463 HD2 PRO 56 2HD PRO 56 -1.235 12.856 -8.499 464 HD3 PRO 56 3HD PRO 56 -1.174 13.086 -10.259 465 H PHE 57 H PHE 57 -2.326 10.652 -7.295 466 HA PHE 57 HA PHE 57 -0.852 8.941 -5.510 467 HB2 PHE 57 2HB PHE 57 -2.019 11.145 -4.825 468 HB3 PHE 57 3HB PHE 57 -3.503 10.197 -4.734 469 HD1 PHE 57 HD1 PHE 57 0.025 10.265 -3.466 470 HD2 PHE 57 HD2 PHE 57 -3.987 9.001 -2.686 471 HE1 PHE 57 HE1 PHE 57 0.700 9.481 -1.241 472 HE2 PHE 57 HE2 PHE 57 -3.295 8.224 -0.458 473 HZ PHE 57 HZ PHE 57 -0.953 8.456 0.268 474 H LYS 58 H LYS 58 -3.919 8.682 -7.195 475 HA LYS 58 HA LYS 58 -4.804 6.203 -6.136 476 HB2 LYS 58 2HB LYS 58 -6.152 7.748 -7.599 477 HB3 LYS 58 3HB LYS 58 -5.184 7.241 -8.974 478 HG2 LYS 58 2HG LYS 58 -6.019 4.917 -8.676 479 HG3 LYS 58 3HG LYS 58 -7.013 5.469 -7.320 480 HD2 LYS 58 2HD LYS 58 -8.162 7.062 -8.920 481 HD3 LYS 58 3HD LYS 58 -7.269 6.305 -10.243 482 HE2 LYS 58 2HE LYS 58 -9.507 5.366 -10.133 483 HE3 LYS 58 3HE LYS 58 -8.347 4.127 -9.655 484 HZ1 LYS 58 1HZ LYS 58 -8.898 4.529 -7.349 485 HZ2 LYS 58 2HZ LYS 58 -10.304 4.184 -8.223 486 HZ3 LYS 58 3HZ LYS 58 -9.956 5.777 -7.786 487 H THR 59 H THR 59 -2.251 7.044 -8.342 488 HA THR 59 HA THR 59 -1.985 4.482 -9.586 489 HB THR 59 HB THR 59 0.028 6.772 -9.592 490 HG1 THR 59 HG1 THR 59 -2.121 6.259 -11.404 491 HG21 THR 59 1HG2 THR 59 0.749 5.835 -11.764 492 HG22 THR 59 2HG2 THR 59 -0.431 4.534 -11.603 493 HG23 THR 59 3HG2 THR 59 0.933 4.630 -10.487 494 H ASP 60 H ASP 60 -0.120 6.272 -7.075 495 HA ASP 60 HA ASP 60 1.841 4.233 -6.803 496 HB2 ASP 60 2HB ASP 60 2.519 5.366 -4.675 497 HB3 ASP 60 3HB ASP 60 2.493 6.396 -6.097 498 H ILE 61 H ILE 61 -1.095 4.951 -4.882 499 HA ILE 61 HA ILE 61 -0.970 2.875 -3.062 500 HB ILE 61 HB ILE 61 -3.499 3.897 -4.431 501 HG12 ILE 61 2HG1 ILE 61 -2.256 4.674 -1.744 502 HG13 ILE 61 3HG1 ILE 61 -2.184 5.643 -3.212 503 HG21 ILE 61 1HG2 ILE 61 -3.251 2.260 -1.861 504 HG22 ILE 61 2HG2 ILE 61 -3.939 1.700 -3.386 505 HG23 ILE 61 3HG2 ILE 61 -4.744 2.977 -2.479 506 HD11 ILE 61 1HD1 ILE 61 -4.712 4.918 -1.732 507 HD12 ILE 61 2HD1 ILE 61 -4.591 5.946 -3.163 508 HD13 ILE 61 3HD1 ILE 61 -3.858 6.456 -1.646 509 H ARG 62 H ARG 62 -2.573 2.641 -6.352 510 HA ARG 62 HA ARG 62 -3.210 -0.090 -5.965 511 HB2 ARG 62 2HB ARG 62 -3.971 -0.163 -8.273 512 HB3 ARG 62 3HB ARG 62 -4.527 1.291 -7.470 513 HG2 ARG 62 2HG ARG 62 -3.994 2.048 -9.593 514 HG3 ARG 62 3HG ARG 62 -2.557 2.483 -8.673 515 HD2 ARG 62 2HD ARG 62 -2.054 1.544 -10.923 516 HD3 ARG 62 3HD ARG 62 -1.334 0.603 -9.614 517 HE ARG 62 HE ARG 62 -3.648 -0.713 -10.030 518 HH11 ARG 62 1HH1 ARG 62 -1.190 0.321 -12.340 519 HH12 ARG 62 2HH1 ARG 62 -1.507 -0.986 -13.432 520 HH21 ARG 62 1HH2 ARG 62 -4.008 -2.440 -11.469 521 HH22 ARG 62 2HH2 ARG 62 -3.094 -2.540 -12.938 522 H ILE 63 H ILE 63 -0.291 1.376 -7.359 523 HA ILE 63 HA ILE 63 0.783 -0.930 -8.591 524 HB ILE 63 HB ILE 63 2.323 1.353 -7.258 525 HG12 ILE 63 2HG1 ILE 63 1.704 0.914 -10.222 526 HG13 ILE 63 3HG1 ILE 63 0.868 2.052 -9.184 527 HG21 ILE 63 1HG2 ILE 63 3.374 -0.769 -9.175 528 HG22 ILE 63 2HG2 ILE 63 3.763 -0.629 -7.461 529 HG23 ILE 63 3HG2 ILE 63 4.287 0.624 -8.583 530 HD11 ILE 63 1HD1 ILE 63 3.794 2.174 -9.913 531 HD12 ILE 63 2HD1 ILE 63 2.936 3.320 -8.879 532 HD13 ILE 63 3HD1 ILE 63 2.502 3.172 -10.581 533 H LEU 64 H LEU 64 1.169 0.291 -5.262 534 HA LEU 64 HA LEU 64 2.730 -1.865 -4.256 535 HB2 LEU 64 2HB LEU 64 2.634 0.429 -3.294 536 HB3 LEU 64 3HB LEU 64 0.976 0.163 -2.807 537 HG LEU 64 HG LEU 64 3.076 -1.706 -1.711 538 HD11 LEU 64 1HD1 LEU 64 4.117 0.483 -1.421 539 HD12 LEU 64 2HD1 LEU 64 3.645 -0.218 0.123 540 HD13 LEU 64 3HD1 LEU 64 2.672 1.073 -0.591 541 HD21 LEU 64 1HD2 LEU 64 1.670 -1.699 0.303 542 HD22 LEU 64 2HD2 LEU 64 0.722 -2.119 -1.121 543 HD23 LEU 64 3HD2 LEU 64 0.596 -0.500 -0.430 544 H LEU 65 H LEU 65 -0.694 -1.127 -4.257 545 HA LEU 65 HA LEU 65 -1.700 -3.065 -2.502 546 HB2 LEU 65 2HB LEU 65 -2.751 -0.921 -3.502 547 HB3 LEU 65 3HB LEU 65 -3.118 -1.872 -4.919 548 HG LEU 65 HG LEU 65 -4.312 -2.248 -2.139 549 HD11 LEU 65 1HD1 LEU 65 -5.099 -0.223 -3.249 550 HD12 LEU 65 2HD1 LEU 65 -6.390 -1.419 -3.193 551 HD13 LEU 65 3HD1 LEU 65 -5.512 -1.141 -4.701 552 HD21 LEU 65 1HD2 LEU 65 -5.892 -3.822 -3.168 553 HD22 LEU 65 2HD2 LEU 65 -4.239 -4.416 -3.279 554 HD23 LEU 65 3HD2 LEU 65 -5.016 -3.718 -4.701 555 H ASP 66 H ASP 66 -2.226 -3.102 -6.043 556 HA ASP 66 HA ASP 66 -2.805 -5.667 -6.583 557 HB2 ASP 66 2HB ASP 66 -2.848 -3.859 -8.227 558 HB3 ASP 66 3HB ASP 66 -1.094 -3.744 -8.194 559 H PHE 67 H PHE 67 0.554 -4.390 -6.351 560 HA PHE 67 HA PHE 67 2.033 -6.671 -6.879 561 HB2 PHE 67 2HB PHE 67 3.165 -4.558 -6.432 562 HB3 PHE 67 3HB PHE 67 2.576 -4.530 -4.775 563 HD1 PHE 67 HD1 PHE 67 4.813 -6.441 -7.096 564 HD2 PHE 67 HD2 PHE 67 3.860 -5.530 -3.024 565 HE1 PHE 67 HE1 PHE 67 6.828 -7.631 -6.346 566 HE2 PHE 67 HE2 PHE 67 5.876 -6.719 -2.291 567 HZ PHE 67 HZ PHE 67 7.361 -7.774 -3.946 568 H LEU 68 H LEU 68 0.524 -5.820 -3.730 569 HA LEU 68 HA LEU 68 1.346 -8.085 -2.235 570 HB2 LEU 68 2HB LEU 68 -1.192 -6.440 -1.935 571 HB3 LEU 68 3HB LEU 68 -0.553 -7.544 -0.722 572 HG LEU 68 HG LEU 68 0.895 -5.046 -1.678 573 HD11 LEU 68 1HD1 LEU 68 -1.214 -4.461 -0.569 574 HD12 LEU 68 2HD1 LEU 68 0.185 -3.991 0.392 575 HD13 LEU 68 3HD1 LEU 68 -0.748 -5.423 0.840 576 HD21 LEU 68 1HD2 LEU 68 1.433 -6.890 0.681 577 HD22 LEU 68 2HD2 LEU 68 2.296 -5.390 0.323 578 HD23 LEU 68 3HD2 LEU 68 2.408 -6.752 -0.787 579 H GLU 69 H GLU 69 -1.459 -7.511 -4.338 580 HA GLU 69 HA GLU 69 -2.852 -9.957 -3.789 581 HB2 GLU 69 2HB GLU 69 -3.064 -8.121 -6.215 582 HB3 GLU 69 3HB GLU 69 -4.254 -9.322 -5.711 583 HG2 GLU 69 2HG GLU 69 -4.618 -8.005 -3.622 584 HG3 GLU 69 3HG GLU 69 -3.499 -6.784 -4.229 585 H SER 70 H SER 70 -0.313 -8.966 -5.919 586 HA SER 70 HA SER 70 1.089 -9.944 -7.376 587 HB2 SER 70 2HB SER 70 1.366 -11.626 -5.524 588 HB3 SER 70 3HB SER 70 0.105 -12.607 -6.265 589 HG SER 70 HG SER 70 1.437 -12.863 -8.077 590 H LYS 71 H LYS 71 -1.543 -9.207 -8.223 591 HA LYS 71 HA LYS 71 -2.452 -11.256 -10.119 592 HB2 LYS 71 2HB LYS 71 -3.607 -8.549 -9.324 593 HB3 LYS 71 3HB LYS 71 -4.333 -9.608 -10.531 594 HG2 LYS 71 2HG LYS 71 -4.716 -11.334 -8.829 595 HG3 LYS 71 3HG LYS 71 -3.929 -10.339 -7.604 596 HD2 LYS 71 2HD LYS 71 -6.386 -10.207 -7.409 597 HD3 LYS 71 3HD LYS 71 -5.700 -8.634 -7.821 598 HE2 LYS 71 2HE LYS 71 -6.350 -8.996 -10.192 599 HE3 LYS 71 3HE LYS 71 -7.041 -10.560 -9.749 600 HZ1 LYS 71 1HZ LYS 71 -8.590 -9.406 -8.287 601 HZ2 LYS 71 2HZ LYS 71 -8.743 -8.868 -9.883 602 HZ3 LYS 71 3HZ LYS 71 -7.935 -7.915 -8.743 603 HA PRO 72 HA PRO 72 -0.213 -8.934 -13.364 604 HB2 PRO 72 2HB PRO 72 -0.463 -10.720 -15.388 605 HB3 PRO 72 3HB PRO 72 0.617 -11.033 -14.008 606 HG2 PRO 72 2HG PRO 72 -2.135 -12.117 -14.533 607 HG3 PRO 72 3HG PRO 72 -0.702 -12.954 -13.900 608 HD2 PRO 72 2HD PRO 72 -2.754 -11.990 -12.301 609 HD3 PRO 72 3HD PRO 72 -1.092 -12.263 -11.737 Start of MODEL 8 1 H GLY 1 1H GLY 1 3.509 -6.222 16.062 2 HA2 GLY 1 2HA GLY 1 4.943 -5.579 14.217 3 HA3 GLY 1 3HA GLY 1 5.906 -7.022 14.508 4 H SER 2 H SER 2 2.858 -5.784 13.286 5 HA SER 2 HA SER 2 1.513 -8.208 12.752 6 HB2 SER 2 2HB SER 2 1.309 -5.585 11.204 7 HB3 SER 2 3HB SER 2 0.084 -6.853 11.299 8 HG SER 2 HG SER 2 -0.321 -5.085 12.716 9 H VAL 3 H VAL 3 1.778 -9.715 11.125 10 HA VAL 3 HA VAL 3 4.087 -9.886 9.541 11 HB VAL 3 HB VAL 3 2.622 -11.813 10.268 12 HG11 VAL 3 1HG1 VAL 3 0.833 -11.038 7.935 13 HG12 VAL 3 2HG1 VAL 3 0.422 -10.898 9.646 14 HG13 VAL 3 3HG1 VAL 3 0.685 -12.490 8.934 15 HG21 VAL 3 1HG2 VAL 3 4.412 -12.176 8.612 16 HG22 VAL 3 2HG2 VAL 3 3.290 -11.814 7.300 17 HG23 VAL 3 3HG2 VAL 3 3.036 -13.239 8.310 18 H VAL 4 H VAL 4 1.282 -8.102 8.988 19 HA VAL 4 HA VAL 4 1.147 -7.927 6.165 20 HB VAL 4 HB VAL 4 0.399 -5.744 8.169 21 HG11 VAL 4 1HG1 VAL 4 0.341 -5.067 5.810 22 HG12 VAL 4 2HG1 VAL 4 -1.282 -5.110 6.493 23 HG13 VAL 4 3HG1 VAL 4 -0.738 -6.413 5.436 24 HG21 VAL 4 1HG2 VAL 4 -1.850 -6.755 8.342 25 HG22 VAL 4 2HG2 VAL 4 -0.605 -7.846 8.954 26 HG23 VAL 4 3HG2 VAL 4 -1.312 -8.125 7.363 27 H LYS 5 H LYS 5 2.813 -6.041 8.689 28 HA LYS 5 HA LYS 5 3.509 -3.828 7.134 29 HB2 LYS 5 2HB LYS 5 3.510 -3.875 9.659 30 HB3 LYS 5 3HB LYS 5 5.040 -4.749 9.602 31 HG2 LYS 5 2HG LYS 5 6.099 -2.842 8.427 32 HG3 LYS 5 3HG LYS 5 4.561 -1.974 8.445 33 HD2 LYS 5 2HD LYS 5 4.633 -1.935 10.944 34 HD3 LYS 5 3HD LYS 5 6.197 -2.760 10.896 35 HE2 LYS 5 2HE LYS 5 7.165 -0.856 9.655 36 HE3 LYS 5 3HE LYS 5 5.603 -0.041 9.678 37 HZ1 LYS 5 1HZ LYS 5 5.735 0.133 12.055 38 HZ2 LYS 5 2HZ LYS 5 7.129 0.790 11.370 39 HZ3 LYS 5 3HZ LYS 5 7.184 -0.735 12.090 40 H GLU 6 H GLU 6 5.352 -6.865 7.590 41 HA GLU 6 HA GLU 6 7.797 -5.939 6.462 42 HB2 GLU 6 2HB GLU 6 8.419 -8.323 6.286 43 HB3 GLU 6 3HB GLU 6 7.710 -7.981 7.858 44 HG2 GLU 6 2HG GLU 6 5.634 -9.041 7.244 45 HG3 GLU 6 3HG GLU 6 6.142 -9.193 5.568 46 H LYS 7 H LYS 7 4.903 -7.421 5.194 47 HA LYS 7 HA LYS 7 5.827 -7.833 2.510 48 HB2 LYS 7 2HB LYS 7 2.980 -7.711 3.606 49 HB3 LYS 7 3HB LYS 7 3.450 -8.355 2.030 50 HG2 LYS 7 2HG LYS 7 4.740 -10.139 3.096 51 HG3 LYS 7 3HG LYS 7 4.396 -9.467 4.693 52 HD2 LYS 7 2HD LYS 7 1.972 -9.919 4.335 53 HD3 LYS 7 3HD LYS 7 2.353 -10.641 2.766 54 HE2 LYS 7 2HE LYS 7 3.301 -11.642 5.475 55 HE3 LYS 7 3HE LYS 7 2.055 -12.382 4.468 56 HZ1 LYS 7 1HZ LYS 7 3.775 -12.737 2.756 57 HZ2 LYS 7 2HZ LYS 7 4.107 -13.556 4.197 58 HZ3 LYS 7 3HZ LYS 7 4.940 -12.137 3.820 59 H LEU 8 H LEU 8 4.120 -5.261 4.201 60 HA LEU 8 HA LEU 8 3.549 -3.585 1.978 61 HB2 LEU 8 2HB LEU 8 3.957 -2.967 4.927 62 HB3 LEU 8 3HB LEU 8 3.429 -1.771 3.757 63 HG LEU 8 HG LEU 8 1.866 -4.280 4.490 64 HD11 LEU 8 1HD1 LEU 8 0.345 -2.765 5.682 65 HD12 LEU 8 2HD1 LEU 8 1.403 -1.397 5.321 66 HD13 LEU 8 3HD1 LEU 8 1.971 -2.704 6.364 67 HD21 LEU 8 1HD2 LEU 8 0.021 -3.243 3.237 68 HD22 LEU 8 2HD2 LEU 8 1.410 -3.542 2.196 69 HD23 LEU 8 3HD2 LEU 8 1.075 -1.905 2.769 70 H GLU 9 H GLU 9 6.381 -4.051 4.052 71 HA GLU 9 HA GLU 9 7.862 -1.785 3.084 72 HB2 GLU 9 2HB GLU 9 8.748 -4.233 4.672 73 HB3 GLU 9 3HB GLU 9 9.809 -2.886 4.274 74 HG2 GLU 9 2HG GLU 9 7.328 -2.764 5.998 75 HG3 GLU 9 3HG GLU 9 8.988 -2.702 6.564 76 H LYS 10 H LYS 10 7.793 -5.280 2.326 77 HA LYS 10 HA LYS 10 9.905 -5.344 0.465 78 HB2 LYS 10 2HB LYS 10 7.366 -7.019 0.653 79 HB3 LYS 10 3HB LYS 10 8.649 -7.357 -0.502 80 HG2 LYS 10 2HG LYS 10 8.964 -7.388 2.515 81 HG3 LYS 10 3HG LYS 10 8.739 -8.812 1.497 82 HD2 LYS 10 2HD LYS 10 10.873 -8.329 0.335 83 HD3 LYS 10 3HD LYS 10 11.097 -6.885 1.330 84 HE2 LYS 10 2HE LYS 10 11.269 -8.263 3.344 85 HE3 LYS 10 3HE LYS 10 10.934 -9.722 2.409 86 HZ1 LYS 10 1HZ LYS 10 13.289 -9.484 2.835 87 HZ2 LYS 10 2HZ LYS 10 13.310 -7.969 2.092 88 HZ3 LYS 10 3HZ LYS 10 12.986 -9.351 1.179 89 H ALA 11 H ALA 11 6.429 -4.740 0.140 90 HA ALA 11 HA ALA 11 6.309 -4.377 -2.649 91 HB1 ALA 11 1HB ALA 11 4.115 -3.364 -2.206 92 HB2 ALA 11 2HB ALA 11 4.490 -3.271 -0.482 93 HB3 ALA 11 3HB ALA 11 4.328 -4.844 -1.271 94 H LEU 12 H LEU 12 6.660 -2.050 0.061 95 HA LEU 12 HA LEU 12 6.701 0.346 -1.301 96 HB2 LEU 12 2HB LEU 12 7.997 -0.574 1.254 97 HB3 LEU 12 3HB LEU 12 8.508 0.971 0.610 98 HG LEU 12 HG LEU 12 5.665 0.257 1.447 99 HD11 LEU 12 1HD1 LEU 12 7.197 0.523 3.348 100 HD12 LEU 12 2HD1 LEU 12 6.037 1.846 3.278 101 HD13 LEU 12 3HD1 LEU 12 7.700 2.104 2.742 102 HD21 LEU 12 1HD2 LEU 12 5.649 1.851 -0.435 103 HD22 LEU 12 2HD2 LEU 12 6.757 2.913 0.440 104 HD23 LEU 12 3HD2 LEU 12 5.130 2.625 1.061 105 H ILE 13 H ILE 13 9.498 -1.845 -0.717 106 HA ILE 13 HA ILE 13 11.463 -0.242 -1.994 107 HB ILE 13 HB ILE 13 11.446 -3.266 -1.516 108 HG12 ILE 13 2HG1 ILE 13 12.724 -1.054 0.164 109 HG13 ILE 13 3HG1 ILE 13 11.217 -1.864 0.565 110 HG21 ILE 13 1HG2 ILE 13 13.795 -1.441 -2.161 111 HG22 ILE 13 2HG2 ILE 13 13.107 -2.665 -3.231 112 HG23 ILE 13 3HG2 ILE 13 13.912 -3.151 -1.738 113 HD11 ILE 13 1HD1 ILE 13 13.940 -3.152 0.420 114 HD12 ILE 13 2HD1 ILE 13 12.427 -3.984 0.792 115 HD13 ILE 13 3HD1 ILE 13 13.038 -2.734 1.877 116 H GLU 14 H GLU 14 9.531 -3.034 -3.148 117 HA GLU 14 HA GLU 14 10.736 -3.300 -5.673 118 HB2 GLU 14 2HB GLU 14 7.919 -4.072 -4.800 119 HB3 GLU 14 3HB GLU 14 8.678 -4.591 -6.304 120 HG2 GLU 14 2HG GLU 14 9.500 -5.316 -3.487 121 HG3 GLU 14 3HG GLU 14 8.836 -6.382 -4.715 122 H VAL 15 H VAL 15 8.005 -1.310 -4.597 123 HA VAL 15 HA VAL 15 7.476 -0.414 -7.346 124 HB VAL 15 HB VAL 15 5.374 0.429 -6.573 125 HG11 VAL 15 1HG1 VAL 15 5.443 -2.013 -6.860 126 HG12 VAL 15 2HG1 VAL 15 4.286 -1.569 -5.609 127 HG13 VAL 15 3HG1 VAL 15 5.861 -2.225 -5.157 128 HG21 VAL 15 1HG2 VAL 15 6.307 0.001 -3.708 129 HG22 VAL 15 2HG2 VAL 15 4.666 0.456 -4.173 130 HG23 VAL 15 3HG2 VAL 15 6.011 1.546 -4.505 131 H ARG 16 H ARG 16 9.382 0.473 -4.746 132 HA ARG 16 HA ARG 16 9.189 3.223 -4.477 133 HB2 ARG 16 2HB ARG 16 10.679 1.810 -3.109 134 HB3 ARG 16 3HB ARG 16 11.760 1.596 -4.477 135 HG2 ARG 16 2HG ARG 16 12.340 3.987 -4.429 136 HG3 ARG 16 3HG ARG 16 11.184 4.255 -3.119 137 HD2 ARG 16 2HD ARG 16 12.495 2.752 -1.654 138 HD3 ARG 16 3HD ARG 16 13.655 2.488 -2.961 139 HE ARG 16 HE ARG 16 13.462 5.251 -2.495 140 HH11 ARG 16 1HH1 ARG 16 14.664 2.383 -0.827 141 HH12 ARG 16 2HH1 ARG 16 15.870 3.255 0.062 142 HH21 ARG 16 1HH2 ARG 16 15.091 6.374 -1.362 143 HH22 ARG 16 2HH2 ARG 16 16.112 5.521 -0.243 144 HA PRO 17 HA PRO 17 11.947 4.069 -8.438 145 HB2 PRO 17 2HB PRO 17 11.574 1.707 -10.201 146 HB3 PRO 17 3HB PRO 17 13.076 2.527 -9.729 147 HG2 PRO 17 2HG PRO 17 12.412 0.056 -8.827 148 HG3 PRO 17 3HG PRO 17 13.396 1.194 -7.878 149 HD2 PRO 17 2HD PRO 17 10.486 0.497 -7.591 150 HD3 PRO 17 3HD PRO 17 11.712 0.813 -6.340 151 H TYR 18 H TYR 18 8.932 2.381 -8.387 152 HA TYR 18 HA TYR 18 7.985 3.414 -10.964 153 HB2 TYR 18 2HB TYR 18 6.799 1.385 -9.014 154 HB3 TYR 18 3HB TYR 18 6.037 1.855 -10.532 155 HD1 TYR 18 HD1 TYR 18 8.950 0.088 -9.042 156 HD2 TYR 18 HD2 TYR 18 6.838 0.958 -12.657 157 HE1 TYR 18 HE1 TYR 18 10.263 -1.626 -10.216 158 HE2 TYR 18 HE2 TYR 18 8.150 -0.758 -13.832 159 HH TYR 18 HH TYR 18 10.057 -3.058 -12.245 160 H VAL 19 H VAL 19 7.503 3.961 -7.528 161 HA VAL 19 HA VAL 19 5.044 5.518 -8.050 162 HB VAL 19 HB VAL 19 4.520 5.426 -5.671 163 HG11 VAL 19 1HG1 VAL 19 4.012 3.028 -5.443 164 HG12 VAL 19 2HG1 VAL 19 5.142 2.656 -6.749 165 HG13 VAL 19 3HG1 VAL 19 3.694 3.610 -7.079 166 HG21 VAL 19 1HG2 VAL 19 6.743 5.429 -4.655 167 HG22 VAL 19 2HG2 VAL 19 7.065 3.807 -5.265 168 HG23 VAL 19 3HG2 VAL 19 5.812 4.057 -4.044 169 H GLU 20 H GLU 20 4.956 7.605 -7.721 170 HA GLU 20 HA GLU 20 7.193 9.112 -6.512 171 HB2 GLU 20 2HB GLU 20 6.032 11.123 -7.376 172 HB3 GLU 20 3HB GLU 20 6.416 9.981 -8.660 173 HG2 GLU 20 2HG GLU 20 4.081 9.200 -8.693 174 HG3 GLU 20 3HG GLU 20 3.687 10.312 -7.379 175 H TYR 21 H TYR 21 6.493 10.883 -4.949 176 HA TYR 21 HA TYR 21 5.721 11.400 -2.875 177 HB2 TYR 21 2HB TYR 21 3.154 10.385 -4.153 178 HB3 TYR 21 3HB TYR 21 3.169 10.979 -2.500 179 HD1 TYR 21 HD1 TYR 21 3.698 13.375 -2.033 180 HD2 TYR 21 HD2 TYR 21 3.257 11.946 -6.038 181 HE1 TYR 21 HE1 TYR 21 3.411 15.681 -2.821 182 HE2 TYR 21 HE2 TYR 21 2.962 14.251 -6.830 183 HH TYR 21 HH TYR 21 2.191 16.452 -5.845 184 H TYR 22 H TYR 22 7.194 9.245 -3.015 185 HA TYR 22 HA TYR 22 6.320 6.808 -1.990 186 HB2 TYR 22 2HB TYR 22 8.583 7.145 -2.963 187 HB3 TYR 22 3HB TYR 22 9.047 8.119 -1.569 188 HD1 TYR 22 HD1 TYR 22 8.164 4.663 -2.672 189 HD2 TYR 22 HD2 TYR 22 9.723 7.046 0.519 190 HE1 TYR 22 HE1 TYR 22 8.837 2.629 -1.473 191 HE2 TYR 22 HE2 TYR 22 10.389 5.012 1.708 192 HH TYR 22 HH TYR 22 9.664 2.578 1.757 193 H ASN 23 H ASN 23 7.206 9.799 -0.290 194 HA ASN 23 HA ASN 23 7.280 8.845 2.359 195 HB2 ASN 23 2HB ASN 23 6.427 11.621 1.418 196 HB3 ASN 23 3HB ASN 23 6.961 11.204 3.045 197 HD21 ASN 23 1HD2 ASN 23 8.033 13.166 1.174 198 HD22 ASN 23 2HD2 ASN 23 9.692 12.751 0.925 199 H GLU 24 H GLU 24 4.581 9.806 0.328 200 HA GLU 24 HA GLU 24 2.622 10.064 2.404 201 HB2 GLU 24 2HB GLU 24 2.164 9.650 -0.582 202 HB3 GLU 24 3HB GLU 24 1.017 10.311 0.578 203 HG2 GLU 24 2HG GLU 24 3.643 11.615 -0.186 204 HG3 GLU 24 3HG GLU 24 2.088 12.020 -0.900 205 H LEU 25 H LEU 25 3.280 7.607 -0.138 206 HA LEU 25 HA LEU 25 1.362 5.698 0.671 207 HB2 LEU 25 2HB LEU 25 2.455 5.816 -1.578 208 HB3 LEU 25 3HB LEU 25 3.972 5.305 -0.860 209 HG LEU 25 HG LEU 25 2.970 3.088 -0.313 210 HD11 LEU 25 1HD1 LEU 25 0.631 3.713 -0.016 211 HD12 LEU 25 2HD1 LEU 25 0.784 2.428 -1.211 212 HD13 LEU 25 3HD1 LEU 25 0.484 4.087 -1.736 213 HD21 LEU 25 1HD2 LEU 25 2.853 2.214 -2.603 214 HD22 LEU 25 2HD2 LEU 25 4.172 3.368 -2.433 215 HD23 LEU 25 3HD2 LEU 25 2.677 3.853 -3.238 216 H LYS 26 H LYS 26 4.784 6.101 1.436 217 HA LYS 26 HA LYS 26 5.332 4.018 3.186 218 HB2 LYS 26 2HB LYS 26 7.058 5.562 2.463 219 HB3 LYS 26 3HB LYS 26 6.230 6.923 3.201 220 HG2 LYS 26 2HG LYS 26 6.703 5.900 5.455 221 HG3 LYS 26 3HG LYS 26 7.675 4.672 4.632 222 HD2 LYS 26 2HD LYS 26 9.173 6.409 3.748 223 HD3 LYS 26 3HD LYS 26 8.168 7.673 4.467 224 HE2 LYS 26 2HE LYS 26 10.198 7.243 5.803 225 HE3 LYS 26 3HE LYS 26 8.736 6.879 6.717 226 HZ1 LYS 26 1HZ LYS 26 10.403 4.853 5.333 227 HZ2 LYS 26 2HZ LYS 26 9.074 4.552 6.327 228 HZ3 LYS 26 3HZ LYS 26 10.487 5.202 6.980 229 H ALA 27 H ALA 27 3.625 7.099 3.858 230 HA ALA 27 HA ALA 27 3.423 6.687 6.701 231 HB1 ALA 27 1HB ALA 27 3.567 8.945 5.729 232 HB2 ALA 27 2HB ALA 27 2.081 8.754 6.664 233 HB3 ALA 27 3HB ALA 27 2.031 8.700 4.899 234 H LEU 28 H LEU 28 1.414 6.096 3.877 235 HA LEU 28 HA LEU 28 -1.038 5.530 5.215 236 HB2 LEU 28 2HB LEU 28 -0.846 6.230 2.825 237 HB3 LEU 28 3HB LEU 28 -0.037 4.717 2.455 238 HG LEU 28 HG LEU 28 -2.125 3.468 3.012 239 HD11 LEU 28 1HD1 LEU 28 -3.396 6.195 3.409 240 HD12 LEU 28 2HD1 LEU 28 -3.090 4.992 4.665 241 HD13 LEU 28 3HD1 LEU 28 -4.237 4.642 3.377 242 HD21 LEU 28 1HD2 LEU 28 -1.683 4.153 0.693 243 HD22 LEU 28 2HD2 LEU 28 -2.551 5.667 0.963 244 HD23 LEU 28 3HD2 LEU 28 -3.410 4.127 1.044 245 H VAL 29 H VAL 29 1.693 3.645 4.061 246 HA VAL 29 HA VAL 29 0.857 1.019 4.691 247 HB VAL 29 HB VAL 29 3.457 2.404 4.043 248 HG11 VAL 29 1HG1 VAL 29 4.814 0.354 4.362 249 HG12 VAL 29 2HG1 VAL 29 3.453 -0.385 5.206 250 HG13 VAL 29 3HG1 VAL 29 4.237 1.043 5.888 251 HG21 VAL 29 1HG2 VAL 29 3.581 0.717 2.246 252 HG22 VAL 29 2HG2 VAL 29 2.033 1.566 2.227 253 HG23 VAL 29 3HG2 VAL 29 2.132 -0.067 2.889 254 H SER 30 H SER 30 2.615 3.500 6.488 255 HA SER 30 HA SER 30 3.201 1.993 8.817 256 HB2 SER 30 2HB SER 30 4.386 4.071 8.233 257 HB3 SER 30 3HB SER 30 2.908 5.008 8.454 258 HG SER 30 HG SER 30 3.494 5.169 10.460 259 H LYS 31 H LYS 31 0.433 3.925 7.840 260 HA LYS 31 HA LYS 31 -0.888 4.064 10.357 261 HB2 LYS 31 2HB LYS 31 -1.222 5.729 8.562 262 HB3 LYS 31 3HB LYS 31 -1.911 4.491 7.518 263 HG2 LYS 31 2HG LYS 31 -3.805 4.227 9.110 264 HG3 LYS 31 3HG LYS 31 -3.116 5.511 10.114 265 HD2 LYS 31 2HD LYS 31 -3.357 7.112 8.247 266 HD3 LYS 31 3HD LYS 31 -4.009 5.832 7.220 267 HE2 LYS 31 2HE LYS 31 -5.302 6.833 9.780 268 HE3 LYS 31 3HE LYS 31 -5.767 7.317 8.150 269 HZ1 LYS 31 1HZ LYS 31 -5.841 4.520 9.126 270 HZ2 LYS 31 2HZ LYS 31 -6.451 5.101 7.666 271 HZ3 LYS 31 3HZ LYS 31 -7.173 5.558 9.125 272 H ILE 32 H ILE 32 -1.407 2.086 7.409 273 HA ILE 32 HA ILE 32 -3.701 0.741 8.451 274 HB ILE 32 HB ILE 32 -3.603 -0.717 6.453 275 HG12 ILE 32 2HG1 ILE 32 -0.972 0.696 5.810 276 HG13 ILE 32 3HG1 ILE 32 -1.145 -0.990 6.272 277 HG21 ILE 32 1HG2 ILE 32 -3.914 1.026 4.728 278 HG22 ILE 32 2HG2 ILE 32 -3.125 2.212 5.769 279 HG23 ILE 32 3HG2 ILE 32 -4.665 1.500 6.254 280 HD11 ILE 32 1HD1 ILE 32 -2.218 0.248 3.740 281 HD12 ILE 32 2HD1 ILE 32 -2.352 -1.450 4.210 282 HD13 ILE 32 3HD1 ILE 32 -0.766 -0.740 3.896 283 H SER 33 H SER 33 -0.246 -0.187 8.223 284 HA SER 33 HA SER 33 -0.397 -2.890 8.859 285 HB2 SER 33 2HB SER 33 1.966 -2.647 9.635 286 HB3 SER 33 3HB SER 33 1.666 -1.836 8.102 287 HG SER 33 HG SER 33 2.213 -0.028 8.998 288 H SER 34 H SER 34 -0.593 -0.133 11.026 289 HA SER 34 HA SER 34 -0.362 -1.752 13.456 290 HB2 SER 34 2HB SER 34 -0.491 0.517 14.577 291 HB3 SER 34 3HB SER 34 0.849 0.345 13.446 292 HG SER 34 HG SER 34 -0.103 1.692 12.061 293 H SER 35 H SER 35 -2.780 -1.307 11.378 294 HA SER 35 HA SER 35 -4.929 -1.138 13.413 295 HB2 SER 35 2HB SER 35 -4.936 -0.016 10.568 296 HB3 SER 35 3HB SER 35 -6.289 0.042 11.707 297 HG SER 35 HG SER 35 -4.474 1.081 13.097 298 H VAL 36 H VAL 36 -3.749 -2.697 10.476 299 HA VAL 36 HA VAL 36 -6.140 -4.387 10.241 300 HB VAL 36 HB VAL 36 -5.241 -5.167 8.105 301 HG11 VAL 36 1HG1 VAL 36 -6.521 -3.070 8.079 302 HG12 VAL 36 2HG1 VAL 36 -5.295 -3.066 6.813 303 HG13 VAL 36 3HG1 VAL 36 -5.037 -2.136 8.294 304 HG21 VAL 36 1HG2 VAL 36 -2.775 -3.481 8.653 305 HG22 VAL 36 2HG2 VAL 36 -3.137 -4.285 7.121 306 HG23 VAL 36 3HG2 VAL 36 -2.848 -5.240 8.577 307 H ASN 37 H ASN 37 -6.180 -6.468 10.890 308 HA ASN 37 HA ASN 37 -3.940 -7.568 12.367 309 HB2 ASN 37 2HB ASN 37 -5.442 -9.389 13.006 310 HB3 ASN 37 3HB ASN 37 -6.255 -7.846 13.223 311 HD21 ASN 37 1HD2 ASN 37 -8.076 -7.398 11.976 312 HD22 ASN 37 2HD2 ASN 37 -8.842 -8.561 10.962 313 H ASP 38 H ASP 38 -5.133 -7.831 9.142 314 HA ASP 38 HA ASP 38 -3.448 -10.191 8.586 315 HB2 ASP 38 2HB ASP 38 -5.951 -10.753 9.047 316 HB3 ASP 38 3HB ASP 38 -6.296 -9.950 7.520 317 H LEU 39 H LEU 39 -2.883 -10.420 6.328 318 HA LEU 39 HA LEU 39 -2.250 -8.006 4.993 319 HB2 LEU 39 2HB LEU 39 -0.971 -10.191 4.932 320 HB3 LEU 39 3HB LEU 39 -2.220 -10.861 3.915 321 HG LEU 39 HG LEU 39 -0.041 -10.173 2.773 322 HD11 LEU 39 1HD1 LEU 39 -2.527 -8.946 1.607 323 HD12 LEU 39 2HD1 LEU 39 -2.024 -10.631 1.464 324 HD13 LEU 39 3HD1 LEU 39 -1.044 -9.359 0.739 325 HD21 LEU 39 1HD2 LEU 39 0.350 -8.047 3.934 326 HD22 LEU 39 2HD2 LEU 39 -1.069 -7.344 3.150 327 HD23 LEU 39 3HD2 LEU 39 0.326 -7.835 2.184 328 H GLU 40 H GLU 40 -4.876 -10.334 4.657 329 HA GLU 40 HA GLU 40 -6.118 -9.390 2.304 330 HB2 GLU 40 2HB GLU 40 -6.642 -11.568 3.428 331 HB3 GLU 40 3HB GLU 40 -7.407 -10.693 4.747 332 HG2 GLU 40 2HG GLU 40 -9.094 -9.804 3.127 333 HG3 GLU 40 3HG GLU 40 -8.347 -10.774 1.858 334 H GLU 41 H GLU 41 -6.313 -8.368 5.695 335 HA GLU 41 HA GLU 41 -8.490 -6.537 5.419 336 HB2 GLU 41 2HB GLU 41 -6.285 -6.679 7.519 337 HB3 GLU 41 3HB GLU 41 -7.695 -5.635 7.633 338 HG2 GLU 41 2HG GLU 41 -7.729 -8.665 7.601 339 HG3 GLU 41 3HG GLU 41 -7.914 -7.646 9.025 340 H ALA 42 H ALA 42 -5.044 -6.382 4.927 341 HA ALA 42 HA ALA 42 -4.792 -3.524 4.739 342 HB1 ALA 42 1HB ALA 42 -2.553 -3.979 3.823 343 HB2 ALA 42 2HB ALA 42 -2.940 -5.702 3.719 344 HB3 ALA 42 3HB ALA 42 -2.851 -4.908 5.292 345 H ILE 43 H ILE 43 -5.181 -6.197 2.444 346 HA ILE 43 HA ILE 43 -4.947 -4.712 0.073 347 HB ILE 43 HB ILE 43 -6.422 -7.318 0.639 348 HG12 ILE 43 2HG1 ILE 43 -3.732 -6.739 -0.695 349 HG13 ILE 43 3HG1 ILE 43 -3.956 -7.392 0.921 350 HG21 ILE 43 1HG2 ILE 43 -6.522 -7.702 -1.797 351 HG22 ILE 43 2HG2 ILE 43 -5.875 -6.088 -2.085 352 HG23 ILE 43 3HG2 ILE 43 -7.461 -6.280 -1.335 353 HD11 ILE 43 1HD1 ILE 43 -4.601 -8.754 -1.689 354 HD12 ILE 43 2HD1 ILE 43 -5.002 -9.402 -0.096 355 HD13 ILE 43 3HD1 ILE 43 -3.316 -9.150 -0.545 356 H VAL 44 H VAL 44 -8.087 -5.989 1.335 357 HA VAL 44 HA VAL 44 -9.944 -4.457 0.184 358 HB VAL 44 HB VAL 44 -9.867 -5.153 3.154 359 HG11 VAL 44 1HG1 VAL 44 -12.336 -5.109 3.098 360 HG12 VAL 44 2HG1 VAL 44 -12.293 -4.519 1.435 361 HG13 VAL 44 3HG1 VAL 44 -11.651 -3.521 2.740 362 HG21 VAL 44 1HG2 VAL 44 -11.098 -7.204 2.525 363 HG22 VAL 44 2HG2 VAL 44 -9.532 -7.128 1.717 364 HG23 VAL 44 3HG2 VAL 44 -11.004 -6.748 0.819 365 H VAL 45 H VAL 45 -8.270 -3.294 3.216 366 HA VAL 45 HA VAL 45 -9.597 -0.815 3.294 367 HB VAL 45 HB VAL 45 -8.227 -1.785 5.212 368 HG11 VAL 45 1HG1 VAL 45 -6.113 -2.200 4.052 369 HG12 VAL 45 2HG1 VAL 45 -5.871 -1.154 5.450 370 HG13 VAL 45 3HG1 VAL 45 -5.879 -0.469 3.822 371 HG21 VAL 45 1HG2 VAL 45 -7.803 1.154 4.584 372 HG22 VAL 45 2HG2 VAL 45 -7.681 0.415 6.185 373 HG23 VAL 45 3HG2 VAL 45 -9.233 0.451 5.342 374 H LEU 46 H LEU 46 -6.601 -1.710 1.558 375 HA LEU 46 HA LEU 46 -5.971 0.965 0.696 376 HB2 LEU 46 2HB LEU 46 -4.996 -1.762 -0.191 377 HB3 LEU 46 3HB LEU 46 -4.477 -0.303 -1.019 378 HG LEU 46 HG LEU 46 -3.981 -0.921 1.923 379 HD11 LEU 46 1HD1 LEU 46 -2.037 -0.957 -0.408 380 HD12 LEU 46 2HD1 LEU 46 -2.665 -2.370 0.447 381 HD13 LEU 46 3HD1 LEU 46 -1.635 -1.218 1.293 382 HD21 LEU 46 1HD2 LEU 46 -2.518 1.062 1.896 383 HD22 LEU 46 2HD2 LEU 46 -4.194 1.487 1.561 384 HD23 LEU 46 3HD2 LEU 46 -3.020 1.420 0.242 385 H ARG 47 H ARG 47 -8.031 -1.588 -0.574 386 HA ARG 47 HA ARG 47 -8.513 -0.502 -3.143 387 HB2 ARG 47 2HB ARG 47 -10.360 -2.172 -1.374 388 HB3 ARG 47 3HB ARG 47 -10.656 -1.813 -3.075 389 HG2 ARG 47 2HG ARG 47 -8.617 -3.022 -3.707 390 HG3 ARG 47 3HG ARG 47 -8.279 -3.365 -2.009 391 HD2 ARG 47 2HD ARG 47 -10.326 -4.699 -1.843 392 HD3 ARG 47 3HD ARG 47 -10.747 -4.302 -3.514 393 HE ARG 47 HE ARG 47 -8.263 -5.440 -3.683 394 HH11 ARG 47 1HH1 ARG 47 -11.362 -6.525 -2.397 395 HH12 ARG 47 2HH1 ARG 47 -11.042 -8.200 -2.734 396 HH21 ARG 47 1HH2 ARG 47 -7.876 -7.633 -4.091 397 HH22 ARG 47 2HH2 ARG 47 -9.066 -8.815 -3.690 398 H GLU 48 H GLU 48 -9.576 0.413 0.010 399 HA GLU 48 HA GLU 48 -11.719 2.184 -0.881 400 HB2 GLU 48 2HB GLU 48 -10.491 1.800 1.889 401 HB3 GLU 48 3HB GLU 48 -11.962 2.705 1.533 402 HG2 GLU 48 2HG GLU 48 -13.086 0.639 0.812 403 HG3 GLU 48 3HG GLU 48 -11.605 -0.279 1.079 404 H GLU 49 H GLU 49 -8.429 2.343 0.445 405 HA GLU 49 HA GLU 49 -8.322 5.168 0.749 406 HB2 GLU 49 2HB GLU 49 -5.992 3.216 0.472 407 HB3 GLU 49 3HB GLU 49 -5.875 4.880 1.037 408 HG2 GLU 49 2HG GLU 49 -7.129 2.516 2.418 409 HG3 GLU 49 3HG GLU 49 -5.829 3.553 2.989 410 H GLU 50 H GLU 50 -7.120 3.044 -1.793 411 HA GLU 50 HA GLU 50 -6.015 4.727 -3.647 412 HB2 GLU 50 2HB GLU 50 -6.139 2.303 -3.901 413 HB3 GLU 50 3HB GLU 50 -7.892 2.368 -4.045 414 HG2 GLU 50 2HG GLU 50 -7.350 3.878 -6.161 415 HG3 GLU 50 3HG GLU 50 -5.780 3.080 -6.066 416 H LYS 51 H LYS 51 -9.487 3.871 -3.471 417 HA LYS 51 HA LYS 51 -10.299 5.674 -5.520 418 HB2 LYS 51 2HB LYS 51 -11.856 3.965 -3.546 419 HB3 LYS 51 3HB LYS 51 -12.617 4.884 -4.844 420 HG2 LYS 51 2HG LYS 51 -11.554 3.548 -6.545 421 HG3 LYS 51 3HG LYS 51 -10.470 2.792 -5.375 422 HD2 LYS 51 2HD LYS 51 -12.212 1.206 -6.008 423 HD3 LYS 51 3HD LYS 51 -12.422 1.661 -4.320 424 HE2 LYS 51 2HE LYS 51 -14.193 3.308 -5.106 425 HE3 LYS 51 3HE LYS 51 -14.064 2.567 -6.701 426 HZ1 LYS 51 1HZ LYS 51 -15.881 1.631 -5.384 427 HZ2 LYS 51 2HZ LYS 51 -14.789 1.111 -4.204 428 HZ3 LYS 51 3HZ LYS 51 -14.729 0.456 -5.762 429 H LYS 52 H LYS 52 -10.018 5.988 -2.032 430 HA LYS 52 HA LYS 52 -11.571 8.415 -1.781 431 HB2 LYS 52 2HB LYS 52 -9.400 7.187 -0.011 432 HB3 LYS 52 3HB LYS 52 -10.252 8.670 0.408 433 HG2 LYS 52 2HG LYS 52 -12.353 7.493 0.617 434 HG3 LYS 52 3HG LYS 52 -11.642 6.008 -0.025 435 HD2 LYS 52 2HD LYS 52 -10.108 5.936 1.970 436 HD3 LYS 52 3HD LYS 52 -10.946 7.346 2.626 437 HE2 LYS 52 2HE LYS 52 -13.037 6.069 2.761 438 HE3 LYS 52 3HE LYS 52 -12.254 4.672 2.014 439 HZ1 LYS 52 1HZ LYS 52 -12.396 4.436 4.410 440 HZ2 LYS 52 2HZ LYS 52 -11.517 5.864 4.639 441 HZ3 LYS 52 3HZ LYS 52 -10.779 4.520 3.921 442 H ALA 53 H ALA 53 -8.277 7.545 -2.583 443 HA ALA 53 HA ALA 53 -7.239 10.250 -2.577 444 HB1 ALA 53 1HB ALA 53 -5.171 9.194 -3.426 445 HB2 ALA 53 2HB ALA 53 -6.015 7.649 -3.591 446 HB3 ALA 53 3HB ALA 53 -5.770 8.360 -1.992 447 H SER 54 H SER 54 -6.100 10.999 -4.569 448 HA SER 54 HA SER 54 -7.670 10.548 -7.050 449 HB2 SER 54 2HB SER 54 -6.506 13.188 -6.041 450 HB3 SER 54 3HB SER 54 -7.418 12.951 -7.533 451 HG SER 54 HG SER 54 -9.154 12.195 -6.109 452 H GLU 55 H GLU 55 -6.348 11.435 -8.977 453 HA GLU 55 HA GLU 55 -3.916 9.988 -9.176 454 HB2 GLU 55 2HB GLU 55 -5.077 12.135 -11.029 455 HB3 GLU 55 3HB GLU 55 -3.729 11.084 -11.441 456 HG2 GLU 55 2HG GLU 55 -5.589 10.144 -12.544 457 HG3 GLU 55 3HG GLU 55 -5.328 9.117 -11.141 458 HA PRO 56 HA PRO 56 -1.918 9.941 -10.145 459 HB2 PRO 56 2HB PRO 56 0.724 9.854 -9.661 460 HB3 PRO 56 3HB PRO 56 0.045 11.056 -10.780 461 HG2 PRO 56 2HG PRO 56 0.874 11.416 -7.919 462 HG3 PRO 56 3HG PRO 56 1.199 12.460 -9.321 463 HD2 PRO 56 2HD PRO 56 -0.862 12.890 -7.499 464 HD3 PRO 56 3HD PRO 56 -0.848 13.520 -9.161 465 H PHE 57 H PHE 57 -1.955 10.626 -6.790 466 HA PHE 57 HA PHE 57 -0.570 8.471 -5.667 467 HB2 PHE 57 2HB PHE 57 -1.455 10.575 -4.503 468 HB3 PHE 57 3HB PHE 57 -3.013 9.760 -4.401 469 HD1 PHE 57 HD1 PHE 57 0.430 8.318 -3.923 470 HD2 PHE 57 HD2 PHE 57 -3.246 9.430 -2.025 471 HE1 PHE 57 HE1 PHE 57 1.196 7.289 -1.829 472 HE2 PHE 57 HE2 PHE 57 -2.463 8.388 0.062 473 HZ PHE 57 HZ PHE 57 -0.252 7.316 0.165 474 H LYS 58 H LYS 58 -3.842 8.557 -6.954 475 HA LYS 58 HA LYS 58 -4.909 6.176 -5.946 476 HB2 LYS 58 2HB LYS 58 -6.252 7.768 -7.218 477 HB3 LYS 58 3HB LYS 58 -5.309 7.464 -8.674 478 HG2 LYS 58 2HG LYS 58 -6.186 5.176 -8.813 479 HG3 LYS 58 3HG LYS 58 -7.046 5.383 -7.286 480 HD2 LYS 58 2HD LYS 58 -7.570 7.013 -9.799 481 HD3 LYS 58 3HD LYS 58 -8.518 5.615 -9.291 482 HE2 LYS 58 2HE LYS 58 -9.340 6.756 -7.349 483 HE3 LYS 58 3HE LYS 58 -8.172 8.068 -7.536 484 HZ1 LYS 58 1HZ LYS 58 -9.283 8.765 -9.532 485 HZ2 LYS 58 2HZ LYS 58 -10.402 8.684 -8.267 486 HZ3 LYS 58 3HZ LYS 58 -10.369 7.475 -9.441 487 H THR 59 H THR 59 -2.535 6.692 -8.457 488 HA THR 59 HA THR 59 -2.546 3.942 -9.401 489 HB THR 59 HB THR 59 -0.775 6.317 -10.157 490 HG1 THR 59 HG1 THR 59 -2.468 6.826 -11.276 491 HG21 THR 59 1HG2 THR 59 -0.140 4.990 -12.155 492 HG22 THR 59 2HG2 THR 59 -1.046 3.609 -11.531 493 HG23 THR 59 3HG2 THR 59 0.381 4.188 -10.671 494 H ASP 60 H ASP 60 -0.482 6.159 -7.588 495 HA ASP 60 HA ASP 60 1.712 4.492 -7.113 496 HB2 ASP 60 2HB ASP 60 0.559 6.664 -5.308 497 HB3 ASP 60 3HB ASP 60 2.160 5.952 -5.117 498 H ILE 61 H ILE 61 -1.419 4.598 -5.498 499 HA ILE 61 HA ILE 61 -0.696 2.876 -3.301 500 HB ILE 61 HB ILE 61 -3.436 3.759 -4.312 501 HG12 ILE 61 2HG1 ILE 61 -1.898 4.557 -1.794 502 HG13 ILE 61 3HG1 ILE 61 -2.010 5.536 -3.250 503 HG21 ILE 61 1HG2 ILE 61 -2.826 2.125 -1.817 504 HG22 ILE 61 2HG2 ILE 61 -3.688 1.550 -3.246 505 HG23 ILE 61 3HG2 ILE 61 -4.402 2.806 -2.230 506 HD11 ILE 61 1HD1 ILE 61 -4.424 5.753 -2.921 507 HD12 ILE 61 2HD1 ILE 61 -3.511 6.335 -1.532 508 HD13 ILE 61 3HD1 ILE 61 -4.316 4.769 -1.458 509 H ARG 62 H ARG 62 -2.562 2.430 -6.398 510 HA ARG 62 HA ARG 62 -2.957 -0.348 -5.864 511 HB2 ARG 62 2HB ARG 62 -3.731 -0.548 -8.237 512 HB3 ARG 62 3HB ARG 62 -4.571 0.649 -7.269 513 HG2 ARG 62 2HG ARG 62 -3.431 2.449 -8.361 514 HG3 ARG 62 3HG ARG 62 -2.361 1.346 -9.212 515 HD2 ARG 62 2HD ARG 62 -4.140 2.197 -10.696 516 HD3 ARG 62 3HD ARG 62 -4.296 0.451 -10.474 517 HE ARG 62 HE ARG 62 -5.910 1.640 -8.555 518 HH11 ARG 62 1HH1 ARG 62 -5.857 1.516 -12.087 519 HH12 ARG 62 2HH1 ARG 62 -7.576 1.706 -12.225 520 HH21 ARG 62 1HH2 ARG 62 -8.152 1.889 -8.784 521 HH22 ARG 62 2HH2 ARG 62 -8.861 1.915 -10.365 522 H ILE 63 H ILE 63 -0.204 1.260 -7.435 523 HA ILE 63 HA ILE 63 0.870 -1.032 -8.710 524 HB ILE 63 HB ILE 63 2.456 1.273 -7.468 525 HG12 ILE 63 2HG1 ILE 63 1.628 0.908 -10.390 526 HG13 ILE 63 3HG1 ILE 63 0.796 1.960 -9.258 527 HG21 ILE 63 1HG2 ILE 63 3.338 -0.750 -9.565 528 HG22 ILE 63 2HG2 ILE 63 3.869 -0.718 -7.885 529 HG23 ILE 63 3HG2 ILE 63 4.297 0.606 -8.966 530 HD11 ILE 63 1HD1 ILE 63 2.278 3.222 -10.697 531 HD12 ILE 63 2HD1 ILE 63 3.662 2.272 -10.156 532 HD13 ILE 63 3HD1 ILE 63 2.813 3.325 -9.020 533 H LEU 64 H LEU 64 1.239 0.183 -5.376 534 HA LEU 64 HA LEU 64 2.878 -1.939 -4.392 535 HB2 LEU 64 2HB LEU 64 2.827 0.244 -3.327 536 HB3 LEU 64 3HB LEU 64 1.116 0.106 -2.992 537 HG LEU 64 HG LEU 64 2.802 -2.026 -1.735 538 HD11 LEU 64 1HD1 LEU 64 3.646 -0.640 0.082 539 HD12 LEU 64 2HD1 LEU 64 3.021 0.812 -0.705 540 HD13 LEU 64 3HD1 LEU 64 4.316 -0.119 -1.464 541 HD21 LEU 64 1HD2 LEU 64 0.627 -0.237 -0.597 542 HD22 LEU 64 2HD2 LEU 64 1.356 -1.626 0.216 543 HD23 LEU 64 3HD2 LEU 64 0.397 -1.863 -1.244 544 H LEU 65 H LEU 65 -0.582 -1.246 -4.177 545 HA LEU 65 HA LEU 65 -1.446 -3.324 -2.559 546 HB2 LEU 65 2HB LEU 65 -2.815 -1.389 -3.004 547 HB3 LEU 65 3HB LEU 65 -2.819 -1.709 -4.728 548 HG LEU 65 HG LEU 65 -4.292 -3.658 -4.404 549 HD11 LEU 65 1HD1 LEU 65 -3.553 -4.439 -2.240 550 HD12 LEU 65 2HD1 LEU 65 -5.291 -4.159 -2.224 551 HD13 LEU 65 3HD1 LEU 65 -4.208 -2.999 -1.453 552 HD21 LEU 65 1HD2 LEU 65 -6.331 -2.475 -3.724 553 HD22 LEU 65 2HD2 LEU 65 -5.335 -1.469 -4.772 554 HD23 LEU 65 3HD2 LEU 65 -5.365 -1.169 -3.031 555 H ASP 66 H ASP 66 -2.035 -3.233 -6.104 556 HA ASP 66 HA ASP 66 -2.670 -5.724 -6.817 557 HB2 ASP 66 2HB ASP 66 -2.370 -3.723 -8.284 558 HB3 ASP 66 3HB ASP 66 -0.629 -3.914 -8.195 559 H PHE 67 H PHE 67 0.778 -4.691 -6.526 560 HA PHE 67 HA PHE 67 2.082 -7.108 -6.888 561 HB2 PHE 67 2HB PHE 67 3.303 -4.988 -6.657 562 HB3 PHE 67 3HB PHE 67 2.836 -4.866 -4.965 563 HD1 PHE 67 HD1 PHE 67 4.851 -6.912 -7.365 564 HD2 PHE 67 HD2 PHE 67 4.171 -5.913 -3.258 565 HE1 PHE 67 HE1 PHE 67 6.862 -8.176 -6.714 566 HE2 PHE 67 HE2 PHE 67 6.182 -7.179 -2.620 567 HZ PHE 67 HZ PHE 67 7.524 -8.310 -4.347 568 H LEU 68 H LEU 68 0.733 -5.891 -3.758 569 HA LEU 68 HA LEU 68 1.488 -8.050 -2.103 570 HB2 LEU 68 2HB LEU 68 -1.006 -6.314 -1.903 571 HB3 LEU 68 3HB LEU 68 -0.448 -7.390 -0.631 572 HG LEU 68 HG LEU 68 1.057 -4.942 -1.641 573 HD11 LEU 68 1HD1 LEU 68 -1.007 -4.361 -0.421 574 HD12 LEU 68 2HD1 LEU 68 0.440 -3.900 0.469 575 HD13 LEU 68 3HD1 LEU 68 -0.471 -5.333 0.954 576 HD21 LEU 68 1HD2 LEU 68 2.590 -6.672 -0.831 577 HD22 LEU 68 2HD2 LEU 68 1.683 -6.803 0.679 578 HD23 LEU 68 3HD2 LEU 68 2.541 -5.309 0.287 579 H GLU 69 H GLU 69 -1.366 -7.558 -4.138 580 HA GLU 69 HA GLU 69 -2.837 -9.842 -3.363 581 HB2 GLU 69 2HB GLU 69 -2.980 -8.224 -5.942 582 HB3 GLU 69 3HB GLU 69 -4.202 -9.366 -5.383 583 HG2 GLU 69 2HG GLU 69 -4.606 -7.963 -3.384 584 HG3 GLU 69 3HG GLU 69 -3.386 -6.820 -3.946 585 H SER 70 H SER 70 -0.174 -9.413 -5.565 586 HA SER 70 HA SER 70 1.230 -10.892 -6.534 587 HB2 SER 70 2HB SER 70 -0.082 -12.876 -4.625 588 HB3 SER 70 3HB SER 70 1.434 -13.148 -5.489 589 HG SER 70 HG SER 70 1.549 -10.787 -4.198 590 H LYS 71 H LYS 71 -1.355 -10.430 -7.680 591 HA LYS 71 HA LYS 71 -2.542 -12.490 -9.090 592 HB2 LYS 71 2HB LYS 71 -2.937 -10.535 -10.845 593 HB3 LYS 71 3HB LYS 71 -3.656 -10.449 -9.248 594 HG2 LYS 71 2HG LYS 71 -2.776 -8.272 -9.873 595 HG3 LYS 71 3HG LYS 71 -1.884 -8.914 -8.497 596 HD2 LYS 71 2HD LYS 71 -0.275 -7.894 -9.932 597 HD3 LYS 71 3HD LYS 71 -0.075 -9.632 -10.140 598 HE2 LYS 71 2HE LYS 71 0.047 -8.574 -12.308 599 HE3 LYS 71 3HE LYS 71 -1.474 -9.466 -12.235 600 HZ1 LYS 71 1HZ LYS 71 -1.100 -6.530 -11.906 601 HZ2 LYS 71 2HZ LYS 71 -2.569 -7.325 -11.659 602 HZ3 LYS 71 3HZ LYS 71 -1.862 -7.322 -13.194 603 HA PRO 72 HA PRO 72 0.305 -13.969 -12.271 604 HB2 PRO 72 2HB PRO 72 -1.861 -13.562 -14.318 605 HB3 PRO 72 3HB PRO 72 -0.971 -15.042 -13.900 606 HG2 PRO 72 2HG PRO 72 -3.498 -14.748 -13.145 607 HG3 PRO 72 3HG PRO 72 -2.314 -15.490 -12.043 608 HD2 PRO 72 2HD PRO 72 -3.410 -12.676 -12.012 609 HD3 PRO 72 3HD PRO 72 -3.127 -13.796 -10.654 Start of MODEL 9 1 H GLY 1 1H GLY 1 2.485 -5.820 17.154 2 HA2 GLY 1 2HA GLY 1 2.572 -4.436 15.183 3 HA3 GLY 1 3HA GLY 1 4.280 -4.826 15.017 4 H SER 2 H SER 2 1.991 -5.351 13.186 5 HA SER 2 HA SER 2 1.451 -8.201 13.270 6 HB2 SER 2 2HB SER 2 0.705 -6.095 11.188 7 HB3 SER 2 3HB SER 2 0.017 -7.718 11.317 8 HG SER 2 HG SER 2 -1.273 -6.083 12.299 9 H VAL 3 H VAL 3 2.112 -9.733 11.711 10 HA VAL 3 HA VAL 3 4.615 -9.550 10.417 11 HB VAL 3 HB VAL 3 3.437 -11.686 11.089 12 HG11 VAL 3 1HG1 VAL 3 1.768 -11.284 8.575 13 HG12 VAL 3 2HG1 VAL 3 1.179 -11.188 10.236 14 HG13 VAL 3 3HG1 VAL 3 1.773 -12.722 9.601 15 HG21 VAL 3 1HG2 VAL 3 5.415 -11.796 9.628 16 HG22 VAL 3 2HG2 VAL 3 4.393 -11.635 8.198 17 HG23 VAL 3 3HG2 VAL 3 4.266 -13.073 9.215 18 H VAL 4 H VAL 4 1.606 -8.327 9.522 19 HA VAL 4 HA VAL 4 1.652 -8.341 6.685 20 HB VAL 4 HB VAL 4 0.296 -6.273 8.483 21 HG11 VAL 4 1HG1 VAL 4 -0.419 -7.283 5.708 22 HG12 VAL 4 2HG1 VAL 4 0.254 -5.702 6.100 23 HG13 VAL 4 3HG1 VAL 4 -1.367 -6.130 6.648 24 HG21 VAL 4 1HG2 VAL 4 -0.268 -8.519 9.317 25 HG22 VAL 4 2HG2 VAL 4 -0.781 -9.008 7.700 26 HG23 VAL 4 3HG2 VAL 4 -1.676 -7.758 8.569 27 H LYS 5 H LYS 5 2.965 -6.264 9.190 28 HA LYS 5 HA LYS 5 3.489 -3.928 7.766 29 HB2 LYS 5 2HB LYS 5 3.643 -4.089 10.243 30 HB3 LYS 5 3HB LYS 5 5.114 -5.048 10.088 31 HG2 LYS 5 2HG LYS 5 6.220 -3.103 8.942 32 HG3 LYS 5 3HG LYS 5 4.749 -2.159 9.192 33 HD2 LYS 5 2HD LYS 5 6.405 -1.589 10.891 34 HD3 LYS 5 3HD LYS 5 5.020 -2.387 11.639 35 HE2 LYS 5 2HE LYS 5 6.299 -4.509 11.734 36 HE3 LYS 5 3HE LYS 5 7.679 -3.709 10.979 37 HZ1 LYS 5 1HZ LYS 5 8.001 -3.802 13.328 38 HZ2 LYS 5 2HZ LYS 5 6.500 -3.089 13.628 39 HZ3 LYS 5 3HZ LYS 5 7.728 -2.191 12.898 40 H GLU 6 H GLU 6 5.408 -6.942 7.978 41 HA GLU 6 HA GLU 6 7.799 -5.924 6.850 42 HB2 GLU 6 2HB GLU 6 8.607 -8.116 6.912 43 HB3 GLU 6 3HB GLU 6 7.306 -8.251 8.084 44 HG2 GLU 6 2HG GLU 6 5.851 -9.156 6.214 45 HG3 GLU 6 3HG GLU 6 7.289 -9.190 5.190 46 H LYS 7 H LYS 7 4.861 -7.320 5.545 47 HA LYS 7 HA LYS 7 5.785 -7.661 2.857 48 HB2 LYS 7 2HB LYS 7 2.902 -7.595 3.857 49 HB3 LYS 7 3HB LYS 7 3.488 -8.328 2.356 50 HG2 LYS 7 2HG LYS 7 4.873 -9.904 3.737 51 HG3 LYS 7 3HG LYS 7 4.128 -9.228 5.189 52 HD2 LYS 7 2HD LYS 7 1.902 -9.990 4.356 53 HD3 LYS 7 3HD LYS 7 2.697 -10.706 2.946 54 HE2 LYS 7 2HE LYS 7 3.072 -11.506 5.854 55 HE3 LYS 7 3HE LYS 7 2.299 -12.454 4.581 56 HZ1 LYS 7 1HZ LYS 7 5.174 -11.796 4.885 57 HZ2 LYS 7 2HZ LYS 7 4.535 -12.364 3.427 58 HZ3 LYS 7 3HZ LYS 7 4.446 -13.322 4.815 59 H LEU 8 H LEU 8 4.161 -5.100 4.594 60 HA LEU 8 HA LEU 8 3.410 -3.545 2.277 61 HB2 LEU 8 2HB LEU 8 3.501 -2.856 5.239 62 HB3 LEU 8 3HB LEU 8 2.815 -1.817 3.997 63 HG LEU 8 HG LEU 8 1.762 -4.590 4.706 64 HD11 LEU 8 1HD1 LEU 8 1.380 -3.041 6.544 65 HD12 LEU 8 2HD1 LEU 8 -0.135 -3.437 5.741 66 HD13 LEU 8 3HD1 LEU 8 0.636 -1.875 5.446 67 HD21 LEU 8 1HD2 LEU 8 0.590 -2.469 2.876 68 HD22 LEU 8 2HD2 LEU 8 -0.170 -4.002 3.316 69 HD23 LEU 8 3HD2 LEU 8 1.316 -3.999 2.373 70 H GLU 9 H GLU 9 6.087 -3.556 4.615 71 HA GLU 9 HA GLU 9 7.273 -1.059 3.790 72 HB2 GLU 9 2HB GLU 9 8.372 -3.366 5.457 73 HB3 GLU 9 3HB GLU 9 9.209 -1.833 5.227 74 HG2 GLU 9 2HG GLU 9 6.430 -1.915 6.423 75 HG3 GLU 9 3HG GLU 9 7.849 -2.247 7.412 76 H LYS 10 H LYS 10 7.740 -4.462 3.126 77 HA LYS 10 HA LYS 10 10.077 -4.341 1.528 78 HB2 LYS 10 2HB LYS 10 9.047 -6.303 2.839 79 HB3 LYS 10 3HB LYS 10 7.887 -6.465 1.540 80 HG2 LYS 10 2HG LYS 10 10.853 -6.651 1.018 81 HG3 LYS 10 3HG LYS 10 9.945 -8.026 1.654 82 HD2 LYS 10 2HD LYS 10 8.371 -7.688 -0.386 83 HD3 LYS 10 3HD LYS 10 9.646 -6.653 -1.038 84 HE2 LYS 10 2HE LYS 10 11.231 -8.562 -0.865 85 HE3 LYS 10 3HE LYS 10 9.907 -9.580 -0.279 86 HZ1 LYS 10 1HZ LYS 10 8.760 -9.201 -2.380 87 HZ2 LYS 10 2HZ LYS 10 10.281 -9.891 -2.630 88 HZ3 LYS 10 3HZ LYS 10 10.045 -8.250 -2.932 89 H ALA 11 H ALA 11 6.580 -4.328 0.900 90 HA ALA 11 HA ALA 11 6.614 -4.512 -1.913 91 HB1 ALA 11 1HB ALA 11 4.567 -4.894 -0.612 92 HB2 ALA 11 2HB ALA 11 4.305 -3.652 -1.837 93 HB3 ALA 11 3HB ALA 11 4.524 -3.193 -0.144 94 H LEU 12 H LEU 12 6.393 -1.673 0.259 95 HA LEU 12 HA LEU 12 6.451 0.484 -1.367 96 HB2 LEU 12 2HB LEU 12 7.982 -0.049 1.187 97 HB3 LEU 12 3HB LEU 12 8.101 1.511 0.394 98 HG LEU 12 HG LEU 12 5.463 0.329 1.349 99 HD11 LEU 12 1HD1 LEU 12 7.247 2.348 2.735 100 HD12 LEU 12 2HD1 LEU 12 6.958 0.685 3.256 101 HD13 LEU 12 3HD1 LEU 12 5.636 1.849 3.255 102 HD21 LEU 12 1HD2 LEU 12 6.197 3.157 0.490 103 HD22 LEU 12 2HD2 LEU 12 4.620 2.624 1.080 104 HD23 LEU 12 3HD2 LEU 12 5.239 2.008 -0.449 105 H ILE 13 H ILE 13 9.361 -1.408 -0.477 106 HA ILE 13 HA ILE 13 11.233 0.187 -1.896 107 HB ILE 13 HB ILE 13 11.489 -2.709 -0.956 108 HG12 ILE 13 2HG1 ILE 13 12.319 -0.128 0.466 109 HG13 ILE 13 3HG1 ILE 13 10.915 -1.105 0.883 110 HG21 ILE 13 1HG2 ILE 13 13.684 -0.718 -1.683 111 HG22 ILE 13 2HG2 ILE 13 13.225 -2.139 -2.624 112 HG23 ILE 13 3HG2 ILE 13 13.940 -2.338 -1.025 113 HD11 ILE 13 1HD1 ILE 13 13.799 -1.969 1.084 114 HD12 ILE 13 2HD1 ILE 13 12.392 -2.964 1.478 115 HD13 ILE 13 3HD1 ILE 13 12.733 -1.509 2.412 116 H GLU 14 H GLU 14 9.520 -2.853 -2.679 117 HA GLU 14 HA GLU 14 10.837 -3.502 -5.083 118 HB2 GLU 14 2HB GLU 14 7.967 -4.149 -4.264 119 HB3 GLU 14 3HB GLU 14 8.872 -4.960 -5.541 120 HG2 GLU 14 2HG GLU 14 9.623 -4.987 -2.605 121 HG3 GLU 14 3HG GLU 14 8.708 -6.251 -3.415 122 H VAL 15 H VAL 15 7.957 -1.526 -4.430 123 HA VAL 15 HA VAL 15 7.583 -0.925 -7.285 124 HB VAL 15 HB VAL 15 5.405 -0.031 -6.688 125 HG11 VAL 15 1HG1 VAL 15 5.851 -2.686 -5.262 126 HG12 VAL 15 2HG1 VAL 15 5.520 -2.471 -6.983 127 HG13 VAL 15 3HG1 VAL 15 4.289 -2.051 -5.793 128 HG21 VAL 15 1HG2 VAL 15 5.954 1.074 -4.559 129 HG22 VAL 15 2HG2 VAL 15 6.142 -0.490 -3.768 130 HG23 VAL 15 3HG2 VAL 15 4.557 0.018 -4.351 131 H ARG 16 H ARG 16 9.332 0.343 -4.756 132 HA ARG 16 HA ARG 16 8.906 3.086 -4.752 133 HB2 ARG 16 2HB ARG 16 10.529 1.970 -3.257 134 HB3 ARG 16 3HB ARG 16 11.626 1.733 -4.616 135 HG2 ARG 16 2HG ARG 16 11.818 4.207 -4.867 136 HG3 ARG 16 3HG ARG 16 10.765 4.410 -3.464 137 HD2 ARG 16 2HD ARG 16 13.083 4.685 -2.794 138 HD3 ARG 16 3HD ARG 16 12.432 3.215 -2.065 139 HE ARG 16 HE ARG 16 13.572 2.098 -4.110 140 HH11 ARG 16 1HH1 ARG 16 14.899 4.847 -2.368 141 HH12 ARG 16 2HH1 ARG 16 16.539 4.433 -2.740 142 HH21 ARG 16 1HH2 ARG 16 15.721 1.552 -4.551 143 HH22 ARG 16 2HH2 ARG 16 17.009 2.563 -3.977 144 HA PRO 17 HA PRO 17 11.781 3.512 -8.871 145 HB2 PRO 17 2HB PRO 17 10.890 0.883 -10.083 146 HB3 PRO 17 3HB PRO 17 12.435 1.749 -10.272 147 HG2 PRO 17 2HG PRO 17 12.326 -0.381 -8.711 148 HG3 PRO 17 3HG PRO 17 13.240 1.053 -8.187 149 HD2 PRO 17 2HD PRO 17 10.519 0.127 -7.302 150 HD3 PRO 17 3HD PRO 17 11.848 0.809 -6.342 151 H TYR 18 H TYR 18 8.609 2.065 -8.532 152 HA TYR 18 HA TYR 18 7.584 3.169 -11.055 153 HB2 TYR 18 2HB TYR 18 6.249 1.350 -8.996 154 HB3 TYR 18 3HB TYR 18 5.571 1.794 -10.557 155 HD1 TYR 18 HD1 TYR 18 8.231 -0.197 -8.881 156 HD2 TYR 18 HD2 TYR 18 6.282 0.656 -12.595 157 HE1 TYR 18 HE1 TYR 18 9.285 -2.172 -9.881 158 HE2 TYR 18 HE2 TYR 18 7.343 -1.321 -13.596 159 HH TYR 18 HH TYR 18 8.903 -3.715 -11.759 160 H VAL 19 H VAL 19 7.250 3.654 -7.540 161 HA VAL 19 HA VAL 19 4.766 5.197 -7.944 162 HB VAL 19 HB VAL 19 4.319 4.987 -5.548 163 HG11 VAL 19 1HG1 VAL 19 5.021 2.306 -6.803 164 HG12 VAL 19 2HG1 VAL 19 3.519 3.208 -7.026 165 HG13 VAL 19 3HG1 VAL 19 3.922 2.552 -5.440 166 HG21 VAL 19 1HG2 VAL 19 6.599 5.025 -4.627 167 HG22 VAL 19 2HG2 VAL 19 6.933 3.436 -5.317 168 HG23 VAL 19 3HG2 VAL 19 5.726 3.608 -4.038 169 H GLU 20 H GLU 20 4.553 7.243 -7.510 170 HA GLU 20 HA GLU 20 6.664 8.896 -6.311 171 HB2 GLU 20 2HB GLU 20 5.592 9.658 -8.453 172 HB3 GLU 20 3HB GLU 20 4.019 9.662 -7.670 173 HG2 GLU 20 2HG GLU 20 4.901 11.940 -7.889 174 HG3 GLU 20 3HG GLU 20 4.732 11.497 -6.193 175 H TYR 21 H TYR 21 5.911 10.437 -4.610 176 HA TYR 21 HA TYR 21 5.097 10.956 -2.586 177 HB2 TYR 21 2HB TYR 21 2.611 9.320 -3.268 178 HB3 TYR 21 3HB TYR 21 2.736 10.579 -2.045 179 HD1 TYR 21 HD1 TYR 21 3.430 12.987 -2.982 180 HD2 TYR 21 HD2 TYR 21 1.687 9.892 -5.365 181 HE1 TYR 21 HE1 TYR 21 2.694 14.658 -4.626 182 HE2 TYR 21 HE2 TYR 21 0.949 11.556 -7.007 183 HH TYR 21 HH TYR 21 2.113 14.716 -7.067 184 H TYR 22 H TYR 22 6.863 8.909 -2.818 185 HA TYR 22 HA TYR 22 6.286 6.409 -1.769 186 HB2 TYR 22 2HB TYR 22 8.444 6.958 -2.846 187 HB3 TYR 22 3HB TYR 22 8.885 7.982 -1.481 188 HD1 TYR 22 HD1 TYR 22 8.049 4.436 -2.374 189 HD2 TYR 22 HD2 TYR 22 10.037 7.011 0.407 190 HE1 TYR 22 HE1 TYR 22 9.017 2.488 -1.250 191 HE2 TYR 22 HE2 TYR 22 10.997 5.051 1.529 192 HH TYR 22 HH TYR 22 10.484 2.627 1.782 193 H ASN 23 H ASN 23 7.265 9.367 -0.042 194 HA ASN 23 HA ASN 23 7.392 8.174 2.555 195 HB2 ASN 23 2HB ASN 23 7.239 11.104 1.713 196 HB3 ASN 23 3HB ASN 23 7.534 10.564 3.366 197 HD21 ASN 23 1HD2 ASN 23 8.912 10.953 0.205 198 HD22 ASN 23 2HD2 ASN 23 10.534 10.546 0.635 199 H GLU 24 H GLU 24 4.826 9.604 0.690 200 HA GLU 24 HA GLU 24 3.016 10.110 2.874 201 HB2 GLU 24 2HB GLU 24 2.657 10.064 -0.154 202 HB3 GLU 24 3HB GLU 24 1.316 10.356 0.946 203 HG2 GLU 24 2HG GLU 24 2.225 12.457 0.025 204 HG3 GLU 24 3HG GLU 24 2.363 12.387 1.781 205 H LEU 25 H LEU 25 3.194 7.694 0.264 206 HA LEU 25 HA LEU 25 1.132 5.998 1.128 207 HB2 LEU 25 2HB LEU 25 2.112 6.116 -1.186 208 HB3 LEU 25 3HB LEU 25 3.572 5.354 -0.578 209 HG LEU 25 HG LEU 25 2.305 3.275 -0.084 210 HD11 LEU 25 1HD1 LEU 25 0.107 4.216 0.426 211 HD12 LEU 25 2HD1 LEU 25 -0.019 2.984 -0.825 212 HD13 LEU 25 3HD1 LEU 25 -0.109 4.693 -1.261 213 HD21 LEU 25 1HD2 LEU 25 3.375 3.518 -2.279 214 HD22 LEU 25 2HD2 LEU 25 1.903 4.242 -2.935 215 HD23 LEU 25 3HD2 LEU 25 1.900 2.560 -2.396 216 H LYS 26 H LYS 26 4.601 6.128 1.790 217 HA LYS 26 HA LYS 26 4.909 3.799 3.341 218 HB2 LYS 26 2HB LYS 26 6.794 5.206 2.491 219 HB3 LYS 26 3HB LYS 26 6.404 6.432 3.689 220 HG2 LYS 26 2HG LYS 26 7.034 4.943 5.507 221 HG3 LYS 26 3HG LYS 26 7.210 3.588 4.391 222 HD2 LYS 26 2HD LYS 26 9.421 4.382 4.923 223 HD3 LYS 26 3HD LYS 26 9.078 4.832 3.250 224 HE2 LYS 26 2HE LYS 26 10.170 6.695 4.349 225 HE3 LYS 26 3HE LYS 26 8.488 7.146 4.066 226 HZ1 LYS 26 1HZ LYS 26 7.997 6.612 6.375 227 HZ2 LYS 26 2HZ LYS 26 9.230 7.763 6.283 228 HZ3 LYS 26 3HZ LYS 26 9.605 6.154 6.638 229 H ALA 27 H ALA 27 3.695 7.033 4.246 230 HA ALA 27 HA ALA 27 3.572 6.530 7.072 231 HB1 ALA 27 1HB ALA 27 2.192 8.657 5.393 232 HB2 ALA 27 2HB ALA 27 3.764 8.815 6.179 233 HB3 ALA 27 3HB ALA 27 2.304 8.647 7.158 234 H LEU 28 H LEU 28 1.391 6.187 4.316 235 HA LEU 28 HA LEU 28 -0.993 5.537 5.721 236 HB2 LEU 28 2HB LEU 28 -0.998 6.255 3.365 237 HB3 LEU 28 3HB LEU 28 -0.064 4.841 2.906 238 HG LEU 28 HG LEU 28 -1.983 3.367 3.492 239 HD11 LEU 28 1HD1 LEU 28 -4.196 4.290 4.003 240 HD12 LEU 28 2HD1 LEU 28 -3.514 5.917 4.090 241 HD13 LEU 28 3HD1 LEU 28 -3.025 4.687 5.259 242 HD21 LEU 28 1HD2 LEU 28 -2.725 5.583 1.555 243 HD22 LEU 28 2HD2 LEU 28 -3.451 3.975 1.624 244 HD23 LEU 28 3HD2 LEU 28 -1.754 4.154 1.188 245 H VAL 29 H VAL 29 1.683 3.652 4.381 246 HA VAL 29 HA VAL 29 0.828 1.048 5.004 247 HB VAL 29 HB VAL 29 3.432 2.358 4.254 248 HG11 VAL 29 1HG1 VAL 29 3.396 -0.436 5.427 249 HG12 VAL 29 2HG1 VAL 29 4.269 0.964 6.058 250 HG13 VAL 29 3HG1 VAL 29 4.743 0.249 4.511 251 HG21 VAL 29 1HG2 VAL 29 3.416 0.661 2.447 252 HG22 VAL 29 2HG2 VAL 29 1.902 1.568 2.501 253 HG23 VAL 29 3HG2 VAL 29 1.973 -0.070 3.155 254 H SER 30 H SER 30 2.692 3.449 6.782 255 HA SER 30 HA SER 30 3.484 1.858 8.987 256 HB2 SER 30 2HB SER 30 4.478 4.073 8.285 257 HB3 SER 30 3HB SER 30 3.061 4.882 8.955 258 HG SER 30 HG SER 30 4.859 3.210 10.382 259 H LYS 31 H LYS 31 0.627 3.754 8.309 260 HA LYS 31 HA LYS 31 -0.521 3.709 10.922 261 HB2 LYS 31 2HB LYS 31 -0.877 5.496 9.166 262 HB3 LYS 31 3HB LYS 31 -1.831 4.339 8.243 263 HG2 LYS 31 2HG LYS 31 -3.472 4.214 10.084 264 HG3 LYS 31 3HG LYS 31 -2.493 5.343 11.035 265 HD2 LYS 31 2HD LYS 31 -2.788 7.036 9.160 266 HD3 LYS 31 3HD LYS 31 -3.931 5.916 8.410 267 HE2 LYS 31 2HE LYS 31 -5.385 6.070 10.387 268 HE3 LYS 31 3HE LYS 31 -4.225 7.145 11.172 269 HZ1 LYS 31 1HZ LYS 31 -5.711 7.715 8.670 270 HZ2 LYS 31 2HZ LYS 31 -4.569 8.733 9.379 271 HZ3 LYS 31 3HZ LYS 31 -6.011 8.394 10.187 272 H ILE 32 H ILE 32 -1.262 2.047 7.839 273 HA ILE 32 HA ILE 32 -3.495 0.621 8.874 274 HB ILE 32 HB ILE 32 -3.597 -0.588 6.736 275 HG12 ILE 32 2HG1 ILE 32 -0.930 0.742 6.043 276 HG13 ILE 32 3HG1 ILE 32 -1.161 -0.969 6.364 277 HG21 ILE 32 1HG2 ILE 32 -4.532 1.688 6.820 278 HG22 ILE 32 2HG2 ILE 32 -3.893 1.342 5.214 279 HG23 ILE 32 3HG2 ILE 32 -2.978 2.368 6.324 280 HD11 ILE 32 1HD1 ILE 32 -2.335 0.550 4.036 281 HD12 ILE 32 2HD1 ILE 32 -2.521 -1.177 4.356 282 HD13 ILE 32 3HD1 ILE 32 -0.928 -0.512 3.996 283 H SER 33 H SER 33 -0.074 -0.273 8.355 284 HA SER 33 HA SER 33 -0.211 -3.013 8.868 285 HB2 SER 33 2HB SER 33 2.212 -2.821 9.477 286 HB3 SER 33 3HB SER 33 1.804 -1.988 7.977 287 HG SER 33 HG SER 33 2.609 -0.285 8.866 288 H SER 34 H SER 34 -0.284 -0.331 11.110 289 HA SER 34 HA SER 34 0.087 -2.000 13.482 290 HB2 SER 34 2HB SER 34 1.087 0.340 13.246 291 HB3 SER 34 3HB SER 34 -0.548 0.984 13.372 292 HG SER 34 HG SER 34 0.691 0.865 15.374 293 H SER 35 H SER 35 -2.414 -1.639 11.462 294 HA SER 35 HA SER 35 -4.536 -1.602 13.533 295 HB2 SER 35 2HB SER 35 -4.550 0.480 12.191 296 HB3 SER 35 3HB SER 35 -4.643 -0.456 10.700 297 HG SER 35 HG SER 35 -6.573 -0.562 12.783 298 H VAL 36 H VAL 36 -3.355 -3.049 10.526 299 HA VAL 36 HA VAL 36 -5.678 -4.812 10.277 300 HB VAL 36 HB VAL 36 -4.730 -5.546 8.119 301 HG11 VAL 36 1HG1 VAL 36 -6.226 -3.627 8.112 302 HG12 VAL 36 2HG1 VAL 36 -4.999 -3.430 6.862 303 HG13 VAL 36 3HG1 VAL 36 -4.872 -2.517 8.371 304 HG21 VAL 36 1HG2 VAL 36 -2.745 -4.447 7.112 305 HG22 VAL 36 2HG2 VAL 36 -2.326 -5.375 8.553 306 HG23 VAL 36 3HG2 VAL 36 -2.436 -3.618 8.641 307 H ASN 37 H ASN 37 -5.657 -6.840 10.856 308 HA ASN 37 HA ASN 37 -3.394 -7.925 12.334 309 HB2 ASN 37 2HB ASN 37 -6.144 -9.184 11.915 310 HB3 ASN 37 3HB ASN 37 -4.967 -9.571 13.169 311 HD21 ASN 37 1HD2 ASN 37 -7.352 -7.271 12.082 312 HD22 ASN 37 2HD2 ASN 37 -7.479 -6.396 13.570 313 H ASP 38 H ASP 38 -4.841 -8.279 9.202 314 HA ASP 38 HA ASP 38 -2.976 -10.451 8.511 315 HB2 ASP 38 2HB ASP 38 -5.245 -11.475 9.024 316 HB3 ASP 38 3HB ASP 38 -5.930 -10.514 7.716 317 H LEU 39 H LEU 39 -2.640 -10.608 6.154 318 HA LEU 39 HA LEU 39 -2.112 -8.046 5.045 319 HB2 LEU 39 2HB LEU 39 -0.693 -10.097 4.787 320 HB3 LEU 39 3HB LEU 39 -1.908 -10.787 3.739 321 HG LEU 39 HG LEU 39 0.201 -9.829 2.626 322 HD11 LEU 39 1HD1 LEU 39 -1.765 -10.391 1.313 323 HD12 LEU 39 2HD1 LEU 39 -0.903 -9.002 0.657 324 HD13 LEU 39 3HD1 LEU 39 -2.401 -8.762 1.559 325 HD21 LEU 39 1HD2 LEU 39 -1.095 -7.150 3.217 326 HD22 LEU 39 2HD2 LEU 39 0.312 -7.421 2.183 327 HD23 LEU 39 3HD2 LEU 39 0.413 -7.757 3.910 328 H GLU 40 H GLU 40 -4.664 -10.422 4.517 329 HA GLU 40 HA GLU 40 -5.879 -9.431 2.198 330 HB2 GLU 40 2HB GLU 40 -6.528 -11.571 3.284 331 HB3 GLU 40 3HB GLU 40 -7.215 -10.683 4.643 332 HG2 GLU 40 2HG GLU 40 -8.838 -9.611 3.043 333 HG3 GLU 40 3HG GLU 40 -8.201 -10.651 1.770 334 H GLU 41 H GLU 41 -6.061 -8.342 5.558 335 HA GLU 41 HA GLU 41 -8.235 -6.509 5.273 336 HB2 GLU 41 2HB GLU 41 -6.016 -6.547 7.361 337 HB3 GLU 41 3HB GLU 41 -7.531 -5.651 7.480 338 HG2 GLU 41 2HG GLU 41 -8.791 -7.744 7.571 339 HG3 GLU 41 3HG GLU 41 -7.297 -8.653 7.334 340 H ALA 42 H ALA 42 -4.749 -6.327 4.920 341 HA ALA 42 HA ALA 42 -4.470 -3.488 4.825 342 HB1 ALA 42 1HB ALA 42 -2.220 -3.935 3.913 343 HB2 ALA 42 2HB ALA 42 -2.639 -5.638 3.698 344 HB3 ALA 42 3HB ALA 42 -2.557 -4.947 5.320 345 H ILE 43 H ILE 43 -4.773 -6.027 2.370 346 HA ILE 43 HA ILE 43 -4.588 -4.500 0.041 347 HB ILE 43 HB ILE 43 -6.174 -7.049 0.571 348 HG12 ILE 43 2HG1 ILE 43 -3.445 -6.628 -0.750 349 HG13 ILE 43 3HG1 ILE 43 -3.714 -7.278 0.864 350 HG21 ILE 43 1HG2 ILE 43 -5.544 -5.777 -2.119 351 HG22 ILE 43 2HG2 ILE 43 -7.142 -5.927 -1.388 352 HG23 ILE 43 3HG2 ILE 43 -6.267 -7.371 -1.888 353 HD11 ILE 43 1HD1 ILE 43 -4.478 -8.566 -1.756 354 HD12 ILE 43 2HD1 ILE 43 -4.905 -9.199 -0.162 355 HD13 ILE 43 3HD1 ILE 43 -3.211 -9.067 -0.633 356 H VAL 44 H VAL 44 -7.750 -5.735 1.348 357 HA VAL 44 HA VAL 44 -9.586 -4.235 0.100 358 HB VAL 44 HB VAL 44 -9.667 -4.769 3.105 359 HG11 VAL 44 1HG1 VAL 44 -11.961 -4.265 1.162 360 HG12 VAL 44 2HG1 VAL 44 -11.415 -3.169 2.432 361 HG13 VAL 44 3HG1 VAL 44 -12.140 -4.718 2.861 362 HG21 VAL 44 1HG2 VAL 44 -10.661 -6.533 0.831 363 HG22 VAL 44 2HG2 VAL 44 -10.841 -6.869 2.554 364 HG23 VAL 44 3HG2 VAL 44 -9.236 -6.842 1.825 365 H VAL 45 H VAL 45 -7.956 -3.070 3.102 366 HA VAL 45 HA VAL 45 -9.107 -0.526 3.284 367 HB VAL 45 HB VAL 45 -6.324 -1.466 4.120 368 HG11 VAL 45 1HG1 VAL 45 -7.591 1.249 4.710 369 HG12 VAL 45 2HG1 VAL 45 -6.139 0.960 3.749 370 HG13 VAL 45 3HG1 VAL 45 -6.128 0.624 5.479 371 HG21 VAL 45 1HG2 VAL 45 -8.227 -2.450 5.352 372 HG22 VAL 45 2HG2 VAL 45 -8.827 -0.837 5.743 373 HG23 VAL 45 3HG2 VAL 45 -7.286 -1.388 6.403 374 H LEU 46 H LEU 46 -6.190 -1.521 1.465 375 HA LEU 46 HA LEU 46 -5.612 1.055 0.383 376 HB2 LEU 46 2HB LEU 46 -4.738 -1.715 -0.488 377 HB3 LEU 46 3HB LEU 46 -4.154 -0.242 -1.247 378 HG LEU 46 HG LEU 46 -3.706 -1.009 1.666 379 HD11 LEU 46 1HD1 LEU 46 -1.740 -1.017 -0.647 380 HD12 LEU 46 2HD1 LEU 46 -2.440 -2.442 0.125 381 HD13 LEU 46 3HD1 LEU 46 -1.373 -1.383 1.045 382 HD21 LEU 46 1HD2 LEU 46 -3.821 1.424 1.403 383 HD22 LEU 46 2HD2 LEU 46 -2.627 1.365 0.103 384 HD23 LEU 46 3HD2 LEU 46 -2.170 0.914 1.748 385 H ARG 47 H ARG 47 -7.661 -1.632 -0.755 386 HA ARG 47 HA ARG 47 -8.184 -0.723 -3.369 387 HB2 ARG 47 2HB ARG 47 -9.944 -2.374 -1.505 388 HB3 ARG 47 3HB ARG 47 -10.304 -2.096 -3.210 389 HG2 ARG 47 2HG ARG 47 -8.170 -3.238 -3.812 390 HG3 ARG 47 3HG ARG 47 -7.894 -3.579 -2.101 391 HD2 ARG 47 2HD ARG 47 -8.819 -5.550 -3.200 392 HD3 ARG 47 3HD ARG 47 -9.996 -4.908 -2.049 393 HE ARG 47 HE ARG 47 -10.679 -3.738 -4.429 394 HH11 ARG 47 1HH1 ARG 47 -10.354 -7.096 -3.425 395 HH12 ARG 47 2HH1 ARG 47 -11.538 -7.664 -4.555 396 HH21 ARG 47 1HH2 ARG 47 -12.201 -4.520 -5.908 397 HH22 ARG 47 2HH2 ARG 47 -12.583 -6.207 -5.960 398 H GLU 48 H GLU 48 -9.358 0.305 -0.274 399 HA GLU 48 HA GLU 48 -11.454 2.014 -1.381 400 HB2 GLU 48 2HB GLU 48 -10.457 1.609 1.462 401 HB3 GLU 48 3HB GLU 48 -11.770 2.703 1.028 402 HG2 GLU 48 2HG GLU 48 -11.748 -0.310 0.625 403 HG3 GLU 48 3HG GLU 48 -12.616 0.557 1.891 404 H GLU 49 H GLU 49 -8.211 2.259 0.023 405 HA GLU 49 HA GLU 49 -8.046 5.063 0.273 406 HB2 GLU 49 2HB GLU 49 -5.820 3.025 -0.143 407 HB3 GLU 49 3HB GLU 49 -5.528 4.728 0.211 408 HG2 GLU 49 2HG GLU 49 -6.879 2.694 2.001 409 HG3 GLU 49 3HG GLU 49 -5.310 3.454 2.244 410 H GLU 50 H GLU 50 -7.133 2.942 -2.378 411 HA GLU 50 HA GLU 50 -6.235 4.637 -4.337 412 HB2 GLU 50 2HB GLU 50 -6.330 2.221 -4.621 413 HB3 GLU 50 3HB GLU 50 -8.088 2.231 -4.527 414 HG2 GLU 50 2HG GLU 50 -8.135 3.549 -6.667 415 HG3 GLU 50 3HG GLU 50 -6.380 3.351 -6.773 416 H LYS 51 H LYS 51 -9.666 3.725 -3.790 417 HA LYS 51 HA LYS 51 -10.953 5.515 -5.483 418 HB2 LYS 51 2HB LYS 51 -11.891 4.338 -2.837 419 HB3 LYS 51 3HB LYS 51 -12.953 5.120 -4.003 420 HG2 LYS 51 2HG LYS 51 -12.693 3.364 -5.590 421 HG3 LYS 51 3HG LYS 51 -11.289 2.697 -4.751 422 HD2 LYS 51 2HD LYS 51 -13.309 1.302 -4.401 423 HD3 LYS 51 3HD LYS 51 -12.700 1.963 -2.884 424 HE2 LYS 51 2HE LYS 51 -14.472 3.747 -3.028 425 HE3 LYS 51 3HE LYS 51 -15.112 2.934 -4.457 426 HZ1 LYS 51 1HZ LYS 51 -14.869 1.712 -1.760 427 HZ2 LYS 51 2HZ LYS 51 -15.539 0.984 -3.127 428 HZ3 LYS 51 3HZ LYS 51 -16.295 2.322 -2.432 429 H LYS 52 H LYS 52 -9.823 5.982 -2.119 430 HA LYS 52 HA LYS 52 -11.176 8.466 -1.645 431 HB2 LYS 52 2HB LYS 52 -8.647 7.503 -0.230 432 HB3 LYS 52 3HB LYS 52 -9.799 8.694 0.360 433 HG2 LYS 52 2HG LYS 52 -10.266 5.727 0.051 434 HG3 LYS 52 3HG LYS 52 -10.006 6.591 1.559 435 HD2 LYS 52 2HD LYS 52 -12.154 7.778 1.252 436 HD3 LYS 52 3HD LYS 52 -12.396 6.951 -0.292 437 HE2 LYS 52 2HE LYS 52 -12.523 4.786 0.845 438 HE3 LYS 52 3HE LYS 52 -12.157 5.547 2.395 439 HZ1 LYS 52 1HZ LYS 52 -14.553 6.152 0.760 440 HZ2 LYS 52 2HZ LYS 52 -14.224 6.716 2.317 441 HZ3 LYS 52 3HZ LYS 52 -14.531 5.074 2.061 442 H ALA 53 H ALA 53 -8.090 7.555 -3.000 443 HA ALA 53 HA ALA 53 -7.041 10.271 -3.125 444 HB1 ALA 53 1HB ALA 53 -5.031 9.202 -4.067 445 HB2 ALA 53 2HB ALA 53 -5.870 7.648 -4.123 446 HB3 ALA 53 3HB ALA 53 -5.527 8.411 -2.569 447 H SER 54 H SER 54 -6.234 11.118 -5.139 448 HA SER 54 HA SER 54 -7.654 10.247 -7.592 449 HB2 SER 54 2HB SER 54 -8.383 12.505 -6.749 450 HB3 SER 54 3HB SER 54 -6.719 13.074 -6.894 451 HG SER 54 HG SER 54 -7.706 13.648 -8.757 452 H GLU 55 H GLU 55 -6.373 10.782 -9.604 453 HA GLU 55 HA GLU 55 -3.771 9.644 -9.491 454 HB2 GLU 55 2HB GLU 55 -5.133 11.182 -11.749 455 HB3 GLU 55 3HB GLU 55 -3.672 10.206 -11.930 456 HG2 GLU 55 2HG GLU 55 -4.921 8.180 -11.321 457 HG3 GLU 55 3HG GLU 55 -6.379 9.139 -11.051 458 HA PRO 56 HA PRO 56 -1.616 9.862 -10.721 459 HB2 PRO 56 2HB PRO 56 0.908 10.454 -9.345 460 HB3 PRO 56 3HB PRO 56 0.547 10.537 -11.078 461 HG2 PRO 56 2HG PRO 56 1.069 12.750 -9.552 462 HG3 PRO 56 3HG PRO 56 0.066 12.781 -11.021 463 HD2 PRO 56 2HD PRO 56 -0.820 12.666 -8.136 464 HD3 PRO 56 3HD PRO 56 -1.444 13.669 -9.469 465 H PHE 57 H PHE 57 -1.918 10.693 -7.343 466 HA PHE 57 HA PHE 57 -0.512 8.539 -6.184 467 HB2 PHE 57 2HB PHE 57 -1.186 10.698 -5.041 468 HB3 PHE 57 3HB PHE 57 -2.824 10.062 -4.919 469 HD1 PHE 57 HD1 PHE 57 0.495 8.370 -4.337 470 HD2 PHE 57 HD2 PHE 57 -3.175 9.722 -2.587 471 HE1 PHE 57 HE1 PHE 57 1.128 7.335 -2.201 472 HE2 PHE 57 HE2 PHE 57 -2.530 8.678 -0.455 473 HZ PHE 57 HZ PHE 57 -0.381 7.483 -0.258 474 H LYS 58 H LYS 58 -3.787 8.698 -7.462 475 HA LYS 58 HA LYS 58 -4.876 6.343 -6.378 476 HB2 LYS 58 2HB LYS 58 -6.184 8.009 -7.680 477 HB3 LYS 58 3HB LYS 58 -5.360 7.507 -9.153 478 HG2 LYS 58 2HG LYS 58 -6.347 5.224 -8.887 479 HG3 LYS 58 3HG LYS 58 -7.220 5.793 -7.459 480 HD2 LYS 58 2HD LYS 58 -7.543 6.938 -10.265 481 HD3 LYS 58 3HD LYS 58 -8.620 5.743 -9.539 482 HE2 LYS 58 2HE LYS 58 -9.243 7.358 -7.781 483 HE3 LYS 58 3HE LYS 58 -8.133 8.547 -8.463 484 HZ1 LYS 58 1HZ LYS 58 -10.416 8.940 -9.137 485 HZ2 LYS 58 2HZ LYS 58 -10.493 7.420 -9.864 486 HZ3 LYS 58 3HZ LYS 58 -9.442 8.592 -10.470 487 H THR 59 H THR 59 -2.502 6.785 -8.898 488 HA THR 59 HA THR 59 -2.591 4.053 -9.874 489 HB THR 59 HB THR 59 -0.530 6.215 -10.509 490 HG1 THR 59 HG1 THR 59 -3.153 6.025 -11.213 491 HG21 THR 59 1HG2 THR 59 -1.359 3.718 -12.053 492 HG22 THR 59 2HG2 THR 59 0.169 3.938 -11.192 493 HG23 THR 59 3HG2 THR 59 -0.202 4.924 -12.611 494 H ASP 60 H ASP 60 -0.515 6.154 -7.940 495 HA ASP 60 HA ASP 60 1.649 4.375 -7.556 496 HB2 ASP 60 2HB ASP 60 0.727 6.658 -5.744 497 HB3 ASP 60 3HB ASP 60 2.321 5.893 -5.705 498 H ILE 61 H ILE 61 -1.292 4.898 -5.651 499 HA ILE 61 HA ILE 61 -0.840 2.941 -3.679 500 HB ILE 61 HB ILE 61 -3.484 3.977 -4.795 501 HG12 ILE 61 2HG1 ILE 61 -2.019 4.624 -2.186 502 HG13 ILE 61 3HG1 ILE 61 -2.044 5.657 -3.611 503 HG21 ILE 61 1HG2 ILE 61 -4.592 2.984 -2.794 504 HG22 ILE 61 2HG2 ILE 61 -3.064 2.233 -2.325 505 HG23 ILE 61 3HG2 ILE 61 -3.870 1.737 -3.813 506 HD11 ILE 61 1HD1 ILE 61 -3.568 6.464 -1.933 507 HD12 ILE 61 2HD1 ILE 61 -4.419 4.920 -1.906 508 HD13 ILE 61 3HD1 ILE 61 -4.466 5.932 -3.354 509 H ARG 62 H ARG 62 -2.683 2.651 -6.848 510 HA ARG 62 HA ARG 62 -3.339 -0.043 -6.392 511 HB2 ARG 62 2HB ARG 62 -4.212 -0.177 -8.615 512 HB3 ARG 62 3HB ARG 62 -4.598 1.391 -7.943 513 HG2 ARG 62 2HG ARG 62 -4.095 1.884 -10.157 514 HG3 ARG 62 3HG ARG 62 -2.590 2.264 -9.332 515 HD2 ARG 62 2HD ARG 62 -2.302 1.041 -11.512 516 HD3 ARG 62 3HD ARG 62 -1.549 0.242 -10.128 517 HE ARG 62 HE ARG 62 -4.240 -0.626 -10.902 518 HH11 ARG 62 1HH1 ARG 62 -0.800 -1.346 -10.965 519 HH12 ARG 62 2HH1 ARG 62 -1.038 -3.020 -11.334 520 HH21 ARG 62 1HH2 ARG 62 -4.527 -2.849 -11.330 521 HH22 ARG 62 2HH2 ARG 62 -3.145 -3.871 -11.539 522 H ILE 63 H ILE 63 -0.407 1.254 -7.835 523 HA ILE 63 HA ILE 63 0.593 -1.098 -9.022 524 HB ILE 63 HB ILE 63 2.106 1.264 -7.814 525 HG12 ILE 63 2HG1 ILE 63 1.481 0.563 -10.727 526 HG13 ILE 63 3HG1 ILE 63 0.666 1.800 -9.782 527 HG21 ILE 63 1HG2 ILE 63 4.110 0.483 -9.053 528 HG22 ILE 63 2HG2 ILE 63 3.243 -0.974 -9.540 529 HG23 ILE 63 3HG2 ILE 63 3.606 -0.691 -7.838 530 HD11 ILE 63 1HD1 ILE 63 2.266 2.789 -11.286 531 HD12 ILE 63 2HD1 ILE 63 3.568 1.819 -10.600 532 HD13 ILE 63 3HD1 ILE 63 2.769 3.050 -9.616 533 H LEU 64 H LEU 64 0.991 0.160 -5.695 534 HA LEU 64 HA LEU 64 2.566 -2.055 -4.753 535 HB2 LEU 64 2HB LEU 64 2.601 0.280 -3.809 536 HB3 LEU 64 3HB LEU 64 0.996 0.020 -3.161 537 HG LEU 64 HG LEU 64 3.260 -1.824 -2.307 538 HD11 LEU 64 1HD1 LEU 64 2.728 0.879 -1.048 539 HD12 LEU 64 2HD1 LEU 64 4.151 0.434 -1.990 540 HD13 LEU 64 3HD1 LEU 64 3.843 -0.357 -0.448 541 HD21 LEU 64 1HD2 LEU 64 0.795 -0.847 -0.814 542 HD22 LEU 64 2HD2 LEU 64 1.991 -1.994 -0.199 543 HD23 LEU 64 3HD2 LEU 64 0.985 -2.425 -1.579 544 H LEU 65 H LEU 65 -0.798 -1.126 -4.702 545 HA LEU 65 HA LEU 65 -1.951 -2.935 -2.956 546 HB2 LEU 65 2HB LEU 65 -2.813 -0.810 -4.302 547 HB3 LEU 65 3HB LEU 65 -3.312 -1.988 -5.493 548 HG LEU 65 HG LEU 65 -4.355 -1.685 -2.663 549 HD11 LEU 65 1HD1 LEU 65 -5.641 -1.209 -5.366 550 HD12 LEU 65 2HD1 LEU 65 -5.165 0.013 -4.184 551 HD13 LEU 65 3HD1 LEU 65 -6.468 -1.107 -3.811 552 HD21 LEU 65 1HD2 LEU 65 -5.981 -3.444 -3.145 553 HD22 LEU 65 2HD2 LEU 65 -4.338 -4.072 -3.209 554 HD23 LEU 65 3HD2 LEU 65 -5.213 -3.749 -4.707 555 H ASP 66 H ASP 66 -2.402 -3.167 -6.509 556 HA ASP 66 HA ASP 66 -2.981 -5.709 -7.024 557 HB2 ASP 66 2HB ASP 66 -2.800 -3.987 -8.744 558 HB3 ASP 66 3HB ASP 66 -1.059 -3.894 -8.540 559 H PHE 67 H PHE 67 0.392 -4.520 -6.742 560 HA PHE 67 HA PHE 67 1.868 -6.808 -7.088 561 HB2 PHE 67 2HB PHE 67 2.883 -4.593 -6.694 562 HB3 PHE 67 3HB PHE 67 2.361 -4.625 -5.016 563 HD1 PHE 67 HD1 PHE 67 4.532 -6.437 -7.476 564 HD2 PHE 67 HD2 PHE 67 3.798 -5.552 -3.346 565 HE1 PHE 67 HE1 PHE 67 6.640 -7.536 -6.856 566 HE2 PHE 67 HE2 PHE 67 5.909 -6.656 -2.741 567 HZ PHE 67 HZ PHE 67 7.331 -7.645 -4.495 568 H LEU 68 H LEU 68 0.376 -5.762 -3.983 569 HA LEU 68 HA LEU 68 1.124 -8.035 -2.446 570 HB2 LEU 68 2HB LEU 68 -1.209 -6.125 -2.066 571 HB3 LEU 68 3HB LEU 68 -0.689 -7.308 -0.871 572 HG LEU 68 HG LEU 68 0.948 -4.930 -1.838 573 HD11 LEU 68 1HD1 LEU 68 -0.450 -5.393 0.811 574 HD12 LEU 68 2HD1 LEU 68 -0.958 -4.270 -0.455 575 HD13 LEU 68 3HD1 LEU 68 0.566 -4.008 0.389 576 HD21 LEU 68 1HD2 LEU 68 2.432 -6.783 -1.257 577 HD22 LEU 68 2HD2 LEU 68 1.609 -7.005 0.290 578 HD23 LEU 68 3HD2 LEU 68 2.529 -5.530 -0.021 579 H GLU 69 H GLU 69 -1.781 -7.268 -4.351 580 HA GLU 69 HA GLU 69 -3.375 -9.484 -3.647 581 HB2 GLU 69 2HB GLU 69 -3.400 -7.871 -6.236 582 HB3 GLU 69 3HB GLU 69 -4.690 -8.931 -5.670 583 HG2 GLU 69 2HG GLU 69 -4.944 -7.429 -3.670 584 HG3 GLU 69 3HG GLU 69 -3.776 -6.335 -4.404 585 H SER 70 H SER 70 -0.708 -9.149 -5.870 586 HA SER 70 HA SER 70 0.603 -10.640 -6.912 587 HB2 SER 70 2HB SER 70 0.211 -12.218 -5.029 588 HB3 SER 70 3HB SER 70 -1.237 -12.817 -5.833 589 HG SER 70 HG SER 70 -0.005 -13.764 -7.370 590 H LYS 71 H LYS 71 -2.154 -9.549 -7.871 591 HA LYS 71 HA LYS 71 -3.055 -11.238 -9.989 592 HB2 LYS 71 2HB LYS 71 -3.455 -8.299 -9.325 593 HB3 LYS 71 3HB LYS 71 -4.220 -9.054 -10.716 594 HG2 LYS 71 2HG LYS 71 -5.651 -10.372 -9.394 595 HG3 LYS 71 3HG LYS 71 -4.653 -10.189 -7.947 596 HD2 LYS 71 2HD LYS 71 -6.854 -8.865 -7.990 597 HD3 LYS 71 3HD LYS 71 -5.400 -7.967 -7.569 598 HE2 LYS 71 2HE LYS 71 -5.297 -7.107 -9.919 599 HE3 LYS 71 3HE LYS 71 -6.821 -7.935 -10.253 600 HZ1 LYS 71 1HZ LYS 71 -7.024 -5.541 -9.682 601 HZ2 LYS 71 2HZ LYS 71 -6.485 -5.901 -8.120 602 HZ3 LYS 71 3HZ LYS 71 -7.933 -6.564 -8.691 603 HA PRO 72 HA PRO 72 -0.156 -9.821 -13.247 604 HB2 PRO 72 2HB PRO 72 -2.212 -10.673 -15.232 605 HB3 PRO 72 3HB PRO 72 -0.580 -11.319 -14.965 606 HG2 PRO 72 2HG PRO 72 -2.776 -12.739 -14.326 607 HG3 PRO 72 3HG PRO 72 -1.283 -12.840 -13.363 608 HD2 PRO 72 2HD PRO 72 -3.787 -11.239 -12.783 609 HD3 PRO 72 3HD PRO 72 -2.824 -12.258 -11.682 Start of MODEL 10 1 H GLY 1 1H GLY 1 3.959 -4.927 16.734 2 HA2 GLY 1 2HA GLY 1 3.296 -4.611 14.427 3 HA3 GLY 1 3HA GLY 1 4.748 -5.593 14.583 4 H SER 2 H SER 2 1.644 -5.448 13.208 5 HA SER 2 HA SER 2 0.967 -8.178 12.916 6 HB2 SER 2 2HB SER 2 0.398 -5.866 11.007 7 HB3 SER 2 3HB SER 2 -0.496 -7.386 11.099 8 HG SER 2 HG SER 2 -1.306 -5.397 12.241 9 H VAL 3 H VAL 3 1.491 -9.696 11.307 10 HA VAL 3 HA VAL 3 3.959 -9.657 9.972 11 HB VAL 3 HB VAL 3 2.600 -11.707 10.529 12 HG11 VAL 3 1HG1 VAL 3 0.865 -12.515 8.980 13 HG12 VAL 3 2HG1 VAL 3 0.977 -11.018 8.052 14 HG13 VAL 3 3HG1 VAL 3 0.400 -10.981 9.721 15 HG21 VAL 3 1HG2 VAL 3 3.318 -13.056 8.586 16 HG22 VAL 3 2HG2 VAL 3 4.570 -11.909 9.072 17 HG23 VAL 3 3HG2 VAL 3 3.577 -11.581 7.648 18 H VAL 4 H VAL 4 1.064 -8.117 9.117 19 HA VAL 4 HA VAL 4 1.159 -7.866 6.304 20 HB VAL 4 HB VAL 4 0.205 -5.697 8.238 21 HG11 VAL 4 1HG1 VAL 4 -1.409 -5.142 6.457 22 HG12 VAL 4 2HG1 VAL 4 -0.735 -6.420 5.442 23 HG13 VAL 4 3HG1 VAL 4 0.254 -5.026 5.880 24 HG21 VAL 4 1HG2 VAL 4 -0.755 -7.823 8.980 25 HG22 VAL 4 2HG2 VAL 4 -1.355 -8.144 7.352 26 HG23 VAL 4 3HG2 VAL 4 -2.008 -6.792 8.281 27 H LYS 5 H LYS 5 2.648 -6.111 8.957 28 HA LYS 5 HA LYS 5 3.408 -3.751 7.758 29 HB2 LYS 5 2HB LYS 5 3.471 -4.109 10.203 30 HB3 LYS 5 3HB LYS 5 4.853 -5.189 10.024 31 HG2 LYS 5 2HG LYS 5 6.232 -3.336 9.193 32 HG3 LYS 5 3HG LYS 5 4.841 -2.248 9.259 33 HD2 LYS 5 2HD LYS 5 4.769 -2.391 11.682 34 HD3 LYS 5 3HD LYS 5 6.015 -3.644 11.691 35 HE2 LYS 5 2HE LYS 5 6.438 -0.793 10.713 36 HE3 LYS 5 3HE LYS 5 6.900 -1.397 12.310 37 HZ1 LYS 5 1HZ LYS 5 7.939 -2.391 9.708 38 HZ2 LYS 5 2HZ LYS 5 8.374 -2.985 11.228 39 HZ3 LYS 5 3HZ LYS 5 8.769 -1.402 10.797 40 H GLU 6 H GLU 6 5.338 -6.787 7.941 41 HA GLU 6 HA GLU 6 7.678 -5.665 6.793 42 HB2 GLU 6 2HB GLU 6 8.538 -7.947 6.649 43 HB3 GLU 6 3HB GLU 6 7.728 -7.740 8.199 44 HG2 GLU 6 2HG GLU 6 5.834 -9.025 7.486 45 HG3 GLU 6 3HG GLU 6 6.380 -9.032 5.816 46 H LYS 7 H LYS 7 4.885 -7.421 5.523 47 HA LYS 7 HA LYS 7 5.824 -7.935 2.895 48 HB2 LYS 7 2HB LYS 7 2.941 -7.621 3.848 49 HB3 LYS 7 3HB LYS 7 3.456 -8.400 2.348 50 HG2 LYS 7 2HG LYS 7 4.639 -10.124 3.628 51 HG3 LYS 7 3HG LYS 7 4.172 -9.338 5.141 52 HD2 LYS 7 2HD LYS 7 1.790 -9.781 4.624 53 HD3 LYS 7 3HD LYS 7 2.264 -10.564 3.110 54 HE2 LYS 7 2HE LYS 7 3.005 -11.491 5.907 55 HE3 LYS 7 3HE LYS 7 1.796 -12.226 4.854 56 HZ1 LYS 7 1HZ LYS 7 3.859 -13.451 4.788 57 HZ2 LYS 7 2HZ LYS 7 4.714 -12.076 4.311 58 HZ3 LYS 7 3HZ LYS 7 3.565 -12.755 3.275 59 H LEU 8 H LEU 8 3.942 -5.286 4.275 60 HA LEU 8 HA LEU 8 3.487 -3.747 1.974 61 HB2 LEU 8 2HB LEU 8 3.891 -2.907 4.861 62 HB3 LEU 8 3HB LEU 8 3.304 -1.833 3.603 63 HG LEU 8 HG LEU 8 1.847 -4.338 4.526 64 HD11 LEU 8 1HD1 LEU 8 1.318 -1.446 5.261 65 HD12 LEU 8 2HD1 LEU 8 1.942 -2.703 6.334 66 HD13 LEU 8 3HD1 LEU 8 0.307 -2.832 5.692 67 HD21 LEU 8 1HD2 LEU 8 -0.068 -3.412 3.303 68 HD22 LEU 8 2HD2 LEU 8 1.293 -3.720 2.230 69 HD23 LEU 8 3HD2 LEU 8 0.932 -2.067 2.735 70 H GLU 9 H GLU 9 6.228 -3.866 4.256 71 HA GLU 9 HA GLU 9 7.688 -1.651 3.219 72 HB2 GLU 9 2HB GLU 9 8.569 -3.988 4.964 73 HB3 GLU 9 3HB GLU 9 9.574 -2.584 4.611 74 HG2 GLU 9 2HG GLU 9 7.961 -1.117 5.749 75 HG3 GLU 9 3HG GLU 9 6.905 -2.492 6.041 76 H LYS 10 H LYS 10 7.801 -5.167 2.546 77 HA LYS 10 HA LYS 10 10.095 -5.214 0.887 78 HB2 LYS 10 2HB LYS 10 7.667 -7.040 0.549 79 HB3 LYS 10 3HB LYS 10 9.328 -7.378 0.067 80 HG2 LYS 10 2HG LYS 10 8.301 -7.156 2.901 81 HG3 LYS 10 3HG LYS 10 8.667 -8.651 2.057 82 HD2 LYS 10 2HD LYS 10 11.032 -8.155 2.045 83 HD3 LYS 10 3HD LYS 10 10.753 -6.505 2.607 84 HE2 LYS 10 2HE LYS 10 11.589 -7.917 4.434 85 HE3 LYS 10 3HE LYS 10 9.948 -7.372 4.778 86 HZ1 LYS 10 1HZ LYS 10 10.202 -9.684 5.341 87 HZ2 LYS 10 2HZ LYS 10 10.738 -10.062 3.781 88 HZ3 LYS 10 3HZ LYS 10 9.147 -9.555 4.027 89 H ALA 11 H ALA 11 6.657 -4.821 0.244 90 HA ALA 11 HA ALA 11 6.709 -4.705 -2.570 91 HB1 ALA 11 1HB ALA 11 4.673 -3.579 -0.619 92 HB2 ALA 11 2HB ALA 11 4.675 -5.215 -1.288 93 HB3 ALA 11 3HB ALA 11 4.414 -3.824 -2.347 94 H LEU 12 H LEU 12 6.727 -2.185 -0.045 95 HA LEU 12 HA LEU 12 6.681 0.149 -1.458 96 HB2 LEU 12 2HB LEU 12 8.179 -0.613 1.054 97 HB3 LEU 12 3HB LEU 12 8.351 1.004 0.396 98 HG LEU 12 HG LEU 12 5.716 -0.219 1.303 99 HD11 LEU 12 1HD1 LEU 12 5.899 1.353 3.196 100 HD12 LEU 12 2HD1 LEU 12 7.518 1.806 2.656 101 HD13 LEU 12 3HD1 LEU 12 7.192 0.154 3.194 102 HD21 LEU 12 1HD2 LEU 12 4.826 2.066 1.077 103 HD22 LEU 12 2HD2 LEU 12 5.390 1.443 -0.472 104 HD23 LEU 12 3HD2 LEU 12 6.373 2.611 0.417 105 H ILE 13 H ILE 13 9.552 -1.935 -0.954 106 HA ILE 13 HA ILE 13 11.418 -0.192 -2.238 107 HB ILE 13 HB ILE 13 11.628 -3.194 -1.685 108 HG12 ILE 13 2HG1 ILE 13 12.523 -0.784 -0.034 109 HG13 ILE 13 3HG1 ILE 13 11.261 -1.931 0.391 110 HG21 ILE 13 1HG2 ILE 13 13.249 -2.480 -3.400 111 HG22 ILE 13 2HG2 ILE 13 14.074 -2.895 -1.896 112 HG23 ILE 13 3HG2 ILE 13 13.834 -1.201 -2.333 113 HD11 ILE 13 1HD1 ILE 13 12.979 -3.689 0.574 114 HD12 ILE 13 2HD1 ILE 13 13.225 -2.348 1.689 115 HD13 ILE 13 3HD1 ILE 13 14.221 -2.480 0.239 116 H GLU 14 H GLU 14 9.559 -3.053 -3.262 117 HA GLU 14 HA GLU 14 10.789 -3.343 -5.805 118 HB2 GLU 14 2HB GLU 14 8.095 -4.390 -4.844 119 HB3 GLU 14 3HB GLU 14 8.972 -4.955 -6.269 120 HG2 GLU 14 2HG GLU 14 9.785 -5.252 -3.365 121 HG3 GLU 14 3HG GLU 14 9.313 -6.537 -4.471 122 H VAL 15 H VAL 15 8.019 -1.456 -4.723 123 HA VAL 15 HA VAL 15 7.444 -0.606 -7.488 124 HB VAL 15 HB VAL 15 5.330 0.245 -6.695 125 HG11 VAL 15 1HG1 VAL 15 4.237 -1.810 -5.855 126 HG12 VAL 15 2HG1 VAL 15 5.814 -2.498 -5.460 127 HG13 VAL 15 3HG1 VAL 15 5.392 -2.175 -7.142 128 HG21 VAL 15 1HG2 VAL 15 4.618 0.139 -4.312 129 HG22 VAL 15 2HG2 VAL 15 5.998 1.211 -4.545 130 HG23 VAL 15 3HG2 VAL 15 6.246 -0.395 -3.863 131 H ARG 16 H ARG 16 9.350 0.387 -4.949 132 HA ARG 16 HA ARG 16 8.988 3.019 -4.409 133 HB2 ARG 16 2HB ARG 16 10.784 1.710 -3.395 134 HB3 ARG 16 3HB ARG 16 11.679 1.706 -4.912 135 HG2 ARG 16 2HG ARG 16 11.900 4.198 -4.745 136 HG3 ARG 16 3HG ARG 16 11.106 4.127 -3.169 137 HD2 ARG 16 2HD ARG 16 12.941 2.722 -2.309 138 HD3 ARG 16 3HD ARG 16 13.716 2.756 -3.890 139 HE ARG 16 HE ARG 16 13.215 5.310 -2.542 140 HH11 ARG 16 1HH1 ARG 16 15.598 2.894 -3.505 141 HH12 ARG 16 2HH1 ARG 16 16.943 3.952 -3.237 142 HH21 ARG 16 1HH2 ARG 16 15.033 6.661 -2.184 143 HH22 ARG 16 2HH2 ARG 16 16.617 6.056 -2.497 144 HA PRO 17 HA PRO 17 11.174 4.829 -8.328 145 HB2 PRO 17 2HB PRO 17 11.784 3.301 -10.499 146 HB3 PRO 17 3HB PRO 17 12.863 3.381 -9.087 147 HG2 PRO 17 2HG PRO 17 10.823 1.269 -9.764 148 HG3 PRO 17 3HG PRO 17 12.515 1.072 -9.245 149 HD2 PRO 17 2HD PRO 17 10.448 0.848 -7.492 150 HD3 PRO 17 3HD PRO 17 12.034 1.481 -7.013 151 H TYR 18 H TYR 18 8.667 2.438 -8.658 152 HA TYR 18 HA TYR 18 7.489 3.521 -11.086 153 HB2 TYR 18 2HB TYR 18 6.462 1.399 -9.146 154 HB3 TYR 18 3HB TYR 18 5.734 1.786 -10.704 155 HD1 TYR 18 HD1 TYR 18 6.908 1.166 -12.830 156 HD2 TYR 18 HD2 TYR 18 8.476 0.028 -9.015 157 HE1 TYR 18 HE1 TYR 18 8.361 -0.502 -13.916 158 HE2 TYR 18 HE2 TYR 18 9.920 -1.635 -10.096 159 HH TYR 18 HH TYR 18 10.057 -2.913 -12.151 160 H VAL 19 H VAL 19 7.105 3.901 -7.639 161 HA VAL 19 HA VAL 19 4.537 5.323 -7.974 162 HB VAL 19 HB VAL 19 4.224 5.163 -5.555 163 HG11 VAL 19 1HG1 VAL 19 4.940 2.467 -6.759 164 HG12 VAL 19 2HG1 VAL 19 3.405 3.324 -6.929 165 HG13 VAL 19 3HG1 VAL 19 3.907 2.728 -5.347 166 HG21 VAL 19 1HG2 VAL 19 6.895 3.713 -5.426 167 HG22 VAL 19 2HG2 VAL 19 5.748 3.871 -4.090 168 HG23 VAL 19 3HG2 VAL 19 6.527 5.306 -4.758 169 H GLU 20 H GLU 20 4.317 7.413 -7.538 170 HA GLU 20 HA GLU 20 6.575 9.053 -6.617 171 HB2 GLU 20 2HB GLU 20 3.792 9.830 -7.626 172 HB3 GLU 20 3HB GLU 20 5.043 10.976 -7.140 173 HG2 GLU 20 2HG GLU 20 6.499 10.194 -8.956 174 HG3 GLU 20 3HG GLU 20 5.295 8.997 -9.421 175 H TYR 21 H TYR 21 6.121 10.646 -4.886 176 HA TYR 21 HA TYR 21 5.638 11.189 -2.759 177 HB2 TYR 21 2HB TYR 21 2.896 9.993 -3.394 178 HB3 TYR 21 3HB TYR 21 3.248 11.086 -2.052 179 HD1 TYR 21 HD1 TYR 21 4.202 13.424 -2.639 180 HD2 TYR 21 HD2 TYR 21 2.292 10.913 -5.522 181 HE1 TYR 21 HE1 TYR 21 3.890 15.360 -4.108 182 HE2 TYR 21 HE2 TYR 21 1.975 12.858 -6.995 183 HH TYR 21 HH TYR 21 3.575 15.826 -6.498 184 H TYR 22 H TYR 22 7.104 9.003 -3.007 185 HA TYR 22 HA TYR 22 6.218 6.569 -1.950 186 HB2 TYR 22 2HB TYR 22 8.280 6.676 -3.231 187 HB3 TYR 22 3HB TYR 22 9.018 7.763 -2.058 188 HD1 TYR 22 HD1 TYR 22 7.597 4.301 -2.367 189 HD2 TYR 22 HD2 TYR 22 10.368 6.837 -0.309 190 HE1 TYR 22 HE1 TYR 22 8.441 2.377 -1.116 191 HE2 TYR 22 HE2 TYR 22 11.209 4.888 0.942 192 HH TYR 22 HH TYR 22 10.460 1.696 0.107 193 H ASN 23 H ASN 23 7.521 9.439 -0.289 194 HA ASN 23 HA ASN 23 7.800 8.164 2.263 195 HB2 ASN 23 2HB ASN 23 7.654 11.125 1.568 196 HB3 ASN 23 3HB ASN 23 8.013 10.503 3.179 197 HD21 ASN 23 1HD2 ASN 23 9.275 11.119 0.028 198 HD22 ASN 23 2HD2 ASN 23 10.897 10.634 0.358 199 H GLU 24 H GLU 24 5.157 9.759 0.631 200 HA GLU 24 HA GLU 24 3.437 10.022 2.920 201 HB2 GLU 24 2HB GLU 24 2.935 10.202 -0.077 202 HB3 GLU 24 3HB GLU 24 1.634 10.327 1.098 203 HG2 GLU 24 2HG GLU 24 2.300 12.542 0.391 204 HG3 GLU 24 3HG GLU 24 2.684 12.312 2.091 205 H LEU 25 H LEU 25 3.705 7.748 0.185 206 HA LEU 25 HA LEU 25 1.606 6.011 0.885 207 HB2 LEU 25 2HB LEU 25 2.683 6.206 -1.378 208 HB3 LEU 25 3HB LEU 25 4.130 5.454 -0.727 209 HG LEU 25 HG LEU 25 2.830 3.361 -0.291 210 HD11 LEU 25 1HD1 LEU 25 0.611 3.049 -1.279 211 HD12 LEU 25 2HD1 LEU 25 0.551 4.760 -1.715 212 HD13 LEU 25 3HD1 LEU 25 0.598 4.277 -0.015 213 HD21 LEU 25 1HD2 LEU 25 2.681 2.622 -2.611 214 HD22 LEU 25 2HD2 LEU 25 4.126 3.597 -2.355 215 HD23 LEU 25 3HD2 LEU 25 2.724 4.298 -3.172 216 H LYS 26 H LYS 26 5.078 5.999 1.575 217 HA LYS 26 HA LYS 26 5.286 3.619 3.064 218 HB2 LYS 26 2HB LYS 26 7.211 4.983 2.154 219 HB3 LYS 26 3HB LYS 26 6.949 6.147 3.445 220 HG2 LYS 26 2HG LYS 26 7.515 4.435 5.126 221 HG3 LYS 26 3HG LYS 26 7.696 3.228 3.851 222 HD2 LYS 26 2HD LYS 26 9.908 3.950 4.438 223 HD3 LYS 26 3HD LYS 26 9.544 4.666 2.866 224 HE2 LYS 26 2HE LYS 26 10.611 6.350 4.225 225 HE3 LYS 26 3HE LYS 26 8.909 6.798 4.089 226 HZ1 LYS 26 1HZ LYS 26 10.188 5.431 6.402 227 HZ2 LYS 26 2HZ LYS 26 8.540 5.785 6.283 228 HZ3 LYS 26 3HZ LYS 26 9.670 7.038 6.351 229 H ALA 27 H ALA 27 4.182 6.871 4.005 230 HA ALA 27 HA ALA 27 4.093 6.321 6.840 231 HB1 ALA 27 1HB ALA 27 3.017 8.539 6.994 232 HB2 ALA 27 2HB ALA 27 2.899 8.609 5.232 233 HB3 ALA 27 3HB ALA 27 4.483 8.607 6.008 234 H LEU 28 H LEU 28 1.930 6.111 4.075 235 HA LEU 28 HA LEU 28 -0.509 5.698 5.494 236 HB2 LEU 28 2HB LEU 28 -0.401 6.429 3.106 237 HB3 LEU 28 3HB LEU 28 0.287 4.873 2.671 238 HG LEU 28 HG LEU 28 -1.832 3.745 3.349 239 HD11 LEU 28 1HD1 LEU 28 -2.911 6.532 3.838 240 HD12 LEU 28 2HD1 LEU 28 -2.610 5.290 5.059 241 HD13 LEU 28 3HD1 LEU 28 -3.848 5.033 3.835 242 HD21 LEU 28 1HD2 LEU 28 -3.223 4.498 1.482 243 HD22 LEU 28 2HD2 LEU 28 -1.531 4.384 1.009 244 HD23 LEU 28 3HD2 LEU 28 -2.250 5.966 1.325 245 H VAL 29 H VAL 29 2.039 3.626 4.196 246 HA VAL 29 HA VAL 29 1.042 1.073 4.873 247 HB VAL 29 HB VAL 29 3.753 2.242 4.233 248 HG11 VAL 29 1HG1 VAL 29 4.394 0.732 6.011 249 HG12 VAL 29 2HG1 VAL 29 4.849 0.003 4.466 250 HG13 VAL 29 3HG1 VAL 29 3.412 -0.561 5.321 251 HG21 VAL 29 1HG2 VAL 29 2.148 -0.021 3.016 252 HG22 VAL 29 2HG2 VAL 29 3.677 0.597 2.385 253 HG23 VAL 29 3HG2 VAL 29 2.246 1.633 2.404 254 H SER 30 H SER 30 3.194 3.312 6.543 255 HA SER 30 HA SER 30 3.661 1.798 8.859 256 HB2 SER 30 2HB SER 30 5.041 3.715 8.164 257 HB3 SER 30 3HB SER 30 3.708 4.825 8.493 258 HG SER 30 HG SER 30 3.903 4.395 10.669 259 H LYS 31 H LYS 31 0.943 3.764 7.935 260 HA LYS 31 HA LYS 31 -0.282 3.920 10.540 261 HB2 LYS 31 2HB LYS 31 -0.505 5.736 8.887 262 HB3 LYS 31 3HB LYS 31 -1.276 4.648 7.751 263 HG2 LYS 31 2HG LYS 31 -2.631 4.973 10.398 264 HG3 LYS 31 3HG LYS 31 -2.634 6.385 9.339 265 HD2 LYS 31 2HD LYS 31 -3.688 5.036 7.542 266 HD3 LYS 31 3HD LYS 31 -3.672 3.616 8.591 267 HE2 LYS 31 2HE LYS 31 -5.189 4.754 10.162 268 HE3 LYS 31 3HE LYS 31 -5.177 6.195 9.143 269 HZ1 LYS 31 1HZ LYS 31 -6.208 3.527 8.332 270 HZ2 LYS 31 2HZ LYS 31 -6.207 4.922 7.379 271 HZ3 LYS 31 3HZ LYS 31 -7.145 4.860 8.779 272 H ILE 32 H ILE 32 -0.974 2.140 7.484 273 HA ILE 32 HA ILE 32 -3.357 0.911 8.496 274 HB ILE 32 HB ILE 32 -3.435 -0.405 6.393 275 HG12 ILE 32 2HG1 ILE 32 -0.730 0.861 5.765 276 HG13 ILE 32 3HG1 ILE 32 -1.002 -0.835 6.133 277 HG21 ILE 32 1HG2 ILE 32 -2.742 2.516 5.907 278 HG22 ILE 32 2HG2 ILE 32 -4.324 1.891 6.378 279 HG23 ILE 32 3HG2 ILE 32 -3.646 1.470 4.806 280 HD11 ILE 32 1HD1 ILE 32 -2.312 -1.070 4.075 281 HD12 ILE 32 2HD1 ILE 32 -0.669 -0.509 3.774 282 HD13 ILE 32 3HD1 ILE 32 -2.012 0.630 3.692 283 H SER 33 H SER 33 -0.007 -0.198 8.203 284 HA SER 33 HA SER 33 -0.218 -2.898 8.796 285 HB2 SER 33 2HB SER 33 2.124 -2.697 9.624 286 HB3 SER 33 3HB SER 33 1.880 -1.811 8.118 287 HG SER 33 HG SER 33 2.188 0.031 9.128 288 H SER 34 H SER 34 -0.494 -0.135 10.918 289 HA SER 34 HA SER 34 -0.417 -1.725 13.371 290 HB2 SER 34 2HB SER 34 0.798 0.459 13.243 291 HB3 SER 34 3HB SER 34 -0.738 1.289 12.993 292 HG SER 34 HG SER 34 -0.544 1.426 15.112 293 H SER 35 H SER 35 -2.701 -0.908 11.093 294 HA SER 35 HA SER 35 -4.974 -0.611 12.950 295 HB2 SER 35 2HB SER 35 -4.760 1.095 11.159 296 HB3 SER 35 3HB SER 35 -4.810 -0.166 9.925 297 HG SER 35 HG SER 35 -6.912 -0.097 11.761 298 H VAL 36 H VAL 36 -3.759 -2.644 10.302 299 HA VAL 36 HA VAL 36 -6.041 -4.511 10.582 300 HB VAL 36 HB VAL 36 -5.590 -5.335 8.322 301 HG11 VAL 36 1HG1 VAL 36 -6.137 -3.335 6.980 302 HG12 VAL 36 2HG1 VAL 36 -5.671 -2.294 8.329 303 HG13 VAL 36 3HG1 VAL 36 -7.058 -3.375 8.486 304 HG21 VAL 36 1HG2 VAL 36 -3.850 -4.363 6.866 305 HG22 VAL 36 2HG2 VAL 36 -3.146 -5.134 8.289 306 HG23 VAL 36 3HG2 VAL 36 -3.274 -3.376 8.211 307 H ASN 37 H ASN 37 -5.645 -6.722 10.695 308 HA ASN 37 HA ASN 37 -3.007 -7.533 11.748 309 HB2 ASN 37 2HB ASN 37 -5.684 -8.993 11.912 310 HB3 ASN 37 3HB ASN 37 -4.180 -9.506 12.672 311 HD21 ASN 37 1HD2 ASN 37 -6.807 -7.247 12.774 312 HD22 ASN 37 2HD2 ASN 37 -6.483 -6.629 14.352 313 H ASP 38 H ASP 38 -4.825 -7.733 8.919 314 HA ASP 38 HA ASP 38 -3.503 -10.226 7.996 315 HB2 ASP 38 2HB ASP 38 -6.383 -9.433 7.364 316 HB3 ASP 38 3HB ASP 38 -5.546 -10.848 6.742 317 H LEU 39 H LEU 39 -2.686 -10.158 5.965 318 HA LEU 39 HA LEU 39 -2.141 -7.688 4.703 319 HB2 LEU 39 2HB LEU 39 -0.713 -9.786 4.647 320 HB3 LEU 39 3HB LEU 39 -1.878 -10.512 3.566 321 HG LEU 39 HG LEU 39 0.292 -9.625 2.521 322 HD11 LEU 39 1HD1 LEU 39 -2.237 -8.546 1.303 323 HD12 LEU 39 2HD1 LEU 39 -1.624 -10.191 1.133 324 HD13 LEU 39 3HD1 LEU 39 -0.703 -8.840 0.477 325 HD21 LEU 39 1HD2 LEU 39 -1.000 -6.922 2.944 326 HD22 LEU 39 2HD2 LEU 39 0.479 -7.249 2.036 327 HD23 LEU 39 3HD2 LEU 39 0.438 -7.523 3.776 328 H GLU 40 H GLU 40 -4.573 -10.195 4.221 329 HA GLU 40 HA GLU 40 -5.730 -9.271 1.809 330 HB2 GLU 40 2HB GLU 40 -6.114 -11.541 2.688 331 HB3 GLU 40 3HB GLU 40 -6.970 -10.882 4.082 332 HG2 GLU 40 2HG GLU 40 -8.729 -10.004 2.618 333 HG3 GLU 40 3HG GLU 40 -7.862 -10.582 1.196 334 H GLU 41 H GLU 41 -6.261 -8.395 5.223 335 HA GLU 41 HA GLU 41 -8.583 -6.772 4.672 336 HB2 GLU 41 2HB GLU 41 -6.808 -6.865 7.143 337 HB3 GLU 41 3HB GLU 41 -8.322 -5.969 7.017 338 HG2 GLU 41 2HG GLU 41 -7.968 -8.976 6.914 339 HG3 GLU 41 3HG GLU 41 -8.689 -8.041 8.217 340 H ALA 42 H ALA 42 -5.118 -6.306 4.750 341 HA ALA 42 HA ALA 42 -5.055 -3.452 4.716 342 HB1 ALA 42 1HB ALA 42 -3.036 -5.439 3.614 343 HB2 ALA 42 2HB ALA 42 -3.061 -4.778 5.252 344 HB3 ALA 42 3HB ALA 42 -2.751 -3.717 3.877 345 H ILE 43 H ILE 43 -5.046 -5.962 2.222 346 HA ILE 43 HA ILE 43 -4.943 -4.448 -0.109 347 HB ILE 43 HB ILE 43 -6.299 -7.099 0.518 348 HG12 ILE 43 2HG1 ILE 43 -3.761 -6.546 -1.089 349 HG13 ILE 43 3HG1 ILE 43 -3.775 -6.968 0.619 350 HG21 ILE 43 1HG2 ILE 43 -6.541 -7.557 -1.879 351 HG22 ILE 43 2HG2 ILE 43 -5.978 -5.933 -2.254 352 HG23 ILE 43 3HG2 ILE 43 -7.502 -6.159 -1.400 353 HD11 ILE 43 1HD1 ILE 43 -3.231 -8.892 -0.719 354 HD12 ILE 43 2HD1 ILE 43 -4.717 -8.718 -1.654 355 HD13 ILE 43 3HD1 ILE 43 -4.794 -9.137 0.061 356 H VAL 44 H VAL 44 -8.055 -5.843 1.141 357 HA VAL 44 HA VAL 44 -9.952 -4.368 -0.060 358 HB VAL 44 HB VAL 44 -9.957 -5.177 2.880 359 HG11 VAL 44 1HG1 VAL 44 -11.767 -3.568 2.467 360 HG12 VAL 44 2HG1 VAL 44 -12.431 -5.184 2.717 361 HG13 VAL 44 3HG1 VAL 44 -12.324 -4.520 1.085 362 HG21 VAL 44 1HG2 VAL 44 -9.516 -7.068 1.353 363 HG22 VAL 44 2HG2 VAL 44 -10.963 -6.672 0.423 364 HG23 VAL 44 3HG2 VAL 44 -11.113 -7.226 2.093 365 H VAL 45 H VAL 45 -8.427 -3.240 3.023 366 HA VAL 45 HA VAL 45 -9.754 -0.766 3.217 367 HB VAL 45 HB VAL 45 -7.010 -1.607 4.262 368 HG11 VAL 45 1HG1 VAL 45 -7.060 0.393 5.739 369 HG12 VAL 45 2HG1 VAL 45 -8.507 0.967 4.906 370 HG13 VAL 45 3HG1 VAL 45 -6.975 0.846 4.038 371 HG21 VAL 45 1HG2 VAL 45 -8.190 -1.746 6.443 372 HG22 VAL 45 2HG2 VAL 45 -8.951 -2.786 5.240 373 HG23 VAL 45 3HG2 VAL 45 -9.692 -1.243 5.662 374 H LEU 46 H LEU 46 -6.698 -1.573 1.532 375 HA LEU 46 HA LEU 46 -6.154 1.083 0.626 376 HB2 LEU 46 2HB LEU 46 -5.091 -1.603 -0.278 377 HB3 LEU 46 3HB LEU 46 -4.583 -0.101 -1.033 378 HG LEU 46 HG LEU 46 -4.158 -0.826 1.892 379 HD11 LEU 46 1HD1 LEU 46 -1.791 -1.046 1.319 380 HD12 LEU 46 2HD1 LEU 46 -2.154 -0.741 -0.383 381 HD13 LEU 46 3HD1 LEU 46 -2.777 -2.191 0.410 382 HD21 LEU 46 1HD2 LEU 46 -4.404 1.589 1.618 383 HD22 LEU 46 2HD2 LEU 46 -3.186 1.596 0.338 384 HD23 LEU 46 3HD2 LEU 46 -2.735 1.178 1.994 385 H ARG 47 H ARG 47 -8.124 -1.530 -0.655 386 HA ARG 47 HA ARG 47 -8.581 -0.535 -3.254 387 HB2 ARG 47 2HB ARG 47 -10.328 -2.274 -1.461 388 HB3 ARG 47 3HB ARG 47 -10.748 -1.890 -3.128 389 HG2 ARG 47 2HG ARG 47 -8.792 -3.058 -3.956 390 HG3 ARG 47 3HG ARG 47 -8.203 -3.331 -2.312 391 HD2 ARG 47 2HD ARG 47 -10.088 -4.790 -1.824 392 HD3 ARG 47 3HD ARG 47 -10.834 -4.421 -3.381 393 HE ARG 47 HE ARG 47 -8.387 -5.468 -4.024 394 HH11 ARG 47 1HH1 ARG 47 -11.147 -6.660 -2.155 395 HH12 ARG 47 2HH1 ARG 47 -10.835 -8.321 -2.541 396 HH21 ARG 47 1HH2 ARG 47 -8.020 -7.651 -4.513 397 HH22 ARG 47 2HH2 ARG 47 -9.064 -8.876 -3.878 398 H GLU 48 H GLU 48 -9.750 0.449 -0.154 399 HA GLU 48 HA GLU 48 -11.879 2.176 -1.173 400 HB2 GLU 48 2HB GLU 48 -10.737 1.912 1.644 401 HB3 GLU 48 3HB GLU 48 -12.193 2.808 1.198 402 HG2 GLU 48 2HG GLU 48 -13.236 0.674 0.451 403 HG3 GLU 48 3HG GLU 48 -11.793 -0.196 0.978 404 H GLU 49 H GLU 49 -8.620 2.359 0.194 405 HA GLU 49 HA GLU 49 -8.374 5.132 0.535 406 HB2 GLU 49 2HB GLU 49 -6.187 3.114 -0.145 407 HB3 GLU 49 3HB GLU 49 -5.885 4.758 0.417 408 HG2 GLU 49 2HG GLU 49 -7.280 2.569 1.983 409 HG3 GLU 49 3HG GLU 49 -5.613 3.089 2.207 410 H GLU 50 H GLU 50 -7.335 3.108 -2.179 411 HA GLU 50 HA GLU 50 -6.450 4.990 -3.991 412 HB2 GLU 50 2HB GLU 50 -6.120 2.603 -4.301 413 HB3 GLU 50 3HB GLU 50 -7.844 2.322 -4.468 414 HG2 GLU 50 2HG GLU 50 -6.429 4.106 -6.437 415 HG3 GLU 50 3HG GLU 50 -6.244 2.369 -6.571 416 H LYS 51 H LYS 51 -9.789 3.632 -3.897 417 HA LYS 51 HA LYS 51 -10.774 5.123 -6.034 418 HB2 LYS 51 2HB LYS 51 -12.233 3.770 -3.744 419 HB3 LYS 51 3HB LYS 51 -13.065 4.483 -5.126 420 HG2 LYS 51 2HG LYS 51 -11.825 2.945 -6.639 421 HG3 LYS 51 3HG LYS 51 -11.070 2.193 -5.227 422 HD2 LYS 51 2HD LYS 51 -13.324 1.531 -4.397 423 HD3 LYS 51 3HD LYS 51 -14.062 2.268 -5.822 424 HE2 LYS 51 2HE LYS 51 -12.883 0.652 -7.263 425 HE3 LYS 51 3HE LYS 51 -12.127 -0.068 -5.841 426 HZ1 LYS 51 1HZ LYS 51 -14.330 -0.685 -5.037 427 HZ2 LYS 51 2HZ LYS 51 -14.031 -1.355 -6.557 428 HZ3 LYS 51 3HZ LYS 51 -15.043 -0.013 -6.413 429 H LYS 52 H LYS 52 -10.573 6.043 -2.620 430 HA LYS 52 HA LYS 52 -12.200 8.446 -3.079 431 HB2 LYS 52 2HB LYS 52 -11.944 8.924 -0.698 432 HB3 LYS 52 3HB LYS 52 -12.490 7.272 -0.942 433 HG2 LYS 52 2HG LYS 52 -10.081 6.535 -0.577 434 HG3 LYS 52 3HG LYS 52 -9.726 8.197 -0.095 435 HD2 LYS 52 2HD LYS 52 -10.139 6.801 1.891 436 HD3 LYS 52 3HD LYS 52 -11.402 8.025 1.734 437 HE2 LYS 52 2HE LYS 52 -12.870 6.277 0.672 438 HE3 LYS 52 3HE LYS 52 -11.613 5.084 0.997 439 HZ1 LYS 52 1HZ LYS 52 -13.053 6.677 3.048 440 HZ2 LYS 52 2HZ LYS 52 -11.873 5.507 3.357 441 HZ3 LYS 52 3HZ LYS 52 -13.349 5.057 2.668 442 H ALA 53 H ALA 53 -8.842 7.493 -2.938 443 HA ALA 53 HA ALA 53 -7.721 10.137 -2.791 444 HB1 ALA 53 1HB ALA 53 -5.591 9.019 -3.407 445 HB2 ALA 53 2HB ALA 53 -6.470 7.516 -3.730 446 HB3 ALA 53 3HB ALA 53 -6.410 8.176 -2.091 447 H SER 54 H SER 54 -6.443 11.095 -4.552 448 HA SER 54 HA SER 54 -7.567 10.637 -7.259 449 HB2 SER 54 2HB SER 54 -6.877 13.077 -7.629 450 HB3 SER 54 3HB SER 54 -8.199 12.823 -6.489 451 HG SER 54 HG SER 54 -7.027 13.725 -5.004 452 H GLU 55 H GLU 55 -6.131 10.826 -9.074 453 HA GLU 55 HA GLU 55 -3.602 9.568 -8.723 454 HB2 GLU 55 2HB GLU 55 -4.938 10.809 -11.157 455 HB3 GLU 55 3HB GLU 55 -3.356 10.033 -11.241 456 HG2 GLU 55 2HG GLU 55 -4.381 7.933 -10.380 457 HG3 GLU 55 3HG GLU 55 -5.956 8.725 -10.411 458 HA PRO 56 HA PRO 56 -1.559 9.501 -10.066 459 HB2 PRO 56 2HB PRO 56 1.056 9.597 -9.465 460 HB3 PRO 56 3HB PRO 56 0.380 10.633 -10.743 461 HG2 PRO 56 2HG PRO 56 1.084 11.354 -7.915 462 HG3 PRO 56 3HG PRO 56 1.385 12.259 -9.417 463 HD2 PRO 56 2HD PRO 56 -0.765 12.731 -7.691 464 HD3 PRO 56 3HD PRO 56 -0.717 13.223 -9.397 465 H PHE 57 H PHE 57 -1.707 10.576 -6.778 466 HA PHE 57 HA PHE 57 -0.189 8.544 -5.522 467 HB2 PHE 57 2HB PHE 57 -0.750 10.742 -4.464 468 HB3 PHE 57 3HB PHE 57 -2.417 10.209 -4.279 469 HD1 PHE 57 HD1 PHE 57 1.082 9.168 -3.398 470 HD2 PHE 57 HD2 PHE 57 -3.039 9.198 -2.215 471 HE1 PHE 57 HE1 PHE 57 1.685 8.156 -1.237 472 HE2 PHE 57 HE2 PHE 57 -2.416 8.183 -0.064 473 HZ PHE 57 HZ PHE 57 -0.063 7.656 0.426 474 H LYS 58 H LYS 58 -3.671 8.719 -6.327 475 HA LYS 58 HA LYS 58 -4.427 6.338 -4.995 476 HB2 LYS 58 2HB LYS 58 -6.503 6.659 -5.851 477 HB3 LYS 58 3HB LYS 58 -5.866 8.228 -6.292 478 HG2 LYS 58 2HG LYS 58 -5.462 7.379 -8.592 479 HG3 LYS 58 3HG LYS 58 -6.156 5.828 -8.124 480 HD2 LYS 58 2HD LYS 58 -8.301 6.982 -7.569 481 HD3 LYS 58 3HD LYS 58 -7.603 8.511 -8.115 482 HE2 LYS 58 2HE LYS 58 -9.028 7.554 -9.857 483 HE3 LYS 58 3HE LYS 58 -7.348 7.558 -10.389 484 HZ1 LYS 58 1HZ LYS 58 -8.489 5.484 -10.915 485 HZ2 LYS 58 2HZ LYS 58 -8.774 5.205 -9.273 486 HZ3 LYS 58 3HZ LYS 58 -7.195 5.224 -9.863 487 H THR 59 H THR 59 -2.613 6.786 -7.915 488 HA THR 59 HA THR 59 -3.033 4.084 -8.872 489 HB THR 59 HB THR 59 -0.985 6.153 -9.798 490 HG1 THR 59 HG1 THR 59 -3.672 5.641 -10.600 491 HG21 THR 59 1HG2 THR 59 -1.005 4.858 -11.912 492 HG22 THR 59 2HG2 THR 59 -2.107 3.690 -11.181 493 HG23 THR 59 3HG2 THR 59 -0.463 3.860 -10.559 494 H ASP 60 H ASP 60 -0.486 6.031 -7.408 495 HA ASP 60 HA ASP 60 1.529 4.161 -6.997 496 HB2 ASP 60 2HB ASP 60 0.739 6.434 -5.115 497 HB3 ASP 60 3HB ASP 60 2.316 5.644 -5.178 498 H ILE 61 H ILE 61 -1.344 4.783 -4.992 499 HA ILE 61 HA ILE 61 -0.923 2.907 -2.959 500 HB ILE 61 HB ILE 61 -3.550 3.905 -4.146 501 HG12 ILE 61 2HG1 ILE 61 -2.141 4.673 -1.548 502 HG13 ILE 61 3HG1 ILE 61 -2.127 5.626 -3.025 503 HG21 ILE 61 1HG2 ILE 61 -3.200 2.273 -1.600 504 HG22 ILE 61 2HG2 ILE 61 -4.000 1.739 -3.078 505 HG23 ILE 61 3HG2 ILE 61 -4.705 3.042 -2.125 506 HD11 ILE 61 1HD1 ILE 61 -4.571 4.989 -1.371 507 HD12 ILE 61 2HD1 ILE 61 -4.541 5.953 -2.852 508 HD13 ILE 61 3HD1 ILE 61 -3.697 6.520 -1.413 509 H ARG 62 H ARG 62 -2.766 2.483 -6.077 510 HA ARG 62 HA ARG 62 -3.259 -0.272 -5.492 511 HB2 ARG 62 2HB ARG 62 -4.375 -0.426 -7.653 512 HB3 ARG 62 3HB ARG 62 -4.898 0.980 -6.749 513 HG2 ARG 62 2HG ARG 62 -4.777 1.762 -8.932 514 HG3 ARG 62 3HG ARG 62 -3.257 2.318 -8.236 515 HD2 ARG 62 2HD ARG 62 -3.070 1.375 -10.559 516 HD3 ARG 62 3HD ARG 62 -2.028 0.575 -9.374 517 HE ARG 62 HE ARG 62 -4.498 -0.786 -9.548 518 HH11 ARG 62 1HH1 ARG 62 -1.600 -0.327 -11.502 519 HH12 ARG 62 2HH1 ARG 62 -1.773 -1.854 -12.301 520 HH21 ARG 62 1HH2 ARG 62 -4.674 -2.785 -10.553 521 HH22 ARG 62 2HH2 ARG 62 -3.519 -3.255 -11.761 522 H ILE 63 H ILE 63 -0.604 1.256 -7.161 523 HA ILE 63 HA ILE 63 0.454 -1.024 -8.471 524 HB ILE 63 HB ILE 63 1.927 1.426 -7.394 525 HG12 ILE 63 2HG1 ILE 63 1.040 0.811 -10.252 526 HG13 ILE 63 3HG1 ILE 63 0.200 1.898 -9.157 527 HG21 ILE 63 1HG2 ILE 63 2.947 -0.676 -9.341 528 HG22 ILE 63 2HG2 ILE 63 3.511 -0.427 -7.688 529 HG23 ILE 63 3HG2 ILE 63 3.789 0.816 -8.906 530 HD11 ILE 63 1HD1 ILE 63 3.007 2.290 -10.201 531 HD12 ILE 63 2HD1 ILE 63 2.145 3.373 -9.102 532 HD13 ILE 63 3HD1 ILE 63 1.552 3.128 -10.743 533 H LEU 64 H LEU 64 0.871 0.324 -5.225 534 HA LEU 64 HA LEU 64 2.658 -1.609 -4.163 535 HB2 LEU 64 2HB LEU 64 2.201 0.654 -3.185 536 HB3 LEU 64 3HB LEU 64 0.569 0.135 -2.801 537 HG LEU 64 HG LEU 64 1.639 -1.662 -1.295 538 HD11 LEU 64 1HD1 LEU 64 4.096 0.066 -1.667 539 HD12 LEU 64 2HD1 LEU 64 3.895 -1.608 -2.193 540 HD13 LEU 64 3HD1 LEU 64 3.899 -1.223 -0.476 541 HD21 LEU 64 1HD2 LEU 64 1.903 -0.128 0.581 542 HD22 LEU 64 2HD2 LEU 64 0.510 0.318 -0.399 543 HD23 LEU 64 3HD2 LEU 64 2.009 1.245 -0.525 544 H LEU 65 H LEU 65 -0.836 -1.200 -4.114 545 HA LEU 65 HA LEU 65 -1.671 -3.224 -2.406 546 HB2 LEU 65 2HB LEU 65 -2.871 -1.161 -3.415 547 HB3 LEU 65 3HB LEU 65 -3.192 -2.159 -4.811 548 HG LEU 65 HG LEU 65 -4.326 -2.512 -2.010 549 HD11 LEU 65 1HD1 LEU 65 -5.642 -1.727 -4.639 550 HD12 LEU 65 2HD1 LEU 65 -5.315 -0.660 -3.270 551 HD13 LEU 65 3HD1 LEU 65 -6.478 -1.972 -3.099 552 HD21 LEU 65 1HD2 LEU 65 -5.742 -4.299 -2.937 553 HD22 LEU 65 2HD2 LEU 65 -4.035 -4.727 -2.973 554 HD23 LEU 65 3HD2 LEU 65 -4.844 -4.221 -4.457 555 H ASP 66 H ASP 66 -2.196 -3.312 -5.957 556 HA ASP 66 HA ASP 66 -2.664 -5.885 -6.488 557 HB2 ASP 66 2HB ASP 66 -2.692 -4.165 -8.200 558 HB3 ASP 66 3HB ASP 66 -0.947 -3.954 -8.092 559 H PHE 67 H PHE 67 0.683 -4.555 -6.310 560 HA PHE 67 HA PHE 67 2.119 -6.874 -6.815 561 HB2 PHE 67 2HB PHE 67 3.155 -4.596 -6.563 562 HB3 PHE 67 3HB PHE 67 2.921 -4.698 -4.820 563 HD1 PHE 67 HD1 PHE 67 4.794 -6.095 -7.697 564 HD2 PHE 67 HD2 PHE 67 4.408 -6.051 -3.435 565 HE1 PHE 67 HE1 PHE 67 6.908 -7.332 -7.479 566 HE2 PHE 67 HE2 PHE 67 6.520 -7.285 -3.231 567 HZ PHE 67 HZ PHE 67 7.768 -7.931 -5.251 568 H LEU 68 H LEU 68 0.763 -5.786 -3.666 569 HA LEU 68 HA LEU 68 1.699 -7.878 -2.014 570 HB2 LEU 68 2HB LEU 68 -0.930 -6.367 -1.808 571 HB3 LEU 68 3HB LEU 68 -0.228 -7.341 -0.524 572 HG LEU 68 HG LEU 68 1.108 -4.856 -1.665 573 HD11 LEU 68 1HD1 LEU 68 -1.037 -4.252 -0.653 574 HD12 LEU 68 2HD1 LEU 68 0.316 -3.665 0.309 575 HD13 LEU 68 3HD1 LEU 68 -0.584 -5.091 0.837 576 HD21 LEU 68 1HD2 LEU 68 2.467 -4.958 0.389 577 HD22 LEU 68 2HD2 LEU 68 2.669 -6.403 -0.595 578 HD23 LEU 68 3HD2 LEU 68 1.660 -6.462 0.854 579 H GLU 69 H GLU 69 -1.188 -7.628 -4.055 580 HA GLU 69 HA GLU 69 -2.422 -10.086 -3.364 581 HB2 GLU 69 2HB GLU 69 -2.677 -8.478 -5.940 582 HB3 GLU 69 3HB GLU 69 -3.786 -9.733 -5.391 583 HG2 GLU 69 2HG GLU 69 -4.363 -8.332 -3.423 584 HG3 GLU 69 3HG GLU 69 -3.296 -7.064 -4.028 585 H SER 70 H SER 70 0.102 -9.211 -5.589 586 HA SER 70 HA SER 70 1.356 -10.253 -7.140 587 HB2 SER 70 2HB SER 70 2.405 -12.400 -6.345 588 HB3 SER 70 3HB SER 70 2.436 -11.106 -5.149 589 HG SER 70 HG SER 70 0.454 -13.132 -5.219 590 H LYS 71 H LYS 71 -1.178 -10.282 -8.030 591 HA LYS 71 HA LYS 71 -2.170 -12.916 -8.630 592 HB2 LYS 71 2HB LYS 71 -3.975 -11.805 -9.847 593 HB3 LYS 71 3HB LYS 71 -3.738 -11.046 -8.279 594 HG2 LYS 71 2HG LYS 71 -2.702 -9.109 -9.274 595 HG3 LYS 71 3HG LYS 71 -2.591 -9.909 -10.844 596 HD2 LYS 71 2HD LYS 71 -4.415 -8.328 -10.927 597 HD3 LYS 71 3HD LYS 71 -5.091 -9.958 -10.962 598 HE2 LYS 71 2HE LYS 71 -6.459 -8.636 -9.491 599 HE3 LYS 71 3HE LYS 71 -5.519 -9.719 -8.462 600 HZ1 LYS 71 1HZ LYS 71 -5.079 -6.825 -8.940 601 HZ2 LYS 71 2HZ LYS 71 -3.918 -7.794 -8.202 602 HZ3 LYS 71 3HZ LYS 71 -5.430 -7.588 -7.478 603 HA PRO 72 HA PRO 72 0.003 -13.502 -12.579 604 HB2 PRO 72 2HB PRO 72 -2.096 -15.499 -13.279 605 HB3 PRO 72 3HB PRO 72 -0.363 -15.757 -12.994 606 HG2 PRO 72 2HG PRO 72 -2.209 -16.642 -11.247 607 HG3 PRO 72 3HG PRO 72 -0.630 -16.027 -10.704 608 HD2 PRO 72 2HD PRO 72 -3.288 -14.579 -10.748 609 HD3 PRO 72 3HD PRO 72 -2.075 -14.665 -9.447 Start of MODEL 11 1 H GLY 1 1H GLY 1 2.304 -5.104 17.265 2 HA2 GLY 1 2HA GLY 1 3.588 -3.944 15.573 3 HA3 GLY 1 3HA GLY 1 4.973 -4.963 15.962 4 H SER 2 H SER 2 2.317 -4.635 13.929 5 HA SER 2 HA SER 2 1.664 -7.386 13.472 6 HB2 SER 2 2HB SER 2 1.136 -4.932 11.739 7 HB3 SER 2 3HB SER 2 0.357 -6.508 11.569 8 HG SER 2 HG SER 2 -0.914 -5.033 12.761 9 H VAL 3 H VAL 3 2.606 -8.799 12.132 10 HA VAL 3 HA VAL 3 4.979 -8.410 10.650 11 HB VAL 3 HB VAL 3 4.145 -10.609 11.536 12 HG11 VAL 3 1HG1 VAL 3 1.785 -10.443 10.915 13 HG12 VAL 3 2HG1 VAL 3 2.494 -11.934 10.296 14 HG13 VAL 3 3HG1 VAL 3 2.202 -10.578 9.204 15 HG21 VAL 3 1HG2 VAL 3 5.969 -10.603 9.883 16 HG22 VAL 3 2HG2 VAL 3 4.800 -10.688 8.564 17 HG23 VAL 3 3HG2 VAL 3 4.952 -12.036 9.695 18 H VAL 4 H VAL 4 1.837 -7.475 9.930 19 HA VAL 4 HA VAL 4 1.692 -7.727 7.104 20 HB VAL 4 HB VAL 4 0.300 -5.608 8.813 21 HG11 VAL 4 1HG1 VAL 4 0.131 -5.197 6.409 22 HG12 VAL 4 2HG1 VAL 4 -1.438 -5.698 7.040 23 HG13 VAL 4 3HG1 VAL 4 -0.445 -6.842 6.138 24 HG21 VAL 4 1HG2 VAL 4 -0.104 -7.831 9.805 25 HG22 VAL 4 2HG2 VAL 4 -0.649 -8.446 8.244 26 HG23 VAL 4 3HG2 VAL 4 -1.580 -7.194 9.072 27 H LYS 5 H LYS 5 3.054 -5.305 9.301 28 HA LYS 5 HA LYS 5 3.259 -3.110 7.598 29 HB2 LYS 5 2HB LYS 5 3.661 -2.966 10.058 30 HB3 LYS 5 3HB LYS 5 5.195 -3.809 9.849 31 HG2 LYS 5 2HG LYS 5 6.056 -1.959 8.468 32 HG3 LYS 5 3HG LYS 5 4.504 -1.123 8.591 33 HD2 LYS 5 2HD LYS 5 4.831 -0.911 11.052 34 HD3 LYS 5 3HD LYS 5 6.392 -1.727 10.909 35 HE2 LYS 5 2HE LYS 5 7.229 0.102 9.489 36 HE3 LYS 5 3HE LYS 5 5.663 0.912 9.587 37 HZ1 LYS 5 1HZ LYS 5 7.272 1.851 11.133 38 HZ2 LYS 5 2HZ LYS 5 7.448 0.355 11.897 39 HZ3 LYS 5 3HZ LYS 5 5.970 1.161 11.957 40 H GLU 6 H GLU 6 5.888 -5.454 8.360 41 HA GLU 6 HA GLU 6 7.814 -4.569 6.599 42 HB2 GLU 6 2HB GLU 6 8.856 -6.789 6.874 43 HB3 GLU 6 3HB GLU 6 8.258 -6.173 8.411 44 HG2 GLU 6 2HG GLU 6 6.201 -7.620 8.063 45 HG3 GLU 6 3HG GLU 6 7.038 -8.350 6.699 46 H LYS 7 H LYS 7 5.165 -6.891 6.021 47 HA LYS 7 HA LYS 7 5.796 -7.760 3.427 48 HB2 LYS 7 2HB LYS 7 3.003 -7.202 4.523 49 HB3 LYS 7 3HB LYS 7 3.381 -8.223 3.140 50 HG2 LYS 7 2HG LYS 7 4.502 -9.838 4.591 51 HG3 LYS 7 3HG LYS 7 4.238 -8.788 5.990 52 HD2 LYS 7 2HD LYS 7 1.724 -8.996 5.497 53 HD3 LYS 7 3HD LYS 7 2.150 -10.269 4.349 54 HE2 LYS 7 2HE LYS 7 2.678 -10.281 7.333 55 HE3 LYS 7 3HE LYS 7 1.459 -11.227 6.477 56 HZ1 LYS 7 1HZ LYS 7 4.387 -11.482 6.072 57 HZ2 LYS 7 2HZ LYS 7 3.186 -12.451 5.380 58 HZ3 LYS 7 3HZ LYS 7 3.459 -12.500 7.046 59 H LEU 8 H LEU 8 3.913 -4.952 4.497 60 HA LEU 8 HA LEU 8 3.247 -3.895 1.939 61 HB2 LEU 8 2HB LEU 8 3.338 -2.540 4.665 62 HB3 LEU 8 3HB LEU 8 2.589 -1.852 3.233 63 HG LEU 8 HG LEU 8 1.666 -4.426 4.564 64 HD11 LEU 8 1HD1 LEU 8 -0.215 -3.145 5.462 65 HD12 LEU 8 2HD1 LEU 8 0.461 -1.654 4.800 66 HD13 LEU 8 3HD1 LEU 8 1.319 -2.526 6.072 67 HD21 LEU 8 1HD2 LEU 8 0.372 -2.745 2.393 68 HD22 LEU 8 2HD2 LEU 8 -0.336 -4.170 3.162 69 HD23 LEU 8 3HD2 LEU 8 1.120 -4.333 2.186 70 H GLU 9 H GLU 9 6.031 -3.538 4.060 71 HA GLU 9 HA GLU 9 7.085 -1.194 2.696 72 HB2 GLU 9 2HB GLU 9 8.275 -2.877 4.939 73 HB3 GLU 9 3HB GLU 9 9.034 -1.438 4.253 74 HG2 GLU 9 2HG GLU 9 6.977 -0.129 4.915 75 HG3 GLU 9 3HG GLU 9 6.412 -1.565 5.767 76 H LYS 10 H LYS 10 7.646 -4.695 2.653 77 HA LYS 10 HA LYS 10 9.913 -4.621 0.914 78 HB2 LYS 10 2HB LYS 10 7.865 -6.843 1.361 79 HB3 LYS 10 3HB LYS 10 9.353 -7.031 0.441 80 HG2 LYS 10 2HG LYS 10 9.155 -6.423 3.402 81 HG3 LYS 10 3HG LYS 10 9.553 -7.984 2.689 82 HD2 LYS 10 2HD LYS 10 11.635 -7.002 1.742 83 HD3 LYS 10 3HD LYS 10 11.225 -5.445 2.468 84 HE2 LYS 10 2HE LYS 10 11.407 -6.395 4.710 85 HE3 LYS 10 3HE LYS 10 11.685 -8.008 4.041 86 HZ1 LYS 10 1HZ LYS 10 13.736 -6.892 4.753 87 HZ2 LYS 10 2HZ LYS 10 13.471 -5.674 3.614 88 HZ3 LYS 10 3HZ LYS 10 13.751 -7.259 3.105 89 H ALA 11 H ALA 11 6.439 -4.615 0.547 90 HA ALA 11 HA ALA 11 6.251 -4.889 -2.258 91 HB1 ALA 11 1HB ALA 11 3.994 -3.932 -1.996 92 HB2 ALA 11 2HB ALA 11 4.385 -3.444 -0.344 93 HB3 ALA 11 3HB ALA 11 4.313 -5.156 -0.766 94 H LEU 12 H LEU 12 6.289 -1.990 -0.148 95 HA LEU 12 HA LEU 12 6.369 0.094 -1.903 96 HB2 LEU 12 2HB LEU 12 7.811 -0.316 0.733 97 HB3 LEU 12 3HB LEU 12 7.973 1.195 -0.140 98 HG LEU 12 HG LEU 12 5.316 0.093 0.865 99 HD11 LEU 12 1HD1 LEU 12 5.473 1.779 2.641 100 HD12 LEU 12 2HD1 LEU 12 7.078 2.252 2.076 101 HD13 LEU 12 3HD1 LEU 12 6.813 0.639 2.740 102 HD21 LEU 12 1HD2 LEU 12 4.472 2.363 0.391 103 HD22 LEU 12 2HD2 LEU 12 5.070 1.584 -1.072 104 HD23 LEU 12 3HD2 LEU 12 6.046 2.819 -0.272 105 H ILE 13 H ILE 13 9.317 -1.588 -0.681 106 HA ILE 13 HA ILE 13 11.219 -0.071 -2.048 107 HB ILE 13 HB ILE 13 11.402 -2.927 -0.971 108 HG12 ILE 13 2HG1 ILE 13 12.269 -0.281 0.298 109 HG13 ILE 13 3HG1 ILE 13 10.826 -1.184 0.728 110 HG21 ILE 13 1HG2 ILE 13 13.693 -1.090 -1.769 111 HG22 ILE 13 2HG2 ILE 13 13.211 -2.572 -2.598 112 HG23 ILE 13 3HG2 ILE 13 13.862 -2.650 -0.961 113 HD11 ILE 13 1HD1 ILE 13 12.573 -1.518 2.358 114 HD12 ILE 13 2HD1 ILE 13 13.668 -2.114 1.112 115 HD13 ILE 13 3HD1 ILE 13 12.216 -3.031 1.528 116 H GLU 14 H GLU 14 9.806 -3.245 -2.923 117 HA GLU 14 HA GLU 14 11.267 -3.676 -5.276 118 HB2 GLU 14 2HB GLU 14 8.504 -4.663 -4.495 119 HB3 GLU 14 3HB GLU 14 9.406 -5.269 -5.878 120 HG2 GLU 14 2HG GLU 14 10.132 -5.528 -2.953 121 HG3 GLU 14 3HG GLU 14 9.664 -6.817 -4.057 122 H VAL 15 H VAL 15 8.308 -1.794 -4.741 123 HA VAL 15 HA VAL 15 8.107 -1.271 -7.646 124 HB VAL 15 HB VAL 15 5.857 -0.451 -7.287 125 HG11 VAL 15 1HG1 VAL 15 6.254 -3.107 -5.861 126 HG12 VAL 15 2HG1 VAL 15 6.091 -2.866 -7.602 127 HG13 VAL 15 3HG1 VAL 15 4.730 -2.518 -6.536 128 HG21 VAL 15 1HG2 VAL 15 6.075 0.648 -5.126 129 HG22 VAL 15 2HG2 VAL 15 6.305 -0.898 -4.317 130 HG23 VAL 15 3HG2 VAL 15 4.748 -0.513 -5.051 131 H ARG 16 H ARG 16 9.689 0.037 -5.118 132 HA ARG 16 HA ARG 16 9.229 2.756 -5.013 133 HB2 ARG 16 2HB ARG 16 10.902 1.724 -3.570 134 HB3 ARG 16 3HB ARG 16 11.939 1.372 -4.950 135 HG2 ARG 16 2HG ARG 16 12.154 3.866 -5.334 136 HG3 ARG 16 3HG ARG 16 11.268 4.116 -3.828 137 HD2 ARG 16 2HD ARG 16 13.697 4.324 -3.508 138 HD3 ARG 16 3HD ARG 16 13.033 2.982 -2.581 139 HE ARG 16 HE ARG 16 14.243 1.501 -3.852 140 HH11 ARG 16 1HH1 ARG 16 14.451 4.668 -5.404 141 HH12 ARG 16 2HH1 ARG 16 15.687 4.164 -6.511 142 HH21 ARG 16 1HH2 ARG 16 15.839 0.871 -5.325 143 HH22 ARG 16 2HH2 ARG 16 16.477 2.013 -6.467 144 HA PRO 17 HA PRO 17 12.049 3.594 -9.004 145 HB2 PRO 17 2HB PRO 17 11.704 1.021 -10.525 146 HB3 PRO 17 3HB PRO 17 13.158 2.028 -10.325 147 HG2 PRO 17 2HG PRO 17 12.961 -0.292 -9.038 148 HG3 PRO 17 3HG PRO 17 13.671 1.125 -8.227 149 HD2 PRO 17 2HD PRO 17 10.886 -0.006 -7.954 150 HD3 PRO 17 3HD PRO 17 12.016 0.531 -6.689 151 H TYR 18 H TYR 18 9.009 2.057 -8.744 152 HA TYR 18 HA TYR 18 7.999 3.156 -11.291 153 HB2 TYR 18 2HB TYR 18 6.696 1.101 -9.451 154 HB3 TYR 18 3HB TYR 18 6.147 1.567 -11.057 155 HD1 TYR 18 HD1 TYR 18 7.404 0.791 -13.095 156 HD2 TYR 18 HD2 TYR 18 8.562 -0.449 -9.172 157 HE1 TYR 18 HE1 TYR 18 8.771 -1.013 -14.061 158 HE2 TYR 18 HE2 TYR 18 9.923 -2.247 -10.134 159 HH TYR 18 HH TYR 18 10.032 -3.572 -12.234 160 H VAL 19 H VAL 19 7.551 3.363 -7.754 161 HA VAL 19 HA VAL 19 5.046 4.887 -8.112 162 HB VAL 19 HB VAL 19 4.695 4.708 -5.662 163 HG11 VAL 19 1HG1 VAL 19 3.712 3.031 -7.144 164 HG12 VAL 19 2HG1 VAL 19 4.138 2.316 -5.589 165 HG13 VAL 19 3HG1 VAL 19 5.155 2.021 -7.003 166 HG21 VAL 19 1HG2 VAL 19 7.209 2.996 -5.609 167 HG22 VAL 19 2HG2 VAL 19 6.084 3.213 -4.264 168 HG23 VAL 19 3HG2 VAL 19 7.011 4.586 -4.869 169 H GLU 20 H GLU 20 4.871 6.944 -7.851 170 HA GLU 20 HA GLU 20 6.888 8.665 -6.605 171 HB2 GLU 20 2HB GLU 20 5.687 9.398 -8.678 172 HB3 GLU 20 3HB GLU 20 4.146 9.284 -7.835 173 HG2 GLU 20 2HG GLU 20 4.883 11.623 -8.048 174 HG3 GLU 20 3HG GLU 20 4.780 11.139 -6.360 175 H TYR 21 H TYR 21 6.133 10.130 -4.791 176 HA TYR 21 HA TYR 21 5.289 10.543 -2.729 177 HB2 TYR 21 2HB TYR 21 2.863 8.952 -3.696 178 HB3 TYR 21 3HB TYR 21 2.894 9.983 -2.272 179 HD1 TYR 21 HD1 TYR 21 3.848 12.503 -2.884 180 HD2 TYR 21 HD2 TYR 21 1.770 9.886 -5.548 181 HE1 TYR 21 HE1 TYR 21 3.143 14.427 -4.237 182 HE2 TYR 21 HE2 TYR 21 1.078 11.810 -6.894 183 HH TYR 21 HH TYR 21 0.721 14.244 -6.559 184 H TYR 22 H TYR 22 6.969 8.334 -3.175 185 HA TYR 22 HA TYR 22 6.444 5.887 -2.096 186 HB2 TYR 22 2HB TYR 22 8.640 6.593 -3.106 187 HB3 TYR 22 3HB TYR 22 9.029 7.437 -1.608 188 HD1 TYR 22 HD1 TYR 22 8.385 4.101 -3.089 189 HD2 TYR 22 HD2 TYR 22 9.889 6.184 0.326 190 HE1 TYR 22 HE1 TYR 22 9.261 2.007 -2.190 191 HE2 TYR 22 HE2 TYR 22 10.763 4.065 1.229 192 HH TYR 22 HH TYR 22 10.133 1.523 0.896 193 H ASN 23 H ASN 23 7.305 8.817 -0.311 194 HA ASN 23 HA ASN 23 7.370 7.527 2.288 195 HB2 ASN 23 2HB ASN 23 7.740 10.418 1.417 196 HB3 ASN 23 3HB ASN 23 7.777 9.917 3.106 197 HD21 ASN 23 1HD2 ASN 23 9.932 10.681 3.239 198 HD22 ASN 23 2HD2 ASN 23 11.251 9.774 2.587 199 H GLU 24 H GLU 24 4.921 9.005 0.393 200 HA GLU 24 HA GLU 24 3.279 9.877 2.640 201 HB2 GLU 24 2HB GLU 24 2.481 9.734 -0.304 202 HB3 GLU 24 3HB GLU 24 1.742 10.700 0.966 203 HG2 GLU 24 2HG GLU 24 4.459 11.120 -0.302 204 HG3 GLU 24 3HG GLU 24 3.040 12.148 -0.479 205 H LEU 25 H LEU 25 3.175 7.475 0.014 206 HA LEU 25 HA LEU 25 1.064 5.880 0.964 207 HB2 LEU 25 2HB LEU 25 1.879 5.864 -1.364 208 HB3 LEU 25 3HB LEU 25 3.425 5.218 -0.840 209 HG LEU 25 HG LEU 25 2.345 3.090 -0.190 210 HD11 LEU 25 1HD1 LEU 25 0.124 3.861 0.461 211 HD12 LEU 25 2HD1 LEU 25 0.009 2.592 -0.754 212 HD13 LEU 25 3HD1 LEU 25 -0.253 4.275 -1.216 213 HD21 LEU 25 1HD2 LEU 25 1.694 3.936 -3.029 214 HD22 LEU 25 2HD2 LEU 25 1.826 2.273 -2.448 215 HD23 LEU 25 3HD2 LEU 25 3.244 3.319 -2.448 216 H LYS 26 H LYS 26 4.570 5.793 1.462 217 HA LYS 26 HA LYS 26 4.784 3.581 3.181 218 HB2 LYS 26 2HB LYS 26 6.743 4.777 2.300 219 HB3 LYS 26 3HB LYS 26 6.359 6.183 3.283 220 HG2 LYS 26 2HG LYS 26 6.832 4.925 5.327 221 HG3 LYS 26 3HG LYS 26 7.115 3.456 4.383 222 HD2 LYS 26 2HD LYS 26 9.049 4.507 3.283 223 HD3 LYS 26 3HD LYS 26 8.751 6.016 4.155 224 HE2 LYS 26 2HE LYS 26 10.590 4.667 5.146 225 HE3 LYS 26 3HE LYS 26 9.264 4.939 6.277 226 HZ1 LYS 26 1HZ LYS 26 10.157 2.637 6.250 227 HZ2 LYS 26 2HZ LYS 26 9.579 2.461 4.674 228 HZ3 LYS 26 3HZ LYS 26 8.496 2.724 5.938 229 H ALA 27 H ALA 27 3.629 6.880 3.917 230 HA ALA 27 HA ALA 27 3.579 6.559 6.764 231 HB1 ALA 27 1HB ALA 27 3.690 8.789 5.714 232 HB2 ALA 27 2HB ALA 27 2.273 8.650 6.759 233 HB3 ALA 27 3HB ALA 27 2.094 8.546 5.004 234 H LEU 28 H LEU 28 1.325 6.064 4.093 235 HA LEU 28 HA LEU 28 -1.007 5.490 5.587 236 HB2 LEU 28 2HB LEU 28 -1.030 6.202 3.228 237 HB3 LEU 28 3HB LEU 28 -0.172 4.744 2.760 238 HG LEU 28 HG LEU 28 -2.131 3.362 3.333 239 HD11 LEU 28 1HD1 LEU 28 -3.528 5.942 4.103 240 HD12 LEU 28 2HD1 LEU 28 -3.065 4.628 5.189 241 HD13 LEU 28 3HD1 LEU 28 -4.287 4.356 3.951 242 HD21 LEU 28 1HD2 LEU 28 -1.941 4.250 1.052 243 HD22 LEU 28 2HD2 LEU 28 -2.867 5.682 1.513 244 HD23 LEU 28 3HD2 LEU 28 -3.626 4.089 1.539 245 H VAL 29 H VAL 29 1.544 3.486 4.160 246 HA VAL 29 HA VAL 29 0.795 0.901 4.838 247 HB VAL 29 HB VAL 29 3.401 2.322 4.369 248 HG11 VAL 29 1HG1 VAL 29 4.762 0.266 4.644 249 HG12 VAL 29 2HG1 VAL 29 3.368 -0.530 5.379 250 HG13 VAL 29 3HG1 VAL 29 4.110 0.868 6.181 251 HG21 VAL 29 1HG2 VAL 29 3.607 0.747 2.496 252 HG22 VAL 29 2HG2 VAL 29 2.062 1.603 2.464 253 HG23 VAL 29 3HG2 VAL 29 2.134 -0.066 3.031 254 H SER 30 H SER 30 2.533 3.298 6.720 255 HA SER 30 HA SER 30 3.034 1.537 8.961 256 HB2 SER 30 2HB SER 30 3.490 4.508 8.552 257 HB3 SER 30 3HB SER 30 3.991 3.623 9.996 258 HG SER 30 HG SER 30 4.938 3.414 7.353 259 H LYS 31 H LYS 31 0.471 3.644 8.022 260 HA LYS 31 HA LYS 31 -0.779 3.936 10.609 261 HB2 LYS 31 2HB LYS 31 -1.172 5.666 8.958 262 HB3 LYS 31 3HB LYS 31 -1.639 4.488 7.739 263 HG2 LYS 31 2HG LYS 31 -3.696 3.975 9.083 264 HG3 LYS 31 3HG LYS 31 -3.245 5.268 10.200 265 HD2 LYS 31 2HD LYS 31 -3.419 6.929 8.398 266 HD3 LYS 31 3HD LYS 31 -3.733 5.651 7.217 267 HE2 LYS 31 2HE LYS 31 -5.815 6.788 7.828 268 HE3 LYS 31 3HE LYS 31 -5.852 5.110 8.370 269 HZ1 LYS 31 1HZ LYS 31 -5.342 5.842 10.606 270 HZ2 LYS 31 2HZ LYS 31 -6.708 6.652 10.036 271 HZ3 LYS 31 3HZ LYS 31 -5.222 7.451 10.094 272 H ILE 32 H ILE 32 -1.484 2.081 7.620 273 HA ILE 32 HA ILE 32 -3.877 0.915 8.620 274 HB ILE 32 HB ILE 32 -3.958 -0.405 6.517 275 HG12 ILE 32 2HG1 ILE 32 -1.187 0.761 5.962 276 HG13 ILE 32 3HG1 ILE 32 -1.567 -0.932 6.219 277 HG21 ILE 32 1HG2 ILE 32 -4.796 1.908 6.505 278 HG22 ILE 32 2HG2 ILE 32 -4.108 1.488 4.937 279 HG23 ILE 32 3HG2 ILE 32 -3.195 2.504 6.055 280 HD11 ILE 32 1HD1 ILE 32 -2.774 -1.008 4.115 281 HD12 ILE 32 2HD1 ILE 32 -1.128 -0.415 3.884 282 HD13 ILE 32 3HD1 ILE 32 -2.480 0.716 3.858 283 H SER 33 H SER 33 -0.602 -0.407 8.090 284 HA SER 33 HA SER 33 -0.809 -3.008 8.814 285 HB2 SER 33 2HB SER 33 1.508 -2.807 9.748 286 HB3 SER 33 3HB SER 33 1.306 -2.017 8.182 287 HG SER 33 HG SER 33 1.904 -0.235 9.098 288 H SER 34 H SER 34 -0.892 -0.283 11.087 289 HA SER 34 HA SER 34 -0.860 -1.886 13.490 290 HB2 SER 34 2HB SER 34 0.052 0.421 13.449 291 HB3 SER 34 3HB SER 34 -1.554 1.063 13.107 292 HG SER 34 HG SER 34 -1.275 -0.590 15.339 293 H SER 35 H SER 35 -3.240 -0.517 11.378 294 HA SER 35 HA SER 35 -5.512 -0.796 13.150 295 HB2 SER 35 2HB SER 35 -5.415 -0.196 10.156 296 HB3 SER 35 3HB SER 35 -6.807 0.034 11.223 297 HG SER 35 HG SER 35 -4.409 1.283 11.950 298 H VAL 36 H VAL 36 -4.099 -2.654 10.497 299 HA VAL 36 HA VAL 36 -6.249 -4.647 10.494 300 HB VAL 36 HB VAL 36 -5.233 -5.540 8.479 301 HG11 VAL 36 1HG1 VAL 36 -6.690 -3.588 8.186 302 HG12 VAL 36 2HG1 VAL 36 -5.424 -3.591 6.961 303 HG13 VAL 36 3HG1 VAL 36 -5.309 -2.496 8.345 304 HG21 VAL 36 1HG2 VAL 36 -2.936 -3.596 8.897 305 HG22 VAL 36 2HG2 VAL 36 -3.180 -4.578 7.448 306 HG23 VAL 36 3HG2 VAL 36 -2.860 -5.355 8.999 307 H ASN 37 H ASN 37 -5.823 -6.845 10.751 308 HA ASN 37 HA ASN 37 -3.622 -7.517 12.614 309 HB2 ASN 37 2HB ASN 37 -6.053 -9.244 11.920 310 HB3 ASN 37 3HB ASN 37 -4.929 -9.477 13.256 311 HD21 ASN 37 1HD2 ASN 37 -7.564 -7.547 12.029 312 HD22 ASN 37 2HD2 ASN 37 -8.000 -6.805 13.530 313 H ASP 38 H ASP 38 -4.910 -8.198 9.406 314 HA ASP 38 HA ASP 38 -2.673 -10.012 8.793 315 HB2 ASP 38 2HB ASP 38 -5.633 -10.512 8.257 316 HB3 ASP 38 3HB ASP 38 -4.377 -11.310 7.315 317 H LEU 39 H LEU 39 -2.439 -10.321 6.424 318 HA LEU 39 HA LEU 39 -2.058 -7.749 5.215 319 HB2 LEU 39 2HB LEU 39 -0.473 -9.727 5.111 320 HB3 LEU 39 3HB LEU 39 -1.594 -10.518 4.032 321 HG LEU 39 HG LEU 39 0.497 -9.426 2.990 322 HD11 LEU 39 1HD1 LEU 39 -1.324 -10.176 1.591 323 HD12 LEU 39 2HD1 LEU 39 -0.569 -8.719 0.950 324 HD13 LEU 39 3HD1 LEU 39 -2.128 -8.616 1.772 325 HD21 LEU 39 1HD2 LEU 39 0.452 -7.034 2.501 326 HD22 LEU 39 2HD2 LEU 39 0.468 -7.316 4.241 327 HD23 LEU 39 3HD2 LEU 39 -1.034 -6.850 3.438 328 H GLU 40 H GLU 40 -4.411 -10.321 4.936 329 HA GLU 40 HA GLU 40 -5.704 -9.719 2.527 330 HB2 GLU 40 2HB GLU 40 -6.166 -11.754 3.837 331 HB3 GLU 40 3HB GLU 40 -6.876 -10.793 5.131 332 HG2 GLU 40 2HG GLU 40 -8.689 -10.081 3.615 333 HG3 GLU 40 3HG GLU 40 -7.968 -11.014 2.304 334 H GLU 41 H GLU 41 -5.940 -8.256 5.714 335 HA GLU 41 HA GLU 41 -8.287 -6.647 5.143 336 HB2 GLU 41 2HB GLU 41 -6.331 -6.443 7.458 337 HB3 GLU 41 3HB GLU 41 -7.922 -5.689 7.374 338 HG2 GLU 41 2HG GLU 41 -8.980 -7.906 7.398 339 HG3 GLU 41 3HG GLU 41 -7.382 -8.658 7.430 340 H ALA 42 H ALA 42 -4.817 -6.353 5.040 341 HA ALA 42 HA ALA 42 -4.628 -3.505 4.817 342 HB1 ALA 42 1HB ALA 42 -2.691 -4.868 5.474 343 HB2 ALA 42 2HB ALA 42 -2.326 -3.922 4.030 344 HB3 ALA 42 3HB ALA 42 -2.677 -5.649 3.890 345 H ILE 43 H ILE 43 -4.790 -6.185 2.495 346 HA ILE 43 HA ILE 43 -4.735 -4.783 0.079 347 HB ILE 43 HB ILE 43 -6.076 -7.413 0.845 348 HG12 ILE 43 2HG1 ILE 43 -3.527 -6.817 -0.728 349 HG13 ILE 43 3HG1 ILE 43 -3.586 -7.351 0.944 350 HG21 ILE 43 1HG2 ILE 43 -7.310 -6.530 -1.091 351 HG22 ILE 43 2HG2 ILE 43 -6.347 -7.931 -1.557 352 HG23 ILE 43 3HG2 ILE 43 -5.796 -6.308 -1.971 353 HD11 ILE 43 1HD1 ILE 43 -4.358 -8.938 -1.498 354 HD12 ILE 43 2HD1 ILE 43 -4.602 -9.481 0.165 355 HD13 ILE 43 3HD1 ILE 43 -2.969 -9.183 -0.432 356 H VAL 44 H VAL 44 -7.796 -6.059 1.589 357 HA VAL 44 HA VAL 44 -9.760 -4.691 0.420 358 HB VAL 44 HB VAL 44 -9.525 -5.030 3.449 359 HG11 VAL 44 1HG1 VAL 44 -11.995 -4.973 3.508 360 HG12 VAL 44 2HG1 VAL 44 -12.037 -4.639 1.775 361 HG13 VAL 44 3HG1 VAL 44 -11.340 -3.455 2.883 362 HG21 VAL 44 1HG2 VAL 44 -9.249 -7.168 2.240 363 HG22 VAL 44 2HG2 VAL 44 -10.779 -6.905 1.405 364 HG23 VAL 44 3HG2 VAL 44 -10.758 -7.145 3.155 365 H VAL 45 H VAL 45 -7.938 -3.267 3.183 366 HA VAL 45 HA VAL 45 -9.256 -0.770 3.182 367 HB VAL 45 HB VAL 45 -6.521 -1.531 4.301 368 HG11 VAL 45 1HG1 VAL 45 -8.033 1.082 4.715 369 HG12 VAL 45 2HG1 VAL 45 -6.499 0.896 3.863 370 HG13 VAL 45 3HG1 VAL 45 -6.583 0.593 5.599 371 HG21 VAL 45 1HG2 VAL 45 -7.697 -1.469 6.490 372 HG22 VAL 45 2HG2 VAL 45 -8.444 -2.631 5.392 373 HG23 VAL 45 3HG2 VAL 45 -9.206 -1.063 5.663 374 H LEU 46 H LEU 46 -6.284 -1.838 1.446 375 HA LEU 46 HA LEU 46 -5.646 0.751 0.368 376 HB2 LEU 46 2HB LEU 46 -4.771 -2.046 -0.427 377 HB3 LEU 46 3HB LEU 46 -4.249 -0.630 -1.328 378 HG LEU 46 HG LEU 46 -3.655 -1.122 1.618 379 HD11 LEU 46 1HD1 LEU 46 -2.482 -2.707 0.152 380 HD12 LEU 46 2HD1 LEU 46 -1.365 -1.585 0.922 381 HD13 LEU 46 3HD1 LEU 46 -1.805 -1.363 -0.776 382 HD21 LEU 46 1HD2 LEU 46 -2.655 1.075 -0.236 383 HD22 LEU 46 2HD2 LEU 46 -2.112 0.793 1.420 384 HD23 LEU 46 3HD2 LEU 46 -3.776 1.274 1.115 385 H ARG 47 H ARG 47 -7.712 -1.888 -0.715 386 HA ARG 47 HA ARG 47 -8.331 -0.959 -3.308 387 HB2 ARG 47 2HB ARG 47 -9.953 -2.607 -1.329 388 HB3 ARG 47 3HB ARG 47 -10.516 -2.258 -2.959 389 HG2 ARG 47 2HG ARG 47 -8.588 -3.469 -3.895 390 HG3 ARG 47 3HG ARG 47 -8.003 -3.810 -2.262 391 HD2 ARG 47 2HD ARG 47 -9.917 -5.178 -1.780 392 HD3 ARG 47 3HD ARG 47 -10.739 -4.663 -3.254 393 HE ARG 47 HE ARG 47 -8.223 -6.076 -3.642 394 HH11 ARG 47 1HH1 ARG 47 -11.738 -6.340 -3.443 395 HH12 ARG 47 2HH1 ARG 47 -11.791 -7.853 -4.285 396 HH21 ARG 47 1HH2 ARG 47 -8.339 -8.091 -4.718 397 HH22 ARG 47 2HH2 ARG 47 -9.873 -8.843 -5.008 398 H GLU 48 H GLU 48 -9.317 0.117 -0.158 399 HA GLU 48 HA GLU 48 -11.520 1.807 -1.105 400 HB2 GLU 48 2HB GLU 48 -11.665 0.533 1.068 401 HB3 GLU 48 3HB GLU 48 -10.341 1.506 1.700 402 HG2 GLU 48 2HG GLU 48 -11.736 3.543 1.398 403 HG3 GLU 48 3HG GLU 48 -13.062 2.530 0.842 404 H GLU 49 H GLU 49 -8.243 1.991 0.125 405 HA GLU 49 HA GLU 49 -8.042 4.780 0.503 406 HB2 GLU 49 2HB GLU 49 -5.851 2.746 -0.078 407 HB3 GLU 49 3HB GLU 49 -5.540 4.427 0.342 408 HG2 GLU 49 2HG GLU 49 -6.691 2.247 2.085 409 HG3 GLU 49 3HG GLU 49 -5.223 3.186 2.330 410 H GLU 50 H GLU 50 -7.227 2.718 -2.254 411 HA GLU 50 HA GLU 50 -6.374 4.619 -4.092 412 HB2 GLU 50 2HB GLU 50 -6.337 2.129 -4.447 413 HB3 GLU 50 3HB GLU 50 -8.079 2.163 -4.697 414 HG2 GLU 50 2HG GLU 50 -7.600 3.839 -6.596 415 HG3 GLU 50 3HG GLU 50 -5.914 3.351 -6.443 416 H LYS 51 H LYS 51 -9.709 3.447 -3.494 417 HA LYS 51 HA LYS 51 -11.067 4.979 -5.381 418 HB2 LYS 51 2HB LYS 51 -12.033 3.789 -2.756 419 HB3 LYS 51 3HB LYS 51 -13.114 4.500 -3.952 420 HG2 LYS 51 2HG LYS 51 -12.472 2.806 -5.601 421 HG3 LYS 51 3HG LYS 51 -11.293 2.124 -4.477 422 HD2 LYS 51 2HD LYS 51 -13.313 0.739 -4.481 423 HD3 LYS 51 3HD LYS 51 -13.141 1.531 -2.915 424 HE2 LYS 51 2HE LYS 51 -14.830 3.216 -3.597 425 HE3 LYS 51 3HE LYS 51 -14.999 2.402 -5.155 426 HZ1 LYS 51 1HZ LYS 51 -15.782 0.430 -4.014 427 HZ2 LYS 51 2HZ LYS 51 -16.743 1.762 -3.599 428 HZ3 LYS 51 3HZ LYS 51 -15.588 1.177 -2.511 429 H LYS 52 H LYS 52 -10.155 5.857 -2.044 430 HA LYS 52 HA LYS 52 -11.767 8.315 -2.123 431 HB2 LYS 52 2HB LYS 52 -11.112 8.623 0.209 432 HB3 LYS 52 3HB LYS 52 -11.660 6.968 -0.026 433 HG2 LYS 52 2HG LYS 52 -9.296 6.214 -0.114 434 HG3 LYS 52 3HG LYS 52 -8.769 7.872 0.171 435 HD2 LYS 52 2HD LYS 52 -8.682 6.555 2.242 436 HD3 LYS 52 3HD LYS 52 -9.873 7.851 2.385 437 HE2 LYS 52 2HE LYS 52 -11.695 6.287 2.078 438 HE3 LYS 52 3HE LYS 52 -10.576 4.985 1.668 439 HZ1 LYS 52 1HZ LYS 52 -9.745 4.979 3.891 440 HZ2 LYS 52 2HZ LYS 52 -11.429 4.859 3.953 441 HZ3 LYS 52 3HZ LYS 52 -10.674 6.329 4.318 442 H ALA 53 H ALA 53 -8.551 7.298 -2.850 443 HA ALA 53 HA ALA 53 -7.356 9.942 -2.605 444 HB1 ALA 53 1HB ALA 53 -6.217 7.388 -3.794 445 HB2 ALA 53 2HB ALA 53 -5.982 7.959 -2.140 446 HB3 ALA 53 3HB ALA 53 -5.321 8.881 -3.491 447 H SER 54 H SER 54 -6.376 11.014 -4.374 448 HA SER 54 HA SER 54 -7.537 10.553 -7.055 449 HB2 SER 54 2HB SER 54 -6.921 13.041 -7.377 450 HB3 SER 54 3HB SER 54 -8.244 12.717 -6.255 451 HG SER 54 HG SER 54 -7.031 13.322 -4.604 452 H GLU 55 H GLU 55 -6.094 10.658 -8.848 453 HA GLU 55 HA GLU 55 -3.499 9.541 -8.457 454 HB2 GLU 55 2HB GLU 55 -4.708 10.790 -10.975 455 HB3 GLU 55 3HB GLU 55 -3.270 9.770 -10.929 456 HG2 GLU 55 2HG GLU 55 -4.682 7.901 -10.050 457 HG3 GLU 55 3HG GLU 55 -6.102 8.925 -10.246 458 HA PRO 56 HA PRO 56 -1.267 9.686 -9.902 459 HB2 PRO 56 2HB PRO 56 1.167 10.576 -8.427 460 HB3 PRO 56 3HB PRO 56 0.958 10.219 -10.153 461 HG2 PRO 56 2HG PRO 56 1.309 12.732 -9.305 462 HG3 PRO 56 3HG PRO 56 0.210 12.360 -10.658 463 HD2 PRO 56 2HD PRO 56 -0.484 12.852 -7.755 464 HD3 PRO 56 3HD PRO 56 -1.214 13.559 -9.220 465 H PHE 57 H PHE 57 -1.457 10.739 -6.538 466 HA PHE 57 HA PHE 57 -0.250 8.597 -5.220 467 HB2 PHE 57 2HB PHE 57 -0.988 10.735 -4.153 468 HB3 PHE 57 3HB PHE 57 -2.659 10.192 -4.248 469 HD1 PHE 57 HD1 PHE 57 0.626 8.814 -2.985 470 HD2 PHE 57 HD2 PHE 57 -3.540 9.435 -2.191 471 HE1 PHE 57 HE1 PHE 57 0.887 7.803 -0.760 472 HE2 PHE 57 HE2 PHE 57 -3.261 8.411 0.031 473 HZ PHE 57 HZ PHE 57 -1.050 7.596 0.748 474 H LYS 58 H LYS 58 -3.541 8.805 -6.519 475 HA LYS 58 HA LYS 58 -4.576 6.359 -5.559 476 HB2 LYS 58 2HB LYS 58 -5.983 8.112 -6.539 477 HB3 LYS 58 3HB LYS 58 -5.232 7.882 -8.110 478 HG2 LYS 58 2HG LYS 58 -6.225 5.645 -8.283 479 HG3 LYS 58 3HG LYS 58 -6.907 5.813 -6.661 480 HD2 LYS 58 2HD LYS 58 -8.220 7.808 -7.503 481 HD3 LYS 58 3HD LYS 58 -7.639 7.435 -9.129 482 HE2 LYS 58 2HE LYS 58 -9.334 5.614 -7.382 483 HE3 LYS 58 3HE LYS 58 -9.904 6.548 -8.763 484 HZ1 LYS 58 1HZ LYS 58 -7.986 4.281 -8.817 485 HZ2 LYS 58 2HZ LYS 58 -8.341 5.251 -10.153 486 HZ3 LYS 58 3HZ LYS 58 -9.555 4.319 -9.453 487 H THR 59 H THR 59 -2.484 7.070 -8.289 488 HA THR 59 HA THR 59 -2.650 4.500 -9.545 489 HB THR 59 HB THR 59 -0.452 6.595 -9.895 490 HG1 THR 59 HG1 THR 59 -2.893 6.353 -11.354 491 HG21 THR 59 1HG2 THR 59 -0.219 5.650 -12.160 492 HG22 THR 59 2HG2 THR 59 -1.478 4.465 -11.814 493 HG23 THR 59 3HG2 THR 59 0.054 4.393 -10.942 494 H ASP 60 H ASP 60 -0.629 5.978 -7.073 495 HA ASP 60 HA ASP 60 1.448 3.975 -7.180 496 HB2 ASP 60 2HB ASP 60 0.895 6.168 -5.122 497 HB3 ASP 60 3HB ASP 60 2.376 5.211 -5.213 498 H ILE 61 H ILE 61 -1.212 4.737 -4.935 499 HA ILE 61 HA ILE 61 -1.010 2.654 -3.130 500 HB ILE 61 HB ILE 61 -3.589 3.829 -4.275 501 HG12 ILE 61 2HG1 ILE 61 -2.117 4.468 -1.676 502 HG13 ILE 61 3HG1 ILE 61 -2.108 5.474 -3.117 503 HG21 ILE 61 1HG2 ILE 61 -4.081 1.631 -3.264 504 HG22 ILE 61 2HG2 ILE 61 -4.751 2.924 -2.270 505 HG23 ILE 61 3HG2 ILE 61 -3.262 2.114 -1.774 506 HD11 ILE 61 1HD1 ILE 61 -3.615 6.363 -1.478 507 HD12 ILE 61 2HD1 ILE 61 -4.501 4.843 -1.400 508 HD13 ILE 61 3HD1 ILE 61 -4.528 5.809 -2.879 509 H ARG 62 H ARG 62 -2.935 2.580 -6.242 510 HA ARG 62 HA ARG 62 -3.558 -0.120 -6.041 511 HB2 ARG 62 2HB ARG 62 -4.192 -0.113 -8.411 512 HB3 ARG 62 3HB ARG 62 -4.825 1.257 -7.532 513 HG2 ARG 62 2HG ARG 62 -4.245 2.170 -9.577 514 HG3 ARG 62 3HG ARG 62 -2.879 2.596 -8.554 515 HD2 ARG 62 2HD ARG 62 -2.165 1.871 -10.796 516 HD3 ARG 62 3HD ARG 62 -1.545 0.795 -9.542 517 HE ARG 62 HE ARG 62 -4.027 -0.068 -10.774 518 HH11 ARG 62 1HH1 ARG 62 -0.504 -0.249 -10.983 519 HH12 ARG 62 2HH1 ARG 62 -0.518 -1.716 -11.904 520 HH21 ARG 62 1HH2 ARG 62 -4.009 -1.970 -12.037 521 HH22 ARG 62 2HH2 ARG 62 -2.503 -2.692 -12.505 522 H ILE 63 H ILE 63 -0.561 1.276 -7.470 523 HA ILE 63 HA ILE 63 0.476 -1.128 -8.527 524 HB ILE 63 HB ILE 63 2.031 1.211 -7.330 525 HG12 ILE 63 2HG1 ILE 63 1.463 0.535 -10.253 526 HG13 ILE 63 3HG1 ILE 63 0.624 1.767 -9.329 527 HG21 ILE 63 1HG2 ILE 63 4.009 0.365 -8.570 528 HG22 ILE 63 2HG2 ILE 63 3.092 -1.062 -9.053 529 HG23 ILE 63 3HG2 ILE 63 3.467 -0.791 -7.351 530 HD11 ILE 63 1HD1 ILE 63 2.696 3.037 -9.104 531 HD12 ILE 63 2HD1 ILE 63 2.305 2.734 -10.796 532 HD13 ILE 63 3HD1 ILE 63 3.568 1.793 -10.004 533 H LEU 64 H LEU 64 0.791 0.157 -5.155 534 HA LEU 64 HA LEU 64 2.286 -2.014 -4.099 535 HB2 LEU 64 2HB LEU 64 1.704 0.312 -3.053 536 HB3 LEU 64 3HB LEU 64 0.238 -0.455 -2.481 537 HG LEU 64 HG LEU 64 3.059 -1.374 -1.740 538 HD11 LEU 64 1HD1 LEU 64 1.147 0.320 -0.115 539 HD12 LEU 64 2HD1 LEU 64 2.646 0.862 -0.874 540 HD13 LEU 64 3HD1 LEU 64 2.704 -0.317 0.432 541 HD21 LEU 64 1HD2 LEU 64 0.405 -2.161 -0.488 542 HD22 LEU 64 2HD2 LEU 64 2.005 -2.639 0.087 543 HD23 LEU 64 3HD2 LEU 64 1.434 -3.192 -1.483 544 H LEU 65 H LEU 65 -1.164 -1.420 -4.380 545 HA LEU 65 HA LEU 65 -2.190 -3.816 -3.249 546 HB2 LEU 65 2HB LEU 65 -3.407 -1.656 -3.571 547 HB3 LEU 65 3HB LEU 65 -3.378 -1.918 -5.305 548 HG LEU 65 HG LEU 65 -4.852 -3.913 -5.013 549 HD11 LEU 65 1HD1 LEU 65 -4.962 -3.093 -2.093 550 HD12 LEU 65 2HD1 LEU 65 -4.206 -4.555 -2.734 551 HD13 LEU 65 3HD1 LEU 65 -5.948 -4.336 -2.868 552 HD21 LEU 65 1HD2 LEU 65 -5.939 -1.347 -3.810 553 HD22 LEU 65 2HD2 LEU 65 -6.894 -2.650 -4.523 554 HD23 LEU 65 3HD2 LEU 65 -5.801 -1.709 -5.534 555 H ASP 66 H ASP 66 -0.961 -2.980 -6.387 556 HA ASP 66 HA ASP 66 -1.814 -5.348 -7.793 557 HB2 ASP 66 2HB ASP 66 -1.512 -3.103 -8.880 558 HB3 ASP 66 3HB ASP 66 0.210 -3.193 -8.565 559 H PHE 67 H PHE 67 0.746 -4.569 -5.685 560 HA PHE 67 HA PHE 67 2.549 -6.632 -6.743 561 HB2 PHE 67 2HB PHE 67 3.433 -4.389 -5.895 562 HB3 PHE 67 3HB PHE 67 2.977 -4.885 -4.265 563 HD1 PHE 67 HD1 PHE 67 5.149 -5.741 -7.176 564 HD2 PHE 67 HD2 PHE 67 4.396 -6.376 -3.016 565 HE1 PHE 67 HE1 PHE 67 7.270 -6.967 -6.970 566 HE2 PHE 67 HE2 PHE 67 6.514 -7.598 -2.819 567 HZ PHE 67 HZ PHE 67 7.949 -7.902 -4.793 568 H LEU 68 H LEU 68 0.616 -5.880 -3.854 569 HA LEU 68 HA LEU 68 1.097 -8.189 -2.340 570 HB2 LEU 68 2HB LEU 68 -1.446 -6.517 -2.462 571 HB3 LEU 68 3HB LEU 68 -1.095 -7.713 -1.224 572 HG LEU 68 HG LEU 68 0.374 -5.085 -1.660 573 HD11 LEU 68 1HD1 LEU 68 -0.553 -4.461 0.517 574 HD12 LEU 68 2HD1 LEU 68 -1.412 -6.001 0.618 575 HD13 LEU 68 3HD1 LEU 68 -1.835 -4.830 -0.636 576 HD21 LEU 68 1HD2 LEU 68 0.943 -7.257 0.393 577 HD22 LEU 68 2HD2 LEU 68 1.658 -5.642 0.385 578 HD23 LEU 68 3HD2 LEU 68 1.996 -6.757 -0.935 579 H GLU 69 H GLU 69 -1.562 -7.486 -4.650 580 HA GLU 69 HA GLU 69 -2.579 -10.193 -4.525 581 HB2 GLU 69 2HB GLU 69 -3.374 -7.818 -6.245 582 HB3 GLU 69 3HB GLU 69 -4.240 -9.350 -6.178 583 HG2 GLU 69 2HG GLU 69 -4.605 -8.923 -3.708 584 HG3 GLU 69 3HG GLU 69 -3.938 -7.308 -3.963 585 H SER 70 H SER 70 -0.662 -8.231 -6.753 586 HA SER 70 HA SER 70 0.645 -8.702 -8.523 587 HB2 SER 70 2HB SER 70 1.523 -10.651 -7.212 588 HB3 SER 70 3HB SER 70 0.263 -11.668 -7.908 589 HG SER 70 HG SER 70 1.451 -10.501 -9.944 590 H LYS 71 H LYS 71 -1.820 -7.910 -8.994 591 HA LYS 71 HA LYS 71 -3.454 -9.539 -10.631 592 HB2 LYS 71 2HB LYS 71 -3.332 -6.488 -10.476 593 HB3 LYS 71 3HB LYS 71 -4.674 -7.436 -11.114 594 HG2 LYS 71 2HG LYS 71 -5.129 -8.343 -8.882 595 HG3 LYS 71 3HG LYS 71 -3.738 -7.490 -8.220 596 HD2 LYS 71 2HD LYS 71 -6.096 -6.049 -9.498 597 HD3 LYS 71 3HD LYS 71 -6.044 -6.458 -7.786 598 HE2 LYS 71 2HE LYS 71 -5.362 -4.179 -7.968 599 HE3 LYS 71 3HE LYS 71 -3.905 -5.105 -7.620 600 HZ1 LYS 71 1HZ LYS 71 -3.562 -3.414 -9.335 601 HZ2 LYS 71 2HZ LYS 71 -4.730 -4.145 -10.312 602 HZ3 LYS 71 3HZ LYS 71 -3.298 -4.964 -9.953 603 HA PRO 72 HA PRO 72 -1.336 -9.176 -14.660 604 HB2 PRO 72 2HB PRO 72 -3.608 -9.420 -16.288 605 HB3 PRO 72 3HB PRO 72 -2.713 -10.783 -15.592 606 HG2 PRO 72 2HG PRO 72 -5.224 -9.479 -14.600 607 HG3 PRO 72 3HG PRO 72 -4.808 -11.207 -14.680 608 HD2 PRO 72 2HD PRO 72 -4.664 -9.874 -12.358 609 HD3 PRO 72 3HD PRO 72 -3.455 -11.114 -12.769 Start of MODEL 12 1 H GLY 1 1H GLY 1 4.914 -4.954 14.245 2 HA2 GLY 1 2HA GLY 1 4.583 -7.131 16.228 3 HA3 GLY 1 3HA GLY 1 3.441 -5.821 15.953 4 H SER 2 H SER 2 2.982 -5.599 13.423 5 HA SER 2 HA SER 2 1.658 -8.062 12.676 6 HB2 SER 2 2HB SER 2 1.701 -5.347 11.279 7 HB3 SER 2 3HB SER 2 0.587 -6.677 10.938 8 HG SER 2 HG SER 2 -0.456 -5.299 12.310 9 H VAL 3 H VAL 3 2.525 -9.573 11.322 10 HA VAL 3 HA VAL 3 4.840 -9.244 9.706 11 HB VAL 3 HB VAL 3 3.933 -11.452 10.534 12 HG11 VAL 3 1HG1 VAL 3 2.206 -12.637 9.280 13 HG12 VAL 3 2HG1 VAL 3 1.954 -11.230 8.245 14 HG13 VAL 3 3HG1 VAL 3 1.565 -11.142 9.964 15 HG21 VAL 3 1HG2 VAL 3 4.627 -12.786 8.579 16 HG22 VAL 3 2HG2 VAL 3 5.712 -11.423 8.844 17 HG23 VAL 3 3HG2 VAL 3 4.516 -11.353 7.550 18 H VAL 4 H VAL 4 1.599 -8.285 9.241 19 HA VAL 4 HA VAL 4 1.297 -8.066 6.462 20 HB VAL 4 HB VAL 4 0.375 -6.040 8.574 21 HG11 VAL 4 1HG1 VAL 4 -0.764 -6.650 5.823 22 HG12 VAL 4 2HG1 VAL 4 0.086 -5.181 6.308 23 HG13 VAL 4 3HG1 VAL 4 -1.486 -5.561 7.010 24 HG21 VAL 4 1HG2 VAL 4 -1.714 -7.343 8.750 25 HG22 VAL 4 2HG2 VAL 4 -0.313 -8.290 9.252 26 HG23 VAL 4 3HG2 VAL 4 -1.044 -8.571 7.671 27 H LYS 5 H LYS 5 2.982 -6.070 8.865 28 HA LYS 5 HA LYS 5 3.505 -3.802 7.341 29 HB2 LYS 5 2HB LYS 5 3.845 -3.907 9.822 30 HB3 LYS 5 3HB LYS 5 5.303 -4.863 9.565 31 HG2 LYS 5 2HG LYS 5 6.292 -2.953 8.283 32 HG3 LYS 5 3HG LYS 5 4.834 -2.014 8.611 33 HD2 LYS 5 2HD LYS 5 5.307 -2.173 11.058 34 HD3 LYS 5 3HD LYS 5 6.791 -3.060 10.692 35 HE2 LYS 5 2HE LYS 5 6.173 -0.217 9.821 36 HE3 LYS 5 3HE LYS 5 7.249 -0.683 11.136 37 HZ1 LYS 5 1HZ LYS 5 7.633 -1.312 8.265 38 HZ2 LYS 5 2HZ LYS 5 8.664 -1.802 9.513 39 HZ3 LYS 5 3HZ LYS 5 8.493 -0.157 9.154 40 H GLU 6 H GLU 6 5.444 -6.836 7.568 41 HA GLU 6 HA GLU 6 7.725 -5.780 6.238 42 HB2 GLU 6 2HB GLU 6 8.615 -7.992 6.138 43 HB3 GLU 6 3HB GLU 6 7.751 -7.883 7.663 44 HG2 GLU 6 2HG GLU 6 6.053 -9.357 6.971 45 HG3 GLU 6 3HG GLU 6 6.356 -9.065 5.265 46 H LYS 7 H LYS 7 4.850 -7.475 5.198 47 HA LYS 7 HA LYS 7 5.517 -7.984 2.497 48 HB2 LYS 7 2HB LYS 7 2.785 -7.527 3.783 49 HB3 LYS 7 3HB LYS 7 3.051 -8.252 2.201 50 HG2 LYS 7 2HG LYS 7 4.170 -10.162 3.179 51 HG3 LYS 7 3HG LYS 7 4.124 -9.424 4.782 52 HD2 LYS 7 2HD LYS 7 1.687 -9.615 4.852 53 HD3 LYS 7 3HD LYS 7 1.647 -10.208 3.188 54 HE2 LYS 7 2HE LYS 7 3.001 -11.634 5.502 55 HE3 LYS 7 3HE LYS 7 1.401 -12.022 4.866 56 HZ1 LYS 7 1HZ LYS 7 3.079 -13.488 3.956 57 HZ2 LYS 7 2HZ LYS 7 3.955 -12.176 3.356 58 HZ3 LYS 7 3HZ LYS 7 2.429 -12.529 2.723 59 H LEU 8 H LEU 8 4.057 -5.247 4.132 60 HA LEU 8 HA LEU 8 3.520 -3.614 1.854 61 HB2 LEU 8 2HB LEU 8 3.945 -2.902 4.776 62 HB3 LEU 8 3HB LEU 8 3.306 -1.805 3.565 63 HG LEU 8 HG LEU 8 1.926 -4.379 4.419 64 HD11 LEU 8 1HD1 LEU 8 2.058 -2.792 6.281 65 HD12 LEU 8 2HD1 LEU 8 0.403 -2.977 5.709 66 HD13 LEU 8 3HD1 LEU 8 1.329 -1.537 5.275 67 HD21 LEU 8 1HD2 LEU 8 -0.030 -3.462 3.273 68 HD22 LEU 8 2HD2 LEU 8 1.320 -3.663 2.161 69 HD23 LEU 8 3HD2 LEU 8 0.907 -2.056 2.762 70 H GLU 9 H GLU 9 6.330 -4.046 4.007 71 HA GLU 9 HA GLU 9 7.871 -1.823 3.115 72 HB2 GLU 9 2HB GLU 9 8.895 -4.451 4.304 73 HB3 GLU 9 3HB GLU 9 9.809 -2.954 4.179 74 HG2 GLU 9 2HG GLU 9 7.375 -3.420 5.897 75 HG3 GLU 9 3HG GLU 9 9.030 -3.374 6.469 76 H LYS 10 H LYS 10 7.755 -5.277 2.196 77 HA LYS 10 HA LYS 10 9.791 -5.347 0.284 78 HB2 LYS 10 2HB LYS 10 7.189 -6.943 0.178 79 HB3 LYS 10 3HB LYS 10 8.690 -7.347 -0.642 80 HG2 LYS 10 2HG LYS 10 8.206 -7.386 2.338 81 HG3 LYS 10 3HG LYS 10 8.335 -8.783 1.283 82 HD2 LYS 10 2HD LYS 10 10.694 -8.334 0.877 83 HD3 LYS 10 3HD LYS 10 10.599 -6.808 1.766 84 HE2 LYS 10 2HE LYS 10 11.636 -8.607 3.122 85 HE3 LYS 10 3HE LYS 10 10.138 -8.027 3.851 86 HZ1 LYS 10 1HZ LYS 10 9.003 -9.950 2.914 87 HZ2 LYS 10 2HZ LYS 10 10.267 -10.423 3.923 88 HZ3 LYS 10 3HZ LYS 10 10.451 -10.508 2.245 89 H ALA 11 H ALA 11 6.318 -4.663 -0.017 90 HA ALA 11 HA ALA 11 6.181 -4.376 -2.812 91 HB1 ALA 11 1HB ALA 11 4.205 -4.751 -1.413 92 HB2 ALA 11 2HB ALA 11 4.009 -3.287 -2.379 93 HB3 ALA 11 3HB ALA 11 4.406 -3.167 -0.662 94 H LEU 12 H LEU 12 6.293 -1.858 -0.251 95 HA LEU 12 HA LEU 12 6.547 0.441 -1.649 96 HB2 LEU 12 2HB LEU 12 7.807 -0.410 0.959 97 HB3 LEU 12 3HB LEU 12 8.132 1.190 0.322 98 HG LEU 12 HG LEU 12 5.373 0.130 1.065 99 HD11 LEU 12 1HD1 LEU 12 5.521 1.691 2.957 100 HD12 LEU 12 2HD1 LEU 12 7.161 2.141 2.483 101 HD13 LEU 12 3HD1 LEU 12 6.815 0.496 3.021 102 HD21 LEU 12 1HD2 LEU 12 4.618 2.464 0.730 103 HD22 LEU 12 2HD2 LEU 12 5.228 1.761 -0.764 104 HD23 LEU 12 3HD2 LEU 12 6.225 2.905 0.139 105 H ILE 13 H ILE 13 9.287 -1.759 -0.892 106 HA ILE 13 HA ILE 13 11.304 -0.047 -1.987 107 HB ILE 13 HB ILE 13 11.347 -2.993 -1.171 108 HG12 ILE 13 2HG1 ILE 13 12.484 -0.504 0.190 109 HG13 ILE 13 3HG1 ILE 13 11.037 -1.369 0.686 110 HG21 ILE 13 1HG2 ILE 13 13.719 -1.286 -2.014 111 HG22 ILE 13 2HG2 ILE 13 13.072 -2.674 -2.892 112 HG23 ILE 13 3HG2 ILE 13 13.823 -2.900 -1.313 113 HD11 ILE 13 1HD1 ILE 13 13.857 -2.430 0.766 114 HD12 ILE 13 2HD1 ILE 13 12.407 -3.333 1.216 115 HD13 ILE 13 3HD1 ILE 13 12.874 -1.902 2.133 116 H GLU 14 H GLU 14 9.782 -3.092 -3.111 117 HA GLU 14 HA GLU 14 11.193 -3.364 -5.515 118 HB2 GLU 14 2HB GLU 14 8.401 -4.350 -4.808 119 HB3 GLU 14 3HB GLU 14 9.295 -4.861 -6.234 120 HG2 GLU 14 2HG GLU 14 10.041 -5.370 -3.348 121 HG3 GLU 14 3HG GLU 14 9.466 -6.555 -4.513 122 H VAL 15 H VAL 15 8.314 -1.435 -4.772 123 HA VAL 15 HA VAL 15 8.075 -0.644 -7.604 124 HB VAL 15 HB VAL 15 5.824 0.018 -7.188 125 HG11 VAL 15 1HG1 VAL 15 6.102 -2.414 -7.433 126 HG12 VAL 15 2HG1 VAL 15 4.730 -2.050 -6.391 127 HG13 VAL 15 3HG1 VAL 15 6.251 -2.600 -5.682 128 HG21 VAL 15 1HG2 VAL 15 6.046 1.189 -5.069 129 HG22 VAL 15 2HG2 VAL 15 6.306 -0.321 -4.206 130 HG23 VAL 15 3HG2 VAL 15 4.736 0.014 -4.939 131 H ARG 16 H ARG 16 9.543 0.464 -4.808 132 HA ARG 16 HA ARG 16 9.040 3.167 -4.596 133 HB2 ARG 16 2HB ARG 16 10.535 2.137 -3.023 134 HB3 ARG 16 3HB ARG 16 11.703 1.727 -4.273 135 HG2 ARG 16 2HG ARG 16 12.364 4.040 -4.510 136 HG3 ARG 16 3HG ARG 16 11.022 4.587 -3.500 137 HD2 ARG 16 2HD ARG 16 13.206 4.614 -2.312 138 HD3 ARG 16 3HD ARG 16 12.012 3.580 -1.532 139 HE ARG 16 HE ARG 16 14.085 2.445 -3.310 140 HH11 ARG 16 1HH1 ARG 16 12.530 2.504 -0.131 141 HH12 ARG 16 2HH1 ARG 16 13.412 1.128 0.450 142 HH21 ARG 16 1HH2 ARG 16 15.243 0.680 -2.519 143 HH22 ARG 16 2HH2 ARG 16 14.955 0.092 -0.913 144 HA PRO 17 HA PRO 17 12.136 4.360 -8.221 145 HB2 PRO 17 2HB PRO 17 12.127 1.965 -10.011 146 HB3 PRO 17 3HB PRO 17 13.496 2.953 -9.455 147 HG2 PRO 17 2HG PRO 17 13.085 0.450 -8.539 148 HG3 PRO 17 3HG PRO 17 13.785 1.723 -7.506 149 HD2 PRO 17 2HD PRO 17 10.976 0.642 -7.571 150 HD3 PRO 17 3HD PRO 17 11.989 1.089 -6.178 151 H TYR 18 H TYR 18 9.280 2.460 -8.498 152 HA TYR 18 HA TYR 18 8.448 3.482 -11.116 153 HB2 TYR 18 2HB TYR 18 7.040 1.517 -9.243 154 HB3 TYR 18 3HB TYR 18 6.596 1.860 -10.910 155 HD1 TYR 18 HD1 TYR 18 9.463 0.560 -8.868 156 HD2 TYR 18 HD2 TYR 18 7.435 0.408 -12.622 157 HE1 TYR 18 HE1 TYR 18 10.910 -1.286 -9.568 158 HE2 TYR 18 HE2 TYR 18 8.896 -1.446 -13.324 159 HH TYR 18 HH TYR 18 10.919 -3.137 -11.152 160 H VAL 19 H VAL 19 7.626 3.798 -7.678 161 HA VAL 19 HA VAL 19 5.207 5.354 -8.323 162 HB VAL 19 HB VAL 19 4.501 5.112 -6.005 163 HG11 VAL 19 1HG1 VAL 19 4.042 2.693 -5.976 164 HG12 VAL 19 2HG1 VAL 19 5.275 2.441 -7.216 165 HG13 VAL 19 3HG1 VAL 19 3.830 3.387 -7.585 166 HG21 VAL 19 1HG2 VAL 19 5.708 3.677 -4.371 167 HG22 VAL 19 2HG2 VAL 19 6.639 5.103 -4.828 168 HG23 VAL 19 3HG2 VAL 19 7.053 3.533 -5.511 169 H GLU 20 H GLU 20 4.913 7.373 -7.727 170 HA GLU 20 HA GLU 20 7.043 8.930 -6.407 171 HB2 GLU 20 2HB GLU 20 5.355 10.889 -6.969 172 HB3 GLU 20 3HB GLU 20 6.383 10.245 -8.227 173 HG2 GLU 20 2HG GLU 20 3.645 9.061 -7.950 174 HG3 GLU 20 3HG GLU 20 3.767 10.689 -8.607 175 H TYR 21 H TYR 21 6.281 10.472 -4.676 176 HA TYR 21 HA TYR 21 5.486 10.810 -2.577 177 HB2 TYR 21 2HB TYR 21 2.951 9.555 -3.735 178 HB3 TYR 21 3HB TYR 21 3.034 10.366 -2.174 179 HD1 TYR 21 HD1 TYR 21 3.690 12.839 -2.104 180 HD2 TYR 21 HD2 TYR 21 2.633 10.862 -5.749 181 HE1 TYR 21 HE1 TYR 21 3.321 15.015 -3.174 182 HE2 TYR 21 HE2 TYR 21 2.260 13.049 -6.816 183 HH TYR 21 HH TYR 21 3.306 15.972 -5.440 184 H TYR 22 H TYR 22 7.004 8.523 -3.104 185 HA TYR 22 HA TYR 22 6.372 6.125 -1.952 186 HB2 TYR 22 2HB TYR 22 8.516 6.410 -3.005 187 HB3 TYR 22 3HB TYR 22 8.980 7.689 -1.892 188 HD1 TYR 22 HD1 TYR 22 8.122 4.005 -1.908 189 HD2 TYR 22 HD2 TYR 22 10.375 7.132 -0.043 190 HE1 TYR 22 HE1 TYR 22 9.236 2.357 -0.464 191 HE2 TYR 22 HE2 TYR 22 11.482 5.472 1.396 192 HH TYR 22 HH TYR 22 11.026 3.168 2.266 193 H ASN 23 H ASN 23 7.225 9.118 -0.251 194 HA ASN 23 HA ASN 23 7.331 7.903 2.365 195 HB2 ASN 23 2HB ASN 23 7.412 10.812 1.472 196 HB3 ASN 23 3HB ASN 23 7.571 10.308 3.154 197 HD21 ASN 23 1HD2 ASN 23 9.499 11.715 1.467 198 HD22 ASN 23 2HD2 ASN 23 10.925 10.739 1.437 199 H GLU 24 H GLU 24 4.809 9.350 0.455 200 HA GLU 24 HA GLU 24 3.000 9.891 2.658 201 HB2 GLU 24 2HB GLU 24 2.433 9.729 -0.344 202 HB3 GLU 24 3HB GLU 24 1.356 10.399 0.873 203 HG2 GLU 24 2HG GLU 24 4.069 11.506 0.126 204 HG3 GLU 24 3HG GLU 24 2.526 12.150 -0.414 205 H LEU 25 H LEU 25 3.320 7.501 0.064 206 HA LEU 25 HA LEU 25 1.237 5.760 0.794 207 HB2 LEU 25 2HB LEU 25 2.429 5.940 -1.448 208 HB3 LEU 25 3HB LEU 25 3.804 5.120 -0.724 209 HG LEU 25 HG LEU 25 2.401 3.099 -0.352 210 HD11 LEU 25 1HD1 LEU 25 0.191 4.602 -1.793 211 HD12 LEU 25 2HD1 LEU 25 0.197 4.123 -0.093 212 HD13 LEU 25 3HD1 LEU 25 0.173 2.892 -1.351 213 HD21 LEU 25 1HD2 LEU 25 2.244 2.388 -2.692 214 HD22 LEU 25 2HD2 LEU 25 3.729 3.291 -2.412 215 HD23 LEU 25 3HD2 LEU 25 2.370 4.064 -3.234 216 H LYS 26 H LYS 26 4.694 5.866 1.547 217 HA LYS 26 HA LYS 26 4.998 3.681 3.259 218 HB2 LYS 26 2HB LYS 26 6.886 5.090 2.553 219 HB3 LYS 26 3HB LYS 26 6.263 6.442 3.488 220 HG2 LYS 26 2HG LYS 26 6.642 5.104 5.582 221 HG3 LYS 26 3HG LYS 26 7.356 3.827 4.592 222 HD2 LYS 26 2HD LYS 26 9.141 5.193 5.567 223 HD3 LYS 26 3HD LYS 26 9.112 5.436 3.819 224 HE2 LYS 26 2HE LYS 26 7.832 7.550 4.171 225 HE3 LYS 26 3HE LYS 26 7.956 7.312 5.913 226 HZ1 LYS 26 1HZ LYS 26 10.353 7.470 5.736 227 HZ2 LYS 26 2HZ LYS 26 9.634 8.851 5.085 228 HZ3 LYS 26 3HZ LYS 26 10.257 7.659 4.059 229 H ALA 27 H ALA 27 3.568 6.886 3.961 230 HA ALA 27 HA ALA 27 3.272 6.479 6.777 231 HB1 ALA 27 1HB ALA 27 3.389 8.732 5.790 232 HB2 ALA 27 2HB ALA 27 1.891 8.519 6.701 233 HB3 ALA 27 3HB ALA 27 1.873 8.451 4.935 234 H LEU 28 H LEU 28 1.294 5.858 3.916 235 HA LEU 28 HA LEU 28 -1.129 5.190 5.253 236 HB2 LEU 28 2HB LEU 28 -1.039 5.888 2.885 237 HB3 LEU 28 3HB LEU 28 -0.107 4.458 2.476 238 HG LEU 28 HG LEU 28 -2.025 3.009 2.883 239 HD11 LEU 28 1HD1 LEU 28 -3.029 4.130 4.809 240 HD12 LEU 28 2HD1 LEU 28 -4.227 3.830 3.555 241 HD13 LEU 28 3HD1 LEU 28 -3.579 5.456 3.778 242 HD21 LEU 28 1HD2 LEU 28 -2.866 5.406 1.209 243 HD22 LEU 28 2HD2 LEU 28 -3.565 3.786 1.134 244 HD23 LEU 28 3HD2 LEU 28 -1.889 4.038 0.661 245 H VAL 29 H VAL 29 1.632 3.352 4.055 246 HA VAL 29 HA VAL 29 0.937 0.742 4.802 247 HB VAL 29 HB VAL 29 3.521 2.233 4.296 248 HG11 VAL 29 1HG1 VAL 29 4.877 0.172 4.589 249 HG12 VAL 29 2HG1 VAL 29 3.491 -0.608 5.348 250 HG13 VAL 29 3HG1 VAL 29 4.238 0.796 6.114 251 HG21 VAL 29 1HG2 VAL 29 2.200 1.494 2.379 252 HG22 VAL 29 2HG2 VAL 29 2.239 -0.172 2.963 253 HG23 VAL 29 3HG2 VAL 29 3.728 0.611 2.437 254 H SER 30 H SER 30 2.517 3.345 6.613 255 HA SER 30 HA SER 30 3.051 1.801 8.972 256 HB2 SER 30 2HB SER 30 4.352 3.826 8.262 257 HB3 SER 30 3HB SER 30 2.958 4.836 8.652 258 HG SER 30 HG SER 30 3.560 4.776 10.659 259 H LYS 31 H LYS 31 0.320 3.515 7.788 260 HA LYS 31 HA LYS 31 -1.128 3.798 10.256 261 HB2 LYS 31 2HB LYS 31 -1.491 5.358 8.397 262 HB3 LYS 31 3HB LYS 31 -1.948 4.036 7.327 263 HG2 LYS 31 2HG LYS 31 -3.974 3.632 8.694 264 HG3 LYS 31 3HG LYS 31 -3.519 4.970 9.756 265 HD2 LYS 31 2HD LYS 31 -3.687 6.546 7.842 266 HD3 LYS 31 3HD LYS 31 -4.124 5.205 6.778 267 HE2 LYS 31 2HE LYS 31 -6.181 4.830 8.092 268 HE3 LYS 31 3HE LYS 31 -5.734 6.158 9.169 269 HZ1 LYS 31 1HZ LYS 31 -6.283 6.412 6.257 270 HZ2 LYS 31 2HZ LYS 31 -5.861 7.677 7.296 271 HZ3 LYS 31 3HZ LYS 31 -7.330 6.867 7.507 272 H ILE 32 H ILE 32 -1.498 1.739 7.342 273 HA ILE 32 HA ILE 32 -3.781 0.355 8.321 274 HB ILE 32 HB ILE 32 -3.571 -1.113 6.305 275 HG12 ILE 32 2HG1 ILE 32 -0.990 0.437 5.803 276 HG13 ILE 32 3HG1 ILE 32 -1.123 -1.276 6.160 277 HG21 ILE 32 1HG2 ILE 32 -4.746 1.048 6.114 278 HG22 ILE 32 2HG2 ILE 32 -3.935 0.643 4.602 279 HG23 ILE 32 3HG2 ILE 32 -3.233 1.850 5.682 280 HD11 ILE 32 1HD1 ILE 32 -0.642 -0.861 3.828 281 HD12 ILE 32 2HD1 ILE 32 -2.131 0.069 3.657 282 HD13 ILE 32 3HD1 ILE 32 -2.202 -1.659 4.021 283 H SER 33 H SER 33 -0.349 -0.690 8.027 284 HA SER 33 HA SER 33 -0.585 -3.324 8.908 285 HB2 SER 33 2HB SER 33 1.817 -3.098 9.629 286 HB3 SER 33 3HB SER 33 1.509 -2.476 8.013 287 HG SER 33 HG SER 33 2.296 -0.667 8.681 288 H SER 34 H SER 34 -0.411 -0.354 10.824 289 HA SER 34 HA SER 34 -0.192 -1.678 13.377 290 HB2 SER 34 2HB SER 34 -0.851 1.228 12.722 291 HB3 SER 34 3HB SER 34 -0.335 0.601 14.293 292 HG SER 34 HG SER 34 1.134 0.942 11.926 293 H SER 35 H SER 35 -2.780 -0.913 11.274 294 HA SER 35 HA SER 35 -4.811 -0.652 13.390 295 HB2 SER 35 2HB SER 35 -4.685 1.012 11.484 296 HB3 SER 35 3HB SER 35 -5.132 -0.282 10.370 297 HG SER 35 HG SER 35 -6.999 -0.499 12.010 298 H VAL 36 H VAL 36 -3.790 -2.777 10.768 299 HA VAL 36 HA VAL 36 -6.063 -4.622 11.222 300 HB VAL 36 HB VAL 36 -5.902 -5.391 8.963 301 HG11 VAL 36 1HG1 VAL 36 -5.657 -2.363 8.894 302 HG12 VAL 36 2HG1 VAL 36 -7.129 -3.282 9.209 303 HG13 VAL 36 3HG1 VAL 36 -6.361 -3.369 7.622 304 HG21 VAL 36 1HG2 VAL 36 -4.206 -4.639 7.314 305 HG22 VAL 36 2HG2 VAL 36 -3.474 -5.494 8.669 306 HG23 VAL 36 3HG2 VAL 36 -3.379 -3.739 8.588 307 H ASN 37 H ASN 37 -5.649 -6.836 11.321 308 HA ASN 37 HA ASN 37 -2.924 -7.628 12.143 309 HB2 ASN 37 2HB ASN 37 -5.573 -9.101 12.499 310 HB3 ASN 37 3HB ASN 37 -4.022 -9.607 13.158 311 HD21 ASN 37 1HD2 ASN 37 -6.652 -7.349 13.436 312 HD22 ASN 37 2HD2 ASN 37 -6.237 -6.751 15.001 313 H ASP 38 H ASP 38 -4.810 -7.727 9.384 314 HA ASP 38 HA ASP 38 -3.555 -10.209 8.348 315 HB2 ASP 38 2HB ASP 38 -6.410 -9.302 7.742 316 HB3 ASP 38 3HB ASP 38 -5.615 -10.735 7.103 317 H LEU 39 H LEU 39 -2.669 -10.035 6.341 318 HA LEU 39 HA LEU 39 -2.418 -7.588 4.945 319 HB2 LEU 39 2HB LEU 39 -0.859 -9.580 4.829 320 HB3 LEU 39 3HB LEU 39 -2.043 -10.414 3.853 321 HG LEU 39 HG LEU 39 0.002 -9.369 2.654 322 HD11 LEU 39 1HD1 LEU 39 -1.883 -10.215 1.388 323 HD12 LEU 39 2HD1 LEU 39 -1.195 -8.783 0.629 324 HD13 LEU 39 3HD1 LEU 39 -2.704 -8.663 1.538 325 HD21 LEU 39 1HD2 LEU 39 -1.542 -6.785 3.026 326 HD22 LEU 39 2HD2 LEU 39 -0.108 -7.007 2.020 327 HD23 LEU 39 3HD2 LEU 39 0.010 -7.183 3.769 328 H GLU 40 H GLU 40 -4.716 -10.242 4.774 329 HA GLU 40 HA GLU 40 -6.278 -9.626 2.559 330 HB2 GLU 40 2HB GLU 40 -6.559 -11.642 3.979 331 HB3 GLU 40 3HB GLU 40 -7.166 -10.644 5.297 332 HG2 GLU 40 2HG GLU 40 -9.100 -9.989 3.874 333 HG3 GLU 40 3HG GLU 40 -8.500 -11.051 2.599 334 H GLU 41 H GLU 41 -6.390 -8.271 5.854 335 HA GLU 41 HA GLU 41 -8.693 -6.598 5.399 336 HB2 GLU 41 2HB GLU 41 -6.652 -6.666 7.652 337 HB3 GLU 41 3HB GLU 41 -8.040 -5.590 7.636 338 HG2 GLU 41 2HG GLU 41 -8.167 -8.611 7.630 339 HG3 GLU 41 3HG GLU 41 -8.393 -7.577 9.038 340 H ALA 42 H ALA 42 -5.244 -6.293 5.026 341 HA ALA 42 HA ALA 42 -5.086 -3.425 4.974 342 HB1 ALA 42 1HB ALA 42 -2.812 -3.772 4.069 343 HB2 ALA 42 2HB ALA 42 -3.142 -5.497 3.868 344 HB3 ALA 42 3HB ALA 42 -3.104 -4.782 5.482 345 H ILE 43 H ILE 43 -5.218 -5.994 2.526 346 HA ILE 43 HA ILE 43 -5.137 -4.590 0.146 347 HB ILE 43 HB ILE 43 -6.685 -7.117 0.892 348 HG12 ILE 43 2HG1 ILE 43 -4.132 -6.846 -0.765 349 HG13 ILE 43 3HG1 ILE 43 -4.146 -7.180 0.962 350 HG21 ILE 43 1HG2 ILE 43 -6.311 -6.027 -1.921 351 HG22 ILE 43 2HG2 ILE 43 -7.837 -6.161 -1.045 352 HG23 ILE 43 3HG2 ILE 43 -6.961 -7.616 -1.518 353 HD11 ILE 43 1HD1 ILE 43 -3.808 -9.215 -0.232 354 HD12 ILE 43 2HD1 ILE 43 -5.241 -8.939 -1.224 355 HD13 ILE 43 3HD1 ILE 43 -5.409 -9.260 0.506 356 H VAL 44 H VAL 44 -8.238 -5.789 1.556 357 HA VAL 44 HA VAL 44 -10.128 -4.358 0.366 358 HB VAL 44 HB VAL 44 -9.991 -4.888 3.375 359 HG11 VAL 44 1HG1 VAL 44 -12.473 -4.813 3.358 360 HG12 VAL 44 2HG1 VAL 44 -12.441 -4.288 1.672 361 HG13 VAL 44 3HG1 VAL 44 -11.759 -3.256 2.930 362 HG21 VAL 44 1HG2 VAL 44 -11.207 -6.586 1.152 363 HG22 VAL 44 2HG2 VAL 44 -11.275 -6.950 2.878 364 HG23 VAL 44 3HG2 VAL 44 -9.724 -6.945 2.039 365 H VAL 45 H VAL 45 -8.416 -3.071 3.284 366 HA VAL 45 HA VAL 45 -9.668 -0.557 3.384 367 HB VAL 45 HB VAL 45 -6.884 -1.366 4.342 368 HG11 VAL 45 1HG1 VAL 45 -8.340 1.246 4.933 369 HG12 VAL 45 2HG1 VAL 45 -6.859 1.073 3.991 370 HG13 VAL 45 3HG1 VAL 45 -6.852 0.706 5.715 371 HG21 VAL 45 1HG2 VAL 45 -9.471 -0.911 5.879 372 HG22 VAL 45 2HG2 VAL 45 -7.921 -1.377 6.584 373 HG23 VAL 45 3HG2 VAL 45 -8.762 -2.479 5.493 374 H LEU 46 H LEU 46 -6.762 -1.574 1.561 375 HA LEU 46 HA LEU 46 -6.063 1.045 0.607 376 HB2 LEU 46 2HB LEU 46 -5.225 -1.729 -0.309 377 HB3 LEU 46 3HB LEU 46 -4.577 -0.256 -1.015 378 HG LEU 46 HG LEU 46 -4.267 -1.092 1.893 379 HD11 LEU 46 1HD1 LEU 46 -2.224 -1.056 -0.348 380 HD12 LEU 46 2HD1 LEU 46 -2.967 -2.493 0.359 381 HD13 LEU 46 3HD1 LEU 46 -1.918 -1.475 1.342 382 HD21 LEU 46 1HD2 LEU 46 -2.716 0.806 2.082 383 HD22 LEU 46 2HD2 LEU 46 -4.348 1.341 1.690 384 HD23 LEU 46 3HD2 LEU 46 -3.108 1.302 0.433 385 H ARG 47 H ARG 47 -8.089 -1.542 -0.645 386 HA ARG 47 HA ARG 47 -8.543 -0.484 -3.234 387 HB2 ARG 47 2HB ARG 47 -10.222 -2.325 -1.476 388 HB3 ARG 47 3HB ARG 47 -10.677 -1.902 -3.124 389 HG2 ARG 47 2HG ARG 47 -8.550 -2.891 -3.945 390 HG3 ARG 47 3HG ARG 47 -8.156 -3.369 -2.293 391 HD2 ARG 47 2HD ARG 47 -9.941 -4.945 -2.215 392 HD3 ARG 47 3HD ARG 47 -10.703 -4.277 -3.664 393 HE ARG 47 HE ARG 47 -8.045 -5.563 -3.823 394 HH11 ARG 47 1HH1 ARG 47 -11.433 -5.500 -4.805 395 HH12 ARG 47 2HH1 ARG 47 -11.200 -6.677 -6.053 396 HH21 ARG 47 1HH2 ARG 47 -7.782 -7.060 -5.509 397 HH22 ARG 47 2HH2 ARG 47 -9.148 -7.558 -6.453 398 H GLU 48 H GLU 48 -9.686 0.432 -0.118 399 HA GLU 48 HA GLU 48 -11.880 2.093 -1.134 400 HB2 GLU 48 2HB GLU 48 -10.932 1.756 1.742 401 HB3 GLU 48 3HB GLU 48 -12.442 2.480 1.207 402 HG2 GLU 48 2HG GLU 48 -11.643 -0.431 1.092 403 HG3 GLU 48 3HG GLU 48 -12.938 0.284 2.038 404 H GLU 49 H GLU 49 -8.678 2.329 0.328 405 HA GLU 49 HA GLU 49 -8.544 5.135 0.662 406 HB2 GLU 49 2HB GLU 49 -6.320 3.094 0.215 407 HB3 GLU 49 3HB GLU 49 -6.017 4.788 0.582 408 HG2 GLU 49 2HG GLU 49 -7.423 2.791 2.361 409 HG3 GLU 49 3HG GLU 49 -5.795 3.424 2.579 410 H GLU 50 H GLU 50 -7.628 3.011 -1.993 411 HA GLU 50 HA GLU 50 -6.667 4.747 -3.902 412 HB2 GLU 50 2HB GLU 50 -6.791 2.228 -4.077 413 HB3 GLU 50 3HB GLU 50 -8.519 2.363 -4.388 414 HG2 GLU 50 2HG GLU 50 -7.896 3.817 -6.406 415 HG3 GLU 50 3HG GLU 50 -6.233 3.291 -6.147 416 H LYS 51 H LYS 51 -10.083 3.729 -3.454 417 HA LYS 51 HA LYS 51 -11.382 5.304 -5.321 418 HB2 LYS 51 2HB LYS 51 -12.366 4.440 -2.569 419 HB3 LYS 51 3HB LYS 51 -13.408 5.094 -3.826 420 HG2 LYS 51 2HG LYS 51 -12.987 3.170 -5.249 421 HG3 LYS 51 3HG LYS 51 -11.816 2.525 -4.094 422 HD2 LYS 51 2HD LYS 51 -13.621 2.297 -2.398 423 HD3 LYS 51 3HD LYS 51 -14.791 2.940 -3.551 424 HE2 LYS 51 2HE LYS 51 -14.484 0.985 -4.995 425 HE3 LYS 51 3HE LYS 51 -13.217 0.368 -3.930 426 HZ1 LYS 51 1HZ LYS 51 -16.064 0.767 -3.157 427 HZ2 LYS 51 2HZ LYS 51 -14.846 0.147 -2.158 428 HZ3 LYS 51 3HZ LYS 51 -15.343 -0.717 -3.521 429 H LYS 52 H LYS 52 -10.351 6.157 -2.050 430 HA LYS 52 HA LYS 52 -11.743 8.699 -2.004 431 HB2 LYS 52 2HB LYS 52 -9.721 7.503 -0.052 432 HB3 LYS 52 3HB LYS 52 -10.673 8.958 0.236 433 HG2 LYS 52 2HG LYS 52 -12.758 7.616 0.137 434 HG3 LYS 52 3HG LYS 52 -11.801 6.163 -0.148 435 HD2 LYS 52 2HD LYS 52 -10.679 6.549 2.087 436 HD3 LYS 52 3HD LYS 52 -11.814 7.871 2.373 437 HE2 LYS 52 2HE LYS 52 -12.503 4.934 2.002 438 HE3 LYS 52 3HE LYS 52 -12.610 5.862 3.498 439 HZ1 LYS 52 1HZ LYS 52 -14.317 7.257 2.402 440 HZ2 LYS 52 2HZ LYS 52 -14.779 5.638 2.544 441 HZ3 LYS 52 3HZ LYS 52 -14.260 6.238 1.054 442 H ALA 53 H ALA 53 -8.550 7.528 -2.776 443 HA ALA 53 HA ALA 53 -7.192 10.061 -2.658 444 HB1 ALA 53 1HB ALA 53 -5.303 8.828 -3.641 445 HB2 ALA 53 2HB ALA 53 -6.349 7.440 -3.961 446 HB3 ALA 53 3HB ALA 53 -6.009 7.927 -2.299 447 H SER 54 H SER 54 -5.902 10.738 -4.643 448 HA SER 54 HA SER 54 -7.466 10.652 -7.155 449 HB2 SER 54 2HB SER 54 -6.104 13.094 -5.928 450 HB3 SER 54 3HB SER 54 -6.878 13.048 -7.514 451 HG SER 54 HG SER 54 -8.271 12.344 -5.163 452 H GLU 55 H GLU 55 -6.167 11.193 -9.048 453 HA GLU 55 HA GLU 55 -3.735 9.717 -9.164 454 HB2 GLU 55 2HB GLU 55 -4.977 11.596 -11.240 455 HB3 GLU 55 3HB GLU 55 -3.652 10.480 -11.549 456 HG2 GLU 55 2HG GLU 55 -5.520 9.378 -12.436 457 HG3 GLU 55 3HG GLU 55 -5.295 8.605 -10.872 458 HA PRO 56 HA PRO 56 -1.703 9.700 -10.327 459 HB2 PRO 56 2HB PRO 56 0.945 9.763 -9.920 460 HB3 PRO 56 3HB PRO 56 0.193 10.898 -11.061 461 HG2 PRO 56 2HG PRO 56 1.087 11.394 -8.239 462 HG3 PRO 56 3HG PRO 56 1.320 12.400 -9.687 463 HD2 PRO 56 2HD PRO 56 -0.718 12.782 -7.815 464 HD3 PRO 56 3HD PRO 56 -0.757 13.380 -9.489 465 H PHE 57 H PHE 57 -1.880 10.552 -7.043 466 HA PHE 57 HA PHE 57 -0.442 8.408 -5.861 467 HB2 PHE 57 2HB PHE 57 -1.115 10.564 -4.709 468 HB3 PHE 57 3HB PHE 57 -2.750 9.919 -4.577 469 HD1 PHE 57 HD1 PHE 57 0.797 8.853 -3.835 470 HD2 PHE 57 HD2 PHE 57 -3.274 8.900 -2.511 471 HE1 PHE 57 HE1 PHE 57 1.460 7.767 -1.730 472 HE2 PHE 57 HE2 PHE 57 -2.599 7.813 -0.410 473 HZ PHE 57 HZ PHE 57 -0.234 7.248 -0.018 474 H LYS 58 H LYS 58 -3.717 8.592 -7.143 475 HA LYS 58 HA LYS 58 -4.685 6.113 -6.174 476 HB2 LYS 58 2HB LYS 58 -6.136 7.782 -7.271 477 HB3 LYS 58 3HB LYS 58 -5.333 7.504 -8.814 478 HG2 LYS 58 2HG LYS 58 -6.217 5.242 -8.940 479 HG3 LYS 58 3HG LYS 58 -6.873 5.350 -7.307 480 HD2 LYS 58 2HD LYS 58 -7.757 7.071 -9.648 481 HD3 LYS 58 3HD LYS 58 -8.612 5.634 -9.084 482 HE2 LYS 58 2HE LYS 58 -9.173 6.681 -7.003 483 HE3 LYS 58 3HE LYS 58 -8.065 8.022 -7.291 484 HZ1 LYS 58 1HZ LYS 58 -9.478 8.712 -9.151 485 HZ2 LYS 58 2HZ LYS 58 -10.322 8.703 -7.683 486 HZ3 LYS 58 3HZ LYS 58 -10.558 7.458 -8.798 487 H THR 59 H THR 59 -2.456 6.894 -8.747 488 HA THR 59 HA THR 59 -2.358 4.255 -9.909 489 HB THR 59 HB THR 59 -0.371 6.549 -10.261 490 HG1 THR 59 HG1 THR 59 -2.959 6.195 -11.182 491 HG21 THR 59 1HG2 THR 59 0.086 5.539 -12.456 492 HG22 THR 59 2HG2 THR 59 -1.051 4.232 -12.118 493 HG23 THR 59 3HG2 THR 59 0.429 4.383 -11.168 494 H ASP 60 H ASP 60 -0.637 6.069 -7.414 495 HA ASP 60 HA ASP 60 1.598 4.289 -7.182 496 HB2 ASP 60 2HB ASP 60 0.536 6.367 -5.207 497 HB3 ASP 60 3HB ASP 60 2.094 5.551 -5.072 498 H ILE 61 H ILE 61 -1.380 4.753 -5.272 499 HA ILE 61 HA ILE 61 -1.117 2.704 -3.424 500 HB ILE 61 HB ILE 61 -3.680 3.815 -4.673 501 HG12 ILE 61 2HG1 ILE 61 -2.323 4.368 -1.985 502 HG13 ILE 61 3HG1 ILE 61 -2.341 5.459 -3.365 503 HG21 ILE 61 1HG2 ILE 61 -4.920 2.787 -2.772 504 HG22 ILE 61 2HG2 ILE 61 -3.439 1.986 -2.247 505 HG23 ILE 61 3HG2 ILE 61 -4.165 1.561 -3.796 506 HD11 ILE 61 1HD1 ILE 61 -3.915 6.172 -1.695 507 HD12 ILE 61 2HD1 ILE 61 -4.730 4.609 -1.740 508 HD13 ILE 61 3HD1 ILE 61 -4.773 5.669 -3.152 509 H ARG 62 H ARG 62 -2.885 2.478 -6.623 510 HA ARG 62 HA ARG 62 -3.489 -0.226 -6.358 511 HB2 ARG 62 2HB ARG 62 -4.098 -0.268 -8.689 512 HB3 ARG 62 3HB ARG 62 -4.582 1.264 -7.991 513 HG2 ARG 62 2HG ARG 62 -3.790 1.972 -10.023 514 HG3 ARG 62 3HG ARG 62 -2.327 2.134 -9.056 515 HD2 ARG 62 2HD ARG 62 -1.909 1.109 -11.273 516 HD3 ARG 62 3HD ARG 62 -1.459 0.031 -9.948 517 HE ARG 62 HE ARG 62 -4.039 -0.229 -11.393 518 HH11 ARG 62 1HH1 ARG 62 -1.069 -1.727 -10.221 519 HH12 ARG 62 2HH1 ARG 62 -1.549 -3.324 -10.685 520 HH21 ARG 62 1HH2 ARG 62 -4.643 -2.334 -12.012 521 HH22 ARG 62 2HH2 ARG 62 -3.576 -3.669 -11.704 522 H ILE 63 H ILE 63 -0.487 1.184 -7.659 523 HA ILE 63 HA ILE 63 0.680 -1.223 -8.611 524 HB ILE 63 HB ILE 63 2.000 1.369 -7.696 525 HG12 ILE 63 2HG1 ILE 63 1.494 0.270 -10.504 526 HG13 ILE 63 3HG1 ILE 63 0.562 1.546 -9.733 527 HG21 ILE 63 1HG2 ILE 63 3.634 -0.473 -7.488 528 HG22 ILE 63 2HG2 ILE 63 4.071 0.611 -8.806 529 HG23 ILE 63 3HG2 ILE 63 3.320 -0.947 -9.159 530 HD11 ILE 63 1HD1 ILE 63 2.125 2.469 -11.322 531 HD12 ILE 63 2HD1 ILE 63 3.477 1.690 -10.503 532 HD13 ILE 63 3HD1 ILE 63 2.565 2.966 -9.690 533 H LEU 64 H LEU 64 0.874 0.374 -5.392 534 HA LEU 64 HA LEU 64 2.561 -1.478 -4.078 535 HB2 LEU 64 2HB LEU 64 1.796 0.762 -3.144 536 HB3 LEU 64 3HB LEU 64 0.203 0.070 -2.905 537 HG LEU 64 HG LEU 64 1.451 -1.686 -1.386 538 HD11 LEU 64 1HD1 LEU 64 3.464 -0.858 -0.288 539 HD12 LEU 64 2HD1 LEU 64 3.502 0.541 -1.363 540 HD13 LEU 64 3HD1 LEU 64 3.727 -1.086 -2.015 541 HD21 LEU 64 1HD2 LEU 64 -0.167 -0.066 -0.515 542 HD22 LEU 64 2HD2 LEU 64 1.090 1.171 -0.427 543 HD23 LEU 64 3HD2 LEU 64 1.189 -0.265 0.595 544 H LEU 65 H LEU 65 -0.914 -1.178 -4.130 545 HA LEU 65 HA LEU 65 -1.820 -3.464 -2.868 546 HB2 LEU 65 2HB LEU 65 -3.117 -1.411 -3.299 547 HB3 LEU 65 3HB LEU 65 -3.114 -1.751 -5.019 548 HG LEU 65 HG LEU 65 -4.565 -3.731 -4.636 549 HD11 LEU 65 1HD1 LEU 65 -5.586 -4.142 -2.441 550 HD12 LEU 65 2HD1 LEU 65 -4.551 -2.910 -1.717 551 HD13 LEU 65 3HD1 LEU 65 -3.840 -4.374 -2.399 552 HD21 LEU 65 1HD2 LEU 65 -6.609 -2.515 -4.072 553 HD22 LEU 65 2HD2 LEU 65 -5.581 -1.543 -5.120 554 HD23 LEU 65 3HD2 LEU 65 -5.664 -1.188 -3.391 555 H ASP 66 H ASP 66 -0.517 -3.148 -6.081 556 HA ASP 66 HA ASP 66 -1.731 -5.474 -7.239 557 HB2 ASP 66 2HB ASP 66 -0.862 -3.526 -8.568 558 HB3 ASP 66 3HB ASP 66 0.776 -3.922 -8.071 559 H PHE 67 H PHE 67 1.612 -4.692 -6.326 560 HA PHE 67 HA PHE 67 2.754 -7.213 -6.370 561 HB2 PHE 67 2HB PHE 67 3.962 -5.001 -6.118 562 HB3 PHE 67 3HB PHE 67 3.464 -4.956 -4.432 563 HD1 PHE 67 HD1 PHE 67 4.470 -6.552 -2.783 564 HD2 PHE 67 HD2 PHE 67 5.766 -6.469 -6.857 565 HE1 PHE 67 HE1 PHE 67 6.458 -7.871 -2.180 566 HE2 PHE 67 HE2 PHE 67 7.746 -7.793 -6.246 567 HZ PHE 67 HZ PHE 67 8.089 -8.492 -3.913 568 H LEU 68 H LEU 68 0.954 -5.650 -3.729 569 HA LEU 68 HA LEU 68 1.457 -7.486 -1.641 570 HB2 LEU 68 2HB LEU 68 -0.873 -5.605 -2.124 571 HB3 LEU 68 3HB LEU 68 -0.673 -6.513 -0.630 572 HG LEU 68 HG LEU 68 1.329 -4.478 -1.682 573 HD11 LEU 68 1HD1 LEU 68 -0.771 -3.392 -1.067 574 HD12 LEU 68 2HD1 LEU 68 0.506 -2.993 0.076 575 HD13 LEU 68 3HD1 LEU 68 -0.733 -4.171 0.518 576 HD21 LEU 68 1HD2 LEU 68 1.195 -5.927 0.982 577 HD22 LEU 68 2HD2 LEU 68 2.337 -4.649 0.554 578 HD23 LEU 68 3HD2 LEU 68 2.387 -6.188 -0.298 579 H GLU 69 H GLU 69 -1.426 -7.199 -3.766 580 HA GLU 69 HA GLU 69 -2.609 -9.648 -2.938 581 HB2 GLU 69 2HB GLU 69 -3.036 -7.969 -5.444 582 HB3 GLU 69 3HB GLU 69 -4.016 -9.368 -5.010 583 HG2 GLU 69 2HG GLU 69 -4.597 -8.174 -2.843 584 HG3 GLU 69 3HG GLU 69 -3.792 -6.751 -3.511 585 H SER 70 H SER 70 -0.094 -8.868 -5.154 586 HA SER 70 HA SER 70 1.349 -10.049 -6.381 587 HB2 SER 70 2HB SER 70 1.432 -11.650 -4.448 588 HB3 SER 70 3HB SER 70 0.090 -12.552 -5.142 589 HG SER 70 HG SER 70 1.999 -13.565 -5.707 590 H LYS 71 H LYS 71 -1.112 -9.105 -7.395 591 HA LYS 71 HA LYS 71 -2.685 -10.616 -8.992 592 HB2 LYS 71 2HB LYS 71 -1.471 -7.937 -9.804 593 HB3 LYS 71 3HB LYS 71 -2.944 -8.638 -10.468 594 HG2 LYS 71 2HG LYS 71 -4.003 -8.453 -8.214 595 HG3 LYS 71 3HG LYS 71 -2.535 -7.671 -7.620 596 HD2 LYS 71 2HD LYS 71 -2.878 -5.868 -9.365 597 HD3 LYS 71 3HD LYS 71 -4.422 -6.619 -9.775 598 HE2 LYS 71 2HE LYS 71 -3.701 -5.562 -7.022 599 HE3 LYS 71 3HE LYS 71 -4.630 -4.669 -8.223 600 HZ1 LYS 71 1HZ LYS 71 -6.326 -6.354 -8.139 601 HZ2 LYS 71 2HZ LYS 71 -6.032 -5.756 -6.584 602 HZ3 LYS 71 3HZ LYS 71 -5.425 -7.268 -7.038 603 HA PRO 72 HA PRO 72 0.164 -12.663 -11.897 604 HB2 PRO 72 2HB PRO 72 -2.335 -13.213 -13.482 605 HB3 PRO 72 3HB PRO 72 -1.153 -14.359 -12.811 606 HG2 PRO 72 2HG PRO 72 -3.570 -14.112 -11.716 607 HG3 PRO 72 3HG PRO 72 -2.128 -14.355 -10.701 608 HD2 PRO 72 2HD PRO 72 -3.619 -11.789 -11.262 609 HD3 PRO 72 3HD PRO 72 -2.983 -12.411 -9.722 Start of MODEL 13 1 H GLY 1 1H GLY 1 1.953 -5.819 16.306 2 HA2 GLY 1 2HA GLY 1 4.484 -6.169 14.809 3 HA3 GLY 1 3HA GLY 1 3.962 -7.146 16.176 4 H SER 2 H SER 2 2.525 -5.945 13.128 5 HA SER 2 HA SER 2 1.185 -8.504 12.600 6 HB2 SER 2 2HB SER 2 1.147 -5.880 11.032 7 HB3 SER 2 3HB SER 2 0.076 -7.262 10.774 8 HG SER 2 HG SER 2 -0.990 -5.760 12.039 9 H VAL 3 H VAL 3 2.026 -9.992 11.170 10 HA VAL 3 HA VAL 3 4.492 -9.754 9.828 11 HB VAL 3 HB VAL 3 3.380 -11.945 10.370 12 HG11 VAL 3 1HG1 VAL 3 1.690 -12.914 8.864 13 HG12 VAL 3 2HG1 VAL 3 1.597 -11.396 7.970 14 HG13 VAL 3 3HG1 VAL 3 1.086 -11.458 9.658 15 HG21 VAL 3 1HG2 VAL 3 4.208 -11.676 7.452 16 HG22 VAL 3 2HG2 VAL 3 4.159 -13.181 8.377 17 HG23 VAL 3 3HG2 VAL 3 5.296 -11.907 8.822 18 H VAL 4 H VAL 4 1.244 -8.861 8.842 19 HA VAL 4 HA VAL 4 1.385 -8.189 6.220 20 HB VAL 4 HB VAL 4 0.313 -6.297 8.374 21 HG11 VAL 4 1HG1 VAL 4 -1.246 -5.511 6.620 22 HG12 VAL 4 2HG1 VAL 4 -0.471 -6.578 5.450 23 HG13 VAL 4 3HG1 VAL 4 0.436 -5.244 6.158 24 HG21 VAL 4 1HG2 VAL 4 -0.618 -8.532 8.703 25 HG22 VAL 4 2HG2 VAL 4 -1.109 -8.606 7.013 26 HG23 VAL 4 3HG2 VAL 4 -1.866 -7.438 8.101 27 H LYS 5 H LYS 5 2.820 -6.323 8.921 28 HA LYS 5 HA LYS 5 3.317 -3.961 7.538 29 HB2 LYS 5 2HB LYS 5 3.415 -4.052 10.001 30 HB3 LYS 5 3HB LYS 5 4.897 -5.006 9.927 31 HG2 LYS 5 2HG LYS 5 6.129 -3.155 8.954 32 HG3 LYS 5 3HG LYS 5 4.650 -2.216 8.736 33 HD2 LYS 5 2HD LYS 5 4.400 -2.026 11.193 34 HD3 LYS 5 3HD LYS 5 5.871 -2.981 11.423 35 HE2 LYS 5 2HE LYS 5 7.194 -1.244 10.287 36 HE3 LYS 5 3HE LYS 5 5.732 -0.305 9.984 37 HZ1 LYS 5 1HZ LYS 5 6.762 -0.973 12.688 38 HZ2 LYS 5 2HZ LYS 5 5.470 0.051 12.323 39 HZ3 LYS 5 3HZ LYS 5 7.042 0.486 11.889 40 H GLU 6 H GLU 6 5.518 -6.793 7.913 41 HA GLU 6 HA GLU 6 7.743 -5.550 6.637 42 HB2 GLU 6 2HB GLU 6 8.812 -7.730 6.687 43 HB3 GLU 6 3HB GLU 6 7.966 -7.482 8.211 44 HG2 GLU 6 2HG GLU 6 6.129 -8.941 7.436 45 HG3 GLU 6 3HG GLU 6 6.955 -9.171 5.901 46 H LYS 7 H LYS 7 5.033 -7.485 5.488 47 HA LYS 7 HA LYS 7 5.914 -7.897 2.813 48 HB2 LYS 7 2HB LYS 7 3.077 -7.769 3.924 49 HB3 LYS 7 3HB LYS 7 3.528 -8.424 2.349 50 HG2 LYS 7 2HG LYS 7 4.811 -10.203 3.390 51 HG3 LYS 7 3HG LYS 7 4.532 -9.512 4.993 52 HD2 LYS 7 2HD LYS 7 2.114 -9.959 4.774 53 HD3 LYS 7 3HD LYS 7 2.373 -10.616 3.154 54 HE2 LYS 7 2HE LYS 7 3.553 -11.753 5.710 55 HE3 LYS 7 3HE LYS 7 2.141 -12.387 4.866 56 HZ1 LYS 7 1HZ LYS 7 4.120 -13.636 4.310 57 HZ2 LYS 7 2HZ LYS 7 4.893 -12.240 3.764 58 HZ3 LYS 7 3HZ LYS 7 3.542 -12.830 2.941 59 H LEU 8 H LEU 8 4.127 -5.311 4.402 60 HA LEU 8 HA LEU 8 3.556 -3.716 2.112 61 HB2 LEU 8 2HB LEU 8 3.880 -2.962 5.042 62 HB3 LEU 8 3HB LEU 8 3.265 -1.877 3.810 63 HG LEU 8 HG LEU 8 1.889 -4.456 4.658 64 HD11 LEU 8 1HD1 LEU 8 1.236 -1.595 5.441 65 HD12 LEU 8 2HD1 LEU 8 1.926 -2.833 6.496 66 HD13 LEU 8 3HD1 LEU 8 0.296 -3.033 5.860 67 HD21 LEU 8 1HD2 LEU 8 0.884 -2.185 2.904 68 HD22 LEU 8 2HD2 LEU 8 -0.045 -3.598 3.417 69 HD23 LEU 8 3HD2 LEU 8 1.343 -3.801 2.353 70 H GLU 9 H GLU 9 6.261 -3.866 4.438 71 HA GLU 9 HA GLU 9 7.768 -1.649 3.564 72 HB2 GLU 9 2HB GLU 9 8.713 -4.225 4.898 73 HB3 GLU 9 3HB GLU 9 9.697 -2.779 4.719 74 HG2 GLU 9 2HG GLU 9 7.179 -3.046 6.367 75 HG3 GLU 9 3HG GLU 9 8.820 -2.979 6.989 76 H LYS 10 H LYS 10 7.755 -5.062 2.612 77 HA LYS 10 HA LYS 10 9.878 -5.004 0.762 78 HB2 LYS 10 2HB LYS 10 7.459 -6.818 1.081 79 HB3 LYS 10 3HB LYS 10 8.582 -7.047 -0.254 80 HG2 LYS 10 2HG LYS 10 9.314 -7.151 2.693 81 HG3 LYS 10 3HG LYS 10 9.067 -8.554 1.648 82 HD2 LYS 10 2HD LYS 10 10.985 -7.898 0.256 83 HD3 LYS 10 3HD LYS 10 11.198 -6.419 1.195 84 HE2 LYS 10 2HE LYS 10 11.758 -7.765 3.186 85 HE3 LYS 10 3HE LYS 10 11.538 -9.247 2.250 86 HZ1 LYS 10 1HZ LYS 10 13.862 -8.633 2.396 87 HZ2 LYS 10 2HZ LYS 10 13.547 -7.131 1.696 88 HZ3 LYS 10 3HZ LYS 10 13.335 -8.545 0.795 89 H ALA 11 H ALA 11 6.338 -4.845 0.240 90 HA ALA 11 HA ALA 11 6.237 -4.393 -2.474 91 HB1 ALA 11 1HB ALA 11 4.275 -4.912 -1.085 92 HB2 ALA 11 2HB ALA 11 3.985 -3.482 -2.079 93 HB3 ALA 11 3HB ALA 11 4.345 -3.307 -0.357 94 H LEU 12 H LEU 12 6.605 -2.000 0.133 95 HA LEU 12 HA LEU 12 6.461 0.414 -1.194 96 HB2 LEU 12 2HB LEU 12 8.111 -0.540 1.155 97 HB3 LEU 12 3HB LEU 12 8.350 1.090 0.553 98 HG LEU 12 HG LEU 12 5.678 0.023 1.548 99 HD11 LEU 12 1HD1 LEU 12 7.288 0.092 3.383 100 HD12 LEU 12 2HD1 LEU 12 6.094 1.376 3.565 101 HD13 LEU 12 3HD1 LEU 12 7.716 1.759 2.982 102 HD21 LEU 12 1HD2 LEU 12 4.986 2.377 1.517 103 HD22 LEU 12 2HD2 LEU 12 5.478 1.857 -0.094 104 HD23 LEU 12 3HD2 LEU 12 6.562 2.856 0.880 105 H ILE 13 H ILE 13 9.410 -1.540 -0.663 106 HA ILE 13 HA ILE 13 11.148 0.112 -2.182 107 HB ILE 13 HB ILE 13 11.478 -2.794 -1.306 108 HG12 ILE 13 2HG1 ILE 13 12.460 -0.228 0.040 109 HG13 ILE 13 3HG1 ILE 13 11.072 -1.169 0.570 110 HG21 ILE 13 1HG2 ILE 13 13.918 -2.444 -1.568 111 HG22 ILE 13 2HG2 ILE 13 13.618 -0.833 -2.221 112 HG23 ILE 13 3HG2 ILE 13 13.073 -2.256 -3.109 113 HD11 ILE 13 1HD1 ILE 13 12.555 -3.064 1.050 114 HD12 ILE 13 2HD1 ILE 13 12.983 -1.617 1.961 115 HD13 ILE 13 3HD1 ILE 13 13.944 -2.088 0.560 116 H GLU 14 H GLU 14 9.298 -2.847 -2.987 117 HA GLU 14 HA GLU 14 10.416 -3.457 -5.488 118 HB2 GLU 14 2HB GLU 14 7.549 -3.919 -4.539 119 HB3 GLU 14 3HB GLU 14 8.315 -4.737 -5.897 120 HG2 GLU 14 2HG GLU 14 9.170 -4.969 -3.002 121 HG3 GLU 14 3HG GLU 14 8.183 -6.138 -3.861 122 H VAL 15 H VAL 15 7.996 -1.108 -4.543 123 HA VAL 15 HA VAL 15 7.434 -0.367 -7.367 124 HB VAL 15 HB VAL 15 5.299 0.498 -6.687 125 HG11 VAL 15 1HG1 VAL 15 4.169 -1.479 -5.731 126 HG12 VAL 15 2HG1 VAL 15 5.723 -2.141 -5.219 127 HG13 VAL 15 3HG1 VAL 15 5.365 -1.954 -6.938 128 HG21 VAL 15 1HG2 VAL 15 5.898 1.637 -4.605 129 HG22 VAL 15 2HG2 VAL 15 6.131 0.095 -3.782 130 HG23 VAL 15 3HG2 VAL 15 4.517 0.576 -4.313 131 H ARG 16 H ARG 16 9.267 0.550 -4.792 132 HA ARG 16 HA ARG 16 9.056 3.284 -4.478 133 HB2 ARG 16 2HB ARG 16 10.582 1.854 -3.173 134 HB3 ARG 16 3HB ARG 16 11.631 1.668 -4.574 135 HG2 ARG 16 2HG ARG 16 12.141 4.087 -4.509 136 HG3 ARG 16 3HG ARG 16 11.087 4.271 -3.103 137 HD2 ARG 16 2HD ARG 16 13.437 4.141 -2.415 138 HD3 ARG 16 3HD ARG 16 12.540 2.742 -1.813 139 HE ARG 16 HE ARG 16 13.664 2.015 -4.262 140 HH11 ARG 16 1HH1 ARG 16 14.861 2.940 -1.085 141 HH12 ARG 16 2HH1 ARG 16 16.319 2.014 -1.237 142 HH21 ARG 16 1HH2 ARG 16 15.558 0.801 -4.438 143 HH22 ARG 16 2HH2 ARG 16 16.714 0.796 -3.143 144 HA PRO 17 HA PRO 17 11.744 4.207 -8.456 145 HB2 PRO 17 2HB PRO 17 11.567 1.825 -10.218 146 HB3 PRO 17 3HB PRO 17 13.005 2.716 -9.674 147 HG2 PRO 17 2HG PRO 17 12.441 0.220 -8.790 148 HG3 PRO 17 3HG PRO 17 13.277 1.426 -7.779 149 HD2 PRO 17 2HD PRO 17 10.379 0.597 -7.743 150 HD3 PRO 17 3HD PRO 17 11.494 0.881 -6.384 151 H TYR 18 H TYR 18 8.755 2.489 -8.436 152 HA TYR 18 HA TYR 18 7.795 3.467 -11.025 153 HB2 TYR 18 2HB TYR 18 6.450 1.800 -8.840 154 HB3 TYR 18 3HB TYR 18 5.664 2.254 -10.345 155 HD1 TYR 18 HD1 TYR 18 8.740 0.439 -9.116 156 HD2 TYR 18 HD2 TYR 18 5.740 0.754 -12.153 157 HE1 TYR 18 HE1 TYR 18 9.595 -1.605 -10.187 158 HE2 TYR 18 HE2 TYR 18 6.601 -1.280 -13.219 159 HH TYR 18 HH TYR 18 8.616 -2.609 -13.320 160 H VAL 19 H VAL 19 7.370 4.165 -7.575 161 HA VAL 19 HA VAL 19 4.978 5.808 -8.143 162 HB VAL 19 HB VAL 19 4.386 5.613 -5.792 163 HG11 VAL 19 1HG1 VAL 19 3.664 3.814 -7.280 164 HG12 VAL 19 2HG1 VAL 19 3.961 3.179 -5.662 165 HG13 VAL 19 3HG1 VAL 19 5.140 2.901 -6.949 166 HG21 VAL 19 1HG2 VAL 19 5.685 4.230 -4.176 167 HG22 VAL 19 2HG2 VAL 19 6.581 5.651 -4.713 168 HG23 VAL 19 3HG2 VAL 19 6.975 4.063 -5.373 169 H GLU 20 H GLU 20 4.827 7.882 -7.635 170 HA GLU 20 HA GLU 20 7.083 9.323 -6.372 171 HB2 GLU 20 2HB GLU 20 5.473 11.393 -7.010 172 HB3 GLU 20 3HB GLU 20 6.604 10.712 -8.160 173 HG2 GLU 20 2HG GLU 20 3.719 9.810 -8.074 174 HG3 GLU 20 3HG GLU 20 4.221 11.243 -8.973 175 H TYR 21 H TYR 21 6.446 11.000 -4.746 176 HA TYR 21 HA TYR 21 5.710 11.497 -2.658 177 HB2 TYR 21 2HB TYR 21 3.019 10.422 -3.639 178 HB3 TYR 21 3HB TYR 21 3.266 11.484 -2.251 179 HD1 TYR 21 HD1 TYR 21 4.154 13.863 -2.657 180 HD2 TYR 21 HD2 TYR 21 2.846 11.352 -5.865 181 HE1 TYR 21 HE1 TYR 21 4.027 15.821 -4.143 182 HE2 TYR 21 HE2 TYR 21 2.715 13.307 -7.343 183 HH TYR 21 HH TYR 21 4.118 16.288 -6.588 184 H TYR 22 H TYR 22 7.072 9.214 -3.001 185 HA TYR 22 HA TYR 22 6.078 6.807 -1.979 186 HB2 TYR 22 2HB TYR 22 8.155 6.929 -3.262 187 HB3 TYR 22 3HB TYR 22 8.907 7.943 -2.034 188 HD1 TYR 22 HD1 TYR 22 7.396 4.527 -2.487 189 HD2 TYR 22 HD2 TYR 22 10.247 6.904 -0.361 190 HE1 TYR 22 HE1 TYR 22 8.256 2.518 -1.379 191 HE2 TYR 22 HE2 TYR 22 11.103 4.883 0.750 192 HH TYR 22 HH TYR 22 10.286 1.736 -0.281 193 H ASN 23 H ASN 23 7.375 9.656 -0.354 194 HA ASN 23 HA ASN 23 7.704 8.625 2.255 195 HB2 ASN 23 2HB ASN 23 6.965 11.474 1.418 196 HB3 ASN 23 3HB ASN 23 7.571 11.005 3.006 197 HD21 ASN 23 1HD2 ASN 23 8.722 12.930 1.231 198 HD22 ASN 23 2HD2 ASN 23 10.302 12.371 0.808 199 H GLU 24 H GLU 24 4.885 9.838 0.522 200 HA GLU 24 HA GLU 24 3.201 10.123 2.847 201 HB2 GLU 24 2HB GLU 24 2.358 10.217 -0.083 202 HB3 GLU 24 3HB GLU 24 1.532 10.939 1.296 203 HG2 GLU 24 2HG GLU 24 4.199 11.804 0.137 204 HG3 GLU 24 3HG GLU 24 2.666 12.650 -0.040 205 H LEU 25 H LEU 25 3.543 7.906 0.092 206 HA LEU 25 HA LEU 25 1.373 6.175 0.659 207 HB2 LEU 25 2HB LEU 25 2.426 6.293 -1.559 208 HB3 LEU 25 3HB LEU 25 3.955 5.738 -0.896 209 HG LEU 25 HG LEU 25 2.926 3.514 -0.403 210 HD11 LEU 25 1HD1 LEU 25 0.729 2.910 -1.323 211 HD12 LEU 25 2HD1 LEU 25 0.456 4.590 -1.795 212 HD13 LEU 25 3HD1 LEU 25 0.600 4.161 -0.087 213 HD21 LEU 25 1HD2 LEU 25 2.808 2.714 -2.722 214 HD22 LEU 25 2HD2 LEU 25 4.146 3.840 -2.500 215 HD23 LEU 25 3HD2 LEU 25 2.666 4.377 -3.301 216 H LYS 26 H LYS 26 4.853 5.992 1.353 217 HA LYS 26 HA LYS 26 4.938 3.704 2.940 218 HB2 LYS 26 2HB LYS 26 6.937 4.892 2.116 219 HB3 LYS 26 3HB LYS 26 6.622 6.222 3.224 220 HG2 LYS 26 2HG LYS 26 7.102 4.815 5.149 221 HG3 LYS 26 3HG LYS 26 7.194 3.379 4.126 222 HD2 LYS 26 2HD LYS 26 9.442 4.144 4.738 223 HD3 LYS 26 3HD LYS 26 9.190 4.293 2.995 224 HE2 LYS 26 2HE LYS 26 10.350 6.262 3.895 225 HE3 LYS 26 3HE LYS 26 8.767 6.716 3.268 226 HZ1 LYS 26 1HZ LYS 26 7.914 6.781 5.506 227 HZ2 LYS 26 2HZ LYS 26 9.300 7.744 5.416 228 HZ3 LYS 26 3HZ LYS 26 9.380 6.219 6.130 229 H ALA 27 H ALA 27 3.744 6.916 3.780 230 HA ALA 27 HA ALA 27 3.640 6.411 6.632 231 HB1 ALA 27 1HB ALA 27 2.477 8.673 4.976 232 HB2 ALA 27 2HB ALA 27 4.034 8.680 5.801 233 HB3 ALA 27 3HB ALA 27 2.545 8.618 6.744 234 H LEU 28 H LEU 28 1.479 6.159 3.835 235 HA LEU 28 HA LEU 28 -0.928 5.570 5.204 236 HB2 LEU 28 2HB LEU 28 -0.811 6.152 2.793 237 HB3 LEU 28 3HB LEU 28 0.027 4.648 2.463 238 HG LEU 28 HG LEU 28 -1.993 3.354 3.071 239 HD11 LEU 28 1HD1 LEU 28 -2.952 4.813 4.775 240 HD12 LEU 28 2HD1 LEU 28 -4.141 4.442 3.530 241 HD13 LEU 28 3HD1 LEU 28 -3.353 6.022 3.552 242 HD21 LEU 28 1HD2 LEU 28 -1.706 4.051 0.734 243 HD22 LEU 28 2HD2 LEU 28 -2.611 5.535 1.052 244 HD23 LEU 28 3HD2 LEU 28 -3.410 3.965 1.177 245 H VAL 29 H VAL 29 1.736 3.576 4.028 246 HA VAL 29 HA VAL 29 0.855 1.015 4.810 247 HB VAL 29 HB VAL 29 3.500 2.294 4.097 248 HG11 VAL 29 1HG1 VAL 29 4.704 0.121 4.359 249 HG12 VAL 29 2HG1 VAL 29 3.314 -0.495 5.254 250 HG13 VAL 29 3HG1 VAL 29 4.240 0.867 5.895 251 HG21 VAL 29 1HG2 VAL 29 2.002 1.595 2.291 252 HG22 VAL 29 2HG2 VAL 29 1.980 -0.054 2.923 253 HG23 VAL 29 3HG2 VAL 29 3.476 0.619 2.271 254 H SER 30 H SER 30 2.746 3.513 6.427 255 HA SER 30 HA SER 30 3.366 2.076 8.792 256 HB2 SER 30 2HB SER 30 4.614 4.068 7.969 257 HB3 SER 30 3HB SER 30 3.232 5.093 8.368 258 HG SER 30 HG SER 30 5.188 4.061 9.982 259 H LYS 31 H LYS 31 0.610 4.010 7.810 260 HA LYS 31 HA LYS 31 -0.635 4.314 10.365 261 HB2 LYS 31 2HB LYS 31 -1.130 5.854 8.512 262 HB3 LYS 31 3HB LYS 31 -1.712 4.522 7.519 263 HG2 LYS 31 2HG LYS 31 -3.539 4.166 9.251 264 HG3 LYS 31 3HG LYS 31 -3.022 5.682 10.000 265 HD2 LYS 31 2HD LYS 31 -3.530 6.899 7.928 266 HD3 LYS 31 3HD LYS 31 -3.938 5.386 7.114 267 HE2 LYS 31 2HE LYS 31 -5.986 6.519 7.739 268 HE3 LYS 31 3HE LYS 31 -5.820 5.074 8.736 269 HZ1 LYS 31 1HZ LYS 31 -5.139 7.841 9.583 270 HZ2 LYS 31 2HZ LYS 31 -5.039 6.456 10.548 271 HZ3 LYS 31 3HZ LYS 31 -6.541 7.001 10.009 272 H ILE 32 H ILE 32 -1.345 2.233 7.520 273 HA ILE 32 HA ILE 32 -3.594 0.967 8.672 274 HB ILE 32 HB ILE 32 -3.554 -0.584 6.726 275 HG12 ILE 32 2HG1 ILE 32 -0.921 0.778 5.973 276 HG13 ILE 32 3HG1 ILE 32 -1.071 -0.868 6.566 277 HG21 ILE 32 1HG2 ILE 32 -3.838 1.110 4.942 278 HG22 ILE 32 2HG2 ILE 32 -3.036 2.315 5.953 279 HG23 ILE 32 3HG2 ILE 32 -4.585 1.634 6.453 280 HD11 ILE 32 1HD1 ILE 32 -2.206 0.154 3.969 281 HD12 ILE 32 2HD1 ILE 32 -2.276 -1.507 4.567 282 HD13 ILE 32 3HD1 ILE 32 -0.721 -0.776 4.171 283 H SER 33 H SER 33 -0.192 -0.071 8.412 284 HA SER 33 HA SER 33 -0.340 -2.724 9.164 285 HB2 SER 33 2HB SER 33 2.039 -2.430 9.928 286 HB3 SER 33 3HB SER 33 1.718 -1.714 8.349 287 HG SER 33 HG SER 33 2.015 0.234 9.143 288 H SER 34 H SER 34 -0.708 0.087 11.193 289 HA SER 34 HA SER 34 -0.244 -1.253 13.717 290 HB2 SER 34 2HB SER 34 -1.382 1.521 13.175 291 HB3 SER 34 3HB SER 34 -0.657 0.945 14.681 292 HG SER 34 HG SER 34 0.551 1.738 12.303 293 H SER 35 H SER 35 -2.818 -1.324 11.626 294 HA SER 35 HA SER 35 -4.887 -1.546 13.740 295 HB2 SER 35 2HB SER 35 -5.245 -0.281 10.981 296 HB3 SER 35 3HB SER 35 -6.469 -0.415 12.252 297 HG SER 35 HG SER 35 -4.749 0.791 13.541 298 H VAL 36 H VAL 36 -3.568 -2.777 10.717 299 HA VAL 36 HA VAL 36 -5.826 -4.576 10.255 300 HB VAL 36 HB VAL 36 -4.692 -5.223 8.164 301 HG11 VAL 36 1HG1 VAL 36 -6.144 -3.252 8.113 302 HG12 VAL 36 2HG1 VAL 36 -4.805 -3.039 6.986 303 HG13 VAL 36 3HG1 VAL 36 -4.790 -2.202 8.542 304 HG21 VAL 36 1HG2 VAL 36 -2.587 -4.135 7.411 305 HG22 VAL 36 2HG2 VAL 36 -2.341 -5.128 8.848 306 HG23 VAL 36 3HG2 VAL 36 -2.424 -3.376 9.000 307 H ASN 37 H ASN 37 -5.860 -6.634 10.769 308 HA ASN 37 HA ASN 37 -3.702 -7.730 12.425 309 HB2 ASN 37 2HB ASN 37 -6.544 -8.755 12.032 310 HB3 ASN 37 3HB ASN 37 -5.401 -9.307 13.254 311 HD21 ASN 37 1HD2 ASN 37 -8.052 -8.227 13.642 312 HD22 ASN 37 2HD2 ASN 37 -7.888 -6.812 14.622 313 H ASP 38 H ASP 38 -5.218 -8.257 9.336 314 HA ASP 38 HA ASP 38 -3.521 -10.620 8.800 315 HB2 ASP 38 2HB ASP 38 -5.825 -11.411 9.286 316 HB3 ASP 38 3HB ASP 38 -6.475 -10.300 8.087 317 H LEU 39 H LEU 39 -3.210 -10.940 6.411 318 HA LEU 39 HA LEU 39 -2.321 -8.511 5.251 319 HB2 LEU 39 2HB LEU 39 -1.311 -10.853 5.027 320 HB3 LEU 39 3HB LEU 39 -2.557 -11.207 3.854 321 HG LEU 39 HG LEU 39 -0.196 -10.567 2.987 322 HD11 LEU 39 1HD1 LEU 39 -2.098 -10.737 1.485 323 HD12 LEU 39 2HD1 LEU 39 -1.005 -9.443 1.002 324 HD13 LEU 39 3HD1 LEU 39 -2.525 -9.057 1.815 325 HD21 LEU 39 1HD2 LEU 39 0.177 -8.614 4.447 326 HD22 LEU 39 2HD2 LEU 39 -1.124 -7.748 3.624 327 HD23 LEU 39 3HD2 LEU 39 0.335 -8.199 2.740 328 H GLU 40 H GLU 40 -5.159 -10.568 4.703 329 HA GLU 40 HA GLU 40 -6.253 -9.254 2.448 330 HB2 GLU 40 2HB GLU 40 -7.070 -11.442 3.122 331 HB3 GLU 40 3HB GLU 40 -7.600 -10.828 4.686 332 HG2 GLU 40 2HG GLU 40 -9.349 -9.503 3.625 333 HG3 GLU 40 3HG GLU 40 -8.768 -9.948 2.022 334 H GLU 41 H GLU 41 -6.312 -8.487 5.892 335 HA GLU 41 HA GLU 41 -8.431 -6.580 5.886 336 HB2 GLU 41 2HB GLU 41 -6.005 -6.696 7.728 337 HB3 GLU 41 3HB GLU 41 -7.467 -5.763 8.027 338 HG2 GLU 41 2HG GLU 41 -7.342 -8.779 7.825 339 HG3 GLU 41 3HG GLU 41 -7.327 -7.871 9.333 340 H ALA 42 H ALA 42 -4.925 -6.331 5.425 341 HA ALA 42 HA ALA 42 -4.747 -3.518 5.130 342 HB1 ALA 42 1HB ALA 42 -2.535 -3.950 4.136 343 HB2 ALA 42 2HB ALA 42 -2.909 -5.674 4.032 344 HB3 ALA 42 3HB ALA 42 -2.776 -4.891 5.607 345 H ILE 43 H ILE 43 -5.080 -6.187 2.801 346 HA ILE 43 HA ILE 43 -4.858 -4.763 0.415 347 HB ILE 43 HB ILE 43 -6.447 -7.282 1.063 348 HG12 ILE 43 2HG1 ILE 43 -3.795 -6.929 -0.417 349 HG13 ILE 43 3HG1 ILE 43 -3.962 -7.472 1.250 350 HG21 ILE 43 1HG2 ILE 43 -6.612 -7.705 -1.381 351 HG22 ILE 43 2HG2 ILE 43 -5.952 -6.100 -1.690 352 HG23 ILE 43 3HG2 ILE 43 -7.513 -6.268 -0.887 353 HD11 ILE 43 1HD1 ILE 43 -3.551 -9.352 -0.175 354 HD12 ILE 43 2HD1 ILE 43 -4.905 -8.925 -1.220 355 HD13 ILE 43 3HD1 ILE 43 -5.200 -9.455 0.440 356 H VAL 44 H VAL 44 -8.062 -5.929 1.684 357 HA VAL 44 HA VAL 44 -9.847 -4.452 0.370 358 HB VAL 44 HB VAL 44 -9.995 -4.896 3.394 359 HG11 VAL 44 1HG1 VAL 44 -12.454 -4.873 3.095 360 HG12 VAL 44 2HG1 VAL 44 -12.246 -4.477 1.386 361 HG13 VAL 44 3HG1 VAL 44 -11.729 -3.333 2.625 362 HG21 VAL 44 1HG2 VAL 44 -10.912 -6.752 1.152 363 HG22 VAL 44 2HG2 VAL 44 -11.159 -7.024 2.880 364 HG23 VAL 44 3HG2 VAL 44 -9.527 -7.015 2.212 365 H VAL 45 H VAL 45 -8.315 -3.223 3.402 366 HA VAL 45 HA VAL 45 -9.468 -0.660 3.462 367 HB VAL 45 HB VAL 45 -6.767 -1.604 4.528 368 HG11 VAL 45 1HG1 VAL 45 -6.641 0.504 5.859 369 HG12 VAL 45 2HG1 VAL 45 -8.045 1.128 4.990 370 HG13 VAL 45 3HG1 VAL 45 -6.541 0.816 4.124 371 HG21 VAL 45 1HG2 VAL 45 -8.751 -2.558 5.633 372 HG22 VAL 45 2HG2 VAL 45 -9.389 -0.941 5.932 373 HG23 VAL 45 3HG2 VAL 45 -7.907 -1.468 6.734 374 H LEU 46 H LEU 46 -6.459 -1.728 1.877 375 HA LEU 46 HA LEU 46 -5.716 0.820 0.839 376 HB2 LEU 46 2HB LEU 46 -4.838 -2.007 0.198 377 HB3 LEU 46 3HB LEU 46 -4.241 -0.648 -0.740 378 HG LEU 46 HG LEU 46 -3.829 -1.019 2.249 379 HD11 LEU 46 1HD1 LEU 46 -1.855 -1.345 -0.038 380 HD12 LEU 46 2HD1 LEU 46 -2.552 -2.647 0.930 381 HD13 LEU 46 3HD1 LEU 46 -1.483 -1.468 1.686 382 HD21 LEU 46 1HD2 LEU 46 -2.289 0.901 2.077 383 HD22 LEU 46 2HD2 LEU 46 -3.937 1.359 1.656 384 HD23 LEU 46 3HD2 LEU 46 -2.736 1.122 0.384 385 H ARG 47 H ARG 47 -7.787 -1.774 -0.410 386 HA ARG 47 HA ARG 47 -7.984 -0.768 -3.077 387 HB2 ARG 47 2HB ARG 47 -9.848 -2.641 -1.544 388 HB3 ARG 47 3HB ARG 47 -10.024 -2.243 -3.252 389 HG2 ARG 47 2HG ARG 47 -7.682 -3.183 -3.597 390 HG3 ARG 47 3HG ARG 47 -7.768 -3.787 -1.940 391 HD2 ARG 47 2HD ARG 47 -9.600 -4.529 -4.245 392 HD3 ARG 47 3HD ARG 47 -8.369 -5.555 -3.507 393 HE ARG 47 HE ARG 47 -10.749 -4.600 -2.012 394 HH11 ARG 47 1HH1 ARG 47 -8.682 -7.292 -3.012 395 HH12 ARG 47 2HH1 ARG 47 -9.528 -8.446 -2.028 396 HH21 ARG 47 1HH2 ARG 47 -11.851 -6.127 -0.767 397 HH22 ARG 47 2HH2 ARG 47 -11.327 -7.779 -0.755 398 H GLU 48 H GLU 48 -9.442 0.055 -0.069 399 HA GLU 48 HA GLU 48 -11.523 1.724 -1.233 400 HB2 GLU 48 2HB GLU 48 -10.590 1.433 1.657 401 HB3 GLU 48 3HB GLU 48 -12.002 2.343 1.131 402 HG2 GLU 48 2HG GLU 48 -11.604 -0.656 0.923 403 HG3 GLU 48 3HG GLU 48 -12.686 0.184 2.026 404 H GLU 49 H GLU 49 -8.306 2.010 0.154 405 HA GLU 49 HA GLU 49 -8.176 4.838 0.309 406 HB2 GLU 49 2HB GLU 49 -5.929 2.795 -0.017 407 HB3 GLU 49 3HB GLU 49 -5.668 4.508 0.285 408 HG2 GLU 49 2HG GLU 49 -6.913 2.478 2.137 409 HG3 GLU 49 3HG GLU 49 -5.423 3.390 2.371 410 H GLU 50 H GLU 50 -7.266 2.550 -2.217 411 HA GLU 50 HA GLU 50 -6.230 4.200 -4.184 412 HB2 GLU 50 2HB GLU 50 -6.317 1.701 -4.243 413 HB3 GLU 50 3HB GLU 50 -8.050 1.780 -4.549 414 HG2 GLU 50 2HG GLU 50 -7.442 3.133 -6.659 415 HG3 GLU 50 3HG GLU 50 -5.782 2.604 -6.378 416 H LYS 51 H LYS 51 -9.645 3.147 -3.880 417 HA LYS 51 HA LYS 51 -10.902 4.717 -5.760 418 HB2 LYS 51 2HB LYS 51 -11.895 3.712 -3.063 419 HB3 LYS 51 3HB LYS 51 -12.957 4.391 -4.294 420 HG2 LYS 51 2HG LYS 51 -12.633 2.569 -5.769 421 HG3 LYS 51 3HG LYS 51 -11.173 2.030 -4.938 422 HD2 LYS 51 2HD LYS 51 -13.107 0.521 -4.521 423 HD3 LYS 51 3HD LYS 51 -12.482 1.237 -3.038 424 HE2 LYS 51 2HE LYS 51 -14.348 2.873 -3.065 425 HE3 LYS 51 3HE LYS 51 -14.972 2.120 -4.534 426 HZ1 LYS 51 1HZ LYS 51 -15.311 0.080 -3.325 427 HZ2 LYS 51 2HZ LYS 51 -16.108 1.339 -2.536 428 HZ3 LYS 51 3HZ LYS 51 -14.651 0.739 -1.920 429 H LYS 52 H LYS 52 -10.082 5.587 -2.412 430 HA LYS 52 HA LYS 52 -11.431 8.144 -2.383 431 HB2 LYS 52 2HB LYS 52 -9.249 7.009 -0.565 432 HB3 LYS 52 3HB LYS 52 -10.143 8.496 -0.250 433 HG2 LYS 52 2HG LYS 52 -12.186 7.307 0.137 434 HG3 LYS 52 3HG LYS 52 -11.514 5.807 -0.511 435 HD2 LYS 52 2HD LYS 52 -9.834 5.845 1.406 436 HD3 LYS 52 3HD LYS 52 -10.748 7.190 2.093 437 HE2 LYS 52 2HE LYS 52 -12.721 5.771 2.323 438 HE3 LYS 52 3HE LYS 52 -11.892 4.438 1.513 439 HZ1 LYS 52 1HZ LYS 52 -11.843 4.093 3.863 440 HZ2 LYS 52 2HZ LYS 52 -11.180 5.623 4.142 441 HZ3 LYS 52 3HZ LYS 52 -10.272 4.442 3.345 442 H ALA 53 H ALA 53 -8.293 6.958 -3.316 443 HA ALA 53 HA ALA 53 -6.902 9.487 -3.226 444 HB1 ALA 53 1HB ALA 53 -5.003 8.239 -4.174 445 HB2 ALA 53 2HB ALA 53 -6.042 6.831 -4.429 446 HB3 ALA 53 3HB ALA 53 -5.697 7.390 -2.792 447 H SER 54 H SER 54 -6.379 10.774 -4.885 448 HA SER 54 HA SER 54 -7.419 10.209 -7.593 449 HB2 SER 54 2HB SER 54 -7.044 12.751 -7.865 450 HB3 SER 54 3HB SER 54 -8.346 12.262 -6.783 451 HG SER 54 HG SER 54 -5.954 13.524 -6.222 452 H GLU 55 H GLU 55 -6.019 10.601 -9.380 453 HA GLU 55 HA GLU 55 -3.420 9.540 -9.080 454 HB2 GLU 55 2HB GLU 55 -4.672 10.939 -11.477 455 HB3 GLU 55 3HB GLU 55 -3.184 9.992 -11.525 456 HG2 GLU 55 2HG GLU 55 -4.477 7.994 -10.773 457 HG3 GLU 55 3HG GLU 55 -5.954 8.957 -10.857 458 HA PRO 56 HA PRO 56 -1.204 9.690 -10.326 459 HB2 PRO 56 2HB PRO 56 1.275 9.930 -9.222 460 HB3 PRO 56 3HB PRO 56 0.779 10.892 -10.633 461 HG2 PRO 56 2HG PRO 56 0.762 11.700 -7.728 462 HG3 PRO 56 3HG PRO 56 1.463 12.557 -9.125 463 HD2 PRO 56 2HD PRO 56 -0.980 13.222 -8.188 464 HD3 PRO 56 3HD PRO 56 -0.627 13.255 -9.930 465 H PHE 57 H PHE 57 -1.754 10.654 -7.021 466 HA PHE 57 HA PHE 57 -0.513 8.531 -5.675 467 HB2 PHE 57 2HB PHE 57 -1.479 10.766 -4.722 468 HB3 PHE 57 3HB PHE 57 -2.979 9.865 -4.514 469 HD1 PHE 57 HD1 PHE 57 0.701 9.331 -3.876 470 HD2 PHE 57 HD2 PHE 57 -3.284 8.989 -2.336 471 HE1 PHE 57 HE1 PHE 57 1.591 8.447 -1.762 472 HE2 PHE 57 HE2 PHE 57 -2.375 8.103 -0.230 473 HZ PHE 57 HZ PHE 57 0.052 7.830 0.060 474 H LYS 58 H LYS 58 -3.707 8.573 -7.208 475 HA LYS 58 HA LYS 58 -4.681 6.157 -6.098 476 HB2 LYS 58 2HB LYS 58 -6.108 7.729 -7.414 477 HB3 LYS 58 3HB LYS 58 -5.292 7.213 -8.888 478 HG2 LYS 58 2HG LYS 58 -6.148 4.943 -8.636 479 HG3 LYS 58 3HG LYS 58 -6.815 5.333 -7.051 480 HD2 LYS 58 2HD LYS 58 -8.626 5.284 -8.641 481 HD3 LYS 58 3HD LYS 58 -8.374 6.962 -8.155 482 HE2 LYS 58 2HE LYS 58 -7.153 7.391 -10.248 483 HE3 LYS 58 3HE LYS 58 -7.347 5.700 -10.723 484 HZ1 LYS 58 1HZ LYS 58 -9.530 7.676 -10.327 485 HZ2 LYS 58 2HZ LYS 58 -9.758 6.046 -10.691 486 HZ3 LYS 58 3HZ LYS 58 -8.991 7.054 -11.807 487 H THR 59 H THR 59 -2.313 6.758 -8.525 488 HA THR 59 HA THR 59 -2.220 4.017 -9.516 489 HB THR 59 HB THR 59 -0.311 6.316 -10.135 490 HG1 THR 59 HG1 THR 59 -1.780 6.409 -12.083 491 HG21 THR 59 1HG2 THR 59 0.522 4.097 -10.867 492 HG22 THR 59 2HG2 THR 59 0.086 5.098 -12.252 493 HG23 THR 59 3HG2 THR 59 -0.995 3.807 -11.731 494 H ASP 60 H ASP 60 -0.306 6.268 -7.588 495 HA ASP 60 HA ASP 60 1.912 4.700 -7.007 496 HB2 ASP 60 2HB ASP 60 0.600 6.775 -5.196 497 HB3 ASP 60 3HB ASP 60 2.242 6.159 -5.015 498 H ILE 61 H ILE 61 -1.206 4.869 -5.290 499 HA ILE 61 HA ILE 61 -0.630 2.905 -3.313 500 HB ILE 61 HB ILE 61 -3.322 3.855 -4.399 501 HG12 ILE 61 2HG1 ILE 61 -1.831 4.534 -1.822 502 HG13 ILE 61 3HG1 ILE 61 -2.049 5.605 -3.201 503 HG21 ILE 61 1HG2 ILE 61 -4.387 2.765 -2.427 504 HG22 ILE 61 2HG2 ILE 61 -2.830 2.062 -1.985 505 HG23 ILE 61 3HG2 ILE 61 -3.615 1.580 -3.488 506 HD11 ILE 61 1HD1 ILE 61 -4.478 5.591 -2.787 507 HD12 ILE 61 2HD1 ILE 61 -3.543 6.218 -1.433 508 HD13 ILE 61 3HD1 ILE 61 -4.208 4.588 -1.358 509 H ARG 62 H ARG 62 -2.384 2.710 -6.491 510 HA ARG 62 HA ARG 62 -3.192 0.059 -6.144 511 HB2 ARG 62 2HB ARG 62 -4.093 0.107 -8.307 512 HB3 ARG 62 3HB ARG 62 -4.157 1.768 -7.767 513 HG2 ARG 62 2HG ARG 62 -3.454 2.109 -9.920 514 HG3 ARG 62 3HG ARG 62 -1.880 1.958 -9.140 515 HD2 ARG 62 2HD ARG 62 -2.060 0.680 -11.283 516 HD3 ARG 62 3HD ARG 62 -1.672 -0.349 -9.901 517 HE ARG 62 HE ARG 62 -4.497 -0.149 -10.561 518 HH11 ARG 62 1HH1 ARG 62 -1.563 -2.058 -11.062 519 HH12 ARG 62 2HH1 ARG 62 -2.440 -3.476 -11.541 520 HH21 ARG 62 1HH2 ARG 62 -5.606 -2.005 -11.167 521 HH22 ARG 62 2HH2 ARG 62 -4.735 -3.438 -11.599 522 H ILE 63 H ILE 63 -0.137 1.236 -7.561 523 HA ILE 63 HA ILE 63 0.678 -1.237 -8.716 524 HB ILE 63 HB ILE 63 2.458 1.041 -7.723 525 HG12 ILE 63 2HG1 ILE 63 1.366 0.501 -10.527 526 HG13 ILE 63 3HG1 ILE 63 0.836 1.790 -9.458 527 HG21 ILE 63 1HG2 ILE 63 3.131 -1.186 -9.684 528 HG22 ILE 63 2HG2 ILE 63 3.717 -1.075 -8.027 529 HG23 ILE 63 3HG2 ILE 63 4.199 0.139 -9.210 530 HD11 ILE 63 1HD1 ILE 63 3.575 1.518 -10.688 531 HD12 ILE 63 2HD1 ILE 63 3.079 2.788 -9.566 532 HD13 ILE 63 3HD1 ILE 63 2.310 2.658 -11.147 533 H LEU 64 H LEU 64 1.252 0.203 -5.496 534 HA LEU 64 HA LEU 64 2.818 -1.902 -4.408 535 HB2 LEU 64 2HB LEU 64 2.687 0.421 -3.511 536 HB3 LEU 64 3HB LEU 64 1.046 0.125 -2.975 537 HG LEU 64 HG LEU 64 3.275 -1.625 -1.888 538 HD11 LEU 64 1HD1 LEU 64 3.707 -0.071 -0.057 539 HD12 LEU 64 2HD1 LEU 64 2.646 1.128 -0.802 540 HD13 LEU 64 3HD1 LEU 64 4.135 0.638 -1.613 541 HD21 LEU 64 1HD2 LEU 64 1.869 -1.710 0.147 542 HD22 LEU 64 2HD2 LEU 64 0.973 -2.238 -1.275 543 HD23 LEU 64 3HD2 LEU 64 0.698 -0.625 -0.615 544 H LEU 65 H LEU 65 -0.586 -1.123 -4.238 545 HA LEU 65 HA LEU 65 -1.620 -3.062 -2.567 546 HB2 LEU 65 2HB LEU 65 -2.588 -0.897 -3.804 547 HB3 LEU 65 3HB LEU 65 -3.121 -2.059 -4.995 548 HG LEU 65 HG LEU 65 -4.048 -1.705 -2.143 549 HD11 LEU 65 1HD1 LEU 65 -5.500 -1.698 -4.801 550 HD12 LEU 65 2HD1 LEU 65 -5.081 -0.295 -3.812 551 HD13 LEU 65 3HD1 LEU 65 -6.242 -1.470 -3.215 552 HD21 LEU 65 1HD2 LEU 65 -4.727 -4.089 -3.882 553 HD22 LEU 65 2HD2 LEU 65 -5.508 -3.668 -2.353 554 HD23 LEU 65 3HD2 LEU 65 -3.805 -4.115 -2.378 555 H ASP 66 H ASP 66 -2.148 -3.099 -6.102 556 HA ASP 66 HA ASP 66 -2.773 -5.585 -6.760 557 HB2 ASP 66 2HB ASP 66 -2.660 -3.925 -8.453 558 HB3 ASP 66 3HB ASP 66 -0.975 -3.566 -8.132 559 H PHE 67 H PHE 67 0.701 -4.568 -6.525 560 HA PHE 67 HA PHE 67 1.978 -6.955 -6.972 561 HB2 PHE 67 2HB PHE 67 3.248 -4.902 -6.548 562 HB3 PHE 67 3HB PHE 67 2.712 -4.869 -4.872 563 HD1 PHE 67 HD1 PHE 67 4.662 -6.970 -7.297 564 HD2 PHE 67 HD2 PHE 67 4.052 -5.929 -3.187 565 HE1 PHE 67 HE1 PHE 67 6.594 -8.352 -6.653 566 HE2 PHE 67 HE2 PHE 67 5.983 -7.319 -2.556 567 HZ PHE 67 HZ PHE 67 7.253 -8.530 -4.287 568 H LEU 68 H LEU 68 0.559 -5.946 -3.829 569 HA LEU 68 HA LEU 68 1.300 -8.239 -2.323 570 HB2 LEU 68 2HB LEU 68 -1.051 -6.359 -1.898 571 HB3 LEU 68 3HB LEU 68 -0.484 -7.530 -0.716 572 HG LEU 68 HG LEU 68 1.142 -5.157 -1.722 573 HD11 LEU 68 1HD1 LEU 68 -0.314 -5.497 0.919 574 HD12 LEU 68 2HD1 LEU 68 -0.794 -4.428 -0.402 575 HD13 LEU 68 3HD1 LEU 68 0.717 -4.139 0.457 576 HD21 LEU 68 1HD2 LEU 68 2.677 -5.694 0.139 577 HD22 LEU 68 2HD2 LEU 68 2.581 -7.012 -1.027 578 HD23 LEU 68 3HD2 LEU 68 1.726 -7.134 0.516 579 H GLU 69 H GLU 69 -1.665 -7.463 -4.155 580 HA GLU 69 HA GLU 69 -3.050 -9.890 -3.488 581 HB2 GLU 69 2HB GLU 69 -3.558 -7.928 -5.769 582 HB3 GLU 69 3HB GLU 69 -4.666 -9.187 -5.232 583 HG2 GLU 69 2HG GLU 69 -4.711 -8.012 -2.970 584 HG3 GLU 69 3HG GLU 69 -3.851 -6.679 -3.745 585 H SER 70 H SER 70 -0.709 -8.975 -5.806 586 HA SER 70 HA SER 70 0.444 -9.897 -7.459 587 HB2 SER 70 2HB SER 70 0.914 -12.350 -7.397 588 HB3 SER 70 3HB SER 70 1.093 -11.598 -5.817 589 HG SER 70 HG SER 70 -1.398 -12.640 -6.381 590 H LYS 71 H LYS 71 -1.933 -8.927 -8.217 591 HA LYS 71 HA LYS 71 -3.498 -10.804 -9.777 592 HB2 LYS 71 2HB LYS 71 -3.550 -7.759 -9.702 593 HB3 LYS 71 3HB LYS 71 -4.728 -8.767 -10.540 594 HG2 LYS 71 2HG LYS 71 -5.504 -9.692 -8.422 595 HG3 LYS 71 3HG LYS 71 -4.253 -8.814 -7.542 596 HD2 LYS 71 2HD LYS 71 -6.552 -7.549 -9.095 597 HD3 LYS 71 3HD LYS 71 -6.456 -7.702 -7.339 598 HE2 LYS 71 2HE LYS 71 -4.343 -6.292 -7.435 599 HE3 LYS 71 3HE LYS 71 -4.692 -6.000 -9.138 600 HZ1 LYS 71 1HZ LYS 71 -5.498 -4.190 -7.804 601 HZ2 LYS 71 2HZ LYS 71 -6.393 -5.230 -6.823 602 HZ3 LYS 71 3HZ LYS 71 -6.827 -5.018 -8.442 603 HA PRO 72 HA PRO 72 -0.753 -10.220 -13.405 604 HB2 PRO 72 2HB PRO 72 -2.486 -12.120 -14.860 605 HB3 PRO 72 3HB PRO 72 -0.820 -12.354 -14.296 606 HG2 PRO 72 2HG PRO 72 -2.925 -13.697 -13.217 607 HG3 PRO 72 3HG PRO 72 -1.470 -13.274 -12.285 608 HD2 PRO 72 2HD PRO 72 -4.140 -11.850 -12.344 609 HD3 PRO 72 3HD PRO 72 -3.124 -12.286 -10.947 Start of MODEL 14 1 H GLY 1 1H GLY 1 8.067 -7.548 16.204 2 HA2 GLY 1 2HA GLY 1 6.133 -6.275 15.478 3 HA3 GLY 1 3HA GLY 1 7.272 -6.612 14.173 4 H SER 2 H SER 2 4.585 -5.974 13.701 5 HA SER 2 HA SER 2 2.847 -8.147 13.291 6 HB2 SER 2 2HB SER 2 2.992 -5.471 11.819 7 HB3 SER 2 3HB SER 2 1.610 -6.570 11.798 8 HG SER 2 HG SER 2 1.133 -6.048 13.820 9 H VAL 3 H VAL 3 2.897 -9.761 11.825 10 HA VAL 3 HA VAL 3 4.996 -10.114 9.961 11 HB VAL 3 HB VAL 3 3.755 -12.003 11.089 12 HG11 VAL 3 1HG1 VAL 3 1.631 -12.831 10.158 13 HG12 VAL 3 2HG1 VAL 3 1.542 -11.433 9.085 14 HG13 VAL 3 3HG1 VAL 3 1.448 -11.209 10.832 15 HG21 VAL 3 1HG2 VAL 3 5.225 -12.467 9.174 16 HG22 VAL 3 2HG2 VAL 3 3.887 -12.210 8.056 17 HG23 VAL 3 3HG2 VAL 3 3.845 -13.569 9.180 18 H VAL 4 H VAL 4 1.826 -8.683 9.724 19 HA VAL 4 HA VAL 4 1.553 -8.627 6.876 20 HB VAL 4 HB VAL 4 0.296 -6.856 9.040 21 HG11 VAL 4 1HG1 VAL 4 -0.544 -7.193 6.141 22 HG12 VAL 4 2HG1 VAL 4 0.150 -5.741 6.864 23 HG13 VAL 4 3HG1 VAL 4 -1.443 -6.303 7.370 24 HG21 VAL 4 1HG2 VAL 4 -0.830 -9.319 7.659 25 HG22 VAL 4 2HG2 VAL 4 -1.664 -8.328 8.859 26 HG23 VAL 4 3HG2 VAL 4 -0.231 -9.250 9.320 27 H LYS 5 H LYS 5 2.946 -6.493 9.347 28 HA LYS 5 HA LYS 5 3.139 -4.103 7.930 29 HB2 LYS 5 2HB LYS 5 3.535 -4.176 10.354 30 HB3 LYS 5 3HB LYS 5 4.989 -5.140 10.118 31 HG2 LYS 5 2HG LYS 5 6.052 -3.236 8.925 32 HG3 LYS 5 3HG LYS 5 4.594 -2.275 9.178 33 HD2 LYS 5 2HD LYS 5 4.938 -2.385 11.629 34 HD3 LYS 5 3HD LYS 5 6.375 -3.382 11.385 35 HE2 LYS 5 2HE LYS 5 7.466 -1.529 10.182 36 HE3 LYS 5 3HE LYS 5 6.029 -0.529 10.403 37 HZ1 LYS 5 1HZ LYS 5 7.783 -1.576 12.569 38 HZ2 LYS 5 2HZ LYS 5 6.367 -0.684 12.812 39 HZ3 LYS 5 3HZ LYS 5 7.683 0.028 12.033 40 H GLU 6 H GLU 6 5.686 -6.576 8.396 41 HA GLU 6 HA GLU 6 7.723 -5.475 6.891 42 HB2 GLU 6 2HB GLU 6 8.689 -7.744 6.868 43 HB3 GLU 6 3HB GLU 6 8.020 -7.363 8.451 44 HG2 GLU 6 2HG GLU 6 5.997 -8.698 7.917 45 HG3 GLU 6 3HG GLU 6 6.665 -9.063 6.336 46 H LYS 7 H LYS 7 4.998 -7.456 5.823 47 HA LYS 7 HA LYS 7 5.910 -8.054 3.194 48 HB2 LYS 7 2HB LYS 7 3.019 -7.769 4.124 49 HB3 LYS 7 3HB LYS 7 3.568 -8.591 2.670 50 HG2 LYS 7 2HG LYS 7 4.727 -10.277 4.033 51 HG3 LYS 7 3HG LYS 7 4.202 -9.450 5.501 52 HD2 LYS 7 2HD LYS 7 1.804 -9.842 4.758 53 HD3 LYS 7 3HD LYS 7 2.437 -10.836 3.443 54 HE2 LYS 7 2HE LYS 7 2.782 -11.359 6.411 55 HE3 LYS 7 3HE LYS 7 1.703 -12.224 5.321 56 HZ1 LYS 7 1HZ LYS 7 4.664 -12.193 5.154 57 HZ2 LYS 7 2HZ LYS 7 3.629 -13.024 4.111 58 HZ3 LYS 7 3HZ LYS 7 3.717 -13.463 5.742 59 H LEU 8 H LEU 8 3.950 -5.463 4.543 60 HA LEU 8 HA LEU 8 3.426 -4.022 2.141 61 HB2 LEU 8 2HB LEU 8 3.409 -3.032 5.030 62 HB3 LEU 8 3HB LEU 8 2.609 -2.259 3.670 63 HG LEU 8 HG LEU 8 1.877 -4.985 4.815 64 HD11 LEU 8 1HD1 LEU 8 -0.163 -3.940 5.671 65 HD12 LEU 8 2HD1 LEU 8 0.389 -2.363 5.106 66 HD13 LEU 8 3HD1 LEU 8 1.279 -3.207 6.372 67 HD21 LEU 8 1HD2 LEU 8 -0.097 -4.894 3.359 68 HD22 LEU 8 2HD2 LEU 8 1.400 -4.900 2.431 69 HD23 LEU 8 3HD2 LEU 8 0.495 -3.397 2.635 70 H GLU 9 H GLU 9 6.049 -4.013 4.513 71 HA GLU 9 HA GLU 9 7.224 -1.498 3.776 72 HB2 GLU 9 2HB GLU 9 8.359 -3.827 5.392 73 HB3 GLU 9 3HB GLU 9 9.160 -2.269 5.209 74 HG2 GLU 9 2HG GLU 9 6.457 -2.699 6.500 75 HG3 GLU 9 3HG GLU 9 7.978 -2.525 7.369 76 H LYS 10 H LYS 10 7.967 -4.921 3.021 77 HA LYS 10 HA LYS 10 10.299 -4.433 1.458 78 HB2 LYS 10 2HB LYS 10 8.352 -6.792 1.375 79 HB3 LYS 10 3HB LYS 10 9.893 -6.754 0.533 80 HG2 LYS 10 2HG LYS 10 9.523 -6.661 3.536 81 HG3 LYS 10 3HG LYS 10 9.995 -8.079 2.600 82 HD2 LYS 10 2HD LYS 10 12.071 -6.851 1.889 83 HD3 LYS 10 3HD LYS 10 11.597 -5.514 2.940 84 HE2 LYS 10 2HE LYS 10 11.697 -7.028 4.901 85 HE3 LYS 10 3HE LYS 10 12.188 -8.355 3.844 86 HZ1 LYS 10 1HZ LYS 10 13.711 -5.850 4.340 87 HZ2 LYS 10 2HZ LYS 10 14.171 -7.052 3.248 88 HZ3 LYS 10 3HZ LYS 10 14.107 -7.395 4.904 89 H ALA 11 H ALA 11 6.843 -4.643 0.771 90 HA ALA 11 HA ALA 11 6.946 -4.643 -2.064 91 HB1 ALA 11 1HB ALA 11 4.541 -4.145 -1.938 92 HB2 ALA 11 2HB ALA 11 4.693 -3.784 -0.216 93 HB3 ALA 11 3HB ALA 11 4.984 -5.421 -0.805 94 H LEU 12 H LEU 12 6.616 -2.048 0.366 95 HA LEU 12 HA LEU 12 6.330 0.214 -1.194 96 HB2 LEU 12 2HB LEU 12 7.797 -0.280 1.408 97 HB3 LEU 12 3HB LEU 12 7.834 1.318 0.685 98 HG LEU 12 HG LEU 12 5.285 -0.130 1.498 99 HD11 LEU 12 1HD1 LEU 12 6.645 0.391 3.467 100 HD12 LEU 12 2HD1 LEU 12 5.213 1.412 3.410 101 HD13 LEU 12 3HD1 LEU 12 6.784 2.076 2.956 102 HD21 LEU 12 1HD2 LEU 12 4.912 1.458 -0.328 103 HD22 LEU 12 2HD2 LEU 12 5.735 2.734 0.573 104 HD23 LEU 12 3HD2 LEU 12 4.210 2.075 1.168 105 H ILE 13 H ILE 13 9.317 -1.531 -0.387 106 HA ILE 13 HA ILE 13 11.143 0.223 -1.679 107 HB ILE 13 HB ILE 13 11.493 -2.734 -0.972 108 HG12 ILE 13 2HG1 ILE 13 12.255 -0.295 0.710 109 HG13 ILE 13 3HG1 ILE 13 10.838 -1.296 0.996 110 HG21 ILE 13 1HG2 ILE 13 13.925 -2.269 -0.978 111 HG22 ILE 13 2HG2 ILE 13 13.613 -0.611 -1.494 112 HG23 ILE 13 3HG2 ILE 13 13.208 -1.955 -2.562 113 HD11 ILE 13 1HD1 ILE 13 12.620 -1.853 2.524 114 HD12 ILE 13 2HD1 ILE 13 13.707 -2.204 1.181 115 HD13 ILE 13 3HD1 ILE 13 12.283 -3.213 1.454 116 H GLU 14 H GLU 14 9.495 -2.806 -2.651 117 HA GLU 14 HA GLU 14 10.784 -3.309 -5.084 118 HB2 GLU 14 2HB GLU 14 7.871 -3.931 -4.413 119 HB3 GLU 14 3HB GLU 14 8.817 -4.683 -5.689 120 HG2 GLU 14 2HG GLU 14 9.208 -4.990 -2.709 121 HG3 GLU 14 3HG GLU 14 8.613 -6.204 -3.829 122 H VAL 15 H VAL 15 7.905 -1.344 -4.349 123 HA VAL 15 HA VAL 15 7.574 -0.588 -7.158 124 HB VAL 15 HB VAL 15 5.407 0.283 -6.550 125 HG11 VAL 15 1HG1 VAL 15 4.269 -1.742 -5.713 126 HG12 VAL 15 2HG1 VAL 15 5.814 -2.402 -5.167 127 HG13 VAL 15 3HG1 VAL 15 5.519 -2.147 -6.889 128 HG21 VAL 15 1HG2 VAL 15 4.523 0.288 -4.224 129 HG22 VAL 15 2HG2 VAL 15 5.908 1.361 -4.418 130 HG23 VAL 15 3HG2 VAL 15 6.112 -0.202 -3.627 131 H ARG 16 H ARG 16 9.298 0.569 -4.519 132 HA ARG 16 HA ARG 16 8.857 3.298 -4.387 133 HB2 ARG 16 2HB ARG 16 10.473 2.170 -2.896 134 HB3 ARG 16 3HB ARG 16 11.601 1.982 -4.235 135 HG2 ARG 16 2HG ARG 16 11.604 4.555 -4.405 136 HG3 ARG 16 3HG ARG 16 10.755 4.555 -2.856 137 HD2 ARG 16 2HD ARG 16 13.127 4.891 -2.485 138 HD3 ARG 16 3HD ARG 16 12.671 3.309 -1.849 139 HE ARG 16 HE ARG 16 13.550 2.423 -4.049 140 HH11 ARG 16 1HH1 ARG 16 14.899 5.359 -2.645 141 HH12 ARG 16 2HH1 ARG 16 16.444 5.146 -3.412 142 HH21 ARG 16 1HH2 ARG 16 15.575 2.158 -5.033 143 HH22 ARG 16 2HH2 ARG 16 16.826 3.337 -4.758 144 HA PRO 17 HA PRO 17 11.758 4.291 -8.261 145 HB2 PRO 17 2HB PRO 17 12.112 2.247 -10.110 146 HB3 PRO 17 3HB PRO 17 13.261 2.600 -8.803 147 HG2 PRO 17 2HG PRO 17 11.097 0.515 -8.879 148 HG3 PRO 17 3HG PRO 17 12.784 0.363 -8.338 149 HD2 PRO 17 2HD PRO 17 10.781 0.640 -6.569 150 HD3 PRO 17 3HD PRO 17 12.363 1.409 -6.296 151 H TYR 18 H TYR 18 8.979 2.216 -8.306 152 HA TYR 18 HA TYR 18 7.972 3.044 -10.904 153 HB2 TYR 18 2HB TYR 18 6.822 1.224 -8.739 154 HB3 TYR 18 3HB TYR 18 5.996 1.569 -10.254 155 HD1 TYR 18 HD1 TYR 18 9.028 -0.058 -8.793 156 HD2 TYR 18 HD2 TYR 18 6.625 0.448 -12.293 157 HE1 TYR 18 HE1 TYR 18 10.272 -1.858 -9.916 158 HE2 TYR 18 HE2 TYR 18 7.867 -1.352 -13.406 159 HH TYR 18 HH TYR 18 10.124 -2.399 -13.234 160 H VAL 19 H VAL 19 7.414 3.918 -7.528 161 HA VAL 19 HA VAL 19 4.958 5.396 -8.276 162 HB VAL 19 HB VAL 19 4.275 5.334 -5.924 163 HG11 VAL 19 1HG1 VAL 19 3.770 2.932 -5.722 164 HG12 VAL 19 2HG1 VAL 19 4.991 2.564 -6.946 165 HG13 VAL 19 3HG1 VAL 19 3.559 3.502 -7.380 166 HG21 VAL 19 1HG2 VAL 19 5.478 3.993 -4.215 167 HG22 VAL 19 2HG2 VAL 19 6.449 5.348 -4.788 168 HG23 VAL 19 3HG2 VAL 19 6.795 3.719 -5.363 169 H GLU 20 H GLU 20 4.873 7.528 -8.114 170 HA GLU 20 HA GLU 20 6.742 9.067 -6.425 171 HB2 GLU 20 2HB GLU 20 5.787 11.087 -7.373 172 HB3 GLU 20 3HB GLU 20 6.222 10.024 -8.696 173 HG2 GLU 20 2HG GLU 20 3.391 10.211 -7.653 174 HG3 GLU 20 3HG GLU 20 4.005 11.315 -8.869 175 H TYR 21 H TYR 21 5.602 10.648 -4.896 176 HA TYR 21 HA TYR 21 4.536 10.852 -2.911 177 HB2 TYR 21 2HB TYR 21 2.271 9.348 -4.302 178 HB3 TYR 21 3HB TYR 21 2.144 10.012 -2.682 179 HD1 TYR 21 HD1 TYR 21 2.846 11.059 -6.210 180 HD2 TYR 21 HD2 TYR 21 1.347 12.223 -2.395 181 HE1 TYR 21 HE1 TYR 21 2.092 13.191 -7.161 182 HE2 TYR 21 HE2 TYR 21 0.593 14.356 -3.341 183 HH TYR 21 HH TYR 21 1.024 15.801 -5.214 184 H TYR 22 H TYR 22 6.258 8.537 -3.585 185 HA TYR 22 HA TYR 22 5.603 6.154 -2.360 186 HB2 TYR 22 2HB TYR 22 7.668 6.185 -3.554 187 HB3 TYR 22 3HB TYR 22 8.266 7.592 -2.680 188 HD1 TYR 22 HD1 TYR 22 7.306 3.983 -2.087 189 HD2 TYR 22 HD2 TYR 22 9.814 7.243 -0.894 190 HE1 TYR 22 HE1 TYR 22 8.441 2.535 -0.463 191 HE2 TYR 22 HE2 TYR 22 10.935 5.778 0.729 192 HH TYR 22 HH TYR 22 10.594 2.427 0.754 193 H ASN 23 H ASN 23 6.821 9.130 -0.888 194 HA ASN 23 HA ASN 23 7.250 8.105 1.729 195 HB2 ASN 23 2HB ASN 23 6.869 10.987 0.785 196 HB3 ASN 23 3HB ASN 23 7.480 10.514 2.371 197 HD21 ASN 23 1HD2 ASN 23 8.764 12.085 0.225 198 HD22 ASN 23 2HD2 ASN 23 10.241 11.265 -0.145 199 H GLU 24 H GLU 24 4.515 9.610 0.122 200 HA GLU 24 HA GLU 24 2.875 10.075 2.406 201 HB2 GLU 24 2HB GLU 24 2.036 9.688 -0.500 202 HB3 GLU 24 3HB GLU 24 1.065 10.431 0.762 203 HG2 GLU 24 2HG GLU 24 3.631 11.514 -0.419 204 HG3 GLU 24 3HG GLU 24 2.006 12.133 -0.695 205 H LEU 25 H LEU 25 2.874 7.569 -0.123 206 HA LEU 25 HA LEU 25 0.928 5.822 0.821 207 HB2 LEU 25 2HB LEU 25 2.001 5.772 -1.430 208 HB3 LEU 25 3HB LEU 25 3.498 5.229 -0.700 209 HG LEU 25 HG LEU 25 2.375 3.099 -0.019 210 HD11 LEU 25 1HD1 LEU 25 -0.021 4.128 -1.573 211 HD12 LEU 25 2HD1 LEU 25 0.062 3.855 0.172 212 HD13 LEU 25 3HD1 LEU 25 0.179 2.492 -0.937 213 HD21 LEU 25 1HD2 LEU 25 3.662 3.229 -2.116 214 HD22 LEU 25 2HD2 LEU 25 2.204 3.698 -2.997 215 HD23 LEU 25 3HD2 LEU 25 2.316 2.100 -2.259 216 H LYS 26 H LYS 26 4.411 5.956 1.380 217 HA LYS 26 HA LYS 26 4.826 3.683 2.925 218 HB2 LYS 26 2HB LYS 26 6.627 5.124 1.970 219 HB3 LYS 26 3HB LYS 26 6.239 6.381 3.138 220 HG2 LYS 26 2HG LYS 26 6.928 4.845 4.981 221 HG3 LYS 26 3HG LYS 26 7.346 3.624 3.774 222 HD2 LYS 26 2HD LYS 26 9.362 4.803 4.510 223 HD3 LYS 26 3HD LYS 26 9.045 5.157 2.810 224 HE2 LYS 26 2HE LYS 26 9.736 7.169 4.052 225 HE3 LYS 26 3HE LYS 26 8.095 7.341 3.426 226 HZ1 LYS 26 1HZ LYS 26 8.836 6.636 6.219 227 HZ2 LYS 26 2HZ LYS 26 7.257 6.776 5.636 228 HZ3 LYS 26 3HZ LYS 26 8.257 8.137 5.696 229 H ALA 27 H ALA 27 3.695 6.943 3.907 230 HA ALA 27 HA ALA 27 3.703 6.420 6.738 231 HB1 ALA 27 1HB ALA 27 3.874 8.713 5.842 232 HB2 ALA 27 2HB ALA 27 2.471 8.559 6.901 233 HB3 ALA 27 3HB ALA 27 2.261 8.582 5.145 234 H LEU 28 H LEU 28 1.394 6.134 4.104 235 HA LEU 28 HA LEU 28 -1.005 5.921 5.619 236 HB2 LEU 28 2HB LEU 28 -1.035 6.689 3.308 237 HB3 LEU 28 3HB LEU 28 -0.293 5.199 2.750 238 HG LEU 28 HG LEU 28 -2.362 3.940 3.280 239 HD11 LEU 28 1HD1 LEU 28 -3.528 6.602 4.154 240 HD12 LEU 28 2HD1 LEU 28 -3.180 5.208 5.183 241 HD13 LEU 28 3HD1 LEU 28 -4.430 5.096 3.948 242 HD21 LEU 28 1HD2 LEU 28 -3.800 4.881 1.511 243 HD22 LEU 28 2HD2 LEU 28 -2.107 4.872 1.030 244 HD23 LEU 28 3HD2 LEU 28 -2.868 6.381 1.537 245 H VAL 29 H VAL 29 1.045 3.522 3.995 246 HA VAL 29 HA VAL 29 -0.648 1.312 4.703 247 HB VAL 29 HB VAL 29 0.602 1.577 2.492 248 HG11 VAL 29 1HG1 VAL 29 3.009 0.623 4.065 249 HG12 VAL 29 2HG1 VAL 29 2.804 2.227 3.360 250 HG13 VAL 29 3HG1 VAL 29 2.910 0.814 2.309 251 HG21 VAL 29 1HG2 VAL 29 -0.484 -0.522 3.140 252 HG22 VAL 29 2HG2 VAL 29 0.996 -1.046 3.943 253 HG23 VAL 29 3HG2 VAL 29 0.978 -0.820 2.195 254 H SER 30 H SER 30 2.516 2.587 5.753 255 HA SER 30 HA SER 30 3.087 0.544 7.658 256 HB2 SER 30 2HB SER 30 4.762 2.231 6.818 257 HB3 SER 30 3HB SER 30 3.986 3.457 7.826 258 HG SER 30 HG SER 30 5.252 1.050 8.644 259 H LYS 31 H LYS 31 0.977 3.357 7.750 260 HA LYS 31 HA LYS 31 0.420 3.366 10.548 261 HB2 LYS 31 2HB LYS 31 -0.034 5.328 9.170 262 HB3 LYS 31 3HB LYS 31 -1.144 4.419 8.154 263 HG2 LYS 31 2HG LYS 31 -2.681 4.184 10.105 264 HG3 LYS 31 3HG LYS 31 -1.579 5.176 11.063 265 HD2 LYS 31 2HD LYS 31 -1.909 7.074 9.535 266 HD3 LYS 31 3HD LYS 31 -2.932 6.086 8.490 267 HE2 LYS 31 2HE LYS 31 -3.564 6.878 11.349 268 HE3 LYS 31 3HE LYS 31 -4.271 7.583 9.894 269 HZ1 LYS 31 1HZ LYS 31 -5.108 5.316 9.355 270 HZ2 LYS 31 2HZ LYS 31 -5.784 6.001 10.740 271 HZ3 LYS 31 3HZ LYS 31 -4.597 4.811 10.886 272 H ILE 32 H ILE 32 -1.277 1.895 7.716 273 HA ILE 32 HA ILE 32 -3.348 0.732 9.325 274 HB ILE 32 HB ILE 32 -4.178 -0.421 7.368 275 HG12 ILE 32 2HG1 ILE 32 -1.645 0.417 5.888 276 HG13 ILE 32 3HG1 ILE 32 -2.015 -1.221 6.409 277 HG21 ILE 32 1HG2 ILE 32 -4.559 1.487 5.852 278 HG22 ILE 32 2HG2 ILE 32 -3.224 2.362 6.602 279 HG23 ILE 32 3HG2 ILE 32 -4.668 1.982 7.541 280 HD11 ILE 32 1HD1 ILE 32 -3.540 0.385 4.357 281 HD12 ILE 32 2HD1 ILE 32 -3.962 -1.242 4.904 282 HD13 ILE 32 3HD1 ILE 32 -2.445 -0.963 4.051 283 H SER 33 H SER 33 -0.167 -0.354 8.413 284 HA SER 33 HA SER 33 -0.164 -3.056 9.018 285 HB2 SER 33 2HB SER 33 1.901 -0.967 9.838 286 HB3 SER 33 3HB SER 33 2.183 -2.707 9.822 287 HG SER 33 HG SER 33 1.234 -1.621 7.464 288 H SER 34 H SER 34 -0.431 -0.325 11.203 289 HA SER 34 HA SER 34 -0.125 -1.890 13.659 290 HB2 SER 34 2HB SER 34 0.973 0.328 13.444 291 HB3 SER 34 3HB SER 34 -0.599 1.097 13.229 292 HG SER 34 HG SER 34 -1.037 0.817 15.315 293 H SER 35 H SER 35 -2.604 -1.505 11.589 294 HA SER 35 HA SER 35 -4.727 -1.255 13.645 295 HB2 SER 35 2HB SER 35 -4.834 -0.386 10.716 296 HB3 SER 35 3HB SER 35 -6.108 -0.173 11.920 297 HG SER 35 HG SER 35 -4.167 0.933 13.087 298 H VAL 36 H VAL 36 -3.653 -2.955 10.713 299 HA VAL 36 HA VAL 36 -6.031 -4.697 10.687 300 HB VAL 36 HB VAL 36 -5.320 -5.483 8.499 301 HG11 VAL 36 1HG1 VAL 36 -5.096 -2.450 8.630 302 HG12 VAL 36 2HG1 VAL 36 -6.585 -3.392 8.517 303 HG13 VAL 36 3HG1 VAL 36 -5.444 -3.392 7.173 304 HG21 VAL 36 1HG2 VAL 36 -3.284 -4.653 7.333 305 HG22 VAL 36 2HG2 VAL 36 -2.899 -5.590 8.776 306 HG23 VAL 36 3HG2 VAL 36 -2.788 -3.832 8.816 307 H ASN 37 H ASN 37 -5.946 -6.801 11.356 308 HA ASN 37 HA ASN 37 -3.484 -7.795 12.563 309 HB2 ASN 37 2HB ASN 37 -4.761 -9.449 13.650 310 HB3 ASN 37 3HB ASN 37 -5.857 -8.086 13.572 311 HD21 ASN 37 1HD2 ASN 37 -6.603 -8.601 10.733 312 HD22 ASN 37 2HD2 ASN 37 -7.614 -9.992 10.774 313 H ASP 38 H ASP 38 -4.953 -7.996 9.490 314 HA ASP 38 HA ASP 38 -3.279 -10.284 8.699 315 HB2 ASP 38 2HB ASP 38 -5.741 -10.972 9.292 316 HB3 ASP 38 3HB ASP 38 -6.181 -10.182 7.782 317 H LEU 39 H LEU 39 -2.848 -10.421 6.443 318 HA LEU 39 HA LEU 39 -2.294 -7.932 5.184 319 HB2 LEU 39 2HB LEU 39 -0.995 -10.169 5.099 320 HB3 LEU 39 3HB LEU 39 -2.157 -10.702 3.909 321 HG LEU 39 HG LEU 39 0.096 -9.933 3.009 322 HD11 LEU 39 1HD1 LEU 39 -2.246 -8.426 1.858 323 HD12 LEU 39 2HD1 LEU 39 -1.804 -10.095 1.503 324 HD13 LEU 39 3HD1 LEU 39 -0.719 -8.786 1.044 325 HD21 LEU 39 1HD2 LEU 39 0.456 -8.011 4.500 326 HD22 LEU 39 2HD2 LEU 39 -0.868 -7.146 3.715 327 HD23 LEU 39 3HD2 LEU 39 0.587 -7.553 2.803 328 H GLU 40 H GLU 40 -4.827 -10.305 4.890 329 HA GLU 40 HA GLU 40 -6.259 -9.692 2.627 330 HB2 GLU 40 2HB GLU 40 -6.890 -11.478 4.188 331 HB3 GLU 40 3HB GLU 40 -7.238 -10.304 5.449 332 HG2 GLU 40 2HG GLU 40 -9.073 -9.406 3.869 333 HG3 GLU 40 3HG GLU 40 -8.833 -10.882 2.940 334 H GLU 41 H GLU 41 -6.367 -8.062 5.784 335 HA GLU 41 HA GLU 41 -8.456 -6.210 5.054 336 HB2 GLU 41 2HB GLU 41 -6.633 -6.135 7.478 337 HB3 GLU 41 3HB GLU 41 -8.167 -5.292 7.287 338 HG2 GLU 41 2HG GLU 41 -9.322 -7.501 7.218 339 HG3 GLU 41 3HG GLU 41 -7.765 -8.285 7.514 340 H ALA 42 H ALA 42 -4.960 -6.265 5.142 341 HA ALA 42 HA ALA 42 -4.433 -3.475 5.018 342 HB1 ALA 42 1HB ALA 42 -2.745 -5.788 3.960 343 HB2 ALA 42 2HB ALA 42 -2.679 -5.125 5.593 344 HB3 ALA 42 3HB ALA 42 -2.188 -4.128 4.225 345 H ILE 43 H ILE 43 -4.768 -6.008 2.561 346 HA ILE 43 HA ILE 43 -4.485 -4.480 0.233 347 HB ILE 43 HB ILE 43 -5.892 -7.114 0.803 348 HG12 ILE 43 2HG1 ILE 43 -3.339 -6.400 -0.712 349 HG13 ILE 43 3HG1 ILE 43 -3.433 -7.149 0.877 350 HG21 ILE 43 1HG2 ILE 43 -5.676 -5.849 -1.948 351 HG22 ILE 43 2HG2 ILE 43 -7.165 -6.136 -1.050 352 HG23 ILE 43 3HG2 ILE 43 -6.206 -7.500 -1.621 353 HD11 ILE 43 1HD1 ILE 43 -4.168 -8.375 -1.771 354 HD12 ILE 43 2HD1 ILE 43 -4.513 -9.122 -0.210 355 HD13 ILE 43 3HD1 ILE 43 -2.844 -8.816 -0.688 356 H VAL 44 H VAL 44 -7.714 -5.725 1.424 357 HA VAL 44 HA VAL 44 -9.270 -4.197 -0.208 358 HB VAL 44 HB VAL 44 -10.134 -6.095 1.078 359 HG11 VAL 44 1HG1 VAL 44 -10.850 -5.883 3.418 360 HG12 VAL 44 2HG1 VAL 44 -10.137 -4.271 3.496 361 HG13 VAL 44 3HG1 VAL 44 -9.105 -5.680 3.244 362 HG21 VAL 44 1HG2 VAL 44 -11.804 -3.588 1.520 363 HG22 VAL 44 2HG2 VAL 44 -12.408 -5.247 1.536 364 HG23 VAL 44 3HG2 VAL 44 -11.759 -4.557 0.047 365 H VAL 45 H VAL 45 -8.114 -3.104 3.035 366 HA VAL 45 HA VAL 45 -9.350 -0.573 3.100 367 HB VAL 45 HB VAL 45 -6.661 -1.490 4.212 368 HG11 VAL 45 1HG1 VAL 45 -6.519 0.620 5.523 369 HG12 VAL 45 2HG1 VAL 45 -7.902 1.260 4.632 370 HG13 VAL 45 3HG1 VAL 45 -6.395 0.915 3.786 371 HG21 VAL 45 1HG2 VAL 45 -7.825 -1.326 6.402 372 HG22 VAL 45 2HG2 VAL 45 -8.666 -2.418 5.303 373 HG23 VAL 45 3HG2 VAL 45 -9.296 -0.794 5.578 374 H LEU 46 H LEU 46 -6.221 -1.501 1.554 375 HA LEU 46 HA LEU 46 -5.686 1.079 0.437 376 HB2 LEU 46 2HB LEU 46 -4.591 -1.654 -0.291 377 HB3 LEU 46 3HB LEU 46 -4.043 -0.176 -1.063 378 HG LEU 46 HG LEU 46 -3.749 -0.812 1.899 379 HD11 LEU 46 1HD1 LEU 46 -1.633 -0.800 -0.277 380 HD12 LEU 46 2HD1 LEU 46 -2.329 -2.233 0.486 381 HD13 LEU 46 3HD1 LEU 46 -1.374 -1.107 1.443 382 HD21 LEU 46 1HD2 LEU 46 -3.973 1.604 1.531 383 HD22 LEU 46 2HD2 LEU 46 -2.683 1.565 0.328 384 HD23 LEU 46 3HD2 LEU 46 -2.329 1.195 2.018 385 H ARG 47 H ARG 47 -7.671 -1.607 -0.684 386 HA ARG 47 HA ARG 47 -7.980 -0.806 -3.380 387 HB2 ARG 47 2HB ARG 47 -9.907 -2.368 -1.605 388 HB3 ARG 47 3HB ARG 47 -10.099 -2.153 -3.344 389 HG2 ARG 47 2HG ARG 47 -7.839 -3.279 -3.632 390 HG3 ARG 47 3HG ARG 47 -7.909 -3.679 -1.913 391 HD2 ARG 47 2HD ARG 47 -8.684 -5.567 -3.246 392 HD3 ARG 47 3HD ARG 47 -10.037 -4.905 -2.315 393 HE ARG 47 HE ARG 47 -9.981 -3.672 -4.845 394 HH11 ARG 47 1HH1 ARG 47 -10.674 -6.834 -3.481 395 HH12 ARG 47 2HH1 ARG 47 -11.775 -7.271 -4.748 396 HH21 ARG 47 1HH2 ARG 47 -11.439 -4.238 -6.479 397 HH22 ARG 47 2HH2 ARG 47 -12.209 -5.796 -6.453 398 H GLU 48 H GLU 48 -9.370 0.350 -0.434 399 HA GLU 48 HA GLU 48 -11.401 2.003 -1.751 400 HB2 GLU 48 2HB GLU 48 -10.636 1.892 1.198 401 HB3 GLU 48 3HB GLU 48 -12.057 2.671 0.509 402 HG2 GLU 48 2HG GLU 48 -12.849 0.420 -0.271 403 HG3 GLU 48 3HG GLU 48 -11.484 -0.304 0.578 404 H GLU 49 H GLU 49 -8.226 2.189 -0.274 405 HA GLU 49 HA GLU 49 -8.011 4.995 -0.009 406 HB2 GLU 49 2HB GLU 49 -5.835 2.882 -0.338 407 HB3 GLU 49 3HB GLU 49 -5.488 4.584 -0.055 408 HG2 GLU 49 2HG GLU 49 -6.955 2.708 1.809 409 HG3 GLU 49 3HG GLU 49 -5.336 3.374 2.031 410 H GLU 50 H GLU 50 -6.997 2.812 -2.628 411 HA GLU 50 HA GLU 50 -6.101 4.574 -4.549 412 HB2 GLU 50 2HB GLU 50 -6.061 2.134 -4.868 413 HB3 GLU 50 3HB GLU 50 -7.819 2.077 -4.924 414 HG2 GLU 50 2HG GLU 50 -7.697 3.525 -7.006 415 HG3 GLU 50 3HG GLU 50 -5.950 3.298 -6.976 416 H LYS 51 H LYS 51 -9.490 3.455 -4.157 417 HA LYS 51 HA LYS 51 -10.804 4.935 -6.063 418 HB2 LYS 51 2HB LYS 51 -11.792 4.072 -3.315 419 HB3 LYS 51 3HB LYS 51 -12.843 4.686 -4.585 420 HG2 LYS 51 2HG LYS 51 -12.321 2.767 -6.008 421 HG3 LYS 51 3HG LYS 51 -11.166 2.168 -4.811 422 HD2 LYS 51 2HD LYS 51 -13.326 0.949 -4.665 423 HD3 LYS 51 3HD LYS 51 -12.989 1.836 -3.176 424 HE2 LYS 51 2HE LYS 51 -14.522 3.643 -3.942 425 HE3 LYS 51 3HE LYS 51 -14.886 2.702 -5.388 426 HZ1 LYS 51 1HZ LYS 51 -16.581 2.439 -3.687 427 HZ2 LYS 51 2HZ LYS 51 -15.437 1.842 -2.597 428 HZ3 LYS 51 3HZ LYS 51 -15.808 0.971 -3.995 429 H LYS 52 H LYS 52 -10.101 5.950 -2.702 430 HA LYS 52 HA LYS 52 -11.733 8.356 -2.984 431 HB2 LYS 52 2HB LYS 52 -11.499 8.599 -0.580 432 HB3 LYS 52 3HB LYS 52 -11.920 6.938 -0.964 433 HG2 LYS 52 2HG LYS 52 -9.341 6.495 -0.789 434 HG3 LYS 52 3HG LYS 52 -9.306 8.027 0.079 435 HD2 LYS 52 2HD LYS 52 -10.858 5.526 0.842 436 HD3 LYS 52 3HD LYS 52 -9.445 6.183 1.665 437 HE2 LYS 52 2HE LYS 52 -12.180 7.489 1.509 438 HE3 LYS 52 3HE LYS 52 -11.486 6.683 2.914 439 HZ1 LYS 52 1HZ LYS 52 -9.722 8.348 2.922 440 HZ2 LYS 52 2HZ LYS 52 -11.247 9.041 3.117 441 HZ3 LYS 52 3HZ LYS 52 -10.454 9.149 1.629 442 H ALA 53 H ALA 53 -8.377 7.488 -3.081 443 HA ALA 53 HA ALA 53 -7.382 10.221 -2.936 444 HB1 ALA 53 1HB ALA 53 -5.219 9.227 -3.598 445 HB2 ALA 53 2HB ALA 53 -6.004 7.666 -3.865 446 HB3 ALA 53 3HB ALA 53 -5.928 8.352 -2.242 447 H SER 54 H SER 54 -6.507 11.353 -4.709 448 HA SER 54 HA SER 54 -7.483 10.619 -7.410 449 HB2 SER 54 2HB SER 54 -7.119 13.022 -7.949 450 HB3 SER 54 3HB SER 54 -8.186 12.859 -6.555 451 HG SER 54 HG SER 54 -6.529 14.451 -6.258 452 H GLU 55 H GLU 55 -5.998 10.870 -9.173 453 HA GLU 55 HA GLU 55 -3.390 9.839 -8.775 454 HB2 GLU 55 2HB GLU 55 -4.569 11.196 -11.249 455 HB3 GLU 55 3HB GLU 55 -3.099 10.223 -11.220 456 HG2 GLU 55 2HG GLU 55 -4.428 8.254 -10.507 457 HG3 GLU 55 3HG GLU 55 -5.895 9.229 -10.596 458 HA PRO 56 HA PRO 56 -1.211 10.013 -9.885 459 HB2 PRO 56 2HB PRO 56 1.271 10.840 -8.538 460 HB3 PRO 56 3HB PRO 56 0.933 10.731 -10.275 461 HG2 PRO 56 2HG PRO 56 1.335 13.108 -9.014 462 HG3 PRO 56 3HG PRO 56 0.286 12.945 -10.443 463 HD2 PRO 56 2HD PRO 56 -0.509 13.007 -7.522 464 HD3 PRO 56 3HD PRO 56 -1.192 13.923 -8.894 465 H PHE 57 H PHE 57 -1.810 10.999 -6.613 466 HA PHE 57 HA PHE 57 -0.519 8.890 -5.211 467 HB2 PHE 57 2HB PHE 57 -1.460 11.013 -4.180 468 HB3 PHE 57 3HB PHE 57 -3.065 10.309 -4.318 469 HD1 PHE 57 HD1 PHE 57 0.224 8.869 -3.167 470 HD2 PHE 57 HD2 PHE 57 -3.802 9.844 -2.110 471 HE1 PHE 57 HE1 PHE 57 0.564 7.887 -0.943 472 HE2 PHE 57 HE2 PHE 57 -3.452 8.847 0.114 473 HZ PHE 57 HZ PHE 57 -1.267 7.868 0.701 474 H LYS 58 H LYS 58 -3.680 9.019 -6.834 475 HA LYS 58 HA LYS 58 -4.649 6.457 -6.068 476 HB2 LYS 58 2HB LYS 58 -6.083 8.147 -7.158 477 HB3 LYS 58 3HB LYS 58 -5.145 8.014 -8.637 478 HG2 LYS 58 2HG LYS 58 -5.892 5.580 -8.767 479 HG3 LYS 58 3HG LYS 58 -6.995 5.922 -7.435 480 HD2 LYS 58 2HD LYS 58 -7.008 7.364 -10.115 481 HD3 LYS 58 3HD LYS 58 -8.078 6.030 -9.698 482 HE2 LYS 58 2HE LYS 58 -7.993 8.718 -8.289 483 HE3 LYS 58 3HE LYS 58 -9.186 8.233 -9.490 484 HZ1 LYS 58 1HZ LYS 58 -8.786 7.029 -6.808 485 HZ2 LYS 58 2HZ LYS 58 -9.842 6.416 -7.975 486 HZ3 LYS 58 3HZ LYS 58 -10.107 7.951 -7.321 487 H THR 59 H THR 59 -2.319 7.472 -8.498 488 HA THR 59 HA THR 59 -2.126 4.892 -9.797 489 HB THR 59 HB THR 59 -0.297 7.312 -10.155 490 HG1 THR 59 HG1 THR 59 -1.769 7.774 -11.922 491 HG21 THR 59 1HG2 THR 59 0.583 5.234 -11.179 492 HG22 THR 59 2HG2 THR 59 0.066 6.368 -12.427 493 HG23 THR 59 3HG2 THR 59 -0.950 4.984 -12.018 494 H ASP 60 H ASP 60 -0.625 6.520 -7.200 495 HA ASP 60 HA ASP 60 1.796 5.003 -7.016 496 HB2 ASP 60 2HB ASP 60 1.971 7.126 -6.068 497 HB3 ASP 60 3HB ASP 60 0.320 7.147 -5.484 498 H ILE 61 H ILE 61 -1.351 5.005 -5.409 499 HA ILE 61 HA ILE 61 -0.813 3.000 -3.479 500 HB ILE 61 HB ILE 61 -3.485 4.097 -4.479 501 HG12 ILE 61 2HG1 ILE 61 -1.993 4.618 -1.860 502 HG13 ILE 61 3HG1 ILE 61 -1.962 5.697 -3.247 503 HG21 ILE 61 1HG2 ILE 61 -4.547 3.036 -2.494 504 HG22 ILE 61 2HG2 ILE 61 -3.018 2.250 -2.102 505 HG23 ILE 61 3HG2 ILE 61 -3.865 1.829 -3.589 506 HD11 ILE 61 1HD1 ILE 61 -3.481 6.493 -1.558 507 HD12 ILE 61 2HD1 ILE 61 -4.386 4.981 -1.613 508 HD13 ILE 61 3HD1 ILE 61 -4.366 6.054 -3.017 509 H ARG 62 H ARG 62 -2.602 2.914 -6.626 510 HA ARG 62 HA ARG 62 -3.325 0.232 -6.563 511 HB2 ARG 62 2HB ARG 62 -3.496 0.332 -9.041 512 HB3 ARG 62 3HB ARG 62 -4.279 1.681 -8.231 513 HG2 ARG 62 2HG ARG 62 -2.537 3.189 -8.846 514 HG3 ARG 62 3HG ARG 62 -1.503 1.885 -9.413 515 HD2 ARG 62 2HD ARG 62 -2.504 3.063 -11.308 516 HD3 ARG 62 3HD ARG 62 -3.137 1.420 -11.229 517 HE ARG 62 HE ARG 62 -5.202 2.290 -10.356 518 HH11 ARG 62 1HH1 ARG 62 -3.047 4.770 -11.624 519 HH12 ARG 62 2HH1 ARG 62 -4.316 5.930 -11.861 520 HH21 ARG 62 1HH2 ARG 62 -6.862 3.775 -10.774 521 HH22 ARG 62 2HH2 ARG 62 -6.479 5.357 -11.379 522 H ILE 63 H ILE 63 -0.204 1.566 -7.790 523 HA ILE 63 HA ILE 63 0.811 -0.838 -8.865 524 HB ILE 63 HB ILE 63 2.386 1.518 -7.738 525 HG12 ILE 63 2HG1 ILE 63 1.629 0.852 -10.625 526 HG13 ILE 63 3HG1 ILE 63 0.884 2.104 -9.641 527 HG21 ILE 63 1HG2 ILE 63 3.822 -0.482 -7.832 528 HG22 ILE 63 2HG2 ILE 63 4.317 0.689 -9.053 529 HG23 ILE 63 3HG2 ILE 63 3.385 -0.735 -9.523 530 HD11 ILE 63 1HD1 ILE 63 3.772 2.068 -10.531 531 HD12 ILE 63 2HD1 ILE 63 2.989 3.332 -9.576 532 HD13 ILE 63 3HD1 ILE 63 2.470 3.029 -11.232 533 H LEU 64 H LEU 64 1.015 0.463 -5.539 534 HA LEU 64 HA LEU 64 2.639 -1.625 -4.445 535 HB2 LEU 64 2HB LEU 64 2.252 0.583 -3.302 536 HB3 LEU 64 3HB LEU 64 0.571 0.145 -3.061 537 HG LEU 64 HG LEU 64 1.454 -1.875 -1.690 538 HD11 LEU 64 1HD1 LEU 64 3.663 -1.655 -0.687 539 HD12 LEU 64 2HD1 LEU 64 4.006 -0.250 -1.698 540 HD13 LEU 64 3HD1 LEU 64 3.767 -1.837 -2.437 541 HD21 LEU 64 1HD2 LEU 64 1.888 0.904 -0.555 542 HD22 LEU 64 2HD2 LEU 64 1.662 -0.580 0.373 543 HD23 LEU 64 3HD2 LEU 64 0.352 0.036 -0.629 544 H LEU 65 H LEU 65 -0.824 -0.981 -4.511 545 HA LEU 65 HA LEU 65 -1.802 -3.038 -2.928 546 HB2 LEU 65 2HB LEU 65 -3.113 -1.069 -3.406 547 HB3 LEU 65 3HB LEU 65 -3.013 -1.345 -5.135 548 HG LEU 65 HG LEU 65 -4.510 -3.326 -4.898 549 HD11 LEU 65 1HD1 LEU 65 -3.997 -3.964 -2.586 550 HD12 LEU 65 2HD1 LEU 65 -5.725 -3.769 -2.850 551 HD13 LEU 65 3HD1 LEU 65 -4.823 -2.517 -1.995 552 HD21 LEU 65 1HD2 LEU 65 -6.574 -2.055 -4.548 553 HD22 LEU 65 2HD2 LEU 65 -5.418 -1.129 -5.499 554 HD23 LEU 65 3HD2 LEU 65 -5.664 -0.744 -3.793 555 H ASP 66 H ASP 66 -2.306 -2.872 -6.486 556 HA ASP 66 HA ASP 66 -3.003 -5.327 -7.228 557 HB2 ASP 66 2HB ASP 66 -2.663 -3.382 -8.736 558 HB3 ASP 66 3HB ASP 66 -0.921 -3.553 -8.601 559 H PHE 67 H PHE 67 0.444 -4.380 -7.046 560 HA PHE 67 HA PHE 67 1.778 -6.760 -7.368 561 HB2 PHE 67 2HB PHE 67 2.898 -4.580 -7.114 562 HB3 PHE 67 3HB PHE 67 2.423 -4.504 -5.424 563 HD1 PHE 67 HD1 PHE 67 4.498 -6.469 -7.837 564 HD2 PHE 67 HD2 PHE 67 3.861 -5.406 -3.741 565 HE1 PHE 67 HE1 PHE 67 6.601 -7.581 -7.212 566 HE2 PHE 67 HE2 PHE 67 5.967 -6.521 -3.129 567 HZ PHE 67 HZ PHE 67 7.335 -7.608 -4.864 568 H LEU 68 H LEU 68 0.488 -5.534 -4.239 569 HA LEU 68 HA LEU 68 1.257 -7.715 -2.593 570 HB2 LEU 68 2HB LEU 68 -0.930 -5.626 -2.277 571 HB3 LEU 68 3HB LEU 68 -0.581 -6.806 -1.026 572 HG LEU 68 HG LEU 68 1.510 -4.844 -2.046 573 HD11 LEU 68 1HD1 LEU 68 1.046 -3.454 -0.082 574 HD12 LEU 68 2HD1 LEU 68 -0.307 -4.496 0.363 575 HD13 LEU 68 3HD1 LEU 68 -0.365 -3.560 -1.132 576 HD21 LEU 68 1HD2 LEU 68 2.431 -6.819 -0.937 577 HD22 LEU 68 2HD2 LEU 68 1.395 -6.552 0.467 578 HD23 LEU 68 3HD2 LEU 68 2.662 -5.389 0.069 579 H GLU 69 H GLU 69 -1.715 -7.100 -4.460 580 HA GLU 69 HA GLU 69 -3.257 -9.272 -3.449 581 HB2 GLU 69 2HB GLU 69 -3.558 -7.817 -6.106 582 HB3 GLU 69 3HB GLU 69 -4.782 -8.811 -5.327 583 HG2 GLU 69 2HG GLU 69 -4.929 -7.204 -3.480 584 HG3 GLU 69 3HG GLU 69 -3.677 -6.217 -4.227 585 H SER 70 H SER 70 -0.766 -9.024 -5.856 586 HA SER 70 HA SER 70 0.455 -10.536 -6.999 587 HB2 SER 70 2HB SER 70 -0.645 -12.502 -4.939 588 HB3 SER 70 3HB SER 70 0.828 -12.708 -5.894 589 HG SER 70 HG SER 70 0.457 -10.458 -4.227 590 H LYS 71 H LYS 71 -2.388 -10.222 -7.948 591 HA LYS 71 HA LYS 71 -3.497 -12.751 -8.596 592 HB2 LYS 71 2HB LYS 71 -5.212 -11.605 -9.783 593 HB3 LYS 71 3HB LYS 71 -4.787 -10.542 -8.458 594 HG2 LYS 71 2HG LYS 71 -3.859 -10.185 -11.331 595 HG3 LYS 71 3HG LYS 71 -5.230 -9.349 -10.611 596 HD2 LYS 71 2HD LYS 71 -2.348 -9.107 -9.671 597 HD3 LYS 71 3HD LYS 71 -3.171 -7.944 -10.710 598 HE2 LYS 71 2HE LYS 71 -4.108 -8.656 -7.912 599 HE3 LYS 71 3HE LYS 71 -3.052 -7.298 -8.285 600 HZ1 LYS 71 1HZ LYS 71 -4.772 -6.336 -9.630 601 HZ2 LYS 71 2HZ LYS 71 -5.366 -6.640 -8.076 602 HZ3 LYS 71 3HZ LYS 71 -5.792 -7.659 -9.358 603 HA PRO 72 HA PRO 72 -1.412 -13.630 -12.597 604 HB2 PRO 72 2HB PRO 72 -3.362 -15.289 -13.680 605 HB3 PRO 72 3HB PRO 72 -2.144 -15.831 -12.512 606 HG2 PRO 72 2HG PRO 72 -5.005 -15.101 -12.043 607 HG3 PRO 72 3HG PRO 72 -4.045 -16.416 -11.328 608 HD2 PRO 72 2HD PRO 72 -4.572 -14.099 -9.992 609 HD3 PRO 72 3HD PRO 72 -3.080 -15.030 -9.737 Start of MODEL 15 1 H GLY 1 1H GLY 1 3.131 -5.661 17.435 2 HA2 GLY 1 2HA GLY 1 3.786 -5.359 15.144 3 HA3 GLY 1 3HA GLY 1 4.709 -6.655 15.896 4 H SER 2 H SER 2 2.043 -5.927 13.693 5 HA SER 2 HA SER 2 1.326 -8.586 13.012 6 HB2 SER 2 2HB SER 2 0.954 -6.005 11.428 7 HB3 SER 2 3HB SER 2 0.085 -7.517 11.153 8 HG SER 2 HG SER 2 -1.245 -6.353 12.401 9 H VAL 3 H VAL 3 2.274 -10.007 11.620 10 HA VAL 3 HA VAL 3 4.589 -9.667 10.119 11 HB VAL 3 HB VAL 3 3.575 -11.855 10.772 12 HG11 VAL 3 1HG1 VAL 3 1.653 -11.440 8.459 13 HG12 VAL 3 2HG1 VAL 3 1.235 -11.437 10.174 14 HG13 VAL 3 3HG1 VAL 3 1.828 -12.916 9.416 15 HG21 VAL 3 1HG2 VAL 3 4.274 -13.151 8.805 16 HG22 VAL 3 2HG2 VAL 3 5.400 -11.828 9.116 17 HG23 VAL 3 3HG2 VAL 3 4.226 -11.697 7.805 18 H VAL 4 H VAL 4 1.455 -8.495 9.377 19 HA VAL 4 HA VAL 4 1.423 -8.184 6.606 20 HB VAL 4 HB VAL 4 0.463 -6.101 8.624 21 HG11 VAL 4 1HG1 VAL 4 0.329 -5.328 6.308 22 HG12 VAL 4 2HG1 VAL 4 -1.290 -5.591 6.958 23 HG13 VAL 4 3HG1 VAL 4 -0.581 -6.770 5.853 24 HG21 VAL 4 1HG2 VAL 4 -0.350 -8.289 9.350 25 HG22 VAL 4 2HG2 VAL 4 -1.012 -8.601 7.744 26 HG23 VAL 4 3HG2 VAL 4 -1.686 -7.307 8.739 27 H LYS 5 H LYS 5 2.973 -6.220 9.156 28 HA LYS 5 HA LYS 5 3.377 -3.881 7.703 29 HB2 LYS 5 2HB LYS 5 3.575 -4.029 10.194 30 HB3 LYS 5 3HB LYS 5 5.125 -4.846 10.009 31 HG2 LYS 5 2HG LYS 5 6.078 -2.840 8.922 32 HG3 LYS 5 3HG LYS 5 4.508 -2.034 9.011 33 HD2 LYS 5 2HD LYS 5 4.656 -2.272 11.543 34 HD3 LYS 5 3HD LYS 5 6.323 -2.810 11.320 35 HE2 LYS 5 2HE LYS 5 5.205 -0.128 10.448 36 HE3 LYS 5 3HE LYS 5 6.187 -0.410 11.883 37 HZ1 LYS 5 1HZ LYS 5 8.001 -1.112 10.439 38 HZ2 LYS 5 2HZ LYS 5 7.509 0.464 10.098 39 HZ3 LYS 5 3HZ LYS 5 7.053 -0.794 9.071 40 H GLU 6 H GLU 6 5.633 -6.636 8.148 41 HA GLU 6 HA GLU 6 7.878 -5.490 6.887 42 HB2 GLU 6 2HB GLU 6 8.762 -7.803 6.804 43 HB3 GLU 6 3HB GLU 6 8.061 -7.444 8.378 44 HG2 GLU 6 2HG GLU 6 6.005 -8.674 7.730 45 HG3 GLU 6 3HG GLU 6 6.729 -9.049 6.172 46 H LYS 7 H LYS 7 5.136 -7.323 5.679 47 HA LYS 7 HA LYS 7 6.055 -7.860 3.039 48 HB2 LYS 7 2HB LYS 7 3.159 -7.467 3.927 49 HB3 LYS 7 3HB LYS 7 3.712 -8.338 2.498 50 HG2 LYS 7 2HG LYS 7 4.757 -10.051 3.914 51 HG3 LYS 7 3HG LYS 7 4.279 -9.159 5.362 52 HD2 LYS 7 2HD LYS 7 1.862 -9.470 4.636 53 HD3 LYS 7 3HD LYS 7 2.451 -10.538 3.356 54 HE2 LYS 7 2HE LYS 7 2.771 -10.953 6.348 55 HE3 LYS 7 3HE LYS 7 1.712 -11.863 5.271 56 HZ1 LYS 7 1HZ LYS 7 4.682 -11.819 5.153 57 HZ2 LYS 7 2HZ LYS 7 3.671 -12.699 4.119 58 HZ3 LYS 7 3HZ LYS 7 3.734 -13.073 5.766 59 H LEU 8 H LEU 8 4.363 -5.152 4.512 60 HA LEU 8 HA LEU 8 3.882 -3.617 2.145 61 HB2 LEU 8 2HB LEU 8 4.027 -2.713 5.045 62 HB3 LEU 8 3HB LEU 8 3.274 -1.828 3.727 63 HG LEU 8 HG LEU 8 2.300 -4.524 4.758 64 HD11 LEU 8 1HD1 LEU 8 0.468 -3.292 5.814 65 HD12 LEU 8 2HD1 LEU 8 1.207 -1.760 5.329 66 HD13 LEU 8 3HD1 LEU 8 2.034 -2.824 6.469 67 HD21 LEU 8 1HD2 LEU 8 0.280 -4.070 3.450 68 HD22 LEU 8 2HD2 LEU 8 1.705 -4.134 2.417 69 HD23 LEU 8 3HD2 LEU 8 0.994 -2.573 2.839 70 H GLU 9 H GLU 9 6.508 -3.777 4.529 71 HA GLU 9 HA GLU 9 7.824 -1.343 3.796 72 HB2 GLU 9 2HB GLU 9 9.047 -3.776 5.171 73 HB3 GLU 9 3HB GLU 9 9.733 -2.156 5.137 74 HG2 GLU 9 2HG GLU 9 7.187 -2.998 6.544 75 HG3 GLU 9 3HG GLU 9 8.730 -2.682 7.310 76 H LYS 10 H LYS 10 8.330 -4.784 2.991 77 HA LYS 10 HA LYS 10 10.467 -4.444 1.187 78 HB2 LYS 10 2HB LYS 10 8.354 -6.640 1.199 79 HB3 LYS 10 3HB LYS 10 9.894 -6.712 0.352 80 HG2 LYS 10 2HG LYS 10 9.503 -6.631 3.355 81 HG3 LYS 10 3HG LYS 10 9.918 -8.050 2.399 82 HD2 LYS 10 2HD LYS 10 12.097 -7.047 1.823 83 HD3 LYS 10 3HD LYS 10 11.671 -5.577 2.710 84 HE2 LYS 10 2HE LYS 10 11.526 -6.898 4.806 85 HE3 LYS 10 3HE LYS 10 11.985 -8.352 3.915 86 HZ1 LYS 10 1HZ LYS 10 13.655 -5.916 4.189 87 HZ2 LYS 10 2HZ LYS 10 14.097 -7.344 3.404 88 HZ3 LYS 10 3HZ LYS 10 13.857 -7.343 5.075 89 H ALA 11 H ALA 11 6.900 -4.545 0.714 90 HA ALA 11 HA ALA 11 6.836 -4.651 -2.075 91 HB1 ALA 11 1HB ALA 11 4.905 -5.145 -0.649 92 HB2 ALA 11 2HB ALA 11 4.501 -3.938 -1.872 93 HB3 ALA 11 3HB ALA 11 4.784 -3.442 -0.198 94 H LEU 12 H LEU 12 6.424 -1.759 0.029 95 HA LEU 12 HA LEU 12 6.550 0.364 -1.565 96 HB2 LEU 12 2HB LEU 12 8.167 -0.159 0.938 97 HB3 LEU 12 3HB LEU 12 8.259 1.394 0.129 98 HG LEU 12 HG LEU 12 5.750 0.195 1.366 99 HD11 LEU 12 1HD1 LEU 12 7.540 2.473 2.272 100 HD12 LEU 12 2HD1 LEU 12 7.358 0.900 3.058 101 HD13 LEU 12 3HD1 LEU 12 6.004 2.024 3.010 102 HD21 LEU 12 1HD2 LEU 12 4.725 2.405 0.909 103 HD22 LEU 12 2HD2 LEU 12 5.171 1.571 -0.576 104 HD23 LEU 12 3HD2 LEU 12 6.176 2.891 0.025 105 H ILE 13 H ILE 13 9.423 -1.619 -0.807 106 HA ILE 13 HA ILE 13 11.284 0.052 -2.226 107 HB ILE 13 HB ILE 13 11.611 -2.758 -1.062 108 HG12 ILE 13 2HG1 ILE 13 12.405 -0.059 0.141 109 HG13 ILE 13 3HG1 ILE 13 10.993 -0.989 0.620 110 HG21 ILE 13 1HG2 ILE 13 14.048 -2.343 -1.136 111 HG22 ILE 13 2HG2 ILE 13 13.763 -0.805 -1.951 112 HG23 ILE 13 3HG2 ILE 13 13.344 -2.320 -2.754 113 HD11 ILE 13 1HD1 ILE 13 13.871 -1.828 0.965 114 HD12 ILE 13 2HD1 ILE 13 12.460 -2.792 1.411 115 HD13 ILE 13 3HD1 ILE 13 12.772 -1.257 2.221 116 H GLU 14 H GLU 14 9.507 -2.949 -2.898 117 HA GLU 14 HA GLU 14 10.869 -3.736 -5.253 118 HB2 GLU 14 2HB GLU 14 7.965 -4.302 -4.494 119 HB3 GLU 14 3HB GLU 14 8.914 -5.185 -5.687 120 HG2 GLU 14 2HG GLU 14 9.365 -5.123 -2.694 121 HG3 GLU 14 3HG GLU 14 8.737 -6.468 -3.632 122 H VAL 15 H VAL 15 7.774 -1.933 -4.825 123 HA VAL 15 HA VAL 15 7.768 -1.111 -7.604 124 HB VAL 15 HB VAL 15 5.558 -0.168 -7.149 125 HG11 VAL 15 1HG1 VAL 15 5.684 -2.584 -7.613 126 HG12 VAL 15 2HG1 VAL 15 4.338 -2.218 -6.532 127 HG13 VAL 15 3HG1 VAL 15 5.825 -2.923 -5.886 128 HG21 VAL 15 1HG2 VAL 15 4.491 -0.293 -4.906 129 HG22 VAL 15 2HG2 VAL 15 5.912 0.751 -4.893 130 HG23 VAL 15 3HG2 VAL 15 6.015 -0.875 -4.223 131 H ARG 16 H ARG 16 9.497 -0.017 -5.090 132 HA ARG 16 HA ARG 16 9.143 2.720 -4.845 133 HB2 ARG 16 2HB ARG 16 10.791 1.456 -3.537 134 HB3 ARG 16 3HB ARG 16 11.821 1.282 -4.950 135 HG2 ARG 16 2HG ARG 16 12.273 3.685 -4.967 136 HG3 ARG 16 3HG ARG 16 11.127 3.938 -3.647 137 HD2 ARG 16 2HD ARG 16 12.551 2.554 -2.154 138 HD3 ARG 16 3HD ARG 16 13.704 2.332 -3.476 139 HE ARG 16 HE ARG 16 13.870 4.881 -3.417 140 HH11 ARG 16 1HH1 ARG 16 13.277 2.968 -0.519 141 HH12 ARG 16 2HH1 ARG 16 14.001 4.136 0.539 142 HH21 ARG 16 1HH2 ARG 16 14.808 6.396 -2.018 143 HH22 ARG 16 2HH2 ARG 16 14.869 6.081 -0.309 144 HA PRO 17 HA PRO 17 11.675 3.819 -8.837 145 HB2 PRO 17 2HB PRO 17 12.219 1.947 -10.735 146 HB3 PRO 17 3HB PRO 17 13.253 2.138 -9.300 147 HG2 PRO 17 2HG PRO 17 11.035 0.146 -9.750 148 HG3 PRO 17 3HG PRO 17 12.696 -0.140 -9.176 149 HD2 PRO 17 2HD PRO 17 10.628 0.063 -7.445 150 HD3 PRO 17 3HD PRO 17 12.249 0.660 -7.034 151 H TYR 18 H TYR 18 8.737 2.317 -8.518 152 HA TYR 18 HA TYR 18 7.760 3.054 -11.216 153 HB2 TYR 18 2HB TYR 18 6.570 0.934 -9.370 154 HB3 TYR 18 3HB TYR 18 6.091 1.279 -11.029 155 HD1 TYR 18 HD1 TYR 18 8.632 1.406 -12.506 156 HD2 TYR 18 HD2 TYR 18 7.489 -1.259 -9.360 157 HE1 TYR 18 HE1 TYR 18 10.251 -0.253 -13.315 158 HE2 TYR 18 HE2 TYR 18 9.115 -2.914 -10.172 159 HH TYR 18 HH TYR 18 10.291 -3.479 -12.286 160 H VAL 19 H VAL 19 7.310 3.552 -7.762 161 HA VAL 19 HA VAL 19 4.734 4.952 -8.267 162 HB VAL 19 HB VAL 19 4.282 4.862 -5.843 163 HG11 VAL 19 1HG1 VAL 19 3.802 2.459 -5.646 164 HG12 VAL 19 2HG1 VAL 19 4.878 2.121 -7.005 165 HG13 VAL 19 3HG1 VAL 19 3.411 3.072 -7.255 166 HG21 VAL 19 1HG2 VAL 19 6.557 4.865 -4.941 167 HG22 VAL 19 2HG2 VAL 19 6.852 3.251 -5.587 168 HG23 VAL 19 3HG2 VAL 19 5.659 3.484 -4.304 169 H GLU 20 H GLU 20 4.371 6.955 -7.633 170 HA GLU 20 HA GLU 20 6.517 8.763 -6.778 171 HB2 GLU 20 2HB GLU 20 3.698 9.190 -7.851 172 HB3 GLU 20 3HB GLU 20 4.563 10.491 -7.044 173 HG2 GLU 20 2HG GLU 20 4.756 10.712 -9.453 174 HG3 GLU 20 3HG GLU 20 6.331 10.412 -8.726 175 H TYR 21 H TYR 21 5.949 10.350 -5.009 176 HA TYR 21 HA TYR 21 5.299 10.949 -2.915 177 HB2 TYR 21 2HB TYR 21 2.818 9.381 -3.732 178 HB3 TYR 21 3HB TYR 21 2.917 10.222 -2.193 179 HD1 TYR 21 HD1 TYR 21 3.193 10.863 -5.896 180 HD2 TYR 21 HD2 TYR 21 2.238 12.480 -2.068 181 HE1 TYR 21 HE1 TYR 21 2.408 12.933 -6.966 182 HE2 TYR 21 HE2 TYR 21 1.453 14.541 -3.129 183 HH TYR 21 HH TYR 21 0.927 14.817 -6.491 184 H TYR 22 H TYR 22 7.040 8.782 -3.104 185 HA TYR 22 HA TYR 22 6.452 6.406 -1.840 186 HB2 TYR 22 2HB TYR 22 8.549 6.871 -3.085 187 HB3 TYR 22 3HB TYR 22 9.112 7.892 -1.770 188 HD1 TYR 22 HD1 TYR 22 8.126 4.351 -2.566 189 HD2 TYR 22 HD2 TYR 22 10.367 6.906 0.032 190 HE1 TYR 22 HE1 TYR 22 9.167 2.389 -1.521 191 HE2 TYR 22 HE2 TYR 22 11.407 4.936 1.072 192 HH TYR 22 HH TYR 22 10.913 2.485 1.356 193 H ASN 23 H ASN 23 7.331 9.496 -0.293 194 HA ASN 23 HA ASN 23 7.629 8.543 2.371 195 HB2 ASN 23 2HB ASN 23 8.548 10.693 1.520 196 HB3 ASN 23 3HB ASN 23 6.918 11.325 1.354 197 HD21 ASN 23 1HD2 ASN 23 7.171 13.013 2.744 198 HD22 ASN 23 2HD2 ASN 23 7.441 12.839 4.440 199 H GLU 24 H GLU 24 4.906 9.930 0.585 200 HA GLU 24 HA GLU 24 3.087 10.100 2.768 201 HB2 GLU 24 2HB GLU 24 2.261 9.932 -0.154 202 HB3 GLU 24 3HB GLU 24 1.421 10.743 1.164 203 HG2 GLU 24 2HG GLU 24 3.974 11.603 -0.212 204 HG3 GLU 24 3HG GLU 24 2.412 12.407 -0.265 205 H LEU 25 H LEU 25 3.466 7.778 0.101 206 HA LEU 25 HA LEU 25 1.418 5.983 0.763 207 HB2 LEU 25 2HB LEU 25 2.573 6.202 -1.465 208 HB3 LEU 25 3HB LEU 25 4.014 5.490 -0.762 209 HG LEU 25 HG LEU 25 2.732 3.363 -0.361 210 HD11 LEU 25 1HD1 LEU 25 0.571 2.998 -1.460 211 HD12 LEU 25 2HD1 LEU 25 0.498 4.704 -1.908 212 HD13 LEU 25 3HD1 LEU 25 0.467 4.231 -0.206 213 HD21 LEU 25 1HD2 LEU 25 2.767 4.267 -3.258 214 HD22 LEU 25 2HD2 LEU 25 2.710 2.597 -2.688 215 HD23 LEU 25 3HD2 LEU 25 4.130 3.588 -2.362 216 H LYS 26 H LYS 26 4.875 6.086 1.541 217 HA LYS 26 HA LYS 26 5.074 3.860 3.253 218 HB2 LYS 26 2HB LYS 26 7.004 5.285 2.506 219 HB3 LYS 26 3HB LYS 26 6.498 6.529 3.640 220 HG2 LYS 26 2HG LYS 26 6.928 4.992 5.525 221 HG3 LYS 26 3HG LYS 26 7.382 3.721 4.393 222 HD2 LYS 26 2HD LYS 26 9.456 4.551 5.110 223 HD3 LYS 26 3HD LYS 26 9.218 5.379 3.573 224 HE2 LYS 26 2HE LYS 26 8.662 6.573 6.314 225 HE3 LYS 26 3HE LYS 26 10.110 6.867 5.355 226 HZ1 LYS 26 1HZ LYS 26 8.662 7.822 3.628 227 HZ2 LYS 26 2HZ LYS 26 8.607 8.672 5.086 228 HZ3 LYS 26 3HZ LYS 26 7.335 7.646 4.659 229 H ALA 27 H ALA 27 3.811 7.144 3.983 230 HA ALA 27 HA ALA 27 3.361 6.664 6.764 231 HB1 ALA 27 1HB ALA 27 2.132 8.747 4.926 232 HB2 ALA 27 2HB ALA 27 3.616 8.931 5.862 233 HB3 ALA 27 3HB ALA 27 2.068 8.759 6.690 234 H LEU 28 H LEU 28 1.621 5.864 3.875 235 HA LEU 28 HA LEU 28 -0.933 5.393 5.124 236 HB2 LEU 28 2HB LEU 28 -0.803 6.085 2.767 237 HB3 LEU 28 3HB LEU 28 0.142 4.656 2.380 238 HG LEU 28 HG LEU 28 -1.811 3.206 2.904 239 HD11 LEU 28 1HD1 LEU 28 -3.368 5.768 3.342 240 HD12 LEU 28 2HD1 LEU 28 -2.949 4.573 4.573 241 HD13 LEU 28 3HD1 LEU 28 -4.041 4.137 3.262 242 HD21 LEU 28 1HD2 LEU 28 -2.442 5.372 0.885 243 HD22 LEU 28 2HD2 LEU 28 -3.168 3.763 0.953 244 HD23 LEU 28 3HD2 LEU 28 -1.452 3.936 0.606 245 H VAL 29 H VAL 29 1.781 3.327 3.903 246 HA VAL 29 HA VAL 29 0.674 0.899 4.789 247 HB VAL 29 HB VAL 29 2.771 -0.186 4.538 248 HG11 VAL 29 1HG1 VAL 29 3.490 0.482 2.288 249 HG12 VAL 29 2HG1 VAL 29 2.635 2.017 2.464 250 HG13 VAL 29 3HG1 VAL 29 1.730 0.504 2.443 251 HG21 VAL 29 1HG2 VAL 29 4.936 0.927 4.274 252 HG22 VAL 29 2HG2 VAL 29 4.223 1.299 5.841 253 HG23 VAL 29 3HG2 VAL 29 4.182 2.499 4.550 254 H SER 30 H SER 30 2.426 3.396 6.490 255 HA SER 30 HA SER 30 2.885 2.033 8.940 256 HB2 SER 30 2HB SER 30 4.008 4.155 8.331 257 HB3 SER 30 3HB SER 30 2.466 5.010 8.423 258 HG SER 30 HG SER 30 3.864 3.726 10.537 259 H LYS 31 H LYS 31 0.248 4.129 7.836 260 HA LYS 31 HA LYS 31 -1.501 4.055 9.963 261 HB2 LYS 31 2HB LYS 31 -1.824 5.624 8.182 262 HB3 LYS 31 3HB LYS 31 -1.903 4.354 6.970 263 HG2 LYS 31 2HG LYS 31 -4.108 3.669 7.775 264 HG3 LYS 31 3HG LYS 31 -4.027 4.855 9.085 265 HD2 LYS 31 2HD LYS 31 -4.039 6.700 7.487 266 HD3 LYS 31 3HD LYS 31 -3.927 5.581 6.126 267 HE2 LYS 31 2HE LYS 31 -6.281 5.626 8.045 268 HE3 LYS 31 3HE LYS 31 -6.225 6.560 6.552 269 HZ1 LYS 31 1HZ LYS 31 -5.985 3.600 6.689 270 HZ2 LYS 31 2HZ LYS 31 -6.050 4.541 5.288 271 HZ3 LYS 31 3HZ LYS 31 -7.398 4.447 6.302 272 H ILE 32 H ILE 32 -1.380 1.785 7.156 273 HA ILE 32 HA ILE 32 -3.740 0.395 8.052 274 HB ILE 32 HB ILE 32 -3.506 -1.086 6.097 275 HG12 ILE 32 2HG1 ILE 32 -0.907 0.379 5.476 276 HG13 ILE 32 3HG1 ILE 32 -1.005 -1.265 6.083 277 HG21 ILE 32 1HG2 ILE 32 -3.035 1.831 5.362 278 HG22 ILE 32 2HG2 ILE 32 -4.592 1.097 5.751 279 HG23 ILE 32 3HG2 ILE 32 -3.728 0.604 4.295 280 HD11 ILE 32 1HD1 ILE 32 -2.125 -1.962 4.028 281 HD12 ILE 32 2HD1 ILE 32 -0.557 -1.224 3.712 282 HD13 ILE 32 3HD1 ILE 32 -2.032 -0.311 3.410 283 H SER 33 H SER 33 -0.254 -0.485 7.919 284 HA SER 33 HA SER 33 -0.370 -3.083 8.919 285 HB2 SER 33 2HB SER 33 1.970 -2.724 9.695 286 HB3 SER 33 3HB SER 33 1.699 -2.104 8.071 287 HG SER 33 HG SER 33 2.490 -0.323 8.839 288 H SER 34 H SER 34 -0.303 -0.038 10.733 289 HA SER 34 HA SER 34 -0.213 -1.242 13.338 290 HB2 SER 34 2HB SER 34 0.750 0.995 12.850 291 HB3 SER 34 3HB SER 34 -0.862 1.621 12.507 292 HG SER 34 HG SER 34 -0.624 2.145 14.569 293 H SER 35 H SER 35 -2.677 -1.062 11.108 294 HA SER 35 HA SER 35 -4.871 -0.734 13.070 295 HB2 SER 35 2HB SER 35 -4.870 0.835 11.133 296 HB3 SER 35 3HB SER 35 -4.921 -0.531 10.017 297 HG SER 35 HG SER 35 -6.906 -0.601 11.925 298 H VAL 36 H VAL 36 -3.633 -2.865 10.482 299 HA VAL 36 HA VAL 36 -5.886 -4.740 10.907 300 HB VAL 36 HB VAL 36 -5.559 -5.613 8.664 301 HG11 VAL 36 1HG1 VAL 36 -6.990 -3.629 8.843 302 HG12 VAL 36 2HG1 VAL 36 -6.156 -3.653 7.289 303 HG13 VAL 36 3HG1 VAL 36 -5.600 -2.573 8.573 304 HG21 VAL 36 1HG2 VAL 36 -3.889 -4.729 7.076 305 HG22 VAL 36 2HG2 VAL 36 -3.109 -5.453 8.482 306 HG23 VAL 36 3HG2 VAL 36 -3.218 -3.700 8.344 307 H ASN 37 H ASN 37 -5.514 -6.910 11.049 308 HA ASN 37 HA ASN 37 -2.903 -7.759 12.091 309 HB2 ASN 37 2HB ASN 37 -5.643 -9.102 12.202 310 HB3 ASN 37 3HB ASN 37 -4.186 -9.713 12.975 311 HD21 ASN 37 1HD2 ASN 37 -6.642 -7.221 13.056 312 HD22 ASN 37 2HD2 ASN 37 -6.314 -6.672 14.662 313 H ASP 38 H ASP 38 -4.694 -7.955 9.182 314 HA ASP 38 HA ASP 38 -3.092 -10.261 8.227 315 HB2 ASP 38 2HB ASP 38 -6.058 -9.816 7.661 316 HB3 ASP 38 3HB ASP 38 -5.058 -11.003 6.835 317 H LEU 39 H LEU 39 -2.273 -10.075 6.218 318 HA LEU 39 HA LEU 39 -2.097 -7.630 4.825 319 HB2 LEU 39 2HB LEU 39 -0.457 -9.562 4.770 320 HB3 LEU 39 3HB LEU 39 -1.577 -10.444 3.759 321 HG LEU 39 HG LEU 39 0.444 -9.374 2.602 322 HD11 LEU 39 1HD1 LEU 39 -1.434 -10.180 1.296 323 HD12 LEU 39 2HD1 LEU 39 -0.700 -8.752 0.571 324 HD13 LEU 39 3HD1 LEU 39 -2.228 -8.611 1.446 325 HD21 LEU 39 1HD2 LEU 39 0.434 -7.219 3.775 326 HD22 LEU 39 2HD2 LEU 39 -1.090 -6.791 2.991 327 HD23 LEU 39 3HD2 LEU 39 0.372 -7.008 2.025 328 H GLU 40 H GLU 40 -4.258 -10.397 4.549 329 HA GLU 40 HA GLU 40 -5.684 -9.779 2.211 330 HB2 GLU 40 2HB GLU 40 -5.886 -11.941 3.376 331 HB3 GLU 40 3HB GLU 40 -6.637 -11.161 4.764 332 HG2 GLU 40 2HG GLU 40 -8.594 -10.574 3.401 333 HG3 GLU 40 3HG GLU 40 -7.833 -11.269 1.973 334 H GLU 41 H GLU 41 -6.045 -8.605 5.519 335 HA GLU 41 HA GLU 41 -8.420 -7.049 5.003 336 HB2 GLU 41 2HB GLU 41 -6.518 -6.969 7.376 337 HB3 GLU 41 3HB GLU 41 -8.092 -6.181 7.302 338 HG2 GLU 41 2HG GLU 41 -7.553 -9.160 7.263 339 HG3 GLU 41 3HG GLU 41 -8.242 -8.233 8.590 340 H ALA 42 H ALA 42 -4.954 -6.487 4.973 341 HA ALA 42 HA ALA 42 -4.958 -3.646 4.878 342 HB1 ALA 42 1HB ALA 42 -2.928 -4.932 5.389 343 HB2 ALA 42 2HB ALA 42 -2.659 -3.872 4.004 344 HB3 ALA 42 3HB ALA 42 -2.917 -5.604 3.756 345 H ILE 43 H ILE 43 -5.159 -6.176 2.445 346 HA ILE 43 HA ILE 43 -4.937 -4.683 0.088 347 HB ILE 43 HB ILE 43 -6.308 -7.320 0.722 348 HG12 ILE 43 2HG1 ILE 43 -3.783 -6.746 -0.900 349 HG13 ILE 43 3HG1 ILE 43 -3.786 -7.196 0.800 350 HG21 ILE 43 1HG2 ILE 43 -6.561 -7.774 -1.692 351 HG22 ILE 43 2HG2 ILE 43 -6.043 -6.127 -2.052 352 HG23 ILE 43 3HG2 ILE 43 -7.550 -6.405 -1.178 353 HD11 ILE 43 1HD1 ILE 43 -4.872 -9.352 0.148 354 HD12 ILE 43 2HD1 ILE 43 -3.239 -9.117 -0.473 355 HD13 ILE 43 3HD1 ILE 43 -4.627 -8.895 -1.543 356 H VAL 44 H VAL 44 -8.117 -5.961 1.348 357 HA VAL 44 HA VAL 44 -9.916 -4.471 0.009 358 HB VAL 44 HB VAL 44 -10.101 -5.003 3.009 359 HG11 VAL 44 1HG1 VAL 44 -11.864 -3.472 2.254 360 HG12 VAL 44 2HG1 VAL 44 -12.550 -5.042 2.674 361 HG13 VAL 44 3HG1 VAL 44 -12.330 -4.602 0.978 362 HG21 VAL 44 1HG2 VAL 44 -11.215 -7.138 2.413 363 HG22 VAL 44 2HG2 VAL 44 -9.552 -7.080 1.826 364 HG23 VAL 44 3HG2 VAL 44 -10.891 -6.828 0.704 365 H VAL 45 H VAL 45 -8.344 -3.338 3.040 366 HA VAL 45 HA VAL 45 -9.523 -0.802 3.254 367 HB VAL 45 HB VAL 45 -6.749 -1.717 4.137 368 HG11 VAL 45 1HG1 VAL 45 -6.711 0.242 5.672 369 HG12 VAL 45 2HG1 VAL 45 -8.192 0.849 4.925 370 HG13 VAL 45 3HG1 VAL 45 -6.705 0.740 3.979 371 HG21 VAL 45 1HG2 VAL 45 -9.314 -1.363 5.732 372 HG22 VAL 45 2HG2 VAL 45 -7.766 -1.925 6.368 373 HG23 VAL 45 3HG2 VAL 45 -8.650 -2.905 5.195 374 H LEU 46 H LEU 46 -6.539 -1.750 1.496 375 HA LEU 46 HA LEU 46 -5.963 0.873 0.496 376 HB2 LEU 46 2HB LEU 46 -4.978 -1.861 -0.383 377 HB3 LEU 46 3HB LEU 46 -4.423 -0.368 -1.126 378 HG LEU 46 HG LEU 46 -4.004 -1.166 1.782 379 HD11 LEU 46 1HD1 LEU 46 -2.021 -0.973 -0.505 380 HD12 LEU 46 2HD1 LEU 46 -2.630 -2.460 0.225 381 HD13 LEU 46 3HD1 LEU 46 -1.639 -1.359 1.177 382 HD21 LEU 46 1HD2 LEU 46 -2.594 0.841 1.965 383 HD22 LEU 46 2HD2 LEU 46 -4.261 1.267 1.592 384 HD23 LEU 46 3HD2 LEU 46 -3.036 1.318 0.321 385 H ARG 47 H ARG 47 -8.007 -1.746 -0.706 386 HA ARG 47 HA ARG 47 -8.430 -0.678 -3.313 387 HB2 ARG 47 2HB ARG 47 -10.174 -2.590 -1.685 388 HB3 ARG 47 3HB ARG 47 -10.446 -2.190 -3.380 389 HG2 ARG 47 2HG ARG 47 -8.064 -3.067 -3.802 390 HG3 ARG 47 3HG ARG 47 -8.133 -3.730 -2.175 391 HD2 ARG 47 2HD ARG 47 -10.092 -4.402 -4.388 392 HD3 ARG 47 3HD ARG 47 -8.661 -5.359 -4.000 393 HE ARG 47 HE ARG 47 -10.818 -4.903 -2.020 394 HH11 ARG 47 1HH1 ARG 47 -8.743 -7.126 -3.807 395 HH12 ARG 47 2HH1 ARG 47 -9.293 -8.530 -2.949 396 HH21 ARG 47 1HH2 ARG 47 -11.583 -6.778 -0.944 397 HH22 ARG 47 2HH2 ARG 47 -10.906 -8.328 -1.323 398 H GLU 48 H GLU 48 -9.531 0.239 -0.220 399 HA GLU 48 HA GLU 48 -11.670 1.973 -1.222 400 HB2 GLU 48 2HB GLU 48 -10.561 1.841 1.613 401 HB3 GLU 48 3HB GLU 48 -12.084 2.554 1.100 402 HG2 GLU 48 2HG GLU 48 -11.361 -0.383 1.203 403 HG3 GLU 48 3HG GLU 48 -12.549 0.456 2.192 404 H GLU 49 H GLU 49 -8.431 2.228 0.282 405 HA GLU 49 HA GLU 49 -8.234 5.021 0.463 406 HB2 GLU 49 2HB GLU 49 -5.957 3.052 -0.028 407 HB3 GLU 49 3HB GLU 49 -5.765 4.711 0.522 408 HG2 GLU 49 2HG GLU 49 -7.063 2.441 2.039 409 HG3 GLU 49 3HG GLU 49 -5.499 3.169 2.370 410 H GLU 50 H GLU 50 -7.267 2.845 -2.121 411 HA GLU 50 HA GLU 50 -6.222 4.409 -4.109 412 HB2 GLU 50 2HB GLU 50 -6.421 1.989 -4.275 413 HB3 GLU 50 3HB GLU 50 -8.178 2.081 -4.250 414 HG2 GLU 50 2HG GLU 50 -7.925 3.399 -6.488 415 HG3 GLU 50 3HG GLU 50 -6.282 2.755 -6.509 416 H LYS 51 H LYS 51 -9.712 3.677 -3.705 417 HA LYS 51 HA LYS 51 -10.655 5.346 -5.768 418 HB2 LYS 51 2HB LYS 51 -12.244 4.329 -3.375 419 HB3 LYS 51 3HB LYS 51 -12.893 4.863 -4.923 420 HG2 LYS 51 2HG LYS 51 -11.588 2.920 -5.978 421 HG3 LYS 51 3HG LYS 51 -11.318 2.338 -4.337 422 HD2 LYS 51 2HD LYS 51 -13.984 2.653 -5.769 423 HD3 LYS 51 3HD LYS 51 -13.202 1.154 -5.272 424 HE2 LYS 51 2HE LYS 51 -14.285 3.254 -3.364 425 HE3 LYS 51 3HE LYS 51 -15.104 1.759 -3.808 426 HZ1 LYS 51 1HZ LYS 51 -13.400 0.483 -2.788 427 HZ2 LYS 51 2HZ LYS 51 -13.893 1.657 -1.675 428 HZ3 LYS 51 3HZ LYS 51 -12.441 1.845 -2.519 429 H LYS 52 H LYS 52 -9.994 5.958 -2.372 430 HA LYS 52 HA LYS 52 -11.419 8.466 -2.176 431 HB2 LYS 52 2HB LYS 52 -9.153 7.354 -0.460 432 HB3 LYS 52 3HB LYS 52 -10.142 8.756 -0.052 433 HG2 LYS 52 2HG LYS 52 -12.112 7.366 0.203 434 HG3 LYS 52 3HG LYS 52 -11.235 5.946 -0.380 435 HD2 LYS 52 2HD LYS 52 -9.674 6.188 1.596 436 HD3 LYS 52 3HD LYS 52 -10.713 7.483 2.200 437 HE2 LYS 52 2HE LYS 52 -12.593 5.883 2.345 438 HE3 LYS 52 3HE LYS 52 -11.538 4.597 1.752 439 HZ1 LYS 52 1HZ LYS 52 -11.331 6.066 4.318 440 HZ2 LYS 52 2HZ LYS 52 -10.099 5.078 3.722 441 HZ3 LYS 52 3HZ LYS 52 -11.609 4.411 4.083 442 H ALA 53 H ALA 53 -8.225 7.397 -3.102 443 HA ALA 53 HA ALA 53 -6.952 9.979 -2.989 444 HB1 ALA 53 1HB ALA 53 -6.000 7.371 -4.221 445 HB2 ALA 53 2HB ALA 53 -5.673 7.927 -2.579 446 HB3 ALA 53 3HB ALA 53 -5.007 8.808 -3.957 447 H SER 54 H SER 54 -6.105 11.103 -4.745 448 HA SER 54 HA SER 54 -7.366 10.719 -7.397 449 HB2 SER 54 2HB SER 54 -6.221 13.244 -6.108 450 HB3 SER 54 3HB SER 54 -6.914 13.149 -7.731 451 HG SER 54 HG SER 54 -8.469 12.220 -5.602 452 H GLU 55 H GLU 55 -5.984 10.920 -9.236 453 HA GLU 55 HA GLU 55 -3.491 9.627 -9.037 454 HB2 GLU 55 2HB GLU 55 -4.708 11.265 -11.304 455 HB3 GLU 55 3HB GLU 55 -3.263 10.271 -11.487 456 HG2 GLU 55 2HG GLU 55 -4.542 8.245 -11.008 457 HG3 GLU 55 3HG GLU 55 -5.982 9.202 -10.661 458 HA PRO 56 HA PRO 56 -1.456 9.490 -9.973 459 HB2 PRO 56 2HB PRO 56 1.184 9.570 -9.319 460 HB3 PRO 56 3HB PRO 56 0.531 10.429 -10.727 461 HG2 PRO 56 2HG PRO 56 1.479 11.533 -8.149 462 HG3 PRO 56 3HG PRO 56 1.378 12.304 -9.743 463 HD2 PRO 56 2HD PRO 56 -0.503 12.532 -7.552 464 HD3 PRO 56 3HD PRO 56 -0.594 13.305 -9.149 465 H PHE 57 H PHE 57 -1.959 10.606 -6.845 466 HA PHE 57 HA PHE 57 -0.635 8.536 -5.353 467 HB2 PHE 57 2HB PHE 57 -1.330 10.820 -4.425 468 HB3 PHE 57 3HB PHE 57 -2.980 10.206 -4.355 469 HD1 PHE 57 HD1 PHE 57 0.405 8.802 -3.411 470 HD2 PHE 57 HD2 PHE 57 -3.577 9.704 -2.106 471 HE1 PHE 57 HE1 PHE 57 0.909 7.849 -1.198 472 HE2 PHE 57 HE2 PHE 57 -3.055 8.745 0.102 473 HZ PHE 57 HZ PHE 57 -0.818 7.817 0.559 474 H LYS 58 H LYS 58 -3.796 8.821 -6.887 475 HA LYS 58 HA LYS 58 -4.997 6.440 -5.982 476 HB2 LYS 58 2HB LYS 58 -6.173 8.122 -7.362 477 HB3 LYS 58 3HB LYS 58 -5.161 7.716 -8.744 478 HG2 LYS 58 2HG LYS 58 -6.144 5.410 -8.733 479 HG3 LYS 58 3HG LYS 58 -7.206 5.899 -7.411 480 HD2 LYS 58 2HD LYS 58 -7.158 7.129 -10.198 481 HD3 LYS 58 3HD LYS 58 -8.365 5.989 -9.603 482 HE2 LYS 58 2HE LYS 58 -9.075 7.635 -7.898 483 HE3 LYS 58 3HE LYS 58 -7.865 8.775 -8.490 484 HZ1 LYS 58 1HZ LYS 58 -10.135 7.717 -10.085 485 HZ2 LYS 58 2HZ LYS 58 -9.012 8.869 -10.597 486 HZ3 LYS 58 3HZ LYS 58 -10.088 9.234 -9.347 487 H THR 59 H THR 59 -2.428 7.016 -8.250 488 HA THR 59 HA THR 59 -2.367 4.322 -9.326 489 HB THR 59 HB THR 59 -0.464 6.657 -9.821 490 HG1 THR 59 HG1 THR 59 -3.019 6.036 -10.833 491 HG21 THR 59 1HG2 THR 59 0.434 4.494 -10.614 492 HG22 THR 59 2HG2 THR 59 0.004 5.536 -11.968 493 HG23 THR 59 3HG2 THR 59 -1.057 4.199 -11.521 494 H ASP 60 H ASP 60 -0.802 6.187 -6.827 495 HA ASP 60 HA ASP 60 1.552 4.535 -6.567 496 HB2 ASP 60 2HB ASP 60 0.336 6.511 -4.573 497 HB3 ASP 60 3HB ASP 60 1.955 5.814 -4.472 498 H ILE 61 H ILE 61 -1.552 4.836 -4.925 499 HA ILE 61 HA ILE 61 -1.129 2.819 -2.961 500 HB ILE 61 HB ILE 61 -3.757 3.959 -4.033 501 HG12 ILE 61 2HG1 ILE 61 -2.145 4.716 -1.551 502 HG13 ILE 61 3HG1 ILE 61 -2.286 5.684 -3.009 503 HG21 ILE 61 1HG2 ILE 61 -3.278 2.336 -1.503 504 HG22 ILE 61 2HG2 ILE 61 -4.129 1.775 -2.943 505 HG23 ILE 61 3HG2 ILE 61 -4.810 3.080 -1.972 506 HD11 ILE 61 1HD1 ILE 61 -3.674 6.572 -1.265 507 HD12 ILE 61 2HD1 ILE 61 -4.507 5.032 -1.079 508 HD13 ILE 61 3HD1 ILE 61 -4.689 5.962 -2.569 509 H ARG 62 H ARG 62 -2.902 2.862 -6.132 510 HA ARG 62 HA ARG 62 -3.756 0.219 -6.026 511 HB2 ARG 62 2HB ARG 62 -4.640 0.529 -8.140 512 HB3 ARG 62 3HB ARG 62 -4.482 2.185 -7.596 513 HG2 ARG 62 2HG ARG 62 -3.625 2.466 -9.700 514 HG3 ARG 62 3HG ARG 62 -2.126 1.978 -8.905 515 HD2 ARG 62 2HD ARG 62 -2.719 -0.432 -9.611 516 HD3 ARG 62 3HD ARG 62 -3.983 0.279 -10.616 517 HE ARG 62 HE ARG 62 -1.727 1.606 -11.384 518 HH11 ARG 62 1HH1 ARG 62 -2.603 -1.813 -11.230 519 HH12 ARG 62 2HH1 ARG 62 -1.557 -2.262 -12.540 520 HH21 ARG 62 1HH2 ARG 62 -0.318 0.965 -13.088 521 HH22 ARG 62 2HH2 ARG 62 -0.270 -0.696 -13.583 522 H ILE 63 H ILE 63 -0.668 1.479 -7.457 523 HA ILE 63 HA ILE 63 0.149 -0.995 -8.610 524 HB ILE 63 HB ILE 63 1.805 1.432 -7.791 525 HG12 ILE 63 2HG1 ILE 63 0.909 0.443 -10.541 526 HG13 ILE 63 3HG1 ILE 63 0.236 1.817 -9.680 527 HG21 ILE 63 1HG2 ILE 63 3.687 0.502 -9.108 528 HG22 ILE 63 2HG2 ILE 63 2.774 -0.989 -9.349 529 HG23 ILE 63 3HG2 ILE 63 3.292 -0.522 -7.727 530 HD11 ILE 63 1HD1 ILE 63 3.054 1.618 -10.759 531 HD12 ILE 63 2HD1 ILE 63 2.374 2.999 -9.891 532 HD13 ILE 63 3HD1 ILE 63 1.719 2.531 -11.458 533 H LEU 64 H LEU 64 0.638 0.415 -5.397 534 HA LEU 64 HA LEU 64 2.395 -1.577 -4.355 535 HB2 LEU 64 2HB LEU 64 2.085 0.700 -3.362 536 HB3 LEU 64 3HB LEU 64 0.442 0.262 -2.922 537 HG LEU 64 HG LEU 64 1.481 -1.620 -1.484 538 HD11 LEU 64 1HD1 LEU 64 3.711 -1.652 -2.455 539 HD12 LEU 64 2HD1 LEU 64 3.785 -1.298 -0.733 540 HD13 LEU 64 3HD1 LEU 64 4.004 0.003 -1.905 541 HD21 LEU 64 1HD2 LEU 64 1.863 -0.140 0.410 542 HD22 LEU 64 2HD2 LEU 64 0.464 0.388 -0.524 543 HD23 LEU 64 3HD2 LEU 64 2.000 1.248 -0.672 544 H LEU 65 H LEU 65 -1.070 -1.040 -4.223 545 HA LEU 65 HA LEU 65 -1.921 -3.040 -2.473 546 HB2 LEU 65 2HB LEU 65 -3.424 -1.283 -2.821 547 HB3 LEU 65 3HB LEU 65 -3.143 -1.242 -4.548 548 HG LEU 65 HG LEU 65 -4.577 -3.285 -4.805 549 HD11 LEU 65 1HD1 LEU 65 -5.293 -2.902 -1.891 550 HD12 LEU 65 2HD1 LEU 65 -4.330 -4.228 -2.550 551 HD13 LEU 65 3HD1 LEU 65 -6.012 -4.044 -3.027 552 HD21 LEU 65 1HD2 LEU 65 -5.957 -0.925 -3.489 553 HD22 LEU 65 2HD2 LEU 65 -6.688 -2.107 -4.578 554 HD23 LEU 65 3HD2 LEU 65 -5.450 -1.013 -5.181 555 H ASP 66 H ASP 66 -2.618 -3.032 -5.984 556 HA ASP 66 HA ASP 66 -3.165 -5.578 -6.587 557 HB2 ASP 66 2HB ASP 66 -3.203 -3.719 -8.163 558 HB3 ASP 66 3HB ASP 66 -1.455 -3.577 -8.125 559 H PHE 67 H PHE 67 0.203 -4.296 -6.438 560 HA PHE 67 HA PHE 67 1.650 -6.619 -6.882 561 HB2 PHE 67 2HB PHE 67 2.698 -4.388 -6.642 562 HB3 PHE 67 3HB PHE 67 2.350 -4.394 -4.917 563 HD1 PHE 67 HD1 PHE 67 4.312 -6.125 -7.584 564 HD2 PHE 67 HD2 PHE 67 3.873 -5.466 -3.371 565 HE1 PHE 67 HE1 PHE 67 6.429 -7.302 -7.166 566 HE2 PHE 67 HE2 PHE 67 5.994 -6.651 -2.974 567 HZ PHE 67 HZ PHE 67 7.267 -7.571 -4.869 568 H LEU 68 H LEU 68 0.247 -5.558 -3.764 569 HA LEU 68 HA LEU 68 1.212 -7.754 -2.192 570 HB2 LEU 68 2HB LEU 68 -1.152 -5.891 -1.742 571 HB3 LEU 68 3HB LEU 68 -0.515 -6.992 -0.530 572 HG LEU 68 HG LEU 68 1.163 -4.774 -1.765 573 HD11 LEU 68 1HD1 LEU 68 0.721 -3.433 0.224 574 HD12 LEU 68 2HD1 LEU 68 -0.405 -4.656 0.825 575 HD13 LEU 68 3HD1 LEU 68 -0.771 -3.764 -0.655 576 HD21 LEU 68 1HD2 LEU 68 1.549 -6.440 0.747 577 HD22 LEU 68 2HD2 LEU 68 2.589 -5.111 0.225 578 HD23 LEU 68 3HD2 LEU 68 2.473 -6.570 -0.753 579 H GLU 69 H GLU 69 -1.672 -7.259 -4.163 580 HA GLU 69 HA GLU 69 -3.024 -9.689 -3.430 581 HB2 GLU 69 2HB GLU 69 -3.343 -8.012 -5.963 582 HB3 GLU 69 3HB GLU 69 -4.480 -9.207 -5.348 583 HG2 GLU 69 2HG GLU 69 -4.861 -7.763 -3.342 584 HG3 GLU 69 3HG GLU 69 -3.791 -6.554 -4.044 585 H SER 70 H SER 70 -0.500 -8.760 -5.583 586 HA SER 70 HA SER 70 1.056 -9.833 -6.766 587 HB2 SER 70 2HB SER 70 0.998 -11.512 -4.849 588 HB3 SER 70 3HB SER 70 -0.064 -12.504 -5.843 589 HG SER 70 HG SER 70 2.559 -11.652 -6.551 590 H LYS 71 H LYS 71 -1.211 -8.926 -8.012 591 HA LYS 71 HA LYS 71 -2.048 -10.889 -10.044 592 HB2 LYS 71 2HB LYS 71 -2.999 -8.062 -9.411 593 HB3 LYS 71 3HB LYS 71 -3.677 -9.086 -10.676 594 HG2 LYS 71 2HG LYS 71 -4.503 -10.667 -9.035 595 HG3 LYS 71 3HG LYS 71 -3.704 -9.790 -7.724 596 HD2 LYS 71 2HD LYS 71 -5.164 -7.844 -8.098 597 HD3 LYS 71 3HD LYS 71 -5.919 -8.642 -9.481 598 HE2 LYS 71 2HE LYS 71 -6.871 -10.346 -8.015 599 HE3 LYS 71 3HE LYS 71 -6.027 -9.658 -6.625 600 HZ1 LYS 71 1HZ LYS 71 -8.341 -8.971 -6.712 601 HZ2 LYS 71 2HZ LYS 71 -8.100 -8.265 -8.224 602 HZ3 LYS 71 3HZ LYS 71 -7.306 -7.643 -6.869 603 HA PRO 72 HA PRO 72 0.897 -8.798 -12.946 604 HB2 PRO 72 2HB PRO 72 -0.260 -10.699 -14.949 605 HB3 PRO 72 3HB PRO 72 1.431 -10.473 -14.461 606 HG2 PRO 72 2HG PRO 72 0.079 -12.663 -13.732 607 HG3 PRO 72 3HG PRO 72 1.249 -11.897 -12.629 608 HD2 PRO 72 2HD PRO 72 -1.768 -11.657 -12.625 609 HD3 PRO 72 3HD PRO 72 -0.662 -11.930 -11.256 Start of MODEL 16 1 H GLY 1 1H GLY 1 6.231 -4.236 15.233 2 HA2 GLY 1 2HA GLY 1 4.801 -5.877 16.292 3 HA3 GLY 1 3HA GLY 1 3.896 -4.716 15.336 4 H SER 2 H SER 2 2.821 -5.409 13.503 5 HA SER 2 HA SER 2 2.011 -8.137 13.367 6 HB2 SER 2 2HB SER 2 1.463 -5.828 11.436 7 HB3 SER 2 3HB SER 2 0.568 -7.351 11.510 8 HG SER 2 HG SER 2 -0.476 -5.664 12.639 9 H VAL 3 H VAL 3 2.437 -9.709 11.819 10 HA VAL 3 HA VAL 3 4.822 -9.721 10.281 11 HB VAL 3 HB VAL 3 3.581 -11.770 11.145 12 HG11 VAL 3 1HG1 VAL 3 1.733 -11.328 8.765 13 HG12 VAL 3 2HG1 VAL 3 1.287 -11.192 10.466 14 HG13 VAL 3 3HG1 VAL 3 1.754 -12.757 9.804 15 HG21 VAL 3 1HG2 VAL 3 5.421 -12.027 9.527 16 HG22 VAL 3 2HG2 VAL 3 4.285 -11.847 8.186 17 HG23 VAL 3 3HG2 VAL 3 4.171 -13.246 9.258 18 H VAL 4 H VAL 4 1.768 -8.337 9.710 19 HA VAL 4 HA VAL 4 1.616 -8.380 6.860 20 HB VAL 4 HB VAL 4 0.424 -6.329 8.781 21 HG11 VAL 4 1HG1 VAL 4 0.324 -5.580 6.449 22 HG12 VAL 4 2HG1 VAL 4 -1.298 -6.001 7.003 23 HG13 VAL 4 3HG1 VAL 4 -0.406 -7.109 5.960 24 HG21 VAL 4 1HG2 VAL 4 -1.610 -7.727 8.808 25 HG22 VAL 4 2HG2 VAL 4 -0.222 -8.590 9.480 26 HG23 VAL 4 3HG2 VAL 4 -0.782 -8.953 7.843 27 H LYS 5 H LYS 5 3.032 -6.228 9.288 28 HA LYS 5 HA LYS 5 3.357 -3.937 7.716 29 HB2 LYS 5 2HB LYS 5 3.597 -3.997 10.210 30 HB3 LYS 5 3HB LYS 5 5.169 -4.775 10.015 31 HG2 LYS 5 2HG LYS 5 6.030 -2.810 8.814 32 HG3 LYS 5 3HG LYS 5 4.441 -2.041 8.889 33 HD2 LYS 5 2HD LYS 5 4.622 -2.035 11.391 34 HD3 LYS 5 3HD LYS 5 6.264 -2.679 11.239 35 HE2 LYS 5 2HE LYS 5 5.263 0.001 10.194 36 HE3 LYS 5 3HE LYS 5 6.339 -0.250 11.571 37 HZ1 LYS 5 1HZ LYS 5 7.971 -1.199 10.018 38 HZ2 LYS 5 2HZ LYS 5 7.600 0.410 9.669 39 HZ3 LYS 5 3HZ LYS 5 6.952 -0.828 8.716 40 H GLU 6 H GLU 6 5.768 -6.521 8.431 41 HA GLU 6 HA GLU 6 7.867 -5.564 6.876 42 HB2 GLU 6 2HB GLU 6 8.806 -7.827 7.062 43 HB3 GLU 6 3HB GLU 6 8.114 -7.312 8.601 44 HG2 GLU 6 2HG GLU 6 6.065 -8.654 8.068 45 HG3 GLU 6 3HG GLU 6 6.867 -9.240 6.611 46 H LYS 7 H LYS 7 5.107 -7.651 5.988 47 HA LYS 7 HA LYS 7 5.857 -8.385 3.366 48 HB2 LYS 7 2HB LYS 7 3.049 -7.823 4.427 49 HB3 LYS 7 3HB LYS 7 3.425 -8.695 2.944 50 HG2 LYS 7 2HG LYS 7 4.425 -10.517 4.195 51 HG3 LYS 7 3HG LYS 7 4.249 -9.617 5.706 52 HD2 LYS 7 2HD LYS 7 1.742 -9.653 5.353 53 HD3 LYS 7 3HD LYS 7 2.011 -10.696 3.951 54 HE2 LYS 7 2HE LYS 7 2.801 -11.364 6.806 55 HE3 LYS 7 3HE LYS 7 1.374 -11.978 5.973 56 HZ1 LYS 7 1HZ LYS 7 2.862 -13.025 4.344 57 HZ2 LYS 7 2HZ LYS 7 3.121 -13.597 5.909 58 HZ3 LYS 7 3HZ LYS 7 4.206 -12.494 5.225 59 H LEU 8 H LEU 8 4.050 -5.596 4.602 60 HA LEU 8 HA LEU 8 3.647 -4.209 2.169 61 HB2 LEU 8 2HB LEU 8 3.792 -3.186 5.028 62 HB3 LEU 8 3HB LEU 8 3.246 -2.224 3.663 63 HG LEU 8 HG LEU 8 1.847 -4.758 4.620 64 HD11 LEU 8 1HD1 LEU 8 1.718 -3.029 6.360 65 HD12 LEU 8 2HD1 LEU 8 0.147 -3.318 5.619 66 HD13 LEU 8 3HD1 LEU 8 1.074 -1.877 5.182 67 HD21 LEU 8 1HD2 LEU 8 0.952 -2.617 2.654 68 HD22 LEU 8 2HD2 LEU 8 -0.019 -3.988 3.203 69 HD23 LEU 8 3HD2 LEU 8 1.439 -4.267 2.254 70 H GLU 9 H GLU 9 6.339 -4.301 4.500 71 HA GLU 9 HA GLU 9 7.714 -1.974 3.602 72 HB2 GLU 9 2HB GLU 9 8.710 -4.362 5.198 73 HB3 GLU 9 3HB GLU 9 9.654 -2.903 4.913 74 HG2 GLU 9 2HG GLU 9 7.057 -3.073 6.479 75 HG3 GLU 9 3HG GLU 9 8.666 -2.920 7.170 76 H LYS 10 H LYS 10 7.964 -5.454 2.799 77 HA LYS 10 HA LYS 10 10.200 -5.348 1.059 78 HB2 LYS 10 2HB LYS 10 7.790 -7.213 0.811 79 HB3 LYS 10 3HB LYS 10 9.390 -7.483 0.123 80 HG2 LYS 10 2HG LYS 10 8.760 -7.413 3.089 81 HG3 LYS 10 3HG LYS 10 8.875 -8.881 2.119 82 HD2 LYS 10 2HD LYS 10 11.245 -8.471 1.699 83 HD3 LYS 10 3HD LYS 10 11.163 -6.903 2.514 84 HE2 LYS 10 2HE LYS 10 10.678 -8.001 4.643 85 HE3 LYS 10 3HE LYS 10 10.633 -9.580 3.852 86 HZ1 LYS 10 1HZ LYS 10 12.939 -9.377 3.336 87 HZ2 LYS 10 2HZ LYS 10 12.723 -9.130 4.995 88 HZ3 LYS 10 3HZ LYS 10 13.001 -7.815 3.972 89 H ALA 11 H ALA 11 6.715 -5.138 0.575 90 HA ALA 11 HA ALA 11 6.616 -4.998 -2.222 91 HB1 ALA 11 1HB ALA 11 4.716 -5.675 -0.810 92 HB2 ALA 11 2HB ALA 11 4.270 -4.332 -1.864 93 HB3 ALA 11 3HB ALA 11 4.609 -4.036 -0.156 94 H LEU 12 H LEU 12 6.783 -2.521 0.264 95 HA LEU 12 HA LEU 12 6.205 -0.206 -1.202 96 HB2 LEU 12 2HB LEU 12 7.741 -0.749 1.339 97 HB3 LEU 12 3HB LEU 12 7.801 0.863 0.647 98 HG LEU 12 HG LEU 12 5.276 -0.553 1.571 99 HD11 LEU 12 1HD1 LEU 12 5.283 1.182 3.363 100 HD12 LEU 12 2HD1 LEU 12 6.909 1.643 2.855 101 HD13 LEU 12 3HD1 LEU 12 6.604 0.020 3.481 102 HD21 LEU 12 1HD2 LEU 12 4.164 1.623 1.219 103 HD22 LEU 12 2HD2 LEU 12 4.786 0.959 -0.288 104 HD23 LEU 12 3HD2 LEU 12 5.651 2.271 0.518 105 H ILE 13 H ILE 13 9.317 -1.790 -0.457 106 HA ILE 13 HA ILE 13 10.942 0.130 -1.801 107 HB ILE 13 HB ILE 13 11.612 -2.713 -0.916 108 HG12 ILE 13 2HG1 ILE 13 12.111 -0.034 0.479 109 HG13 ILE 13 3HG1 ILE 13 10.905 -1.224 0.956 110 HG21 ILE 13 1HG2 ILE 13 13.990 -2.035 -1.059 111 HG22 ILE 13 2HG2 ILE 13 13.514 -0.463 -1.706 112 HG23 ILE 13 3HG2 ILE 13 13.207 -1.933 -2.634 113 HD11 ILE 13 1HD1 ILE 13 13.901 -1.620 1.037 114 HD12 ILE 13 2HD1 ILE 13 12.684 -2.801 1.530 115 HD13 ILE 13 3HD1 ILE 13 12.846 -1.283 2.409 116 H GLU 14 H GLU 14 9.561 -3.032 -2.736 117 HA GLU 14 HA GLU 14 10.938 -3.461 -5.135 118 HB2 GLU 14 2HB GLU 14 8.145 -4.325 -4.273 119 HB3 GLU 14 3HB GLU 14 8.913 -4.897 -5.755 120 HG2 GLU 14 2HG GLU 14 9.919 -5.358 -2.921 121 HG3 GLU 14 3HG GLU 14 9.113 -6.545 -3.944 122 H VAL 15 H VAL 15 7.965 -1.616 -4.500 123 HA VAL 15 HA VAL 15 7.751 -0.878 -7.354 124 HB VAL 15 HB VAL 15 5.473 -0.162 -6.901 125 HG11 VAL 15 1HG1 VAL 15 4.415 -2.301 -6.249 126 HG12 VAL 15 2HG1 VAL 15 5.954 -2.875 -5.603 127 HG13 VAL 15 3HG1 VAL 15 5.785 -2.571 -7.334 128 HG21 VAL 15 1HG2 VAL 15 5.732 0.829 -4.667 129 HG22 VAL 15 2HG2 VAL 15 5.988 -0.768 -3.959 130 HG23 VAL 15 3HG2 VAL 15 4.419 -0.352 -4.649 131 H ARG 16 H ARG 16 9.116 0.288 -4.532 132 HA ARG 16 HA ARG 16 8.538 2.959 -4.290 133 HB2 ARG 16 2HB ARG 16 10.109 1.742 -2.828 134 HB3 ARG 16 3HB ARG 16 11.323 1.766 -4.100 135 HG2 ARG 16 2HG ARG 16 11.488 4.201 -3.955 136 HG3 ARG 16 3HG ARG 16 10.173 4.245 -2.779 137 HD2 ARG 16 2HD ARG 16 12.293 4.480 -1.611 138 HD3 ARG 16 3HD ARG 16 11.570 2.919 -1.204 139 HE ARG 16 HE ARG 16 13.393 2.722 -3.398 140 HH11 ARG 16 1HH1 ARG 16 13.296 2.887 0.119 141 HH12 ARG 16 2HH1 ARG 16 14.825 2.094 0.308 142 HH21 ARG 16 1HH2 ARG 16 15.392 1.695 -3.121 143 HH22 ARG 16 2HH2 ARG 16 16.012 1.419 -1.521 144 HA PRO 17 HA PRO 17 11.634 4.255 -7.953 145 HB2 PRO 17 2HB PRO 17 11.498 1.838 -9.733 146 HB3 PRO 17 3HB PRO 17 12.895 2.852 -9.316 147 HG2 PRO 17 2HG PRO 17 12.657 0.389 -8.312 148 HG3 PRO 17 3HG PRO 17 13.314 1.723 -7.334 149 HD2 PRO 17 2HD PRO 17 10.550 0.527 -7.263 150 HD3 PRO 17 3HD PRO 17 11.604 1.013 -5.917 151 H TYR 18 H TYR 18 8.822 2.203 -8.368 152 HA TYR 18 HA TYR 18 7.898 3.368 -10.861 153 HB2 TYR 18 2HB TYR 18 6.551 1.391 -8.961 154 HB3 TYR 18 3HB TYR 18 5.950 1.819 -10.558 155 HD1 TYR 18 HD1 TYR 18 8.898 0.235 -8.821 156 HD2 TYR 18 HD2 TYR 18 6.665 0.563 -12.457 157 HE1 TYR 18 HE1 TYR 18 10.193 -1.616 -9.782 158 HE2 TYR 18 HE2 TYR 18 7.961 -1.285 -13.419 159 HH TYR 18 HH TYR 18 9.960 -3.304 -11.558 160 H VAL 19 H VAL 19 7.182 3.702 -7.409 161 HA VAL 19 HA VAL 19 4.688 5.166 -7.981 162 HB VAL 19 HB VAL 19 4.083 4.854 -5.618 163 HG11 VAL 19 1HG1 VAL 19 3.454 3.110 -7.225 164 HG12 VAL 19 2HG1 VAL 19 3.755 2.411 -5.635 165 HG13 VAL 19 3HG1 VAL 19 4.964 2.247 -6.913 166 HG21 VAL 19 1HG2 VAL 19 5.430 3.453 -4.080 167 HG22 VAL 19 2HG2 VAL 19 6.303 4.911 -4.549 168 HG23 VAL 19 3HG2 VAL 19 6.720 3.363 -5.286 169 H GLU 20 H GLU 20 4.613 7.289 -7.892 170 HA GLU 20 HA GLU 20 6.574 8.847 -6.332 171 HB2 GLU 20 2HB GLU 20 5.705 10.818 -7.553 172 HB3 GLU 20 3HB GLU 20 6.346 9.588 -8.637 173 HG2 GLU 20 2HG GLU 20 4.020 8.848 -9.116 174 HG3 GLU 20 3HG GLU 20 3.410 10.149 -8.094 175 H TYR 21 H TYR 21 5.742 10.556 -4.926 176 HA TYR 21 HA TYR 21 4.719 11.123 -3.008 177 HB2 TYR 21 2HB TYR 21 2.185 9.800 -4.100 178 HB3 TYR 21 3HB TYR 21 2.257 10.884 -2.713 179 HD1 TYR 21 HD1 TYR 21 3.004 13.315 -3.120 180 HD2 TYR 21 HD2 TYR 21 1.908 10.694 -6.312 181 HE1 TYR 21 HE1 TYR 21 2.683 15.245 -4.590 182 HE2 TYR 21 HE2 TYR 21 1.592 12.625 -7.785 183 HH TYR 21 HH TYR 21 2.666 15.766 -6.980 184 H TYR 22 H TYR 22 6.146 8.692 -3.405 185 HA TYR 22 HA TYR 22 5.238 6.477 -1.971 186 HB2 TYR 22 2HB TYR 22 7.265 6.371 -3.337 187 HB3 TYR 22 3HB TYR 22 8.067 7.557 -2.314 188 HD1 TYR 22 HD1 TYR 22 6.586 4.118 -2.244 189 HD2 TYR 22 HD2 TYR 22 9.393 6.801 -0.442 190 HE1 TYR 22 HE1 TYR 22 7.433 2.296 -0.847 191 HE2 TYR 22 HE2 TYR 22 10.230 4.978 0.965 192 HH TYR 22 HH TYR 22 9.299 2.753 1.863 193 H ASN 23 H ASN 23 6.625 9.540 -0.767 194 HA ASN 23 HA ASN 23 7.055 8.935 1.918 195 HB2 ASN 23 2HB ASN 23 5.956 11.527 0.731 196 HB3 ASN 23 3HB ASN 23 6.608 11.373 2.361 197 HD21 ASN 23 1HD2 ASN 23 7.466 13.072 0.129 198 HD22 ASN 23 2HD2 ASN 23 9.136 12.699 -0.135 199 H GLU 24 H GLU 24 4.101 9.809 0.237 200 HA GLU 24 HA GLU 24 2.365 9.955 2.502 201 HB2 GLU 24 2HB GLU 24 1.704 9.582 -0.448 202 HB3 GLU 24 3HB GLU 24 0.574 10.103 0.803 203 HG2 GLU 24 2HG GLU 24 3.029 11.636 -0.132 204 HG3 GLU 24 3HG GLU 24 1.366 11.967 -0.617 205 H LEU 25 H LEU 25 2.994 7.480 -0.026 206 HA LEU 25 HA LEU 25 1.031 5.598 0.701 207 HB2 LEU 25 2HB LEU 25 2.255 5.692 -1.480 208 HB3 LEU 25 3HB LEU 25 3.707 5.140 -0.669 209 HG LEU 25 HG LEU 25 2.592 2.970 -0.140 210 HD11 LEU 25 1HD1 LEU 25 0.444 2.374 -1.207 211 HD12 LEU 25 2HD1 LEU 25 0.255 4.045 -1.748 212 HD13 LEU 25 3HD1 LEU 25 0.270 3.668 -0.024 213 HD21 LEU 25 1HD2 LEU 25 2.531 3.655 -3.096 214 HD22 LEU 25 2HD2 LEU 25 2.632 2.037 -2.397 215 HD23 LEU 25 3HD2 LEU 25 3.957 3.172 -2.171 216 H LYS 26 H LYS 26 4.479 5.772 1.430 217 HA LYS 26 HA LYS 26 4.814 3.529 3.037 218 HB2 LYS 26 2HB LYS 26 6.627 5.109 2.098 219 HB3 LYS 26 3HB LYS 26 6.318 6.140 3.491 220 HG2 LYS 26 2HG LYS 26 6.922 4.211 4.979 221 HG3 LYS 26 3HG LYS 26 7.306 3.267 3.545 222 HD2 LYS 26 2HD LYS 26 9.380 4.069 4.416 223 HD3 LYS 26 3HD LYS 26 9.050 5.022 2.969 224 HE2 LYS 26 2HE LYS 26 9.891 6.454 4.773 225 HE3 LYS 26 3HE LYS 26 8.218 6.876 4.407 226 HZ1 LYS 26 1HZ LYS 26 7.511 5.571 6.323 227 HZ2 LYS 26 2HZ LYS 26 8.601 6.780 6.779 228 HZ3 LYS 26 3HZ LYS 26 9.119 5.174 6.673 229 H ALA 27 H ALA 27 3.440 6.687 3.849 230 HA ALA 27 HA ALA 27 3.452 6.310 6.716 231 HB1 ALA 27 1HB ALA 27 3.631 8.565 5.745 232 HB2 ALA 27 2HB ALA 27 2.182 8.430 6.743 233 HB3 ALA 27 3HB ALA 27 2.046 8.376 4.983 234 H LEU 28 H LEU 28 1.203 5.945 4.023 235 HA LEU 28 HA LEU 28 -1.190 5.462 5.476 236 HB2 LEU 28 2HB LEU 28 -1.136 6.172 3.109 237 HB3 LEU 28 3HB LEU 28 -0.322 4.684 2.660 238 HG LEU 28 HG LEU 28 -2.357 3.380 3.217 239 HD11 LEU 28 1HD1 LEU 28 -3.296 4.784 4.987 240 HD12 LEU 28 2HD1 LEU 28 -4.486 4.468 3.729 241 HD13 LEU 28 3HD1 LEU 28 -3.687 6.040 3.807 242 HD21 LEU 28 1HD2 LEU 28 -2.928 5.668 1.306 243 HD22 LEU 28 2HD2 LEU 28 -3.734 4.098 1.336 244 HD23 LEU 28 3HD2 LEU 28 -2.026 4.198 0.920 245 H VAL 29 H VAL 29 1.392 3.412 4.228 246 HA VAL 29 HA VAL 29 0.419 0.868 4.977 247 HB VAL 29 HB VAL 29 3.088 2.015 4.186 248 HG11 VAL 29 1HG1 VAL 29 4.248 -0.191 4.505 249 HG12 VAL 29 2HG1 VAL 29 2.864 -0.737 5.452 250 HG13 VAL 29 3HG1 VAL 29 3.844 0.617 6.022 251 HG21 VAL 29 1HG2 VAL 29 2.964 0.270 2.429 252 HG22 VAL 29 2HG2 VAL 29 1.506 1.265 2.459 253 HG23 VAL 29 3HG2 VAL 29 1.483 -0.355 3.161 254 H SER 30 H SER 30 2.460 3.245 6.630 255 HA SER 30 HA SER 30 3.043 1.640 8.916 256 HB2 SER 30 2HB SER 30 4.405 3.600 8.193 257 HB3 SER 30 3HB SER 30 3.100 4.677 8.695 258 HG SER 30 HG SER 30 3.659 4.407 10.715 259 H LYS 31 H LYS 31 0.386 3.705 8.052 260 HA LYS 31 HA LYS 31 -0.870 3.959 10.590 261 HB2 LYS 31 2HB LYS 31 -1.340 5.512 8.727 262 HB3 LYS 31 3HB LYS 31 -1.974 4.186 7.756 263 HG2 LYS 31 2HG LYS 31 -3.793 3.886 9.474 264 HG3 LYS 31 3HG LYS 31 -3.188 5.331 10.294 265 HD2 LYS 31 2HD LYS 31 -3.629 6.654 8.225 266 HD3 LYS 31 3HD LYS 31 -4.277 5.204 7.450 267 HE2 LYS 31 2HE LYS 31 -6.122 6.579 8.275 268 HE3 LYS 31 3HE LYS 31 -6.036 5.088 9.216 269 HZ1 LYS 31 1HZ LYS 31 -4.949 6.281 10.985 270 HZ2 LYS 31 2HZ LYS 31 -6.391 7.064 10.589 271 HZ3 LYS 31 3HZ LYS 31 -4.918 7.702 10.070 272 H ILE 32 H ILE 32 -1.607 1.929 7.716 273 HA ILE 32 HA ILE 32 -3.782 0.575 8.935 274 HB ILE 32 HB ILE 32 -3.812 -0.925 6.960 275 HG12 ILE 32 2HG1 ILE 32 -1.232 0.476 6.090 276 HG13 ILE 32 3HG1 ILE 32 -1.336 -1.190 6.640 277 HG21 ILE 32 1HG2 ILE 32 -3.360 1.990 6.209 278 HG22 ILE 32 2HG2 ILE 32 -4.869 1.289 6.795 279 HG23 ILE 32 3HG2 ILE 32 -4.220 0.793 5.232 280 HD11 ILE 32 1HD1 ILE 32 -1.131 -1.021 4.223 281 HD12 ILE 32 2HD1 ILE 32 -2.625 -0.089 4.142 282 HD13 ILE 32 3HD1 ILE 32 -2.659 -1.770 4.683 283 H SER 33 H SER 33 -0.359 -0.348 8.507 284 HA SER 33 HA SER 33 -0.495 -3.032 9.304 285 HB2 SER 33 2HB SER 33 1.952 -2.860 9.620 286 HB3 SER 33 3HB SER 33 1.438 -2.062 8.132 287 HG SER 33 HG SER 33 2.264 -0.298 8.880 288 H SER 34 H SER 34 -0.455 -0.104 11.201 289 HA SER 34 HA SER 34 0.224 -1.319 13.723 290 HB2 SER 34 2HB SER 34 0.807 1.044 13.214 291 HB3 SER 34 3HB SER 34 -0.903 1.451 13.084 292 HG SER 34 HG SER 34 -0.198 0.216 15.449 293 H SER 35 H SER 35 -2.509 -1.539 11.880 294 HA SER 35 HA SER 35 -4.336 -1.847 14.188 295 HB2 SER 35 2HB SER 35 -4.905 0.152 12.815 296 HB3 SER 35 3HB SER 35 -5.061 -0.872 11.389 297 HG SER 35 HG SER 35 -6.888 -1.717 12.181 298 H VAL 36 H VAL 36 -3.180 -3.129 11.087 299 HA VAL 36 HA VAL 36 -5.237 -5.242 11.081 300 HB VAL 36 HB VAL 36 -4.681 -5.705 8.744 301 HG11 VAL 36 1HG1 VAL 36 -4.983 -2.708 9.180 302 HG12 VAL 36 2HG1 VAL 36 -6.288 -3.897 9.151 303 HG13 VAL 36 3HG1 VAL 36 -5.359 -3.578 7.686 304 HG21 VAL 36 1HG2 VAL 36 -2.499 -3.578 8.935 305 HG22 VAL 36 2HG2 VAL 36 -3.007 -4.400 7.458 306 HG23 VAL 36 3HG2 VAL 36 -2.241 -5.317 8.754 307 H ASN 37 H ASN 37 -4.779 -7.282 11.465 308 HA ASN 37 HA ASN 37 -1.999 -8.228 11.818 309 HB2 ASN 37 2HB ASN 37 -4.631 -9.317 12.932 310 HB3 ASN 37 3HB ASN 37 -3.060 -10.087 13.160 311 HD21 ASN 37 1HD2 ASN 37 -4.905 -9.009 15.163 312 HD22 ASN 37 2HD2 ASN 37 -4.027 -7.816 16.049 313 H ASP 38 H ASP 38 -4.266 -8.134 9.497 314 HA ASP 38 HA ASP 38 -3.336 -10.652 8.220 315 HB2 ASP 38 2HB ASP 38 -6.160 -9.515 7.920 316 HB3 ASP 38 3HB ASP 38 -5.527 -10.940 7.106 317 H LEU 39 H LEU 39 -2.594 -10.346 6.148 318 HA LEU 39 HA LEU 39 -2.226 -7.679 5.136 319 HB2 LEU 39 2HB LEU 39 -0.543 -9.463 4.743 320 HB3 LEU 39 3HB LEU 39 -1.702 -10.345 3.763 321 HG LEU 39 HG LEU 39 -1.722 -8.430 2.113 322 HD11 LEU 39 1HD1 LEU 39 -1.073 -6.607 3.590 323 HD12 LEU 39 2HD1 LEU 39 0.008 -6.697 2.202 324 HD13 LEU 39 3HD1 LEU 39 0.543 -7.296 3.778 325 HD21 LEU 39 1HD2 LEU 39 1.027 -9.604 2.587 326 HD22 LEU 39 2HD2 LEU 39 0.427 -8.898 1.082 327 HD23 LEU 39 3HD2 LEU 39 -0.298 -10.375 1.710 328 H GLU 40 H GLU 40 -4.548 -10.251 4.603 329 HA GLU 40 HA GLU 40 -5.817 -9.299 2.279 330 HB2 GLU 40 2HB GLU 40 -6.191 -11.553 3.377 331 HB3 GLU 40 3HB GLU 40 -7.150 -10.740 4.612 332 HG2 GLU 40 2HG GLU 40 -8.747 -9.987 2.874 333 HG3 GLU 40 3HG GLU 40 -7.782 -10.784 1.636 334 H GLU 41 H GLU 41 -6.122 -8.330 5.698 335 HA GLU 41 HA GLU 41 -8.355 -6.546 5.304 336 HB2 GLU 41 2HB GLU 41 -6.355 -6.764 7.594 337 HB3 GLU 41 3HB GLU 41 -7.807 -5.761 7.622 338 HG2 GLU 41 2HG GLU 41 -7.697 -8.793 7.465 339 HG3 GLU 41 3HG GLU 41 -8.167 -7.828 8.860 340 H ALA 42 H ALA 42 -4.916 -6.334 4.986 341 HA ALA 42 HA ALA 42 -4.593 -3.484 5.159 342 HB1 ALA 42 1HB ALA 42 -2.803 -5.577 3.853 343 HB2 ALA 42 2HB ALA 42 -2.688 -5.011 5.524 344 HB3 ALA 42 3HB ALA 42 -2.349 -3.904 4.189 345 H ILE 43 H ILE 43 -4.766 -5.820 2.509 346 HA ILE 43 HA ILE 43 -4.551 -4.119 0.296 347 HB ILE 43 HB ILE 43 -5.938 -6.824 0.567 348 HG12 ILE 43 2HG1 ILE 43 -3.166 -6.148 -0.533 349 HG13 ILE 43 3HG1 ILE 43 -3.479 -6.802 1.069 350 HG21 ILE 43 1HG2 ILE 43 -6.833 -5.697 -1.423 351 HG22 ILE 43 2HG2 ILE 43 -5.802 -7.045 -1.896 352 HG23 ILE 43 3HG2 ILE 43 -5.197 -5.391 -2.011 353 HD11 ILE 43 1HD1 ILE 43 -3.968 -8.199 -1.569 354 HD12 ILE 43 2HD1 ILE 43 -4.379 -8.858 0.018 355 HD13 ILE 43 3HD1 ILE 43 -2.695 -8.540 -0.395 356 H VAL 44 H VAL 44 -7.637 -5.683 1.357 357 HA VAL 44 HA VAL 44 -9.530 -4.275 0.071 358 HB VAL 44 HB VAL 44 -9.694 -5.113 3.001 359 HG11 VAL 44 1HG1 VAL 44 -12.155 -5.221 2.661 360 HG12 VAL 44 2HG1 VAL 44 -11.957 -4.555 1.037 361 HG13 VAL 44 3HG1 VAL 44 -11.545 -3.578 2.449 362 HG21 VAL 44 1HG2 VAL 44 -9.076 -6.979 1.496 363 HG22 VAL 44 2HG2 VAL 44 -10.487 -6.647 0.489 364 HG23 VAL 44 3HG2 VAL 44 -10.700 -7.202 2.152 365 H VAL 45 H VAL 45 -8.228 -3.133 3.282 366 HA VAL 45 HA VAL 45 -9.591 -0.670 3.374 367 HB VAL 45 HB VAL 45 -6.916 -1.539 4.535 368 HG11 VAL 45 1HG1 VAL 45 -8.183 1.201 4.956 369 HG12 VAL 45 2HG1 VAL 45 -6.635 0.880 4.174 370 HG13 VAL 45 3HG1 VAL 45 -6.834 0.552 5.895 371 HG21 VAL 45 1HG2 VAL 45 -8.952 -2.490 5.546 372 HG22 VAL 45 2HG2 VAL 45 -9.597 -0.871 5.824 373 HG23 VAL 45 3HG2 VAL 45 -8.155 -1.405 6.689 374 H LEU 46 H LEU 46 -6.502 -1.443 1.768 375 HA LEU 46 HA LEU 46 -5.857 1.184 0.881 376 HB2 LEU 46 2HB LEU 46 -5.017 -1.533 -0.191 377 HB3 LEU 46 3HB LEU 46 -4.387 -0.021 -0.828 378 HG LEU 46 HG LEU 46 -4.019 -1.013 2.025 379 HD11 LEU 46 1HD1 LEU 46 -2.740 -2.361 0.427 380 HD12 LEU 46 2HD1 LEU 46 -1.677 -1.381 1.432 381 HD13 LEU 46 3HD1 LEU 46 -1.999 -0.900 -0.237 382 HD21 LEU 46 1HD2 LEU 46 -2.451 0.870 2.279 383 HD22 LEU 46 2HD2 LEU 46 -4.084 1.432 1.944 384 HD23 LEU 46 3HD2 LEU 46 -2.870 1.450 0.662 385 H ARG 47 H ARG 47 -8.035 -1.277 -0.395 386 HA ARG 47 HA ARG 47 -8.372 -0.201 -2.999 387 HB2 ARG 47 2HB ARG 47 -10.089 -2.076 -1.347 388 HB3 ARG 47 3HB ARG 47 -10.575 -1.552 -2.961 389 HG2 ARG 47 2HG ARG 47 -8.346 -2.420 -3.792 390 HG3 ARG 47 3HG ARG 47 -8.113 -3.155 -2.203 391 HD2 ARG 47 2HD ARG 47 -9.852 -4.709 -2.546 392 HD3 ARG 47 3HD ARG 47 -10.610 -3.733 -3.817 393 HE ARG 47 HE ARG 47 -8.215 -5.440 -4.085 394 HH11 ARG 47 1HH1 ARG 47 -10.658 -3.420 -5.638 395 HH12 ARG 47 2HH1 ARG 47 -10.215 -3.905 -7.239 396 HH21 ARG 47 1HH2 ARG 47 -7.557 -5.913 -6.204 397 HH22 ARG 47 2HH2 ARG 47 -8.463 -5.314 -7.560 398 H GLU 48 H GLU 48 -9.610 0.814 0.049 399 HA GLU 48 HA GLU 48 -11.697 2.532 -1.097 400 HB2 GLU 48 2HB GLU 48 -10.657 2.234 1.757 401 HB3 GLU 48 3HB GLU 48 -12.031 3.243 1.289 402 HG2 GLU 48 2HG GLU 48 -13.314 1.306 0.631 403 HG3 GLU 48 3HG GLU 48 -11.924 0.240 0.829 404 H GLU 49 H GLU 49 -8.446 2.659 0.194 405 HA GLU 49 HA GLU 49 -8.192 5.509 0.345 406 HB2 GLU 49 2HB GLU 49 -5.963 3.446 0.127 407 HB3 GLU 49 3HB GLU 49 -5.800 5.110 0.692 408 HG2 GLU 49 2HG GLU 49 -7.191 2.793 2.066 409 HG3 GLU 49 3HG GLU 49 -5.810 3.725 2.638 410 H GLU 50 H GLU 50 -7.312 3.139 -2.064 411 HA GLU 50 HA GLU 50 -6.011 4.739 -3.942 412 HB2 GLU 50 2HB GLU 50 -5.926 2.273 -3.864 413 HB3 GLU 50 3HB GLU 50 -7.621 2.183 -4.314 414 HG2 GLU 50 2HG GLU 50 -5.831 3.640 -6.202 415 HG3 GLU 50 3HG GLU 50 -5.553 1.911 -6.062 416 H LYS 51 H LYS 51 -9.443 3.681 -3.853 417 HA LYS 51 HA LYS 51 -10.292 5.099 -6.115 418 HB2 LYS 51 2HB LYS 51 -11.891 4.031 -3.768 419 HB3 LYS 51 3HB LYS 51 -12.603 4.616 -5.273 420 HG2 LYS 51 2HG LYS 51 -11.440 2.834 -6.526 421 HG3 LYS 51 3HG LYS 51 -10.700 2.253 -5.032 422 HD2 LYS 51 2HD LYS 51 -12.594 0.834 -5.573 423 HD3 LYS 51 3HD LYS 51 -12.984 1.768 -4.128 424 HE2 LYS 51 2HE LYS 51 -14.900 1.654 -5.674 425 HE3 LYS 51 3HE LYS 51 -14.342 3.318 -5.496 426 HZ1 LYS 51 1HZ LYS 51 -13.704 1.505 -7.768 427 HZ2 LYS 51 2HZ LYS 51 -13.153 3.093 -7.594 428 HZ3 LYS 51 3HZ LYS 51 -14.801 2.791 -7.791 429 H LYS 52 H LYS 52 -10.031 6.184 -2.730 430 HA LYS 52 HA LYS 52 -11.566 8.632 -3.239 431 HB2 LYS 52 2HB LYS 52 -11.101 9.266 -0.950 432 HB3 LYS 52 3HB LYS 52 -11.552 7.564 -0.960 433 HG2 LYS 52 2HG LYS 52 -9.177 6.933 -0.768 434 HG3 LYS 52 3HG LYS 52 -8.713 8.631 -0.772 435 HD2 LYS 52 2HD LYS 52 -8.670 7.732 1.498 436 HD3 LYS 52 3HD LYS 52 -9.921 8.970 1.364 437 HE2 LYS 52 2HE LYS 52 -11.669 7.306 1.366 438 HE3 LYS 52 3HE LYS 52 -10.508 5.992 1.146 439 HZ1 LYS 52 1HZ LYS 52 -10.480 7.741 3.529 440 HZ2 LYS 52 2HZ LYS 52 -9.720 6.244 3.318 441 HZ3 LYS 52 3HZ LYS 52 -11.402 6.329 3.453 442 H ALA 53 H ALA 53 -8.256 7.549 -3.469 443 HA ALA 53 HA ALA 53 -6.997 10.143 -3.479 444 HB1 ALA 53 1HB ALA 53 -5.736 8.134 -2.810 445 HB2 ALA 53 2HB ALA 53 -4.979 8.885 -4.216 446 HB3 ALA 53 3HB ALA 53 -5.964 7.428 -4.411 447 H SER 54 H SER 54 -6.350 11.327 -5.257 448 HA SER 54 HA SER 54 -7.313 10.529 -7.940 449 HB2 SER 54 2HB SER 54 -6.886 12.958 -8.511 450 HB3 SER 54 3HB SER 54 -8.104 12.726 -7.260 451 HG SER 54 HG SER 54 -5.985 14.232 -7.107 452 H GLU 55 H GLU 55 -5.830 10.706 -9.759 453 HA GLU 55 HA GLU 55 -3.268 9.590 -9.264 454 HB2 GLU 55 2HB GLU 55 -4.488 10.754 -11.803 455 HB3 GLU 55 3HB GLU 55 -2.941 9.907 -11.765 456 HG2 GLU 55 2HG GLU 55 -4.101 7.866 -10.945 457 HG3 GLU 55 3HG GLU 55 -5.645 8.721 -11.045 458 HA PRO 56 HA PRO 56 -1.172 9.541 -10.474 459 HB2 PRO 56 2HB PRO 56 1.457 10.282 -9.446 460 HB3 PRO 56 3HB PRO 56 0.953 10.105 -11.134 461 HG2 PRO 56 2HG PRO 56 1.631 12.508 -9.997 462 HG3 PRO 56 3HG PRO 56 0.535 12.342 -11.390 463 HD2 PRO 56 2HD PRO 56 -0.162 12.706 -8.470 464 HD3 PRO 56 3HD PRO 56 -0.862 13.504 -9.901 465 H PHE 57 H PHE 57 -1.538 10.825 -7.309 466 HA PHE 57 HA PHE 57 -0.277 8.761 -5.804 467 HB2 PHE 57 2HB PHE 57 -0.923 10.955 -4.836 468 HB3 PHE 57 3HB PHE 57 -2.623 10.532 -5.001 469 HD1 PHE 57 HD1 PHE 57 0.433 8.821 -3.583 470 HD2 PHE 57 HD2 PHE 57 -3.613 10.041 -2.915 471 HE1 PHE 57 HE1 PHE 57 0.497 7.831 -1.338 472 HE2 PHE 57 HE2 PHE 57 -3.532 9.042 -0.671 473 HZ PHE 57 HZ PHE 57 -1.481 7.932 0.122 474 H LYS 58 H LYS 58 -3.459 8.941 -7.336 475 HA LYS 58 HA LYS 58 -4.545 6.540 -6.296 476 HB2 LYS 58 2HB LYS 58 -5.833 8.274 -7.554 477 HB3 LYS 58 3HB LYS 58 -5.037 7.764 -9.033 478 HG2 LYS 58 2HG LYS 58 -6.123 5.587 -8.936 479 HG3 LYS 58 3HG LYS 58 -6.801 5.962 -7.345 480 HD2 LYS 58 2HD LYS 58 -8.053 7.890 -8.433 481 HD3 LYS 58 3HD LYS 58 -7.493 7.289 -9.999 482 HE2 LYS 58 2HE LYS 58 -9.198 5.714 -8.028 483 HE3 LYS 58 3HE LYS 58 -9.812 6.552 -9.458 484 HZ1 LYS 58 1HZ LYS 58 -8.486 5.100 -10.847 485 HZ2 LYS 58 2HZ LYS 58 -9.483 4.179 -9.837 486 HZ3 LYS 58 3HZ LYS 58 -7.837 4.328 -9.486 487 H THR 59 H THR 59 -2.161 7.154 -8.768 488 HA THR 59 HA THR 59 -2.120 4.489 -9.879 489 HB THR 59 HB THR 59 -0.088 6.748 -10.160 490 HG1 THR 59 HG1 THR 59 -2.464 6.142 -11.599 491 HG21 THR 59 1HG2 THR 59 0.823 4.558 -10.894 492 HG22 THR 59 2HG2 THR 59 0.566 5.630 -12.273 493 HG23 THR 59 3HG2 THR 59 -0.578 4.328 -11.943 494 H ASP 60 H ASP 60 -0.336 6.388 -7.554 495 HA ASP 60 HA ASP 60 1.857 4.777 -6.973 496 HB2 ASP 60 2HB ASP 60 1.922 7.000 -6.197 497 HB3 ASP 60 3HB ASP 60 0.299 6.931 -5.544 498 H ILE 61 H ILE 61 -1.196 5.042 -5.141 499 HA ILE 61 HA ILE 61 -0.798 2.871 -3.451 500 HB ILE 61 HB ILE 61 -3.522 3.897 -4.357 501 HG12 ILE 61 2HG1 ILE 61 -1.797 4.763 -1.979 502 HG13 ILE 61 3HG1 ILE 61 -2.110 5.721 -3.423 503 HG21 ILE 61 1HG2 ILE 61 -3.673 1.693 -3.235 504 HG22 ILE 61 2HG2 ILE 61 -4.352 2.951 -2.206 505 HG23 ILE 61 3HG2 ILE 61 -2.746 2.307 -1.860 506 HD11 ILE 61 1HD1 ILE 61 -3.436 6.471 -1.539 507 HD12 ILE 61 2HD1 ILE 61 -4.179 4.882 -1.384 508 HD13 ILE 61 3HD1 ILE 61 -4.476 5.864 -2.824 509 H ARG 62 H ARG 62 -2.697 2.865 -6.613 510 HA ARG 62 HA ARG 62 -3.463 0.179 -6.295 511 HB2 ARG 62 2HB ARG 62 -4.188 0.125 -8.627 512 HB3 ARG 62 3HB ARG 62 -4.724 1.568 -7.802 513 HG2 ARG 62 2HG ARG 62 -4.195 2.278 -9.975 514 HG3 ARG 62 3HG ARG 62 -2.835 2.813 -8.992 515 HD2 ARG 62 2HD ARG 62 -2.280 1.795 -11.279 516 HD3 ARG 62 3HD ARG 62 -1.390 1.161 -9.889 517 HE ARG 62 HE ARG 62 -3.781 -0.326 -10.633 518 HH11 ARG 62 1HH1 ARG 62 -0.303 -0.088 -11.060 519 HH12 ARG 62 2HH1 ARG 62 -0.138 -1.734 -11.541 520 HH21 ARG 62 1HH2 ARG 62 -3.518 -2.502 -11.210 521 HH22 ARG 62 2HH2 ARG 62 -1.949 -3.104 -11.627 522 H ILE 63 H ILE 63 -0.479 1.455 -7.745 523 HA ILE 63 HA ILE 63 0.478 -0.953 -8.862 524 HB ILE 63 HB ILE 63 2.116 1.333 -7.662 525 HG12 ILE 63 2HG1 ILE 63 1.521 0.690 -10.594 526 HG13 ILE 63 3HG1 ILE 63 0.703 1.930 -9.659 527 HG21 ILE 63 1HG2 ILE 63 4.065 0.428 -8.918 528 HG22 ILE 63 2HG2 ILE 63 3.104 -0.975 -9.398 529 HG23 ILE 63 3HG2 ILE 63 3.494 -0.709 -7.698 530 HD11 ILE 63 1HD1 ILE 63 2.405 2.873 -11.122 531 HD12 ILE 63 2HD1 ILE 63 3.650 1.911 -10.327 532 HD13 ILE 63 3HD1 ILE 63 2.795 3.169 -9.428 533 H LEU 64 H LEU 64 0.847 0.338 -5.528 534 HA LEU 64 HA LEU 64 2.411 -1.813 -4.493 535 HB2 LEU 64 2HB LEU 64 2.236 0.400 -3.362 536 HB3 LEU 64 3HB LEU 64 0.537 0.095 -3.032 537 HG LEU 64 HG LEU 64 1.327 -1.984 -1.688 538 HD11 LEU 64 1HD1 LEU 64 3.580 -2.137 -2.556 539 HD12 LEU 64 2HD1 LEU 64 3.603 -1.946 -0.807 540 HD13 LEU 64 3HD1 LEU 64 3.995 -0.574 -1.848 541 HD21 LEU 64 1HD2 LEU 64 0.447 -0.001 -0.573 542 HD22 LEU 64 2HD2 LEU 64 2.048 0.743 -0.593 543 HD23 LEU 64 3HD2 LEU 64 1.762 -0.720 0.352 544 H LEU 65 H LEU 65 -0.994 -1.045 -4.415 545 HA LEU 65 HA LEU 65 -2.065 -2.993 -2.785 546 HB2 LEU 65 2HB LEU 65 -3.053 -0.814 -3.734 547 HB3 LEU 65 3HB LEU 65 -3.388 -1.697 -5.207 548 HG LEU 65 HG LEU 65 -4.641 -2.313 -2.496 549 HD11 LEU 65 1HD1 LEU 65 -5.340 -0.117 -3.275 550 HD12 LEU 65 2HD1 LEU 65 -6.672 -1.257 -3.411 551 HD13 LEU 65 3HD1 LEU 65 -5.777 -0.779 -4.854 552 HD21 LEU 65 1HD2 LEU 65 -5.399 -3.351 -5.254 553 HD22 LEU 65 2HD2 LEU 65 -6.291 -3.648 -3.758 554 HD23 LEU 65 3HD2 LEU 65 -4.665 -4.291 -3.952 555 H ASP 66 H ASP 66 -2.575 -2.983 -6.322 556 HA ASP 66 HA ASP 66 -3.111 -5.535 -6.939 557 HB2 ASP 66 2HB ASP 66 -3.093 -3.800 -8.632 558 HB3 ASP 66 3HB ASP 66 -1.363 -3.543 -8.421 559 H PHE 67 H PHE 67 0.260 -4.259 -6.737 560 HA PHE 67 HA PHE 67 1.740 -6.528 -7.243 561 HB2 PHE 67 2HB PHE 67 2.803 -4.342 -6.825 562 HB3 PHE 67 3HB PHE 67 2.344 -4.408 -5.129 563 HD1 PHE 67 HD1 PHE 67 4.499 -6.005 -7.710 564 HD2 PHE 67 HD2 PHE 67 3.747 -5.575 -3.524 565 HE1 PHE 67 HE1 PHE 67 6.597 -7.168 -7.210 566 HE2 PHE 67 HE2 PHE 67 5.849 -6.740 -3.040 567 HZ PHE 67 HZ PHE 67 7.276 -7.541 -4.873 568 H LEU 68 H LEU 68 0.337 -5.634 -4.048 569 HA LEU 68 HA LEU 68 1.243 -7.852 -2.542 570 HB2 LEU 68 2HB LEU 68 -1.236 -6.119 -2.205 571 HB3 LEU 68 3HB LEU 68 -0.717 -7.305 -1.014 572 HG LEU 68 HG LEU 68 1.006 -4.939 -1.849 573 HD11 LEU 68 1HD1 LEU 68 -1.075 -4.097 -0.866 574 HD12 LEU 68 2HD1 LEU 68 0.297 -3.822 0.205 575 HD13 LEU 68 3HD1 LEU 68 -0.838 -5.130 0.550 576 HD21 LEU 68 1HD2 LEU 68 2.267 -6.807 -0.872 577 HD22 LEU 68 2HD2 LEU 68 1.191 -6.834 0.529 578 HD23 LEU 68 3HD2 LEU 68 2.235 -5.439 0.239 579 H GLU 69 H GLU 69 -1.655 -7.376 -4.528 580 HA GLU 69 HA GLU 69 -2.921 -9.872 -3.887 581 HB2 GLU 69 2HB GLU 69 -3.372 -8.059 -6.289 582 HB3 GLU 69 3HB GLU 69 -4.474 -9.308 -5.702 583 HG2 GLU 69 2HG GLU 69 -4.732 -7.989 -3.579 584 HG3 GLU 69 3HG GLU 69 -3.737 -6.712 -4.284 585 H SER 70 H SER 70 -0.528 -8.831 -6.160 586 HA SER 70 HA SER 70 0.990 -9.860 -7.425 587 HB2 SER 70 2HB SER 70 1.119 -11.497 -5.508 588 HB3 SER 70 3HB SER 70 -0.048 -12.514 -6.352 589 HG SER 70 HG SER 70 2.342 -11.686 -7.612 590 H LYS 71 H LYS 71 -1.748 -9.267 -8.368 591 HA LYS 71 HA LYS 71 -2.682 -11.355 -10.090 592 HB2 LYS 71 2HB LYS 71 -3.368 -8.394 -9.961 593 HB3 LYS 71 3HB LYS 71 -4.213 -9.552 -10.984 594 HG2 LYS 71 2HG LYS 71 -5.047 -10.752 -9.062 595 HG3 LYS 71 3HG LYS 71 -4.065 -9.772 -7.963 596 HD2 LYS 71 2HD LYS 71 -5.372 -7.781 -8.482 597 HD3 LYS 71 3HD LYS 71 -6.265 -8.635 -9.744 598 HE2 LYS 71 2HE LYS 71 -7.387 -10.005 -8.106 599 HE3 LYS 71 3HE LYS 71 -6.352 -9.402 -6.811 600 HZ1 LYS 71 1HZ LYS 71 -8.524 -8.360 -6.801 601 HZ2 LYS 71 2HZ LYS 71 -8.269 -7.770 -8.365 602 HZ3 LYS 71 3HZ LYS 71 -7.297 -7.237 -7.090 603 HA PRO 72 HA PRO 72 -0.189 -10.327 -13.730 604 HB2 PRO 72 2HB PRO 72 -1.926 -11.890 -15.467 605 HB3 PRO 72 3HB PRO 72 -0.361 -12.369 -14.791 606 HG2 PRO 72 2HG PRO 72 -2.786 -13.526 -14.107 607 HG3 PRO 72 3HG PRO 72 -1.314 -13.590 -13.116 608 HD2 PRO 72 2HD PRO 72 -3.715 -11.809 -12.806 609 HD3 PRO 72 3HD PRO 72 -2.693 -12.565 -11.562 Start of MODEL 17 1 H GLY 1 1H GLY 1 4.852 -7.853 16.871 2 HA2 GLY 1 2HA GLY 1 3.737 -5.404 15.621 3 HA3 GLY 1 3HA GLY 1 5.159 -6.269 15.043 4 H SER 2 H SER 2 2.988 -5.848 13.372 5 HA SER 2 HA SER 2 1.441 -8.320 13.180 6 HB2 SER 2 2HB SER 2 1.547 -5.864 11.352 7 HB3 SER 2 3HB SER 2 0.398 -7.199 11.208 8 HG SER 2 HG SER 2 -0.647 -5.668 12.352 9 H VAL 3 H VAL 3 2.028 -10.007 11.918 10 HA VAL 3 HA VAL 3 4.332 -10.265 10.343 11 HB VAL 3 HB VAL 3 2.977 -12.173 11.237 12 HG11 VAL 3 1HG1 VAL 3 1.000 -11.598 9.000 13 HG12 VAL 3 2HG1 VAL 3 0.712 -11.353 10.722 14 HG13 VAL 3 3HG1 VAL 3 0.959 -12.983 10.098 15 HG21 VAL 3 1HG2 VAL 3 3.298 -13.726 9.349 16 HG22 VAL 3 2HG2 VAL 3 4.660 -12.612 9.490 17 HG23 VAL 3 3HG2 VAL 3 3.443 -12.359 8.239 18 H VAL 4 H VAL 4 1.442 -8.609 9.661 19 HA VAL 4 HA VAL 4 1.417 -8.653 6.809 20 HB VAL 4 HB VAL 4 0.276 -6.469 8.609 21 HG11 VAL 4 1HG1 VAL 4 -1.387 -6.195 6.790 22 HG12 VAL 4 2HG1 VAL 4 -0.558 -7.443 5.862 23 HG13 VAL 4 3HG1 VAL 4 0.263 -5.927 6.223 24 HG21 VAL 4 1HG2 VAL 4 -0.485 -8.640 9.476 25 HG22 VAL 4 2HG2 VAL 4 -1.047 -9.101 7.868 26 HG23 VAL 4 3HG2 VAL 4 -1.825 -7.766 8.723 27 H LYS 5 H LYS 5 2.891 -6.627 9.306 28 HA LYS 5 HA LYS 5 3.477 -4.315 7.923 29 HB2 LYS 5 2HB LYS 5 3.693 -4.426 10.353 30 HB3 LYS 5 3HB LYS 5 5.032 -5.563 10.228 31 HG2 LYS 5 2HG LYS 5 6.463 -3.841 9.244 32 HG3 LYS 5 3HG LYS 5 5.113 -2.706 9.179 33 HD2 LYS 5 2HD LYS 5 5.013 -2.658 11.641 34 HD3 LYS 5 3HD LYS 5 6.324 -3.836 11.737 35 HE2 LYS 5 2HE LYS 5 7.916 -2.259 10.870 36 HE3 LYS 5 3HE LYS 5 6.644 -1.132 10.395 37 HZ1 LYS 5 1HZ LYS 5 7.764 -0.418 12.411 38 HZ2 LYS 5 2HZ LYS 5 7.342 -1.855 13.195 39 HZ3 LYS 5 3HZ LYS 5 6.141 -0.762 12.720 40 H GLU 6 H GLU 6 5.470 -7.277 8.151 41 HA GLU 6 HA GLU 6 7.765 -6.280 6.845 42 HB2 GLU 6 2HB GLU 6 8.446 -8.662 6.669 43 HB3 GLU 6 3HB GLU 6 7.864 -8.270 8.283 44 HG2 GLU 6 2HG GLU 6 5.699 -9.345 7.771 45 HG3 GLU 6 3HG GLU 6 6.270 -9.734 6.153 46 H LYS 7 H LYS 7 4.880 -7.970 5.731 47 HA LYS 7 HA LYS 7 5.630 -8.433 3.021 48 HB2 LYS 7 2HB LYS 7 2.799 -8.050 4.107 49 HB3 LYS 7 3HB LYS 7 3.253 -8.896 2.630 50 HG2 LYS 7 2HG LYS 7 4.354 -10.658 3.921 51 HG3 LYS 7 3HG LYS 7 4.039 -9.781 5.424 52 HD2 LYS 7 2HD LYS 7 1.575 -10.015 4.985 53 HD3 LYS 7 3HD LYS 7 1.956 -10.999 3.570 54 HE2 LYS 7 2HE LYS 7 2.697 -11.679 6.433 55 HE3 LYS 7 3HE LYS 7 1.348 -12.370 5.534 56 HZ1 LYS 7 1HZ LYS 7 3.209 -13.864 5.515 57 HZ2 LYS 7 2HZ LYS 7 4.232 -12.674 4.891 58 HZ3 LYS 7 3HZ LYS 7 2.968 -13.280 3.949 59 H LEU 8 H LEU 8 4.216 -5.729 4.702 60 HA LEU 8 HA LEU 8 3.525 -4.176 2.374 61 HB2 LEU 8 2HB LEU 8 3.542 -3.552 5.342 62 HB3 LEU 8 3HB LEU 8 2.999 -2.414 4.122 63 HG LEU 8 HG LEU 8 1.715 -5.102 4.750 64 HD11 LEU 8 1HD1 LEU 8 -0.188 -3.790 5.562 65 HD12 LEU 8 2HD1 LEU 8 0.701 -2.293 5.263 66 HD13 LEU 8 3HD1 LEU 8 1.279 -3.439 6.475 67 HD21 LEU 8 1HD2 LEU 8 0.868 -3.025 2.701 68 HD22 LEU 8 2HD2 LEU 8 -0.050 -4.467 3.148 69 HD23 LEU 8 3HD2 LEU 8 1.516 -4.633 2.360 70 H GLU 9 H GLU 9 6.300 -4.471 4.499 71 HA GLU 9 HA GLU 9 7.575 -2.003 3.665 72 HB2 GLU 9 2HB GLU 9 8.599 -4.357 5.301 73 HB3 GLU 9 3HB GLU 9 9.561 -2.923 4.945 74 HG2 GLU 9 2HG GLU 9 7.976 -1.507 6.163 75 HG3 GLU 9 3HG GLU 9 6.930 -2.894 6.460 76 H LYS 10 H LYS 10 7.791 -5.465 2.887 77 HA LYS 10 HA LYS 10 9.789 -5.378 0.912 78 HB2 LYS 10 2HB LYS 10 7.300 -7.142 1.085 79 HB3 LYS 10 3HB LYS 10 8.575 -7.381 -0.104 80 HG2 LYS 10 2HG LYS 10 8.936 -7.547 2.898 81 HG3 LYS 10 3HG LYS 10 8.752 -8.928 1.817 82 HD2 LYS 10 2HD LYS 10 10.863 -8.263 0.649 83 HD3 LYS 10 3HD LYS 10 11.047 -6.919 1.782 84 HE2 LYS 10 2HE LYS 10 11.206 -8.524 3.654 85 HE3 LYS 10 3HE LYS 10 11.023 -9.868 2.525 86 HZ1 LYS 10 1HZ LYS 10 13.249 -7.909 2.575 87 HZ2 LYS 10 2HZ LYS 10 13.067 -9.134 1.428 88 HZ3 LYS 10 3HZ LYS 10 13.329 -9.528 3.051 89 H ALA 11 H ALA 11 6.257 -4.916 0.751 90 HA ALA 11 HA ALA 11 5.890 -4.527 -1.969 91 HB1 ALA 11 1HB ALA 11 3.778 -3.427 -1.357 92 HB2 ALA 11 2HB ALA 11 4.331 -3.255 0.311 93 HB3 ALA 11 3HB ALA 11 4.048 -4.860 -0.365 94 H LEU 12 H LEU 12 6.382 -2.041 0.565 95 HA LEU 12 HA LEU 12 6.551 0.286 -0.809 96 HB2 LEU 12 2HB LEU 12 8.054 -0.726 1.597 97 HB3 LEU 12 3HB LEU 12 8.477 0.845 0.943 98 HG LEU 12 HG LEU 12 5.745 0.047 2.011 99 HD11 LEU 12 1HD1 LEU 12 6.267 1.625 3.832 100 HD12 LEU 12 2HD1 LEU 12 7.872 1.886 3.151 101 HD13 LEU 12 3HD1 LEU 12 7.424 0.295 3.771 102 HD21 LEU 12 1HD2 LEU 12 5.153 2.448 1.702 103 HD22 LEU 12 2HD2 LEU 12 5.486 1.653 0.167 104 HD23 LEU 12 3HD2 LEU 12 6.696 2.717 0.889 105 H ILE 13 H ILE 13 9.412 -1.846 -0.241 106 HA ILE 13 HA ILE 13 11.230 -0.162 -1.624 107 HB ILE 13 HB ILE 13 11.526 -3.105 -0.849 108 HG12 ILE 13 2HG1 ILE 13 12.482 -0.584 0.595 109 HG13 ILE 13 3HG1 ILE 13 11.124 -1.586 1.093 110 HG21 ILE 13 1HG2 ILE 13 13.975 -2.773 -1.081 111 HG22 ILE 13 2HG2 ILE 13 13.697 -1.132 -1.665 112 HG23 ILE 13 3HG2 ILE 13 13.147 -2.509 -2.618 113 HD11 ILE 13 1HD1 ILE 13 13.086 -2.009 2.448 114 HD12 ILE 13 2HD1 ILE 13 14.015 -2.451 1.016 115 HD13 ILE 13 3HD1 ILE 13 12.646 -3.443 1.524 116 H GLU 14 H GLU 14 9.482 -3.132 -2.572 117 HA GLU 14 HA GLU 14 10.646 -3.649 -5.053 118 HB2 GLU 14 2HB GLU 14 7.773 -4.132 -4.138 119 HB3 GLU 14 3HB GLU 14 8.440 -4.783 -5.632 120 HG2 GLU 14 2HG GLU 14 9.281 -5.456 -2.804 121 HG3 GLU 14 3HG GLU 14 8.459 -6.505 -3.953 122 H VAL 15 H VAL 15 7.792 -1.618 -4.313 123 HA VAL 15 HA VAL 15 7.546 -0.789 -7.101 124 HB VAL 15 HB VAL 15 5.429 0.181 -6.495 125 HG11 VAL 15 1HG1 VAL 15 5.725 -2.483 -5.053 126 HG12 VAL 15 2HG1 VAL 15 5.428 -2.260 -6.777 127 HG13 VAL 15 3HG1 VAL 15 4.203 -1.772 -5.607 128 HG21 VAL 15 1HG2 VAL 15 5.978 1.288 -4.385 129 HG22 VAL 15 2HG2 VAL 15 6.142 -0.265 -3.568 130 HG23 VAL 15 3HG2 VAL 15 4.561 0.261 -4.151 131 H ARG 16 H ARG 16 9.324 0.257 -4.474 132 HA ARG 16 HA ARG 16 8.960 2.977 -4.184 133 HB2 ARG 16 2HB ARG 16 10.459 1.631 -2.763 134 HB3 ARG 16 3HB ARG 16 11.613 1.493 -4.084 135 HG2 ARG 16 2HG ARG 16 12.040 3.919 -3.990 136 HG3 ARG 16 3HG ARG 16 10.837 4.089 -2.707 137 HD2 ARG 16 2HD ARG 16 13.091 4.068 -1.746 138 HD3 ARG 16 3HD ARG 16 12.203 2.623 -1.245 139 HE ARG 16 HE ARG 16 13.881 2.332 -3.603 140 HH11 ARG 16 1HH1 ARG 16 13.693 1.868 -0.106 141 HH12 ARG 16 2HH1 ARG 16 15.011 0.745 -0.080 142 HH21 ARG 16 1HH2 ARG 16 15.625 0.888 -3.507 143 HH22 ARG 16 2HH2 ARG 16 16.096 0.197 -1.986 144 HA PRO 17 HA PRO 17 11.952 4.170 -7.842 145 HB2 PRO 17 2HB PRO 17 12.653 2.347 -9.760 146 HB3 PRO 17 3HB PRO 17 13.559 2.514 -8.241 147 HG2 PRO 17 2HG PRO 17 11.471 0.481 -8.963 148 HG3 PRO 17 3HG PRO 17 13.029 0.248 -8.139 149 HD2 PRO 17 2HD PRO 17 10.653 0.391 -6.787 150 HD3 PRO 17 3HD PRO 17 12.197 0.907 -6.081 151 H TYR 18 H TYR 18 9.082 2.413 -8.074 152 HA TYR 18 HA TYR 18 8.375 3.362 -10.778 153 HB2 TYR 18 2HB TYR 18 6.933 1.372 -8.953 154 HB3 TYR 18 3HB TYR 18 6.444 1.790 -10.595 155 HD1 TYR 18 HD1 TYR 18 7.978 1.189 -12.538 156 HD2 TYR 18 HD2 TYR 18 8.654 -0.299 -8.585 157 HE1 TYR 18 HE1 TYR 18 9.470 -0.541 -13.438 158 HE2 TYR 18 HE2 TYR 18 10.152 -2.029 -9.490 159 HH TYR 18 HH TYR 18 11.339 -1.942 -12.673 160 H VAL 19 H VAL 19 7.503 3.742 -7.365 161 HA VAL 19 HA VAL 19 5.123 5.326 -8.057 162 HB VAL 19 HB VAL 19 4.478 5.211 -5.682 163 HG11 VAL 19 1HG1 VAL 19 3.937 2.817 -5.576 164 HG12 VAL 19 2HG1 VAL 19 5.137 2.478 -6.826 165 HG13 VAL 19 3HG1 VAL 19 3.717 3.454 -7.208 166 HG21 VAL 19 1HG2 VAL 19 6.993 3.551 -5.232 167 HG22 VAL 19 2HG2 VAL 19 5.700 3.787 -4.052 168 HG23 VAL 19 3HG2 VAL 19 6.671 5.161 -4.584 169 H GLU 20 H GLU 20 4.974 7.412 -7.782 170 HA GLU 20 HA GLU 20 6.985 8.995 -6.321 171 HB2 GLU 20 2HB GLU 20 5.898 10.969 -7.298 172 HB3 GLU 20 3HB GLU 20 6.361 9.838 -8.562 173 HG2 GLU 20 2HG GLU 20 4.016 9.064 -8.736 174 HG3 GLU 20 3HG GLU 20 3.550 10.206 -7.472 175 H TYR 21 H TYR 21 5.911 10.775 -4.898 176 HA TYR 21 HA TYR 21 4.878 11.242 -2.929 177 HB2 TYR 21 2HB TYR 21 2.606 9.732 -4.294 178 HB3 TYR 21 3HB TYR 21 2.415 10.418 -2.686 179 HD1 TYR 21 HD1 TYR 21 3.970 11.750 -5.857 180 HD2 TYR 21 HD2 TYR 21 1.020 12.282 -2.815 181 HE1 TYR 21 HE1 TYR 21 3.324 13.891 -6.863 182 HE2 TYR 21 HE2 TYR 21 0.375 14.421 -3.817 183 HH TYR 21 HH TYR 21 1.327 15.371 -6.915 184 H TYR 22 H TYR 22 6.537 8.897 -3.272 185 HA TYR 22 HA TYR 22 5.768 6.644 -1.846 186 HB2 TYR 22 2HB TYR 22 7.879 6.777 -3.150 187 HB3 TYR 22 3HB TYR 22 8.562 7.886 -1.964 188 HD1 TYR 22 HD1 TYR 22 7.423 4.367 -2.491 189 HD2 TYR 22 HD2 TYR 22 9.547 7.029 0.095 190 HE1 TYR 22 HE1 TYR 22 8.244 2.458 -1.189 191 HE2 TYR 22 HE2 TYR 22 10.359 5.117 1.394 192 HH TYR 22 HH TYR 22 9.588 2.743 1.838 193 H ASN 23 H ASN 23 6.866 9.808 -0.596 194 HA ASN 23 HA ASN 23 7.118 9.245 2.127 195 HB2 ASN 23 2HB ASN 23 5.866 11.800 1.007 196 HB3 ASN 23 3HB ASN 23 6.653 11.613 2.571 197 HD21 ASN 23 1HD2 ASN 23 8.308 13.010 2.406 198 HD22 ASN 23 2HD2 ASN 23 9.501 13.009 1.156 199 H GLU 24 H GLU 24 4.254 10.073 0.234 200 HA GLU 24 HA GLU 24 2.418 10.280 2.401 201 HB2 GLU 24 2HB GLU 24 1.932 10.030 -0.599 202 HB3 GLU 24 3HB GLU 24 0.718 10.495 0.583 203 HG2 GLU 24 2HG GLU 24 3.213 12.056 -0.139 204 HG3 GLU 24 3HG GLU 24 1.559 12.458 -0.599 205 H LEU 25 H LEU 25 3.027 7.843 -0.124 206 HA LEU 25 HA LEU 25 1.037 5.978 0.609 207 HB2 LEU 25 2HB LEU 25 2.110 6.093 -1.629 208 HB3 LEU 25 3HB LEU 25 3.648 5.622 -0.929 209 HG LEU 25 HG LEU 25 2.707 3.376 -0.375 210 HD11 LEU 25 1HD1 LEU 25 0.543 2.649 -1.272 211 HD12 LEU 25 2HD1 LEU 25 0.195 4.296 -1.806 212 HD13 LEU 25 3HD1 LEU 25 0.352 3.938 -0.083 213 HD21 LEU 25 1HD2 LEU 25 2.423 4.132 -3.301 214 HD22 LEU 25 2HD2 LEU 25 2.621 2.494 -2.670 215 HD23 LEU 25 3HD2 LEU 25 3.918 3.672 -2.478 216 H LYS 26 H LYS 26 4.476 6.319 1.395 217 HA LYS 26 HA LYS 26 4.761 4.071 3.093 218 HB2 LYS 26 2HB LYS 26 6.690 5.360 2.226 219 HB3 LYS 26 3HB LYS 26 6.275 6.701 3.283 220 HG2 LYS 26 2HG LYS 26 6.826 5.401 5.258 221 HG3 LYS 26 3HG LYS 26 7.008 3.934 4.291 222 HD2 LYS 26 2HD LYS 26 9.197 4.883 4.914 223 HD3 LYS 26 3HD LYS 26 8.966 4.870 3.166 224 HE2 LYS 26 2HE LYS 26 10.015 6.960 3.858 225 HE3 LYS 26 3HE LYS 26 8.395 7.298 3.252 226 HZ1 LYS 26 1HZ LYS 26 8.791 8.543 5.240 227 HZ2 LYS 26 2HZ LYS 26 9.247 7.157 6.092 228 HZ3 LYS 26 3HZ LYS 26 7.647 7.345 5.592 229 H ALA 27 H ALA 27 3.325 7.258 3.748 230 HA ALA 27 HA ALA 27 3.258 6.952 6.623 231 HB1 ALA 27 1HB ALA 27 3.349 9.189 5.591 232 HB2 ALA 27 2HB ALA 27 1.894 9.014 6.576 233 HB3 ALA 27 3HB ALA 27 1.790 8.911 4.816 234 H LEU 28 H LEU 28 1.200 6.234 3.896 235 HA LEU 28 HA LEU 28 -1.245 5.747 5.298 236 HB2 LEU 28 2HB LEU 28 -1.262 6.435 2.968 237 HB3 LEU 28 3HB LEU 28 -0.230 5.094 2.510 238 HG LEU 28 HG LEU 28 -2.065 3.495 2.934 239 HD11 LEU 28 1HD1 LEU 28 -3.802 5.893 3.597 240 HD12 LEU 28 2HD1 LEU 28 -3.212 4.694 4.752 241 HD13 LEU 28 3HD1 LEU 28 -4.323 4.210 3.478 242 HD21 LEU 28 1HD2 LEU 28 -2.923 5.768 1.111 243 HD22 LEU 28 2HD2 LEU 28 -3.477 4.094 1.035 244 HD23 LEU 28 3HD2 LEU 28 -1.794 4.476 0.689 245 H VAL 29 H VAL 29 1.311 3.758 3.902 246 HA VAL 29 HA VAL 29 0.213 1.254 4.680 247 HB VAL 29 HB VAL 29 1.819 1.825 2.690 248 HG11 VAL 29 1HG1 VAL 29 3.905 1.302 4.822 249 HG12 VAL 29 2HG1 VAL 29 3.619 2.837 3.999 250 HG13 VAL 29 3HG1 VAL 29 4.196 1.443 3.089 251 HG21 VAL 29 1HG2 VAL 29 2.257 -0.716 4.281 252 HG22 VAL 29 2HG2 VAL 29 2.654 -0.488 2.576 253 HG23 VAL 29 3HG2 VAL 29 0.971 -0.434 3.108 254 H SER 30 H SER 30 2.336 3.584 6.194 255 HA SER 30 HA SER 30 3.387 1.944 8.290 256 HB2 SER 30 2HB SER 30 4.413 4.110 7.760 257 HB3 SER 30 3HB SER 30 2.927 4.962 8.183 258 HG SER 30 HG SER 30 3.553 4.920 10.182 259 H LYS 31 H LYS 31 0.592 4.120 8.048 260 HA LYS 31 HA LYS 31 -0.616 3.840 10.507 261 HB2 LYS 31 2HB LYS 31 -1.403 5.485 8.931 262 HB3 LYS 31 3HB LYS 31 -1.714 4.262 7.708 263 HG2 LYS 31 2HG LYS 31 -3.546 3.359 9.231 264 HG3 LYS 31 3HG LYS 31 -3.322 4.804 10.222 265 HD2 LYS 31 2HD LYS 31 -3.929 6.242 8.335 266 HD3 LYS 31 3HD LYS 31 -3.995 4.848 7.252 267 HE2 LYS 31 2HE LYS 31 -5.902 3.950 8.534 268 HE3 LYS 31 3HE LYS 31 -5.837 5.348 9.609 269 HZ1 LYS 31 1HZ LYS 31 -6.358 5.438 6.692 270 HZ2 LYS 31 2HZ LYS 31 -6.306 6.774 7.727 271 HZ3 LYS 31 3HZ LYS 31 -7.520 5.611 7.910 272 H ILE 32 H ILE 32 -1.283 1.906 7.531 273 HA ILE 32 HA ILE 32 -3.232 0.290 8.839 274 HB ILE 32 HB ILE 32 -3.411 -1.036 6.790 275 HG12 ILE 32 2HG1 ILE 32 -1.013 0.515 5.721 276 HG13 ILE 32 3HG1 ILE 32 -0.987 -1.180 6.175 277 HG21 ILE 32 1HG2 ILE 32 -4.051 0.778 5.231 278 HG22 ILE 32 2HG2 ILE 32 -3.128 1.934 6.196 279 HG23 ILE 32 3HG2 ILE 32 -4.546 1.141 6.886 280 HD11 ILE 32 1HD1 ILE 32 -1.100 -0.914 3.772 281 HD12 ILE 32 2HD1 ILE 32 -2.593 0.015 3.909 282 HD13 ILE 32 3HD1 ILE 32 -2.565 -1.688 4.373 283 H SER 33 H SER 33 0.215 -0.324 7.996 284 HA SER 33 HA SER 33 0.365 -3.011 8.769 285 HB2 SER 33 2HB SER 33 2.811 -2.594 9.105 286 HB3 SER 33 3HB SER 33 2.213 -1.911 7.595 287 HG SER 33 HG SER 33 3.003 -0.107 8.276 288 H SER 34 H SER 34 0.400 -0.087 10.772 289 HA SER 34 HA SER 34 1.189 -1.390 13.222 290 HB2 SER 34 2HB SER 34 0.016 1.385 12.756 291 HB3 SER 34 3HB SER 34 0.710 0.819 14.277 292 HG SER 34 HG SER 34 1.949 1.918 12.219 293 H SER 35 H SER 35 -1.726 -1.542 11.565 294 HA SER 35 HA SER 35 -3.357 -1.707 14.046 295 HB2 SER 35 2HB SER 35 -5.250 -0.706 12.736 296 HB3 SER 35 3HB SER 35 -3.892 0.394 12.937 297 HG SER 35 HG SER 35 -3.547 0.372 10.857 298 H VAL 36 H VAL 36 -2.778 -3.034 10.802 299 HA VAL 36 HA VAL 36 -5.147 -4.748 10.963 300 HB VAL 36 HB VAL 36 -4.857 -5.292 8.614 301 HG11 VAL 36 1HG1 VAL 36 -6.009 -3.180 9.085 302 HG12 VAL 36 2HG1 VAL 36 -5.127 -3.067 7.562 303 HG13 VAL 36 3HG1 VAL 36 -4.481 -2.297 9.015 304 HG21 VAL 36 1HG2 VAL 36 -2.427 -5.474 8.427 305 HG22 VAL 36 2HG2 VAL 36 -2.248 -3.734 8.627 306 HG23 VAL 36 3HG2 VAL 36 -3.042 -4.377 7.189 307 H ASN 37 H ASN 37 -5.074 -6.793 11.440 308 HA ASN 37 HA ASN 37 -2.547 -8.156 12.046 309 HB2 ASN 37 2HB ASN 37 -5.448 -8.932 12.616 310 HB3 ASN 37 3HB ASN 37 -4.042 -9.857 13.138 311 HD21 ASN 37 1HD2 ASN 37 -6.138 -8.607 14.737 312 HD22 ASN 37 2HD2 ASN 37 -5.339 -7.523 15.819 313 H ASP 38 H ASP 38 -4.781 -7.991 9.509 314 HA ASP 38 HA ASP 38 -3.854 -10.552 8.310 315 HB2 ASP 38 2HB ASP 38 -6.539 -9.170 7.854 316 HB3 ASP 38 3HB ASP 38 -6.001 -10.639 7.048 317 H LEU 39 H LEU 39 -3.016 -10.450 6.269 318 HA LEU 39 HA LEU 39 -2.230 -7.988 5.090 319 HB2 LEU 39 2HB LEU 39 -1.017 -10.207 4.898 320 HB3 LEU 39 3HB LEU 39 -2.269 -10.761 3.816 321 HG LEU 39 HG LEU 39 -0.027 -10.020 2.766 322 HD11 LEU 39 1HD1 LEU 39 -2.486 -8.727 1.613 323 HD12 LEU 39 2HD1 LEU 39 -1.980 -10.400 1.380 324 HD13 LEU 39 3HD1 LEU 39 -0.982 -9.087 0.758 325 HD21 LEU 39 1HD2 LEU 39 0.304 -7.962 4.074 326 HD22 LEU 39 2HD2 LEU 39 -1.087 -7.226 3.274 327 HD23 LEU 39 3HD2 LEU 39 0.350 -7.650 2.339 328 H GLU 40 H GLU 40 -4.968 -10.143 4.677 329 HA GLU 40 HA GLU 40 -6.130 -9.066 2.348 330 HB2 GLU 40 2HB GLU 40 -6.854 -11.206 3.321 331 HB3 GLU 40 3HB GLU 40 -7.474 -10.381 4.750 332 HG2 GLU 40 2HG GLU 40 -9.177 -9.250 3.378 333 HG3 GLU 40 3HG GLU 40 -8.519 -9.988 1.920 334 H GLU 41 H GLU 41 -6.141 -7.944 5.704 335 HA GLU 41 HA GLU 41 -8.234 -5.990 5.342 336 HB2 GLU 41 2HB GLU 41 -6.204 -6.377 7.578 337 HB3 GLU 41 3HB GLU 41 -7.466 -5.155 7.610 338 HG2 GLU 41 2HG GLU 41 -7.918 -8.148 7.522 339 HG3 GLU 41 3HG GLU 41 -8.049 -7.128 8.953 340 H ALA 42 H ALA 42 -4.780 -6.138 4.960 341 HA ALA 42 HA ALA 42 -4.242 -3.323 4.847 342 HB1 ALA 42 1HB ALA 42 -2.676 -5.660 3.680 343 HB2 ALA 42 2HB ALA 42 -2.465 -4.978 5.294 344 HB3 ALA 42 3HB ALA 42 -2.082 -4.004 3.874 345 H ILE 43 H ILE 43 -4.768 -5.884 2.435 346 HA ILE 43 HA ILE 43 -4.675 -4.426 0.063 347 HB ILE 43 HB ILE 43 -6.302 -6.920 0.738 348 HG12 ILE 43 2HG1 ILE 43 -3.607 -6.557 -0.636 349 HG13 ILE 43 3HG1 ILE 43 -3.870 -7.219 0.971 350 HG21 ILE 43 1HG2 ILE 43 -6.534 -7.346 -1.684 351 HG22 ILE 43 2HG2 ILE 43 -5.729 -5.819 -2.039 352 HG23 ILE 43 3HG2 ILE 43 -7.303 -5.816 -1.246 353 HD11 ILE 43 1HD1 ILE 43 -3.388 -8.997 -0.508 354 HD12 ILE 43 2HD1 ILE 43 -4.611 -8.463 -1.664 355 HD13 ILE 43 3HD1 ILE 43 -5.099 -9.106 -0.092 356 H VAL 44 H VAL 44 -7.767 -5.540 1.592 357 HA VAL 44 HA VAL 44 -9.661 -4.130 0.376 358 HB VAL 44 HB VAL 44 -9.486 -4.674 3.372 359 HG11 VAL 44 1HG1 VAL 44 -11.951 -3.835 1.797 360 HG12 VAL 44 2HG1 VAL 44 -11.157 -2.899 3.063 361 HG13 VAL 44 3HG1 VAL 44 -11.962 -4.416 3.464 362 HG21 VAL 44 1HG2 VAL 44 -9.423 -6.683 1.925 363 HG22 VAL 44 2HG2 VAL 44 -10.928 -6.184 1.154 364 HG23 VAL 44 3HG2 VAL 44 -10.918 -6.629 2.864 365 H VAL 45 H VAL 45 -7.912 -2.739 3.236 366 HA VAL 45 HA VAL 45 -9.111 -0.213 3.242 367 HB VAL 45 HB VAL 45 -6.274 -0.959 4.089 368 HG11 VAL 45 1HG1 VAL 45 -6.236 1.220 5.342 369 HG12 VAL 45 2HG1 VAL 45 -7.736 1.680 4.537 370 HG13 VAL 45 3HG1 VAL 45 -6.266 1.444 3.591 371 HG21 VAL 45 1HG2 VAL 45 -8.782 -0.439 5.737 372 HG22 VAL 45 2HG2 VAL 45 -7.193 -0.852 6.390 373 HG23 VAL 45 3HG2 VAL 45 -8.079 -2.022 5.409 374 H LEU 46 H LEU 46 -6.174 -1.273 1.441 375 HA LEU 46 HA LEU 46 -5.564 1.266 0.314 376 HB2 LEU 46 2HB LEU 46 -4.796 -1.518 -0.623 377 HB3 LEU 46 3HB LEU 46 -4.173 -0.046 -1.353 378 HG LEU 46 HG LEU 46 -3.708 -0.922 1.521 379 HD11 LEU 46 1HD1 LEU 46 -2.506 -2.297 -0.107 380 HD12 LEU 46 2HD1 LEU 46 -1.402 -1.311 0.847 381 HD13 LEU 46 3HD1 LEU 46 -1.784 -0.851 -0.816 382 HD21 LEU 46 1HD2 LEU 46 -3.784 1.522 1.380 383 HD22 LEU 46 2HD2 LEU 46 -2.613 1.509 0.058 384 HD23 LEU 46 3HD2 LEU 46 -2.136 0.970 1.671 385 H ARG 47 H ARG 47 -7.660 -1.367 -0.789 386 HA ARG 47 HA ARG 47 -8.208 -0.442 -3.411 387 HB2 ARG 47 2HB ARG 47 -10.075 -2.022 -1.586 388 HB3 ARG 47 3HB ARG 47 -10.193 -1.891 -3.339 389 HG2 ARG 47 2HG ARG 47 -7.983 -3.034 -3.524 390 HG3 ARG 47 3HG ARG 47 -7.994 -3.256 -1.776 391 HD2 ARG 47 2HD ARG 47 -8.743 -5.302 -2.796 392 HD3 ARG 47 3HD ARG 47 -10.134 -4.542 -2.019 393 HE ARG 47 HE ARG 47 -11.049 -4.071 -4.114 394 HH11 ARG 47 1HH1 ARG 47 -7.918 -5.623 -4.462 395 HH12 ARG 47 2HH1 ARG 47 -8.146 -5.987 -6.135 396 HH21 ARG 47 1HH2 ARG 47 -11.304 -4.504 -6.336 397 HH22 ARG 47 2HH2 ARG 47 -10.069 -5.352 -7.203 398 H GLU 48 H GLU 48 -9.271 0.645 -0.313 399 HA GLU 48 HA GLU 48 -11.531 2.216 -1.315 400 HB2 GLU 48 2HB GLU 48 -10.391 1.923 1.499 401 HB3 GLU 48 3HB GLU 48 -11.870 2.792 1.086 402 HG2 GLU 48 2HG GLU 48 -12.892 0.698 0.277 403 HG3 GLU 48 3HG GLU 48 -11.414 -0.180 0.659 404 H GLU 49 H GLU 49 -8.302 2.622 0.038 405 HA GLU 49 HA GLU 49 -8.201 5.445 0.197 406 HB2 GLU 49 2HB GLU 49 -5.872 3.554 -0.384 407 HB3 GLU 49 3HB GLU 49 -5.741 5.201 0.219 408 HG2 GLU 49 2HG GLU 49 -6.812 2.782 1.662 409 HG3 GLU 49 3HG GLU 49 -5.387 3.732 2.054 410 H GLU 50 H GLU 50 -7.336 3.217 -2.337 411 HA GLU 50 HA GLU 50 -6.479 4.760 -4.433 412 HB2 GLU 50 2HB GLU 50 -6.480 2.332 -4.439 413 HB3 GLU 50 3HB GLU 50 -8.235 2.279 -4.330 414 HG2 GLU 50 2HG GLU 50 -8.351 3.287 -6.622 415 HG3 GLU 50 3HG GLU 50 -6.590 3.163 -6.717 416 H LYS 51 H LYS 51 -9.903 3.757 -3.873 417 HA LYS 51 HA LYS 51 -10.857 5.301 -6.069 418 HB2 LYS 51 2HB LYS 51 -13.080 4.453 -5.472 419 HB3 LYS 51 3HB LYS 51 -11.878 3.176 -5.510 420 HG2 LYS 51 2HG LYS 51 -11.774 3.250 -3.015 421 HG3 LYS 51 3HG LYS 51 -13.089 4.432 -3.031 422 HD2 LYS 51 2HD LYS 51 -14.563 2.780 -4.149 423 HD3 LYS 51 3HD LYS 51 -13.247 1.604 -4.163 424 HE2 LYS 51 2HE LYS 51 -13.261 1.548 -1.705 425 HE3 LYS 51 3HE LYS 51 -14.548 2.756 -1.671 426 HZ1 LYS 51 1HZ LYS 51 -14.754 0.054 -2.882 427 HZ2 LYS 51 2HZ LYS 51 -15.987 1.209 -2.820 428 HZ3 LYS 51 3HZ LYS 51 -15.406 0.516 -1.392 429 H LYS 52 H LYS 52 -10.575 6.012 -2.654 430 HA LYS 52 HA LYS 52 -12.368 8.313 -2.771 431 HB2 LYS 52 2HB LYS 52 -11.811 8.709 -0.461 432 HB3 LYS 52 3HB LYS 52 -12.041 6.979 -0.654 433 HG2 LYS 52 2HG LYS 52 -9.584 6.669 -0.700 434 HG3 LYS 52 3HG LYS 52 -9.370 8.404 -0.464 435 HD2 LYS 52 2HD LYS 52 -9.068 7.188 1.651 436 HD3 LYS 52 3HD LYS 52 -10.474 8.248 1.743 437 HE2 LYS 52 2HE LYS 52 -11.979 6.364 1.500 438 HE3 LYS 52 3HE LYS 52 -10.635 5.273 1.150 439 HZ1 LYS 52 1HZ LYS 52 -9.847 5.483 3.356 440 HZ2 LYS 52 2HZ LYS 52 -11.498 5.146 3.456 441 HZ3 LYS 52 3HZ LYS 52 -10.938 6.720 3.721 442 H ALA 53 H ALA 53 -8.992 7.656 -3.337 443 HA ALA 53 HA ALA 53 -8.260 10.510 -3.424 444 HB1 ALA 53 1HB ALA 53 -6.664 8.980 -2.327 445 HB2 ALA 53 2HB ALA 53 -5.950 9.691 -3.775 446 HB3 ALA 53 3HB ALA 53 -6.537 8.024 -3.806 447 H SER 54 H SER 54 -6.784 11.031 -5.318 448 HA SER 54 HA SER 54 -7.725 9.959 -7.907 449 HB2 SER 54 2HB SER 54 -7.688 12.364 -8.744 450 HB3 SER 54 3HB SER 54 -8.964 12.029 -7.575 451 HG SER 54 HG SER 54 -7.864 13.099 -6.027 452 H GLU 55 H GLU 55 -6.169 10.929 -9.664 453 HA GLU 55 HA GLU 55 -3.617 9.818 -9.184 454 HB2 GLU 55 2HB GLU 55 -4.493 11.632 -11.491 455 HB3 GLU 55 3HB GLU 55 -3.012 10.688 -11.456 456 HG2 GLU 55 2HG GLU 55 -4.361 9.351 -12.768 457 HG3 GLU 55 3HG GLU 55 -4.618 8.636 -11.184 458 HA PRO 56 HA PRO 56 -1.398 10.028 -9.957 459 HB2 PRO 56 2HB PRO 56 1.059 10.222 -8.904 460 HB3 PRO 56 3HB PRO 56 0.520 11.384 -10.138 461 HG2 PRO 56 2HG PRO 56 0.608 11.732 -7.152 462 HG3 PRO 56 3HG PRO 56 1.169 12.838 -8.427 463 HD2 PRO 56 2HD PRO 56 -1.299 13.056 -7.180 464 HD3 PRO 56 3HD PRO 56 -0.957 13.681 -8.810 465 H PHE 57 H PHE 57 -2.015 10.792 -6.634 466 HA PHE 57 HA PHE 57 -0.697 8.728 -5.289 467 HB2 PHE 57 2HB PHE 57 -1.742 10.803 -4.272 468 HB3 PHE 57 3HB PHE 57 -3.313 10.023 -4.423 469 HD1 PHE 57 HD1 PHE 57 0.037 8.710 -3.268 470 HD2 PHE 57 HD2 PHE 57 -4.039 9.529 -2.208 471 HE1 PHE 57 HE1 PHE 57 0.403 7.708 -1.053 472 HE2 PHE 57 HE2 PHE 57 -3.652 8.515 0.002 473 HZ PHE 57 HZ PHE 57 -1.437 7.606 0.581 474 H LYS 58 H LYS 58 -3.851 8.706 -6.911 475 HA LYS 58 HA LYS 58 -4.801 6.201 -6.019 476 HB2 LYS 58 2HB LYS 58 -6.151 7.928 -7.299 477 HB3 LYS 58 3HB LYS 58 -5.321 7.415 -8.762 478 HG2 LYS 58 2HG LYS 58 -6.217 5.069 -8.321 479 HG3 LYS 58 3HG LYS 58 -7.195 5.773 -7.035 480 HD2 LYS 58 2HD LYS 58 -8.638 5.637 -8.923 481 HD3 LYS 58 3HD LYS 58 -8.171 7.338 -8.822 482 HE2 LYS 58 2HE LYS 58 -6.416 6.898 -10.564 483 HE3 LYS 58 3HE LYS 58 -7.018 5.246 -10.703 484 HZ1 LYS 58 1HZ LYS 58 -9.196 6.200 -11.335 485 HZ2 LYS 58 2HZ LYS 58 -7.958 6.554 -12.431 486 HZ3 LYS 58 3HZ LYS 58 -8.487 7.741 -11.347 487 H THR 59 H THR 59 -2.528 7.088 -8.529 488 HA THR 59 HA THR 59 -2.379 4.560 -9.851 489 HB THR 59 HB THR 59 -0.286 6.785 -9.967 490 HG1 THR 59 HG1 THR 59 -1.560 7.779 -11.523 491 HG21 THR 59 1HG2 THR 59 0.332 4.661 -11.116 492 HG22 THR 59 2HG2 THR 59 0.103 5.976 -12.269 493 HG23 THR 59 3HG2 THR 59 -1.151 4.750 -12.074 494 H ASP 60 H ASP 60 -0.653 6.170 -7.236 495 HA ASP 60 HA ASP 60 1.630 4.411 -7.204 496 HB2 ASP 60 2HB ASP 60 0.677 6.447 -5.131 497 HB3 ASP 60 3HB ASP 60 2.265 5.669 -5.140 498 H ILE 61 H ILE 61 -1.185 4.893 -5.102 499 HA ILE 61 HA ILE 61 -0.930 2.823 -3.309 500 HB ILE 61 HB ILE 61 -3.488 3.902 -4.565 501 HG12 ILE 61 2HG1 ILE 61 -2.291 4.474 -1.816 502 HG13 ILE 61 3HG1 ILE 61 -2.061 5.509 -3.221 503 HG21 ILE 61 1HG2 ILE 61 -3.260 2.094 -2.121 504 HG22 ILE 61 2HG2 ILE 61 -3.975 1.654 -3.671 505 HG23 ILE 61 3HG2 ILE 61 -4.743 2.884 -2.668 506 HD11 ILE 61 1HD1 ILE 61 -4.713 4.879 -1.935 507 HD12 ILE 61 2HD1 ILE 61 -4.443 5.952 -3.312 508 HD13 ILE 61 3HD1 ILE 61 -3.776 6.357 -1.733 509 H ARG 62 H ARG 62 -2.704 2.641 -6.498 510 HA ARG 62 HA ARG 62 -3.317 -0.067 -6.241 511 HB2 ARG 62 2HB ARG 62 -4.027 -0.072 -8.560 512 HB3 ARG 62 3HB ARG 62 -4.573 1.372 -7.740 513 HG2 ARG 62 2HG ARG 62 -4.012 2.105 -9.884 514 HG3 ARG 62 3HG ARG 62 -2.628 2.588 -8.907 515 HD2 ARG 62 2HD ARG 62 -2.159 1.550 -11.224 516 HD3 ARG 62 3HD ARG 62 -1.238 0.914 -9.856 517 HE ARG 62 HE ARG 62 -3.678 -0.533 -10.442 518 HH11 ARG 62 1HH1 ARG 62 -0.238 -0.363 -11.175 519 HH12 ARG 62 2HH1 ARG 62 -0.153 -2.018 -11.681 520 HH21 ARG 62 1HH2 ARG 62 -3.509 -2.707 -11.049 521 HH22 ARG 62 2HH2 ARG 62 -1.995 -3.344 -11.607 522 H ILE 63 H ILE 63 -0.398 1.378 -7.673 523 HA ILE 63 HA ILE 63 0.743 -0.963 -8.741 524 HB ILE 63 HB ILE 63 2.029 1.567 -7.643 525 HG12 ILE 63 2HG1 ILE 63 1.660 0.571 -10.509 526 HG13 ILE 63 3HG1 ILE 63 0.661 1.784 -9.721 527 HG21 ILE 63 1HG2 ILE 63 4.165 0.894 -8.696 528 HG22 ILE 63 2HG2 ILE 63 3.476 -0.684 -9.079 529 HG23 ILE 63 3HG2 ILE 63 3.703 -0.207 -7.398 530 HD11 ILE 63 1HD1 ILE 63 3.594 2.060 -10.379 531 HD12 ILE 63 2HD1 ILE 63 2.599 3.274 -9.569 532 HD13 ILE 63 3HD1 ILE 63 2.243 2.808 -11.231 533 H LEU 64 H LEU 64 0.981 0.331 -5.372 534 HA LEU 64 HA LEU 64 2.542 -1.854 -4.359 535 HB2 LEU 64 2HB LEU 64 2.295 0.451 -3.318 536 HB3 LEU 64 3HB LEU 64 0.701 -0.020 -2.774 537 HG LEU 64 HG LEU 64 3.126 -1.646 -1.923 538 HD11 LEU 64 1HD1 LEU 64 3.734 0.651 -1.388 539 HD12 LEU 64 2HD1 LEU 64 3.417 -0.271 0.080 540 HD13 LEU 64 3HD1 LEU 64 2.215 0.878 -0.519 541 HD21 LEU 64 1HD2 LEU 64 0.917 -2.588 -1.372 542 HD22 LEU 64 2HD2 LEU 64 0.496 -1.118 -0.495 543 HD23 LEU 64 3HD2 LEU 64 1.804 -2.152 0.087 544 H LEU 65 H LEU 65 -0.896 -1.200 -4.679 545 HA LEU 65 HA LEU 65 -1.960 -3.457 -3.302 546 HB2 LEU 65 2HB LEU 65 -3.218 -1.361 -3.847 547 HB3 LEU 65 3HB LEU 65 -3.183 -1.801 -5.545 548 HG LEU 65 HG LEU 65 -4.551 -3.859 -4.971 549 HD11 LEU 65 1HD1 LEU 65 -4.809 -2.554 -2.250 550 HD12 LEU 65 2HD1 LEU 65 -3.992 -4.078 -2.610 551 HD13 LEU 65 3HD1 LEU 65 -5.734 -3.942 -2.830 552 HD21 LEU 65 1HD2 LEU 65 -6.675 -2.665 -4.791 553 HD22 LEU 65 2HD2 LEU 65 -5.593 -1.854 -5.919 554 HD23 LEU 65 3HD2 LEU 65 -5.831 -1.194 -4.298 555 H ASP 66 H ASP 66 -0.574 -3.025 -6.452 556 HA ASP 66 HA ASP 66 -1.663 -5.330 -7.751 557 HB2 ASP 66 2HB ASP 66 -0.815 -3.252 -8.909 558 HB3 ASP 66 3HB ASP 66 0.821 -3.681 -8.431 559 H PHE 67 H PHE 67 0.826 -4.806 -5.488 560 HA PHE 67 HA PHE 67 2.458 -7.128 -6.204 561 HB2 PHE 67 2HB PHE 67 3.623 -5.076 -5.457 562 HB3 PHE 67 3HB PHE 67 2.729 -5.080 -3.940 563 HD1 PHE 67 HD1 PHE 67 5.288 -6.962 -5.925 564 HD2 PHE 67 HD2 PHE 67 3.523 -6.375 -2.062 565 HE1 PHE 67 HE1 PHE 67 7.054 -8.332 -4.893 566 HE2 PHE 67 HE2 PHE 67 5.298 -7.740 -1.048 567 HZ PHE 67 HZ PHE 67 7.062 -8.721 -2.459 568 H LEU 68 H LEU 68 0.259 -5.952 -3.709 569 HA LEU 68 HA LEU 68 0.427 -8.162 -1.952 570 HB2 LEU 68 2HB LEU 68 -1.795 -6.120 -2.303 571 HB3 LEU 68 3HB LEU 68 -1.657 -7.235 -0.953 572 HG LEU 68 HG LEU 68 0.168 -4.888 -1.594 573 HD11 LEU 68 1HD1 LEU 68 -1.920 -4.293 -0.489 574 HD12 LEU 68 2HD1 LEU 68 -0.558 -4.062 0.602 575 HD13 LEU 68 3HD1 LEU 68 -1.612 -5.468 0.794 576 HD21 LEU 68 1HD2 LEU 68 1.618 -6.706 -0.859 577 HD22 LEU 68 2HD2 LEU 68 0.589 -7.013 0.544 578 HD23 LEU 68 3HD2 LEU 68 1.485 -5.497 0.417 579 H GLU 69 H GLU 69 -2.135 -7.291 -4.374 580 HA GLU 69 HA GLU 69 -3.677 -9.627 -4.131 581 HB2 GLU 69 2HB GLU 69 -3.283 -7.864 -6.563 582 HB3 GLU 69 3HB GLU 69 -4.579 -9.035 -6.359 583 HG2 GLU 69 2HG GLU 69 -5.509 -7.698 -4.519 584 HG3 GLU 69 3HG GLU 69 -4.189 -6.530 -4.696 585 H SER 70 H SER 70 -0.994 -8.809 -6.355 586 HA SER 70 HA SER 70 0.540 -10.041 -7.464 587 HB2 SER 70 2HB SER 70 0.716 -11.122 -5.181 588 HB3 SER 70 3HB SER 70 -0.362 -12.394 -5.748 589 HG SER 70 HG SER 70 1.736 -11.998 -7.446 590 H LYS 71 H LYS 71 -1.975 -9.780 -8.805 591 HA LYS 71 HA LYS 71 -2.633 -12.254 -10.192 592 HB2 LYS 71 2HB LYS 71 -3.312 -9.544 -11.404 593 HB3 LYS 71 3HB LYS 71 -4.198 -11.048 -11.506 594 HG2 LYS 71 2HG LYS 71 -5.618 -9.843 -10.152 595 HG3 LYS 71 3HG LYS 71 -4.622 -10.620 -8.915 596 HD2 LYS 71 2HD LYS 71 -4.914 -8.242 -8.403 597 HD3 LYS 71 3HD LYS 71 -3.222 -8.588 -8.763 598 HE2 LYS 71 2HE LYS 71 -3.687 -7.741 -11.127 599 HE3 LYS 71 3HE LYS 71 -5.251 -7.182 -10.528 600 HZ1 LYS 71 1HZ LYS 71 -4.032 -5.863 -8.856 601 HZ2 LYS 71 2HZ LYS 71 -3.695 -5.401 -10.447 602 HZ3 LYS 71 3HZ LYS 71 -2.573 -6.325 -9.588 603 HA PRO 72 HA PRO 72 0.339 -11.751 -13.727 604 HB2 PRO 72 2HB PRO 72 -1.243 -12.296 -15.943 605 HB3 PRO 72 3HB PRO 72 -0.576 -13.552 -14.884 606 HG2 PRO 72 2HG PRO 72 -3.328 -12.353 -14.866 607 HG3 PRO 72 3HG PRO 72 -2.850 -14.059 -14.714 608 HD2 PRO 72 2HD PRO 72 -3.524 -12.611 -12.544 609 HD3 PRO 72 3HD PRO 72 -2.234 -13.832 -12.468 Start of MODEL 18 1 H GLY 1 1H GLY 1 4.765 -6.209 16.637 2 HA2 GLY 1 2HA GLY 1 2.507 -5.958 15.814 3 HA3 GLY 1 3HA GLY 1 3.708 -5.457 14.625 4 H SER 2 H SER 2 2.101 -5.805 12.992 5 HA SER 2 HA SER 2 1.145 -8.503 12.414 6 HB2 SER 2 2HB SER 2 0.759 -5.898 10.866 7 HB3 SER 2 3HB SER 2 -0.150 -7.399 10.639 8 HG SER 2 HG SER 2 -0.926 -5.514 12.103 9 H VAL 3 H VAL 3 2.024 -9.829 10.859 10 HA VAL 3 HA VAL 3 4.483 -9.453 9.581 11 HB VAL 3 HB VAL 3 3.396 -11.673 9.875 12 HG11 VAL 3 1HG1 VAL 3 1.653 -12.477 8.319 13 HG12 VAL 3 2HG1 VAL 3 1.547 -10.869 7.597 14 HG13 VAL 3 3HG1 VAL 3 1.078 -11.112 9.280 15 HG21 VAL 3 1HG2 VAL 3 4.103 -12.691 7.745 16 HG22 VAL 3 2HG2 VAL 3 5.259 -11.465 8.273 17 HG23 VAL 3 3HG2 VAL 3 4.116 -11.102 6.976 18 H VAL 4 H VAL 4 1.284 -8.517 8.615 19 HA VAL 4 HA VAL 4 1.372 -7.691 6.015 20 HB VAL 4 HB VAL 4 0.249 -5.993 8.301 21 HG11 VAL 4 1HG1 VAL 4 0.231 -4.798 6.157 22 HG12 VAL 4 2HG1 VAL 4 -1.415 -5.206 6.639 23 HG13 VAL 4 3HG1 VAL 4 -0.606 -6.146 5.382 24 HG21 VAL 4 1HG2 VAL 4 -0.535 -8.305 8.528 25 HG22 VAL 4 2HG2 VAL 4 -1.086 -8.306 6.850 26 HG23 VAL 4 3HG2 VAL 4 -1.862 -7.248 8.033 27 H LYS 5 H LYS 5 2.817 -6.073 8.818 28 HA LYS 5 HA LYS 5 3.361 -3.576 7.689 29 HB2 LYS 5 2HB LYS 5 3.349 -4.116 10.147 30 HB3 LYS 5 3HB LYS 5 4.918 -4.895 9.946 31 HG2 LYS 5 2HG LYS 5 5.962 -2.798 9.338 32 HG3 LYS 5 3HG LYS 5 4.392 -1.988 9.252 33 HD2 LYS 5 2HD LYS 5 4.095 -2.376 11.710 34 HD3 LYS 5 3HD LYS 5 5.718 -3.076 11.772 35 HE2 LYS 5 2HE LYS 5 6.669 -0.929 11.028 36 HE3 LYS 5 3HE LYS 5 5.052 -0.234 10.923 37 HZ1 LYS 5 1HZ LYS 5 4.813 -0.504 13.291 38 HZ2 LYS 5 2HZ LYS 5 6.201 0.397 12.953 39 HZ3 LYS 5 3HZ LYS 5 6.336 -1.229 13.405 40 H GLU 6 H GLU 6 5.443 -6.507 7.831 41 HA GLU 6 HA GLU 6 7.688 -5.189 6.625 42 HB2 GLU 6 2HB GLU 6 8.838 -7.279 6.685 43 HB3 GLU 6 3HB GLU 6 7.890 -7.214 8.164 44 HG2 GLU 6 2HG GLU 6 6.261 -8.778 7.249 45 HG3 GLU 6 3HG GLU 6 7.057 -8.756 5.678 46 H LYS 7 H LYS 7 5.003 -7.241 5.527 47 HA LYS 7 HA LYS 7 5.812 -7.765 2.884 48 HB2 LYS 7 2HB LYS 7 2.997 -7.441 4.013 49 HB3 LYS 7 3HB LYS 7 3.353 -8.091 2.412 50 HG2 LYS 7 2HG LYS 7 4.642 -9.933 3.479 51 HG3 LYS 7 3HG LYS 7 4.186 -9.307 5.068 52 HD2 LYS 7 2HD LYS 7 1.808 -9.726 4.569 53 HD3 LYS 7 3HD LYS 7 2.228 -10.258 2.936 54 HE2 LYS 7 2HE LYS 7 2.984 -11.635 5.537 55 HE3 LYS 7 3HE LYS 7 1.813 -12.203 4.348 56 HZ1 LYS 7 1HZ LYS 7 3.633 -12.405 2.741 57 HZ2 LYS 7 2HZ LYS 7 3.895 -13.366 4.105 58 HZ3 LYS 7 3HZ LYS 7 4.743 -11.917 3.922 59 H LEU 8 H LEU 8 4.033 -5.053 4.249 60 HA LEU 8 HA LEU 8 3.489 -3.569 1.916 61 HB2 LEU 8 2HB LEU 8 3.852 -2.746 4.811 62 HB3 LEU 8 3HB LEU 8 3.318 -1.635 3.562 63 HG LEU 8 HG LEU 8 1.781 -4.147 4.326 64 HD11 LEU 8 1HD1 LEU 8 1.295 -1.307 5.272 65 HD12 LEU 8 2HD1 LEU 8 1.905 -2.641 6.256 66 HD13 LEU 8 3HD1 LEU 8 0.273 -2.713 5.599 67 HD21 LEU 8 1HD2 LEU 8 -0.085 -3.107 3.136 68 HD22 LEU 8 2HD2 LEU 8 1.296 -3.302 2.061 69 HD23 LEU 8 3HD2 LEU 8 0.920 -1.710 2.728 70 H GLU 9 H GLU 9 6.189 -3.509 4.253 71 HA GLU 9 HA GLU 9 7.664 -1.387 3.117 72 HB2 GLU 9 2HB GLU 9 8.453 -3.684 4.931 73 HB3 GLU 9 3HB GLU 9 9.606 -2.443 4.445 74 HG2 GLU 9 2HG GLU 9 7.011 -1.899 5.933 75 HG3 GLU 9 3HG GLU 9 8.591 -2.060 6.696 76 H LYS 10 H LYS 10 7.775 -4.917 2.451 77 HA LYS 10 HA LYS 10 10.075 -4.923 0.789 78 HB2 LYS 10 2HB LYS 10 7.697 -6.822 0.529 79 HB3 LYS 10 3HB LYS 10 9.344 -7.110 -0.026 80 HG2 LYS 10 2HG LYS 10 8.450 -6.907 2.857 81 HG3 LYS 10 3HG LYS 10 8.785 -8.399 1.991 82 HD2 LYS 10 2HD LYS 10 11.152 -7.824 1.824 83 HD3 LYS 10 3HD LYS 10 10.856 -6.226 2.517 84 HE2 LYS 10 2HE LYS 10 11.819 -7.825 4.173 85 HE3 LYS 10 3HE LYS 10 10.239 -7.219 4.661 86 HZ1 LYS 10 1HZ LYS 10 9.247 -9.281 3.916 87 HZ2 LYS 10 2HZ LYS 10 10.464 -9.593 5.044 88 HZ3 LYS 10 3HZ LYS 10 10.749 -9.859 3.397 89 H ALA 11 H ALA 11 6.618 -4.622 0.196 90 HA ALA 11 HA ALA 11 6.554 -4.494 -2.594 91 HB1 ALA 11 1HB ALA 11 4.321 -3.470 -2.295 92 HB2 ALA 11 2HB ALA 11 4.668 -3.222 -0.580 93 HB3 ALA 11 3HB ALA 11 4.548 -4.860 -1.227 94 H LEU 12 H LEU 12 6.582 -1.868 -0.177 95 HA LEU 12 HA LEU 12 6.688 0.408 -1.661 96 HB2 LEU 12 2HB LEU 12 7.969 -0.355 0.957 97 HB3 LEU 12 3HB LEU 12 8.293 1.235 0.286 98 HG LEU 12 HG LEU 12 5.471 0.244 0.838 99 HD11 LEU 12 1HD1 LEU 12 5.568 1.660 2.880 100 HD12 LEU 12 2HD1 LEU 12 7.313 1.805 2.648 101 HD13 LEU 12 3HD1 LEU 12 6.588 0.226 2.949 102 HD21 LEU 12 1HD2 LEU 12 6.582 3.033 0.361 103 HD22 LEU 12 2HD2 LEU 12 4.901 2.641 0.736 104 HD23 LEU 12 3HD2 LEU 12 5.615 2.090 -0.778 105 H ILE 13 H ILE 13 9.521 -1.645 -0.852 106 HA ILE 13 HA ILE 13 11.507 -0.019 -2.048 107 HB ILE 13 HB ILE 13 11.523 -3.030 -1.533 108 HG12 ILE 13 2HG1 ILE 13 12.605 -0.770 0.217 109 HG13 ILE 13 3HG1 ILE 13 11.100 -1.632 0.509 110 HG21 ILE 13 1HG2 ILE 13 13.294 -2.425 -3.125 111 HG22 ILE 13 2HG2 ILE 13 14.001 -2.865 -1.572 112 HG23 ILE 13 3HG2 ILE 13 13.879 -1.166 -2.033 113 HD11 ILE 13 1HD1 ILE 13 12.863 -2.429 1.956 114 HD12 ILE 13 2HD1 ILE 13 13.866 -2.837 0.564 115 HD13 ILE 13 3HD1 ILE 13 12.354 -3.705 0.851 116 H GLU 14 H GLU 14 9.743 -2.906 -3.222 117 HA GLU 14 HA GLU 14 11.059 -3.115 -5.716 118 HB2 GLU 14 2HB GLU 14 8.300 -4.162 -4.956 119 HB3 GLU 14 3HB GLU 14 9.279 -4.715 -6.315 120 HG2 GLU 14 2HG GLU 14 9.840 -5.096 -3.360 121 HG3 GLU 14 3HG GLU 14 9.436 -6.336 -4.539 122 H VAL 15 H VAL 15 8.263 -1.260 -4.680 123 HA VAL 15 HA VAL 15 7.619 -0.465 -7.446 124 HB VAL 15 HB VAL 15 5.478 0.292 -6.652 125 HG11 VAL 15 1HG1 VAL 15 5.644 -2.141 -6.977 126 HG12 VAL 15 2HG1 VAL 15 4.494 -1.770 -5.692 127 HG13 VAL 15 3HG1 VAL 15 6.110 -2.358 -5.287 128 HG21 VAL 15 1HG2 VAL 15 6.453 -0.159 -3.799 129 HG22 VAL 15 2HG2 VAL 15 4.799 0.265 -4.249 130 HG23 VAL 15 3HG2 VAL 15 6.117 1.399 -4.553 131 H ARG 16 H ARG 16 9.495 0.592 -4.892 132 HA ARG 16 HA ARG 16 9.145 3.336 -4.688 133 HB2 ARG 16 2HB ARG 16 10.752 2.126 -3.295 134 HB3 ARG 16 3HB ARG 16 11.781 1.827 -4.691 135 HG2 ARG 16 2HG ARG 16 12.236 4.261 -4.883 136 HG3 ARG 16 3HG ARG 16 11.200 4.558 -3.482 137 HD2 ARG 16 2HD ARG 16 12.722 3.172 -2.093 138 HD3 ARG 16 3HD ARG 16 13.772 2.939 -3.496 139 HE ARG 16 HE ARG 16 13.605 5.637 -3.292 140 HH11 ARG 16 1HH1 ARG 16 14.459 3.160 -0.964 141 HH12 ARG 16 2HH1 ARG 16 15.534 4.183 -0.079 142 HH21 ARG 16 1HH2 ARG 16 15.043 6.964 -2.143 143 HH22 ARG 16 2HH2 ARG 16 15.866 6.348 -0.748 144 HA PRO 17 HA PRO 17 11.912 4.099 -8.751 145 HB2 PRO 17 2HB PRO 17 11.371 1.593 -10.317 146 HB3 PRO 17 3HB PRO 17 12.887 2.501 -10.132 147 HG2 PRO 17 2HG PRO 17 12.559 0.147 -8.917 148 HG3 PRO 17 3HG PRO 17 13.422 1.480 -8.115 149 HD2 PRO 17 2HD PRO 17 10.593 0.542 -7.685 150 HD3 PRO 17 3HD PRO 17 11.822 1.008 -6.489 151 H TYR 18 H TYR 18 8.813 2.574 -8.508 152 HA TYR 18 HA TYR 18 7.790 3.648 -11.055 153 HB2 TYR 18 2HB TYR 18 6.576 1.714 -9.022 154 HB3 TYR 18 3HB TYR 18 5.762 2.235 -10.494 155 HD1 TYR 18 HD1 TYR 18 8.735 0.334 -9.229 156 HD2 TYR 18 HD2 TYR 18 6.206 1.155 -12.583 157 HE1 TYR 18 HE1 TYR 18 9.783 -1.504 -10.474 158 HE2 TYR 18 HE2 TYR 18 7.258 -0.678 -13.827 159 HH TYR 18 HH TYR 18 9.349 -1.941 -13.835 160 H VAL 19 H VAL 19 7.356 4.037 -7.537 161 HA VAL 19 HA VAL 19 4.818 5.462 -7.955 162 HB VAL 19 HB VAL 19 4.446 5.309 -5.527 163 HG11 VAL 19 1HG1 VAL 19 4.169 2.869 -5.342 164 HG12 VAL 19 2HG1 VAL 19 5.243 2.630 -6.724 165 HG13 VAL 19 3HG1 VAL 19 3.695 3.452 -6.939 166 HG21 VAL 19 1HG2 VAL 19 5.964 4.047 -4.030 167 HG22 VAL 19 2HG2 VAL 19 6.757 5.480 -4.684 168 HG23 VAL 19 3HG2 VAL 19 7.137 3.887 -5.342 169 H GLU 20 H GLU 20 4.503 7.571 -7.594 170 HA GLU 20 HA GLU 20 6.594 9.280 -6.458 171 HB2 GLU 20 2HB GLU 20 3.809 9.911 -7.534 172 HB3 GLU 20 3HB GLU 20 4.868 11.122 -6.807 173 HG2 GLU 20 2HG GLU 20 6.558 10.664 -8.576 174 HG3 GLU 20 3HG GLU 20 5.435 9.528 -9.327 175 H TYR 21 H TYR 21 6.057 10.683 -4.667 176 HA TYR 21 HA TYR 21 5.431 11.190 -2.573 177 HB2 TYR 21 2HB TYR 21 2.823 9.727 -3.205 178 HB3 TYR 21 3HB TYR 21 3.059 10.902 -1.918 179 HD1 TYR 21 HD1 TYR 21 3.864 13.314 -2.712 180 HD2 TYR 21 HD2 TYR 21 1.920 10.480 -5.267 181 HE1 TYR 21 HE1 TYR 21 3.233 15.122 -4.250 182 HE2 TYR 21 HE2 TYR 21 1.289 12.288 -6.801 183 HH TYR 21 HH TYR 21 0.943 14.772 -6.684 184 H TYR 22 H TYR 22 7.159 9.253 -2.712 185 HA TYR 22 HA TYR 22 6.547 6.675 -1.830 186 HB2 TYR 22 2HB TYR 22 8.729 7.360 -2.874 187 HB3 TYR 22 3HB TYR 22 9.168 8.165 -1.370 188 HD1 TYR 22 HD1 TYR 22 7.743 4.782 -2.252 189 HD2 TYR 22 HD2 TYR 22 10.812 6.923 -0.169 190 HE1 TYR 22 HE1 TYR 22 8.668 2.665 -1.437 191 HE2 TYR 22 HE2 TYR 22 11.738 4.792 0.644 192 HH TYR 22 HH TYR 22 10.965 2.460 1.038 193 H ASN 23 H ASN 23 7.385 9.587 0.048 194 HA ASN 23 HA ASN 23 7.506 8.285 2.608 195 HB2 ASN 23 2HB ASN 23 7.133 11.243 1.955 196 HB3 ASN 23 3HB ASN 23 7.475 10.596 3.560 197 HD21 ASN 23 1HD2 ASN 23 8.790 11.307 0.409 198 HD22 ASN 23 2HD2 ASN 23 10.446 11.072 0.835 199 H GLU 24 H GLU 24 4.930 9.618 0.678 200 HA GLU 24 HA GLU 24 3.027 9.986 2.812 201 HB2 GLU 24 2HB GLU 24 2.622 9.944 -0.209 202 HB3 GLU 24 3HB GLU 24 1.431 10.479 0.978 203 HG2 GLU 24 2HG GLU 24 4.109 11.785 0.397 204 HG3 GLU 24 3HG GLU 24 2.528 12.391 -0.089 205 H LEU 25 H LEU 25 3.482 7.669 0.137 206 HA LEU 25 HA LEU 25 1.421 5.875 0.777 207 HB2 LEU 25 2HB LEU 25 2.634 6.014 -1.419 208 HB3 LEU 25 3HB LEU 25 4.050 5.316 -0.651 209 HG LEU 25 HG LEU 25 2.808 3.197 -0.251 210 HD11 LEU 25 1HD1 LEU 25 0.501 4.502 -1.727 211 HD12 LEU 25 2HD1 LEU 25 0.537 4.053 -0.019 212 HD13 LEU 25 3HD1 LEU 25 0.600 2.801 -1.257 213 HD21 LEU 25 1HD2 LEU 25 2.705 4.090 -3.150 214 HD22 LEU 25 2HD2 LEU 25 2.705 2.421 -2.572 215 HD23 LEU 25 3HD2 LEU 25 4.118 3.440 -2.310 216 H LYS 26 H LYS 26 4.865 6.002 1.704 217 HA LYS 26 HA LYS 26 4.997 3.790 3.407 218 HB2 LYS 26 2HB LYS 26 6.454 6.442 3.482 219 HB3 LYS 26 3HB LYS 26 6.710 5.252 4.752 220 HG2 LYS 26 2HG LYS 26 7.313 3.605 2.940 221 HG3 LYS 26 3HG LYS 26 7.306 4.952 1.809 222 HD2 LYS 26 2HD LYS 26 9.589 4.473 2.541 223 HD3 LYS 26 3HD LYS 26 9.087 6.058 3.141 224 HE2 LYS 26 2HE LYS 26 10.312 4.736 4.855 225 HE3 LYS 26 3HE LYS 26 8.668 5.116 5.366 226 HZ1 LYS 26 1HZ LYS 26 7.981 2.885 4.824 227 HZ2 LYS 26 2HZ LYS 26 9.328 2.811 5.839 228 HZ3 LYS 26 3HZ LYS 26 9.505 2.513 4.188 229 H ALA 27 H ALA 27 3.616 7.023 4.074 230 HA ALA 27 HA ALA 27 3.333 6.612 6.880 231 HB1 ALA 27 1HB ALA 27 1.935 8.620 5.073 232 HB2 ALA 27 2HB ALA 27 3.464 8.880 5.918 233 HB3 ALA 27 3HB ALA 27 1.969 8.673 6.836 234 H LEU 28 H LEU 28 1.280 6.183 4.038 235 HA LEU 28 HA LEU 28 -1.147 5.482 5.301 236 HB2 LEU 28 2HB LEU 28 -0.960 6.181 2.931 237 HB3 LEU 28 3HB LEU 28 -0.028 4.740 2.566 238 HG LEU 28 HG LEU 28 -1.999 3.314 3.002 239 HD11 LEU 28 1HD1 LEU 28 -3.090 4.642 4.736 240 HD12 LEU 28 2HD1 LEU 28 -4.209 4.263 3.432 241 HD13 LEU 28 3HD1 LEU 28 -3.512 5.882 3.549 242 HD21 LEU 28 1HD2 LEU 28 -1.657 4.145 0.720 243 HD22 LEU 28 2HD2 LEU 28 -2.629 5.577 1.076 244 HD23 LEU 28 3HD2 LEU 28 -3.373 3.974 1.081 245 H VAL 29 H VAL 29 1.630 3.636 4.160 246 HA VAL 29 HA VAL 29 0.830 1.007 4.769 247 HB VAL 29 HB VAL 29 3.421 2.426 4.190 248 HG11 VAL 29 1HG1 VAL 29 3.410 -0.392 5.303 249 HG12 VAL 29 2HG1 VAL 29 4.203 1.021 6.006 250 HG13 VAL 29 3HG1 VAL 29 4.782 0.354 4.477 251 HG21 VAL 29 1HG2 VAL 29 2.103 -0.015 2.957 252 HG22 VAL 29 2HG2 VAL 29 3.561 0.775 2.349 253 HG23 VAL 29 3HG2 VAL 29 2.022 1.638 2.338 254 H SER 30 H SER 30 2.547 3.460 6.609 255 HA SER 30 HA SER 30 3.215 1.874 8.866 256 HB2 SER 30 2HB SER 30 4.375 3.992 8.236 257 HB3 SER 30 3HB SER 30 2.933 4.904 8.685 258 HG SER 30 HG SER 30 4.913 4.157 10.235 259 H LYS 31 H LYS 31 0.374 3.697 7.985 260 HA LYS 31 HA LYS 31 -0.870 3.710 10.574 261 HB2 LYS 31 2HB LYS 31 -1.228 5.503 8.920 262 HB3 LYS 31 3HB LYS 31 -1.955 4.348 7.805 263 HG2 LYS 31 2HG LYS 31 -3.836 4.005 9.316 264 HG3 LYS 31 3HG LYS 31 -3.087 5.043 10.538 265 HD2 LYS 31 2HD LYS 31 -3.253 6.975 8.995 266 HD3 LYS 31 3HD LYS 31 -3.991 5.940 7.769 267 HE2 LYS 31 2HE LYS 31 -5.701 7.256 8.945 268 HE3 LYS 31 3HE LYS 31 -5.905 5.534 9.265 269 HZ1 LYS 31 1HZ LYS 31 -6.159 6.878 11.258 270 HZ2 LYS 31 2HZ LYS 31 -4.583 7.463 11.092 271 HZ3 LYS 31 3HZ LYS 31 -4.847 5.821 11.403 272 H ILE 32 H ILE 32 -1.501 1.991 7.478 273 HA ILE 32 HA ILE 32 -3.743 0.532 8.447 274 HB ILE 32 HB ILE 32 -3.660 -0.770 6.339 275 HG12 ILE 32 2HG1 ILE 32 -1.057 0.728 5.767 276 HG13 ILE 32 3HG1 ILE 32 -1.177 -0.982 6.147 277 HG21 ILE 32 1HG2 ILE 32 -3.221 2.208 5.884 278 HG22 ILE 32 2HG2 ILE 32 -4.750 1.438 6.319 279 HG23 ILE 32 3HG2 ILE 32 -4.006 1.094 4.759 280 HD11 ILE 32 1HD1 ILE 32 -0.823 -0.596 3.789 281 HD12 ILE 32 2HD1 ILE 32 -2.307 0.350 3.695 282 HD13 ILE 32 3HD1 ILE 32 -2.379 -1.374 4.075 283 H SER 33 H SER 33 -0.294 -0.304 8.132 284 HA SER 33 HA SER 33 -0.323 -3.016 8.705 285 HB2 SER 33 2HB SER 33 2.005 -2.678 9.509 286 HB3 SER 33 3HB SER 33 1.691 -1.818 8.004 287 HG SER 33 HG SER 33 2.250 -0.076 8.998 288 H SER 34 H SER 34 -0.660 -0.294 10.880 289 HA SER 34 HA SER 34 -0.449 -1.907 13.306 290 HB2 SER 34 2HB SER 34 0.614 0.373 13.139 291 HB3 SER 34 3HB SER 34 -0.994 1.081 12.986 292 HG SER 34 HG SER 34 -1.421 -0.005 15.067 293 H SER 35 H SER 35 -2.847 -0.830 11.116 294 HA SER 35 HA SER 35 -5.069 -0.729 13.012 295 HB2 SER 35 2HB SER 35 -4.949 0.961 11.205 296 HB3 SER 35 3HB SER 35 -4.993 -0.315 9.990 297 HG SER 35 HG SER 35 -7.065 -0.642 11.651 298 H VAL 36 H VAL 36 -3.797 -2.780 10.443 299 HA VAL 36 HA VAL 36 -5.920 -4.786 10.913 300 HB VAL 36 HB VAL 36 -5.793 -5.547 8.626 301 HG11 VAL 36 1HG1 VAL 36 -7.269 -3.621 8.970 302 HG12 VAL 36 2HG1 VAL 36 -6.579 -3.584 7.347 303 HG13 VAL 36 3HG1 VAL 36 -5.946 -2.510 8.599 304 HG21 VAL 36 1HG2 VAL 36 -4.314 -4.575 6.903 305 HG22 VAL 36 2HG2 VAL 36 -3.383 -5.309 8.208 306 HG23 VAL 36 3HG2 VAL 36 -3.552 -3.556 8.124 307 H ASN 37 H ASN 37 -5.285 -6.920 10.912 308 HA ASN 37 HA ASN 37 -2.448 -7.460 11.581 309 HB2 ASN 37 2HB ASN 37 -4.989 -8.895 12.489 310 HB3 ASN 37 3HB ASN 37 -3.349 -9.361 12.937 311 HD21 ASN 37 1HD2 ASN 37 -5.649 -8.477 14.586 312 HD22 ASN 37 2HD2 ASN 37 -5.052 -7.157 15.530 313 H ASP 38 H ASP 38 -4.480 -7.763 9.065 314 HA ASP 38 HA ASP 38 -3.393 -10.341 8.098 315 HB2 ASP 38 2HB ASP 38 -6.340 -9.522 8.015 316 HB3 ASP 38 3HB ASP 38 -5.669 -10.907 7.156 317 H LEU 39 H LEU 39 -2.924 -10.364 5.956 318 HA LEU 39 HA LEU 39 -2.386 -7.884 4.685 319 HB2 LEU 39 2HB LEU 39 -1.055 -10.091 4.574 320 HB3 LEU 39 3HB LEU 39 -2.242 -10.656 3.423 321 HG LEU 39 HG LEU 39 -0.030 -9.826 2.461 322 HD11 LEU 39 1HD1 LEU 39 -0.938 -8.790 0.507 323 HD12 LEU 39 2HD1 LEU 39 -2.442 -8.415 1.352 324 HD13 LEU 39 3HD1 LEU 39 -1.997 -10.093 1.039 325 HD21 LEU 39 1HD2 LEU 39 0.358 -7.435 2.214 326 HD22 LEU 39 2HD2 LEU 39 0.280 -7.869 3.919 327 HD23 LEU 39 3HD2 LEU 39 -1.096 -7.072 3.150 328 H GLU 40 H GLU 40 -4.881 -10.378 4.251 329 HA GLU 40 HA GLU 40 -6.150 -9.404 1.937 330 HB2 GLU 40 2HB GLU 40 -6.636 -11.622 2.934 331 HB3 GLU 40 3HB GLU 40 -7.390 -10.842 4.323 332 HG2 GLU 40 2HG GLU 40 -9.129 -9.882 2.826 333 HG3 GLU 40 3HG GLU 40 -8.383 -10.697 1.450 334 H GLU 41 H GLU 41 -6.433 -8.474 5.344 335 HA GLU 41 HA GLU 41 -8.673 -6.708 4.967 336 HB2 GLU 41 2HB GLU 41 -6.723 -6.920 7.294 337 HB3 GLU 41 3HB GLU 41 -8.218 -5.983 7.300 338 HG2 GLU 41 2HG GLU 41 -7.999 -9.002 7.036 339 HG3 GLU 41 3HG GLU 41 -8.464 -8.122 8.490 340 H ALA 42 H ALA 42 -5.184 -6.428 4.808 341 HA ALA 42 HA ALA 42 -4.986 -3.578 4.777 342 HB1 ALA 42 1HB ALA 42 -3.028 -5.007 5.195 343 HB2 ALA 42 2HB ALA 42 -2.740 -3.938 3.821 344 HB3 ALA 42 3HB ALA 42 -3.124 -5.642 3.549 345 H ILE 43 H ILE 43 -5.249 -6.046 2.238 346 HA ILE 43 HA ILE 43 -5.060 -4.471 -0.060 347 HB ILE 43 HB ILE 43 -6.592 -7.052 0.443 348 HG12 ILE 43 2HG1 ILE 43 -3.941 -6.645 -1.017 349 HG13 ILE 43 3HG1 ILE 43 -4.065 -7.086 0.682 350 HG21 ILE 43 1HG2 ILE 43 -6.701 -7.399 -2.011 351 HG22 ILE 43 2HG2 ILE 43 -6.048 -5.781 -2.264 352 HG23 ILE 43 3HG2 ILE 43 -7.628 -5.987 -1.506 353 HD11 ILE 43 1HD1 ILE 43 -5.005 -8.733 -1.668 354 HD12 ILE 43 2HD1 ILE 43 -5.221 -9.167 0.031 355 HD13 ILE 43 3HD1 ILE 43 -3.598 -9.031 -0.645 356 H VAL 44 H VAL 44 -8.227 -5.775 1.138 357 HA VAL 44 HA VAL 44 -9.973 -4.190 -0.180 358 HB VAL 44 HB VAL 44 -10.691 -6.086 1.163 359 HG11 VAL 44 1HG1 VAL 44 -10.909 -6.026 3.609 360 HG12 VAL 44 2HG1 VAL 44 -10.179 -4.419 3.649 361 HG13 VAL 44 3HG1 VAL 44 -9.225 -5.807 3.123 362 HG21 VAL 44 1HG2 VAL 44 -12.774 -5.209 2.139 363 HG22 VAL 44 2HG2 VAL 44 -12.419 -4.426 0.596 364 HG23 VAL 44 3HG2 VAL 44 -12.111 -3.573 2.111 365 H VAL 45 H VAL 45 -8.481 -3.239 2.995 366 HA VAL 45 HA VAL 45 -9.756 -0.721 3.255 367 HB VAL 45 HB VAL 45 -7.036 -1.652 4.277 368 HG11 VAL 45 1HG1 VAL 45 -7.054 0.316 5.821 369 HG12 VAL 45 2HG1 VAL 45 -8.469 0.951 4.976 370 HG13 VAL 45 3HG1 VAL 45 -6.926 0.804 4.132 371 HG21 VAL 45 1HG2 VAL 45 -8.981 -2.817 5.239 372 HG22 VAL 45 2HG2 VAL 45 -9.706 -1.275 5.690 373 HG23 VAL 45 3HG2 VAL 45 -8.207 -1.801 6.459 374 H LEU 46 H LEU 46 -6.708 -1.587 1.586 375 HA LEU 46 HA LEU 46 -5.970 1.030 0.771 376 HB2 LEU 46 2HB LEU 46 -5.197 -1.719 -0.231 377 HB3 LEU 46 3HB LEU 46 -4.594 -0.271 -1.024 378 HG LEU 46 HG LEU 46 -4.101 -0.994 1.890 379 HD11 LEU 46 1HD1 LEU 46 -2.922 -2.511 0.362 380 HD12 LEU 46 2HD1 LEU 46 -1.799 -1.461 1.222 381 HD13 LEU 46 3HD1 LEU 46 -2.196 -1.129 -0.467 382 HD21 LEU 46 1HD2 LEU 46 -4.146 1.434 1.559 383 HD22 LEU 46 2HD2 LEU 46 -2.999 1.298 0.222 384 HD23 LEU 46 3HD2 LEU 46 -2.501 0.885 1.864 385 H ARG 47 H ARG 47 -8.157 -1.345 -0.603 386 HA ARG 47 HA ARG 47 -8.499 -0.080 -3.132 387 HB2 ARG 47 2HB ARG 47 -10.161 -2.155 -1.654 388 HB3 ARG 47 3HB ARG 47 -10.571 -1.579 -3.274 389 HG2 ARG 47 2HG ARG 47 -8.259 -2.289 -4.015 390 HG3 ARG 47 3HG ARG 47 -8.038 -3.036 -2.434 391 HD2 ARG 47 2HD ARG 47 -9.704 -4.687 -2.882 392 HD3 ARG 47 3HD ARG 47 -10.335 -3.794 -4.272 393 HE ARG 47 HE ARG 47 -8.098 -5.607 -4.241 394 HH11 ARG 47 1HH1 ARG 47 -9.416 -2.803 -5.917 395 HH12 ARG 47 2HH1 ARG 47 -8.541 -3.112 -7.378 396 HH21 ARG 47 1HH2 ARG 47 -6.943 -5.962 -6.167 397 HH22 ARG 47 2HH2 ARG 47 -7.149 -4.893 -7.519 398 H GLU 48 H GLU 48 -9.736 0.622 -0.002 399 HA GLU 48 HA GLU 48 -11.814 2.466 -0.948 400 HB2 GLU 48 2HB GLU 48 -10.733 1.905 1.854 401 HB3 GLU 48 3HB GLU 48 -12.038 3.038 1.503 402 HG2 GLU 48 2HG GLU 48 -12.079 0.035 1.061 403 HG3 GLU 48 3HG GLU 48 -12.925 0.919 2.334 404 H GLU 49 H GLU 49 -8.588 2.501 0.505 405 HA GLU 49 HA GLU 49 -8.263 5.246 1.000 406 HB2 GLU 49 2HB GLU 49 -6.140 3.173 0.290 407 HB3 GLU 49 3HB GLU 49 -5.790 4.774 0.942 408 HG2 GLU 49 2HG GLU 49 -7.221 2.496 2.338 409 HG3 GLU 49 3HG GLU 49 -5.625 3.143 2.709 410 H GLU 50 H GLU 50 -7.256 3.297 -1.730 411 HA GLU 50 HA GLU 50 -6.331 5.048 -3.595 412 HB2 GLU 50 2HB GLU 50 -6.383 2.652 -3.896 413 HB3 GLU 50 3HB GLU 50 -8.143 2.634 -3.907 414 HG2 GLU 50 2HG GLU 50 -8.129 3.873 -6.051 415 HG3 GLU 50 3HG GLU 50 -6.361 3.863 -6.037 416 H LYS 51 H LYS 51 -9.798 4.108 -3.284 417 HA LYS 51 HA LYS 51 -10.794 5.852 -5.229 418 HB2 LYS 51 2HB LYS 51 -12.255 4.612 -2.858 419 HB3 LYS 51 3HB LYS 51 -13.037 5.374 -4.245 420 HG2 LYS 51 2HG LYS 51 -11.929 3.679 -5.726 421 HG3 LYS 51 3HG LYS 51 -11.324 2.871 -4.284 422 HD2 LYS 51 2HD LYS 51 -14.263 3.269 -4.960 423 HD3 LYS 51 3HD LYS 51 -13.349 1.796 -5.267 424 HE2 LYS 51 2HE LYS 51 -14.546 1.339 -3.298 425 HE3 LYS 51 3HE LYS 51 -12.931 1.733 -2.725 426 HZ1 LYS 51 1HZ LYS 51 -14.696 2.744 -1.406 427 HZ2 LYS 51 2HZ LYS 51 -15.233 3.611 -2.754 428 HZ3 LYS 51 3HZ LYS 51 -13.700 3.916 -2.105 429 H LYS 52 H LYS 52 -10.135 6.429 -1.802 430 HA LYS 52 HA LYS 52 -11.536 8.976 -1.670 431 HB2 LYS 52 2HB LYS 52 -9.437 7.786 0.197 432 HB3 LYS 52 3HB LYS 52 -10.419 9.210 0.542 433 HG2 LYS 52 2HG LYS 52 -12.444 7.846 0.572 434 HG3 LYS 52 3HG LYS 52 -11.516 6.409 0.122 435 HD2 LYS 52 2HD LYS 52 -10.219 6.627 2.252 436 HD3 LYS 52 3HD LYS 52 -11.229 8.007 2.699 437 HE2 LYS 52 2HE LYS 52 -12.186 5.153 2.272 438 HE3 LYS 52 3HE LYS 52 -11.989 5.963 3.829 439 HZ1 LYS 52 1HZ LYS 52 -13.920 6.674 1.685 440 HZ2 LYS 52 2HZ LYS 52 -13.675 7.591 3.083 441 HZ3 LYS 52 3HZ LYS 52 -14.279 6.016 3.201 442 H ALA 53 H ALA 53 -8.300 7.816 -2.352 443 HA ALA 53 HA ALA 53 -6.994 10.390 -2.385 444 HB1 ALA 53 1HB ALA 53 -6.050 7.676 -3.401 445 HB2 ALA 53 2HB ALA 53 -5.743 8.339 -1.795 446 HB3 ALA 53 3HB ALA 53 -5.040 9.114 -3.217 447 H SER 54 H SER 54 -5.786 10.988 -4.419 448 HA SER 54 HA SER 54 -7.456 10.678 -6.852 449 HB2 SER 54 2HB SER 54 -7.641 12.952 -5.852 450 HB3 SER 54 3HB SER 54 -5.889 13.134 -5.921 451 HG SER 54 HG SER 54 -5.990 13.472 -8.021 452 H GLU 55 H GLU 55 -6.316 10.662 -8.857 453 HA GLU 55 HA GLU 55 -3.791 9.364 -8.921 454 HB2 GLU 55 2HB GLU 55 -5.334 10.765 -11.159 455 HB3 GLU 55 3HB GLU 55 -3.931 9.722 -11.409 456 HG2 GLU 55 2HG GLU 55 -5.219 7.847 -10.329 457 HG3 GLU 55 3HG GLU 55 -6.629 8.902 -10.276 458 HA PRO 56 HA PRO 56 -1.831 9.396 -10.523 459 HB2 PRO 56 2HB PRO 56 0.817 9.525 -10.088 460 HB3 PRO 56 3HB PRO 56 0.040 10.630 -11.245 461 HG2 PRO 56 2HG PRO 56 0.869 11.169 -8.399 462 HG3 PRO 56 3HG PRO 56 1.124 12.163 -9.853 463 HD2 PRO 56 2HD PRO 56 -0.958 12.562 -8.056 464 HD3 PRO 56 3HD PRO 56 -0.998 13.084 -9.755 465 H PHE 57 H PHE 57 -1.918 10.252 -7.234 466 HA PHE 57 HA PHE 57 -0.395 8.164 -6.078 467 HB2 PHE 57 2HB PHE 57 -1.041 10.371 -5.005 468 HB3 PHE 57 3HB PHE 57 -2.651 9.709 -4.755 469 HD1 PHE 57 HD1 PHE 57 0.941 8.766 -4.096 470 HD2 PHE 57 HD2 PHE 57 -3.079 8.817 -2.609 471 HE1 PHE 57 HE1 PHE 57 1.716 7.862 -1.941 472 HE2 PHE 57 HE2 PHE 57 -2.289 7.906 -0.469 473 HZ PHE 57 HZ PHE 57 0.100 7.429 -0.129 474 H LYS 58 H LYS 58 -3.797 8.256 -7.160 475 HA LYS 58 HA LYS 58 -4.659 5.802 -6.043 476 HB2 LYS 58 2HB LYS 58 -5.388 7.032 -8.713 477 HB3 LYS 58 3HB LYS 58 -6.142 5.562 -8.097 478 HG2 LYS 58 2HG LYS 58 -6.845 6.901 -6.070 479 HG3 LYS 58 3HG LYS 58 -6.297 8.339 -6.921 480 HD2 LYS 58 2HD LYS 58 -8.681 8.143 -7.276 481 HD3 LYS 58 3HD LYS 58 -7.881 7.759 -8.803 482 HE2 LYS 58 2HE LYS 58 -8.104 5.304 -8.186 483 HE3 LYS 58 3HE LYS 58 -9.084 5.807 -6.807 484 HZ1 LYS 58 1HZ LYS 58 -10.452 5.167 -8.657 485 HZ2 LYS 58 2HZ LYS 58 -9.696 6.289 -9.668 486 HZ3 LYS 58 3HZ LYS 58 -10.633 6.819 -8.367 487 H THR 59 H THR 59 -2.410 6.377 -8.637 488 HA THR 59 HA THR 59 -2.419 3.634 -9.583 489 HB THR 59 HB THR 59 -0.463 5.866 -10.293 490 HG1 THR 59 HG1 THR 59 -2.972 5.160 -11.421 491 HG21 THR 59 1HG2 THR 59 -1.210 3.321 -11.790 492 HG22 THR 59 2HG2 THR 59 0.324 3.607 -10.961 493 HG23 THR 59 3HG2 THR 59 -0.110 4.570 -12.376 494 H ASP 60 H ASP 60 -0.270 5.872 -7.901 495 HA ASP 60 HA ASP 60 1.885 4.216 -7.290 496 HB2 ASP 60 2HB ASP 60 0.762 6.478 -5.557 497 HB3 ASP 60 3HB ASP 60 2.401 5.828 -5.477 498 H ILE 61 H ILE 61 -1.218 4.525 -5.616 499 HA ILE 61 HA ILE 61 -0.677 2.708 -3.502 500 HB ILE 61 HB ILE 61 -3.313 3.661 -4.687 501 HG12 ILE 61 2HG1 ILE 61 -1.969 4.249 -2.001 502 HG13 ILE 61 3HG1 ILE 61 -1.977 5.328 -3.392 503 HG21 ILE 61 1HG2 ILE 61 -3.737 1.398 -3.807 504 HG22 ILE 61 2HG2 ILE 61 -4.500 2.602 -2.771 505 HG23 ILE 61 3HG2 ILE 61 -2.993 1.833 -2.265 506 HD11 ILE 61 1HD1 ILE 61 -4.411 5.554 -3.201 507 HD12 ILE 61 2HD1 ILE 61 -3.578 6.037 -1.725 508 HD13 ILE 61 3HD1 ILE 61 -4.400 4.479 -1.797 509 H ARG 62 H ARG 62 -2.465 2.186 -6.678 510 HA ARG 62 HA ARG 62 -2.902 -0.542 -6.097 511 HB2 ARG 62 2HB ARG 62 -3.630 -0.849 -8.461 512 HB3 ARG 62 3HB ARG 62 -4.436 0.429 -7.585 513 HG2 ARG 62 2HG ARG 62 -4.148 1.211 -9.788 514 HG3 ARG 62 3HG ARG 62 -2.976 2.084 -8.804 515 HD2 ARG 62 2HD ARG 62 -2.103 1.333 -11.037 516 HD3 ARG 62 3HD ARG 62 -1.160 0.748 -9.660 517 HE ARG 62 HE ARG 62 -3.198 -1.091 -10.539 518 HH11 ARG 62 1HH1 ARG 62 0.126 -0.093 -11.135 519 HH12 ARG 62 2HH1 ARG 62 0.575 -1.615 -11.823 520 HH21 ARG 62 1HH2 ARG 62 -2.572 -3.088 -11.386 521 HH22 ARG 62 2HH2 ARG 62 -0.953 -3.313 -11.966 522 H ILE 63 H ILE 63 -0.089 0.911 -7.568 523 HA ILE 63 HA ILE 63 1.014 -1.387 -8.793 524 HB ILE 63 HB ILE 63 2.577 0.895 -7.474 525 HG12 ILE 63 2HG1 ILE 63 1.731 0.659 -10.404 526 HG13 ILE 63 3HG1 ILE 63 0.928 1.677 -9.222 527 HG21 ILE 63 1HG2 ILE 63 3.439 -1.043 -9.659 528 HG22 ILE 63 2HG2 ILE 63 3.963 -1.094 -7.978 529 HG23 ILE 63 3HG2 ILE 63 4.411 0.275 -8.993 530 HD11 ILE 63 1HD1 ILE 63 3.788 1.968 -10.125 531 HD12 ILE 63 2HD1 ILE 63 2.976 2.979 -8.926 532 HD13 ILE 63 3HD1 ILE 63 2.423 2.977 -10.601 533 H LEU 64 H LEU 64 1.254 -0.106 -5.503 534 HA LEU 64 HA LEU 64 2.836 -2.224 -4.401 535 HB2 LEU 64 2HB LEU 64 2.884 0.033 -3.483 536 HB3 LEU 64 3HB LEU 64 1.166 -0.011 -3.156 537 HG LEU 64 HG LEU 64 2.837 -2.076 -1.743 538 HD11 LEU 64 1HD1 LEU 64 4.250 -0.094 -1.516 539 HD12 LEU 64 2HD1 LEU 64 3.542 -0.559 0.028 540 HD13 LEU 64 3HD1 LEU 64 2.885 0.819 -0.864 541 HD21 LEU 64 1HD2 LEU 64 0.548 -0.321 -0.773 542 HD22 LEU 64 2HD2 LEU 64 1.301 -1.640 0.132 543 HD23 LEU 64 3HD2 LEU 64 0.405 -1.987 -1.344 544 H LEU 65 H LEU 65 -0.584 -1.382 -4.364 545 HA LEU 65 HA LEU 65 -1.664 -3.220 -2.622 546 HB2 LEU 65 2HB LEU 65 -2.653 -1.135 -3.834 547 HB3 LEU 65 3HB LEU 65 -3.046 -2.228 -5.141 548 HG LEU 65 HG LEU 65 -4.186 -2.412 -2.317 549 HD11 LEU 65 1HD1 LEU 65 -4.923 -0.365 -3.449 550 HD12 LEU 65 2HD1 LEU 65 -6.259 -1.500 -3.286 551 HD13 LEU 65 3HD1 LEU 65 -5.457 -1.306 -4.848 552 HD21 LEU 65 1HD2 LEU 65 -4.226 -4.598 -3.446 553 HD22 LEU 65 2HD2 LEU 65 -5.051 -3.881 -4.832 554 HD23 LEU 65 3HD2 LEU 65 -5.853 -3.946 -3.259 555 H ASP 66 H ASP 66 -2.050 -3.522 -6.188 556 HA ASP 66 HA ASP 66 -2.565 -6.109 -6.597 557 HB2 ASP 66 2HB ASP 66 -2.477 -4.551 -8.432 558 HB3 ASP 66 3HB ASP 66 -0.763 -4.253 -8.182 559 H PHE 67 H PHE 67 0.781 -4.826 -6.285 560 HA PHE 67 HA PHE 67 2.261 -7.139 -6.653 561 HB2 PHE 67 2HB PHE 67 3.241 -4.845 -6.354 562 HB3 PHE 67 3HB PHE 67 2.892 -4.930 -4.632 563 HD1 PHE 67 HD1 PHE 67 4.964 -6.376 -7.360 564 HD2 PHE 67 HD2 PHE 67 4.366 -6.155 -3.126 565 HE1 PHE 67 HE1 PHE 67 7.129 -7.474 -6.985 566 HE2 PHE 67 HE2 PHE 67 6.532 -7.253 -2.766 567 HZ PHE 67 HZ PHE 67 7.916 -7.914 -4.692 568 H LEU 68 H LEU 68 0.759 -5.992 -3.607 569 HA LEU 68 HA LEU 68 1.594 -8.074 -1.880 570 HB2 LEU 68 2HB LEU 68 -0.946 -6.409 -1.786 571 HB3 LEU 68 3HB LEU 68 -0.345 -7.398 -0.463 572 HG LEU 68 HG LEU 68 1.069 -4.959 -1.602 573 HD11 LEU 68 1HD1 LEU 68 -1.017 -4.393 -0.436 574 HD12 LEU 68 2HD1 LEU 68 0.402 -3.827 0.439 575 HD13 LEU 68 3HD1 LEU 68 -0.457 -5.266 0.996 576 HD21 LEU 68 1HD2 LEU 68 2.671 -6.583 -0.694 577 HD22 LEU 68 2HD2 LEU 68 1.759 -6.676 0.816 578 HD23 LEU 68 3HD2 LEU 68 2.564 -5.172 0.355 579 H GLU 69 H GLU 69 -1.339 -7.681 -3.860 580 HA GLU 69 HA GLU 69 -2.732 -10.009 -3.102 581 HB2 GLU 69 2HB GLU 69 -2.839 -8.538 -5.766 582 HB3 GLU 69 3HB GLU 69 -4.059 -9.655 -5.157 583 HG2 GLU 69 2HG GLU 69 -4.522 -8.079 -3.294 584 HG3 GLU 69 3HG GLU 69 -3.350 -6.952 -3.972 585 H SER 70 H SER 70 -0.141 -9.461 -5.353 586 HA SER 70 HA SER 70 1.132 -10.717 -6.711 587 HB2 SER 70 2HB SER 70 0.212 -13.018 -4.943 588 HB3 SER 70 3HB SER 70 1.629 -13.035 -5.998 589 HG SER 70 HG SER 70 1.319 -11.048 -4.006 590 H LYS 71 H LYS 71 -1.644 -10.234 -7.492 591 HA LYS 71 HA LYS 71 -2.563 -12.677 -8.830 592 HB2 LYS 71 2HB LYS 71 -3.919 -9.999 -8.295 593 HB3 LYS 71 3HB LYS 71 -4.661 -11.290 -9.238 594 HG2 LYS 71 2HG LYS 71 -4.647 -12.773 -7.287 595 HG3 LYS 71 3HG LYS 71 -3.808 -11.549 -6.334 596 HD2 LYS 71 2HD LYS 71 -6.219 -11.635 -5.796 597 HD3 LYS 71 3HD LYS 71 -5.758 -10.064 -6.455 598 HE2 LYS 71 2HE LYS 71 -7.922 -10.864 -7.358 599 HE3 LYS 71 3HE LYS 71 -6.722 -10.675 -8.635 600 HZ1 LYS 71 1HZ LYS 71 -6.368 -13.047 -8.626 601 HZ2 LYS 71 2HZ LYS 71 -8.012 -12.722 -8.840 602 HZ3 LYS 71 3HZ LYS 71 -7.444 -13.247 -7.340 603 HA PRO 72 HA PRO 72 -1.199 -11.082 -12.884 604 HB2 PRO 72 2HB PRO 72 -2.832 -12.720 -14.446 605 HB3 PRO 72 3HB PRO 72 -1.276 -13.234 -13.759 606 HG2 PRO 72 2HG PRO 72 -4.050 -13.739 -12.727 607 HG3 PRO 72 3HG PRO 72 -2.661 -14.847 -12.808 608 HD2 PRO 72 2HD PRO 72 -3.360 -13.641 -10.493 609 HD3 PRO 72 3HD PRO 72 -1.656 -13.950 -10.894 Start of MODEL 19 1 H GLY 1 1H GLY 1 7.630 -1.770 14.589 2 HA2 GLY 1 2HA GLY 1 5.337 -1.870 13.830 3 HA3 GLY 1 3HA GLY 1 6.462 -2.529 12.649 4 H SER 2 H SER 2 3.828 -3.191 12.455 5 HA SER 2 HA SER 2 3.262 -5.769 13.677 6 HB2 SER 2 2HB SER 2 1.803 -4.179 11.512 7 HB3 SER 2 3HB SER 2 1.188 -5.644 12.284 8 HG SER 2 HG SER 2 1.393 -4.497 14.302 9 H VAL 3 H VAL 3 2.710 -7.701 12.284 10 HA VAL 3 HA VAL 3 4.925 -8.400 10.613 11 HB VAL 3 HB VAL 3 3.837 -10.015 12.146 12 HG11 VAL 3 1HG1 VAL 3 1.648 -11.028 11.659 13 HG12 VAL 3 2HG1 VAL 3 1.424 -9.916 10.306 14 HG13 VAL 3 3HG1 VAL 3 1.502 -9.292 11.955 15 HG21 VAL 3 1HG2 VAL 3 5.104 -10.908 10.226 16 HG22 VAL 3 2HG2 VAL 3 3.630 -10.936 9.255 17 HG23 VAL 3 3HG2 VAL 3 3.773 -11.980 10.671 18 H VAL 4 H VAL 4 1.737 -7.226 10.076 19 HA VAL 4 HA VAL 4 1.389 -7.726 7.300 20 HB VAL 4 HB VAL 4 0.367 -5.353 8.943 21 HG11 VAL 4 1HG1 VAL 4 -1.445 -5.224 7.249 22 HG12 VAL 4 2HG1 VAL 4 -0.652 -6.495 6.321 23 HG13 VAL 4 3HG1 VAL 4 0.149 -4.942 6.546 24 HG21 VAL 4 1HG2 VAL 4 -0.288 -7.491 9.980 25 HG22 VAL 4 2HG2 VAL 4 -0.988 -8.029 8.454 26 HG23 VAL 4 3HG2 VAL 4 -1.693 -6.656 9.312 27 H LYS 5 H LYS 5 2.904 -5.149 9.184 28 HA LYS 5 HA LYS 5 3.225 -3.233 7.173 29 HB2 LYS 5 2HB LYS 5 3.438 -2.731 9.600 30 HB3 LYS 5 3HB LYS 5 4.991 -3.560 9.628 31 HG2 LYS 5 2HG LYS 5 6.000 -1.904 8.198 32 HG3 LYS 5 3HG LYS 5 4.433 -1.175 7.832 33 HD2 LYS 5 2HD LYS 5 4.222 -0.384 10.147 34 HD3 LYS 5 3HD LYS 5 5.732 -1.188 10.586 35 HE2 LYS 5 2HE LYS 5 6.997 0.288 9.122 36 HE3 LYS 5 3HE LYS 5 5.511 1.032 8.526 37 HZ1 LYS 5 1HZ LYS 5 6.656 2.377 10.204 38 HZ2 LYS 5 2HZ LYS 5 6.443 1.150 11.345 39 HZ3 LYS 5 3HZ LYS 5 5.099 1.941 10.698 40 H GLU 6 H GLU 6 5.705 -5.620 8.330 41 HA GLU 6 HA GLU 6 7.790 -4.889 6.658 42 HB2 GLU 6 2HB GLU 6 8.799 -7.028 7.171 43 HB3 GLU 6 3HB GLU 6 7.964 -6.450 8.606 44 HG2 GLU 6 2HG GLU 6 6.081 -8.001 8.125 45 HG3 GLU 6 3HG GLU 6 6.943 -8.588 6.701 46 H LYS 7 H LYS 7 5.072 -7.011 5.976 47 HA LYS 7 HA LYS 7 5.863 -7.963 3.419 48 HB2 LYS 7 2HB LYS 7 3.077 -7.562 4.573 49 HB3 LYS 7 3HB LYS 7 3.442 -8.490 3.121 50 HG2 LYS 7 2HG LYS 7 4.747 -10.088 4.438 51 HG3 LYS 7 3HG LYS 7 4.443 -9.153 5.908 52 HD2 LYS 7 2HD LYS 7 2.134 -9.709 5.928 53 HD3 LYS 7 3HD LYS 7 2.145 -10.213 4.236 54 HE2 LYS 7 2HE LYS 7 3.444 -11.680 6.548 55 HE3 LYS 7 3HE LYS 7 1.970 -12.144 5.692 56 HZ1 LYS 7 1HZ LYS 7 3.322 -12.337 3.650 57 HZ2 LYS 7 2HZ LYS 7 3.778 -13.428 4.852 58 HZ3 LYS 7 3HZ LYS 7 4.718 -12.053 4.564 59 H LEU 8 H LEU 8 3.894 -5.211 4.459 60 HA LEU 8 HA LEU 8 3.346 -4.086 1.904 61 HB2 LEU 8 2HB LEU 8 3.482 -2.789 4.649 62 HB3 LEU 8 3HB LEU 8 2.815 -2.019 3.224 63 HG LEU 8 HG LEU 8 1.642 -4.553 4.433 64 HD11 LEU 8 1HD1 LEU 8 1.552 -2.745 6.091 65 HD12 LEU 8 2HD1 LEU 8 -0.056 -3.140 5.489 66 HD13 LEU 8 3HD1 LEU 8 0.768 -1.685 4.914 67 HD21 LEU 8 1HD2 LEU 8 1.042 -4.180 2.077 68 HD22 LEU 8 2HD2 LEU 8 0.468 -2.555 2.463 69 HD23 LEU 8 3HD2 LEU 8 -0.356 -3.969 3.128 70 H GLU 9 H GLU 9 6.099 -3.965 4.074 71 HA GLU 9 HA GLU 9 7.385 -1.645 2.933 72 HB2 GLU 9 2HB GLU 9 8.361 -3.728 4.934 73 HB3 GLU 9 3HB GLU 9 9.367 -2.395 4.370 74 HG2 GLU 9 2HG GLU 9 7.717 -0.775 5.270 75 HG3 GLU 9 3HG GLU 9 6.745 -2.118 5.869 76 H LYS 10 H LYS 10 7.580 -5.157 2.537 77 HA LYS 10 HA LYS 10 9.755 -5.300 0.753 78 HB2 LYS 10 2HB LYS 10 7.274 -7.006 1.184 79 HB3 LYS 10 3HB LYS 10 8.380 -7.380 -0.132 80 HG2 LYS 10 2HG LYS 10 9.264 -7.205 2.766 81 HG3 LYS 10 3HG LYS 10 8.717 -8.702 2.003 82 HD2 LYS 10 2HD LYS 10 10.532 -8.533 0.333 83 HD3 LYS 10 3HD LYS 10 11.080 -7.019 1.058 84 HE2 LYS 10 2HE LYS 10 11.004 -9.673 2.539 85 HE3 LYS 10 3HE LYS 10 12.429 -9.044 1.708 86 HZ1 LYS 10 1HZ LYS 10 12.446 -7.166 3.169 87 HZ2 LYS 10 2HZ LYS 10 12.411 -8.578 4.093 88 HZ3 LYS 10 3HZ LYS 10 11.011 -7.654 3.908 89 H ALA 11 H ALA 11 6.274 -4.835 0.285 90 HA ALA 11 HA ALA 11 6.171 -4.680 -2.513 91 HB1 ALA 11 1HB ALA 11 4.192 -5.020 -1.086 92 HB2 ALA 11 2HB ALA 11 3.963 -3.661 -2.186 93 HB3 ALA 11 3HB ALA 11 4.330 -3.369 -0.482 94 H LEU 12 H LEU 12 6.400 -2.074 -0.050 95 HA LEU 12 HA LEU 12 6.492 0.208 -1.548 96 HB2 LEU 12 2HB LEU 12 8.020 -0.544 0.963 97 HB3 LEU 12 3HB LEU 12 8.194 1.055 0.259 98 HG LEU 12 HG LEU 12 5.512 -0.076 1.167 99 HD11 LEU 12 1HD1 LEU 12 7.038 0.107 3.090 100 HD12 LEU 12 2HD1 LEU 12 5.743 1.296 3.177 101 HD13 LEU 12 3HD1 LEU 12 7.364 1.792 2.681 102 HD21 LEU 12 1HD2 LEU 12 5.343 1.722 -0.516 103 HD22 LEU 12 2HD2 LEU 12 6.354 2.768 0.482 104 HD23 LEU 12 3HD2 LEU 12 4.762 2.267 1.057 105 H ILE 13 H ILE 13 9.340 -1.828 -0.740 106 HA ILE 13 HA ILE 13 11.252 -0.302 -2.147 107 HB ILE 13 HB ILE 13 11.416 -3.259 -1.377 108 HG12 ILE 13 2HG1 ILE 13 12.303 -0.796 0.209 109 HG13 ILE 13 3HG1 ILE 13 10.898 -1.781 0.577 110 HG21 ILE 13 1HG2 ILE 13 13.875 -2.947 -1.441 111 HG22 ILE 13 2HG2 ILE 13 13.657 -1.277 -1.967 112 HG23 ILE 13 3HG2 ILE 13 13.155 -2.602 -3.018 113 HD11 ILE 13 1HD1 ILE 13 12.701 -2.307 2.068 114 HD12 ILE 13 2HD1 ILE 13 13.776 -2.659 0.716 115 HD13 ILE 13 3HD1 ILE 13 12.378 -3.693 1.028 116 H GLU 14 H GLU 14 9.379 -3.215 -3.076 117 HA GLU 14 HA GLU 14 10.612 -3.758 -5.533 118 HB2 GLU 14 2HB GLU 14 7.755 -4.293 -4.630 119 HB3 GLU 14 3HB GLU 14 8.453 -4.954 -6.106 120 HG2 GLU 14 2HG GLU 14 9.409 -5.501 -3.283 121 HG3 GLU 14 3HG GLU 14 8.477 -6.599 -4.293 122 H VAL 15 H VAL 15 7.801 -1.672 -4.813 123 HA VAL 15 HA VAL 15 7.552 -0.935 -7.648 124 HB VAL 15 HB VAL 15 5.440 0.145 -7.051 125 HG11 VAL 15 1HG1 VAL 15 4.137 -1.838 -6.349 126 HG12 VAL 15 2HG1 VAL 15 5.623 -2.637 -5.826 127 HG13 VAL 15 3HG1 VAL 15 5.374 -2.264 -7.533 128 HG21 VAL 15 1HG2 VAL 15 4.508 0.073 -4.744 129 HG22 VAL 15 2HG2 VAL 15 5.986 1.030 -4.828 130 HG23 VAL 15 3HG2 VAL 15 6.034 -0.597 -4.158 131 H ARG 16 H ARG 16 9.374 0.045 -5.086 132 HA ARG 16 HA ARG 16 9.193 2.747 -4.686 133 HB2 ARG 16 2HB ARG 16 10.785 1.408 -3.446 134 HB3 ARG 16 3HB ARG 16 11.718 1.073 -4.898 135 HG2 ARG 16 2HG ARG 16 12.394 3.449 -5.022 136 HG3 ARG 16 3HG ARG 16 11.456 3.793 -3.569 137 HD2 ARG 16 2HD ARG 16 12.911 2.365 -2.234 138 HD3 ARG 16 3HD ARG 16 13.786 1.843 -3.680 139 HE ARG 16 HE ARG 16 13.935 4.632 -3.544 140 HH11 ARG 16 1HH1 ARG 16 15.161 1.877 -1.715 141 HH12 ARG 16 2HH1 ARG 16 16.565 2.731 -1.163 142 HH21 ARG 16 1HH2 ARG 16 15.772 5.709 -2.840 143 HH22 ARG 16 2HH2 ARG 16 16.913 4.912 -1.803 144 HA PRO 17 HA PRO 17 12.005 3.958 -8.506 145 HB2 PRO 17 2HB PRO 17 12.192 2.241 -10.642 146 HB3 PRO 17 3HB PRO 17 13.309 2.165 -9.262 147 HG2 PRO 17 2HG PRO 17 10.834 0.515 -9.752 148 HG3 PRO 17 3HG PRO 17 12.469 -0.029 -9.300 149 HD2 PRO 17 2HD PRO 17 10.556 0.227 -7.441 150 HD3 PRO 17 3HD PRO 17 12.236 0.675 -7.078 151 H TYR 18 H TYR 18 8.992 2.222 -8.806 152 HA TYR 18 HA TYR 18 8.095 3.672 -11.186 153 HB2 TYR 18 2HB TYR 18 6.590 1.657 -9.443 154 HB3 TYR 18 3HB TYR 18 6.059 2.273 -11.008 155 HD1 TYR 18 HD1 TYR 18 7.660 1.816 -13.043 156 HD2 TYR 18 HD2 TYR 18 7.839 -0.373 -9.373 157 HE1 TYR 18 HE1 TYR 18 8.853 -0.001 -14.184 158 HE2 TYR 18 HE2 TYR 18 9.035 -2.186 -10.520 159 HH TYR 18 HH TYR 18 10.367 -1.863 -13.628 160 H VAL 19 H VAL 19 7.528 3.670 -7.654 161 HA VAL 19 HA VAL 19 5.144 5.374 -8.030 162 HB VAL 19 HB VAL 19 4.503 4.889 -5.720 163 HG11 VAL 19 1HG1 VAL 19 3.968 2.496 -5.975 164 HG12 VAL 19 2HG1 VAL 19 5.163 2.362 -7.270 165 HG13 VAL 19 3HG1 VAL 19 3.737 3.381 -7.485 166 HG21 VAL 19 1HG2 VAL 19 5.706 3.236 -4.313 167 HG22 VAL 19 2HG2 VAL 19 6.695 4.661 -4.636 168 HG23 VAL 19 3HG2 VAL 19 7.002 3.162 -5.512 169 H GLU 20 H GLU 20 5.090 7.410 -7.551 170 HA GLU 20 HA GLU 20 7.075 8.700 -5.799 171 HB2 GLU 20 2HB GLU 20 6.070 10.835 -6.493 172 HB3 GLU 20 3HB GLU 20 6.575 9.896 -7.892 173 HG2 GLU 20 2HG GLU 20 4.257 9.254 -8.348 174 HG3 GLU 20 3HG GLU 20 3.714 10.084 -6.892 175 H TYR 21 H TYR 21 6.038 10.350 -4.225 176 HA TYR 21 HA TYR 21 5.033 10.636 -2.211 177 HB2 TYR 21 2HB TYR 21 2.851 8.799 -3.307 178 HB3 TYR 21 3HB TYR 21 2.751 9.618 -1.757 179 HD1 TYR 21 HD1 TYR 21 2.882 12.215 -1.786 180 HD2 TYR 21 HD2 TYR 21 1.992 9.879 -5.254 181 HE1 TYR 21 HE1 TYR 21 1.841 14.168 -2.834 182 HE2 TYR 21 HE2 TYR 21 0.948 11.836 -6.301 183 HH TYR 21 HH TYR 21 1.270 15.001 -5.006 184 H TYR 22 H TYR 22 7.085 8.781 -2.549 185 HA TYR 22 HA TYR 22 6.618 6.202 -1.555 186 HB2 TYR 22 2HB TYR 22 8.726 7.002 -2.748 187 HB3 TYR 22 3HB TYR 22 9.240 7.725 -1.225 188 HD1 TYR 22 HD1 TYR 22 8.242 4.454 -2.765 189 HD2 TYR 22 HD2 TYR 22 10.402 6.348 0.401 190 HE1 TYR 22 HE1 TYR 22 9.155 2.287 -2.083 191 HE2 TYR 22 HE2 TYR 22 11.305 4.166 1.092 192 HH TYR 22 HH TYR 22 10.650 1.715 0.836 193 H ASN 23 H ASN 23 7.333 9.233 0.155 194 HA ASN 23 HA ASN 23 7.608 8.074 2.769 195 HB2 ASN 23 2HB ASN 23 7.029 10.971 1.998 196 HB3 ASN 23 3HB ASN 23 7.481 10.418 3.610 197 HD21 ASN 23 1HD2 ASN 23 9.332 11.697 3.669 198 HD22 ASN 23 2HD2 ASN 23 10.725 11.392 2.693 199 H GLU 24 H GLU 24 4.915 9.292 0.873 200 HA GLU 24 HA GLU 24 3.105 9.676 3.082 201 HB2 GLU 24 2HB GLU 24 2.597 9.640 0.072 202 HB3 GLU 24 3HB GLU 24 1.429 10.145 1.291 203 HG2 GLU 24 2HG GLU 24 4.066 11.495 0.656 204 HG3 GLU 24 3HG GLU 24 2.458 12.088 0.237 205 H LEU 25 H LEU 25 3.300 7.410 0.347 206 HA LEU 25 HA LEU 25 1.268 5.645 1.103 207 HB2 LEU 25 2HB LEU 25 2.193 5.847 -1.192 208 HB3 LEU 25 3HB LEU 25 3.728 5.198 -0.642 209 HG LEU 25 HG LEU 25 2.668 2.994 -0.216 210 HD11 LEU 25 1HD1 LEU 25 0.365 2.510 -0.921 211 HD12 LEU 25 2HD1 LEU 25 0.098 4.219 -1.269 212 HD13 LEU 25 3HD1 LEU 25 0.405 3.690 0.388 213 HD21 LEU 25 1HD2 LEU 25 2.251 2.342 -2.557 214 HD22 LEU 25 2HD2 LEU 25 3.654 3.399 -2.424 215 HD23 LEU 25 3HD2 LEU 25 2.119 4.045 -3.015 216 H LYS 26 H LYS 26 4.794 5.660 1.753 217 HA LYS 26 HA LYS 26 4.979 3.317 3.291 218 HB2 LYS 26 2HB LYS 26 6.952 4.696 2.601 219 HB3 LYS 26 3HB LYS 26 6.512 5.897 3.811 220 HG2 LYS 26 2HG LYS 26 6.826 4.153 5.591 221 HG3 LYS 26 3HG LYS 26 7.357 3.026 4.344 222 HD2 LYS 26 2HD LYS 26 9.324 3.930 5.416 223 HD3 LYS 26 3HD LYS 26 9.237 4.615 3.791 224 HE2 LYS 26 2HE LYS 26 8.297 6.695 4.709 225 HE3 LYS 26 3HE LYS 26 8.339 6.012 6.339 226 HZ1 LYS 26 1HZ LYS 26 10.779 5.808 6.065 227 HZ2 LYS 26 2HZ LYS 26 10.228 7.402 6.043 228 HZ3 LYS 26 3HZ LYS 26 10.659 6.639 4.598 229 H ALA 27 H ALA 27 3.849 6.571 4.265 230 HA ALA 27 HA ALA 27 3.656 5.935 7.072 231 HB1 ALA 27 1HB ALA 27 2.522 8.281 5.513 232 HB2 ALA 27 2HB ALA 27 4.089 8.233 6.319 233 HB3 ALA 27 3HB ALA 27 2.610 8.151 7.276 234 H LEU 28 H LEU 28 1.573 5.782 4.263 235 HA LEU 28 HA LEU 28 -0.897 5.303 5.582 236 HB2 LEU 28 2HB LEU 28 -0.714 6.086 3.235 237 HB3 LEU 28 3HB LEU 28 0.062 4.576 2.783 238 HG LEU 28 HG LEU 28 -2.050 3.347 3.315 239 HD11 LEU 28 1HD1 LEU 28 -2.994 4.820 5.016 240 HD12 LEU 28 2HD1 LEU 28 -4.142 4.572 3.705 241 HD13 LEU 28 3HD1 LEU 28 -3.249 6.090 3.814 242 HD21 LEU 28 1HD2 LEU 28 -3.335 4.112 1.370 243 HD22 LEU 28 2HD2 LEU 28 -1.612 4.063 1.013 244 HD23 LEU 28 3HD2 LEU 28 -2.403 5.611 1.322 245 H VAL 29 H VAL 29 1.694 3.298 4.280 246 HA VAL 29 HA VAL 29 0.788 0.701 4.844 247 HB VAL 29 HB VAL 29 3.454 2.032 4.344 248 HG11 VAL 29 1HG1 VAL 29 4.721 -0.096 4.545 249 HG12 VAL 29 2HG1 VAL 29 3.313 -0.833 5.310 250 HG13 VAL 29 3HG1 VAL 29 4.142 0.509 6.103 251 HG21 VAL 29 1HG2 VAL 29 2.057 1.403 2.434 252 HG22 VAL 29 2HG2 VAL 29 2.049 -0.278 2.971 253 HG23 VAL 29 3HG2 VAL 29 3.556 0.464 2.431 254 H SER 30 H SER 30 2.463 3.098 6.758 255 HA SER 30 HA SER 30 3.001 1.445 9.044 256 HB2 SER 30 2HB SER 30 4.374 3.424 8.392 257 HB3 SER 30 3HB SER 30 3.022 4.486 8.788 258 HG SER 30 HG SER 30 3.359 4.158 10.876 259 H LYS 31 H LYS 31 0.340 3.449 8.011 260 HA LYS 31 HA LYS 31 -0.886 3.749 10.616 261 HB2 LYS 31 2HB LYS 31 -1.029 5.552 8.943 262 HB3 LYS 31 3HB LYS 31 -1.858 4.480 7.818 263 HG2 LYS 31 2HG LYS 31 -3.812 4.379 9.250 264 HG3 LYS 31 3HG LYS 31 -2.973 5.268 10.528 265 HD2 LYS 31 2HD LYS 31 -2.848 7.263 9.069 266 HD3 LYS 31 3HD LYS 31 -3.666 6.379 7.776 267 HE2 LYS 31 2HE LYS 31 -4.864 6.992 10.501 268 HE3 LYS 31 3HE LYS 31 -5.203 7.880 9.015 269 HZ1 LYS 31 1HZ LYS 31 -6.116 5.864 8.056 270 HZ2 LYS 31 2HZ LYS 31 -6.916 6.263 9.488 271 HZ3 LYS 31 3HZ LYS 31 -5.789 5.002 9.474 272 H ILE 32 H ILE 32 -1.628 2.027 7.580 273 HA ILE 32 HA ILE 32 -4.043 0.849 8.483 274 HB ILE 32 HB ILE 32 -3.983 -0.565 6.456 275 HG12 ILE 32 2HG1 ILE 32 -1.166 0.538 6.034 276 HG13 ILE 32 3HG1 ILE 32 -1.589 -1.134 6.360 277 HG21 ILE 32 1HG2 ILE 32 -4.789 1.755 6.237 278 HG22 ILE 32 2HG2 ILE 32 -4.006 1.222 4.750 279 HG23 ILE 32 3HG2 ILE 32 -3.152 2.301 5.855 280 HD11 ILE 32 1HD1 ILE 32 -2.298 0.395 3.859 281 HD12 ILE 32 2HD1 ILE 32 -2.666 -1.302 4.187 282 HD13 ILE 32 3HD1 ILE 32 -0.990 -0.771 4.042 283 H SER 33 H SER 33 -0.682 -0.389 8.295 284 HA SER 33 HA SER 33 -1.133 -3.030 9.102 285 HB2 SER 33 2HB SER 33 1.259 -3.057 9.730 286 HB3 SER 33 3HB SER 33 1.008 -2.235 8.190 287 HG SER 33 HG SER 33 1.983 -0.605 9.059 288 H SER 34 H SER 34 -0.911 -0.092 11.048 289 HA SER 34 HA SER 34 -0.643 -1.371 13.601 290 HB2 SER 34 2HB SER 34 0.094 0.988 13.123 291 HB3 SER 34 3HB SER 34 -1.596 1.468 12.970 292 HG SER 34 HG SER 34 -1.781 0.551 15.207 293 H SER 35 H SER 35 -3.260 -0.887 11.464 294 HA SER 35 HA SER 35 -5.364 -1.021 13.527 295 HB2 SER 35 2HB SER 35 -5.514 0.779 11.801 296 HB3 SER 35 3HB SER 35 -5.575 -0.443 10.530 297 HG SER 35 HG SER 35 -7.439 -0.350 12.672 298 H VAL 36 H VAL 36 -4.052 -2.739 10.714 299 HA VAL 36 HA VAL 36 -6.295 -4.642 10.722 300 HB VAL 36 HB VAL 36 -5.624 -5.317 8.499 301 HG11 VAL 36 1HG1 VAL 36 -5.951 -3.215 7.243 302 HG12 VAL 36 2HG1 VAL 36 -5.591 -2.282 8.700 303 HG13 VAL 36 3HG1 VAL 36 -7.025 -3.311 8.640 304 HG21 VAL 36 1HG2 VAL 36 -3.211 -3.493 8.760 305 HG22 VAL 36 2HG2 VAL 36 -3.716 -4.307 7.278 306 HG23 VAL 36 3HG2 VAL 36 -3.193 -5.254 8.668 307 H ASN 37 H ASN 37 -6.068 -6.772 11.112 308 HA ASN 37 HA ASN 37 -3.734 -7.654 12.561 309 HB2 ASN 37 2HB ASN 37 -5.060 -9.751 12.953 310 HB3 ASN 37 3HB ASN 37 -5.886 -8.281 13.449 311 HD21 ASN 37 1HD2 ASN 37 -7.946 -9.138 13.344 312 HD22 ASN 37 2HD2 ASN 37 -8.709 -9.592 11.864 313 H ASP 38 H ASP 38 -4.829 -8.029 9.250 314 HA ASP 38 HA ASP 38 -2.641 -9.916 8.708 315 HB2 ASP 38 2HB ASP 38 -4.679 -11.279 9.032 316 HB3 ASP 38 3HB ASP 38 -5.527 -10.334 7.814 317 H LEU 39 H LEU 39 -2.101 -10.081 6.441 318 HA LEU 39 HA LEU 39 -1.669 -7.566 5.253 319 HB2 LEU 39 2HB LEU 39 -0.202 -9.625 5.121 320 HB3 LEU 39 3HB LEU 39 -1.337 -10.320 3.988 321 HG LEU 39 HG LEU 39 0.823 -9.311 3.023 322 HD11 LEU 39 1HD1 LEU 39 -1.020 -9.877 1.555 323 HD12 LEU 39 2HD1 LEU 39 -0.159 -8.446 0.996 324 HD13 LEU 39 3HD1 LEU 39 -1.724 -8.277 1.797 325 HD21 LEU 39 1HD2 LEU 39 0.943 -6.901 2.652 326 HD22 LEU 39 2HD2 LEU 39 0.894 -7.261 4.375 327 HD23 LEU 39 3HD2 LEU 39 -0.554 -6.662 3.558 328 H GLU 40 H GLU 40 -3.990 -10.161 4.553 329 HA GLU 40 HA GLU 40 -5.046 -9.071 2.142 330 HB2 GLU 40 2HB GLU 40 -5.213 -11.473 2.815 331 HB3 GLU 40 3HB GLU 40 -6.359 -11.031 4.076 332 HG2 GLU 40 2HG GLU 40 -7.968 -10.284 2.387 333 HG3 GLU 40 3HG GLU 40 -6.801 -10.603 1.103 334 H GLU 41 H GLU 41 -5.672 -8.396 5.516 335 HA GLU 41 HA GLU 41 -8.151 -6.964 5.120 336 HB2 GLU 41 2HB GLU 41 -6.249 -6.613 7.468 337 HB3 GLU 41 3HB GLU 41 -7.979 -6.296 7.431 338 HG2 GLU 41 2HG GLU 41 -6.591 -8.978 7.400 339 HG3 GLU 41 3HG GLU 41 -7.563 -8.295 8.698 340 H ALA 42 H ALA 42 -4.725 -6.182 5.236 341 HA ALA 42 HA ALA 42 -4.887 -3.354 5.070 342 HB1 ALA 42 1HB ALA 42 -2.536 -3.454 4.297 343 HB2 ALA 42 2HB ALA 42 -2.674 -5.205 4.101 344 HB3 ALA 42 3HB ALA 42 -2.803 -4.481 5.705 345 H ILE 43 H ILE 43 -4.749 -5.938 2.667 346 HA ILE 43 HA ILE 43 -4.642 -4.475 0.303 347 HB ILE 43 HB ILE 43 -5.909 -7.181 0.905 348 HG12 ILE 43 2HG1 ILE 43 -3.299 -6.421 -0.503 349 HG13 ILE 43 3HG1 ILE 43 -3.429 -7.041 1.137 350 HG21 ILE 43 1HG2 ILE 43 -5.517 -5.953 -1.844 351 HG22 ILE 43 2HG2 ILE 43 -7.068 -6.243 -1.058 352 HG23 ILE 43 3HG2 ILE 43 -6.048 -7.604 -1.523 353 HD11 ILE 43 1HD1 ILE 43 -4.005 -8.515 -1.424 354 HD12 ILE 43 2HD1 ILE 43 -4.364 -9.149 0.186 355 HD13 ILE 43 3HD1 ILE 43 -2.696 -8.799 -0.270 356 H VAL 44 H VAL 44 -7.757 -5.916 1.583 357 HA VAL 44 HA VAL 44 -9.691 -4.563 0.372 358 HB VAL 44 HB VAL 44 -9.593 -4.959 3.400 359 HG11 VAL 44 1HG1 VAL 44 -12.079 -4.954 3.326 360 HG12 VAL 44 2HG1 VAL 44 -12.024 -4.525 1.615 361 HG13 VAL 44 3HG1 VAL 44 -11.405 -3.400 2.825 362 HG21 VAL 44 1HG2 VAL 44 -10.799 -7.080 2.980 363 HG22 VAL 44 2HG2 VAL 44 -9.238 -7.064 2.157 364 HG23 VAL 44 3HG2 VAL 44 -10.718 -6.788 1.238 365 H VAL 45 H VAL 45 -8.074 -3.142 3.248 366 HA VAL 45 HA VAL 45 -9.337 -0.635 3.221 367 HB VAL 45 HB VAL 45 -6.535 -1.328 4.215 368 HG11 VAL 45 1HG1 VAL 45 -6.692 0.744 5.590 369 HG12 VAL 45 2HG1 VAL 45 -8.202 1.162 4.775 370 HG13 VAL 45 3HG1 VAL 45 -6.695 1.104 3.862 371 HG21 VAL 45 1HG2 VAL 45 -7.615 -1.439 6.444 372 HG22 VAL 45 2HG2 VAL 45 -8.348 -2.591 5.327 373 HG23 VAL 45 3HG2 VAL 45 -9.182 -1.085 5.706 374 H LEU 46 H LEU 46 -6.342 -1.669 1.538 375 HA LEU 46 HA LEU 46 -5.711 0.882 0.414 376 HB2 LEU 46 2HB LEU 46 -4.754 -1.908 -0.277 377 HB3 LEU 46 3HB LEU 46 -4.186 -0.489 -1.142 378 HG LEU 46 HG LEU 46 -3.809 -0.959 1.843 379 HD11 LEU 46 1HD1 LEU 46 -1.782 -1.220 -0.400 380 HD12 LEU 46 2HD1 LEU 46 -2.504 -2.552 0.509 381 HD13 LEU 46 3HD1 LEU 46 -1.460 -1.393 1.329 382 HD21 LEU 46 1HD2 LEU 46 -2.695 1.230 0.049 383 HD22 LEU 46 2HD2 LEU 46 -2.266 0.966 1.742 384 HD23 LEU 46 3HD2 LEU 46 -3.909 1.428 1.317 385 H ARG 47 H ARG 47 -7.784 -1.745 -0.685 386 HA ARG 47 HA ARG 47 -8.176 -0.969 -3.363 387 HB2 ARG 47 2HB ARG 47 -10.088 -2.356 -1.431 388 HB3 ARG 47 3HB ARG 47 -10.353 -2.230 -3.167 389 HG2 ARG 47 2HG ARG 47 -8.415 -3.603 -3.630 390 HG3 ARG 47 3HG ARG 47 -7.950 -3.607 -1.929 391 HD2 ARG 47 2HD ARG 47 -9.007 -5.730 -2.570 392 HD3 ARG 47 3HD ARG 47 -9.963 -4.879 -1.356 393 HE ARG 47 HE ARG 47 -10.699 -4.598 -4.191 394 HH11 ARG 47 1HH1 ARG 47 -11.466 -5.957 -1.041 395 HH12 ARG 47 2HH1 ARG 47 -13.096 -6.359 -1.468 396 HH21 ARG 47 1HH2 ARG 47 -12.845 -5.118 -4.743 397 HH22 ARG 47 2HH2 ARG 47 -13.882 -5.882 -3.580 398 H GLU 48 H GLU 48 -9.429 0.230 -0.359 399 HA GLU 48 HA GLU 48 -11.376 2.029 -1.612 400 HB2 GLU 48 2HB GLU 48 -10.702 1.567 1.325 401 HB3 GLU 48 3HB GLU 48 -11.964 2.649 0.742 402 HG2 GLU 48 2HG GLU 48 -11.870 -0.364 0.431 403 HG3 GLU 48 3HG GLU 48 -12.943 0.551 1.487 404 H GLU 49 H GLU 49 -8.189 2.054 -0.113 405 HA GLU 49 HA GLU 49 -7.918 4.848 0.261 406 HB2 GLU 49 2HB GLU 49 -5.705 2.820 -0.300 407 HB3 GLU 49 3HB GLU 49 -5.428 4.489 0.184 408 HG2 GLU 49 2HG GLU 49 -6.603 2.242 1.815 409 HG3 GLU 49 3HG GLU 49 -5.136 3.163 2.128 410 H GLU 50 H GLU 50 -7.012 2.745 -2.424 411 HA GLU 50 HA GLU 50 -6.148 4.461 -4.392 412 HB2 GLU 50 2HB GLU 50 -6.234 2.023 -4.650 413 HB3 GLU 50 3HB GLU 50 -7.991 2.037 -4.560 414 HG2 GLU 50 2HG GLU 50 -7.767 3.571 -6.723 415 HG3 GLU 50 3HG GLU 50 -6.190 2.793 -6.849 416 H LYS 51 H LYS 51 -9.555 3.427 -3.936 417 HA LYS 51 HA LYS 51 -10.805 4.978 -5.844 418 HB2 LYS 51 2HB LYS 51 -11.871 3.897 -3.210 419 HB3 LYS 51 3HB LYS 51 -12.903 4.593 -4.457 420 HG2 LYS 51 2HG LYS 51 -12.396 2.821 -5.998 421 HG3 LYS 51 3HG LYS 51 -11.100 2.208 -4.966 422 HD2 LYS 51 2HD LYS 51 -13.108 0.785 -4.793 423 HD3 LYS 51 3HD LYS 51 -12.736 1.549 -3.250 424 HE2 LYS 51 2HE LYS 51 -14.524 3.223 -3.677 425 HE3 LYS 51 3HE LYS 51 -14.905 2.408 -5.197 426 HZ1 LYS 51 1HZ LYS 51 -15.075 1.176 -2.493 427 HZ2 LYS 51 2HZ LYS 51 -15.469 0.420 -3.951 428 HZ3 LYS 51 3HZ LYS 51 -16.391 1.727 -3.406 429 H LYS 52 H LYS 52 -10.140 5.854 -2.440 430 HA LYS 52 HA LYS 52 -11.768 8.263 -2.565 431 HB2 LYS 52 2HB LYS 52 -11.223 8.581 -0.228 432 HB3 LYS 52 3HB LYS 52 -11.575 6.874 -0.471 433 HG2 LYS 52 2HG LYS 52 -9.127 6.399 -0.513 434 HG3 LYS 52 3HG LYS 52 -8.811 8.105 -0.199 435 HD2 LYS 52 2HD LYS 52 -8.608 6.798 1.862 436 HD3 LYS 52 3HD LYS 52 -9.964 7.920 1.984 437 HE2 LYS 52 2HE LYS 52 -11.557 6.133 1.650 438 HE3 LYS 52 3HE LYS 52 -10.275 4.989 1.241 439 HZ1 LYS 52 1HZ LYS 52 -9.431 5.199 3.497 440 HZ2 LYS 52 2HZ LYS 52 -11.032 4.668 3.497 441 HZ3 LYS 52 3HZ LYS 52 -10.674 6.271 3.893 442 H ALA 53 H ALA 53 -8.419 7.361 -2.938 443 HA ALA 53 HA ALA 53 -7.286 10.005 -2.697 444 HB1 ALA 53 1HB ALA 53 -6.093 7.482 -3.919 445 HB2 ALA 53 2HB ALA 53 -5.918 8.000 -2.242 446 HB3 ALA 53 3HB ALA 53 -5.210 8.966 -3.536 447 H SER 54 H SER 54 -6.264 11.140 -4.458 448 HA SER 54 HA SER 54 -7.486 10.729 -7.143 449 HB2 SER 54 2HB SER 54 -6.877 13.188 -7.463 450 HB3 SER 54 3HB SER 54 -8.093 12.895 -6.221 451 HG SER 54 HG SER 54 -5.327 13.185 -5.659 452 H GLU 55 H GLU 55 -6.099 10.850 -8.976 453 HA GLU 55 HA GLU 55 -3.519 9.749 -8.737 454 HB2 GLU 55 2HB GLU 55 -4.727 11.262 -11.095 455 HB3 GLU 55 3HB GLU 55 -3.255 10.291 -11.167 456 HG2 GLU 55 2HG GLU 55 -4.583 8.279 -10.532 457 HG3 GLU 55 3HG GLU 55 -6.047 9.265 -10.560 458 HA PRO 56 HA PRO 56 -1.272 9.930 -9.901 459 HB2 PRO 56 2HB PRO 56 1.101 10.456 -8.214 460 HB3 PRO 56 3HB PRO 56 0.959 10.466 -9.983 461 HG2 PRO 56 2HG PRO 56 1.380 12.734 -8.566 462 HG3 PRO 56 3HG PRO 56 0.447 12.714 -10.083 463 HD2 PRO 56 2HD PRO 56 -0.590 12.688 -7.240 464 HD3 PRO 56 3HD PRO 56 -1.096 13.707 -8.613 465 H PHE 57 H PHE 57 -1.724 10.757 -6.518 466 HA PHE 57 HA PHE 57 -0.575 8.561 -5.247 467 HB2 PHE 57 2HB PHE 57 -1.331 10.760 -4.198 468 HB3 PHE 57 3HB PHE 57 -2.969 10.117 -4.182 469 HD1 PHE 57 HD1 PHE 57 0.369 8.592 -3.277 470 HD2 PHE 57 HD2 PHE 57 -3.542 9.689 -1.924 471 HE1 PHE 57 HE1 PHE 57 0.855 7.623 -1.068 472 HE2 PHE 57 HE2 PHE 57 -3.046 8.713 0.275 473 HZ PHE 57 HZ PHE 57 -0.854 7.678 0.709 474 H LYS 58 H LYS 58 -3.889 8.862 -6.572 475 HA LYS 58 HA LYS 58 -5.083 6.519 -5.649 476 HB2 LYS 58 2HB LYS 58 -6.435 8.029 -6.951 477 HB3 LYS 58 3HB LYS 58 -5.363 7.910 -8.341 478 HG2 LYS 58 2HG LYS 58 -6.074 5.593 -8.742 479 HG3 LYS 58 3HG LYS 58 -7.077 5.622 -7.294 480 HD2 LYS 58 2HD LYS 58 -7.508 7.433 -9.702 481 HD3 LYS 58 3HD LYS 58 -8.347 5.900 -9.451 482 HE2 LYS 58 2HE LYS 58 -9.357 6.757 -7.389 483 HE3 LYS 58 3HE LYS 58 -8.467 8.269 -7.557 484 HZ1 LYS 58 1HZ LYS 58 -10.648 7.262 -9.292 485 HZ2 LYS 58 2HZ LYS 58 -9.668 8.568 -9.711 486 HZ3 LYS 58 3HZ LYS 58 -10.637 8.654 -8.331 487 H THR 59 H THR 59 -2.735 6.915 -8.227 488 HA THR 59 HA THR 59 -3.094 4.195 -9.194 489 HB THR 59 HB THR 59 -1.176 6.320 -10.252 490 HG1 THR 59 HG1 THR 59 -2.924 6.832 -11.683 491 HG21 THR 59 1HG2 THR 59 -2.432 3.880 -11.597 492 HG22 THR 59 2HG2 THR 59 -0.734 4.049 -11.138 493 HG23 THR 59 3HG2 THR 59 -1.418 5.077 -12.401 494 H ASP 60 H ASP 60 -0.526 6.200 -7.736 495 HA ASP 60 HA ASP 60 1.503 4.278 -7.533 496 HB2 ASP 60 2HB ASP 60 0.895 6.554 -5.595 497 HB3 ASP 60 3HB ASP 60 2.398 5.632 -5.615 498 H ILE 61 H ILE 61 -1.260 4.842 -5.367 499 HA ILE 61 HA ILE 61 -0.691 2.887 -3.404 500 HB ILE 61 HB ILE 61 -3.369 4.003 -4.345 501 HG12 ILE 61 2HG1 ILE 61 -1.821 4.458 -1.751 502 HG13 ILE 61 3HG1 ILE 61 -1.839 5.570 -3.112 503 HG21 ILE 61 1HG2 ILE 61 -2.927 2.104 -2.005 504 HG22 ILE 61 2HG2 ILE 61 -3.823 1.739 -3.481 505 HG23 ILE 61 3HG2 ILE 61 -4.439 2.948 -2.351 506 HD11 ILE 61 1HD1 ILE 61 -4.215 4.803 -1.422 507 HD12 ILE 61 2HD1 ILE 61 -4.237 5.917 -2.794 508 HD13 ILE 61 3HD1 ILE 61 -3.308 6.313 -1.348 509 H ARG 62 H ARG 62 -2.699 2.628 -6.436 510 HA ARG 62 HA ARG 62 -3.242 -0.123 -5.910 511 HB2 ARG 62 2HB ARG 62 -4.467 -0.202 -7.984 512 HB3 ARG 62 3HB ARG 62 -4.857 1.249 -7.090 513 HG2 ARG 62 2HG ARG 62 -4.801 2.004 -9.275 514 HG3 ARG 62 3HG ARG 62 -3.193 2.433 -8.697 515 HD2 ARG 62 2HD ARG 62 -3.262 1.435 -11.011 516 HD3 ARG 62 3HD ARG 62 -2.196 0.586 -9.884 517 HE ARG 62 HE ARG 62 -4.881 -0.477 -10.034 518 HH11 ARG 62 1HH1 ARG 62 -1.664 -0.704 -11.453 519 HH12 ARG 62 2HH1 ARG 62 -1.913 -2.317 -12.040 520 HH21 ARG 62 1HH2 ARG 62 -5.159 -2.604 -10.708 521 HH22 ARG 62 2HH2 ARG 62 -3.914 -3.408 -11.611 522 H ILE 63 H ILE 63 -0.588 1.360 -7.629 523 HA ILE 63 HA ILE 63 0.357 -0.884 -9.063 524 HB ILE 63 HB ILE 63 1.917 1.443 -7.840 525 HG12 ILE 63 2HG1 ILE 63 1.074 0.946 -10.740 526 HG13 ILE 63 3HG1 ILE 63 0.289 2.071 -9.644 527 HG21 ILE 63 1HG2 ILE 63 2.932 -0.641 -9.805 528 HG22 ILE 63 2HG2 ILE 63 3.445 -0.458 -8.128 529 HG23 ILE 63 3HG2 ILE 63 3.815 0.805 -9.303 530 HD11 ILE 63 1HD1 ILE 63 3.117 2.274 -10.672 531 HD12 ILE 63 2HD1 ILE 63 2.360 3.386 -9.527 532 HD13 ILE 63 3HD1 ILE 63 1.732 3.248 -11.169 533 H LEU 64 H LEU 64 0.972 0.193 -5.718 534 HA LEU 64 HA LEU 64 2.588 -2.011 -4.927 535 HB2 LEU 64 2HB LEU 64 2.615 0.174 -3.818 536 HB3 LEU 64 3HB LEU 64 0.951 -0.017 -3.313 537 HG LEU 64 HG LEU 64 2.914 -2.087 -2.329 538 HD11 LEU 64 1HD1 LEU 64 4.188 -0.018 -2.027 539 HD12 LEU 64 2HD1 LEU 64 3.702 -0.709 -0.482 540 HD13 LEU 64 3HD1 LEU 64 2.842 0.693 -1.129 541 HD21 LEU 64 1HD2 LEU 64 1.576 -1.993 -0.263 542 HD22 LEU 64 2HD2 LEU 64 0.542 -2.263 -1.664 543 HD23 LEU 64 3HD2 LEU 64 0.621 -0.662 -0.926 544 H LEU 65 H LEU 65 -0.851 -1.266 -4.640 545 HA LEU 65 HA LEU 65 -1.711 -3.343 -2.989 546 HB2 LEU 65 2HB LEU 65 -3.066 -1.393 -3.362 547 HB3 LEU 65 3HB LEU 65 -3.072 -1.652 -5.094 548 HG LEU 65 HG LEU 65 -4.543 -3.642 -4.785 549 HD11 LEU 65 1HD1 LEU 65 -5.687 -4.004 -2.639 550 HD12 LEU 65 2HD1 LEU 65 -4.599 -2.849 -1.869 551 HD13 LEU 65 3HD1 LEU 65 -3.960 -4.343 -2.559 552 HD21 LEU 65 1HD2 LEU 65 -5.520 -1.473 -5.343 553 HD22 LEU 65 2HD2 LEU 65 -5.649 -1.066 -3.628 554 HD23 LEU 65 3HD2 LEU 65 -6.597 -2.397 -4.296 555 H ASP 66 H ASP 66 -2.462 -3.182 -6.509 556 HA ASP 66 HA ASP 66 -3.245 -5.673 -7.154 557 HB2 ASP 66 2HB ASP 66 -3.196 -3.750 -8.700 558 HB3 ASP 66 3HB ASP 66 -1.442 -3.790 -8.759 559 H PHE 67 H PHE 67 0.161 -4.599 -7.241 560 HA PHE 67 HA PHE 67 1.563 -6.857 -7.878 561 HB2 PHE 67 2HB PHE 67 2.693 -4.731 -7.518 562 HB3 PHE 67 3HB PHE 67 2.248 -4.718 -5.815 563 HD1 PHE 67 HD1 PHE 67 4.309 -6.574 -8.336 564 HD2 PHE 67 HD2 PHE 67 3.711 -5.689 -4.184 565 HE1 PHE 67 HE1 PHE 67 6.419 -7.712 -7.778 566 HE2 PHE 67 HE2 PHE 67 5.822 -6.830 -3.644 567 HZ PHE 67 HZ PHE 67 7.174 -7.838 -5.440 568 H LEU 68 H LEU 68 0.570 -5.994 -4.508 569 HA LEU 68 HA LEU 68 1.546 -8.346 -3.254 570 HB2 LEU 68 2HB LEU 68 -0.525 -6.302 -2.420 571 HB3 LEU 68 3HB LEU 68 -0.150 -7.678 -1.395 572 HG LEU 68 HG LEU 68 1.866 -5.567 -2.266 573 HD11 LEU 68 1HD1 LEU 68 0.190 -4.646 -0.729 574 HD12 LEU 68 2HD1 LEU 68 1.766 -4.770 0.047 575 HD13 LEU 68 3HD1 LEU 68 0.506 -5.950 0.421 576 HD21 LEU 68 1HD2 LEU 68 3.343 -6.623 -0.559 577 HD22 LEU 68 2HD2 LEU 68 2.969 -7.713 -1.889 578 HD23 LEU 68 3HD2 LEU 68 2.151 -7.907 -0.336 579 H GLU 69 H GLU 69 -1.533 -7.601 -4.776 580 HA GLU 69 HA GLU 69 -2.924 -9.966 -3.926 581 HB2 GLU 69 2HB GLU 69 -3.563 -8.063 -6.217 582 HB3 GLU 69 3HB GLU 69 -4.659 -9.251 -5.515 583 HG2 GLU 69 2HG GLU 69 -4.627 -8.025 -3.368 584 HG3 GLU 69 3HG GLU 69 -3.515 -6.846 -4.065 585 H SER 70 H SER 70 -0.645 -9.237 -6.417 586 HA SER 70 HA SER 70 0.709 -10.651 -7.557 587 HB2 SER 70 2HB SER 70 0.353 -12.324 -5.719 588 HB3 SER 70 3HB SER 70 -1.045 -12.952 -6.587 589 HG SER 70 HG SER 70 0.756 -13.098 -8.372 590 H LYS 71 H LYS 71 -1.821 -9.400 -8.524 591 HA LYS 71 HA LYS 71 -2.994 -11.037 -10.537 592 HB2 LYS 71 2HB LYS 71 -3.013 -8.012 -10.172 593 HB3 LYS 71 3HB LYS 71 -4.069 -8.901 -11.269 594 HG2 LYS 71 2HG LYS 71 -5.167 -10.016 -9.426 595 HG3 LYS 71 3HG LYS 71 -4.015 -9.344 -8.265 596 HD2 LYS 71 2HD LYS 71 -4.867 -7.073 -8.697 597 HD3 LYS 71 3HD LYS 71 -5.974 -7.696 -9.927 598 HE2 LYS 71 2HE LYS 71 -7.229 -8.927 -8.243 599 HE3 LYS 71 3HE LYS 71 -6.048 -8.505 -7.000 600 HZ1 LYS 71 1HZ LYS 71 -6.659 -6.205 -7.209 601 HZ2 LYS 71 2HZ LYS 71 -8.035 -7.131 -6.890 602 HZ3 LYS 71 3HZ LYS 71 -7.747 -6.556 -8.455 603 HA PRO 72 HA PRO 72 0.263 -10.893 -13.658 604 HB2 PRO 72 2HB PRO 72 -1.981 -11.347 -15.622 605 HB3 PRO 72 3HB PRO 72 -0.508 -12.303 -15.347 606 HG2 PRO 72 2HG PRO 72 -2.845 -13.218 -14.494 607 HG3 PRO 72 3HG PRO 72 -1.393 -13.393 -13.476 608 HD2 PRO 72 2HD PRO 72 -3.618 -11.358 -13.241 609 HD3 PRO 72 3HD PRO 72 -2.829 -12.315 -11.964 Start of MODEL 20 1 H GLY 1 1H GLY 1 7.435 -4.607 15.801 2 HA2 GLY 1 2HA GLY 1 5.173 -4.358 15.024 3 HA3 GLY 1 3HA GLY 1 6.308 -4.429 13.681 4 H SER 2 H SER 2 3.758 -4.911 13.063 5 HA SER 2 HA SER 2 2.795 -7.562 13.376 6 HB2 SER 2 2HB SER 2 2.013 -5.401 11.364 7 HB3 SER 2 3HB SER 2 1.054 -6.833 11.748 8 HG SER 2 HG SER 2 0.413 -5.933 13.566 9 H VAL 3 H VAL 3 2.655 -9.279 11.864 10 HA VAL 3 HA VAL 3 4.676 -9.696 9.937 11 HB VAL 3 HB VAL 3 3.385 -11.533 11.076 12 HG11 VAL 3 1HG1 VAL 3 1.195 -12.257 10.223 13 HG12 VAL 3 2HG1 VAL 3 1.130 -10.847 9.163 14 HG13 VAL 3 3HG1 VAL 3 1.112 -10.635 10.916 15 HG21 VAL 3 1HG2 VAL 3 4.754 -12.060 9.101 16 HG22 VAL 3 2HG2 VAL 3 3.381 -11.734 8.042 17 HG23 VAL 3 3HG2 VAL 3 3.324 -13.095 9.166 18 H VAL 4 H VAL 4 1.738 -7.942 9.787 19 HA VAL 4 HA VAL 4 1.250 -7.924 6.971 20 HB VAL 4 HB VAL 4 0.519 -5.729 8.967 21 HG11 VAL 4 1HG1 VAL 4 0.222 -5.083 6.622 22 HG12 VAL 4 2HG1 VAL 4 -1.341 -5.243 7.421 23 HG13 VAL 4 3HG1 VAL 4 -0.775 -6.512 6.334 24 HG21 VAL 4 1HG2 VAL 4 -1.078 -8.234 8.335 25 HG22 VAL 4 2HG2 VAL 4 -1.647 -6.875 9.308 26 HG23 VAL 4 3HG2 VAL 4 -0.289 -7.856 9.870 27 H LYS 5 H LYS 5 3.113 -5.934 9.257 28 HA LYS 5 HA LYS 5 3.536 -3.690 7.645 29 HB2 LYS 5 2HB LYS 5 3.921 -3.664 10.108 30 HB3 LYS 5 3HB LYS 5 5.356 -4.666 9.887 31 HG2 LYS 5 2HG LYS 5 6.363 -2.852 8.483 32 HG3 LYS 5 3HG LYS 5 4.942 -1.852 8.801 33 HD2 LYS 5 2HD LYS 5 5.486 -1.854 11.218 34 HD3 LYS 5 3HD LYS 5 6.899 -2.868 10.904 35 HE2 LYS 5 2HE LYS 5 7.894 -1.085 9.550 36 HE3 LYS 5 3HE LYS 5 6.465 -0.077 9.794 37 HZ1 LYS 5 1HZ LYS 5 8.320 -1.003 11.921 38 HZ2 LYS 5 2HZ LYS 5 6.944 -0.051 12.161 39 HZ3 LYS 5 3HZ LYS 5 8.244 0.559 11.276 40 H GLU 6 H GLU 6 5.805 -6.402 8.304 41 HA GLU 6 HA GLU 6 7.911 -5.637 6.696 42 HB2 GLU 6 2HB GLU 6 8.591 -8.033 6.790 43 HB3 GLU 6 3HB GLU 6 8.090 -7.409 8.360 44 HG2 GLU 6 2HG GLU 6 5.830 -8.479 7.973 45 HG3 GLU 6 3HG GLU 6 6.498 -9.228 6.528 46 H LYS 7 H LYS 7 5.081 -7.640 5.839 47 HA LYS 7 HA LYS 7 5.702 -8.255 3.171 48 HB2 LYS 7 2HB LYS 7 3.004 -7.739 4.484 49 HB3 LYS 7 3HB LYS 7 3.188 -8.416 2.872 50 HG2 LYS 7 2HG LYS 7 4.280 -10.394 3.760 51 HG3 LYS 7 3HG LYS 7 4.286 -9.705 5.389 52 HD2 LYS 7 2HD LYS 7 1.829 -9.755 5.448 53 HD3 LYS 7 3HD LYS 7 1.776 -10.340 3.783 54 HE2 LYS 7 2HE LYS 7 2.947 -11.830 6.149 55 HE3 LYS 7 3HE LYS 7 1.390 -12.156 5.383 56 HZ1 LYS 7 1HZ LYS 7 3.005 -13.694 4.566 57 HZ2 LYS 7 2HZ LYS 7 4.075 -12.460 4.152 58 HZ3 LYS 7 3HZ LYS 7 2.621 -12.635 3.307 59 H LEU 8 H LEU 8 4.070 -5.426 4.539 60 HA LEU 8 HA LEU 8 3.605 -4.036 2.094 61 HB2 LEU 8 2HB LEU 8 3.702 -3.115 4.980 62 HB3 LEU 8 3HB LEU 8 3.241 -2.063 3.656 63 HG LEU 8 HG LEU 8 1.726 -4.599 4.384 64 HD11 LEU 8 1HD1 LEU 8 1.623 -3.005 6.242 65 HD12 LEU 8 2HD1 LEU 8 0.060 -3.157 5.447 66 HD13 LEU 8 3HD1 LEU 8 1.068 -1.737 5.144 67 HD21 LEU 8 1HD2 LEU 8 0.975 -2.271 2.584 68 HD22 LEU 8 2HD2 LEU 8 -0.050 -3.657 2.977 69 HD23 LEU 8 3HD2 LEU 8 1.432 -3.893 2.057 70 H GLU 9 H GLU 9 6.363 -4.272 4.268 71 HA GLU 9 HA GLU 9 7.750 -1.925 3.340 72 HB2 GLU 9 2HB GLU 9 8.724 -4.303 4.994 73 HB3 GLU 9 3HB GLU 9 9.712 -2.890 4.625 74 HG2 GLU 9 2HG GLU 9 8.048 -1.463 5.827 75 HG3 GLU 9 3HG GLU 9 7.157 -2.915 6.264 76 H LYS 10 H LYS 10 7.836 -5.421 2.627 77 HA LYS 10 HA LYS 10 9.931 -5.457 0.751 78 HB2 LYS 10 2HB LYS 10 7.400 -7.146 0.485 79 HB3 LYS 10 3HB LYS 10 9.006 -7.530 -0.117 80 HG2 LYS 10 2HG LYS 10 8.026 -7.586 2.739 81 HG3 LYS 10 3HG LYS 10 8.557 -8.945 1.757 82 HD2 LYS 10 2HD LYS 10 10.869 -8.182 1.850 83 HD3 LYS 10 3HD LYS 10 10.386 -6.682 2.648 84 HE2 LYS 10 2HE LYS 10 9.594 -8.011 4.600 85 HE3 LYS 10 3HE LYS 10 10.165 -9.481 3.809 86 HZ1 LYS 10 1HZ LYS 10 12.411 -8.584 3.854 87 HZ2 LYS 10 2HZ LYS 10 11.766 -8.654 5.414 88 HZ3 LYS 10 3HZ LYS 10 11.858 -7.176 4.606 89 H ALA 11 H ALA 11 6.459 -4.961 0.443 90 HA ALA 11 HA ALA 11 6.200 -4.649 -2.309 91 HB1 ALA 11 1HB ALA 11 4.510 -3.426 -0.102 92 HB2 ALA 11 2HB ALA 11 4.317 -5.046 -0.778 93 HB3 ALA 11 3HB ALA 11 4.023 -3.629 -1.789 94 H LEU 12 H LEU 12 6.606 -2.135 0.221 95 HA LEU 12 HA LEU 12 6.537 0.177 -1.252 96 HB2 LEU 12 2HB LEU 12 8.072 -0.568 1.247 97 HB3 LEU 12 3HB LEU 12 8.264 1.031 0.553 98 HG LEU 12 HG LEU 12 5.653 -0.142 1.585 99 HD11 LEU 12 1HD1 LEU 12 7.224 0.383 3.389 100 HD12 LEU 12 2HD1 LEU 12 5.871 1.513 3.389 101 HD13 LEU 12 3HD1 LEU 12 7.440 2.018 2.753 102 HD21 LEU 12 1HD2 LEU 12 6.230 2.626 0.466 103 HD22 LEU 12 2HD2 LEU 12 4.720 2.116 1.225 104 HD23 LEU 12 3HD2 LEU 12 5.233 1.377 -0.289 105 H ILE 13 H ILE 13 9.455 -1.817 -0.593 106 HA ILE 13 HA ILE 13 11.308 -0.073 -1.845 107 HB ILE 13 HB ILE 13 11.570 -3.063 -1.266 108 HG12 ILE 13 2HG1 ILE 13 12.445 -0.676 0.426 109 HG13 ILE 13 3HG1 ILE 13 11.077 -1.721 0.773 110 HG21 ILE 13 1HG2 ILE 13 14.018 -2.709 -1.349 111 HG22 ILE 13 2HG2 ILE 13 13.762 -1.026 -1.813 112 HG23 ILE 13 3HG2 ILE 13 13.263 -2.325 -2.896 113 HD11 ILE 13 1HD1 ILE 13 12.618 -3.611 1.088 114 HD12 ILE 13 2HD1 ILE 13 12.941 -2.273 2.189 115 HD13 ILE 13 3HD1 ILE 13 13.985 -2.531 0.792 116 H GLU 14 H GLU 14 9.719 -3.089 -2.906 117 HA GLU 14 HA GLU 14 10.994 -3.371 -5.394 118 HB2 GLU 14 2HB GLU 14 8.239 -4.374 -4.573 119 HB3 GLU 14 3HB GLU 14 9.176 -4.965 -5.942 120 HG2 GLU 14 2HG GLU 14 9.998 -5.191 -3.030 121 HG3 GLU 14 3HG GLU 14 9.257 -6.473 -3.976 122 H VAL 15 H VAL 15 8.178 -1.443 -4.455 123 HA VAL 15 HA VAL 15 7.629 -0.763 -7.283 124 HB VAL 15 HB VAL 15 5.432 -0.065 -6.652 125 HG11 VAL 15 1HG1 VAL 15 6.032 -2.639 -5.142 126 HG12 VAL 15 2HG1 VAL 15 5.675 -2.497 -6.865 127 HG13 VAL 15 3HG1 VAL 15 4.432 -2.107 -5.675 128 HG21 VAL 15 1HG2 VAL 15 6.224 -0.326 -3.726 129 HG22 VAL 15 2HG2 VAL 15 4.586 -0.004 -4.305 130 HG23 VAL 15 3HG2 VAL 15 5.871 1.168 -4.596 131 H ARG 16 H ARG 16 9.315 0.450 -4.661 132 HA ARG 16 HA ARG 16 8.816 3.158 -4.503 133 HB2 ARG 16 2HB ARG 16 10.450 2.039 -3.067 134 HB3 ARG 16 3HB ARG 16 11.540 1.810 -4.429 135 HG2 ARG 16 2HG ARG 16 11.767 4.314 -4.596 136 HG3 ARG 16 3HG ARG 16 10.781 4.461 -3.138 137 HD2 ARG 16 2HD ARG 16 12.479 3.089 -1.922 138 HD3 ARG 16 3HD ARG 16 13.478 3.089 -3.376 139 HE ARG 16 HE ARG 16 12.733 5.705 -2.338 140 HH11 ARG 16 1HH1 ARG 16 15.203 3.194 -2.413 141 HH12 ARG 16 2HH1 ARG 16 16.467 4.262 -1.896 142 HH21 ARG 16 1HH2 ARG 16 14.400 7.072 -1.621 143 HH22 ARG 16 2HH2 ARG 16 16.012 6.454 -1.447 144 HA PRO 17 HA PRO 17 11.593 4.205 -8.441 145 HB2 PRO 17 2HB PRO 17 11.518 1.740 -10.109 146 HB3 PRO 17 3HB PRO 17 12.906 2.755 -9.674 147 HG2 PRO 17 2HG PRO 17 12.558 0.275 -8.645 148 HG3 PRO 17 3HG PRO 17 13.339 1.590 -7.734 149 HD2 PRO 17 2HD PRO 17 10.546 0.512 -7.493 150 HD3 PRO 17 3HD PRO 17 11.672 1.040 -6.220 151 H TYR 18 H TYR 18 8.804 2.141 -8.471 152 HA TYR 18 HA TYR 18 7.761 3.011 -11.042 153 HB2 TYR 18 2HB TYR 18 6.575 1.207 -8.880 154 HB3 TYR 18 3HB TYR 18 5.814 1.519 -10.434 155 HD1 TYR 18 HD1 TYR 18 8.965 0.099 -8.935 156 HD2 TYR 18 HD2 TYR 18 6.300 0.112 -12.281 157 HE1 TYR 18 HE1 TYR 18 10.184 -1.802 -9.915 158 HE2 TYR 18 HE2 TYR 18 7.520 -1.782 -13.260 159 HH TYR 18 HH TYR 18 9.763 -2.795 -13.142 160 H VAL 19 H VAL 19 7.216 3.734 -7.626 161 HA VAL 19 HA VAL 19 4.727 5.190 -8.245 162 HB VAL 19 HB VAL 19 4.215 5.153 -5.846 163 HG11 VAL 19 1HG1 VAL 19 3.817 2.744 -5.554 164 HG12 VAL 19 2HG1 VAL 19 4.949 2.388 -6.863 165 HG13 VAL 19 3HG1 VAL 19 3.454 3.266 -7.201 166 HG21 VAL 19 1HG2 VAL 19 6.813 3.625 -5.436 167 HG22 VAL 19 2HG2 VAL 19 5.576 3.905 -4.205 168 HG23 VAL 19 3HG2 VAL 19 6.471 5.265 -4.884 169 H GLU 20 H GLU 20 4.622 7.330 -8.179 170 HA GLU 20 HA GLU 20 6.557 8.963 -6.665 171 HB2 GLU 20 2HB GLU 20 4.349 9.675 -8.648 172 HB3 GLU 20 3HB GLU 20 5.096 10.892 -7.620 173 HG2 GLU 20 2HG GLU 20 6.053 10.894 -9.877 174 HG3 GLU 20 3HG GLU 20 7.260 10.507 -8.654 175 H TYR 21 H TYR 21 5.665 10.470 -5.068 176 HA TYR 21 HA TYR 21 4.638 10.876 -3.112 177 HB2 TYR 21 2HB TYR 21 2.233 9.481 -4.372 178 HB3 TYR 21 3HB TYR 21 2.187 10.233 -2.782 179 HD1 TYR 21 HD1 TYR 21 3.091 11.091 -6.339 180 HD2 TYR 21 HD2 TYR 21 1.444 12.487 -2.654 181 HE1 TYR 21 HE1 TYR 21 2.593 13.243 -7.388 182 HE2 TYR 21 HE2 TYR 21 0.942 14.651 -3.713 183 HH TYR 21 HH TYR 21 1.034 15.124 -7.068 184 H TYR 22 H TYR 22 6.268 8.591 -3.666 185 HA TYR 22 HA TYR 22 5.619 6.254 -2.315 186 HB2 TYR 22 2HB TYR 22 7.646 6.320 -3.625 187 HB3 TYR 22 3HB TYR 22 8.317 7.626 -2.654 188 HD1 TYR 22 HD1 TYR 22 7.145 4.059 -2.312 189 HD2 TYR 22 HD2 TYR 22 9.862 7.061 -0.921 190 HE1 TYR 22 HE1 TYR 22 8.218 2.417 -0.838 191 HE2 TYR 22 HE2 TYR 22 10.925 5.410 0.556 192 HH TYR 22 HH TYR 22 10.454 2.103 0.292 193 H ASN 23 H ASN 23 6.760 9.356 -0.929 194 HA ASN 23 HA ASN 23 7.203 8.459 1.722 195 HB2 ASN 23 2HB ASN 23 6.338 11.228 0.781 196 HB3 ASN 23 3HB ASN 23 6.963 10.858 2.385 197 HD21 ASN 23 1HD2 ASN 23 7.984 12.725 0.422 198 HD22 ASN 23 2HD2 ASN 23 9.608 12.237 0.083 199 H GLU 24 H GLU 24 4.297 9.449 0.013 200 HA GLU 24 HA GLU 24 2.562 9.739 2.270 201 HB2 GLU 24 2HB GLU 24 1.899 9.248 -0.670 202 HB3 GLU 24 3HB GLU 24 0.762 9.790 0.557 203 HG2 GLU 24 2HG GLU 24 3.200 11.370 -0.295 204 HG3 GLU 24 3HG GLU 24 1.602 11.572 -1.010 205 H LEU 25 H LEU 25 3.118 7.202 -0.200 206 HA LEU 25 HA LEU 25 1.311 5.252 0.715 207 HB2 LEU 25 2HB LEU 25 2.497 5.387 -1.538 208 HB3 LEU 25 3HB LEU 25 3.934 4.778 -0.751 209 HG LEU 25 HG LEU 25 2.774 2.646 -0.240 210 HD11 LEU 25 1HD1 LEU 25 0.486 3.440 0.003 211 HD12 LEU 25 2HD1 LEU 25 0.562 2.143 -1.183 212 HD13 LEU 25 3HD1 LEU 25 0.400 3.816 -1.721 213 HD21 LEU 25 1HD2 LEU 25 2.649 1.769 -2.539 214 HD22 LEU 25 2HD2 LEU 25 4.042 2.829 -2.334 215 HD23 LEU 25 3HD2 LEU 25 2.604 3.418 -3.174 216 H LYS 26 H LYS 26 4.707 5.833 1.353 217 HA LYS 26 HA LYS 26 5.295 3.627 2.994 218 HB2 LYS 26 2HB LYS 26 6.995 5.127 1.941 219 HB3 LYS 26 3HB LYS 26 6.568 6.400 3.075 220 HG2 LYS 26 2HG LYS 26 7.479 5.153 4.934 221 HG3 LYS 26 3HG LYS 26 7.657 3.702 3.944 222 HD2 LYS 26 2HD LYS 26 9.831 4.804 4.304 223 HD3 LYS 26 3HD LYS 26 9.393 4.803 2.594 224 HE2 LYS 26 2HE LYS 26 10.348 6.958 3.194 225 HE3 LYS 26 3HE LYS 26 8.637 7.177 2.831 226 HZ1 LYS 26 1HZ LYS 26 9.223 8.406 4.785 227 HZ2 LYS 26 2HZ LYS 26 9.881 7.042 5.524 228 HZ3 LYS 26 3HZ LYS 26 8.217 7.130 5.252 229 H ALA 27 H ALA 27 3.701 6.689 3.721 230 HA ALA 27 HA ALA 27 3.759 6.326 6.605 231 HB1 ALA 27 1HB ALA 27 3.956 8.580 5.643 232 HB2 ALA 27 2HB ALA 27 2.509 8.451 6.647 233 HB3 ALA 27 3HB ALA 27 2.370 8.411 4.889 234 H LEU 28 H LEU 28 1.608 5.754 3.880 235 HA LEU 28 HA LEU 28 -0.805 5.276 5.295 236 HB2 LEU 28 2HB LEU 28 -0.716 5.815 2.871 237 HB3 LEU 28 3HB LEU 28 0.128 4.311 2.559 238 HG LEU 28 HG LEU 28 -1.889 3.019 3.202 239 HD11 LEU 28 1HD1 LEU 28 -2.861 4.508 4.863 240 HD12 LEU 28 2HD1 LEU 28 -4.040 4.111 3.618 241 HD13 LEU 28 3HD1 LEU 28 -3.256 5.694 3.612 242 HD21 LEU 28 1HD2 LEU 28 -1.577 3.662 0.852 243 HD22 LEU 28 2HD2 LEU 28 -2.499 5.144 1.123 244 HD23 LEU 28 3HD2 LEU 28 -3.286 3.570 1.275 245 H VAL 29 H VAL 29 1.762 3.208 4.010 246 HA VAL 29 HA VAL 29 1.011 0.679 4.897 247 HB VAL 29 HB VAL 29 3.624 2.009 4.201 248 HG11 VAL 29 1HG1 VAL 29 4.898 -0.118 4.504 249 HG12 VAL 29 2HG1 VAL 29 3.513 -0.782 5.372 250 HG13 VAL 29 3HG1 VAL 29 4.380 0.609 6.030 251 HG21 VAL 29 1HG2 VAL 29 2.171 1.259 2.388 252 HG22 VAL 29 2HG2 VAL 29 2.178 -0.382 3.036 253 HG23 VAL 29 3HG2 VAL 29 3.666 0.317 2.395 254 H SER 30 H SER 30 2.921 3.196 6.465 255 HA SER 30 HA SER 30 3.562 1.798 8.838 256 HB2 SER 30 2HB SER 30 4.765 3.802 7.970 257 HB3 SER 30 3HB SER 30 3.373 4.807 8.373 258 HG SER 30 HG SER 30 4.962 4.891 9.983 259 H LYS 31 H LYS 31 0.732 3.544 7.835 260 HA LYS 31 HA LYS 31 -0.453 3.784 10.467 261 HB2 LYS 31 2HB LYS 31 -0.768 5.546 8.762 262 HB3 LYS 31 3HB LYS 31 -1.544 4.392 7.686 263 HG2 LYS 31 2HG LYS 31 -3.451 4.193 9.175 264 HG3 LYS 31 3HG LYS 31 -2.646 5.175 10.405 265 HD2 LYS 31 2HD LYS 31 -2.672 7.116 8.828 266 HD3 LYS 31 3HD LYS 31 -3.533 6.121 7.649 267 HE2 LYS 31 2HE LYS 31 -4.558 6.876 10.408 268 HE3 LYS 31 3HE LYS 31 -5.074 7.598 8.884 269 HZ1 LYS 31 1HZ LYS 31 -6.644 5.940 9.628 270 HZ2 LYS 31 2HZ LYS 31 -5.446 4.751 9.663 271 HZ3 LYS 31 3HZ LYS 31 -5.917 5.434 8.189 272 H ILE 32 H ILE 32 -1.012 1.820 7.514 273 HA ILE 32 HA ILE 32 -3.460 0.709 8.520 274 HB ILE 32 HB ILE 32 -3.566 -0.668 6.450 275 HG12 ILE 32 2HG1 ILE 32 -0.873 0.590 5.749 276 HG13 ILE 32 3HG1 ILE 32 -1.168 -1.109 6.072 277 HG21 ILE 32 1HG2 ILE 32 -2.938 2.253 5.896 278 HG22 ILE 32 2HG2 ILE 32 -4.488 1.612 6.445 279 HG23 ILE 32 3HG2 ILE 32 -3.872 1.175 4.852 280 HD11 ILE 32 1HD1 ILE 32 -2.259 0.431 3.708 281 HD12 ILE 32 2HD1 ILE 32 -2.481 -1.293 4.032 282 HD13 ILE 32 3HD1 ILE 32 -0.871 -0.657 3.700 283 H SER 33 H SER 33 -0.192 -0.624 7.964 284 HA SER 33 HA SER 33 -0.417 -3.256 8.506 285 HB2 SER 33 2HB SER 33 1.899 -3.145 9.481 286 HB3 SER 33 3HB SER 33 1.710 -2.256 7.970 287 HG SER 33 HG SER 33 2.273 -0.520 8.984 288 H SER 34 H SER 34 -0.546 -0.771 11.023 289 HA SER 34 HA SER 34 -0.624 -2.762 13.187 290 HB2 SER 34 2HB SER 34 -0.610 0.279 13.343 291 HB3 SER 34 3HB SER 34 -0.438 -0.828 14.705 292 HG SER 34 HG SER 34 1.451 -1.648 13.435 293 H SER 35 H SER 35 -2.711 -0.691 11.355 294 HA SER 35 HA SER 35 -4.917 -0.611 13.223 295 HB2 SER 35 2HB SER 35 -4.466 1.221 11.569 296 HB3 SER 35 3HB SER 35 -4.856 0.114 10.254 297 HG SER 35 HG SER 35 -6.571 1.127 12.275 298 H VAL 36 H VAL 36 -4.038 -2.497 10.380 299 HA VAL 36 HA VAL 36 -6.428 -4.155 10.495 300 HB VAL 36 HB VAL 36 -5.713 -5.157 8.411 301 HG11 VAL 36 1HG1 VAL 36 -5.705 -3.227 6.897 302 HG12 VAL 36 2HG1 VAL 36 -5.314 -2.154 8.245 303 HG13 VAL 36 3HG1 VAL 36 -6.861 -3.008 8.212 304 HG21 VAL 36 1HG2 VAL 36 -3.116 -3.607 8.657 305 HG22 VAL 36 2HG2 VAL 36 -3.616 -4.536 7.241 306 HG23 VAL 36 3HG2 VAL 36 -3.313 -5.356 8.773 307 H ASN 37 H ASN 37 -6.378 -6.344 10.903 308 HA ASN 37 HA ASN 37 -4.267 -7.405 12.544 309 HB2 ASN 37 2HB ASN 37 -6.800 -8.681 11.429 310 HB3 ASN 37 3HB ASN 37 -5.665 -9.542 12.462 311 HD21 ASN 37 1HD2 ASN 37 -8.026 -6.960 12.324 312 HD22 ASN 37 2HD2 ASN 37 -8.236 -6.809 14.030 313 H ASP 38 H ASP 38 -5.281 -7.864 9.141 314 HA ASP 38 HA ASP 38 -2.961 -9.662 8.687 315 HB2 ASP 38 2HB ASP 38 -5.846 -10.134 7.801 316 HB3 ASP 38 3HB ASP 38 -4.478 -10.959 7.060 317 H LEU 39 H LEU 39 -2.394 -9.873 6.416 318 HA LEU 39 HA LEU 39 -2.154 -7.375 5.066 319 HB2 LEU 39 2HB LEU 39 -0.535 -9.397 5.040 320 HB3 LEU 39 3HB LEU 39 -1.613 -10.136 3.882 321 HG LEU 39 HG LEU 39 0.458 -9.083 2.902 322 HD11 LEU 39 1HD1 LEU 39 -0.537 -8.057 0.967 323 HD12 LEU 39 2HD1 LEU 39 -2.078 -7.895 1.813 324 HD13 LEU 39 3HD1 LEU 39 -1.431 -9.495 1.454 325 HD21 LEU 39 1HD2 LEU 39 -0.819 -6.441 3.650 326 HD22 LEU 39 2HD2 LEU 39 0.652 -6.663 2.696 327 HD23 LEU 39 3HD2 LEU 39 0.622 -7.146 4.391 328 H GLU 40 H GLU 40 -4.266 -10.176 4.788 329 HA GLU 40 HA GLU 40 -5.684 -9.599 2.440 330 HB2 GLU 40 2HB GLU 40 -5.782 -11.736 3.730 331 HB3 GLU 40 3HB GLU 40 -6.690 -10.924 5.000 332 HG2 GLU 40 2HG GLU 40 -8.571 -10.571 3.490 333 HG3 GLU 40 3HG GLU 40 -7.647 -11.222 2.136 334 H GLU 41 H GLU 41 -6.001 -8.317 5.695 335 HA GLU 41 HA GLU 41 -8.425 -6.812 5.212 336 HB2 GLU 41 2HB GLU 41 -6.499 -6.503 7.544 337 HB3 GLU 41 3HB GLU 41 -8.181 -5.992 7.480 338 HG2 GLU 41 2HG GLU 41 -7.132 -8.832 7.574 339 HG3 GLU 41 3HG GLU 41 -7.967 -7.962 8.858 340 H ALA 42 H ALA 42 -5.004 -6.298 4.983 341 HA ALA 42 HA ALA 42 -4.990 -3.429 4.893 342 HB1 ALA 42 1HB ALA 42 -2.690 -3.652 4.040 343 HB2 ALA 42 2HB ALA 42 -2.931 -5.384 3.784 344 HB3 ALA 42 3HB ALA 42 -2.943 -4.723 5.423 345 H ILE 43 H ILE 43 -5.134 -6.024 2.506 346 HA ILE 43 HA ILE 43 -5.132 -4.586 0.110 347 HB ILE 43 HB ILE 43 -6.415 -7.251 0.859 348 HG12 ILE 43 2HG1 ILE 43 -3.848 -6.652 -0.687 349 HG13 ILE 43 3HG1 ILE 43 -3.915 -7.092 1.011 350 HG21 ILE 43 1HG2 ILE 43 -7.610 -6.391 -1.118 351 HG22 ILE 43 2HG2 ILE 43 -6.629 -7.797 -1.527 352 HG23 ILE 43 3HG2 ILE 43 -6.074 -6.183 -1.963 353 HD11 ILE 43 1HD1 ILE 43 -4.589 -8.835 -1.352 354 HD12 ILE 43 2HD1 ILE 43 -4.909 -9.284 0.325 355 HD13 ILE 43 3HD1 ILE 43 -3.251 -9.004 -0.209 356 H VAL 44 H VAL 44 -8.141 -5.999 1.589 357 HA VAL 44 HA VAL 44 -10.108 -4.551 0.468 358 HB VAL 44 HB VAL 44 -9.952 -5.238 3.447 359 HG11 VAL 44 1HG1 VAL 44 -12.430 -5.312 3.406 360 HG12 VAL 44 2HG1 VAL 44 -12.418 -4.731 1.739 361 HG13 VAL 44 3HG1 VAL 44 -11.818 -3.697 3.037 362 HG21 VAL 44 1HG2 VAL 44 -11.087 -7.353 2.851 363 HG22 VAL 44 2HG2 VAL 44 -9.535 -7.209 2.023 364 HG23 VAL 44 3HG2 VAL 44 -11.035 -6.908 1.142 365 H VAL 45 H VAL 45 -8.277 -3.291 3.362 366 HA VAL 45 HA VAL 45 -9.517 -0.777 3.528 367 HB VAL 45 HB VAL 45 -6.679 -1.615 4.245 368 HG11 VAL 45 1HG1 VAL 45 -6.351 0.555 5.412 369 HG12 VAL 45 2HG1 VAL 45 -7.874 1.146 4.742 370 HG13 VAL 45 3HG1 VAL 45 -6.522 0.786 3.671 371 HG21 VAL 45 1HG2 VAL 45 -8.474 -2.493 5.673 372 HG22 VAL 45 2HG2 VAL 45 -9.097 -0.864 5.937 373 HG23 VAL 45 3HG2 VAL 45 -7.515 -1.317 6.575 374 H LEU 46 H LEU 46 -6.803 -1.782 1.419 375 HA LEU 46 HA LEU 46 -6.335 0.801 0.283 376 HB2 LEU 46 2HB LEU 46 -5.544 -1.944 -0.733 377 HB3 LEU 46 3HB LEU 46 -5.041 -0.447 -1.499 378 HG LEU 46 HG LEU 46 -4.261 -1.420 1.274 379 HD11 LEU 46 1HD1 LEU 46 -3.085 -2.534 -0.551 380 HD12 LEU 46 2HD1 LEU 46 -1.996 -1.511 0.379 381 HD13 LEU 46 3HD1 LEU 46 -2.575 -0.974 -1.201 382 HD21 LEU 46 1HD2 LEU 46 -4.574 1.005 1.362 383 HD22 LEU 46 2HD2 LEU 46 -3.516 1.215 -0.035 384 HD23 LEU 46 3HD2 LEU 46 -2.867 0.589 1.484 385 H ARG 47 H ARG 47 -8.634 -1.728 -0.485 386 HA ARG 47 HA ARG 47 -9.497 -0.885 -3.005 387 HB2 ARG 47 2HB ARG 47 -11.016 -2.179 -0.706 388 HB3 ARG 47 3HB ARG 47 -11.745 -1.908 -2.284 389 HG2 ARG 47 2HG ARG 47 -9.264 -3.595 -1.779 390 HG3 ARG 47 3HG ARG 47 -10.901 -4.225 -2.014 391 HD2 ARG 47 2HD ARG 47 -10.983 -3.235 -4.241 392 HD3 ARG 47 3HD ARG 47 -9.374 -2.546 -4.016 393 HE ARG 47 HE ARG 47 -9.271 -5.344 -3.698 394 HH11 ARG 47 1HH1 ARG 47 -9.691 -2.897 -6.192 395 HH12 ARG 47 2HH1 ARG 47 -9.027 -3.889 -7.448 396 HH21 ARG 47 1HH2 ARG 47 -8.381 -6.625 -5.359 397 HH22 ARG 47 2HH2 ARG 47 -8.289 -5.996 -6.969 398 H GLU 48 H GLU 48 -10.065 0.526 0.125 399 HA GLU 48 HA GLU 48 -12.002 2.479 -0.896 400 HB2 GLU 48 2HB GLU 48 -11.674 1.236 1.617 401 HB3 GLU 48 3HB GLU 48 -11.118 2.871 1.902 402 HG2 GLU 48 2HG GLU 48 -13.792 2.331 0.595 403 HG3 GLU 48 3HG GLU 48 -13.610 2.280 2.344 404 H GLU 49 H GLU 49 -8.638 2.194 0.083 405 HA GLU 49 HA GLU 49 -8.080 4.980 0.362 406 HB2 GLU 49 2HB GLU 49 -6.145 2.681 -0.117 407 HB3 GLU 49 3HB GLU 49 -5.669 4.315 0.321 408 HG2 GLU 49 2HG GLU 49 -7.169 2.309 2.013 409 HG3 GLU 49 3HG GLU 49 -5.561 2.965 2.289 410 H GLU 50 H GLU 50 -7.331 2.676 -2.257 411 HA GLU 50 HA GLU 50 -6.186 4.298 -4.172 412 HB2 GLU 50 2HB GLU 50 -6.418 1.850 -4.393 413 HB3 GLU 50 3HB GLU 50 -8.161 2.007 -4.561 414 HG2 GLU 50 2HG GLU 50 -7.620 3.422 -6.682 415 HG3 GLU 50 3HG GLU 50 -6.001 2.735 -6.553 416 H LYS 51 H LYS 51 -9.673 3.682 -3.678 417 HA LYS 51 HA LYS 51 -10.509 5.253 -5.894 418 HB2 LYS 51 2HB LYS 51 -12.181 4.103 -3.637 419 HB3 LYS 51 3HB LYS 51 -12.794 4.713 -5.172 420 HG2 LYS 51 2HG LYS 51 -11.377 2.910 -6.313 421 HG3 LYS 51 3HG LYS 51 -11.102 2.237 -4.705 422 HD2 LYS 51 2HD LYS 51 -12.910 1.015 -5.736 423 HD3 LYS 51 3HD LYS 51 -13.596 2.005 -4.445 424 HE2 LYS 51 2HE LYS 51 -14.998 2.043 -6.479 425 HE3 LYS 51 3HE LYS 51 -14.371 3.650 -6.108 426 HZ1 LYS 51 1HZ LYS 51 -12.661 3.317 -7.801 427 HZ2 LYS 51 2HZ LYS 51 -14.204 3.154 -8.465 428 HZ3 LYS 51 3HZ LYS 51 -13.274 1.780 -8.149 429 H LYS 52 H LYS 52 -9.955 6.054 -2.514 430 HA LYS 52 HA LYS 52 -11.428 8.588 -2.761 431 HB2 LYS 52 2HB LYS 52 -10.880 9.024 -0.441 432 HB3 LYS 52 3HB LYS 52 -11.498 7.385 -0.584 433 HG2 LYS 52 2HG LYS 52 -9.263 6.465 -0.361 434 HG3 LYS 52 3HG LYS 52 -8.553 8.075 -0.386 435 HD2 LYS 52 2HD LYS 52 -8.559 7.282 1.892 436 HD3 LYS 52 3HD LYS 52 -9.735 8.587 1.764 437 HE2 LYS 52 2HE LYS 52 -10.480 5.641 1.685 438 HE3 LYS 52 3HE LYS 52 -10.447 6.601 3.163 439 HZ1 LYS 52 1HZ LYS 52 -12.651 6.598 2.438 440 HZ2 LYS 52 2HZ LYS 52 -12.239 6.898 0.833 441 HZ3 LYS 52 3HZ LYS 52 -12.067 8.123 1.988 442 H ALA 53 H ALA 53 -8.211 7.342 -3.102 443 HA ALA 53 HA ALA 53 -6.733 9.773 -2.854 444 HB1 ALA 53 1HB ALA 53 -4.897 8.513 -3.922 445 HB2 ALA 53 2HB ALA 53 -6.022 7.220 -4.353 446 HB3 ALA 53 3HB ALA 53 -5.669 7.552 -2.657 447 H SER 54 H SER 54 -6.075 11.209 -4.414 448 HA SER 54 HA SER 54 -7.227 11.009 -7.128 449 HB2 SER 54 2HB SER 54 -6.043 13.396 -5.644 450 HB3 SER 54 3HB SER 54 -6.702 13.443 -7.283 451 HG SER 54 HG SER 54 -8.289 12.436 -5.190 452 H GLU 55 H GLU 55 -5.852 11.415 -8.947 453 HA GLU 55 HA GLU 55 -3.499 9.871 -8.914 454 HB2 GLU 55 2HB GLU 55 -4.560 11.803 -11.016 455 HB3 GLU 55 3HB GLU 55 -3.242 10.664 -11.297 456 HG2 GLU 55 2HG GLU 55 -4.779 8.776 -10.884 457 HG3 GLU 55 3HG GLU 55 -6.093 9.912 -10.573 458 HA PRO 56 HA PRO 56 -1.653 9.483 -9.864 459 HB2 PRO 56 2HB PRO 56 1.005 9.242 -9.755 460 HB3 PRO 56 3HB PRO 56 0.264 10.334 -10.950 461 HG2 PRO 56 2HG PRO 56 1.501 11.022 -8.295 462 HG3 PRO 56 3HG PRO 56 1.737 11.801 -9.877 463 HD2 PRO 56 2HD PRO 56 -0.042 12.722 -7.946 464 HD3 PRO 56 3HD PRO 56 -0.194 13.067 -9.685 465 H PHE 57 H PHE 57 -1.605 10.658 -6.730 466 HA PHE 57 HA PHE 57 -0.438 8.489 -5.313 467 HB2 PHE 57 2HB PHE 57 -1.022 10.677 -4.261 468 HB3 PHE 57 3HB PHE 57 -2.731 10.296 -4.418 469 HD1 PHE 57 HD1 PHE 57 0.241 8.343 -3.152 470 HD2 PHE 57 HD2 PHE 57 -3.638 9.913 -2.270 471 HE1 PHE 57 HE1 PHE 57 0.312 7.293 -0.928 472 HE2 PHE 57 HE2 PHE 57 -3.550 8.857 -0.052 473 HZ PHE 57 HZ PHE 57 -1.581 7.542 0.621 474 H LYS 58 H LYS 58 -3.632 8.859 -6.816 475 HA LYS 58 HA LYS 58 -4.831 6.457 -6.046 476 HB2 LYS 58 2HB LYS 58 -6.000 8.183 -7.363 477 HB3 LYS 58 3HB LYS 58 -4.982 7.839 -8.758 478 HG2 LYS 58 2HG LYS 58 -5.961 5.568 -8.915 479 HG3 LYS 58 3HG LYS 58 -6.956 5.893 -7.496 480 HD2 LYS 58 2HD LYS 58 -7.129 7.372 -10.156 481 HD3 LYS 58 3HD LYS 58 -8.245 6.122 -9.605 482 HE2 LYS 58 2HE LYS 58 -8.849 7.593 -7.664 483 HE3 LYS 58 3HE LYS 58 -7.817 8.852 -8.343 484 HZ1 LYS 58 1HZ LYS 58 -10.246 7.697 -9.609 485 HZ2 LYS 58 2HZ LYS 58 -9.230 8.837 -10.329 486 HZ3 LYS 58 3HZ LYS 58 -10.091 9.241 -8.938 487 H THR 59 H THR 59 -2.338 7.067 -8.455 488 HA THR 59 HA THR 59 -2.309 4.421 -9.587 489 HB THR 59 HB THR 59 -0.255 6.663 -9.872 490 HG1 THR 59 HG1 THR 59 -2.780 6.255 -11.001 491 HG21 THR 59 1HG2 THR 59 0.577 4.463 -10.687 492 HG22 THR 59 2HG2 THR 59 0.333 5.599 -12.012 493 HG23 THR 59 3HG2 THR 59 -0.844 4.317 -11.729 494 H ASP 60 H ASP 60 -0.508 6.229 -7.234 495 HA ASP 60 HA ASP 60 1.704 4.584 -6.797 496 HB2 ASP 60 2HB ASP 60 1.863 6.807 -6.051 497 HB3 ASP 60 3HB ASP 60 0.267 6.797 -5.327 498 H ILE 61 H ILE 61 -1.219 4.950 -4.761 499 HA ILE 61 HA ILE 61 -0.928 2.796 -3.078 500 HB ILE 61 HB ILE 61 -3.544 3.950 -4.129 501 HG12 ILE 61 2HG1 ILE 61 -1.992 4.488 -1.554 502 HG13 ILE 61 3HG1 ILE 61 -2.139 5.588 -2.918 503 HG21 ILE 61 1HG2 ILE 61 -4.664 2.912 -2.174 504 HG22 ILE 61 2HG2 ILE 61 -3.153 2.113 -1.732 505 HG23 ILE 61 3HG2 ILE 61 -3.968 1.689 -3.239 506 HD11 ILE 61 1HD1 ILE 61 -4.567 5.751 -2.478 507 HD12 ILE 61 2HD1 ILE 61 -3.569 6.294 -1.133 508 HD13 ILE 61 3HD1 ILE 61 -4.351 4.718 -1.060 509 H ARG 62 H ARG 62 -2.800 2.730 -6.225 510 HA ARG 62 HA ARG 62 -3.485 0.049 -5.984 511 HB2 ARG 62 2HB ARG 62 -4.144 0.033 -8.305 512 HB3 ARG 62 3HB ARG 62 -4.652 1.509 -7.522 513 HG2 ARG 62 2HG ARG 62 -4.035 2.183 -9.657 514 HG3 ARG 62 3HG ARG 62 -2.643 2.623 -8.672 515 HD2 ARG 62 2HD ARG 62 -2.192 1.534 -10.964 516 HD3 ARG 62 3HD ARG 62 -1.314 0.886 -9.576 517 HE ARG 62 HE ARG 62 -3.798 -0.480 -10.226 518 HH11 ARG 62 1HH1 ARG 62 -0.313 -0.444 -10.794 519 HH12 ARG 62 2HH1 ARG 62 -0.255 -2.118 -11.249 520 HH21 ARG 62 1HH2 ARG 62 -3.673 -2.686 -10.751 521 HH22 ARG 62 2HH2 ARG 62 -2.154 -3.382 -11.220 522 H ILE 63 H ILE 63 -0.457 1.354 -7.354 523 HA ILE 63 HA ILE 63 0.548 -1.118 -8.332 524 HB ILE 63 HB ILE 63 2.104 1.322 -7.362 525 HG12 ILE 63 2HG1 ILE 63 1.431 0.437 -10.208 526 HG13 ILE 63 3HG1 ILE 63 0.586 1.702 -9.335 527 HG21 ILE 63 1HG2 ILE 63 3.569 -0.658 -7.311 528 HG22 ILE 63 2HG2 ILE 63 4.044 0.429 -8.614 529 HG23 ILE 63 3HG2 ILE 63 3.135 -1.039 -8.978 530 HD11 ILE 63 1HD1 ILE 63 3.500 1.786 -10.133 531 HD12 ILE 63 2HD1 ILE 63 2.609 3.060 -9.295 532 HD13 ILE 63 3HD1 ILE 63 2.168 2.614 -10.942 533 H LEU 64 H LEU 64 0.721 0.319 -5.014 534 HA LEU 64 HA LEU 64 2.178 -1.779 -3.777 535 HB2 LEU 64 2HB LEU 64 1.462 0.470 -2.724 536 HB3 LEU 64 3HB LEU 64 -0.106 -0.266 -2.457 537 HG LEU 64 HG LEU 64 1.269 -2.123 -1.160 538 HD11 LEU 64 1HD1 LEU 64 3.251 0.154 -1.013 539 HD12 LEU 64 2HD1 LEU 64 3.488 -1.389 -1.836 540 HD13 LEU 64 3HD1 LEU 64 3.305 -1.350 -0.087 541 HD21 LEU 64 1HD2 LEU 64 1.040 -0.918 0.944 542 HD22 LEU 64 2HD2 LEU 64 -0.354 -0.629 -0.091 543 HD23 LEU 64 3HD2 LEU 64 0.884 0.615 0.080 544 H LEU 65 H LEU 65 -1.300 -1.300 -4.277 545 HA LEU 65 HA LEU 65 -2.319 -3.705 -3.177 546 HB2 LEU 65 2HB LEU 65 -3.649 -1.637 -3.654 547 HB3 LEU 65 3HB LEU 65 -3.483 -1.941 -5.372 548 HG LEU 65 HG LEU 65 -4.836 -4.051 -5.092 549 HD11 LEU 65 1HD1 LEU 65 -5.262 -3.093 -2.251 550 HD12 LEU 65 2HD1 LEU 65 -4.384 -4.541 -2.750 551 HD13 LEU 65 3HD1 LEU 65 -6.117 -4.423 -3.038 552 HD21 LEU 65 1HD2 LEU 65 -6.228 -1.515 -4.167 553 HD22 LEU 65 2HD2 LEU 65 -7.015 -2.942 -4.850 554 HD23 LEU 65 3HD2 LEU 65 -5.919 -1.984 -5.842 555 H ASP 66 H ASP 66 -0.845 -2.969 -6.227 556 HA ASP 66 HA ASP 66 -1.602 -5.310 -7.674 557 HB2 ASP 66 2HB ASP 66 -0.990 -3.137 -8.725 558 HB3 ASP 66 3HB ASP 66 0.655 -3.317 -8.149 559 H PHE 67 H PHE 67 0.918 -4.596 -5.395 560 HA PHE 67 HA PHE 67 2.581 -6.880 -6.205 561 HB2 PHE 67 2HB PHE 67 3.668 -4.703 -5.486 562 HB3 PHE 67 3HB PHE 67 3.041 -4.966 -3.862 563 HD1 PHE 67 HD1 PHE 67 5.519 -6.071 -6.366 564 HD2 PHE 67 HD2 PHE 67 4.012 -6.746 -2.412 565 HE1 PHE 67 HE1 PHE 67 7.473 -7.474 -5.846 566 HE2 PHE 67 HE2 PHE 67 5.971 -8.140 -1.908 567 HZ PHE 67 HZ PHE 67 7.695 -8.509 -3.621 568 H LEU 68 H LEU 68 0.464 -5.785 -3.606 569 HA LEU 68 HA LEU 68 0.901 -7.855 -1.755 570 HB2 LEU 68 2HB LEU 68 -1.572 -6.133 -2.159 571 HB3 LEU 68 3HB LEU 68 -1.294 -7.164 -0.763 572 HG LEU 68 HG LEU 68 0.191 -4.629 -1.522 573 HD11 LEU 68 1HD1 LEU 68 -1.395 -5.344 0.954 574 HD12 LEU 68 2HD1 LEU 68 -1.940 -4.315 -0.373 575 HD13 LEU 68 3HD1 LEU 68 -0.586 -3.807 0.631 576 HD21 LEU 68 1HD2 LEU 68 1.884 -6.228 -0.785 577 HD22 LEU 68 2HD2 LEU 68 0.960 -6.574 0.681 578 HD23 LEU 68 3HD2 LEU 68 1.653 -4.969 0.425 579 H GLU 69 H GLU 69 -1.717 -7.433 -4.184 580 HA GLU 69 HA GLU 69 -2.704 -10.117 -3.882 581 HB2 GLU 69 2HB GLU 69 -3.168 -8.157 -6.166 582 HB3 GLU 69 3HB GLU 69 -4.134 -9.582 -5.792 583 HG2 GLU 69 2HG GLU 69 -4.807 -8.531 -3.630 584 HG3 GLU 69 3HG GLU 69 -3.887 -7.092 -4.065 585 H SER 70 H SER 70 -0.341 -8.502 -5.921 586 HA SER 70 HA SER 70 1.356 -9.209 -7.201 587 HB2 SER 70 2HB SER 70 1.673 -11.080 -5.539 588 HB3 SER 70 3HB SER 70 0.617 -12.091 -6.520 589 HG SER 70 HG SER 70 3.145 -10.996 -7.240 590 H LYS 71 H LYS 71 -0.822 -8.344 -8.255 591 HA LYS 71 HA LYS 71 -2.280 -9.787 -10.138 592 HB2 LYS 71 2HB LYS 71 -1.476 -6.847 -10.119 593 HB3 LYS 71 3HB LYS 71 -2.782 -7.523 -11.083 594 HG2 LYS 71 2HG LYS 71 -2.705 -7.539 -8.043 595 HG3 LYS 71 3HG LYS 71 -3.543 -6.327 -9.015 596 HD2 LYS 71 2HD LYS 71 -4.147 -9.312 -9.015 597 HD3 LYS 71 3HD LYS 71 -5.080 -8.079 -8.164 598 HE2 LYS 71 2HE LYS 71 -5.731 -7.046 -10.270 599 HE3 LYS 71 3HE LYS 71 -4.682 -8.138 -11.176 600 HZ1 LYS 71 1HZ LYS 71 -6.055 -9.985 -10.457 601 HZ2 LYS 71 2HZ LYS 71 -6.976 -8.835 -11.280 602 HZ3 LYS 71 3HZ LYS 71 -7.060 -8.938 -9.596 603 HA PRO 72 HA PRO 72 1.056 -10.301 -13.288 604 HB2 PRO 72 2HB PRO 72 -1.019 -11.891 -14.731 605 HB3 PRO 72 3HB PRO 72 0.585 -12.399 -14.166 606 HG2 PRO 72 2HG PRO 72 -1.632 -13.308 -12.972 607 HG3 PRO 72 3HG PRO 72 -0.169 -12.929 -12.030 608 HD2 PRO 72 2HD PRO 72 -2.644 -11.229 -12.405 609 HD3 PRO 72 3HD PRO 72 -1.765 -11.617 -10.904
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