NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
640389 | 6e9m | 30505 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 HT1 GLY 1 3.236 -13.243 -6.462 2 H2 GLY 1 HT2 GLY 1 3.789 -14.415 -5.378 3 H3 GLY 1 HT3 GLY 1 4.407 -14.360 -6.949 4 HA2 GLY 1 HA1 GLY 1 4.761 -12.254 -4.896 5 HA3 GLY 1 HA2 GLY 1 5.974 -13.445 -5.342 6 H SER 2 HN SER 2 4.334 -10.531 -6.262 7 HA SER 2 HA SER 2 6.496 -9.929 -8.106 8 HB2 SER 2 HB2 SER 2 3.585 -9.881 -8.938 9 HB3 SER 2 HB1 SER 2 4.899 -9.156 -9.862 10 HG SER 2 HG SER 2 5.553 -11.680 -9.270 11 H GLY 3 HN GLY 3 6.461 -7.615 -8.754 12 HA2 GLY 3 HA2 GLY 3 5.839 -5.376 -8.429 13 HA3 GLY 3 HA1 GLY 3 4.793 -5.881 -7.111 14 H TRP 4 HN TRP 4 5.771 -6.432 -5.081 15 HA TRP 4 HA TRP 4 8.392 -5.153 -4.693 16 HB2 TRP 4 HB2 TRP 4 5.930 -5.040 -2.955 17 HB3 TRP 4 HB1 TRP 4 7.529 -4.616 -2.359 18 HD1 TRP 4 HD1 TRP 4 4.619 -3.198 -4.222 19 HE1 TRP 4 HE1 TRP 4 5.157 -0.788 -4.956 20 HE3 TRP 4 HE3 TRP 4 9.626 -3.169 -3.251 21 HZ2 TRP 4 HZ2 TRP 4 7.424 0.883 -5.126 22 HZ3 TRP 4 HZ3 TRP 4 10.911 -1.131 -3.731 23 HH2 TRP 4 HH2 TRP 4 9.832 0.853 -4.650 24 H GLU 5 HN GLU 5 9.821 -6.105 -3.315 25 HA GLU 5 HA GLU 5 9.644 -8.899 -2.957 26 HB2 GLU 5 HB2 GLU 5 11.537 -6.881 -1.743 27 HB3 GLU 5 HB1 GLU 5 11.736 -8.624 -1.638 28 HG2 GLU 5 HG2 GLU 5 11.732 -6.989 -4.165 29 HG3 GLU 5 HG1 GLU 5 13.144 -7.686 -3.374 30 H SER 6 HN SER 6 8.269 -9.803 -1.614 31 HA SER 6 HA SER 6 7.774 -8.541 0.992 32 HB2 SER 6 HB2 SER 6 6.072 -10.554 -0.501 33 HB3 SER 6 HB1 SER 6 5.641 -9.729 0.998 34 HG SER 6 HG SER 6 6.171 -8.449 -1.486 35 H LYS 7 HN LYS 7 10.032 -10.294 0.240 36 HA LYS 7 HA LYS 7 9.678 -12.915 1.164 37 HB2 LYS 7 HB2 LYS 7 12.134 -13.002 1.305 38 HB3 LYS 7 HB1 LYS 7 11.580 -12.303 -0.205 39 HG2 LYS 7 HG2 LYS 7 13.258 -10.860 0.304 40 HG3 LYS 7 HG1 LYS 7 11.912 -10.048 1.097 41 HD2 LYS 7 HD2 LYS 7 13.743 -10.046 2.621 42 HD3 LYS 7 HD1 LYS 7 12.562 -11.219 3.209 43 HE2 LYS 7 HE2 LYS 7 13.865 -13.040 2.297 44 HE3 LYS 7 HE1 LYS 7 15.004 -11.902 1.584 45 HZ1 LYS 7 HZ1 LYS 7 14.513 -12.251 4.492 46 HZ2 LYS 7 HZ2 LYS 7 15.625 -11.181 3.799 47 HZ3 LYS 7 HZ3 LYS 7 15.847 -12.848 3.643 48 H THR 8 HN THR 8 9.969 -9.970 2.877 49 HA THR 8 HA THR 8 10.914 -10.974 5.341 50 HB THR 8 HB THR 8 9.077 -8.606 5.074 51 HG1 THR 8 HG1 THR 8 11.884 -8.475 4.648 52 HG21 THR 8 HG21 THR 8 10.481 -7.701 6.860 53 HG22 THR 8 HG22 THR 8 11.489 -9.146 6.813 54 HG23 THR 8 HG23 THR 8 9.806 -9.261 7.328 55 H GLY 9 HN GLY 9 7.899 -11.166 3.723 56 HA2 GLY 9 HA2 GLY 9 6.010 -12.370 4.270 57 HA3 GLY 9 HA1 GLY 9 6.764 -12.789 5.799 58 H SER 10 HN SER 10 6.850 -9.489 5.332 59 HA SER 10 HA SER 10 5.138 -9.021 7.533 60 HB2 SER 10 HB2 SER 10 6.214 -6.964 5.607 61 HB3 SER 10 HB1 SER 10 5.755 -6.725 7.293 62 HG SER 10 HG SER 10 7.532 -7.825 7.949 63 H CYS 11 HN CYS 11 4.640 -9.001 4.103 64 HA CYS 11 HA CYS 11 2.047 -7.662 4.481 65 HB2 CYS 11 HB2 CYS 11 3.633 -6.582 2.901 66 HB3 CYS 11 HB1 CYS 11 3.619 -8.046 1.926 67 H ASN 12 HN ASN 12 0.175 -8.634 3.783 68 HA ASN 12 HA ASN 12 0.379 -11.511 3.362 69 HB2 ASN 12 HB2 ASN 12 -1.968 -11.623 3.936 70 HB3 ASN 12 HB1 ASN 12 -1.114 -10.666 5.139 71 HD21 ASN 12 HD21 ASN 12 -1.516 -8.459 5.274 72 HD22 ASN 12 HD22 ASN 12 -2.896 -7.733 4.524 73 H THR 13 HN THR 13 -0.283 -8.689 1.532 74 HA THR 13 HA THR 13 -1.635 -10.277 -0.545 75 HB THR 13 HB THR 13 -2.209 -7.986 -1.489 76 HG1 THR 13 HG1 THR 13 -2.073 -6.281 0.105 77 HG21 THR 13 HG21 THR 13 -3.264 -8.694 1.254 78 HG22 THR 13 HG22 THR 13 -3.840 -9.355 -0.276 79 HG23 THR 13 HG23 THR 13 -4.060 -7.644 0.081 80 H GLY 14 HN GLY 14 1.128 -8.245 0.106 81 HA2 GLY 14 HA2 GLY 14 3.148 -8.406 -1.135 82 HA3 GLY 14 HA1 GLY 14 2.218 -8.953 -2.523 83 H LYS 15 HN LYS 15 0.542 -6.451 -1.181 84 HA LYS 15 HA LYS 15 1.609 -4.581 -3.157 85 HB2 LYS 15 HB2 LYS 15 -0.952 -4.600 -1.565 86 HB3 LYS 15 HB1 LYS 15 -0.441 -3.217 -2.522 87 HG2 LYS 15 HG2 LYS 15 -0.334 -4.849 -4.488 88 HG3 LYS 15 HG1 LYS 15 -1.258 -5.944 -3.456 89 HD2 LYS 15 HD2 LYS 15 -3.046 -4.352 -3.264 90 HD3 LYS 15 HD1 LYS 15 -2.094 -3.124 -4.095 91 HE2 LYS 15 HE2 LYS 15 -2.063 -4.667 -6.083 92 HE3 LYS 15 HE1 LYS 15 -3.269 -5.639 -5.245 93 HZ1 LYS 15 HZ1 LYS 15 -3.614 -2.756 -5.817 94 HZ2 LYS 15 HZ2 LYS 15 -4.805 -3.849 -5.311 95 HZ3 LYS 15 HZ3 LYS 15 -4.143 -3.965 -6.869 96 H LEU 16 HN LEU 16 3.477 -3.944 -2.114 97 HA LEU 16 HA LEU 16 3.252 -2.616 0.457 98 HB2 LEU 16 HB2 LEU 16 5.578 -3.382 -1.295 99 HB3 LEU 16 HB1 LEU 16 5.769 -2.330 0.088 100 HG LEU 16 HG LEU 16 4.904 -4.138 1.546 101 HD11 LEU 16 HD11 LEU 16 5.005 -5.757 -0.978 102 HD12 LEU 16 HD12 LEU 16 3.570 -5.346 -0.035 103 HD13 LEU 16 HD13 LEU 16 4.799 -6.416 0.646 104 HD21 LEU 16 HD21 LEU 16 6.910 -5.553 1.426 105 HD22 LEU 16 HD22 LEU 16 7.297 -3.838 1.299 106 HD23 LEU 16 HD23 LEU 16 7.295 -4.849 -0.145 107 H ALA 17 HN ALA 17 3.133 -0.470 0.662 108 HA ALA 17 HA ALA 17 3.932 1.216 -1.602 109 HB1 ALA 17 HB1 ALA 17 1.271 1.363 -0.186 110 HB2 ALA 17 HB2 ALA 17 1.551 0.958 -1.879 111 HB3 ALA 17 HB3 ALA 17 1.881 2.596 -1.296 112 H CYS 18 HN CYS 18 4.409 3.393 -1.014 113 HA CYS 18 HA CYS 18 5.136 3.729 1.791 114 HB2 CYS 18 HB2 CYS 18 5.603 5.531 -0.596 115 HB3 CYS 18 HB1 CYS 18 6.255 5.780 1.016 116 H CYS 19 HN CYS 19 3.343 4.212 2.964 117 HA CYS 19 HA CYS 19 1.456 6.146 1.804 118 HB2 CYS 19 HB2 CYS 19 0.983 3.839 3.678 119 HB3 CYS 19 HB1 CYS 19 -0.213 5.095 3.396 120 H ASP 20 HN ASP 20 0.456 7.664 3.189 121 HA ASP 20 HA ASP 20 1.962 8.272 5.636 122 HB2 ASP 20 HB2 ASP 20 1.324 10.065 3.829 123 HB3 ASP 20 HB1 ASP 20 -0.283 9.920 4.510 124 H THR 21 HN THR 21 1.070 7.761 7.578 125 HA THR 21 HA THR 21 -1.647 6.712 7.553 126 HB THR 21 HB THR 21 -1.130 5.987 9.892 127 HG1 THR 21 HG1 THR 21 0.521 7.158 10.664 128 HG21 THR 21 HG21 THR 21 0.365 4.177 9.223 129 HG22 THR 21 HG22 THR 21 0.821 5.073 7.774 130 HG23 THR 21 HG23 THR 21 -0.833 4.489 7.967 131 H ASN 22 HN ASN 22 -0.311 9.638 7.842 132 HA ASN 22 HA ASN 22 -2.206 10.601 9.877 133 HB2 ASN 22 HB2 ASN 22 0.091 12.076 8.568 134 HB3 ASN 22 HB1 ASN 22 -0.869 12.627 9.924 135 HD21 ASN 22 HD21 ASN 22 1.660 10.581 8.871 136 HD22 ASN 22 HD22 ASN 22 2.218 10.120 10.442 137 H LYS 23 HN LYS 23 -1.356 10.588 6.550 138 HA LYS 23 HA LYS 23 -3.471 12.505 5.911 139 HB2 LYS 23 HB2 LYS 23 -1.120 11.462 4.393 140 HB3 LYS 23 HB1 LYS 23 -2.479 12.120 3.524 141 HG2 LYS 23 HG2 LYS 23 -2.151 14.169 5.075 142 HG3 LYS 23 HG1 LYS 23 -0.568 13.452 5.347 143 HD2 LYS 23 HD2 LYS 23 -1.703 14.208 2.667 144 HD3 LYS 23 HD1 LYS 23 -0.478 15.112 3.560 145 HE2 LYS 23 HE2 LYS 23 -0.105 12.239 2.856 146 HE3 LYS 23 HE1 LYS 23 0.297 13.511 1.700 147 HZ1 LYS 23 HZ1 LYS 23 1.756 14.451 3.487 148 HZ2 LYS 23 HZ2 LYS 23 2.259 12.961 2.873 149 HZ3 LYS 23 HZ3 LYS 23 1.491 13.031 4.378 150 H LYS 24 HN LYS 24 -5.227 11.923 4.843 151 HA LYS 24 HA LYS 24 -5.472 9.170 3.954 152 HB2 LYS 24 HB2 LYS 24 -7.552 8.833 5.209 153 HB3 LYS 24 HB1 LYS 24 -6.151 9.073 6.240 154 HG2 LYS 24 HG2 LYS 24 -7.754 10.324 7.278 155 HG3 LYS 24 HG1 LYS 24 -6.906 11.529 6.320 156 HD2 LYS 24 HD2 LYS 24 -9.265 11.915 6.096 157 HD3 LYS 24 HD1 LYS 24 -8.643 11.282 4.569 158 HE2 LYS 24 HE2 LYS 24 -10.789 10.261 5.175 159 HE3 LYS 24 HE1 LYS 24 -9.492 9.072 5.105 160 HZ1 LYS 24 HZ1 LYS 24 -10.524 10.313 7.599 161 HZ2 LYS 24 HZ2 LYS 24 -9.355 9.096 7.499 162 HZ3 LYS 24 HZ3 LYS 24 -10.949 8.776 7.035 163 H VAL 25 HN VAL 25 -7.579 8.732 2.864 164 HA VAL 25 HA VAL 25 -8.238 11.067 1.173 165 HB VAL 25 HB VAL 25 -8.422 8.232 0.211 166 HG11 VAL 25 HG11 VAL 25 -9.439 9.938 -1.161 167 HG12 VAL 25 HG12 VAL 25 -8.024 9.272 -1.975 168 HG13 VAL 25 HG13 VAL 25 -7.928 10.848 -1.192 169 HG21 VAL 25 HG21 VAL 25 -6.134 8.433 -0.715 170 HG22 VAL 25 HG22 VAL 25 -6.173 8.360 1.044 171 HG23 VAL 25 HG23 VAL 25 -5.913 9.905 0.232 172 H GLN 26 HN GLN 26 -10.391 11.253 0.464 173 HA GLN 26 HA GLN 26 -12.342 10.071 2.228 174 HB2 GLN 26 HB2 GLN 26 -12.510 12.127 0.039 175 HB3 GLN 26 HB1 GLN 26 -13.922 11.528 0.888 176 HG2 GLN 26 HG2 GLN 26 -12.975 12.321 3.004 177 HG3 GLN 26 HG1 GLN 26 -11.584 12.952 2.125 178 HE21 GLN 26 HE21 GLN 26 -11.835 14.754 0.809 179 HE22 GLN 26 HE22 GLN 26 -13.209 15.798 0.937 180 H LYS 27 HN LYS 27 -11.157 9.549 -0.963 181 HA LYS 27 HA LYS 27 -13.444 7.871 -1.647 182 HB2 LYS 27 HB2 LYS 27 -10.964 8.526 -3.254 183 HB3 LYS 27 HB1 LYS 27 -12.347 7.618 -3.840 184 HG2 LYS 27 HG2 LYS 27 -12.706 10.405 -2.823 185 HG3 LYS 27 HG1 LYS 27 -12.094 10.121 -4.450 186 HD2 LYS 27 HD2 LYS 27 -14.439 10.418 -4.645 187 HD3 LYS 27 HD1 LYS 27 -14.132 8.696 -4.854 188 HE2 LYS 27 HE2 LYS 27 -14.882 8.235 -2.625 189 HE3 LYS 27 HE1 LYS 27 -14.994 9.952 -2.250 190 HZ1 LYS 27 HZ1 LYS 27 -17.152 8.943 -2.725 191 HZ2 LYS 27 HZ2 LYS 27 -16.630 8.525 -4.278 192 HZ3 LYS 27 HZ3 LYS 27 -16.777 10.155 -3.842 193 H SER 28 HN SER 28 -13.350 5.656 -1.726 194 HA SER 28 HA SER 28 -10.873 4.271 -1.214 195 HB2 SER 28 HB2 SER 28 -11.764 3.276 0.941 196 HB3 SER 28 HB1 SER 28 -11.294 4.973 1.032 197 HG SER 28 HG SER 28 -13.845 4.871 0.299 198 H THR 29 HN THR 29 -11.327 2.999 -3.011 199 HA THR 29 HA THR 29 -13.542 1.116 -2.570 200 HB THR 29 HB THR 29 -13.482 0.741 -5.085 201 HG1 THR 29 HG1 THR 29 -11.922 3.116 -4.867 202 HG21 THR 29 HG21 THR 29 -14.925 2.697 -5.531 203 HG22 THR 29 HG22 THR 29 -14.414 3.395 -3.995 204 HG23 THR 29 HG23 THR 29 -15.325 1.887 -4.018 205 H GLY 30 HN GLY 30 -10.620 1.224 -4.580 206 HA2 GLY 30 HA2 GLY 30 -8.913 -0.318 -4.822 207 HA3 GLY 30 HA1 GLY 30 -9.437 -1.048 -3.308 208 H GLU 31 HN GLU 31 -10.104 -0.873 -6.759 209 HA GLU 31 HA GLU 31 -11.770 -3.273 -6.527 210 HB2 GLU 31 HB2 GLU 31 -11.583 -1.262 -8.770 211 HB3 GLU 31 HB1 GLU 31 -12.658 -2.652 -8.736 212 HG2 GLU 31 HG2 GLU 31 -13.832 -1.760 -6.839 213 HG3 GLU 31 HG1 GLU 31 -12.695 -0.418 -6.722 214 H GLU 32 HN GLU 32 -8.699 -3.173 -6.686 215 HA GLU 32 HA GLU 32 -8.268 -4.389 -9.294 216 HB2 GLU 32 HB2 GLU 32 -6.369 -3.764 -7.037 217 HB3 GLU 32 HB1 GLU 32 -5.883 -4.586 -8.514 218 HG2 GLU 32 HG2 GLU 32 -6.669 -2.606 -9.798 219 HG3 GLU 32 HG1 GLU 32 -6.962 -1.789 -8.264 220 H SER 33 HN SER 33 -7.502 -5.305 -5.961 221 HA SER 33 HA SER 33 -7.878 -8.121 -6.645 222 HB2 SER 33 HB2 SER 33 -7.068 -6.855 -4.012 223 HB3 SER 33 HB1 SER 33 -6.997 -8.572 -4.415 224 HG SER 33 HG SER 33 -5.520 -7.944 -6.131 225 H GLY 34 HN GLY 34 -9.323 -5.468 -4.959 226 HA2 GLY 34 HA2 GLY 34 -11.410 -7.154 -3.793 227 HA3 GLY 34 HA1 GLY 34 -11.118 -5.459 -3.435 228 H LEU 35 HN LEU 35 -11.568 -7.086 -6.566 229 HA LEU 35 HA LEU 35 -13.026 -5.227 -7.889 230 HB2 LEU 35 HB2 LEU 35 -13.551 -8.204 -7.946 231 HB3 LEU 35 HB1 LEU 35 -14.155 -7.062 -9.127 232 HG LEU 35 HG LEU 35 -11.590 -6.522 -9.443 233 HD11 LEU 35 HD11 LEU 35 -10.730 -7.924 -7.691 234 HD12 LEU 35 HD12 LEU 35 -10.245 -8.590 -9.249 235 HD13 LEU 35 HD13 LEU 35 -11.569 -9.328 -8.347 236 HD21 LEU 35 HD21 LEU 35 -12.946 -8.975 -10.551 237 HD22 LEU 35 HD22 LEU 35 -11.529 -8.185 -11.243 238 HD23 LEU 35 HD23 LEU 35 -13.072 -7.334 -11.183 239 H LEU 36 HN LEU 36 -14.506 -7.833 -5.967 240 HA LEU 36 HA LEU 36 -16.748 -6.019 -5.422 241 HB2 LEU 36 HB2 LEU 36 -17.408 -8.155 -6.401 242 HB3 LEU 36 HB1 LEU 36 -16.558 -9.016 -5.132 243 HG LEU 36 HG LEU 36 -18.125 -8.140 -3.467 244 HD11 LEU 36 HD11 LEU 36 -18.657 -6.015 -4.542 245 HD12 LEU 36 HD12 LEU 36 -20.119 -6.923 -4.163 246 HD13 LEU 36 HD13 LEU 36 -19.519 -6.871 -5.820 247 HD21 LEU 36 HD21 LEU 36 -19.442 -9.431 -5.846 248 HD22 LEU 36 HD22 LEU 36 -20.104 -9.379 -4.214 249 HD23 LEU 36 HD23 LEU 36 -18.611 -10.259 -4.531 250 H HIS 37 HN HIS 37 -15.994 -4.837 -3.748 251 HA HIS 37 HA HIS 37 -14.948 -6.287 -1.406 252 HB2 HIS 37 HB2 HIS 37 -13.900 -4.112 -0.758 253 HB3 HIS 37 HB1 HIS 37 -13.297 -4.750 -2.283 254 HD1 HIS 37 HD1 HIS 37 -13.705 -3.379 -4.383 255 HD2 HIS 37 HD2 HIS 37 -15.505 -1.775 -0.996 256 HE1 HIS 37 HE1 HIS 37 -14.533 -1.104 -5.065 257 HE2 HIS 37 HE2 HIS 37 -15.806 -0.256 -3.064 258 H THR 38 HN THR 38 -17.438 -4.240 -2.578 259 HA THR 38 HA THR 38 -18.024 -2.783 -0.251 260 HB THR 38 HB THR 38 -19.994 -3.460 -2.435 261 HG1 THR 38 HG1 THR 38 -18.622 -1.117 -2.745 262 HG21 THR 38 HG21 THR 38 -20.852 -1.204 -1.955 263 HG22 THR 38 HG22 THR 38 -19.657 -1.029 -0.671 264 HG23 THR 38 HG23 THR 38 -20.926 -2.245 -0.534 265 H GLY 39 HN GLY 39 -18.937 -6.000 -1.219 266 HA2 GLY 39 HA2 GLY 39 -21.036 -6.075 0.813 267 HA3 GLY 39 HA1 GLY 39 -20.739 -7.312 -0.398 268 H ASP 40 HN ASP 40 -17.857 -6.341 0.971 269 HA ASP 40 HA ASP 40 -17.973 -8.544 2.926 270 HB2 ASP 40 HB2 ASP 40 -16.575 -9.058 0.938 271 HB3 ASP 40 HB1 ASP 40 -15.578 -7.659 1.305 272 H VAL 41 HN VAL 41 -16.293 -5.541 2.076 273 HA VAL 41 HA VAL 41 -16.083 -4.935 4.941 274 HB VAL 41 HB VAL 41 -13.776 -3.958 4.461 275 HG11 VAL 41 HG11 VAL 41 -12.671 -6.125 4.811 276 HG12 VAL 41 HG12 VAL 41 -14.162 -6.951 4.359 277 HG13 VAL 41 HG13 VAL 41 -14.114 -5.953 5.812 278 HG21 VAL 41 HG21 VAL 41 -13.901 -4.047 2.021 279 HG22 VAL 41 HG22 VAL 41 -13.991 -5.807 2.084 280 HG23 VAL 41 HG23 VAL 41 -12.530 -4.980 2.623 281 H LEU 42 HN LEU 42 -16.652 -2.961 5.444 282 HA LEU 42 HA LEU 42 -16.744 -0.914 3.355 283 HB2 LEU 42 HB2 LEU 42 -18.466 -1.363 5.771 284 HB3 LEU 42 HB1 LEU 42 -18.542 0.057 4.772 285 HG LEU 42 HG LEU 42 -19.164 -2.751 3.880 286 HD11 LEU 42 HD11 LEU 42 -20.867 -1.841 5.354 287 HD12 LEU 42 HD12 LEU 42 -21.465 -1.940 3.697 288 HD13 LEU 42 HD13 LEU 42 -20.966 -0.386 4.364 289 HD21 LEU 42 HD21 LEU 42 -18.225 -1.502 2.049 290 HD22 LEU 42 HD22 LEU 42 -19.279 -0.132 2.395 291 HD23 LEU 42 HD23 LEU 42 -19.967 -1.647 1.814 292 H ASP 43 HN ASP 43 -15.289 -1.929 6.181 293 HA ASP 43 HA ASP 43 -14.888 0.672 7.386 294 HB2 ASP 43 HB2 ASP 43 -13.789 -0.501 9.155 295 HB3 ASP 43 HB1 ASP 43 -15.188 -1.469 8.698 296 H GLN 44 HN GLN 44 -13.581 -0.763 4.781 297 HA GLN 44 HA GLN 44 -10.893 -0.861 4.915 298 HB2 GLN 44 HB2 GLN 44 -12.193 0.574 2.634 299 HB3 GLN 44 HB1 GLN 44 -10.790 -0.469 2.606 300 HG2 GLN 44 HG2 GLN 44 -12.194 -2.400 3.073 301 HG3 GLN 44 HG1 GLN 44 -13.619 -1.362 3.095 302 HE21 GLN 44 HE21 GLN 44 -11.267 -2.948 1.127 303 HE22 GLN 44 HE22 GLN 44 -11.991 -2.593 -0.398 304 H VAL 45 HN VAL 45 -9.254 0.457 5.145 305 HA VAL 45 HA VAL 45 -9.805 3.283 5.664 306 HB VAL 45 HB VAL 45 -7.398 1.611 6.432 307 HG11 VAL 45 HG11 VAL 45 -6.723 3.536 7.781 308 HG12 VAL 45 HG12 VAL 45 -8.090 4.458 7.156 309 HG13 VAL 45 HG13 VAL 45 -6.798 3.950 6.068 310 HG21 VAL 45 HG21 VAL 45 -9.387 0.996 7.683 311 HG22 VAL 45 HG22 VAL 45 -9.666 2.686 8.100 312 HG23 VAL 45 HG23 VAL 45 -8.245 1.849 8.720 313 H ALA 46 HN ALA 46 -9.215 4.710 4.248 314 HA ALA 46 HA ALA 46 -7.256 3.960 2.188 315 HB1 ALA 46 HB1 ALA 46 -9.553 5.903 2.112 316 HB2 ALA 46 HB2 ALA 46 -9.383 4.400 1.201 317 HB3 ALA 46 HB3 ALA 46 -8.335 5.775 0.844 318 H ILE 47 HN ILE 47 -5.363 4.639 3.002 319 HA ILE 47 HA ILE 47 -5.209 7.406 3.917 320 HB ILE 47 HB ILE 47 -2.854 6.789 4.603 321 HG12 ILE 47 HG12 ILE 47 -3.923 3.990 4.163 322 HG13 ILE 47 HG11 ILE 47 -2.625 4.749 3.247 323 HG21 ILE 47 HG21 ILE 47 -4.710 7.049 6.160 324 HG22 ILE 47 HG22 ILE 47 -3.612 5.767 6.679 325 HG23 ILE 47 HG23 ILE 47 -5.153 5.357 5.919 326 HD11 ILE 47 HD11 ILE 47 -1.738 3.219 4.901 327 HD12 ILE 47 HD12 ILE 47 -2.575 4.093 6.184 328 HD13 ILE 47 HD13 ILE 47 -1.278 4.878 5.283 329 H GLN 48 HN GLN 48 -3.617 8.802 3.110 330 HA GLN 48 HA GLN 48 -3.458 8.684 0.247 331 HB2 GLN 48 HB2 GLN 48 -3.647 10.722 1.949 332 HB3 GLN 48 HB1 GLN 48 -1.898 10.654 1.866 333 HG2 GLN 48 HG2 GLN 48 -3.771 11.057 -0.453 334 HG3 GLN 48 HG1 GLN 48 -2.792 12.290 0.324 335 HE21 GLN 48 HE21 GLN 48 -2.874 9.738 -1.946 336 HE22 GLN 48 HE22 GLN 48 -1.240 9.875 -2.498 337 H CYS 49 HN CYS 49 -1.828 7.973 -0.948 338 HA CYS 49 HA CYS 49 0.636 7.149 0.428 339 HB2 CYS 49 HB2 CYS 49 -1.268 5.388 -0.315 340 HB3 CYS 49 HB1 CYS 49 -0.355 5.482 -1.811 341 H THR 50 HN THR 50 2.464 6.824 -1.033 342 HA THR 50 HA THR 50 2.361 7.964 -3.655 343 HB THR 50 HB THR 50 2.316 10.059 -2.478 344 HG1 THR 50 HG1 THR 50 4.155 10.979 -3.363 345 HG21 THR 50 HG21 THR 50 3.148 9.299 -0.316 346 HG22 THR 50 HG22 THR 50 4.048 10.708 -0.879 347 HG23 THR 50 HG23 THR 50 4.760 9.099 -1.000 348 H GLN 51 HN GLN 51 3.941 7.046 -4.847 349 HA GLN 51 HA GLN 51 6.095 5.761 -3.316 350 HB2 GLN 51 HB2 GLN 51 4.190 4.427 -4.683 351 HB3 GLN 51 HB1 GLN 51 5.403 4.611 -5.947 352 HG2 GLN 51 HG2 GLN 51 6.010 3.511 -3.220 353 HG3 GLN 51 HG1 GLN 51 5.561 2.504 -4.597 354 HE21 GLN 51 HE21 GLN 51 8.052 2.777 -2.962 355 HE22 GLN 51 HE22 GLN 51 9.310 3.005 -4.122 356 H ILE 52 HN ILE 52 7.833 6.882 -3.552 357 HA ILE 52 HA ILE 52 8.519 8.564 -5.710 358 HB ILE 52 HB ILE 52 10.353 7.305 -3.655 359 HG12 ILE 52 HG12 ILE 52 8.751 9.871 -3.533 360 HG13 ILE 52 HG11 ILE 52 8.421 8.411 -2.608 361 HG21 ILE 52 HG21 ILE 52 11.495 8.407 -5.551 362 HG22 ILE 52 HG22 ILE 52 11.780 9.224 -4.016 363 HG23 ILE 52 HG23 ILE 52 10.634 9.898 -5.173 364 HD11 ILE 52 HD11 ILE 52 10.885 10.115 -2.387 365 HD12 ILE 52 HD12 ILE 52 10.538 8.664 -1.445 366 HD13 ILE 52 HD13 ILE 52 9.527 10.098 -1.262 367 HA PRO 53 HA PRO 53 9.443 6.045 -9.136 368 HB2 PRO 53 HB2 PRO 53 12.120 7.397 -8.945 369 HB3 PRO 53 HB1 PRO 53 11.150 7.046 -10.382 370 HG2 PRO 53 HG2 PRO 53 11.107 9.467 -9.251 371 HG3 PRO 53 HG1 PRO 53 9.646 8.749 -9.950 372 HD2 PRO 53 HD2 PRO 53 10.311 9.250 -7.132 373 HD3 PRO 53 HD1 PRO 53 8.732 8.943 -7.878 374 H LEU 54 HN LEU 54 9.519 4.018 -8.473 375 HA LEU 54 HA LEU 54 11.457 2.988 -6.680 376 HB2 LEU 54 HB2 LEU 54 10.213 0.851 -7.020 377 HB3 LEU 54 HB1 LEU 54 9.239 2.202 -6.479 378 HG LEU 54 HG LEU 54 8.718 2.471 -9.046 379 HD11 LEU 54 HD11 LEU 54 8.631 0.370 -10.239 380 HD12 LEU 54 HD12 LEU 54 9.383 -0.459 -8.879 381 HD13 LEU 54 HD13 LEU 54 10.292 0.749 -9.785 382 HD21 LEU 54 HD21 LEU 54 7.503 0.303 -7.344 383 HD22 LEU 54 HD22 LEU 54 6.764 1.031 -8.771 384 HD23 LEU 54 HD23 LEU 54 7.061 2.010 -7.335 385 H LEU 55 HN LEU 55 13.162 1.701 -6.996 386 HA LEU 55 HA LEU 55 13.868 0.894 -9.709 387 HB2 LEU 55 HB2 LEU 55 15.270 0.732 -7.058 388 HB3 LEU 55 HB1 LEU 55 15.834 -0.181 -8.441 389 HG LEU 55 HG LEU 55 16.100 1.962 -9.688 390 HD11 LEU 55 HD11 LEU 55 16.141 4.053 -8.431 391 HD12 LEU 55 HD12 LEU 55 15.548 3.208 -7.002 392 HD13 LEU 55 HD13 LEU 55 14.530 3.336 -8.436 393 HD21 LEU 55 HD21 LEU 55 17.989 0.881 -8.622 394 HD22 LEU 55 HD22 LEU 55 17.628 1.708 -7.106 395 HD23 LEU 55 HD23 LEU 55 18.136 2.634 -8.518 396 H ILE 56 HN ILE 56 14.003 -1.255 -10.371 397 HA ILE 56 HA ILE 56 12.055 -2.993 -9.244 398 HB ILE 56 HB ILE 56 14.170 -3.667 -11.280 399 HG12 ILE 56 HG12 ILE 56 11.345 -2.683 -11.720 400 HG13 ILE 56 HG11 ILE 56 12.791 -1.699 -11.914 401 HG21 ILE 56 HG21 ILE 56 13.097 -5.628 -10.305 402 HG22 ILE 56 HG22 ILE 56 12.627 -5.422 -11.992 403 HG23 ILE 56 HG23 ILE 56 11.514 -4.964 -10.705 404 HD11 ILE 56 HD11 ILE 56 11.928 -2.492 -14.046 405 HD12 ILE 56 HD12 ILE 56 12.125 -4.159 -13.505 406 HD13 ILE 56 HD13 ILE 56 13.539 -3.128 -13.719 407 H GLY 57 HN GLY 57 12.260 -4.704 -7.952 408 HA2 GLY 57 HA2 GLY 57 13.269 -6.412 -6.736 409 HA3 GLY 57 HA1 GLY 57 14.827 -5.893 -7.357 410 H ILE 58 HN ILE 58 13.559 -3.133 -6.309 411 HA ILE 58 HA ILE 58 15.233 -3.176 -3.963 412 HB ILE 58 HB ILE 58 14.275 -1.196 -5.810 413 HG12 ILE 58 HG12 ILE 58 16.626 -1.698 -5.235 414 HG13 ILE 58 HG11 ILE 58 16.238 0.010 -5.067 415 HG21 ILE 58 HG21 ILE 58 12.697 -0.469 -4.174 416 HG22 ILE 58 HG22 ILE 58 14.027 0.689 -4.213 417 HG23 ILE 58 HG23 ILE 58 13.924 -0.498 -2.906 418 HD11 ILE 58 HD11 ILE 58 16.046 -0.277 -2.647 419 HD12 ILE 58 HD12 ILE 58 17.637 -0.752 -3.241 420 HD13 ILE 58 HD13 ILE 58 16.448 -1.985 -2.822 421 H ALA 59 HN ALA 59 14.563 -2.245 -1.945 422 HA ALA 59 HA ALA 59 12.054 -3.396 -1.050 423 HB1 ALA 59 HB1 ALA 59 14.104 -3.886 0.159 424 HB2 ALA 59 HB2 ALA 59 12.984 -2.986 1.186 425 HB3 ALA 59 HB3 ALA 59 14.359 -2.165 0.443 426 H ILE 60 HN ILE 60 10.328 -2.280 -0.525 427 HA ILE 60 HA ILE 60 9.809 0.335 -1.291 428 HB ILE 60 HB ILE 60 8.109 -1.427 -0.863 429 HG12 ILE 60 HG12 ILE 60 6.442 0.070 0.335 430 HG13 ILE 60 HG11 ILE 60 7.763 1.212 0.565 431 HG21 ILE 60 HG21 ILE 60 7.311 -1.725 1.492 432 HG22 ILE 60 HG22 ILE 60 8.768 -0.880 2.028 433 HG23 ILE 60 HG23 ILE 60 8.903 -2.407 1.156 434 HD11 ILE 60 HD11 ILE 60 8.039 1.368 -1.855 435 HD12 ILE 60 HD12 ILE 60 6.411 1.816 -1.348 436 HD13 ILE 60 HD13 ILE 60 6.705 0.237 -2.076 437 H GLU 61 HN GLU 61 10.937 -0.853 1.837 438 HA GLU 61 HA GLU 61 10.336 1.597 3.199 439 HB2 GLU 61 HB2 GLU 61 11.543 0.504 5.100 440 HB3 GLU 61 HB1 GLU 61 10.207 -0.435 4.454 441 HG2 GLU 61 HG2 GLU 61 11.669 -1.919 3.336 442 HG3 GLU 61 HG1 GLU 61 13.049 -0.874 3.637 443 H ASP 62 HN ASP 62 12.999 0.391 1.397 444 HA ASP 62 HA ASP 62 14.833 2.366 2.545 445 HB2 ASP 62 HB2 ASP 62 15.741 0.123 2.336 446 HB3 ASP 62 HB1 ASP 62 15.309 0.072 0.630 447 H GLU 63 HN GLU 63 12.974 1.654 -0.272 448 HA GLU 63 HA GLU 63 14.338 3.298 -2.128 449 HB2 GLU 63 HB2 GLU 63 12.776 1.488 -2.764 450 HB3 GLU 63 HB1 GLU 63 11.442 2.426 -2.109 451 HG2 GLU 63 HG2 GLU 63 11.519 2.612 -4.516 452 HG3 GLU 63 HG1 GLU 63 11.848 4.167 -3.762 453 H CYS 64 HN CYS 64 11.822 3.908 0.233 454 HA CYS 64 HA CYS 64 11.766 6.711 -0.649 455 HB2 CYS 64 HB2 CYS 64 9.416 6.789 -0.444 456 HB3 CYS 64 HB1 CYS 64 9.743 5.262 -1.269 457 H LYS 65 HN LYS 65 11.376 8.267 0.995 458 HA LYS 65 HA LYS 65 11.985 7.318 3.692 459 HB2 LYS 65 HB2 LYS 65 13.360 9.147 2.712 460 HB3 LYS 65 HB1 LYS 65 11.925 10.157 2.640 461 HG2 LYS 65 HG2 LYS 65 13.281 10.737 4.559 462 HG3 LYS 65 HG1 LYS 65 11.743 10.052 5.085 463 HD2 LYS 65 HD2 LYS 65 13.444 9.102 6.450 464 HD3 LYS 65 HD1 LYS 65 12.913 7.852 5.326 465 HE2 LYS 65 HE2 LYS 65 15.297 7.771 5.455 466 HE3 LYS 65 HE1 LYS 65 14.856 8.416 3.878 467 HZ1 LYS 65 HZ1 LYS 65 15.708 10.030 6.219 468 HZ2 LYS 65 HZ2 LYS 65 15.308 10.638 4.695 469 HZ3 LYS 65 HZ3 LYS 65 16.671 9.657 4.879 470 H ASN 66 HN ASN 66 9.608 6.509 3.157 471 HA ASN 66 HA ASN 66 7.905 8.196 4.837 472 HB2 ASN 66 HB2 ASN 66 7.098 6.949 2.209 473 HB3 ASN 66 HB1 ASN 66 5.919 7.403 3.431 474 HD21 ASN 66 HD21 ASN 66 8.073 8.513 0.987 475 HD22 ASN 66 HD22 ASN 66 7.605 10.176 1.031 476 H THR 67 HN THR 67 5.721 6.496 5.018 477 HA THR 67 HA THR 67 6.971 4.345 6.513 478 HB THR 67 HB THR 67 4.021 4.982 6.410 479 HG1 THR 67 HG1 THR 67 6.070 6.032 8.106 480 HG21 THR 67 HG21 THR 67 5.815 3.445 8.284 481 HG22 THR 67 HG22 THR 67 4.447 2.836 7.351 482 HG23 THR 67 HG23 THR 67 4.170 3.927 8.711 483 HA PRO 68 HA PRO 68 5.951 1.495 3.275 484 HB2 PRO 68 HB2 PRO 68 7.088 -0.674 4.453 485 HB3 PRO 68 HB1 PRO 68 8.017 0.572 3.618 486 HG2 PRO 68 HG2 PRO 68 7.716 0.068 6.513 487 HG3 PRO 68 HG1 PRO 68 9.062 0.808 5.629 488 HD2 PRO 68 HD2 PRO 68 7.068 2.148 7.100 489 HD3 PRO 68 HD1 PRO 68 8.235 2.881 5.998 490 H THR 69 HN THR 69 3.970 0.744 3.057 491 HA THR 69 HA THR 69 2.683 -0.568 5.362 492 HB THR 69 HB THR 69 0.538 0.205 4.080 493 HG1 THR 69 HG1 THR 69 0.986 1.349 2.374 494 HG21 THR 69 HG21 THR 69 0.414 2.261 5.288 495 HG22 THR 69 HG22 THR 69 2.173 2.335 5.451 496 HG23 THR 69 HG23 THR 69 1.259 1.084 6.300 497 H CYS 70 HN CYS 70 1.207 -2.271 4.896 498 HA CYS 70 HA CYS 70 1.455 -3.484 2.218 499 HB2 CYS 70 HB2 CYS 70 2.160 -4.997 3.971 500 HB3 CYS 70 HB1 CYS 70 0.700 -4.680 4.897 501 H CYS 71 HN CYS 71 -0.181 -2.704 0.992 502 HA CYS 71 HA CYS 71 -2.760 -2.075 2.210 503 HB2 CYS 71 HB2 CYS 71 -1.797 -1.799 -0.654 504 HB3 CYS 71 HB1 CYS 71 -3.379 -1.317 -0.089 505 H GLU 72 HN GLU 72 -4.608 -3.253 1.892 506 HA GLU 72 HA GLU 72 -4.412 -5.898 0.882 507 HB2 GLU 72 HB2 GLU 72 -5.991 -5.835 2.521 508 HB3 GLU 72 HB1 GLU 72 -6.473 -4.181 2.157 509 HG2 GLU 72 HG2 GLU 72 -7.820 -4.890 0.367 510 HG3 GLU 72 HG1 GLU 72 -7.172 -6.527 0.426 511 H ASP 73 HN ASP 73 -5.482 -2.811 -0.294 512 HA ASP 73 HA ASP 73 -5.096 -3.680 -3.024 513 HB2 ASP 73 HB2 ASP 73 -7.650 -3.948 -2.253 514 HB3 ASP 73 HB1 ASP 73 -7.661 -2.224 -2.623 515 H VAL 74 HN VAL 74 -5.131 -1.693 -4.476 516 HA VAL 74 HA VAL 74 -4.868 0.802 -2.935 517 HB VAL 74 HB VAL 74 -2.874 0.279 -5.128 518 HG11 VAL 74 HG11 VAL 74 -1.587 1.947 -3.882 519 HG12 VAL 74 HG12 VAL 74 -2.881 2.043 -2.690 520 HG13 VAL 74 HG13 VAL 74 -3.177 2.552 -4.352 521 HG21 VAL 74 HG21 VAL 74 -2.310 -0.294 -2.225 522 HG22 VAL 74 HG22 VAL 74 -1.256 -0.579 -3.613 523 HG23 VAL 74 HG23 VAL 74 -2.711 -1.549 -3.393 524 H GLU 75 HN GLU 75 -5.595 2.586 -3.979 525 HA GLU 75 HA GLU 75 -6.944 2.129 -6.542 526 HB2 GLU 75 HB2 GLU 75 -7.989 3.117 -4.297 527 HB3 GLU 75 HB1 GLU 75 -7.338 4.614 -4.947 528 HG2 GLU 75 HG2 GLU 75 -8.622 4.285 -6.995 529 HG3 GLU 75 HG1 GLU 75 -9.293 2.797 -6.328 530 H ASP 76 HN ASP 76 -6.901 3.871 -8.134 531 HA ASP 76 HA ASP 76 -5.803 5.229 -9.580 532 HB2 ASP 76 HB2 ASP 76 -4.519 6.295 -7.051 533 HB3 ASP 76 HB1 ASP 76 -4.351 7.029 -8.639 534 H ASP 77 HN ASP 77 -3.045 6.192 -9.271 535 HA ASP 77 HA ASP 77 -1.675 3.821 -10.152 536 HB2 ASP 77 HB2 ASP 77 -0.702 6.652 -9.728 537 HB3 ASP 77 HB1 ASP 77 0.290 5.357 -10.389 538 H GLY 78 HN GLY 78 -2.617 4.300 -7.284 539 HA2 GLY 78 HA2 GLY 78 -1.689 2.947 -5.521 540 HA3 GLY 78 HA1 GLY 78 -0.093 3.469 -6.017 541 H LEU 79 HN LEU 79 -2.628 5.803 -5.940 542 HA LEU 79 HA LEU 79 -1.229 7.312 -3.929 543 HB2 LEU 79 HB2 LEU 79 -3.676 7.824 -5.600 544 HB3 LEU 79 HB1 LEU 79 -3.134 8.939 -4.363 545 HG LEU 79 HG LEU 79 -2.502 9.548 -6.686 546 HD11 LEU 79 HD11 LEU 79 -0.220 9.057 -4.788 547 HD12 LEU 79 HD12 LEU 79 -1.303 10.448 -4.775 548 HD13 LEU 79 HD13 LEU 79 -0.212 10.194 -6.137 549 HD21 LEU 79 HD21 LEU 79 -2.022 7.355 -7.592 550 HD22 LEU 79 HD22 LEU 79 -0.648 7.192 -6.500 551 HD23 LEU 79 HD23 LEU 79 -0.631 8.424 -7.762 552 H VAL 80 HN VAL 80 -3.933 5.181 -4.000 553 HA VAL 80 HA VAL 80 -4.674 6.074 -1.290 554 HB VAL 80 HB VAL 80 -6.632 5.026 -3.327 555 HG11 VAL 80 HG11 VAL 80 -8.320 5.840 -1.762 556 HG12 VAL 80 HG12 VAL 80 -7.043 6.340 -0.654 557 HG13 VAL 80 HG13 VAL 80 -7.271 4.631 -1.023 558 HG21 VAL 80 HG21 VAL 80 -5.896 7.139 -4.153 559 HG22 VAL 80 HG22 VAL 80 -6.014 7.869 -2.554 560 HG23 VAL 80 HG23 VAL 80 -7.477 7.381 -3.410 561 H GLY 81 HN GLY 81 -3.877 4.478 -0.036 562 HA2 GLY 81 HA2 GLY 81 -3.974 1.733 -1.031 563 HA3 GLY 81 HA1 GLY 81 -3.089 2.288 0.376 564 H ILE 82 HN ILE 82 -5.466 0.340 -0.483 565 HA ILE 82 HA ILE 82 -7.431 1.059 1.531 566 HB ILE 82 HB ILE 82 -7.296 -1.083 -0.577 567 HG12 ILE 82 HG12 ILE 82 -9.536 -0.155 -1.162 568 HG13 ILE 82 HG11 ILE 82 -9.331 1.044 0.105 569 HG21 ILE 82 HG21 ILE 82 -8.039 -2.265 1.376 570 HG22 ILE 82 HG22 ILE 82 -9.410 -2.016 0.293 571 HG23 ILE 82 HG23 ILE 82 -9.226 -1.012 1.730 572 HD11 ILE 82 HD11 ILE 82 -7.384 1.931 -1.053 573 HD12 ILE 82 HD12 ILE 82 -8.827 1.972 -2.069 574 HD13 ILE 82 HD13 ILE 82 -7.601 0.729 -2.328 575 H ASN 83 HN ASN 83 -7.110 0.521 3.541 576 HA ASN 83 HA ASN 83 -6.672 -0.704 5.414 577 HB2 ASN 83 HB2 ASN 83 -6.988 -2.907 3.385 578 HB3 ASN 83 HB1 ASN 83 -6.687 -3.252 5.079 579 HD21 ASN 83 HD21 ASN 83 -8.994 -3.873 3.409 580 HD22 ASN 83 HD22 ASN 83 -10.345 -3.148 4.203 581 H CYS 84 HN CYS 84 -4.495 0.468 4.187 582 HA CYS 84 HA CYS 84 -2.369 -1.463 3.968 583 HB2 CYS 84 HB2 CYS 84 -2.730 1.174 3.082 584 HB3 CYS 84 HB1 CYS 84 -1.460 1.243 4.272 585 H THR 85 HN THR 85 -1.679 -2.403 5.738 586 HA THR 85 HA THR 85 -1.500 -0.903 8.236 587 HB THR 85 HB THR 85 -0.827 -3.813 7.753 588 HG1 THR 85 HG1 THR 85 -2.911 -4.149 7.631 589 HG21 THR 85 HG21 THR 85 -1.279 -4.024 10.164 590 HG22 THR 85 HG22 THR 85 -1.552 -2.285 10.255 591 HG23 THR 85 HG23 THR 85 0.045 -2.905 9.841 592 HA PRO 86 HA PRO 86 2.797 0.039 7.482 593 HB2 PRO 86 HB2 PRO 86 2.883 0.258 10.438 594 HB3 PRO 86 HB1 PRO 86 3.326 1.448 9.211 595 HG2 PRO 86 HG2 PRO 86 1.087 1.736 10.614 596 HG3 PRO 86 HG1 PRO 86 1.119 2.115 8.882 597 HD2 PRO 86 HD2 PRO 86 0.066 -0.321 10.264 598 HD3 PRO 86 HD1 PRO 86 -0.638 0.621 8.936 599 H ILE 87 HN ILE 87 3.994 -1.664 6.963 600 HA ILE 87 HA ILE 87 3.985 -4.068 8.479 601 HB ILE 87 HB ILE 87 5.828 -4.682 6.771 602 HG12 ILE 87 HG12 ILE 87 4.651 -2.267 5.394 603 HG13 ILE 87 HG11 ILE 87 6.246 -2.289 6.128 604 HG21 ILE 87 HG21 ILE 87 3.562 -5.537 6.705 605 HG22 ILE 87 HG22 ILE 87 4.118 -5.153 5.076 606 HG23 ILE 87 HG23 ILE 87 3.010 -4.063 5.910 607 HD11 ILE 87 HD11 ILE 87 6.372 -2.606 3.728 608 HD12 ILE 87 HD12 ILE 87 5.319 -4.015 3.846 609 HD13 ILE 87 HD13 ILE 87 6.924 -4.052 4.575 610 HA PRO 88 HA PRO 88 7.330 -3.217 11.203 611 HB2 PRO 88 HB2 PRO 88 7.852 -6.107 11.200 612 HB3 PRO 88 HB1 PRO 88 7.341 -5.070 12.527 613 HG2 PRO 88 HG2 PRO 88 5.667 -6.832 11.452 614 HG3 PRO 88 HG1 PRO 88 5.102 -5.223 11.950 615 HD2 PRO 88 HD2 PRO 88 5.862 -6.187 9.213 616 HD3 PRO 88 HD1 PRO 88 4.416 -5.292 9.720 617 H LEU 89 HN LEU 89 9.578 -3.256 11.367 618 HA LEU 89 HA LEU 89 10.929 -3.638 8.813 619 HB2 LEU 89 HB2 LEU 89 11.945 -2.453 11.392 620 HB3 LEU 89 HB1 LEU 89 12.742 -2.371 9.830 621 HG LEU 89 HG LEU 89 10.125 -1.051 10.552 622 HD11 LEU 89 HD11 LEU 89 12.096 0.006 11.545 623 HD12 LEU 89 HD12 LEU 89 11.351 1.023 10.314 624 HD13 LEU 89 HD13 LEU 89 12.827 0.131 9.944 625 HD21 LEU 89 HD21 LEU 89 10.285 -0.010 8.334 626 HD22 LEU 89 HD22 LEU 89 10.111 -1.760 8.232 627 HD23 LEU 89 HD23 LEU 89 11.688 -1.015 7.972 628 H ILE 90 HN ILE 90 10.136 -5.915 10.538 629 HA ILE 90 HA ILE 90 12.808 -6.958 11.144 630 HB ILE 90 HB ILE 90 11.749 -8.249 13.015 631 HG12 ILE 90 HG12 ILE 90 9.491 -6.268 12.641 632 HG13 ILE 90 HG11 ILE 90 9.388 -7.984 12.267 633 HG21 ILE 90 HG21 ILE 90 11.808 -5.235 13.120 634 HG22 ILE 90 HG22 ILE 90 13.126 -6.352 13.490 635 HG23 ILE 90 HG23 ILE 90 11.716 -6.273 14.546 636 HD11 ILE 90 HD11 ILE 90 9.772 -8.512 14.621 637 HD12 ILE 90 HD12 ILE 90 8.352 -7.490 14.398 638 HD13 ILE 90 HD13 ILE 90 9.860 -6.789 14.987 Start of MODEL 2 1 H1 GLY 1 HT1 GLY 1 6.652 -13.792 -6.774 2 H2 GLY 1 HT2 GLY 1 8.305 -13.752 -7.137 3 H3 GLY 1 HT3 GLY 1 7.191 -13.045 -8.192 4 HA2 GLY 1 HA1 GLY 1 7.751 -12.135 -5.430 5 HA3 GLY 1 HA2 GLY 1 8.356 -11.372 -6.894 6 H SER 2 HN SER 2 6.460 -10.551 -4.659 7 HA SER 2 HA SER 2 4.004 -10.029 -6.128 8 HB2 SER 2 HB2 SER 2 4.750 -9.126 -3.338 9 HB3 SER 2 HB1 SER 2 3.133 -9.231 -4.036 10 HG SER 2 HG SER 2 3.968 -11.613 -4.303 11 H GLY 3 HN GLY 3 6.324 -8.812 -7.220 12 HA2 GLY 3 HA2 GLY 3 6.839 -6.747 -8.136 13 HA3 GLY 3 HA1 GLY 3 5.522 -6.046 -7.207 14 H TRP 4 HN TRP 4 5.990 -6.123 -4.750 15 HA TRP 4 HA TRP 4 8.597 -4.892 -4.329 16 HB2 TRP 4 HB2 TRP 4 6.087 -5.028 -2.664 17 HB3 TRP 4 HB1 TRP 4 7.607 -4.410 -2.026 18 HD1 TRP 4 HD1 TRP 4 4.608 -3.346 -3.954 19 HE1 TRP 4 HE1 TRP 4 4.922 -0.933 -4.798 20 HE3 TRP 4 HE3 TRP 4 9.595 -2.814 -3.006 21 HZ2 TRP 4 HZ2 TRP 4 7.025 0.939 -5.035 22 HZ3 TRP 4 HZ3 TRP 4 10.688 -0.685 -3.572 23 HH2 TRP 4 HH2 TRP 4 9.428 1.153 -4.567 24 H GLU 5 HN GLU 5 10.135 -5.693 -3.018 25 HA GLU 5 HA GLU 5 10.378 -8.434 -2.685 26 HB2 GLU 5 HB2 GLU 5 12.172 -6.644 -2.761 27 HB3 GLU 5 HB1 GLU 5 11.801 -6.330 -1.072 28 HG2 GLU 5 HG2 GLU 5 12.337 -8.681 -0.560 29 HG3 GLU 5 HG1 GLU 5 12.802 -8.889 -2.249 30 H SER 6 HN SER 6 9.146 -9.644 -1.430 31 HA SER 6 HA SER 6 7.934 -8.547 0.973 32 HB2 SER 6 HB2 SER 6 6.678 -10.772 0.894 33 HB3 SER 6 HB1 SER 6 6.395 -9.661 -0.448 34 HG SER 6 HG SER 6 6.854 -11.955 -0.965 35 H LYS 7 HN LYS 7 10.792 -9.205 0.899 36 HA LYS 7 HA LYS 7 11.423 -11.663 2.022 37 HB2 LYS 7 HB2 LYS 7 13.543 -10.623 2.720 38 HB3 LYS 7 HB1 LYS 7 13.116 -10.225 1.064 39 HG2 LYS 7 HG2 LYS 7 13.738 -8.168 1.746 40 HG3 LYS 7 HG1 LYS 7 12.058 -8.107 2.259 41 HD2 LYS 7 HD2 LYS 7 13.071 -7.385 4.172 42 HD3 LYS 7 HD1 LYS 7 13.056 -9.120 4.479 43 HE2 LYS 7 HE2 LYS 7 15.367 -7.609 3.279 44 HE3 LYS 7 HE1 LYS 7 15.228 -8.024 4.983 45 HZ1 LYS 7 HZ1 LYS 7 16.601 -9.636 3.946 46 HZ2 LYS 7 HZ2 LYS 7 15.497 -9.892 2.693 47 HZ3 LYS 7 HZ3 LYS 7 15.124 -10.393 4.264 48 H THR 8 HN THR 8 10.057 -8.866 3.558 49 HA THR 8 HA THR 8 10.778 -9.635 6.221 50 HB THR 8 HB THR 8 8.895 -7.926 6.778 51 HG1 THR 8 HG1 THR 8 8.999 -6.476 4.674 52 HG21 THR 8 HG21 THR 8 11.372 -7.062 5.283 53 HG22 THR 8 HG22 THR 8 11.293 -7.465 6.998 54 HG23 THR 8 HG23 THR 8 10.425 -6.060 6.380 55 H GLY 9 HN GLY 9 8.118 -10.253 4.065 56 HA2 GLY 9 HA2 GLY 9 6.409 -11.793 4.209 57 HA3 GLY 9 HA1 GLY 9 7.091 -12.337 5.735 58 H SER 10 HN SER 10 6.500 -8.998 5.493 59 HA SER 10 HA SER 10 4.710 -9.122 7.716 60 HB2 SER 10 HB2 SER 10 4.760 -6.589 7.383 61 HB3 SER 10 HB1 SER 10 6.293 -7.370 7.738 62 HG SER 10 HG SER 10 6.866 -6.285 6.013 63 H CYS 11 HN CYS 11 4.339 -8.831 4.310 64 HA CYS 11 HA CYS 11 1.656 -7.683 4.615 65 HB2 CYS 11 HB2 CYS 11 3.300 -6.546 3.111 66 HB3 CYS 11 HB1 CYS 11 3.300 -7.984 2.095 67 H ASN 12 HN ASN 12 -0.144 -8.660 3.783 68 HA ASN 12 HA ASN 12 0.104 -11.535 3.406 69 HB2 ASN 12 HB2 ASN 12 -2.284 -11.641 3.791 70 HB3 ASN 12 HB1 ASN 12 -1.542 -10.648 5.037 71 HD21 ASN 12 HD21 ASN 12 -1.918 -8.406 5.022 72 HD22 ASN 12 HD22 ASN 12 -3.229 -7.714 4.129 73 H THR 13 HN THR 13 -0.728 -8.689 1.576 74 HA THR 13 HA THR 13 -1.708 -10.328 -0.646 75 HB THR 13 HB THR 13 -2.244 -8.019 -1.624 76 HG1 THR 13 HG1 THR 13 -2.304 -6.337 -0.068 77 HG21 THR 13 HG21 THR 13 -4.283 -7.801 -0.259 78 HG22 THR 13 HG22 THR 13 -3.593 -8.905 0.934 79 HG23 THR 13 HG23 THR 13 -3.962 -9.480 -0.693 80 H GLY 14 HN GLY 14 0.885 -8.178 0.277 81 HA2 GLY 14 HA2 GLY 14 3.050 -8.362 -0.728 82 HA3 GLY 14 HA1 GLY 14 2.271 -8.872 -2.218 83 H LYS 15 HN LYS 15 0.396 -6.444 -1.163 84 HA LYS 15 HA LYS 15 1.632 -4.553 -2.984 85 HB2 LYS 15 HB2 LYS 15 -0.963 -4.391 -1.436 86 HB3 LYS 15 HB1 LYS 15 -0.423 -3.215 -2.625 87 HG2 LYS 15 HG2 LYS 15 -0.426 -5.047 -4.323 88 HG3 LYS 15 HG1 LYS 15 -1.163 -6.093 -3.108 89 HD2 LYS 15 HD2 LYS 15 -3.078 -4.610 -2.951 90 HD3 LYS 15 HD1 LYS 15 -2.323 -3.485 -4.079 91 HE2 LYS 15 HE2 LYS 15 -2.304 -5.317 -5.763 92 HE3 LYS 15 HE1 LYS 15 -3.270 -6.279 -4.648 93 HZ1 LYS 15 HZ1 LYS 15 -4.063 -3.658 -5.784 94 HZ2 LYS 15 HZ2 LYS 15 -5.012 -4.634 -4.782 95 HZ3 LYS 15 HZ3 LYS 15 -4.606 -5.160 -6.338 96 H LEU 16 HN LEU 16 3.471 -3.948 -1.829 97 HA LEU 16 HA LEU 16 3.132 -2.620 0.727 98 HB2 LEU 16 HB2 LEU 16 5.520 -3.397 -0.922 99 HB3 LEU 16 HB1 LEU 16 5.672 -2.302 0.431 100 HG LEU 16 HG LEU 16 4.719 -4.077 1.900 101 HD11 LEU 16 HD11 LEU 16 3.527 -5.368 0.286 102 HD12 LEU 16 HD12 LEU 16 4.756 -6.384 1.045 103 HD13 LEU 16 HD13 LEU 16 5.020 -5.741 -0.578 104 HD21 LEU 16 HD21 LEU 16 7.115 -3.699 1.795 105 HD22 LEU 16 HD22 LEU 16 7.238 -4.767 0.397 106 HD23 LEU 16 HD23 LEU 16 6.771 -5.420 1.966 107 H ALA 17 HN ALA 17 2.429 -0.579 0.641 108 HA ALA 17 HA ALA 17 3.623 1.172 -1.409 109 HB1 ALA 17 HB1 ALA 17 0.943 1.449 -0.049 110 HB2 ALA 17 HB2 ALA 17 1.224 0.990 -1.729 111 HB3 ALA 17 HB3 ALA 17 1.642 2.617 -1.174 112 H CYS 18 HN CYS 18 4.373 3.166 -0.790 113 HA CYS 18 HA CYS 18 4.926 3.533 2.030 114 HB2 CYS 18 HB2 CYS 18 5.730 5.045 -0.451 115 HB3 CYS 18 HB1 CYS 18 6.132 5.600 1.169 116 H CYS 19 HN CYS 19 3.325 4.329 3.217 117 HA CYS 19 HA CYS 19 1.580 6.356 1.992 118 HB2 CYS 19 HB2 CYS 19 0.774 4.155 3.892 119 HB3 CYS 19 HB1 CYS 19 -0.296 5.385 3.232 120 H ASP 20 HN ASP 20 0.663 7.905 3.361 121 HA ASP 20 HA ASP 20 2.081 8.292 5.900 122 HB2 ASP 20 HB2 ASP 20 0.483 10.151 4.153 123 HB3 ASP 20 HB1 ASP 20 0.883 10.565 5.808 124 H THR 21 HN THR 21 1.092 7.537 7.623 125 HA THR 21 HA THR 21 -1.655 6.751 7.550 126 HB THR 21 HB THR 21 -1.277 6.147 9.956 127 HG1 THR 21 HG1 THR 21 0.384 7.092 10.872 128 HG21 THR 21 HG21 THR 21 -0.910 4.514 8.183 129 HG22 THR 21 HG22 THR 21 0.282 4.308 9.466 130 HG23 THR 21 HG23 THR 21 0.737 5.105 7.960 131 H ASN 22 HN ASN 22 -0.171 9.682 8.059 132 HA ASN 22 HA ASN 22 -2.253 10.679 9.865 133 HB2 ASN 22 HB2 ASN 22 0.294 11.942 8.824 134 HB3 ASN 22 HB1 ASN 22 -0.892 12.800 9.800 135 HD21 ASN 22 HD21 ASN 22 1.906 12.185 10.345 136 HD22 ASN 22 HD22 ASN 22 1.918 11.294 11.829 137 H LYS 23 HN LYS 23 -1.662 10.181 6.689 138 HA LYS 23 HA LYS 23 -3.336 12.436 5.819 139 HB2 LYS 23 HB2 LYS 23 -1.302 10.775 4.332 140 HB3 LYS 23 HB1 LYS 23 -2.408 11.872 3.540 141 HG2 LYS 23 HG2 LYS 23 -1.455 13.734 4.805 142 HG3 LYS 23 HG1 LYS 23 -0.306 12.625 5.554 143 HD2 LYS 23 HD2 LYS 23 0.819 13.697 3.752 144 HD3 LYS 23 HD1 LYS 23 0.457 12.053 3.224 145 HE2 LYS 23 HE2 LYS 23 -1.636 13.001 2.172 146 HE3 LYS 23 HE1 LYS 23 -0.959 14.595 2.478 147 HZ1 LYS 23 HZ1 LYS 23 0.985 13.960 1.154 148 HZ2 LYS 23 HZ2 LYS 23 -0.444 13.911 0.250 149 HZ3 LYS 23 HZ3 LYS 23 0.260 12.473 0.796 150 H LYS 24 HN LYS 24 -5.323 11.695 5.961 151 HA LYS 24 HA LYS 24 -5.901 8.948 5.149 152 HB2 LYS 24 HB2 LYS 24 -7.455 10.977 6.722 153 HB3 LYS 24 HB1 LYS 24 -8.121 9.428 6.242 154 HG2 LYS 24 HG2 LYS 24 -7.448 9.114 8.444 155 HG3 LYS 24 HG1 LYS 24 -6.148 8.398 7.497 156 HD2 LYS 24 HD2 LYS 24 -5.259 9.714 9.342 157 HD3 LYS 24 HD1 LYS 24 -4.818 10.436 7.795 158 HE2 LYS 24 HE2 LYS 24 -5.538 12.098 9.486 159 HE3 LYS 24 HE1 LYS 24 -6.529 12.112 8.030 160 HZ1 LYS 24 HZ1 LYS 24 -7.261 10.726 10.549 161 HZ2 LYS 24 HZ2 LYS 24 -8.228 10.891 9.171 162 HZ3 LYS 24 HZ3 LYS 24 -7.829 12.251 10.092 163 H VAL 25 HN VAL 25 -7.759 8.524 3.870 164 HA VAL 25 HA VAL 25 -8.568 10.759 2.126 165 HB VAL 25 HB VAL 25 -8.534 7.871 1.273 166 HG11 VAL 25 HG11 VAL 25 -9.998 9.317 0.002 167 HG12 VAL 25 HG12 VAL 25 -8.627 8.810 -0.985 168 HG13 VAL 25 HG13 VAL 25 -8.666 10.433 -0.297 169 HG21 VAL 25 HG21 VAL 25 -6.233 8.475 1.796 170 HG22 VAL 25 HG22 VAL 25 -6.367 9.922 0.800 171 HG23 VAL 25 HG23 VAL 25 -6.448 8.327 0.053 172 H GLN 26 HN GLN 26 -10.761 10.812 1.557 173 HA GLN 26 HA GLN 26 -12.450 9.520 3.547 174 HB2 GLN 26 HB2 GLN 26 -12.841 11.897 1.747 175 HB3 GLN 26 HB1 GLN 26 -14.130 11.215 2.719 176 HG2 GLN 26 HG2 GLN 26 -12.872 11.657 4.744 177 HG3 GLN 26 HG1 GLN 26 -11.538 12.291 3.782 178 HE21 GLN 26 HE21 GLN 26 -11.628 14.285 4.763 179 HE22 GLN 26 HE22 GLN 26 -12.896 15.419 4.456 180 H LYS 27 HN LYS 27 -11.475 8.079 1.213 181 HA LYS 27 HA LYS 27 -14.075 7.337 0.073 182 HB2 LYS 27 HB2 LYS 27 -11.437 7.497 -1.399 183 HB3 LYS 27 HB1 LYS 27 -12.900 6.783 -2.057 184 HG2 LYS 27 HG2 LYS 27 -13.002 9.592 -1.090 185 HG3 LYS 27 HG1 LYS 27 -12.196 9.252 -2.619 186 HD2 LYS 27 HD2 LYS 27 -14.481 9.830 -3.075 187 HD3 LYS 27 HD1 LYS 27 -14.272 8.109 -3.391 188 HE2 LYS 27 HE2 LYS 27 -15.330 7.547 -1.309 189 HE3 LYS 27 HE1 LYS 27 -15.398 9.243 -0.833 190 HZ1 LYS 27 HZ1 LYS 27 -17.530 8.458 -1.653 191 HZ2 LYS 27 HZ2 LYS 27 -16.836 8.030 -3.132 192 HZ3 LYS 27 HZ3 LYS 27 -16.908 9.656 -2.673 193 H SER 28 HN SER 28 -14.145 5.088 -0.678 194 HA SER 28 HA SER 28 -12.034 3.339 0.262 195 HB2 SER 28 HB2 SER 28 -13.867 1.916 1.433 196 HB3 SER 28 HB1 SER 28 -13.224 3.324 2.277 197 HG SER 28 HG SER 28 -15.615 3.260 0.741 198 H THR 29 HN THR 29 -12.161 3.467 -2.195 199 HA THR 29 HA THR 29 -13.928 1.308 -3.138 200 HB THR 29 HB THR 29 -12.827 3.506 -4.890 201 HG1 THR 29 HG1 THR 29 -14.997 3.513 -3.137 202 HG21 THR 29 HG21 THR 29 -15.161 1.618 -5.212 203 HG22 THR 29 HG22 THR 29 -13.594 1.454 -6.004 204 HG23 THR 29 HG23 THR 29 -14.636 2.826 -6.384 205 H GLY 30 HN GLY 30 -12.962 -0.261 -4.482 206 HA2 GLY 30 HA2 GLY 30 -10.012 -0.145 -4.480 207 HA3 GLY 30 HA1 GLY 30 -10.918 -1.621 -4.189 208 H GLU 31 HN GLU 31 -8.888 -0.974 -6.206 209 HA GLU 31 HA GLU 31 -10.245 -0.901 -8.741 210 HB2 GLU 31 HB2 GLU 31 -7.372 -1.435 -7.977 211 HB3 GLU 31 HB1 GLU 31 -7.945 -1.405 -9.639 212 HG2 GLU 31 HG2 GLU 31 -8.182 0.901 -7.724 213 HG3 GLU 31 HG1 GLU 31 -6.873 0.699 -8.888 214 H GLU 32 HN GLU 32 -8.741 -3.331 -6.680 215 HA GLU 32 HA GLU 32 -9.821 -5.410 -8.447 216 HB2 GLU 32 HB2 GLU 32 -7.566 -5.564 -6.448 217 HB3 GLU 32 HB1 GLU 32 -8.223 -6.951 -7.306 218 HG2 GLU 32 HG2 GLU 32 -7.587 -5.897 -9.438 219 HG3 GLU 32 HG1 GLU 32 -6.863 -4.566 -8.536 220 H SER 33 HN SER 33 -9.420 -4.412 -5.082 221 HA SER 33 HA SER 33 -11.055 -6.440 -3.961 222 HB2 SER 33 HB2 SER 33 -9.458 -5.060 -2.651 223 HB3 SER 33 HB1 SER 33 -10.495 -3.656 -2.898 224 HG SER 33 HG SER 33 -11.167 -4.408 -0.993 225 H GLY 34 HN GLY 34 -11.731 -3.491 -5.625 226 HA2 GLY 34 HA2 GLY 34 -14.361 -3.037 -4.648 227 HA3 GLY 34 HA1 GLY 34 -13.672 -2.370 -6.119 228 H LEU 35 HN LEU 35 -13.115 -5.348 -6.849 229 HA LEU 35 HA LEU 35 -15.598 -5.778 -8.247 230 HB2 LEU 35 HB2 LEU 35 -12.990 -7.257 -8.092 231 HB3 LEU 35 HB1 LEU 35 -14.390 -8.008 -8.828 232 HG LEU 35 HG LEU 35 -14.508 -6.134 -10.452 233 HD11 LEU 35 HD11 LEU 35 -11.897 -5.297 -9.205 234 HD12 LEU 35 HD12 LEU 35 -13.419 -4.409 -9.127 235 HD13 LEU 35 HD13 LEU 35 -12.602 -4.628 -10.675 236 HD21 LEU 35 HD21 LEU 35 -12.569 -6.821 -11.770 237 HD22 LEU 35 HD22 LEU 35 -13.372 -8.205 -11.029 238 HD23 LEU 35 HD23 LEU 35 -11.870 -7.587 -10.343 239 H LEU 36 HN LEU 36 -14.014 -6.950 -5.397 240 HA LEU 36 HA LEU 36 -16.026 -8.974 -4.896 241 HB2 LEU 36 HB2 LEU 36 -13.635 -8.053 -3.299 242 HB3 LEU 36 HB1 LEU 36 -14.655 -9.412 -2.900 243 HG LEU 36 HG LEU 36 -12.909 -9.193 -5.346 244 HD11 LEU 36 HD11 LEU 36 -12.631 -10.855 -2.850 245 HD12 LEU 36 HD12 LEU 36 -11.629 -9.476 -3.301 246 HD13 LEU 36 HD13 LEU 36 -11.592 -10.948 -4.271 247 HD21 LEU 36 HD21 LEU 36 -13.482 -11.552 -5.694 248 HD22 LEU 36 HD22 LEU 36 -14.899 -10.510 -5.799 249 HD23 LEU 36 HD23 LEU 36 -14.617 -11.470 -4.347 250 H HIS 37 HN HIS 37 -16.880 -8.950 -2.550 251 HA HIS 37 HA HIS 37 -18.131 -6.405 -2.045 252 HB2 HIS 37 HB2 HIS 37 -18.266 -9.074 -0.637 253 HB3 HIS 37 HB1 HIS 37 -19.098 -7.645 -0.034 254 HD1 HIS 37 HD1 HIS 37 -21.449 -7.509 -0.761 255 HD2 HIS 37 HD2 HIS 37 -19.114 -9.577 -3.506 256 HE1 HIS 37 HE1 HIS 37 -23.026 -8.243 -2.571 257 HE2 HIS 37 HE2 HIS 37 -21.562 -9.345 -4.297 258 H THR 38 HN THR 38 -15.187 -7.645 -1.396 259 HA THR 38 HA THR 38 -14.714 -6.752 1.258 260 HB THR 38 HB THR 38 -12.634 -7.105 -0.897 261 HG1 THR 38 HG1 THR 38 -14.314 -8.969 0.315 262 HG21 THR 38 HG21 THR 38 -11.270 -7.902 1.008 263 HG22 THR 38 HG22 THR 38 -12.607 -7.529 2.095 264 HG23 THR 38 HG23 THR 38 -11.801 -6.234 1.209 265 H GLY 39 HN GLY 39 -14.597 -5.292 -1.905 266 HA2 GLY 39 HA2 GLY 39 -13.360 -2.858 -0.849 267 HA3 GLY 39 HA1 GLY 39 -13.670 -3.214 -2.543 268 H ASP 40 HN ASP 40 -16.302 -4.033 -0.699 269 HA ASP 40 HA ASP 40 -17.883 -1.848 -1.720 270 HB2 ASP 40 HB2 ASP 40 -18.700 -4.212 -1.554 271 HB3 ASP 40 HB1 ASP 40 -18.661 -4.061 0.192 272 H VAL 41 HN VAL 41 -16.851 -3.062 1.392 273 HA VAL 41 HA VAL 41 -18.328 -1.375 3.044 274 HB VAL 41 HB VAL 41 -16.459 -1.930 4.744 275 HG11 VAL 41 HG11 VAL 41 -17.340 -4.246 4.958 276 HG12 VAL 41 HG12 VAL 41 -18.106 -4.067 3.378 277 HG13 VAL 41 HG13 VAL 41 -18.609 -3.044 4.725 278 HG21 VAL 41 HG21 VAL 41 -14.724 -2.470 3.113 279 HG22 VAL 41 HG22 VAL 41 -15.707 -3.793 2.488 280 HG23 VAL 41 HG23 VAL 41 -15.083 -3.859 4.136 281 H LEU 42 HN LEU 42 -17.932 0.468 4.114 282 HA LEU 42 HA LEU 42 -15.973 2.296 3.090 283 HB2 LEU 42 HB2 LEU 42 -17.902 2.554 5.384 284 HB3 LEU 42 HB1 LEU 42 -17.020 3.853 4.638 285 HG LEU 42 HG LEU 42 -19.151 2.215 3.275 286 HD11 LEU 42 HD11 LEU 42 -20.082 3.622 5.023 287 HD12 LEU 42 HD12 LEU 42 -20.504 4.248 3.430 288 HD13 LEU 42 HD13 LEU 42 -19.229 5.021 4.370 289 HD21 LEU 42 HD21 LEU 42 -19.013 3.928 1.525 290 HD22 LEU 42 HD22 LEU 42 -17.495 3.048 1.704 291 HD23 LEU 42 HD23 LEU 42 -17.656 4.673 2.371 292 H ASP 43 HN ASP 43 -16.034 -0.137 5.352 293 HA ASP 43 HA ASP 43 -14.572 0.921 7.512 294 HB2 ASP 43 HB2 ASP 43 -14.860 -1.905 6.486 295 HB3 ASP 43 HB1 ASP 43 -13.987 -1.502 7.958 296 H GLN 44 HN GLN 44 -13.606 -0.255 4.389 297 HA GLN 44 HA GLN 44 -10.964 -0.849 4.741 298 HB2 GLN 44 HB2 GLN 44 -11.908 0.828 2.448 299 HB3 GLN 44 HB1 GLN 44 -10.582 -0.307 2.469 300 HG2 GLN 44 HG2 GLN 44 -12.183 -2.149 2.760 301 HG3 GLN 44 HG1 GLN 44 -13.501 -0.984 2.643 302 HE21 GLN 44 HE21 GLN 44 -13.843 0.075 0.677 303 HE22 GLN 44 HE22 GLN 44 -13.298 -0.595 -0.815 304 H VAL 45 HN VAL 45 -9.168 0.203 5.165 305 HA VAL 45 HA VAL 45 -9.384 2.985 5.987 306 HB VAL 45 HB VAL 45 -7.019 1.125 6.287 307 HG11 VAL 45 HG11 VAL 45 -7.703 3.720 7.668 308 HG12 VAL 45 HG12 VAL 45 -6.442 3.484 6.459 309 HG13 VAL 45 HG13 VAL 45 -6.313 2.697 8.031 310 HG21 VAL 45 HG21 VAL 45 -7.766 0.753 8.572 311 HG22 VAL 45 HG22 VAL 45 -8.992 0.221 7.422 312 HG23 VAL 45 HG23 VAL 45 -9.193 1.747 8.282 313 H ALA 46 HN ALA 46 -9.158 4.371 4.402 314 HA ALA 46 HA ALA 46 -7.157 3.865 2.321 315 HB1 ALA 46 HB1 ALA 46 -8.327 5.598 1.051 316 HB2 ALA 46 HB2 ALA 46 -9.431 5.835 2.408 317 HB3 ALA 46 HB3 ALA 46 -9.415 4.298 1.544 318 H ILE 47 HN ILE 47 -5.258 4.742 2.658 319 HA ILE 47 HA ILE 47 -5.184 7.478 3.734 320 HB ILE 47 HB ILE 47 -2.805 6.945 4.448 321 HG12 ILE 47 HG12 ILE 47 -3.813 4.111 4.104 322 HG13 ILE 47 HG11 ILE 47 -2.482 4.859 3.225 323 HG21 ILE 47 HG21 ILE 47 -3.530 5.948 6.576 324 HG22 ILE 47 HG22 ILE 47 -5.094 5.574 5.847 325 HG23 ILE 47 HG23 ILE 47 -4.592 7.254 6.043 326 HD11 ILE 47 HD11 ILE 47 -2.566 4.265 6.175 327 HD12 ILE 47 HD12 ILE 47 -1.246 5.082 5.339 328 HD13 ILE 47 HD13 ILE 47 -1.630 3.406 4.952 329 H GLN 48 HN GLN 48 -3.490 8.821 2.909 330 HA GLN 48 HA GLN 48 -3.302 8.530 0.040 331 HB2 GLN 48 HB2 GLN 48 -3.656 10.668 1.593 332 HB3 GLN 48 HB1 GLN 48 -1.908 10.699 1.544 333 HG2 GLN 48 HG2 GLN 48 -3.715 10.773 -0.859 334 HG3 GLN 48 HG1 GLN 48 -2.944 12.163 -0.118 335 HE21 GLN 48 HE21 GLN 48 -2.579 9.481 -2.195 336 HE22 GLN 48 HE22 GLN 48 -0.955 9.803 -2.698 337 H CYS 49 HN CYS 49 -1.723 7.788 -1.040 338 HA CYS 49 HA CYS 49 0.759 7.087 0.369 339 HB2 CYS 49 HB2 CYS 49 -0.732 5.436 -1.675 340 HB3 CYS 49 HB1 CYS 49 0.742 4.984 -0.844 341 H THR 50 HN THR 50 2.617 6.778 -1.028 342 HA THR 50 HA THR 50 2.500 7.677 -3.739 343 HB THR 50 HB THR 50 2.357 9.860 -2.650 344 HG1 THR 50 HG1 THR 50 3.516 10.370 -4.336 345 HG21 THR 50 HG21 THR 50 4.199 10.699 -1.278 346 HG22 THR 50 HG22 THR 50 4.978 9.118 -1.358 347 HG23 THR 50 HG23 THR 50 3.430 9.297 -0.535 348 H GLN 51 HN GLN 51 4.251 6.994 -4.873 349 HA GLN 51 HA GLN 51 6.473 5.929 -3.286 350 HB2 GLN 51 HB2 GLN 51 4.752 4.552 -5.062 351 HB3 GLN 51 HB1 GLN 51 6.366 4.560 -5.758 352 HG2 GLN 51 HG2 GLN 51 5.652 3.637 -2.985 353 HG3 GLN 51 HG1 GLN 51 5.962 2.585 -4.364 354 HE21 GLN 51 HE21 GLN 51 7.334 2.676 -1.816 355 HE22 GLN 51 HE22 GLN 51 8.990 3.019 -2.169 356 H ILE 52 HN ILE 52 8.502 5.985 -4.187 357 HA ILE 52 HA ILE 52 8.976 8.186 -6.034 358 HB ILE 52 HB ILE 52 10.720 6.561 -4.178 359 HG12 ILE 52 HG12 ILE 52 9.908 9.461 -4.292 360 HG13 ILE 52 HG11 ILE 52 9.444 8.269 -3.088 361 HG21 ILE 52 HG21 ILE 52 11.717 8.747 -6.000 362 HG22 ILE 52 HG22 ILE 52 11.963 7.025 -6.285 363 HG23 ILE 52 HG23 ILE 52 12.661 7.793 -4.860 364 HD11 ILE 52 HD11 ILE 52 12.194 9.411 -3.514 365 HD12 ILE 52 HD12 ILE 52 11.797 8.139 -2.362 366 HD13 ILE 52 HD13 ILE 52 11.101 9.748 -2.173 367 HA PRO 53 HA PRO 53 9.404 5.971 -9.835 368 HB2 PRO 53 HB2 PRO 53 12.214 7.003 -9.678 369 HB3 PRO 53 HB1 PRO 53 11.113 6.969 -11.060 370 HG2 PRO 53 HG2 PRO 53 11.494 9.187 -9.564 371 HG3 PRO 53 HG1 PRO 53 9.953 8.817 -10.352 372 HD2 PRO 53 HD2 PRO 53 10.602 8.849 -7.508 373 HD3 PRO 53 HD1 PRO 53 9.016 8.759 -8.293 374 H LEU 54 HN LEU 54 9.448 3.832 -9.690 375 HA LEU 54 HA LEU 54 10.897 2.482 -7.699 376 HB2 LEU 54 HB2 LEU 54 9.510 1.204 -10.042 377 HB3 LEU 54 HB1 LEU 54 9.830 0.493 -8.473 378 HG LEU 54 HG LEU 54 7.839 2.668 -9.109 379 HD11 LEU 54 HD11 LEU 54 6.204 1.032 -8.359 380 HD12 LEU 54 HD12 LEU 54 7.491 -0.136 -8.061 381 HD13 LEU 54 HD13 LEU 54 7.151 0.399 -9.706 382 HD21 LEU 54 HD21 LEU 54 8.880 3.152 -6.973 383 HD22 LEU 54 HD22 LEU 54 8.590 1.498 -6.438 384 HD23 LEU 54 HD23 LEU 54 7.229 2.577 -6.740 385 H LEU 55 HN LEU 55 12.869 1.654 -7.698 386 HA LEU 55 HA LEU 55 14.106 0.852 -10.233 387 HB2 LEU 55 HB2 LEU 55 15.216 0.873 -7.419 388 HB3 LEU 55 HB1 LEU 55 16.119 0.497 -8.871 389 HG LEU 55 HG LEU 55 14.889 3.179 -8.241 390 HD11 LEU 55 HD11 LEU 55 17.768 2.294 -8.189 391 HD12 LEU 55 HD12 LEU 55 16.769 2.642 -6.777 392 HD13 LEU 55 HD13 LEU 55 17.174 3.931 -7.910 393 HD21 LEU 55 HD21 LEU 55 16.695 2.310 -10.491 394 HD22 LEU 55 HD22 LEU 55 16.173 3.962 -10.168 395 HD23 LEU 55 HD23 LEU 55 14.991 2.740 -10.633 396 H ILE 56 HN ILE 56 13.973 -1.234 -10.861 397 HA ILE 56 HA ILE 56 12.491 -3.089 -9.310 398 HB ILE 56 HB ILE 56 14.202 -3.717 -11.703 399 HG12 ILE 56 HG12 ILE 56 11.280 -2.939 -11.619 400 HG13 ILE 56 HG11 ILE 56 12.581 -1.877 -12.144 401 HG21 ILE 56 HG21 ILE 56 11.842 -5.134 -10.486 402 HG22 ILE 56 HG22 ILE 56 13.518 -5.686 -10.488 403 HG23 ILE 56 HG23 ILE 56 12.621 -5.582 -12.003 404 HD11 ILE 56 HD11 ILE 56 11.400 -2.833 -14.034 405 HD12 ILE 56 HD12 ILE 56 11.773 -4.459 -13.461 406 HD13 ILE 56 HD13 ILE 56 13.072 -3.389 -13.990 407 H GLY 57 HN GLY 57 13.108 -4.658 -7.993 408 HA2 GLY 57 HA2 GLY 57 14.543 -6.148 -6.897 409 HA3 GLY 57 HA1 GLY 57 15.897 -5.458 -7.781 410 H ILE 58 HN ILE 58 13.857 -3.143 -6.374 411 HA ILE 58 HA ILE 58 15.823 -2.689 -4.252 412 HB ILE 58 HB ILE 58 14.468 -0.950 -6.110 413 HG12 ILE 58 HG12 ILE 58 16.899 -1.101 -5.710 414 HG13 ILE 58 HG11 ILE 58 16.285 0.541 -5.560 415 HG21 ILE 58 HG21 ILE 58 12.931 -0.421 -4.339 416 HG22 ILE 58 HG22 ILE 58 14.036 0.933 -4.576 417 HG23 ILE 58 HG23 ILE 58 14.264 -0.168 -3.212 418 HD11 ILE 58 HD11 ILE 58 17.908 0.050 -3.826 419 HD12 ILE 58 HD12 ILE 58 16.937 -1.317 -3.282 420 HD13 ILE 58 HD13 ILE 58 16.313 0.323 -3.125 421 H ALA 59 HN ALA 59 15.155 -1.957 -2.243 422 HA ALA 59 HA ALA 59 12.828 -3.333 -1.220 423 HB1 ALA 59 HB1 ALA 59 15.055 -1.790 0.089 424 HB2 ALA 59 HB2 ALA 59 14.930 -3.543 -0.061 425 HB3 ALA 59 HB3 ALA 59 13.793 -2.663 0.962 426 H ILE 60 HN ILE 60 11.019 -2.414 -0.524 427 HA ILE 60 HA ILE 60 10.089 0.090 -1.222 428 HB ILE 60 HB ILE 60 8.675 -1.800 -0.458 429 HG12 ILE 60 HG12 ILE 60 7.154 -0.390 1.097 430 HG13 ILE 60 HG11 ILE 60 8.337 0.894 0.856 431 HG21 ILE 60 HG21 ILE 60 8.356 -1.966 2.083 432 HG22 ILE 60 HG22 ILE 60 9.924 -1.151 2.194 433 HG23 ILE 60 HG23 ILE 60 9.791 -2.708 1.376 434 HD11 ILE 60 HD11 ILE 60 6.765 -0.492 -1.299 435 HD12 ILE 60 HD12 ILE 60 7.962 0.779 -1.550 436 HD13 ILE 60 HD13 ILE 60 6.477 1.129 -0.666 437 H GLU 61 HN GLU 61 11.923 -0.893 1.544 438 HA GLU 61 HA GLU 61 11.335 1.324 3.221 439 HB2 GLU 61 HB2 GLU 61 13.400 -0.855 3.269 440 HB3 GLU 61 HB1 GLU 61 13.261 0.344 4.547 441 HG2 GLU 61 HG2 GLU 61 11.096 -0.450 5.136 442 HG3 GLU 61 HG1 GLU 61 11.029 -1.482 3.708 443 H ASP 62 HN ASP 62 13.730 0.695 0.769 444 HA ASP 62 HA ASP 62 15.274 3.023 1.685 445 HB2 ASP 62 HB2 ASP 62 16.073 0.639 0.029 446 HB3 ASP 62 HB1 ASP 62 17.061 2.095 0.117 447 H GLU 63 HN GLU 63 13.100 2.043 -0.687 448 HA GLU 63 HA GLU 63 14.109 3.694 -2.810 449 HB2 GLU 63 HB2 GLU 63 12.708 1.645 -3.175 450 HB3 GLU 63 HB1 GLU 63 11.342 2.518 -2.495 451 HG2 GLU 63 HG2 GLU 63 11.220 2.565 -4.893 452 HG3 GLU 63 HG1 GLU 63 11.543 4.184 -4.281 453 H CYS 64 HN CYS 64 11.824 4.009 -0.189 454 HA CYS 64 HA CYS 64 11.253 6.753 -1.077 455 HB2 CYS 64 HB2 CYS 64 8.998 6.484 -0.749 456 HB3 CYS 64 HB1 CYS 64 9.417 4.840 -1.214 457 H LYS 65 HN LYS 65 10.316 8.065 0.842 458 HA LYS 65 HA LYS 65 11.753 7.310 3.299 459 HB2 LYS 65 HB2 LYS 65 12.768 9.239 2.008 460 HB3 LYS 65 HB1 LYS 65 11.303 10.145 2.350 461 HG2 LYS 65 HG2 LYS 65 12.957 10.802 3.928 462 HG3 LYS 65 HG1 LYS 65 11.757 9.831 4.782 463 HD2 LYS 65 HD2 LYS 65 13.920 9.148 5.535 464 HD3 LYS 65 HD1 LYS 65 13.278 7.862 4.512 465 HE2 LYS 65 HE2 LYS 65 14.616 8.679 2.640 466 HE3 LYS 65 HE1 LYS 65 15.237 9.985 3.642 467 HZ1 LYS 65 HZ1 LYS 65 16.217 8.298 5.108 468 HZ2 LYS 65 HZ2 LYS 65 16.828 8.209 3.536 469 HZ3 LYS 65 HZ3 LYS 65 15.686 7.082 4.061 470 H ASN 66 HN ASN 66 9.248 6.424 3.012 471 HA ASN 66 HA ASN 66 7.829 8.008 5.017 472 HB2 ASN 66 HB2 ASN 66 6.640 7.041 2.419 473 HB3 ASN 66 HB1 ASN 66 5.644 7.410 3.822 474 HD21 ASN 66 HD21 ASN 66 7.544 8.698 1.247 475 HD22 ASN 66 HD22 ASN 66 7.169 10.363 1.525 476 H THR 67 HN THR 67 5.590 6.363 5.314 477 HA THR 67 HA THR 67 6.877 4.175 6.665 478 HB THR 67 HB THR 67 3.931 4.838 6.631 479 HG1 THR 67 HG1 THR 67 5.880 6.287 7.616 480 HG21 THR 67 HG21 THR 67 4.362 2.582 7.384 481 HG22 THR 67 HG22 THR 67 3.976 3.576 8.791 482 HG23 THR 67 HG23 THR 67 5.653 3.138 8.446 483 HA PRO 68 HA PRO 68 5.959 1.092 3.544 484 HB2 PRO 68 HB2 PRO 68 6.681 -0.799 5.600 485 HB3 PRO 68 HB1 PRO 68 7.544 -0.419 4.114 486 HG2 PRO 68 HG2 PRO 68 8.324 0.233 6.711 487 HG3 PRO 68 HG1 PRO 68 9.004 0.900 5.220 488 HD2 PRO 68 HD2 PRO 68 7.231 2.126 7.183 489 HD3 PRO 68 HD1 PRO 68 8.209 2.887 5.921 490 H THR 69 HN THR 69 3.896 0.417 3.249 491 HA THR 69 HA THR 69 2.502 -0.723 5.574 492 HB THR 69 HB THR 69 0.384 0.279 4.801 493 HG1 THR 69 HG1 THR 69 2.096 1.436 2.849 494 HG21 THR 69 HG21 THR 69 1.652 1.467 6.516 495 HG22 THR 69 HG22 THR 69 0.835 2.608 5.447 496 HG23 THR 69 HG23 THR 69 2.565 2.317 5.268 497 H CYS 70 HN CYS 70 0.963 -2.332 5.108 498 HA CYS 70 HA CYS 70 1.244 -3.585 2.458 499 HB2 CYS 70 HB2 CYS 70 1.796 -5.064 4.304 500 HB3 CYS 70 HB1 CYS 70 0.275 -4.691 5.106 501 H CYS 71 HN CYS 71 -0.306 -2.929 1.105 502 HA CYS 71 HA CYS 71 -2.946 -2.221 2.158 503 HB2 CYS 71 HB2 CYS 71 -1.871 -1.892 -0.649 504 HB3 CYS 71 HB1 CYS 71 -3.323 -1.159 0.019 505 H GLU 72 HN GLU 72 -4.742 -3.369 1.759 506 HA GLU 72 HA GLU 72 -4.537 -5.983 0.663 507 HB2 GLU 72 HB2 GLU 72 -6.122 -5.981 2.295 508 HB3 GLU 72 HB1 GLU 72 -6.588 -4.313 1.997 509 HG2 GLU 72 HG2 GLU 72 -7.970 -4.925 0.211 510 HG3 GLU 72 HG1 GLU 72 -7.327 -6.564 0.169 511 H ASP 73 HN ASP 73 -5.562 -2.858 -0.453 512 HA ASP 73 HA ASP 73 -5.270 -3.753 -3.201 513 HB2 ASP 73 HB2 ASP 73 -7.755 -3.968 -2.533 514 HB3 ASP 73 HB1 ASP 73 -7.759 -2.212 -2.470 515 H VAL 74 HN VAL 74 -5.015 -1.825 -4.650 516 HA VAL 74 HA VAL 74 -4.786 0.719 -3.205 517 HB VAL 74 HB VAL 74 -2.631 0.125 -5.197 518 HG11 VAL 74 HG11 VAL 74 -1.423 1.769 -3.937 519 HG12 VAL 74 HG12 VAL 74 -2.664 1.780 -2.687 520 HG13 VAL 74 HG13 VAL 74 -3.035 2.391 -4.298 521 HG21 VAL 74 HG21 VAL 74 -2.574 -1.765 -3.597 522 HG22 VAL 74 HG22 VAL 74 -2.417 -0.606 -2.277 523 HG23 VAL 74 HG23 VAL 74 -1.148 -0.734 -3.498 524 H GLU 75 HN GLU 75 -5.403 2.469 -4.341 525 HA GLU 75 HA GLU 75 -6.428 1.993 -7.055 526 HB2 GLU 75 HB2 GLU 75 -8.047 2.705 -5.321 527 HB3 GLU 75 HB1 GLU 75 -7.104 4.163 -5.060 528 HG2 GLU 75 HG2 GLU 75 -7.534 4.772 -7.441 529 HG3 GLU 75 HG1 GLU 75 -8.631 3.395 -7.532 530 H ASP 76 HN ASP 76 -6.180 3.661 -8.647 531 HA ASP 76 HA ASP 76 -5.123 5.284 -9.844 532 HB2 ASP 76 HB2 ASP 76 -5.483 6.511 -7.501 533 HB3 ASP 76 HB1 ASP 76 -3.732 6.395 -7.443 534 H ASP 77 HN ASP 77 -2.493 6.426 -9.195 535 HA ASP 77 HA ASP 77 -0.783 4.258 -9.991 536 HB2 ASP 77 HB2 ASP 77 -0.473 6.698 -10.628 537 HB3 ASP 77 HB1 ASP 77 0.065 6.984 -8.977 538 H GLY 78 HN GLY 78 -2.261 4.345 -7.318 539 HA2 GLY 78 HA2 GLY 78 -1.677 3.112 -5.397 540 HA3 GLY 78 HA1 GLY 78 0.006 3.517 -5.667 541 H LEU 79 HN LEU 79 -2.416 5.971 -5.946 542 HA LEU 79 HA LEU 79 -1.139 7.477 -3.845 543 HB2 LEU 79 HB2 LEU 79 -3.598 8.219 -5.418 544 HB3 LEU 79 HB1 LEU 79 -2.576 9.293 -4.483 545 HG LEU 79 HG LEU 79 -1.887 7.906 -7.072 546 HD11 LEU 79 HD11 LEU 79 -1.643 10.198 -7.900 547 HD12 LEU 79 HD12 LEU 79 -2.160 10.815 -6.331 548 HD13 LEU 79 HD13 LEU 79 -3.276 9.876 -7.323 549 HD21 LEU 79 HD21 LEU 79 0.279 9.050 -6.922 550 HD22 LEU 79 HD22 LEU 79 0.064 7.883 -5.618 551 HD23 LEU 79 HD23 LEU 79 -0.133 9.606 -5.299 552 H VAL 80 HN VAL 80 -3.970 5.538 -4.209 553 HA VAL 80 HA VAL 80 -4.749 6.265 -1.467 554 HB VAL 80 HB VAL 80 -6.662 5.605 -3.716 555 HG11 VAL 80 HG11 VAL 80 -8.419 6.147 -2.093 556 HG12 VAL 80 HG12 VAL 80 -7.193 6.362 -0.845 557 HG13 VAL 80 HG13 VAL 80 -7.447 4.773 -1.568 558 HG21 VAL 80 HG21 VAL 80 -7.426 7.921 -3.493 559 HG22 VAL 80 HG22 VAL 80 -5.724 7.845 -3.951 560 HG23 VAL 80 HG23 VAL 80 -6.173 8.216 -2.287 561 H GLY 81 HN GLY 81 -4.112 4.563 -0.312 562 HA2 GLY 81 HA2 GLY 81 -4.336 1.899 -1.501 563 HA3 GLY 81 HA1 GLY 81 -3.407 2.313 -0.068 564 H ILE 82 HN ILE 82 -5.491 0.251 -0.624 565 HA ILE 82 HA ILE 82 -7.528 1.052 1.323 566 HB ILE 82 HB ILE 82 -7.446 -1.058 -0.809 567 HG12 ILE 82 HG12 ILE 82 -9.742 -0.159 -1.256 568 HG13 ILE 82 HG11 ILE 82 -9.467 1.036 0.006 569 HG21 ILE 82 HG21 ILE 82 -9.202 -1.105 1.624 570 HG22 ILE 82 HG22 ILE 82 -8.088 -2.351 1.068 571 HG23 ILE 82 HG23 ILE 82 -9.555 -2.000 0.150 572 HD11 ILE 82 HD11 ILE 82 -9.087 1.970 -2.195 573 HD12 ILE 82 HD12 ILE 82 -7.869 0.733 -2.519 574 HD13 ILE 82 HD13 ILE 82 -7.593 1.934 -1.254 575 H ASN 83 HN ASN 83 -7.113 0.535 3.317 576 HA ASN 83 HA ASN 83 -6.643 -0.678 5.174 577 HB2 ASN 83 HB2 ASN 83 -7.005 -2.881 3.160 578 HB3 ASN 83 HB1 ASN 83 -6.580 -3.243 4.825 579 HD21 ASN 83 HD21 ASN 83 -8.993 -3.889 3.327 580 HD22 ASN 83 HD22 ASN 83 -10.299 -3.188 4.215 581 H CYS 84 HN CYS 84 -4.571 0.593 4.130 582 HA CYS 84 HA CYS 84 -2.320 -1.175 3.755 583 HB2 CYS 84 HB2 CYS 84 -2.396 1.832 4.038 584 HB3 CYS 84 HB1 CYS 84 -1.024 0.873 3.494 585 H THR 85 HN THR 85 -2.074 -2.283 5.648 586 HA THR 85 HA THR 85 -1.930 -0.932 8.186 587 HB THR 85 HB THR 85 -1.101 -3.771 7.556 588 HG1 THR 85 HG1 THR 85 -3.147 -4.163 7.241 589 HG21 THR 85 HG21 THR 85 -2.030 -2.427 10.096 590 HG22 THR 85 HG22 THR 85 -0.403 -3.010 9.749 591 HG23 THR 85 HG23 THR 85 -1.731 -4.157 9.918 592 HA PRO 86 HA PRO 86 2.406 0.119 7.814 593 HB2 PRO 86 HB2 PRO 86 2.223 0.415 10.749 594 HB3 PRO 86 HB1 PRO 86 2.689 1.605 9.532 595 HG2 PRO 86 HG2 PRO 86 0.339 1.782 10.782 596 HG3 PRO 86 HG1 PRO 86 0.488 2.175 9.060 597 HD2 PRO 86 HD2 PRO 86 -0.547 -0.324 10.345 598 HD3 PRO 86 HD1 PRO 86 -1.200 0.600 8.979 599 H ILE 87 HN ILE 87 3.847 -1.461 7.570 600 HA ILE 87 HA ILE 87 3.599 -3.845 9.203 601 HB ILE 87 HB ILE 87 5.330 -4.709 7.524 602 HG12 ILE 87 HG12 ILE 87 4.354 -2.325 5.954 603 HG13 ILE 87 HG11 ILE 87 5.941 -2.419 6.704 604 HG21 ILE 87 HG21 ILE 87 3.591 -5.196 5.880 605 HG22 ILE 87 HG22 ILE 87 2.571 -3.945 6.594 606 HG23 ILE 87 HG23 ILE 87 2.999 -5.377 7.530 607 HD11 ILE 87 HD11 ILE 87 6.142 -2.956 4.385 608 HD12 ILE 87 HD12 ILE 87 4.864 -4.165 4.510 609 HD13 ILE 87 HD13 ILE 87 6.406 -4.428 5.326 610 HA PRO 88 HA PRO 88 7.276 -3.138 11.574 611 HB2 PRO 88 HB2 PRO 88 7.716 -6.033 11.527 612 HB3 PRO 88 HB1 PRO 88 7.340 -4.991 12.895 613 HG2 PRO 88 HG2 PRO 88 5.560 -6.740 11.952 614 HG3 PRO 88 HG1 PRO 88 5.061 -5.143 12.544 615 HD2 PRO 88 HD2 PRO 88 5.513 -6.053 9.722 616 HD3 PRO 88 HD1 PRO 88 4.152 -5.138 10.397 617 H LEU 89 HN LEU 89 9.555 -3.368 11.500 618 HA LEU 89 HA LEU 89 10.542 -3.679 8.767 619 HB2 LEU 89 HB2 LEU 89 11.986 -2.655 11.209 620 HB3 LEU 89 HB1 LEU 89 12.482 -2.469 9.534 621 HG LEU 89 HG LEU 89 10.062 -1.181 10.806 622 HD11 LEU 89 HD11 LEU 89 11.301 0.905 10.481 623 HD12 LEU 89 HD12 LEU 89 12.691 -0.017 9.912 624 HD13 LEU 89 HD13 LEU 89 12.137 -0.195 11.574 625 HD21 LEU 89 HD21 LEU 89 9.872 0.048 8.693 626 HD22 LEU 89 HD22 LEU 89 9.660 -1.686 8.463 627 HD23 LEU 89 HD23 LEU 89 11.183 -0.919 8.018 628 H ILE 90 HN ILE 90 9.893 -6.040 10.318 629 HA ILE 90 HA ILE 90 12.562 -7.205 10.611 630 HB ILE 90 HB ILE 90 11.694 -8.514 12.557 631 HG12 ILE 90 HG12 ILE 90 9.482 -6.449 12.537 632 HG13 ILE 90 HG11 ILE 90 9.273 -8.144 12.109 633 HG21 ILE 90 HG21 ILE 90 13.186 -6.667 12.914 634 HG22 ILE 90 HG22 ILE 90 11.938 -6.621 14.158 635 HG23 ILE 90 HG23 ILE 90 11.858 -5.509 12.787 636 HD11 ILE 90 HD11 ILE 90 10.117 -7.094 14.800 637 HD12 ILE 90 HD12 ILE 90 9.895 -8.791 14.377 638 HD13 ILE 90 HD13 ILE 90 8.515 -7.692 14.372 Start of MODEL 3 1 H1 GLY 1 HT1 GLY 1 1.572 -8.431 -11.503 2 H2 GLY 1 HT2 GLY 1 1.221 -7.280 -12.689 3 H3 GLY 1 HT3 GLY 1 1.742 -6.786 -11.158 4 HA2 GLY 1 HA1 GLY 1 3.353 -8.309 -13.125 5 HA3 GLY 1 HA2 GLY 1 3.527 -6.596 -12.766 6 H SER 2 HN SER 2 5.372 -6.336 -11.687 7 HA SER 2 HA SER 2 6.409 -8.371 -9.948 8 HB2 SER 2 HB2 SER 2 8.189 -6.588 -9.521 9 HB3 SER 2 HB1 SER 2 8.028 -7.149 -11.186 10 HG SER 2 HG SER 2 6.748 -4.827 -10.159 11 H GLY 3 HN GLY 3 5.821 -8.643 -7.912 12 HA2 GLY 3 HA2 GLY 3 4.378 -6.545 -6.510 13 HA3 GLY 3 HA1 GLY 3 4.635 -8.194 -5.953 14 H TRP 4 HN TRP 4 4.930 -6.131 -4.192 15 HA TRP 4 HA TRP 4 7.714 -5.379 -4.042 16 HB2 TRP 4 HB2 TRP 4 5.326 -4.883 -2.284 17 HB3 TRP 4 HB1 TRP 4 6.955 -4.437 -1.783 18 HD1 TRP 4 HD1 TRP 4 4.077 -3.232 -3.841 19 HE1 TRP 4 HE1 TRP 4 4.709 -1.020 -4.993 20 HE3 TRP 4 HE3 TRP 4 9.096 -3.257 -2.921 21 HZ2 TRP 4 HZ2 TRP 4 7.044 0.505 -5.463 22 HZ3 TRP 4 HZ3 TRP 4 10.463 -1.392 -3.757 23 HH2 TRP 4 HH2 TRP 4 9.457 0.448 -4.999 24 H GLU 5 HN GLU 5 9.100 -5.906 -2.313 25 HA GLU 5 HA GLU 5 9.299 -8.653 -1.902 26 HB2 GLU 5 HB2 GLU 5 10.655 -6.376 -0.450 27 HB3 GLU 5 HB1 GLU 5 11.143 -8.064 -0.343 28 HG2 GLU 5 HG2 GLU 5 11.139 -6.375 -2.831 29 HG3 GLU 5 HG1 GLU 5 12.550 -6.812 -1.873 30 H SER 6 HN SER 6 7.829 -9.748 -0.786 31 HA SER 6 HA SER 6 7.083 -8.764 1.889 32 HB2 SER 6 HB2 SER 6 5.560 -10.699 0.130 33 HB3 SER 6 HB1 SER 6 5.013 -10.016 1.661 34 HG SER 6 HG SER 6 5.703 -8.414 -0.573 35 H LYS 7 HN LYS 7 9.367 -10.525 0.793 36 HA LYS 7 HA LYS 7 8.914 -13.190 1.528 37 HB2 LYS 7 HB2 LYS 7 11.354 -13.457 1.378 38 HB3 LYS 7 HB1 LYS 7 10.678 -12.607 -0.001 39 HG2 LYS 7 HG2 LYS 7 12.467 -11.277 0.384 40 HG3 LYS 7 HG1 LYS 7 11.312 -10.501 1.468 41 HD2 LYS 7 HD2 LYS 7 12.182 -11.825 3.333 42 HD3 LYS 7 HD1 LYS 7 13.368 -12.558 2.250 43 HE2 LYS 7 HE2 LYS 7 14.280 -10.311 1.779 44 HE3 LYS 7 HE1 LYS 7 13.147 -9.632 2.943 45 HZ1 LYS 7 HZ1 LYS 7 15.259 -11.622 3.560 46 HZ2 LYS 7 HZ2 LYS 7 14.187 -10.940 4.672 47 HZ3 LYS 7 HZ3 LYS 7 15.335 -9.969 3.908 48 H THR 8 HN THR 8 9.599 -10.471 3.525 49 HA THR 8 HA THR 8 10.700 -12.086 5.639 50 HB THR 8 HB THR 8 11.262 -9.622 5.252 51 HG1 THR 8 HG1 THR 8 11.151 -9.295 7.699 52 HG21 THR 8 HG21 THR 8 9.841 -7.986 6.371 53 HG22 THR 8 HG22 THR 8 8.671 -9.247 6.757 54 HG23 THR 8 HG23 THR 8 8.952 -8.791 5.077 55 H GLY 9 HN GLY 9 7.614 -11.532 4.460 56 HA2 GLY 9 HA2 GLY 9 5.696 -12.631 5.228 57 HA3 GLY 9 HA1 GLY 9 6.477 -12.869 6.782 58 H SER 10 HN SER 10 6.638 -9.684 5.562 59 HA SER 10 HA SER 10 5.058 -8.741 7.757 60 HB2 SER 10 HB2 SER 10 5.639 -6.475 6.735 61 HB3 SER 10 HB1 SER 10 6.991 -7.465 7.274 62 HG SER 10 HG SER 10 7.362 -6.610 5.191 63 H CYS 11 HN CYS 11 4.588 -9.196 4.348 64 HA CYS 11 HA CYS 11 1.874 -8.100 4.637 65 HB2 CYS 11 HB2 CYS 11 3.333 -6.547 3.362 66 HB3 CYS 11 HB1 CYS 11 3.642 -7.831 2.199 67 H ASN 12 HN ASN 12 0.251 -9.221 3.655 68 HA ASN 12 HA ASN 12 0.935 -11.937 2.862 69 HB2 ASN 12 HB2 ASN 12 -1.420 -12.455 3.180 70 HB3 ASN 12 HB1 ASN 12 -0.793 -11.612 4.592 71 HD21 ASN 12 HD21 ASN 12 -1.478 -9.485 4.992 72 HD22 ASN 12 HD22 ASN 12 -2.891 -8.834 4.236 73 H THR 13 HN THR 13 -0.141 -8.995 1.416 74 HA THR 13 HA THR 13 -1.242 -10.409 -0.894 75 HB THR 13 HB THR 13 -1.925 -8.084 -1.618 76 HG1 THR 13 HG1 THR 13 -1.864 -6.509 0.120 77 HG21 THR 13 HG21 THR 13 -2.912 -9.143 1.034 78 HG22 THR 13 HG22 THR 13 -3.534 -9.547 -0.567 79 HG23 THR 13 HG23 THR 13 -3.742 -7.917 0.074 80 H GLY 14 HN GLY 14 1.454 -8.389 0.029 81 HA2 GLY 14 HA2 GLY 14 3.483 -8.276 -1.187 82 HA3 GLY 14 HA1 GLY 14 2.616 -8.793 -2.626 83 H LYS 15 HN LYS 15 0.704 -6.561 -1.230 84 HA LYS 15 HA LYS 15 1.631 -4.460 -3.031 85 HB2 LYS 15 HB2 LYS 15 -0.905 -4.821 -1.432 86 HB3 LYS 15 HB1 LYS 15 -0.543 -3.353 -2.324 87 HG2 LYS 15 HG2 LYS 15 -0.515 -4.599 -4.408 88 HG3 LYS 15 HG1 LYS 15 -0.813 -6.102 -3.528 89 HD2 LYS 15 HD2 LYS 15 -2.974 -5.380 -2.857 90 HD3 LYS 15 HD1 LYS 15 -2.665 -3.734 -3.396 91 HE2 LYS 15 HE2 LYS 15 -4.110 -4.838 -4.976 92 HE3 LYS 15 HE1 LYS 15 -2.540 -4.548 -5.718 93 HZ1 LYS 15 HZ1 LYS 15 -3.324 -7.137 -4.506 94 HZ2 LYS 15 HZ2 LYS 15 -1.963 -6.822 -5.458 95 HZ3 LYS 15 HZ3 LYS 15 -3.511 -6.778 -6.150 96 H LEU 16 HN LEU 16 3.464 -3.752 -1.863 97 HA LEU 16 HA LEU 16 2.937 -2.514 0.721 98 HB2 LEU 16 HB2 LEU 16 5.482 -3.270 -0.689 99 HB3 LEU 16 HB1 LEU 16 5.468 -2.249 0.726 100 HG LEU 16 HG LEU 16 4.333 -4.104 1.965 101 HD11 LEU 16 HD11 LEU 16 4.418 -6.333 1.042 102 HD12 LEU 16 HD12 LEU 16 5.080 -5.699 -0.464 103 HD13 LEU 16 HD13 LEU 16 3.441 -5.268 0.029 104 HD21 LEU 16 HD21 LEU 16 7.049 -4.673 0.790 105 HD22 LEU 16 HD22 LEU 16 6.378 -5.443 2.228 106 HD23 LEU 16 HD23 LEU 16 6.708 -3.711 2.228 107 H ALA 17 HN ALA 17 2.044 -0.551 0.307 108 HA ALA 17 HA ALA 17 3.352 1.163 -1.674 109 HB1 ALA 17 HB1 ALA 17 1.410 2.650 -1.411 110 HB2 ALA 17 HB2 ALA 17 0.735 1.528 -0.224 111 HB3 ALA 17 HB3 ALA 17 0.947 1.016 -1.898 112 H CYS 18 HN CYS 18 4.069 3.215 -1.175 113 HA CYS 18 HA CYS 18 4.972 3.603 1.544 114 HB2 CYS 18 HB2 CYS 18 6.305 4.128 -0.588 115 HB3 CYS 18 HB1 CYS 18 5.254 5.527 -0.764 116 H CYS 19 HN CYS 19 3.389 4.272 2.917 117 HA CYS 19 HA CYS 19 1.523 6.307 1.913 118 HB2 CYS 19 HB2 CYS 19 0.812 3.958 3.663 119 HB3 CYS 19 HB1 CYS 19 -0.297 5.189 3.074 120 H ASP 20 HN ASP 20 0.708 7.780 3.372 121 HA ASP 20 HA ASP 20 2.156 8.008 5.903 122 HB2 ASP 20 HB2 ASP 20 1.653 10.010 4.291 123 HB3 ASP 20 HB1 ASP 20 0.030 9.885 4.932 124 H THR 21 HN THR 21 1.194 7.496 7.820 125 HA THR 21 HA THR 21 -1.405 6.238 7.649 126 HB THR 21 HB THR 21 -0.986 5.569 9.995 127 HG1 THR 21 HG1 THR 21 1.632 6.629 9.681 128 HG21 THR 21 HG21 THR 21 1.219 4.998 8.017 129 HG22 THR 21 HG22 THR 21 -0.277 4.090 8.225 130 HG23 THR 21 HG23 THR 21 0.942 4.084 9.499 131 H ASN 22 HN ASN 22 -0.390 9.334 8.156 132 HA ASN 22 HA ASN 22 -2.571 9.940 10.026 133 HB2 ASN 22 HB2 ASN 22 -0.163 11.586 9.224 134 HB3 ASN 22 HB1 ASN 22 -1.427 12.126 10.319 135 HD21 ASN 22 HD21 ASN 22 -1.560 11.235 12.377 136 HD22 ASN 22 HD22 ASN 22 -0.256 10.343 13.077 137 H LYS 23 HN LYS 23 -1.114 10.837 6.940 138 HA LYS 23 HA LYS 23 -3.279 12.520 6.143 139 HB2 LYS 23 HB2 LYS 23 -0.915 11.331 4.785 140 HB3 LYS 23 HB1 LYS 23 -2.200 11.968 3.798 141 HG2 LYS 23 HG2 LYS 23 -1.929 14.108 5.194 142 HG3 LYS 23 HG1 LYS 23 -0.412 13.371 5.710 143 HD2 LYS 23 HD2 LYS 23 -1.180 13.888 2.852 144 HD3 LYS 23 HD1 LYS 23 -0.083 14.887 3.813 145 HE2 LYS 23 HE2 LYS 23 1.456 13.090 4.058 146 HE3 LYS 23 HE1 LYS 23 0.304 11.957 3.357 147 HZ1 LYS 23 HZ1 LYS 23 1.598 14.220 1.924 148 HZ2 LYS 23 HZ2 LYS 23 0.520 13.114 1.238 149 HZ3 LYS 23 HZ3 LYS 23 2.036 12.592 1.773 150 H LYS 24 HN LYS 24 -5.007 12.070 5.065 151 HA LYS 24 HA LYS 24 -5.635 9.223 4.640 152 HB2 LYS 24 HB2 LYS 24 -7.502 11.315 5.751 153 HB3 LYS 24 HB1 LYS 24 -7.851 9.606 5.532 154 HG2 LYS 24 HG2 LYS 24 -5.834 10.754 7.446 155 HG3 LYS 24 HG1 LYS 24 -7.441 10.170 7.865 156 HD2 LYS 24 HD2 LYS 24 -5.196 8.539 6.705 157 HD3 LYS 24 HD1 LYS 24 -5.752 8.496 8.375 158 HE2 LYS 24 HE2 LYS 24 -7.382 7.720 5.956 159 HE3 LYS 24 HE1 LYS 24 -6.613 6.600 7.075 160 HZ1 LYS 24 HZ1 LYS 24 -8.016 7.485 8.847 161 HZ2 LYS 24 HZ2 LYS 24 -8.940 6.846 7.587 162 HZ3 LYS 24 HZ3 LYS 24 -8.777 8.520 7.746 163 H VAL 25 HN VAL 25 -7.299 8.785 3.085 164 HA VAL 25 HA VAL 25 -7.829 11.026 1.231 165 HB VAL 25 HB VAL 25 -7.946 8.183 0.306 166 HG11 VAL 25 HG11 VAL 25 -7.403 9.178 -1.850 167 HG12 VAL 25 HG12 VAL 25 -7.248 10.760 -1.088 168 HG13 VAL 25 HG13 VAL 25 -8.813 9.947 -1.125 169 HG21 VAL 25 HG21 VAL 25 -5.386 9.795 0.410 170 HG22 VAL 25 HG22 VAL 25 -5.611 8.253 -0.418 171 HG23 VAL 25 HG23 VAL 25 -5.745 8.333 1.337 172 H GLN 26 HN GLN 26 -9.921 11.227 0.469 173 HA GLN 26 HA GLN 26 -11.984 10.008 2.064 174 HB2 GLN 26 HB2 GLN 26 -11.980 12.027 -0.165 175 HB3 GLN 26 HB1 GLN 26 -13.463 11.416 0.538 176 HG2 GLN 26 HG2 GLN 26 -12.850 12.300 2.698 177 HG3 GLN 26 HG1 GLN 26 -11.286 12.814 2.070 178 HE21 GLN 26 HE21 GLN 26 -11.171 14.597 0.720 179 HE22 GLN 26 HE22 GLN 26 -12.471 15.727 0.574 180 H LYS 27 HN LYS 27 -10.457 9.427 -0.906 181 HA LYS 27 HA LYS 27 -12.620 8.018 -2.172 182 HB2 LYS 27 HB2 LYS 27 -9.667 8.156 -2.821 183 HB3 LYS 27 HB1 LYS 27 -10.910 7.480 -3.868 184 HG2 LYS 27 HG2 LYS 27 -11.120 10.303 -2.923 185 HG3 LYS 27 HG1 LYS 27 -10.072 9.889 -4.279 186 HD2 LYS 27 HD2 LYS 27 -12.905 8.940 -4.239 187 HD3 LYS 27 HD1 LYS 27 -12.542 10.602 -4.704 188 HE2 LYS 27 HE2 LYS 27 -12.620 9.291 -6.698 189 HE3 LYS 27 HE1 LYS 27 -10.941 9.708 -6.375 190 HZ1 LYS 27 HZ1 LYS 27 -10.506 7.530 -5.593 191 HZ2 LYS 27 HZ2 LYS 27 -11.305 7.372 -7.072 192 HZ3 LYS 27 HZ3 LYS 27 -12.143 7.107 -5.631 193 H SER 28 HN SER 28 -13.207 6.026 -1.621 194 HA SER 28 HA SER 28 -11.164 4.058 -0.947 195 HB2 SER 28 HB2 SER 28 -11.975 5.047 1.207 196 HB3 SER 28 HB1 SER 28 -13.604 4.518 0.796 197 HG SER 28 HG SER 28 -11.856 3.147 2.096 198 H THR 29 HN THR 29 -11.504 2.491 -2.381 199 HA THR 29 HA THR 29 -14.146 1.351 -2.677 200 HB THR 29 HB THR 29 -12.692 2.312 -5.147 201 HG1 THR 29 HG1 THR 29 -14.523 3.557 -3.474 202 HG21 THR 29 HG21 THR 29 -14.775 1.728 -6.289 203 HG22 THR 29 HG22 THR 29 -15.465 1.178 -4.764 204 HG23 THR 29 HG23 THR 29 -14.095 0.322 -5.470 205 H GLY 30 HN GLY 30 -11.353 1.145 -4.837 206 HA2 GLY 30 HA2 GLY 30 -9.661 -0.527 -4.765 207 HA3 GLY 30 HA1 GLY 30 -10.690 -1.482 -3.706 208 H GLU 31 HN GLU 31 -9.297 -2.005 -6.362 209 HA GLU 31 HA GLU 31 -11.620 -2.668 -8.017 210 HB2 GLU 31 HB2 GLU 31 -8.661 -2.708 -8.585 211 HB3 GLU 31 HB1 GLU 31 -9.852 -3.370 -9.694 212 HG2 GLU 31 HG2 GLU 31 -10.947 -1.102 -9.682 213 HG3 GLU 31 HG1 GLU 31 -9.522 -0.516 -8.828 214 H GLU 32 HN GLU 32 -8.801 -4.259 -6.531 215 HA GLU 32 HA GLU 32 -9.832 -6.858 -7.261 216 HB2 GLU 32 HB2 GLU 32 -7.465 -6.127 -5.527 217 HB3 GLU 32 HB1 GLU 32 -7.856 -7.745 -6.097 218 HG2 GLU 32 HG2 GLU 32 -7.700 -6.771 -8.445 219 HG3 GLU 32 HG1 GLU 32 -6.934 -5.379 -7.686 220 H SER 33 HN SER 33 -9.441 -4.905 -4.352 221 HA SER 33 HA SER 33 -10.781 -6.749 -2.643 222 HB2 SER 33 HB2 SER 33 -9.327 -4.942 -1.774 223 HB3 SER 33 HB1 SER 33 -10.484 -3.745 -2.350 224 HG SER 33 HG SER 33 -11.140 -4.008 -0.329 225 H GLY 34 HN GLY 34 -11.777 -4.326 -4.912 226 HA2 GLY 34 HA2 GLY 34 -14.457 -4.011 -3.987 227 HA3 GLY 34 HA1 GLY 34 -13.834 -3.523 -5.554 228 H LEU 35 HN LEU 35 -12.910 -6.536 -5.620 229 HA LEU 35 HA LEU 35 -15.205 -7.471 -7.068 230 HB2 LEU 35 HB2 LEU 35 -12.939 -7.927 -7.858 231 HB3 LEU 35 HB1 LEU 35 -12.573 -8.777 -6.370 232 HG LEU 35 HG LEU 35 -14.345 -10.426 -6.972 233 HD11 LEU 35 HD11 LEU 35 -15.057 -10.540 -9.315 234 HD12 LEU 35 HD12 LEU 35 -14.249 -9.004 -9.625 235 HD13 LEU 35 HD13 LEU 35 -15.624 -9.069 -8.524 236 HD21 LEU 35 HD21 LEU 35 -12.954 -11.616 -8.587 237 HD22 LEU 35 HD22 LEU 35 -11.975 -10.887 -7.314 238 HD23 LEU 35 HD23 LEU 35 -12.055 -10.134 -8.907 239 H LEU 36 HN LEU 36 -13.937 -7.704 -3.900 240 HA LEU 36 HA LEU 36 -15.826 -9.852 -3.218 241 HB2 LEU 36 HB2 LEU 36 -13.354 -10.189 -2.773 242 HB3 LEU 36 HB1 LEU 36 -13.467 -8.896 -1.597 243 HG LEU 36 HG LEU 36 -15.049 -10.227 -0.272 244 HD11 LEU 36 HD11 LEU 36 -16.104 -11.506 -2.038 245 HD12 LEU 36 HD12 LEU 36 -15.411 -12.596 -0.838 246 HD13 LEU 36 HD13 LEU 36 -14.585 -12.338 -2.374 247 HD21 LEU 36 HD21 LEU 36 -13.467 -11.929 0.481 248 HD22 LEU 36 HD22 LEU 36 -12.665 -10.385 0.188 249 HD23 LEU 36 HD23 LEU 36 -12.518 -11.692 -0.985 250 H HIS 37 HN HIS 37 -16.525 -9.523 -0.730 251 HA HIS 37 HA HIS 37 -17.947 -7.061 -0.612 252 HB2 HIS 37 HB2 HIS 37 -18.788 -9.159 0.409 253 HB3 HIS 37 HB1 HIS 37 -17.496 -9.085 1.596 254 HD1 HIS 37 HD1 HIS 37 -20.765 -7.493 0.681 255 HD2 HIS 37 HD2 HIS 37 -17.910 -7.272 3.695 256 HE1 HIS 37 HE1 HIS 37 -21.821 -6.147 2.520 257 HE2 HIS 37 HE2 HIS 37 -20.147 -6.186 4.395 258 H THR 38 HN THR 38 -14.762 -7.854 0.149 259 HA THR 38 HA THR 38 -14.283 -6.269 2.411 260 HB THR 38 HB THR 38 -11.894 -6.233 1.556 261 HG1 THR 38 HG1 THR 38 -11.889 -6.544 -0.561 262 HG21 THR 38 HG21 THR 38 -13.310 -8.891 1.774 263 HG22 THR 38 HG22 THR 38 -12.669 -7.936 3.113 264 HG23 THR 38 HG23 THR 38 -11.572 -8.645 1.928 265 H GLY 39 HN GLY 39 -14.471 -5.485 -0.995 266 HA2 GLY 39 HA2 GLY 39 -13.624 -2.734 -0.497 267 HA3 GLY 39 HA1 GLY 39 -13.968 -3.448 -2.065 268 H ASP 40 HN ASP 40 -16.338 -4.205 0.180 269 HA ASP 40 HA ASP 40 -18.260 -2.457 -1.109 270 HB2 ASP 40 HB2 ASP 40 -18.693 -4.875 -0.475 271 HB3 ASP 40 HB1 ASP 40 -18.712 -4.353 1.198 272 H VAL 41 HN VAL 41 -16.713 -2.891 1.965 273 HA VAL 41 HA VAL 41 -18.264 -0.934 3.363 274 HB VAL 41 HB VAL 41 -16.441 -1.199 5.121 275 HG11 VAL 41 HG11 VAL 41 -17.921 -3.656 4.160 276 HG12 VAL 41 HG12 VAL 41 -18.557 -2.409 5.235 277 HG13 VAL 41 HG13 VAL 41 -17.232 -3.444 5.771 278 HG21 VAL 41 HG21 VAL 41 -15.554 -3.383 3.235 279 HG22 VAL 41 HG22 VAL 41 -14.969 -3.139 4.881 280 HG23 VAL 41 HG23 VAL 41 -14.647 -1.926 3.644 281 H LEU 42 HN LEU 42 -17.726 1.126 3.946 282 HA LEU 42 HA LEU 42 -15.502 2.405 2.607 283 HB2 LEU 42 HB2 LEU 42 -17.791 3.352 4.289 284 HB3 LEU 42 HB1 LEU 42 -16.466 4.408 3.892 285 HG LEU 42 HG LEU 42 -18.247 3.055 1.872 286 HD11 LEU 42 HD11 LEU 42 -18.206 5.908 2.847 287 HD12 LEU 42 HD12 LEU 42 -19.474 4.720 3.149 288 HD13 LEU 42 HD13 LEU 42 -19.176 5.294 1.509 289 HD21 LEU 42 HD21 LEU 42 -16.029 3.483 0.994 290 HD22 LEU 42 HD22 LEU 42 -16.097 5.149 1.567 291 HD23 LEU 42 HD23 LEU 42 -17.184 4.611 0.287 292 H ASP 43 HN ASP 43 -15.894 0.570 5.232 293 HA ASP 43 HA ASP 43 -14.496 1.928 7.270 294 HB2 ASP 43 HB2 ASP 43 -15.862 -0.027 7.765 295 HB3 ASP 43 HB1 ASP 43 -14.830 -1.036 6.756 296 H GLN 44 HN GLN 44 -13.489 0.169 4.451 297 HA GLN 44 HA GLN 44 -10.909 -0.520 4.918 298 HB2 GLN 44 HB2 GLN 44 -11.638 1.031 2.458 299 HB3 GLN 44 HB1 GLN 44 -10.436 -0.225 2.619 300 HG2 GLN 44 HG2 GLN 44 -12.255 -1.856 3.016 301 HG3 GLN 44 HG1 GLN 44 -13.416 -0.572 2.680 302 HE21 GLN 44 HE21 GLN 44 -13.524 0.285 0.576 303 HE22 GLN 44 HE22 GLN 44 -12.936 -0.598 -0.791 304 H VAL 45 HN VAL 45 -9.041 0.470 5.293 305 HA VAL 45 HA VAL 45 -9.163 3.277 5.987 306 HB VAL 45 HB VAL 45 -6.854 1.346 6.290 307 HG11 VAL 45 HG11 VAL 45 -7.320 4.078 7.483 308 HG12 VAL 45 HG12 VAL 45 -6.111 3.656 6.271 309 HG13 VAL 45 HG13 VAL 45 -5.993 2.995 7.902 310 HG21 VAL 45 HG21 VAL 45 -8.931 2.230 8.288 311 HG22 VAL 45 HG22 VAL 45 -7.521 1.235 8.647 312 HG23 VAL 45 HG23 VAL 45 -8.784 0.623 7.578 313 H ALA 46 HN ALA 46 -9.023 4.598 4.354 314 HA ALA 46 HA ALA 46 -7.096 4.105 2.212 315 HB1 ALA 46 HB1 ALA 46 -9.364 6.066 2.472 316 HB2 ALA 46 HB2 ALA 46 -9.310 4.624 1.457 317 HB3 ALA 46 HB3 ALA 46 -8.261 6.002 1.095 318 H ILE 47 HN ILE 47 -5.150 4.716 2.944 319 HA ILE 47 HA ILE 47 -4.919 7.452 3.976 320 HB ILE 47 HB ILE 47 -2.597 6.782 4.663 321 HG12 ILE 47 HG12 ILE 47 -3.647 3.998 4.094 322 HG13 ILE 47 HG11 ILE 47 -2.334 4.801 3.237 323 HG21 ILE 47 HG21 ILE 47 -4.848 5.233 5.922 324 HG22 ILE 47 HG22 ILE 47 -4.518 6.943 6.185 325 HG23 ILE 47 HG23 ILE 47 -3.342 5.730 6.699 326 HD11 ILE 47 HD11 ILE 47 -2.348 3.979 6.132 327 HD12 ILE 47 HD12 ILE 47 -1.051 4.872 5.341 328 HD13 ILE 47 HD13 ILE 47 -1.432 3.232 4.822 329 H GLN 48 HN GLN 48 -3.210 8.772 3.177 330 HA GLN 48 HA GLN 48 -3.164 8.640 0.293 331 HB2 GLN 48 HB2 GLN 48 -3.403 10.735 1.825 332 HB3 GLN 48 HB1 GLN 48 -1.650 10.640 1.961 333 HG2 GLN 48 HG2 GLN 48 -1.794 12.028 0.183 334 HG3 GLN 48 HG1 GLN 48 -1.828 10.481 -0.656 335 HE21 GLN 48 HE21 GLN 48 -2.905 11.293 -2.417 336 HE22 GLN 48 HE22 GLN 48 -4.574 11.746 -2.359 337 H CYS 49 HN CYS 49 -1.784 7.697 -0.837 338 HA CYS 49 HA CYS 49 0.823 7.000 0.312 339 HB2 CYS 49 HB2 CYS 49 -0.750 5.553 -1.822 340 HB3 CYS 49 HB1 CYS 49 0.734 5.018 -1.063 341 H THR 50 HN THR 50 2.575 6.787 -1.245 342 HA THR 50 HA THR 50 2.304 7.872 -3.866 343 HB THR 50 HB THR 50 2.273 9.980 -2.550 344 HG1 THR 50 HG1 THR 50 3.179 10.654 -4.323 345 HG21 THR 50 HG21 THR 50 4.324 10.723 -1.428 346 HG22 THR 50 HG22 THR 50 5.051 9.145 -1.726 347 HG23 THR 50 HG23 THR 50 3.649 9.283 -0.667 348 H GLN 51 HN GLN 51 4.011 7.221 -5.146 349 HA GLN 51 HA GLN 51 6.094 5.760 -3.689 350 HB2 GLN 51 HB2 GLN 51 4.359 4.387 -4.936 351 HB3 GLN 51 HB1 GLN 51 5.067 5.018 -6.419 352 HG2 GLN 51 HG2 GLN 51 5.995 2.849 -5.933 353 HG3 GLN 51 HG1 GLN 51 7.232 4.094 -5.771 354 HE21 GLN 51 HE21 GLN 51 8.508 2.771 -4.419 355 HE22 GLN 51 HE22 GLN 51 8.066 2.459 -2.783 356 H ILE 52 HN ILE 52 7.826 6.949 -3.779 357 HA ILE 52 HA ILE 52 8.639 8.758 -5.728 358 HB ILE 52 HB ILE 52 10.311 7.089 -3.838 359 HG12 ILE 52 HG12 ILE 52 9.130 9.856 -3.565 360 HG13 ILE 52 HG11 ILE 52 8.598 8.415 -2.708 361 HG21 ILE 52 HG21 ILE 52 11.635 8.104 -5.673 362 HG22 ILE 52 HG22 ILE 52 12.054 8.726 -4.078 363 HG23 ILE 52 HG23 ILE 52 11.055 9.689 -5.163 364 HD11 ILE 52 HD11 ILE 52 10.756 8.305 -1.575 365 HD12 ILE 52 HD12 ILE 52 9.937 9.838 -1.285 366 HD13 ILE 52 HD13 ILE 52 11.274 9.754 -2.432 367 HA PRO 53 HA PRO 53 9.694 6.635 -9.479 368 HB2 PRO 53 HB2 PRO 53 12.326 7.974 -8.944 369 HB3 PRO 53 HB1 PRO 53 11.428 7.841 -10.460 370 HG2 PRO 53 HG2 PRO 53 11.346 10.066 -8.956 371 HG3 PRO 53 HG1 PRO 53 9.952 9.509 -9.894 372 HD2 PRO 53 HD2 PRO 53 10.329 9.566 -6.989 373 HD3 PRO 53 HD1 PRO 53 8.835 9.371 -7.925 374 H LEU 54 HN LEU 54 10.138 4.556 -9.595 375 HA LEU 54 HA LEU 54 11.374 3.223 -7.443 376 HB2 LEU 54 HB2 LEU 54 10.533 2.152 -10.129 377 HB3 LEU 54 HB1 LEU 54 10.924 1.183 -8.721 378 HG LEU 54 HG LEU 54 8.590 3.080 -8.988 379 HD11 LEU 54 HD11 LEU 54 8.716 0.076 -8.775 380 HD12 LEU 54 HD12 LEU 54 8.314 1.000 -10.224 381 HD13 LEU 54 HD13 LEU 54 7.246 1.050 -8.822 382 HD21 LEU 54 HD21 LEU 54 7.927 2.180 -6.782 383 HD22 LEU 54 HD22 LEU 54 9.404 3.141 -6.727 384 HD23 LEU 54 HD23 LEU 54 9.496 1.382 -6.675 385 H LEU 55 HN LEU 55 13.325 2.454 -7.138 386 HA LEU 55 HA LEU 55 15.223 2.341 -9.377 387 HB2 LEU 55 HB2 LEU 55 15.624 2.077 -6.390 388 HB3 LEU 55 HB1 LEU 55 16.898 1.910 -7.579 389 HG LEU 55 HG LEU 55 15.303 4.430 -7.117 390 HD11 LEU 55 HD11 LEU 55 18.118 3.740 -6.285 391 HD12 LEU 55 HD12 LEU 55 16.731 3.877 -5.205 392 HD13 LEU 55 HD13 LEU 55 17.319 5.297 -6.069 393 HD21 LEU 55 HD21 LEU 55 17.029 5.468 -8.514 394 HD22 LEU 55 HD22 LEU 55 16.119 4.242 -9.394 395 HD23 LEU 55 HD23 LEU 55 17.741 3.881 -8.804 396 H ILE 56 HN ILE 56 15.181 0.444 -10.400 397 HA ILE 56 HA ILE 56 13.575 -1.674 -9.587 398 HB ILE 56 HB ILE 56 15.894 -2.049 -11.446 399 HG12 ILE 56 HG12 ILE 56 13.177 -0.905 -12.139 400 HG13 ILE 56 HG11 ILE 56 14.661 0.034 -12.056 401 HG21 ILE 56 HG21 ILE 56 13.142 -3.270 -11.349 402 HG22 ILE 56 HG22 ILE 56 14.635 -4.041 -10.814 403 HG23 ILE 56 HG23 ILE 56 14.402 -3.657 -12.521 404 HD11 ILE 56 HD11 ILE 56 14.107 -0.491 -14.345 405 HD12 ILE 56 HD12 ILE 56 14.091 -2.214 -13.967 406 HD13 ILE 56 HD13 ILE 56 15.599 -1.305 -13.874 407 H GLY 57 HN GLY 57 13.827 -3.259 -8.237 408 HA2 GLY 57 HA2 GLY 57 14.999 -5.130 -7.360 409 HA3 GLY 57 HA1 GLY 57 16.509 -4.287 -7.655 410 H ILE 58 HN ILE 58 14.633 -1.974 -6.326 411 HA ILE 58 HA ILE 58 15.751 -2.545 -3.688 412 HB ILE 58 HB ILE 58 15.378 -0.112 -5.214 413 HG12 ILE 58 HG12 ILE 58 17.515 -0.981 -4.361 414 HG13 ILE 58 HG11 ILE 58 17.196 0.651 -3.785 415 HG21 ILE 58 HG21 ILE 58 14.931 1.348 -3.225 416 HG22 ILE 58 HG22 ILE 58 14.415 -0.107 -2.360 417 HG23 ILE 58 HG23 ILE 58 13.540 0.429 -3.800 418 HD11 ILE 58 HD11 ILE 58 16.502 -0.225 -1.629 419 HD12 ILE 58 HD12 ILE 58 18.127 -0.779 -2.033 420 HD13 ILE 58 HD13 ILE 58 16.753 -1.874 -2.199 421 H ALA 59 HN ALA 59 14.615 -2.193 -1.808 422 HA ALA 59 HA ALA 59 11.898 -3.191 -1.947 423 HB1 ALA 59 HB1 ALA 59 13.425 -4.304 -0.486 424 HB2 ALA 59 HB2 ALA 59 12.227 -3.466 0.505 425 HB3 ALA 59 HB3 ALA 59 13.846 -2.784 0.301 426 H ILE 60 HN ILE 60 10.127 -2.200 -1.015 427 HA ILE 60 HA ILE 60 9.586 0.417 -1.414 428 HB ILE 60 HB ILE 60 7.857 -1.181 -0.876 429 HG12 ILE 60 HG12 ILE 60 6.517 0.111 0.789 430 HG13 ILE 60 HG11 ILE 60 7.950 1.072 1.139 431 HG21 ILE 60 HG21 ILE 60 8.976 -2.552 0.745 432 HG22 ILE 60 HG22 ILE 60 7.475 -1.947 1.448 433 HG23 ILE 60 HG23 ILE 60 9.020 -1.222 1.905 434 HD11 ILE 60 HD11 ILE 60 6.357 2.150 -0.407 435 HD12 ILE 60 HD12 ILE 60 6.674 0.865 -1.571 436 HD13 ILE 60 HD13 ILE 60 7.974 1.950 -1.079 437 H GLU 61 HN GLU 61 10.917 -0.886 1.622 438 HA GLU 61 HA GLU 61 10.420 1.507 3.058 439 HB2 GLU 61 HB2 GLU 61 11.833 0.374 4.845 440 HB3 GLU 61 HB1 GLU 61 10.336 -0.399 4.377 441 HG2 GLU 61 HG2 GLU 61 12.037 -2.056 4.689 442 HG3 GLU 61 HG1 GLU 61 11.614 -1.981 2.985 443 H ASP 62 HN ASP 62 13.125 0.427 1.180 444 HA ASP 62 HA ASP 62 14.650 2.741 2.169 445 HB2 ASP 62 HB2 ASP 62 15.832 0.568 2.225 446 HB3 ASP 62 HB1 ASP 62 15.618 0.421 0.484 447 H GLU 63 HN GLU 63 12.626 1.771 -0.269 448 HA GLU 63 HA GLU 63 13.734 3.251 -2.443 449 HB2 GLU 63 HB2 GLU 63 12.065 1.377 -2.677 450 HB3 GLU 63 HB1 GLU 63 10.853 2.449 -2.003 451 HG2 GLU 63 HG2 GLU 63 10.646 2.433 -4.385 452 HG3 GLU 63 HG1 GLU 63 11.244 4.006 -3.865 453 H CYS 64 HN CYS 64 11.472 3.872 0.158 454 HA CYS 64 HA CYS 64 11.356 6.695 -0.645 455 HB2 CYS 64 HB2 CYS 64 9.012 6.763 -0.391 456 HB3 CYS 64 HB1 CYS 64 9.322 5.278 -1.294 457 H LYS 65 HN LYS 65 10.613 8.120 1.178 458 HA LYS 65 HA LYS 65 11.690 7.076 3.707 459 HB2 LYS 65 HB2 LYS 65 11.528 9.905 2.677 460 HB3 LYS 65 HB1 LYS 65 12.088 9.468 4.279 461 HG2 LYS 65 HG2 LYS 65 13.363 8.497 1.737 462 HG3 LYS 65 HG1 LYS 65 13.893 9.924 2.626 463 HD2 LYS 65 HD2 LYS 65 13.759 7.137 3.769 464 HD3 LYS 65 HD1 LYS 65 15.221 7.889 3.135 465 HE2 LYS 65 HE2 LYS 65 13.576 8.853 5.473 466 HE3 LYS 65 HE1 LYS 65 15.149 8.064 5.557 467 HZ1 LYS 65 HZ1 LYS 65 15.347 10.457 5.786 468 HZ2 LYS 65 HZ2 LYS 65 14.603 10.698 4.291 469 HZ3 LYS 65 HZ3 LYS 65 16.113 9.939 4.372 470 H ASN 66 HN ASN 66 8.904 6.720 2.879 471 HA ASN 66 HA ASN 66 7.664 8.160 5.133 472 HB2 ASN 66 HB2 ASN 66 6.249 6.947 2.746 473 HB3 ASN 66 HB1 ASN 66 5.472 7.769 4.093 474 HD21 ASN 66 HD21 ASN 66 7.329 8.120 1.216 475 HD22 ASN 66 HD22 ASN 66 7.162 9.833 1.054 476 H THR 67 HN THR 67 5.412 6.430 5.374 477 HA THR 67 HA THR 67 6.741 4.225 6.698 478 HB THR 67 HB THR 67 3.774 4.800 6.653 479 HG1 THR 67 HG1 THR 67 5.762 5.725 8.492 480 HG21 THR 67 HG21 THR 67 5.556 3.303 8.583 481 HG22 THR 67 HG22 THR 67 4.390 2.585 7.475 482 HG23 THR 67 HG23 THR 67 3.827 3.588 8.812 483 HA PRO 68 HA PRO 68 5.725 1.381 3.423 484 HB2 PRO 68 HB2 PRO 68 6.763 -0.819 4.635 485 HB3 PRO 68 HB1 PRO 68 7.764 0.394 3.839 486 HG2 PRO 68 HG2 PRO 68 7.339 -0.102 6.720 487 HG3 PRO 68 HG1 PRO 68 8.734 0.602 5.891 488 HD2 PRO 68 HD2 PRO 68 6.735 1.995 7.291 489 HD3 PRO 68 HD1 PRO 68 7.965 2.694 6.235 490 H THR 69 HN THR 69 3.779 0.423 3.122 491 HA THR 69 HA THR 69 2.478 -0.739 5.488 492 HB THR 69 HB THR 69 0.319 0.219 4.722 493 HG1 THR 69 HG1 THR 69 2.023 1.430 2.794 494 HG21 THR 69 HG21 THR 69 2.509 2.220 5.294 495 HG22 THR 69 HG22 THR 69 1.480 1.406 6.476 496 HG23 THR 69 HG23 THR 69 0.785 2.581 5.359 497 H CYS 70 HN CYS 70 1.187 -2.507 5.149 498 HA CYS 70 HA CYS 70 1.275 -3.719 2.486 499 HB2 CYS 70 HB2 CYS 70 1.910 -5.168 4.343 500 HB3 CYS 70 HB1 CYS 70 0.388 -4.836 5.159 501 H CYS 71 HN CYS 71 -0.322 -3.200 1.170 502 HA CYS 71 HA CYS 71 -2.900 -2.365 2.281 503 HB2 CYS 71 HB2 CYS 71 -1.933 -2.205 -0.580 504 HB3 CYS 71 HB1 CYS 71 -3.338 -1.407 0.110 505 H GLU 72 HN GLU 72 -4.806 -3.328 1.787 506 HA GLU 72 HA GLU 72 -4.725 -6.021 0.779 507 HB2 GLU 72 HB2 GLU 72 -6.191 -5.924 2.528 508 HB3 GLU 72 HB1 GLU 72 -6.657 -4.262 2.200 509 HG2 GLU 72 HG2 GLU 72 -8.186 -4.897 0.590 510 HG3 GLU 72 HG1 GLU 72 -7.501 -6.510 0.422 511 H ASP 73 HN ASP 73 -5.406 -2.857 -0.328 512 HA ASP 73 HA ASP 73 -5.401 -3.731 -3.063 513 HB2 ASP 73 HB2 ASP 73 -7.825 -3.948 -2.452 514 HB3 ASP 73 HB1 ASP 73 -7.838 -2.245 -2.027 515 H VAL 74 HN VAL 74 -4.934 -1.887 -4.476 516 HA VAL 74 HA VAL 74 -4.721 0.688 -3.082 517 HB VAL 74 HB VAL 74 -2.591 0.044 -5.080 518 HG11 VAL 74 HG11 VAL 74 -1.349 1.706 -3.862 519 HG12 VAL 74 HG12 VAL 74 -2.600 1.778 -2.623 520 HG13 VAL 74 HG13 VAL 74 -2.951 2.331 -4.260 521 HG21 VAL 74 HG21 VAL 74 -2.394 -0.663 -2.150 522 HG22 VAL 74 HG22 VAL 74 -1.083 -0.739 -3.329 523 HG23 VAL 74 HG23 VAL 74 -2.469 -1.816 -3.482 524 H GLU 75 HN GLU 75 -5.563 2.292 -4.181 525 HA GLU 75 HA GLU 75 -6.573 1.766 -6.871 526 HB2 GLU 75 HB2 GLU 75 -7.210 3.847 -4.790 527 HB3 GLU 75 HB1 GLU 75 -7.792 3.975 -6.441 528 HG2 GLU 75 HG2 GLU 75 -8.315 1.525 -4.811 529 HG3 GLU 75 HG1 GLU 75 -9.313 2.965 -4.656 530 H ASP 76 HN ASP 76 -6.622 3.675 -8.329 531 HA ASP 76 HA ASP 76 -5.533 5.134 -9.693 532 HB2 ASP 76 HB2 ASP 76 -4.521 6.102 -7.014 533 HB3 ASP 76 HB1 ASP 76 -4.275 6.970 -8.524 534 H ASP 77 HN ASP 77 -2.887 6.317 -9.149 535 HA ASP 77 HA ASP 77 -1.245 4.164 -10.121 536 HB2 ASP 77 HB2 ASP 77 -1.074 6.570 -10.887 537 HB3 ASP 77 HB1 ASP 77 -0.355 6.942 -9.325 538 H GLY 78 HN GLY 78 -2.390 4.101 -7.362 539 HA2 GLY 78 HA2 GLY 78 -1.570 2.956 -5.500 540 HA3 GLY 78 HA1 GLY 78 0.066 3.348 -5.991 541 H LEU 79 HN LEU 79 -2.325 5.851 -5.915 542 HA LEU 79 HA LEU 79 -0.847 7.164 -3.774 543 HB2 LEU 79 HB2 LEU 79 -3.148 8.207 -5.414 544 HB3 LEU 79 HB1 LEU 79 -2.152 9.137 -4.308 545 HG LEU 79 HG LEU 79 -1.275 7.889 -6.922 546 HD11 LEU 79 HD11 LEU 79 -0.947 10.202 -7.626 547 HD12 LEU 79 HD12 LEU 79 -1.577 10.764 -6.079 548 HD13 LEU 79 HD13 LEU 79 -2.627 9.889 -7.194 549 HD21 LEU 79 HD21 LEU 79 0.534 7.760 -5.323 550 HD22 LEU 79 HD22 LEU 79 0.315 9.455 -4.897 551 HD23 LEU 79 HD23 LEU 79 0.871 9.017 -6.511 552 H VAL 80 HN VAL 80 -3.726 5.395 -4.215 553 HA VAL 80 HA VAL 80 -4.631 6.236 -1.547 554 HB VAL 80 HB VAL 80 -6.420 5.491 -3.868 555 HG11 VAL 80 HG11 VAL 80 -7.098 6.402 -1.074 556 HG12 VAL 80 HG12 VAL 80 -7.332 4.780 -1.727 557 HG13 VAL 80 HG13 VAL 80 -8.255 6.135 -2.377 558 HG21 VAL 80 HG21 VAL 80 -5.540 7.669 -4.265 559 HG22 VAL 80 HG22 VAL 80 -5.803 8.147 -2.589 560 HG23 VAL 80 HG23 VAL 80 -7.184 7.870 -3.656 561 H GLY 81 HN GLY 81 -3.968 4.573 -0.339 562 HA2 GLY 81 HA2 GLY 81 -4.237 1.865 -1.402 563 HA3 GLY 81 HA1 GLY 81 -3.303 2.332 0.011 564 H ILE 82 HN ILE 82 -5.369 0.261 -0.443 565 HA ILE 82 HA ILE 82 -7.435 1.132 1.447 566 HB ILE 82 HB ILE 82 -7.323 -1.012 -0.637 567 HG12 ILE 82 HG12 ILE 82 -9.643 -0.151 -1.085 568 HG13 ILE 82 HG11 ILE 82 -9.358 1.074 0.147 569 HG21 ILE 82 HG21 ILE 82 -9.081 -1.073 1.795 570 HG22 ILE 82 HG22 ILE 82 -7.950 -2.305 1.244 571 HG23 ILE 82 HG23 ILE 82 -9.421 -1.981 0.324 572 HD11 ILE 82 HD11 ILE 82 -7.493 1.944 -1.154 573 HD12 ILE 82 HD12 ILE 82 -9.000 1.968 -2.071 574 HD13 ILE 82 HD13 ILE 82 -7.789 0.723 -2.392 575 H ASN 83 HN ASN 83 -7.073 0.652 3.470 576 HA ASN 83 HA ASN 83 -6.629 -0.519 5.367 577 HB2 ASN 83 HB2 ASN 83 -6.995 -2.738 3.381 578 HB3 ASN 83 HB1 ASN 83 -6.482 -3.114 5.020 579 HD21 ASN 83 HD21 ASN 83 -8.960 -3.778 3.620 580 HD22 ASN 83 HD22 ASN 83 -10.235 -3.119 4.582 581 H CYS 84 HN CYS 84 -4.504 0.628 3.897 582 HA CYS 84 HA CYS 84 -2.281 -1.162 3.806 583 HB2 CYS 84 HB2 CYS 84 -2.312 1.861 3.819 584 HB3 CYS 84 HB1 CYS 84 -0.957 0.840 3.354 585 H THR 85 HN THR 85 -1.941 -2.096 5.768 586 HA THR 85 HA THR 85 -1.594 -0.413 8.128 587 HB THR 85 HB THR 85 -1.170 -3.394 7.966 588 HG1 THR 85 HG1 THR 85 -3.557 -1.865 8.112 589 HG21 THR 85 HG21 THR 85 -0.379 -2.434 10.002 590 HG22 THR 85 HG22 THR 85 -1.940 -3.176 10.368 591 HG23 THR 85 HG23 THR 85 -1.816 -1.425 10.156 592 HA PRO 86 HA PRO 86 2.637 0.078 7.336 593 HB2 PRO 86 HB2 PRO 86 3.325 1.242 9.654 594 HB3 PRO 86 HB1 PRO 86 2.381 2.071 8.409 595 HG2 PRO 86 HG2 PRO 86 1.452 0.683 10.850 596 HG3 PRO 86 HG1 PRO 86 0.942 2.250 10.235 597 HD2 PRO 86 HD2 PRO 86 -0.463 -0.009 9.906 598 HD3 PRO 86 HD1 PRO 86 -0.483 1.275 8.708 599 H ILE 87 HN ILE 87 4.390 -1.106 7.513 600 HA ILE 87 HA ILE 87 4.354 -3.282 9.477 601 HB ILE 87 HB ILE 87 6.035 -4.266 7.761 602 HG12 ILE 87 HG12 ILE 87 4.530 -2.421 5.915 603 HG13 ILE 87 HG11 ILE 87 6.128 -2.030 6.529 604 HG21 ILE 87 HG21 ILE 87 4.166 -5.205 6.440 605 HG22 ILE 87 HG22 ILE 87 3.092 -4.011 7.172 606 HG23 ILE 87 HG23 ILE 87 3.870 -5.234 8.178 607 HD11 ILE 87 HD11 ILE 87 6.312 -2.948 4.328 608 HD12 ILE 87 HD12 ILE 87 5.378 -4.371 4.799 609 HD13 ILE 87 HD13 ILE 87 6.981 -4.101 5.484 610 HA PRO 88 HA PRO 88 8.306 -1.901 11.115 611 HB2 PRO 88 HB2 PRO 88 8.906 -4.736 11.558 612 HB3 PRO 88 HB1 PRO 88 8.704 -3.448 12.741 613 HG2 PRO 88 HG2 PRO 88 6.900 -5.396 12.492 614 HG3 PRO 88 HG1 PRO 88 6.414 -3.724 12.832 615 HD2 PRO 88 HD2 PRO 88 6.435 -5.184 10.214 616 HD3 PRO 88 HD1 PRO 88 5.155 -4.182 10.922 617 H LEU 89 HN LEU 89 10.588 -2.186 10.740 618 HA LEU 89 HA LEU 89 11.144 -2.906 7.978 619 HB2 LEU 89 HB2 LEU 89 13.001 -1.768 10.067 620 HB3 LEU 89 HB1 LEU 89 13.275 -1.815 8.334 621 HG LEU 89 HG LEU 89 11.158 -0.180 9.737 622 HD11 LEU 89 HD11 LEU 89 12.481 1.736 9.015 623 HD12 LEU 89 HD12 LEU 89 13.692 0.650 8.336 624 HD13 LEU 89 HD13 LEU 89 13.413 0.681 10.076 625 HD21 LEU 89 HD21 LEU 89 10.403 -0.928 7.546 626 HD22 LEU 89 HD22 LEU 89 11.896 -0.338 6.818 627 HD23 LEU 89 HD23 LEU 89 10.753 0.799 7.531 628 H ILE 90 HN ILE 90 10.615 -4.974 10.027 629 HA ILE 90 HA ILE 90 13.129 -6.448 9.835 630 HB ILE 90 HB ILE 90 12.632 -7.375 12.138 631 HG12 ILE 90 HG12 ILE 90 10.865 -4.918 12.293 632 HG13 ILE 90 HG11 ILE 90 10.296 -6.583 12.302 633 HG21 ILE 90 HG21 ILE 90 13.361 -4.463 11.824 634 HG22 ILE 90 HG22 ILE 90 14.455 -5.847 11.752 635 HG23 ILE 90 HG23 ILE 90 13.665 -5.428 13.271 636 HD11 ILE 90 HD11 ILE 90 10.312 -5.622 14.535 637 HD12 ILE 90 HD12 ILE 90 12.043 -5.314 14.397 638 HD13 ILE 90 HD13 ILE 90 11.440 -6.972 14.412 Start of MODEL 4 1 H1 GLY 1 HT1 GLY 1 0.650 -9.358 -12.089 2 H2 GLY 1 HT2 GLY 1 0.240 -9.361 -10.450 3 H3 GLY 1 HT3 GLY 1 1.541 -10.292 -10.996 4 HA2 GLY 1 HA1 GLY 1 2.720 -8.261 -11.639 5 HA3 GLY 1 HA2 GLY 1 1.381 -7.331 -10.978 6 H SER 2 HN SER 2 4.352 -8.711 -10.341 7 HA SER 2 HA SER 2 4.155 -9.392 -7.621 8 HB2 SER 2 HB2 SER 2 6.578 -8.323 -9.084 9 HB3 SER 2 HB1 SER 2 6.571 -9.328 -7.635 10 HG SER 2 HG SER 2 6.120 -11.054 -8.800 11 H GLY 3 HN GLY 3 4.460 -8.227 -5.766 12 HA2 GLY 3 HA2 GLY 3 4.236 -5.320 -6.063 13 HA3 GLY 3 HA1 GLY 3 3.832 -6.246 -4.622 14 H TRP 4 HN TRP 4 5.262 -6.275 -3.019 15 HA TRP 4 HA TRP 4 8.055 -5.581 -3.635 16 HB2 TRP 4 HB2 TRP 4 6.367 -4.458 -1.401 17 HB3 TRP 4 HB1 TRP 4 8.098 -4.218 -1.547 18 HD1 TRP 4 HD1 TRP 4 4.775 -3.069 -2.993 19 HE1 TRP 4 HE1 TRP 4 5.172 -1.005 -4.474 20 HE3 TRP 4 HE3 TRP 4 9.884 -3.110 -3.079 21 HZ2 TRP 4 HZ2 TRP 4 7.365 0.416 -5.536 22 HZ3 TRP 4 HZ3 TRP 4 11.056 -1.362 -4.351 23 HH2 TRP 4 HH2 TRP 4 9.823 0.366 -5.551 24 H GLU 5 HN GLU 5 9.266 -5.788 -1.304 25 HA GLU 5 HA GLU 5 9.475 -8.529 -0.852 26 HB2 GLU 5 HB2 GLU 5 10.456 -6.106 0.616 27 HB3 GLU 5 HB1 GLU 5 10.678 -7.705 1.319 28 HG2 GLU 5 HG2 GLU 5 12.658 -7.053 0.132 29 HG3 GLU 5 HG1 GLU 5 11.886 -8.395 -0.710 30 H SER 6 HN SER 6 7.845 -9.702 -0.135 31 HA SER 6 HA SER 6 6.446 -8.817 2.295 32 HB2 SER 6 HB2 SER 6 5.531 -10.774 0.175 33 HB3 SER 6 HB1 SER 6 4.602 -10.273 1.589 34 HG SER 6 HG SER 6 5.548 -8.526 -0.445 35 H LYS 7 HN LYS 7 8.942 -10.657 1.446 36 HA LYS 7 HA LYS 7 8.375 -13.210 2.486 37 HB2 LYS 7 HB2 LYS 7 10.658 -13.706 2.243 38 HB3 LYS 7 HB1 LYS 7 10.300 -12.565 0.961 39 HG2 LYS 7 HG2 LYS 7 11.608 -11.838 3.575 40 HG3 LYS 7 HG1 LYS 7 12.474 -12.180 2.080 41 HD2 LYS 7 HD2 LYS 7 11.249 -10.306 1.010 42 HD3 LYS 7 HD1 LYS 7 10.517 -9.942 2.574 43 HE2 LYS 7 HE2 LYS 7 13.463 -9.898 1.922 44 HE3 LYS 7 HE1 LYS 7 12.428 -8.495 2.157 45 HZ1 LYS 7 HZ1 LYS 7 13.192 -10.506 4.201 46 HZ2 LYS 7 HZ2 LYS 7 12.042 -9.290 4.458 47 HZ3 LYS 7 HZ3 LYS 7 13.653 -8.880 4.147 48 H THR 8 HN THR 8 8.907 -10.269 4.080 49 HA THR 8 HA THR 8 9.989 -11.435 6.502 50 HB THR 8 HB THR 8 8.894 -8.657 6.411 51 HG1 THR 8 HG1 THR 8 10.555 -7.926 5.168 52 HG21 THR 8 HG21 THR 8 11.445 -9.844 7.515 53 HG22 THR 8 HG22 THR 8 9.982 -9.509 8.440 54 HG23 THR 8 HG23 THR 8 10.899 -8.181 7.730 55 H GLY 9 HN GLY 9 7.056 -11.699 5.213 56 HA2 GLY 9 HA2 GLY 9 4.950 -12.092 6.107 57 HA3 GLY 9 HA1 GLY 9 5.619 -11.801 7.712 58 H SER 10 HN SER 10 6.308 -9.490 5.356 59 HA SER 10 HA SER 10 5.145 -7.409 6.877 60 HB2 SER 10 HB2 SER 10 5.942 -6.103 4.735 61 HB3 SER 10 HB1 SER 10 7.122 -6.793 5.849 62 HG SER 10 HG SER 10 7.221 -7.230 3.405 63 H CYS 11 HN CYS 11 4.166 -9.164 4.035 64 HA CYS 11 HA CYS 11 1.561 -7.920 4.175 65 HB2 CYS 11 HB2 CYS 11 3.087 -6.455 2.713 66 HB3 CYS 11 HB1 CYS 11 3.014 -7.768 1.542 67 H ASN 12 HN ASN 12 -0.053 -9.177 3.287 68 HA ASN 12 HA ASN 12 0.731 -11.881 2.520 69 HB2 ASN 12 HB2 ASN 12 -2.109 -11.000 2.702 70 HB3 ASN 12 HB1 ASN 12 -1.416 -12.574 3.054 71 HD21 ASN 12 HD21 ASN 12 -2.153 -9.435 4.239 72 HD22 ASN 12 HD22 ASN 12 -1.761 -9.730 5.896 73 H THR 13 HN THR 13 -0.673 -9.005 1.205 74 HA THR 13 HA THR 13 -1.526 -10.342 -1.232 75 HB THR 13 HB THR 13 -2.329 -7.999 -1.820 76 HG1 THR 13 HG1 THR 13 -2.201 -6.441 -0.265 77 HG21 THR 13 HG21 THR 13 -4.241 -8.111 -0.266 78 HG22 THR 13 HG22 THR 13 -3.359 -9.282 0.718 79 HG23 THR 13 HG23 THR 13 -3.842 -9.697 -0.927 80 H GLY 14 HN GLY 14 1.168 -8.659 -0.024 81 HA2 GLY 14 HA2 GLY 14 3.233 -8.455 -1.091 82 HA3 GLY 14 HA1 GLY 14 2.449 -8.808 -2.623 83 H LYS 15 HN LYS 15 0.497 -6.573 -1.394 84 HA LYS 15 HA LYS 15 1.715 -4.514 -3.036 85 HB2 LYS 15 HB2 LYS 15 -0.996 -4.781 -1.745 86 HB3 LYS 15 HB1 LYS 15 -0.477 -3.308 -2.551 87 HG2 LYS 15 HG2 LYS 15 -0.224 -4.511 -4.640 88 HG3 LYS 15 HG1 LYS 15 -0.671 -6.022 -3.842 89 HD2 LYS 15 HD2 LYS 15 -2.881 -5.197 -3.394 90 HD3 LYS 15 HD1 LYS 15 -2.452 -3.591 -3.978 91 HE2 LYS 15 HE2 LYS 15 -3.753 -4.837 -5.632 92 HE3 LYS 15 HE1 LYS 15 -2.133 -4.469 -6.218 93 HZ1 LYS 15 HZ1 LYS 15 -3.045 -7.074 -5.121 94 HZ2 LYS 15 HZ2 LYS 15 -1.470 -6.737 -5.641 95 HZ3 LYS 15 HZ3 LYS 15 -2.743 -6.727 -6.748 96 H LEU 16 HN LEU 16 3.448 -3.903 -1.682 97 HA LEU 16 HA LEU 16 2.766 -2.550 0.786 98 HB2 LEU 16 HB2 LEU 16 5.366 -3.036 -0.646 99 HB3 LEU 16 HB1 LEU 16 5.253 -1.940 0.707 100 HG LEU 16 HG LEU 16 4.401 -3.848 2.092 101 HD11 LEU 16 HD11 LEU 16 5.292 -5.476 -0.271 102 HD12 LEU 16 HD12 LEU 16 3.625 -5.244 0.263 103 HD13 LEU 16 HD13 LEU 16 4.772 -6.101 1.295 104 HD21 LEU 16 HD21 LEU 16 6.608 -4.857 2.397 105 HD22 LEU 16 HD22 LEU 16 6.718 -3.105 2.222 106 HD23 LEU 16 HD23 LEU 16 7.140 -4.154 0.869 107 H ALA 17 HN ALA 17 2.754 -0.340 1.036 108 HA ALA 17 HA ALA 17 3.521 1.295 -1.266 109 HB1 ALA 17 HB1 ALA 17 0.861 1.532 0.137 110 HB2 ALA 17 HB2 ALA 17 1.124 0.950 -1.508 111 HB3 ALA 17 HB3 ALA 17 1.474 2.631 -1.100 112 H CYS 18 HN CYS 18 4.281 3.303 -0.761 113 HA CYS 18 HA CYS 18 4.988 3.830 1.983 114 HB2 CYS 18 HB2 CYS 18 5.293 5.659 -0.411 115 HB3 CYS 18 HB1 CYS 18 6.170 5.742 1.111 116 H CYS 19 HN CYS 19 3.351 4.467 3.275 117 HA CYS 19 HA CYS 19 1.400 6.356 2.145 118 HB2 CYS 19 HB2 CYS 19 0.805 4.022 3.965 119 HB3 CYS 19 HB1 CYS 19 -0.371 5.193 3.376 120 H ASP 20 HN ASP 20 0.555 7.889 3.488 121 HA ASP 20 HA ASP 20 1.960 8.260 6.024 122 HB2 ASP 20 HB2 ASP 20 0.252 10.090 4.342 123 HB3 ASP 20 HB1 ASP 20 0.699 10.497 5.991 124 H THR 21 HN THR 21 1.050 7.536 7.788 125 HA THR 21 HA THR 21 -1.667 6.602 7.748 126 HB THR 21 HB THR 21 -1.203 5.886 10.081 127 HG1 THR 21 HG1 THR 21 0.437 6.772 11.086 128 HG21 THR 21 HG21 THR 21 0.911 5.119 8.064 129 HG22 THR 21 HG22 THR 21 -0.693 4.397 8.211 130 HG23 THR 21 HG23 THR 21 0.485 4.201 9.508 131 H ASN 22 HN ASN 22 -0.394 9.568 8.110 132 HA ASN 22 HA ASN 22 -2.331 10.456 10.124 133 HB2 ASN 22 HB2 ASN 22 0.043 11.895 8.913 134 HB3 ASN 22 HB1 ASN 22 -1.024 12.553 10.143 135 HD21 ASN 22 HD21 ASN 22 1.850 12.066 10.191 136 HD22 ASN 22 HD22 ASN 22 2.133 11.042 11.555 137 H LYS 23 HN LYS 23 -1.695 10.298 6.812 138 HA LYS 23 HA LYS 23 -3.688 12.378 6.241 139 HB2 LYS 23 HB2 LYS 23 -1.152 11.662 4.822 140 HB3 LYS 23 HB1 LYS 23 -2.465 12.425 3.955 141 HG2 LYS 23 HG2 LYS 23 -2.406 14.239 5.716 142 HG3 LYS 23 HG1 LYS 23 -0.913 13.483 6.263 143 HD2 LYS 23 HD2 LYS 23 -1.387 14.538 3.491 144 HD3 LYS 23 HD1 LYS 23 -0.477 15.369 4.760 145 HE2 LYS 23 HE2 LYS 23 1.144 13.625 4.832 146 HE3 LYS 23 HE1 LYS 23 0.165 12.623 3.763 147 HZ1 LYS 23 HZ1 LYS 23 1.914 13.576 2.479 148 HZ2 LYS 23 HZ2 LYS 23 1.610 15.125 3.079 149 HZ3 LYS 23 HZ3 LYS 23 0.497 14.392 2.042 150 H LYS 24 HN LYS 24 -5.271 11.888 4.782 151 HA LYS 24 HA LYS 24 -5.344 9.150 3.841 152 HB2 LYS 24 HB2 LYS 24 -7.451 8.665 4.893 153 HB3 LYS 24 HB1 LYS 24 -6.263 9.114 6.102 154 HG2 LYS 24 HG2 LYS 24 -8.277 11.043 4.996 155 HG3 LYS 24 HG1 LYS 24 -8.556 10.025 6.389 156 HD2 LYS 24 HD2 LYS 24 -6.284 11.966 6.210 157 HD3 LYS 24 HD1 LYS 24 -7.844 12.359 6.927 158 HE2 LYS 24 HE2 LYS 24 -7.518 10.460 8.502 159 HE3 LYS 24 HE1 LYS 24 -5.901 10.244 7.836 160 HZ1 LYS 24 HZ1 LYS 24 -5.882 11.558 9.871 161 HZ2 LYS 24 HZ2 LYS 24 -6.887 12.712 9.155 162 HZ3 LYS 24 HZ3 LYS 24 -5.325 12.464 8.555 163 H VAL 25 HN VAL 25 -7.285 8.644 2.557 164 HA VAL 25 HA VAL 25 -7.829 10.941 0.787 165 HB VAL 25 HB VAL 25 -8.126 8.142 -0.182 166 HG11 VAL 25 HG11 VAL 25 -7.392 9.144 -2.281 167 HG12 VAL 25 HG12 VAL 25 -7.130 10.680 -1.458 168 HG13 VAL 25 HG13 VAL 25 -8.759 10.017 -1.589 169 HG21 VAL 25 HG21 VAL 25 -5.440 9.492 0.133 170 HG22 VAL 25 HG22 VAL 25 -5.748 8.033 -0.812 171 HG23 VAL 25 HG23 VAL 25 -5.987 8.013 0.933 172 H GLN 26 HN GLN 26 -9.883 11.108 -0.158 173 HA GLN 26 HA GLN 26 -12.046 10.279 1.505 174 HB2 GLN 26 HB2 GLN 26 -13.423 11.491 -0.128 175 HB3 GLN 26 HB1 GLN 26 -12.078 12.457 0.451 176 HG2 GLN 26 HG2 GLN 26 -10.869 12.014 -1.599 177 HG3 GLN 26 HG1 GLN 26 -12.172 10.973 -2.163 178 HE21 GLN 26 HE21 GLN 26 -14.231 12.741 -1.058 179 HE22 GLN 26 HE22 GLN 26 -14.317 14.091 -2.131 180 H LYS 27 HN LYS 27 -10.414 8.613 -0.827 181 HA LYS 27 HA LYS 27 -12.818 7.323 -1.910 182 HB2 LYS 27 HB2 LYS 27 -9.966 7.339 -2.906 183 HB3 LYS 27 HB1 LYS 27 -11.269 6.426 -3.649 184 HG2 LYS 27 HG2 LYS 27 -11.284 9.410 -3.322 185 HG3 LYS 27 HG1 LYS 27 -10.730 8.587 -4.777 186 HD2 LYS 27 HD2 LYS 27 -13.497 8.531 -3.580 187 HD3 LYS 27 HD1 LYS 27 -13.004 9.337 -5.070 188 HE2 LYS 27 HE2 LYS 27 -12.915 6.383 -4.557 189 HE3 LYS 27 HE1 LYS 27 -14.155 7.209 -5.494 190 HZ1 LYS 27 HZ1 LYS 27 -12.661 6.368 -7.058 191 HZ2 LYS 27 HZ2 LYS 27 -11.297 6.807 -6.166 192 HZ3 LYS 27 HZ3 LYS 27 -12.227 7.998 -6.933 193 H SER 28 HN SER 28 -13.374 5.453 -1.033 194 HA SER 28 HA SER 28 -11.317 3.837 0.294 195 HB2 SER 28 HB2 SER 28 -14.333 3.632 0.472 196 HB3 SER 28 HB1 SER 28 -13.171 2.722 1.439 197 HG SER 28 HG SER 28 -12.494 5.211 1.752 198 H THR 29 HN THR 29 -12.366 4.099 -2.666 199 HA THR 29 HA THR 29 -13.075 1.349 -3.229 200 HB THR 29 HB THR 29 -13.067 2.221 -5.631 201 HG1 THR 29 HG1 THR 29 -11.865 4.061 -5.497 202 HG21 THR 29 HG21 THR 29 -15.125 1.937 -4.345 203 HG22 THR 29 HG22 THR 29 -15.211 3.386 -5.349 204 HG23 THR 29 HG23 THR 29 -14.902 3.529 -3.618 205 H GLY 30 HN GLY 30 -11.925 0.257 -5.068 206 HA2 GLY 30 HA2 GLY 30 -9.094 0.853 -5.311 207 HA3 GLY 30 HA1 GLY 30 -9.487 -0.629 -4.446 208 H GLU 31 HN GLU 31 -8.134 -1.401 -6.399 209 HA GLU 31 HA GLU 31 -9.772 -1.554 -8.832 210 HB2 GLU 31 HB2 GLU 31 -6.845 -2.196 -8.461 211 HB3 GLU 31 HB1 GLU 31 -7.717 -2.204 -9.987 212 HG2 GLU 31 HG2 GLU 31 -8.187 0.218 -9.650 213 HG3 GLU 31 HG1 GLU 31 -7.130 0.170 -8.238 214 H GLU 32 HN GLU 32 -8.544 -3.491 -6.248 215 HA GLU 32 HA GLU 32 -9.136 -5.946 -7.721 216 HB2 GLU 32 HB2 GLU 32 -7.548 -5.398 -5.233 217 HB3 GLU 32 HB1 GLU 32 -8.066 -7.027 -5.648 218 HG2 GLU 32 HG2 GLU 32 -6.447 -5.271 -7.473 219 HG3 GLU 32 HG1 GLU 32 -5.747 -6.441 -6.355 220 H SER 33 HN SER 33 -9.515 -4.910 -4.353 221 HA SER 33 HA SER 33 -11.932 -6.533 -4.163 222 HB2 SER 33 HB2 SER 33 -10.137 -6.604 -2.388 223 HB3 SER 33 HB1 SER 33 -10.557 -4.941 -1.981 224 HG SER 33 HG SER 33 -11.953 -5.866 -0.705 225 H GLY 34 HN GLY 34 -10.864 -3.251 -4.353 226 HA2 GLY 34 HA2 GLY 34 -13.101 -1.930 -3.270 227 HA3 GLY 34 HA1 GLY 34 -11.960 -1.246 -4.409 228 H LEU 35 HN LEU 35 -12.581 -3.279 -6.464 229 HA LEU 35 HA LEU 35 -14.869 -1.972 -7.613 230 HB2 LEU 35 HB2 LEU 35 -13.224 -4.315 -8.566 231 HB3 LEU 35 HB1 LEU 35 -14.518 -3.581 -9.493 232 HG LEU 35 HG LEU 35 -11.920 -2.270 -8.689 233 HD11 LEU 35 HD11 LEU 35 -11.706 -3.871 -10.512 234 HD12 LEU 35 HD12 LEU 35 -11.505 -2.219 -11.096 235 HD13 LEU 35 HD13 LEU 35 -13.021 -3.075 -11.379 236 HD21 LEU 35 HD21 LEU 35 -14.282 -1.154 -10.192 237 HD22 LEU 35 HD22 LEU 35 -12.708 -0.373 -10.059 238 HD23 LEU 35 HD23 LEU 35 -13.689 -0.628 -8.617 239 H LEU 36 HN LEU 36 -14.280 -4.786 -5.759 240 HA LEU 36 HA LEU 36 -16.733 -6.127 -6.450 241 HB2 LEU 36 HB2 LEU 36 -14.616 -6.614 -4.364 242 HB3 LEU 36 HB1 LEU 36 -16.017 -7.630 -4.576 243 HG LEU 36 HG LEU 36 -13.917 -7.166 -6.684 244 HD11 LEU 36 HD11 LEU 36 -13.011 -8.379 -4.780 245 HD12 LEU 36 HD12 LEU 36 -13.195 -9.444 -6.173 246 HD13 LEU 36 HD13 LEU 36 -14.357 -9.515 -4.849 247 HD21 LEU 36 HD21 LEU 36 -16.098 -7.710 -7.616 248 HD22 LEU 36 HD22 LEU 36 -16.225 -9.105 -6.543 249 HD23 LEU 36 HD23 LEU 36 -14.989 -9.068 -7.800 250 H HIS 37 HN HIS 37 -18.120 -6.848 -4.510 251 HA HIS 37 HA HIS 37 -19.068 -4.500 -3.146 252 HB2 HIS 37 HB2 HIS 37 -19.917 -7.384 -3.194 253 HB3 HIS 37 HB1 HIS 37 -20.588 -6.274 -2.007 254 HD1 HIS 37 HD1 HIS 37 -22.882 -5.804 -2.797 255 HD2 HIS 37 HD2 HIS 37 -20.119 -5.652 -5.892 256 HE1 HIS 37 HE1 HIS 37 -24.169 -5.030 -4.810 257 HE2 HIS 37 HE2 HIS 37 -22.432 -4.747 -6.611 258 H THR 38 HN THR 38 -16.708 -6.810 -2.549 259 HA THR 38 HA THR 38 -16.742 -6.813 0.296 260 HB THR 38 HB THR 38 -14.304 -7.243 -1.437 261 HG1 THR 38 HG1 THR 38 -15.094 -9.535 -1.310 262 HG21 THR 38 HG21 THR 38 -15.168 -8.456 1.192 263 HG22 THR 38 HG22 THR 38 -13.951 -7.198 0.992 264 HG23 THR 38 HG23 THR 38 -13.670 -8.808 0.332 265 H GLY 39 HN GLY 39 -15.536 -4.657 -2.134 266 HA2 GLY 39 HA2 GLY 39 -14.037 -3.101 -0.157 267 HA3 GLY 39 HA1 GLY 39 -14.027 -2.854 -1.896 268 H ASP 40 HN ASP 40 -17.105 -3.377 -0.658 269 HA ASP 40 HA ASP 40 -18.007 -0.723 -1.228 270 HB2 ASP 40 HB2 ASP 40 -19.364 -2.860 -1.417 271 HB3 ASP 40 HB1 ASP 40 -19.457 -2.861 0.329 272 H VAL 41 HN VAL 41 -17.198 -2.580 1.574 273 HA VAL 41 HA VAL 41 -18.268 -0.947 3.576 274 HB VAL 41 HB VAL 41 -16.444 -2.033 5.027 275 HG11 VAL 41 HG11 VAL 41 -18.743 -2.836 4.925 276 HG12 VAL 41 HG12 VAL 41 -17.627 -4.202 4.966 277 HG13 VAL 41 HG13 VAL 41 -18.386 -3.728 3.445 278 HG21 VAL 41 HG21 VAL 41 -14.914 -2.492 3.139 279 HG22 VAL 41 HG22 VAL 41 -16.079 -3.655 2.509 280 HG23 VAL 41 HG23 VAL 41 -15.306 -3.933 4.071 281 H LEU 42 HN LEU 42 -17.643 0.844 4.546 282 HA LEU 42 HA LEU 42 -15.255 2.211 3.646 283 HB2 LEU 42 HB2 LEU 42 -17.699 2.941 5.164 284 HB3 LEU 42 HB1 LEU 42 -16.258 3.883 5.455 285 HG LEU 42 HG LEU 42 -16.146 4.415 3.033 286 HD11 LEU 42 HD11 LEU 42 -17.310 2.473 2.154 287 HD12 LEU 42 HD12 LEU 42 -18.092 3.963 1.624 288 HD13 LEU 42 HD13 LEU 42 -18.806 3.005 2.921 289 HD21 LEU 42 HD21 LEU 42 -18.749 5.114 4.383 290 HD22 LEU 42 HD22 LEU 42 -18.028 5.973 3.022 291 HD23 LEU 42 HD23 LEU 42 -17.213 5.956 4.585 292 H ASP 43 HN ASP 43 -15.903 -0.099 5.815 293 HA ASP 43 HA ASP 43 -14.468 0.610 8.118 294 HB2 ASP 43 HB2 ASP 43 -15.824 -1.422 8.018 295 HB3 ASP 43 HB1 ASP 43 -14.773 -2.090 6.772 296 H GLN 44 HN GLN 44 -13.489 -0.580 4.977 297 HA GLN 44 HA GLN 44 -10.794 -1.003 5.300 298 HB2 GLN 44 HB2 GLN 44 -12.068 0.430 2.988 299 HB3 GLN 44 HB1 GLN 44 -10.550 -0.441 2.964 300 HG2 GLN 44 HG2 GLN 44 -11.775 -2.524 3.456 301 HG3 GLN 44 HG1 GLN 44 -13.281 -1.624 3.354 302 HE21 GLN 44 HE21 GLN 44 -12.363 0.032 1.130 303 HE22 GLN 44 HE22 GLN 44 -12.368 -0.984 -0.258 304 H VAL 45 HN VAL 45 -8.990 0.295 5.270 305 HA VAL 45 HA VAL 45 -9.498 3.088 5.939 306 HB VAL 45 HB VAL 45 -8.380 1.829 7.684 307 HG11 VAL 45 HG11 VAL 45 -7.240 0.144 6.695 308 HG12 VAL 45 HG12 VAL 45 -5.952 1.213 7.250 309 HG13 VAL 45 HG13 VAL 45 -6.434 1.212 5.551 310 HG21 VAL 45 HG21 VAL 45 -6.588 3.867 6.383 311 HG22 VAL 45 HG22 VAL 45 -6.472 3.328 8.058 312 HG23 VAL 45 HG23 VAL 45 -7.902 4.202 7.509 313 H ALA 46 HN ALA 46 -9.109 4.526 4.478 314 HA ALA 46 HA ALA 46 -7.196 3.911 2.333 315 HB1 ALA 46 HB1 ALA 46 -9.520 5.825 2.401 316 HB2 ALA 46 HB2 ALA 46 -9.414 4.311 1.500 317 HB3 ALA 46 HB3 ALA 46 -8.383 5.679 1.059 318 H ILE 47 HN ILE 47 -5.285 4.632 3.077 319 HA ILE 47 HA ILE 47 -5.180 7.427 3.917 320 HB ILE 47 HB ILE 47 -2.839 6.882 4.687 321 HG12 ILE 47 HG12 ILE 47 -3.859 4.055 4.307 322 HG13 ILE 47 HG11 ILE 47 -2.518 4.799 3.443 323 HG21 ILE 47 HG21 ILE 47 -4.778 7.172 6.171 324 HG22 ILE 47 HG22 ILE 47 -3.624 5.990 6.800 325 HG23 ILE 47 HG23 ILE 47 -5.121 5.445 6.034 326 HD11 ILE 47 HD11 ILE 47 -1.684 3.334 5.159 327 HD12 ILE 47 HD12 ILE 47 -2.630 4.177 6.385 328 HD13 ILE 47 HD13 ILE 47 -1.300 5.004 5.572 329 H GLN 48 HN GLN 48 -3.414 8.740 3.100 330 HA GLN 48 HA GLN 48 -3.295 8.462 0.225 331 HB2 GLN 48 HB2 GLN 48 -3.532 10.627 1.702 332 HB3 GLN 48 HB1 GLN 48 -1.777 10.534 1.790 333 HG2 GLN 48 HG2 GLN 48 -1.980 11.856 -0.033 334 HG3 GLN 48 HG1 GLN 48 -2.024 10.279 -0.815 335 HE21 GLN 48 HE21 GLN 48 -3.178 11.047 -2.573 336 HE22 GLN 48 HE22 GLN 48 -4.852 11.469 -2.462 337 H CYS 49 HN CYS 49 -1.764 7.673 -0.911 338 HA CYS 49 HA CYS 49 0.790 7.015 0.381 339 HB2 CYS 49 HB2 CYS 49 -0.726 5.340 -1.626 340 HB3 CYS 49 HB1 CYS 49 0.754 4.909 -0.795 341 H THR 50 HN THR 50 2.551 6.653 -1.182 342 HA THR 50 HA THR 50 2.237 7.608 -3.868 343 HB THR 50 HB THR 50 2.357 9.761 -2.714 344 HG1 THR 50 HG1 THR 50 4.311 10.531 -3.802 345 HG21 THR 50 HG21 THR 50 3.543 9.071 -0.709 346 HG22 THR 50 HG22 THR 50 4.386 10.410 -1.490 347 HG23 THR 50 HG23 THR 50 4.998 8.763 -1.655 348 H GLN 51 HN GLN 51 3.940 6.944 -5.179 349 HA GLN 51 HA GLN 51 6.089 5.513 -3.777 350 HB2 GLN 51 HB2 GLN 51 4.188 4.293 -5.270 351 HB3 GLN 51 HB1 GLN 51 5.404 4.603 -6.503 352 HG2 GLN 51 HG2 GLN 51 5.972 3.213 -3.897 353 HG3 GLN 51 HG1 GLN 51 5.569 2.375 -5.394 354 HE21 GLN 51 HE21 GLN 51 8.018 2.426 -3.688 355 HE22 GLN 51 HE22 GLN 51 9.308 2.812 -4.771 356 H ILE 52 HN ILE 52 7.972 6.390 -4.073 357 HA ILE 52 HA ILE 52 8.464 8.304 -6.188 358 HB ILE 52 HB ILE 52 10.264 7.338 -3.950 359 HG12 ILE 52 HG12 ILE 52 8.492 9.784 -4.139 360 HG13 ILE 52 HG11 ILE 52 8.185 8.371 -3.137 361 HG21 ILE 52 HG21 ILE 52 10.481 9.826 -5.645 362 HG22 ILE 52 HG22 ILE 52 11.467 8.380 -5.846 363 HG23 ILE 52 HG23 ILE 52 11.581 9.325 -4.362 364 HD11 ILE 52 HD11 ILE 52 10.170 8.848 -1.836 365 HD12 ILE 52 HD12 ILE 52 9.076 10.230 -1.848 366 HD13 ILE 52 HD13 ILE 52 10.521 10.240 -2.859 367 HA PRO 53 HA PRO 53 9.962 5.787 -9.431 368 HB2 PRO 53 HB2 PRO 53 12.572 7.090 -9.394 369 HB3 PRO 53 HB1 PRO 53 11.312 7.145 -10.626 370 HG2 PRO 53 HG2 PRO 53 11.890 9.052 -8.495 371 HG3 PRO 53 HG1 PRO 53 10.853 9.243 -9.916 372 HD2 PRO 53 HD2 PRO 53 9.871 9.109 -7.398 373 HD3 PRO 53 HD1 PRO 53 8.978 8.486 -8.801 374 H LEU 54 HN LEU 54 10.515 3.770 -9.197 375 HA LEU 54 HA LEU 54 12.349 3.040 -7.068 376 HB2 LEU 54 HB2 LEU 54 11.196 0.891 -7.044 377 HB3 LEU 54 HB1 LEU 54 10.079 2.222 -6.831 378 HG LEU 54 HG LEU 54 9.828 1.909 -9.480 379 HD11 LEU 54 HD11 LEU 54 11.431 0.083 -9.623 380 HD12 LEU 54 HD12 LEU 54 9.810 -0.462 -10.054 381 HD13 LEU 54 HD13 LEU 54 10.480 -0.855 -8.472 382 HD21 LEU 54 HD21 LEU 54 8.021 1.876 -7.830 383 HD22 LEU 54 HD22 LEU 54 8.423 0.206 -7.429 384 HD23 LEU 54 HD23 LEU 54 7.827 0.607 -9.040 385 H LEU 55 HN LEU 55 14.104 1.779 -7.372 386 HA LEU 55 HA LEU 55 14.697 0.816 -10.069 387 HB2 LEU 55 HB2 LEU 55 16.271 0.745 -7.492 388 HB3 LEU 55 HB1 LEU 55 16.825 0.027 -8.988 389 HG LEU 55 HG LEU 55 16.320 2.964 -8.517 390 HD11 LEU 55 HD11 LEU 55 18.329 2.111 -7.410 391 HD12 LEU 55 HD12 LEU 55 18.732 3.184 -8.750 392 HD13 LEU 55 HD13 LEU 55 18.884 1.438 -8.943 393 HD21 LEU 55 HD21 LEU 55 15.785 2.374 -10.803 394 HD22 LEU 55 HD22 LEU 55 17.314 1.512 -10.965 395 HD23 LEU 55 HD23 LEU 55 17.306 3.262 -10.749 396 H ILE 56 HN ILE 56 14.511 -1.308 -10.653 397 HA ILE 56 HA ILE 56 12.788 -2.945 -9.128 398 HB ILE 56 HB ILE 56 14.570 -3.895 -11.362 399 HG12 ILE 56 HG12 ILE 56 11.821 -2.637 -11.530 400 HG13 ILE 56 HG11 ILE 56 13.322 -1.914 -12.100 401 HG21 ILE 56 HG21 ILE 56 13.504 -5.678 -10.123 402 HG22 ILE 56 HG22 ILE 56 12.775 -5.539 -11.722 403 HG23 ILE 56 HG23 ILE 56 11.932 -4.902 -10.311 404 HD11 ILE 56 HD11 ILE 56 13.553 -3.750 -13.722 405 HD12 ILE 56 HD12 ILE 56 12.081 -2.809 -13.954 406 HD13 ILE 56 HD13 ILE 56 12.002 -4.391 -13.181 407 H GLY 57 HN GLY 57 13.160 -4.566 -7.754 408 HA2 GLY 57 HA2 GLY 57 14.392 -6.230 -6.647 409 HA3 GLY 57 HA1 GLY 57 15.854 -5.618 -7.404 410 H ILE 58 HN ILE 58 13.968 -3.149 -6.082 411 HA ILE 58 HA ILE 58 15.731 -3.049 -3.742 412 HB ILE 58 HB ILE 58 14.922 -1.060 -5.668 413 HG12 ILE 58 HG12 ILE 58 17.223 -1.681 -5.024 414 HG13 ILE 58 HG11 ILE 58 16.914 0.044 -4.895 415 HG21 ILE 58 HG21 ILE 58 13.321 -0.321 -4.014 416 HG22 ILE 58 HG22 ILE 58 14.643 0.839 -4.140 417 HG23 ILE 58 HG23 ILE 58 14.581 -0.287 -2.780 418 HD11 ILE 58 HD11 ILE 58 16.677 -0.161 -2.486 419 HD12 ILE 58 HD12 ILE 58 18.232 -0.803 -3.018 420 HD13 ILE 58 HD13 ILE 58 16.919 -1.902 -2.597 421 H ALA 59 HN ALA 59 14.991 -2.534 -1.795 422 HA ALA 59 HA ALA 59 12.351 -3.346 -1.063 423 HB1 ALA 59 HB1 ALA 59 13.125 -2.695 1.205 424 HB2 ALA 59 HB2 ALA 59 14.600 -2.051 0.473 425 HB3 ALA 59 HB3 ALA 59 14.245 -3.775 0.372 426 H ILE 60 HN ILE 60 10.597 -2.111 -0.859 427 HA ILE 60 HA ILE 60 10.424 0.481 -1.866 428 HB ILE 60 HB ILE 60 8.509 -1.074 -1.668 429 HG12 ILE 60 HG12 ILE 60 8.065 1.590 -0.304 430 HG13 ILE 60 HG11 ILE 60 8.191 1.353 -2.044 431 HG21 ILE 60 HG21 ILE 60 8.661 -0.371 1.265 432 HG22 ILE 60 HG22 ILE 60 8.862 -1.968 0.536 433 HG23 ILE 60 HG23 ILE 60 7.288 -1.172 0.495 434 HD11 ILE 60 HD11 ILE 60 6.184 -0.025 -2.000 435 HD12 ILE 60 HD12 ILE 60 5.886 1.585 -1.343 436 HD13 ILE 60 HD13 ILE 60 6.064 0.208 -0.255 437 H GLU 61 HN GLU 61 11.009 -0.604 1.412 438 HA GLU 61 HA GLU 61 10.467 1.961 2.578 439 HB2 GLU 61 HB2 GLU 61 11.228 0.915 4.665 440 HB3 GLU 61 HB1 GLU 61 10.035 -0.067 3.844 441 HG2 GLU 61 HG2 GLU 61 11.507 -1.685 4.430 442 HG3 GLU 61 HG1 GLU 61 12.175 -1.245 2.861 443 H ASP 62 HN ASP 62 12.999 0.627 0.885 444 HA ASP 62 HA ASP 62 15.011 2.409 2.047 445 HB2 ASP 62 HB2 ASP 62 15.580 0.008 1.534 446 HB3 ASP 62 HB1 ASP 62 15.325 0.369 -0.170 447 H GLU 63 HN GLU 63 13.142 1.738 -0.798 448 HA GLU 63 HA GLU 63 14.331 3.608 -2.543 449 HB2 GLU 63 HB2 GLU 63 12.884 1.603 -3.134 450 HB3 GLU 63 HB1 GLU 63 11.499 2.563 -2.642 451 HG2 GLU 63 HG2 GLU 63 11.860 2.546 -5.068 452 HG3 GLU 63 HG1 GLU 63 11.924 4.153 -4.366 453 H CYS 64 HN CYS 64 11.596 3.758 -0.301 454 HA CYS 64 HA CYS 64 11.463 6.657 -0.818 455 HB2 CYS 64 HB2 CYS 64 9.127 6.636 -0.522 456 HB3 CYS 64 HB1 CYS 64 9.449 5.206 -1.499 457 H LYS 65 HN LYS 65 11.258 8.028 0.979 458 HA LYS 65 HA LYS 65 12.079 6.787 3.500 459 HB2 LYS 65 HB2 LYS 65 12.121 9.697 2.675 460 HB3 LYS 65 HB1 LYS 65 12.738 9.051 4.186 461 HG2 LYS 65 HG2 LYS 65 13.787 8.358 1.454 462 HG3 LYS 65 HG1 LYS 65 14.515 9.518 2.566 463 HD2 LYS 65 HD2 LYS 65 14.071 6.604 3.180 464 HD3 LYS 65 HD1 LYS 65 15.593 7.278 2.599 465 HE2 LYS 65 HE2 LYS 65 14.185 7.998 5.167 466 HE3 LYS 65 HE1 LYS 65 15.619 6.988 5.021 467 HZ1 LYS 65 HZ1 LYS 65 16.223 9.211 5.660 468 HZ2 LYS 65 HZ2 LYS 65 15.429 9.865 4.320 469 HZ3 LYS 65 HZ3 LYS 65 16.801 8.905 4.102 470 H ASN 66 HN ASN 66 9.489 6.305 2.983 471 HA ASN 66 HA ASN 66 8.142 7.982 4.991 472 HB2 ASN 66 HB2 ASN 66 6.970 6.900 2.428 473 HB3 ASN 66 HB1 ASN 66 5.977 7.457 3.766 474 HD21 ASN 66 HD21 ASN 66 8.075 8.384 1.180 475 HD22 ASN 66 HD22 ASN 66 7.777 10.082 1.266 476 H THR 67 HN THR 67 5.866 6.529 5.378 477 HA THR 67 HA THR 67 6.983 4.249 6.747 478 HB THR 67 HB THR 67 4.129 5.258 6.736 479 HG1 THR 67 HG1 THR 67 6.271 6.364 7.774 480 HG21 THR 67 HG21 THR 67 4.029 3.954 8.884 481 HG22 THR 67 HG22 THR 67 5.592 3.250 8.450 482 HG23 THR 67 HG23 THR 67 4.182 2.967 7.430 483 HA PRO 68 HA PRO 68 5.668 1.454 3.558 484 HB2 PRO 68 HB2 PRO 68 6.712 -0.771 4.673 485 HB3 PRO 68 HB1 PRO 68 7.714 0.449 3.887 486 HG2 PRO 68 HG2 PRO 68 7.331 -0.109 6.770 487 HG3 PRO 68 HG1 PRO 68 8.742 0.545 5.927 488 HD2 PRO 68 HD2 PRO 68 6.831 2.008 7.383 489 HD3 PRO 68 HD1 PRO 68 8.067 2.669 6.310 490 H THR 69 HN THR 69 3.762 0.453 3.311 491 HA THR 69 HA THR 69 2.500 -0.746 5.678 492 HB THR 69 HB THR 69 0.324 0.175 4.975 493 HG1 THR 69 HG1 THR 69 1.892 1.589 3.048 494 HG21 THR 69 HG21 THR 69 0.729 2.552 5.546 495 HG22 THR 69 HG22 THR 69 2.461 2.270 5.385 496 HG23 THR 69 HG23 THR 69 1.545 1.439 6.642 497 H CYS 70 HN CYS 70 1.035 -2.447 5.234 498 HA CYS 70 HA CYS 70 1.284 -3.631 2.557 499 HB2 CYS 70 HB2 CYS 70 1.818 -5.183 4.305 500 HB3 CYS 70 HB1 CYS 70 0.369 -4.760 5.209 501 H CYS 71 HN CYS 71 -0.274 -3.076 1.175 502 HA CYS 71 HA CYS 71 -2.902 -2.318 2.246 503 HB2 CYS 71 HB2 CYS 71 -1.762 -1.831 -0.512 504 HB3 CYS 71 HB1 CYS 71 -3.255 -1.170 0.135 505 H GLU 72 HN GLU 72 -4.721 -3.353 1.704 506 HA GLU 72 HA GLU 72 -4.517 -5.918 0.447 507 HB2 GLU 72 HB2 GLU 72 -6.069 -6.090 2.095 508 HB3 GLU 72 HB1 GLU 72 -6.540 -4.398 1.988 509 HG2 GLU 72 HG2 GLU 72 -7.961 -4.818 0.174 510 HG3 GLU 72 HG1 GLU 72 -7.316 -6.438 -0.062 511 H ASP 73 HN ASP 73 -5.453 -2.709 -0.433 512 HA ASP 73 HA ASP 73 -5.526 -3.455 -3.234 513 HB2 ASP 73 HB2 ASP 73 -7.924 -3.618 -2.183 514 HB3 ASP 73 HB1 ASP 73 -7.858 -1.864 -2.176 515 H VAL 74 HN VAL 74 -5.164 -1.582 -4.589 516 HA VAL 74 HA VAL 74 -4.863 0.984 -3.199 517 HB VAL 74 HB VAL 74 -2.710 0.315 -5.162 518 HG11 VAL 74 HG11 VAL 74 -2.746 1.953 -2.639 519 HG12 VAL 74 HG12 VAL 74 -2.979 2.572 -4.272 520 HG13 VAL 74 HG13 VAL 74 -1.430 1.860 -3.810 521 HG21 VAL 74 HG21 VAL 74 -2.554 -0.504 -2.259 522 HG22 VAL 74 HG22 VAL 74 -1.258 -0.611 -3.453 523 HG23 VAL 74 HG23 VAL 74 -2.699 -1.615 -3.621 524 H GLU 75 HN GLU 75 -5.579 2.658 -4.386 525 HA GLU 75 HA GLU 75 -6.484 2.074 -7.121 526 HB2 GLU 75 HB2 GLU 75 -8.144 2.831 -5.368 527 HB3 GLU 75 HB1 GLU 75 -7.319 4.382 -5.354 528 HG2 GLU 75 HG2 GLU 75 -7.890 4.766 -7.655 529 HG3 GLU 75 HG1 GLU 75 -8.591 3.155 -7.788 530 H ASP 76 HN ASP 76 -6.372 3.908 -8.693 531 HA ASP 76 HA ASP 76 -5.064 5.189 -10.024 532 HB2 ASP 76 HB2 ASP 76 -4.362 6.382 -7.340 533 HB3 ASP 76 HB1 ASP 76 -3.638 6.971 -8.828 534 H ASP 77 HN ASP 77 -2.381 6.180 -9.456 535 HA ASP 77 HA ASP 77 -0.900 3.773 -9.978 536 HB2 ASP 77 HB2 ASP 77 0.001 6.638 -9.651 537 HB3 ASP 77 HB1 ASP 77 1.075 5.312 -10.076 538 H GLY 78 HN GLY 78 -2.191 4.219 -7.316 539 HA2 GLY 78 HA2 GLY 78 -1.477 3.044 -5.380 540 HA3 GLY 78 HA1 GLY 78 0.174 3.508 -5.731 541 H LEU 79 HN LEU 79 -2.291 5.918 -6.001 542 HA LEU 79 HA LEU 79 -1.106 7.481 -3.917 543 HB2 LEU 79 HB2 LEU 79 -3.541 7.876 -5.642 544 HB3 LEU 79 HB1 LEU 79 -3.026 9.032 -4.428 545 HG LEU 79 HG LEU 79 -2.389 9.659 -6.716 546 HD11 LEU 79 HD11 LEU 79 -0.067 10.235 -6.230 547 HD12 LEU 79 HD12 LEU 79 -0.053 9.060 -4.916 548 HD13 LEU 79 HD13 LEU 79 -1.099 10.477 -4.821 549 HD21 LEU 79 HD21 LEU 79 -2.005 7.472 -7.685 550 HD22 LEU 79 HD22 LEU 79 -0.598 7.246 -6.646 551 HD23 LEU 79 HD23 LEU 79 -0.590 8.505 -7.881 552 H VAL 80 HN VAL 80 -3.806 5.331 -4.176 553 HA VAL 80 HA VAL 80 -4.691 6.141 -1.487 554 HB VAL 80 HB VAL 80 -6.493 5.149 -3.696 555 HG11 VAL 80 HG11 VAL 80 -7.299 4.616 -1.468 556 HG12 VAL 80 HG12 VAL 80 -8.304 5.862 -2.207 557 HG13 VAL 80 HG13 VAL 80 -7.114 6.300 -0.980 558 HG21 VAL 80 HG21 VAL 80 -7.363 7.522 -3.648 559 HG22 VAL 80 HG22 VAL 80 -5.777 7.290 -4.382 560 HG23 VAL 80 HG23 VAL 80 -5.903 7.939 -2.746 561 H GLY 81 HN GLY 81 -4.054 4.540 -0.174 562 HA2 GLY 81 HA2 GLY 81 -4.207 1.789 -1.189 563 HA3 GLY 81 HA1 GLY 81 -3.254 2.315 0.189 564 H ILE 82 HN ILE 82 -5.422 0.258 -0.293 565 HA ILE 82 HA ILE 82 -7.361 1.117 1.737 566 HB ILE 82 HB ILE 82 -7.467 -0.866 -0.501 567 HG12 ILE 82 HG12 ILE 82 -9.730 0.173 -0.799 568 HG13 ILE 82 HG11 ILE 82 -9.344 1.263 0.528 569 HG21 ILE 82 HG21 ILE 82 -8.103 -2.267 1.294 570 HG22 ILE 82 HG22 ILE 82 -9.590 -1.774 0.480 571 HG23 ILE 82 HG23 ILE 82 -9.121 -1.015 2.000 572 HD11 ILE 82 HD11 ILE 82 -7.458 2.136 -0.749 573 HD12 ILE 82 HD12 ILE 82 -8.989 2.340 -1.601 574 HD13 ILE 82 HD13 ILE 82 -7.875 1.060 -2.085 575 H ASN 83 HN ASN 83 -7.101 0.384 3.716 576 HA ASN 83 HA ASN 83 -6.656 -0.975 5.474 577 HB2 ASN 83 HB2 ASN 83 -6.972 -3.001 3.275 578 HB3 ASN 83 HB1 ASN 83 -6.512 -3.513 4.895 579 HD21 ASN 83 HD21 ASN 83 -8.950 -4.052 3.376 580 HD22 ASN 83 HD22 ASN 83 -10.243 -3.465 4.352 581 H CYS 84 HN CYS 84 -4.565 0.392 4.423 582 HA CYS 84 HA CYS 84 -2.304 -1.351 4.029 583 HB2 CYS 84 HB2 CYS 84 -2.402 1.651 4.361 584 HB3 CYS 84 HB1 CYS 84 -1.034 0.716 3.771 585 H THR 85 HN THR 85 -1.929 -2.474 5.899 586 HA THR 85 HA THR 85 -1.756 -1.167 8.453 587 HB THR 85 HB THR 85 -0.795 -3.932 7.701 588 HG1 THR 85 HG1 THR 85 -3.259 -3.443 8.973 589 HG21 THR 85 HG21 THR 85 -1.558 -2.696 10.352 590 HG22 THR 85 HG22 THR 85 0.064 -3.170 9.844 591 HG23 THR 85 HG23 THR 85 -1.175 -4.399 10.102 592 HA PRO 86 HA PRO 86 2.456 0.226 7.844 593 HB2 PRO 86 HB2 PRO 86 2.360 0.721 10.749 594 HB3 PRO 86 HB1 PRO 86 2.625 1.863 9.428 595 HG2 PRO 86 HG2 PRO 86 0.338 1.856 10.807 596 HG3 PRO 86 HG1 PRO 86 0.357 2.158 9.061 597 HD2 PRO 86 HD2 PRO 86 -0.311 -0.365 10.535 598 HD3 PRO 86 HD1 PRO 86 -1.147 0.403 9.174 599 H ILE 87 HN ILE 87 4.234 -0.986 7.818 600 HA ILE 87 HA ILE 87 4.481 -3.143 9.779 601 HB ILE 87 HB ILE 87 6.184 -3.998 8.042 602 HG12 ILE 87 HG12 ILE 87 4.523 -2.218 6.258 603 HG13 ILE 87 HG11 ILE 87 6.171 -1.854 6.745 604 HG21 ILE 87 HG21 ILE 87 3.230 -3.992 7.459 605 HG22 ILE 87 HG22 ILE 87 4.080 -5.095 8.541 606 HG23 ILE 87 HG23 ILE 87 4.398 -5.140 6.807 607 HD11 ILE 87 HD11 ILE 87 6.915 -3.927 5.640 608 HD12 ILE 87 HD12 ILE 87 6.157 -2.781 4.533 609 HD13 ILE 87 HD13 ILE 87 5.259 -4.193 5.093 610 HA PRO 88 HA PRO 88 8.039 -1.126 11.497 611 HB2 PRO 88 HB2 PRO 88 8.966 -3.786 12.289 612 HB3 PRO 88 HB1 PRO 88 8.467 -2.438 13.303 613 HG2 PRO 88 HG2 PRO 88 6.979 -4.639 13.095 614 HG3 PRO 88 HG1 PRO 88 6.237 -3.030 13.209 615 HD2 PRO 88 HD2 PRO 88 6.749 -4.698 10.769 616 HD3 PRO 88 HD1 PRO 88 5.270 -3.850 11.246 617 H LEU 89 HN LEU 89 10.267 -0.921 11.241 618 HA LEU 89 HA LEU 89 11.354 -2.103 8.815 619 HB2 LEU 89 HB2 LEU 89 12.616 -0.095 10.681 620 HB3 LEU 89 HB1 LEU 89 13.134 -0.483 9.052 621 HG LEU 89 HG LEU 89 10.543 0.886 9.775 622 HD11 LEU 89 HD11 LEU 89 12.434 2.336 10.169 623 HD12 LEU 89 HD12 LEU 89 11.583 2.851 8.713 624 HD13 LEU 89 HD13 LEU 89 13.094 1.953 8.578 625 HD21 LEU 89 HD21 LEU 89 10.313 -0.450 7.763 626 HD22 LEU 89 HD22 LEU 89 11.776 0.271 7.093 627 HD23 LEU 89 HD23 LEU 89 10.344 1.265 7.357 628 H ILE 90 HN ILE 90 10.943 -3.451 11.497 629 HA ILE 90 HA ILE 90 13.691 -4.376 11.920 630 HB ILE 90 HB ILE 90 13.002 -4.652 14.371 631 HG12 ILE 90 HG12 ILE 90 10.937 -2.605 13.527 632 HG13 ILE 90 HG11 ILE 90 10.581 -4.256 14.017 633 HG21 ILE 90 HG21 ILE 90 13.614 -2.320 14.889 634 HG22 ILE 90 HG22 ILE 90 13.363 -1.899 13.192 635 HG23 ILE 90 HG23 ILE 90 14.641 -3.029 13.643 636 HD11 ILE 90 HD11 ILE 90 11.467 -3.769 16.246 637 HD12 ILE 90 HD12 ILE 90 10.128 -2.707 15.811 638 HD13 ILE 90 HD13 ILE 90 11.786 -2.109 15.746 Start of MODEL 5 1 H1 GLY 1 HT1 GLY 1 5.651 -11.844 -3.190 2 H2 GLY 1 HT2 GLY 1 6.364 -11.210 -4.585 3 H3 GLY 1 HT3 GLY 1 4.924 -12.084 -4.697 4 HA2 GLY 1 HA1 GLY 1 3.749 -10.389 -3.453 5 HA3 GLY 1 HA2 GLY 1 5.249 -9.477 -3.322 6 H SER 2 HN SER 2 3.620 -7.891 -4.358 7 HA SER 2 HA SER 2 3.424 -8.283 -7.248 8 HB2 SER 2 HB2 SER 2 2.289 -6.081 -5.507 9 HB3 SER 2 HB1 SER 2 1.934 -6.343 -7.214 10 HG SER 2 HG SER 2 1.480 -8.624 -5.928 11 H GLY 3 HN GLY 3 5.812 -8.086 -7.385 12 HA2 GLY 3 HA2 GLY 3 7.442 -6.770 -8.417 13 HA3 GLY 3 HA1 GLY 3 6.495 -5.338 -8.044 14 H TRP 4 HN TRP 4 6.208 -5.751 -5.282 15 HA TRP 4 HA TRP 4 8.849 -4.984 -4.374 16 HB2 TRP 4 HB2 TRP 4 6.179 -5.079 -2.960 17 HB3 TRP 4 HB1 TRP 4 7.668 -4.501 -2.224 18 HD1 TRP 4 HD1 TRP 4 4.730 -3.295 -4.068 19 HE1 TRP 4 HE1 TRP 4 5.079 -0.869 -4.852 20 HE3 TRP 4 HE3 TRP 4 9.769 -2.920 -3.311 21 HZ2 TRP 4 HZ2 TRP 4 7.216 0.952 -5.135 22 HZ3 TRP 4 HZ3 TRP 4 10.891 -0.805 -3.871 23 HH2 TRP 4 HH2 TRP 4 9.642 1.090 -4.765 24 H GLU 5 HN GLU 5 10.137 -6.147 -3.026 25 HA GLU 5 HA GLU 5 9.743 -8.918 -2.727 26 HB2 GLU 5 HB2 GLU 5 11.604 -7.015 -1.297 27 HB3 GLU 5 HB1 GLU 5 11.631 -8.758 -1.056 28 HG2 GLU 5 HG2 GLU 5 11.928 -8.855 -3.626 29 HG3 GLU 5 HG1 GLU 5 12.409 -7.167 -3.459 30 H SER 6 HN SER 6 8.134 -9.744 -1.594 31 HA SER 6 HA SER 6 7.306 -8.494 0.915 32 HB2 SER 6 HB2 SER 6 6.045 -10.816 -0.566 33 HB3 SER 6 HB1 SER 6 5.329 -9.890 0.753 34 HG SER 6 HG SER 6 6.128 -8.280 -1.278 35 H LYS 7 HN LYS 7 9.823 -9.918 0.580 36 HA LYS 7 HA LYS 7 9.569 -12.513 1.766 37 HB2 LYS 7 HB2 LYS 7 12.053 -12.477 1.734 38 HB3 LYS 7 HB1 LYS 7 11.329 -12.132 0.173 39 HG2 LYS 7 HG2 LYS 7 12.946 -10.530 0.217 40 HG3 LYS 7 HG1 LYS 7 11.616 -9.641 0.954 41 HD2 LYS 7 HD2 LYS 7 13.545 -9.224 2.277 42 HD3 LYS 7 HD1 LYS 7 12.518 -10.335 3.187 43 HE2 LYS 7 HE2 LYS 7 13.887 -12.213 2.465 44 HE3 LYS 7 HE1 LYS 7 14.895 -11.127 1.514 45 HZ1 LYS 7 HZ1 LYS 7 14.575 -11.012 4.462 46 HZ2 LYS 7 HZ2 LYS 7 15.594 -10.037 3.533 47 HZ3 LYS 7 HZ3 LYS 7 15.892 -11.697 3.655 48 H THR 8 HN THR 8 9.367 -9.475 3.054 49 HA THR 8 HA THR 8 10.969 -9.692 5.368 50 HB THR 8 HB THR 8 8.442 -8.061 5.217 51 HG1 THR 8 HG1 THR 8 10.138 -6.468 4.325 52 HG21 THR 8 HG21 THR 8 11.138 -7.558 6.492 53 HG22 THR 8 HG22 THR 8 9.674 -8.055 7.342 54 HG23 THR 8 HG23 THR 8 9.746 -6.477 6.559 55 H GLY 9 HN GLY 9 7.736 -10.777 4.589 56 HA2 GLY 9 HA2 GLY 9 6.576 -12.483 5.681 57 HA3 GLY 9 HA1 GLY 9 7.683 -12.337 7.037 58 H SER 10 HN SER 10 6.343 -9.417 5.871 59 HA SER 10 HA SER 10 4.786 -9.215 8.342 60 HB2 SER 10 HB2 SER 10 5.721 -6.997 6.511 61 HB3 SER 10 HB1 SER 10 5.022 -6.816 8.120 62 HG SER 10 HG SER 10 7.133 -6.739 8.538 63 H CYS 11 HN CYS 11 4.341 -9.563 4.984 64 HA CYS 11 HA CYS 11 1.624 -8.447 5.180 65 HB2 CYS 11 HB2 CYS 11 3.325 -8.134 2.709 66 HB3 CYS 11 HB1 CYS 11 1.871 -7.248 3.163 67 H ASN 12 HN ASN 12 0.033 -9.548 4.119 68 HA ASN 12 HA ASN 12 0.774 -12.143 3.008 69 HB2 ASN 12 HB2 ASN 12 -1.619 -12.703 3.167 70 HB3 ASN 12 HB1 ASN 12 -0.956 -12.193 4.713 71 HD21 ASN 12 HD21 ASN 12 -1.668 -10.290 5.631 72 HD22 ASN 12 HD22 ASN 12 -3.046 -9.426 5.039 73 H THR 13 HN THR 13 -0.451 -9.075 1.955 74 HA THR 13 HA THR 13 -1.689 -10.191 -0.413 75 HB THR 13 HB THR 13 -2.234 -7.800 -0.925 76 HG1 THR 13 HG1 THR 13 -1.778 -6.266 0.700 77 HG21 THR 13 HG21 THR 13 -3.811 -7.557 1.006 78 HG22 THR 13 HG22 THR 13 -3.010 -8.938 1.762 79 HG23 THR 13 HG23 THR 13 -3.856 -9.138 0.227 80 H GLY 14 HN GLY 14 1.238 -8.472 0.417 81 HA2 GLY 14 HA2 GLY 14 3.196 -8.411 -0.845 82 HA3 GLY 14 HA1 GLY 14 2.303 -9.051 -2.216 83 H LYS 15 HN LYS 15 0.572 -6.511 -0.940 84 HA LYS 15 HA LYS 15 1.573 -4.684 -2.995 85 HB2 LYS 15 HB2 LYS 15 -0.903 -4.655 -1.266 86 HB3 LYS 15 HB1 LYS 15 -0.440 -3.296 -2.275 87 HG2 LYS 15 HG2 LYS 15 -0.584 -4.760 -4.258 88 HG3 LYS 15 HG1 LYS 15 -1.140 -6.070 -3.213 89 HD2 LYS 15 HD2 LYS 15 -3.107 -4.841 -2.607 90 HD3 LYS 15 HD1 LYS 15 -2.511 -3.396 -3.411 91 HE2 LYS 15 HE2 LYS 15 -4.230 -4.519 -4.732 92 HE3 LYS 15 HE1 LYS 15 -2.678 -4.501 -5.565 93 HZ1 LYS 15 HZ1 LYS 15 -3.834 -6.650 -5.707 94 HZ2 LYS 15 HZ2 LYS 15 -3.729 -6.807 -4.023 95 HZ3 LYS 15 HZ3 LYS 15 -2.322 -6.777 -4.954 96 H LEU 16 HN LEU 16 3.511 -4.035 -1.990 97 HA LEU 16 HA LEU 16 3.315 -2.714 0.589 98 HB2 LEU 16 HB2 LEU 16 5.634 -3.501 -1.161 99 HB3 LEU 16 HB1 LEU 16 5.834 -2.475 0.237 100 HG LEU 16 HG LEU 16 4.938 -4.292 1.668 101 HD11 LEU 16 HD11 LEU 16 4.975 -5.847 -0.891 102 HD12 LEU 16 HD12 LEU 16 3.572 -5.447 0.114 103 HD13 LEU 16 HD13 LEU 16 4.811 -6.553 0.720 104 HD21 LEU 16 HD21 LEU 16 7.342 -4.014 1.395 105 HD22 LEU 16 HD22 LEU 16 7.308 -5.045 -0.035 106 HD23 LEU 16 HD23 LEU 16 6.919 -5.718 1.549 107 H ALA 17 HN ALA 17 3.035 -0.607 0.751 108 HA ALA 17 HA ALA 17 4.126 1.145 -1.331 109 HB1 ALA 17 HB1 ALA 17 1.796 0.920 -1.938 110 HB2 ALA 17 HB2 ALA 17 2.063 2.531 -1.262 111 HB3 ALA 17 HB3 ALA 17 1.295 1.276 -0.285 112 H CYS 18 HN CYS 18 4.960 3.030 -0.538 113 HA CYS 18 HA CYS 18 5.028 3.372 2.327 114 HB2 CYS 18 HB2 CYS 18 6.089 5.133 0.104 115 HB3 CYS 18 HB1 CYS 18 6.410 5.356 1.822 116 H CYS 19 HN CYS 19 3.524 4.415 3.464 117 HA CYS 19 HA CYS 19 1.787 6.293 2.019 118 HB2 CYS 19 HB2 CYS 19 0.978 3.784 2.839 119 HB3 CYS 19 HB1 CYS 19 0.443 4.813 4.156 120 H ASP 20 HN ASP 20 0.592 7.770 3.404 121 HA ASP 20 HA ASP 20 1.967 8.280 5.949 122 HB2 ASP 20 HB2 ASP 20 0.396 10.099 4.132 123 HB3 ASP 20 HB1 ASP 20 0.737 10.524 5.797 124 H THR 21 HN THR 21 0.956 7.298 7.506 125 HA THR 21 HA THR 21 -1.765 6.465 7.243 126 HB THR 21 HB THR 21 -1.405 5.471 9.504 127 HG1 THR 21 HG1 THR 21 0.361 5.952 10.615 128 HG21 THR 21 HG21 THR 21 -0.874 4.189 7.496 129 HG22 THR 21 HG22 THR 21 0.307 3.845 8.759 130 HG23 THR 21 HG23 THR 21 0.728 4.922 7.425 131 H ASN 22 HN ASN 22 -0.514 9.355 7.986 132 HA ASN 22 HA ASN 22 -2.653 10.066 9.862 133 HB2 ASN 22 HB2 ASN 22 -0.206 11.629 8.997 134 HB3 ASN 22 HB1 ASN 22 -1.418 12.197 10.133 135 HD21 ASN 22 HD21 ASN 22 -1.724 9.557 11.368 136 HD22 ASN 22 HD22 ASN 22 -0.314 9.320 12.340 137 H LYS 23 HN LYS 23 -2.047 9.820 6.670 138 HA LYS 23 HA LYS 23 -3.665 12.170 5.950 139 HB2 LYS 23 HB2 LYS 23 -1.615 10.634 4.350 140 HB3 LYS 23 HB1 LYS 23 -2.655 11.866 3.674 141 HG2 LYS 23 HG2 LYS 23 -1.688 13.459 5.334 142 HG3 LYS 23 HG1 LYS 23 -0.505 12.218 5.735 143 HD2 LYS 23 HD2 LYS 23 0.533 13.619 4.145 144 HD3 LYS 23 HD1 LYS 23 0.041 12.175 3.255 145 HE2 LYS 23 HE2 LYS 23 -0.559 14.058 1.924 146 HE3 LYS 23 HE1 LYS 23 -2.040 13.395 2.611 147 HZ1 LYS 23 HZ1 LYS 23 -0.576 15.739 3.682 148 HZ2 LYS 23 HZ2 LYS 23 -2.027 15.113 4.283 149 HZ3 LYS 23 HZ3 LYS 23 -1.981 15.811 2.744 150 H LYS 24 HN LYS 24 -5.678 11.512 5.840 151 HA LYS 24 HA LYS 24 -6.278 8.836 4.840 152 HB2 LYS 24 HB2 LYS 24 -7.910 10.873 6.332 153 HB3 LYS 24 HB1 LYS 24 -8.582 9.370 5.726 154 HG2 LYS 24 HG2 LYS 24 -8.138 8.971 7.986 155 HG3 LYS 24 HG1 LYS 24 -6.810 8.196 7.127 156 HD2 LYS 24 HD2 LYS 24 -5.931 9.375 9.034 157 HD3 LYS 24 HD1 LYS 24 -5.420 10.208 7.566 158 HE2 LYS 24 HE2 LYS 24 -7.291 11.805 7.881 159 HE3 LYS 24 HE1 LYS 24 -7.681 11.003 9.398 160 HZ1 LYS 24 HZ1 LYS 24 -5.510 11.608 10.244 161 HZ2 LYS 24 HZ2 LYS 24 -6.342 12.986 9.738 162 HZ3 LYS 24 HZ3 LYS 24 -5.106 12.347 8.776 163 H VAL 25 HN VAL 25 -8.085 8.556 3.397 164 HA VAL 25 HA VAL 25 -8.507 10.843 1.581 165 HB VAL 25 HB VAL 25 -8.583 7.931 0.777 166 HG11 VAL 25 HG11 VAL 25 -8.485 8.774 -1.495 167 HG12 VAL 25 HG12 VAL 25 -8.420 10.429 -0.892 168 HG13 VAL 25 HG13 VAL 25 -9.868 9.455 -0.639 169 HG21 VAL 25 HG21 VAL 25 -6.312 8.506 1.495 170 HG22 VAL 25 HG22 VAL 25 -6.304 9.880 0.385 171 HG23 VAL 25 HG23 VAL 25 -6.392 8.235 -0.244 172 H GLN 26 HN GLN 26 -10.631 10.972 0.637 173 HA GLN 26 HA GLN 26 -12.606 10.275 2.619 174 HB2 GLN 26 HB2 GLN 26 -14.019 11.844 1.486 175 HB3 GLN 26 HB1 GLN 26 -12.421 12.548 1.645 176 HG2 GLN 26 HG2 GLN 26 -11.968 11.831 -0.698 177 HG3 GLN 26 HG1 GLN 26 -13.660 11.358 -0.817 178 HE21 GLN 26 HE21 GLN 26 -11.438 14.012 -0.556 179 HE22 GLN 26 HE22 GLN 26 -12.564 15.252 -0.983 180 H LYS 27 HN LYS 27 -11.541 8.885 -0.270 181 HA LYS 27 HA LYS 27 -14.101 7.454 -0.556 182 HB2 LYS 27 HB2 LYS 27 -12.095 8.050 -2.741 183 HB3 LYS 27 HB1 LYS 27 -13.576 7.132 -2.938 184 HG2 LYS 27 HG2 LYS 27 -13.367 10.045 -2.240 185 HG3 LYS 27 HG1 LYS 27 -13.842 9.381 -3.794 186 HD2 LYS 27 HD2 LYS 27 -15.339 9.041 -1.192 187 HD3 LYS 27 HD1 LYS 27 -15.771 10.153 -2.490 188 HE2 LYS 27 HE2 LYS 27 -15.513 7.197 -2.883 189 HE3 LYS 27 HE1 LYS 27 -17.034 7.964 -2.432 190 HZ1 LYS 27 HZ1 LYS 27 -15.456 8.554 -4.881 191 HZ2 LYS 27 HZ2 LYS 27 -16.926 9.275 -4.456 192 HZ3 LYS 27 HZ3 LYS 27 -16.868 7.626 -4.825 193 H SER 28 HN SER 28 -14.047 5.319 -0.343 194 HA SER 28 HA SER 28 -11.432 4.060 0.061 195 HB2 SER 28 HB2 SER 28 -14.189 3.079 0.840 196 HB3 SER 28 HB1 SER 28 -12.655 2.328 1.272 197 HG SER 28 HG SER 28 -12.653 3.604 2.928 198 H THR 29 HN THR 29 -12.483 4.571 -2.597 199 HA THR 29 HA THR 29 -13.283 1.974 -3.602 200 HB THR 29 HB THR 29 -13.176 3.113 -5.846 201 HG1 THR 29 HG1 THR 29 -11.726 4.777 -5.412 202 HG21 THR 29 HG21 THR 29 -14.887 4.450 -3.749 203 HG22 THR 29 HG22 THR 29 -15.269 2.946 -4.585 204 HG23 THR 29 HG23 THR 29 -15.185 4.459 -5.487 205 H GLY 30 HN GLY 30 -12.048 0.755 -5.108 206 HA2 GLY 30 HA2 GLY 30 -9.240 1.457 -5.429 207 HA3 GLY 30 HA1 GLY 30 -9.575 0.019 -4.477 208 H GLU 31 HN GLU 31 -8.171 -0.799 -6.345 209 HA GLU 31 HA GLU 31 -9.639 -1.123 -8.838 210 HB2 GLU 31 HB2 GLU 31 -6.840 -1.976 -8.094 211 HB3 GLU 31 HB1 GLU 31 -7.555 -2.118 -9.692 212 HG2 GLU 31 HG2 GLU 31 -7.805 0.344 -9.749 213 HG3 GLU 31 HG1 GLU 31 -6.956 0.427 -8.206 214 H GLU 32 HN GLU 32 -8.114 -3.213 -6.362 215 HA GLU 32 HA GLU 32 -9.390 -5.487 -7.660 216 HB2 GLU 32 HB2 GLU 32 -7.192 -5.303 -5.627 217 HB3 GLU 32 HB1 GLU 32 -7.998 -6.825 -5.982 218 HG2 GLU 32 HG2 GLU 32 -7.412 -6.386 -8.417 219 HG3 GLU 32 HG1 GLU 32 -6.338 -5.127 -7.812 220 H SER 33 HN SER 33 -9.893 -3.446 -4.949 221 HA SER 33 HA SER 33 -11.352 -5.016 -3.224 222 HB2 SER 33 HB2 SER 33 -11.998 -2.237 -4.224 223 HB3 SER 33 HB1 SER 33 -12.857 -3.013 -2.894 224 HG SER 33 HG SER 33 -10.134 -2.244 -3.044 225 H GLY 34 HN GLY 34 -12.333 -3.923 -6.434 226 HA2 GLY 34 HA2 GLY 34 -15.029 -4.838 -6.231 227 HA3 GLY 34 HA1 GLY 34 -14.182 -4.425 -7.714 228 H LEU 35 HN LEU 35 -12.063 -6.237 -7.517 229 HA LEU 35 HA LEU 35 -13.199 -8.603 -8.550 230 HB2 LEU 35 HB2 LEU 35 -10.892 -7.517 -8.958 231 HB3 LEU 35 HB1 LEU 35 -10.397 -8.317 -7.482 232 HG LEU 35 HG LEU 35 -11.519 -9.819 -9.832 233 HD11 LEU 35 HD11 LEU 35 -8.641 -9.182 -9.204 234 HD12 LEU 35 HD12 LEU 35 -9.563 -8.615 -10.597 235 HD13 LEU 35 HD13 LEU 35 -9.187 -10.328 -10.428 236 HD21 LEU 35 HD21 LEU 35 -9.783 -10.697 -7.528 237 HD22 LEU 35 HD22 LEU 35 -10.401 -11.724 -8.820 238 HD23 LEU 35 HD23 LEU 35 -11.515 -10.988 -7.668 239 H LEU 36 HN LEU 36 -11.499 -7.886 -5.525 240 HA LEU 36 HA LEU 36 -11.985 -10.466 -4.378 241 HB2 LEU 36 HB2 LEU 36 -10.783 -7.885 -3.460 242 HB3 LEU 36 HB1 LEU 36 -11.191 -9.108 -2.285 243 HG LEU 36 HG LEU 36 -9.675 -10.692 -3.411 244 HD11 LEU 36 HD11 LEU 36 -8.104 -9.860 -5.100 245 HD12 LEU 36 HD12 LEU 36 -8.987 -8.336 -5.153 246 HD13 LEU 36 HD13 LEU 36 -9.772 -9.826 -5.670 247 HD21 LEU 36 HD21 LEU 36 -8.391 -8.064 -2.683 248 HD22 LEU 36 HD22 LEU 36 -7.595 -9.639 -2.712 249 HD23 LEU 36 HD23 LEU 36 -8.883 -9.322 -1.549 250 H HIS 37 HN HIS 37 -12.843 -10.327 -1.970 251 HA HIS 37 HA HIS 37 -15.540 -9.233 -2.134 252 HB2 HIS 37 HB2 HIS 37 -15.177 -11.588 -1.389 253 HB3 HIS 37 HB1 HIS 37 -14.299 -10.979 0.009 254 HD1 HIS 37 HD1 HIS 37 -15.655 -10.377 2.028 255 HD2 HIS 37 HD2 HIS 37 -17.992 -10.857 -1.377 256 HE1 HIS 37 HE1 HIS 37 -18.039 -10.287 2.824 257 HE2 HIS 37 HE2 HIS 37 -19.431 -10.707 0.768 258 H THR 38 HN THR 38 -12.658 -8.073 -1.320 259 HA THR 38 HA THR 38 -12.993 -7.002 1.263 260 HB THR 38 HB THR 38 -11.115 -5.490 0.629 261 HG1 THR 38 HG1 THR 38 -10.756 -5.158 -1.424 262 HG21 THR 38 HG21 THR 38 -10.763 -8.386 -0.157 263 HG22 THR 38 HG22 THR 38 -10.667 -7.741 1.481 264 HG23 THR 38 HG23 THR 38 -9.467 -7.273 0.278 265 H GLY 39 HN GLY 39 -13.896 -5.894 -1.921 266 HA2 GLY 39 HA2 GLY 39 -14.422 -3.189 -1.186 267 HA3 GLY 39 HA1 GLY 39 -14.932 -3.982 -2.667 268 H ASP 40 HN ASP 40 -16.052 -5.954 -0.347 269 HA ASP 40 HA ASP 40 -18.759 -5.188 -0.586 270 HB2 ASP 40 HB2 ASP 40 -17.944 -7.486 -0.009 271 HB3 ASP 40 HB1 ASP 40 -17.510 -6.888 1.582 272 H VAL 41 HN VAL 41 -16.348 -4.740 1.916 273 HA VAL 41 HA VAL 41 -18.191 -3.242 3.585 274 HB VAL 41 HB VAL 41 -16.169 -2.998 5.100 275 HG11 VAL 41 HG11 VAL 41 -16.306 -5.333 5.882 276 HG12 VAL 41 HG12 VAL 41 -17.114 -5.777 4.379 277 HG13 VAL 41 HG13 VAL 41 -17.895 -4.665 5.504 278 HG21 VAL 41 HG21 VAL 41 -14.307 -4.540 4.722 279 HG22 VAL 41 HG22 VAL 41 -14.433 -3.345 3.429 280 HG23 VAL 41 HG23 VAL 41 -14.998 -4.995 3.163 281 H LEU 42 HN LEU 42 -18.124 -1.108 3.993 282 HA LEU 42 HA LEU 42 -16.388 0.576 2.376 283 HB2 LEU 42 HB2 LEU 42 -18.813 1.055 2.526 284 HB3 LEU 42 HB1 LEU 42 -18.657 1.245 4.262 285 HG LEU 42 HG LEU 42 -17.098 3.136 3.840 286 HD11 LEU 42 HD11 LEU 42 -17.186 4.187 1.605 287 HD12 LEU 42 HD12 LEU 42 -18.037 2.765 1.004 288 HD13 LEU 42 HD13 LEU 42 -16.384 2.617 1.601 289 HD21 LEU 42 HD21 LEU 42 -19.881 3.403 2.723 290 HD22 LEU 42 HD22 LEU 42 -18.865 4.731 3.285 291 HD23 LEU 42 HD23 LEU 42 -19.429 3.509 4.424 292 H ASP 43 HN ASP 43 -16.353 -1.020 5.211 293 HA ASP 43 HA ASP 43 -15.304 0.764 7.103 294 HB2 ASP 43 HB2 ASP 43 -16.198 -1.482 7.626 295 HB3 ASP 43 HB1 ASP 43 -14.813 -2.209 6.823 296 H GLN 44 HN GLN 44 -13.857 -0.763 4.360 297 HA GLN 44 HA GLN 44 -11.202 -0.907 4.946 298 HB2 GLN 44 HB2 GLN 44 -12.113 0.310 2.367 299 HB3 GLN 44 HB1 GLN 44 -10.729 -0.722 2.657 300 HG2 GLN 44 HG2 GLN 44 -12.401 -2.538 3.245 301 HG3 GLN 44 HG1 GLN 44 -13.616 -1.488 2.516 302 HE21 GLN 44 HE21 GLN 44 -13.474 -1.029 0.284 303 HE22 GLN 44 HE22 GLN 44 -12.566 -2.044 -0.784 304 H VAL 45 HN VAL 45 -9.533 0.453 5.196 305 HA VAL 45 HA VAL 45 -10.208 3.291 5.500 306 HB VAL 45 HB VAL 45 -7.899 1.726 6.674 307 HG11 VAL 45 HG11 VAL 45 -7.465 3.730 8.010 308 HG12 VAL 45 HG12 VAL 45 -8.753 4.580 7.159 309 HG13 VAL 45 HG13 VAL 45 -7.309 4.067 6.285 310 HG21 VAL 45 HG21 VAL 45 -9.069 2.018 8.807 311 HG22 VAL 45 HG22 VAL 45 -10.046 1.112 7.654 312 HG23 VAL 45 HG23 VAL 45 -10.400 2.810 7.966 313 H ALA 46 HN ALA 46 -9.605 4.560 3.947 314 HA ALA 46 HA ALA 46 -7.385 3.782 2.196 315 HB1 ALA 46 HB1 ALA 46 -9.587 5.806 1.823 316 HB2 ALA 46 HB2 ALA 46 -9.470 4.219 1.061 317 HB3 ALA 46 HB3 ALA 46 -8.304 5.482 0.656 318 H ILE 47 HN ILE 47 -5.484 4.647 2.619 319 HA ILE 47 HA ILE 47 -5.426 7.446 3.516 320 HB ILE 47 HB ILE 47 -3.092 6.968 4.342 321 HG12 ILE 47 HG12 ILE 47 -4.000 4.095 4.073 322 HG13 ILE 47 HG11 ILE 47 -2.681 4.853 3.196 323 HG21 ILE 47 HG21 ILE 47 -4.924 7.289 5.860 324 HG22 ILE 47 HG22 ILE 47 -3.871 6.010 6.464 325 HG23 ILE 47 HG23 ILE 47 -5.405 5.600 5.695 326 HD11 ILE 47 HD11 ILE 47 -1.829 3.500 5.003 327 HD12 ILE 47 HD12 ILE 47 -2.811 4.390 6.164 328 HD13 ILE 47 HD13 ILE 47 -1.498 5.203 5.312 329 H GLN 48 HN GLN 48 -3.727 8.755 2.679 330 HA GLN 48 HA GLN 48 -3.420 8.268 -0.174 331 HB2 GLN 48 HB2 GLN 48 -4.019 10.500 1.179 332 HB3 GLN 48 HB1 GLN 48 -2.268 10.668 1.170 333 HG2 GLN 48 HG2 GLN 48 -2.438 11.555 -0.842 334 HG3 GLN 48 HG1 GLN 48 -2.947 9.979 -1.435 335 HE21 GLN 48 HE21 GLN 48 -4.268 10.856 -3.001 336 HE22 GLN 48 HE22 GLN 48 -5.759 11.644 -2.623 337 H CYS 49 HN CYS 49 -1.885 7.111 -0.822 338 HA CYS 49 HA CYS 49 0.554 6.814 0.709 339 HB2 CYS 49 HB2 CYS 49 -0.658 5.361 -1.631 340 HB3 CYS 49 HB1 CYS 49 0.975 5.052 -1.086 341 H THR 50 HN THR 50 2.627 6.693 -0.542 342 HA THR 50 HA THR 50 2.779 8.163 -2.976 343 HB THR 50 HB THR 50 2.523 10.082 -1.538 344 HG1 THR 50 HG1 THR 50 4.139 10.096 -3.273 345 HG21 THR 50 HG21 THR 50 4.123 10.581 0.254 346 HG22 THR 50 HG22 THR 50 4.890 9.015 -0.004 347 HG23 THR 50 HG23 THR 50 3.227 9.098 0.574 348 H GLN 51 HN GLN 51 4.250 7.225 -4.088 349 HA GLN 51 HA GLN 51 6.461 5.912 -2.670 350 HB2 GLN 51 HB2 GLN 51 4.682 4.405 -3.593 351 HB3 GLN 51 HB1 GLN 51 5.106 4.979 -5.200 352 HG2 GLN 51 HG2 GLN 51 6.170 2.852 -4.760 353 HG3 GLN 51 HG1 GLN 51 7.372 4.131 -4.920 354 HE21 GLN 51 HE21 GLN 51 8.916 2.954 -3.766 355 HE22 GLN 51 HE22 GLN 51 8.813 2.739 -2.054 356 H ILE 52 HN ILE 52 8.426 6.455 -3.300 357 HA ILE 52 HA ILE 52 8.943 8.212 -5.466 358 HB ILE 52 HB ILE 52 10.735 6.520 -3.728 359 HG12 ILE 52 HG12 ILE 52 10.192 9.488 -3.863 360 HG13 ILE 52 HG11 ILE 52 9.660 8.382 -2.603 361 HG21 ILE 52 HG21 ILE 52 12.652 7.700 -4.659 362 HG22 ILE 52 HG22 ILE 52 11.598 8.529 -5.803 363 HG23 ILE 52 HG23 ILE 52 11.812 6.782 -5.909 364 HD11 ILE 52 HD11 ILE 52 12.022 7.981 -2.018 365 HD12 ILE 52 HD12 ILE 52 11.526 9.660 -1.817 366 HD13 ILE 52 HD13 ILE 52 12.490 9.187 -3.215 367 HA PRO 53 HA PRO 53 8.627 5.566 -8.978 368 HB2 PRO 53 HB2 PRO 53 11.011 6.549 -10.186 369 HB3 PRO 53 HB1 PRO 53 9.352 7.045 -10.517 370 HG2 PRO 53 HG2 PRO 53 11.389 8.310 -8.776 371 HG3 PRO 53 HG1 PRO 53 10.045 9.051 -9.663 372 HD2 PRO 53 HD2 PRO 53 9.969 8.762 -7.004 373 HD3 PRO 53 HD1 PRO 53 8.507 8.551 -7.995 374 H LEU 54 HN LEU 54 9.039 3.502 -8.608 375 HA LEU 54 HA LEU 54 11.266 2.628 -7.139 376 HB2 LEU 54 HB2 LEU 54 10.348 0.363 -7.527 377 HB3 LEU 54 HB1 LEU 54 9.187 1.505 -6.885 378 HG LEU 54 HG LEU 54 8.545 1.773 -9.441 379 HD11 LEU 54 HD11 LEU 54 8.686 -0.354 -10.631 380 HD12 LEU 54 HD12 LEU 54 9.659 -1.025 -9.321 381 HD13 LEU 54 HD13 LEU 54 10.287 0.304 -10.295 382 HD21 LEU 54 HD21 LEU 54 7.031 1.077 -7.675 383 HD22 LEU 54 HD22 LEU 54 7.705 -0.552 -7.716 384 HD23 LEU 54 HD23 LEU 54 6.817 0.070 -9.107 385 H LEU 55 HN LEU 55 13.111 1.697 -7.654 386 HA LEU 55 HA LEU 55 13.831 1.260 -10.443 387 HB2 LEU 55 HB2 LEU 55 15.382 0.722 -7.901 388 HB3 LEU 55 HB1 LEU 55 16.026 0.673 -9.529 389 HG LEU 55 HG LEU 55 14.989 3.144 -8.141 390 HD11 LEU 55 HD11 LEU 55 17.328 3.833 -8.087 391 HD12 LEU 55 HD12 LEU 55 17.802 2.280 -8.774 392 HD13 LEU 55 HD13 LEU 55 17.073 2.347 -7.172 393 HD21 LEU 55 HD21 LEU 55 14.659 3.247 -10.549 394 HD22 LEU 55 HD22 LEU 55 16.344 2.797 -10.811 395 HD23 LEU 55 HD23 LEU 55 15.951 4.340 -10.052 396 H ILE 56 HN ILE 56 14.549 -0.866 -11.184 397 HA ILE 56 HA ILE 56 12.667 -2.856 -10.382 398 HB ILE 56 HB ILE 56 15.062 -3.389 -12.102 399 HG12 ILE 56 HG12 ILE 56 12.408 -2.228 -12.982 400 HG13 ILE 56 HG11 ILE 56 13.931 -1.346 -12.933 401 HG21 ILE 56 HG21 ILE 56 13.778 -5.328 -11.430 402 HG22 ILE 56 HG22 ILE 56 13.564 -5.027 -13.154 403 HG23 ILE 56 HG23 ILE 56 12.296 -4.573 -12.016 404 HD11 ILE 56 HD11 ILE 56 14.852 -2.845 -14.623 405 HD12 ILE 56 HD12 ILE 56 13.390 -2.042 -15.191 406 HD13 ILE 56 HD13 ILE 56 13.326 -3.727 -14.671 407 H GLY 57 HN GLY 57 12.852 -4.304 -8.870 408 HA2 GLY 57 HA2 GLY 57 13.792 -5.934 -7.515 409 HA3 GLY 57 HA1 GLY 57 15.359 -5.568 -8.222 410 H ILE 58 HN ILE 58 13.628 -2.867 -7.004 411 HA ILE 58 HA ILE 58 15.537 -2.723 -4.797 412 HB ILE 58 HB ILE 58 14.331 -0.764 -6.541 413 HG12 ILE 58 HG12 ILE 58 16.743 -1.130 -6.209 414 HG13 ILE 58 HG11 ILE 58 16.280 0.536 -5.888 415 HG21 ILE 58 HG21 ILE 58 12.859 -0.213 -4.726 416 HG22 ILE 58 HG22 ILE 58 14.085 1.048 -4.874 417 HG23 ILE 58 HG23 ILE 58 14.212 -0.166 -3.594 418 HD11 ILE 58 HD11 ILE 58 16.803 -1.585 -3.816 419 HD12 ILE 58 HD12 ILE 58 16.321 0.077 -3.485 420 HD13 ILE 58 HD13 ILE 58 17.877 -0.253 -4.246 421 H ALA 59 HN ALA 59 14.975 -2.223 -2.753 422 HA ALA 59 HA ALA 59 12.571 -3.457 -1.789 423 HB1 ALA 59 HB1 ALA 59 14.595 -3.813 -0.588 424 HB2 ALA 59 HB2 ALA 59 13.550 -2.817 0.434 425 HB3 ALA 59 HB3 ALA 59 14.886 -2.079 -0.459 426 H ILE 60 HN ILE 60 10.895 -2.503 -0.720 427 HA ILE 60 HA ILE 60 9.912 -0.037 -1.505 428 HB ILE 60 HB ILE 60 8.534 -1.827 -0.556 429 HG12 ILE 60 HG12 ILE 60 7.164 -0.415 1.056 430 HG13 ILE 60 HG11 ILE 60 8.401 0.826 0.872 431 HG21 ILE 60 HG21 ILE 60 9.984 -1.186 1.999 432 HG22 ILE 60 HG22 ILE 60 9.871 -2.734 1.157 433 HG23 ILE 60 HG23 ILE 60 8.451 -2.063 1.958 434 HD11 ILE 60 HD11 ILE 60 6.499 1.237 -0.579 435 HD12 ILE 60 HD12 ILE 60 6.732 -0.335 -1.343 436 HD13 ILE 60 HD13 ILE 60 7.958 0.921 -1.518 437 H GLU 61 HN GLU 61 11.741 -0.873 1.395 438 HA GLU 61 HA GLU 61 11.398 1.622 2.704 439 HB2 GLU 61 HB2 GLU 61 13.330 -0.649 3.093 440 HB3 GLU 61 HB1 GLU 61 13.234 0.734 4.172 441 HG2 GLU 61 HG2 GLU 61 10.965 0.146 4.759 442 HG3 GLU 61 HG1 GLU 61 10.996 -1.182 3.596 443 H ASP 62 HN ASP 62 13.959 0.219 0.722 444 HA ASP 62 HA ASP 62 15.763 2.405 1.203 445 HB2 ASP 62 HB2 ASP 62 15.900 0.068 -0.709 446 HB3 ASP 62 HB1 ASP 62 17.187 1.252 -0.508 447 H GLU 63 HN GLU 63 13.106 1.995 -0.762 448 HA GLU 63 HA GLU 63 14.131 3.623 -2.940 449 HB2 GLU 63 HB2 GLU 63 12.608 1.648 -3.324 450 HB3 GLU 63 HB1 GLU 63 11.328 2.569 -2.553 451 HG2 GLU 63 HG2 GLU 63 11.214 2.677 -4.991 452 HG3 GLU 63 HG1 GLU 63 11.458 4.256 -4.255 453 H CYS 64 HN CYS 64 11.849 3.819 -0.256 454 HA CYS 64 HA CYS 64 11.269 6.591 -1.053 455 HB2 CYS 64 HB2 CYS 64 9.081 6.337 -0.356 456 HB3 CYS 64 HB1 CYS 64 9.436 4.735 -0.994 457 H LYS 65 HN LYS 65 10.483 7.927 0.889 458 HA LYS 65 HA LYS 65 12.097 7.300 3.269 459 HB2 LYS 65 HB2 LYS 65 13.002 9.176 1.804 460 HB3 LYS 65 HB1 LYS 65 11.565 10.090 2.231 461 HG2 LYS 65 HG2 LYS 65 13.354 10.808 3.632 462 HG3 LYS 65 HG1 LYS 65 12.220 9.889 4.622 463 HD2 LYS 65 HD2 LYS 65 14.450 9.229 5.212 464 HD3 LYS 65 HD1 LYS 65 13.688 7.898 4.342 465 HE2 LYS 65 HE2 LYS 65 15.971 8.196 3.584 466 HE3 LYS 65 HE1 LYS 65 14.845 8.590 2.290 467 HZ1 LYS 65 HZ1 LYS 65 16.244 10.547 4.034 468 HZ2 LYS 65 HZ2 LYS 65 15.147 10.940 2.808 469 HZ3 LYS 65 HZ3 LYS 65 16.620 10.208 2.418 470 H ASN 66 HN ASN 66 9.604 6.374 3.206 471 HA ASN 66 HA ASN 66 8.219 8.063 5.139 472 HB2 ASN 66 HB2 ASN 66 6.980 7.059 2.579 473 HB3 ASN 66 HB1 ASN 66 6.012 7.500 3.978 474 HD21 ASN 66 HD21 ASN 66 7.853 8.626 1.318 475 HD22 ASN 66 HD22 ASN 66 7.564 10.315 1.549 476 H THR 67 HN THR 67 5.956 6.560 5.520 477 HA THR 67 HA THR 67 7.081 4.324 6.935 478 HB THR 67 HB THR 67 4.152 5.035 6.713 479 HG1 THR 67 HG1 THR 67 6.227 6.369 7.930 480 HG21 THR 67 HG21 THR 67 4.075 3.988 8.965 481 HG22 THR 67 HG22 THR 67 5.783 3.572 8.796 482 HG23 THR 67 HG23 THR 67 4.594 2.865 7.706 483 HA PRO 68 HA PRO 68 6.077 1.393 3.751 484 HB2 PRO 68 HB2 PRO 68 6.933 -0.809 5.097 485 HB3 PRO 68 HB1 PRO 68 8.028 0.324 4.307 486 HG2 PRO 68 HG2 PRO 68 7.446 -0.036 7.181 487 HG3 PRO 68 HG1 PRO 68 8.910 0.570 6.392 488 HD2 PRO 68 HD2 PRO 68 6.920 2.113 7.641 489 HD3 PRO 68 HD1 PRO 68 8.228 2.708 6.613 490 H THR 69 HN THR 69 4.049 0.782 3.392 491 HA THR 69 HA THR 69 2.607 -0.608 5.544 492 HB THR 69 HB THR 69 0.505 0.473 4.807 493 HG1 THR 69 HG1 THR 69 2.172 1.462 2.842 494 HG21 THR 69 HG21 THR 69 1.018 2.805 5.606 495 HG22 THR 69 HG22 THR 69 2.719 2.337 5.657 496 HG23 THR 69 HG23 THR 69 1.543 1.510 6.683 497 H CYS 70 HN CYS 70 1.204 -2.251 4.847 498 HA CYS 70 HA CYS 70 1.502 -2.971 2.005 499 HB2 CYS 70 HB2 CYS 70 1.288 -4.710 4.456 500 HB3 CYS 70 HB1 CYS 70 1.043 -5.329 2.821 501 H CYS 71 HN CYS 71 -0.213 -2.613 0.890 502 HA CYS 71 HA CYS 71 -2.739 -2.084 2.212 503 HB2 CYS 71 HB2 CYS 71 -2.066 -1.836 -0.723 504 HB3 CYS 71 HB1 CYS 71 -3.390 -1.067 0.140 505 H GLU 72 HN GLU 72 -4.706 -2.987 1.589 506 HA GLU 72 HA GLU 72 -4.507 -5.741 0.725 507 HB2 GLU 72 HB2 GLU 72 -5.768 -5.628 2.643 508 HB3 GLU 72 HB1 GLU 72 -6.439 -4.052 2.249 509 HG2 GLU 72 HG2 GLU 72 -7.989 -4.986 0.771 510 HG3 GLU 72 HG1 GLU 72 -7.198 -6.560 0.810 511 H ASP 73 HN ASP 73 -5.550 -2.649 -0.340 512 HA ASP 73 HA ASP 73 -5.619 -3.572 -3.069 513 HB2 ASP 73 HB2 ASP 73 -7.986 -3.895 -2.389 514 HB3 ASP 73 HB1 ASP 73 -8.066 -2.199 -1.932 515 H VAL 74 HN VAL 74 -5.596 -1.630 -4.546 516 HA VAL 74 HA VAL 74 -5.122 0.891 -3.128 517 HB VAL 74 HB VAL 74 -3.231 0.271 -5.372 518 HG11 VAL 74 HG11 VAL 74 -1.804 1.818 -4.131 519 HG12 VAL 74 HG12 VAL 74 -3.042 1.953 -2.885 520 HG13 VAL 74 HG13 VAL 74 -3.372 2.533 -4.516 521 HG21 VAL 74 HG21 VAL 74 -1.578 -0.619 -3.842 522 HG22 VAL 74 HG22 VAL 74 -3.020 -1.635 -3.817 523 HG23 VAL 74 HG23 VAL 74 -2.719 -0.499 -2.499 524 H GLU 75 HN GLU 75 -5.495 2.743 -4.316 525 HA GLU 75 HA GLU 75 -6.994 2.396 -6.827 526 HB2 GLU 75 HB2 GLU 75 -8.388 3.249 -5.068 527 HB3 GLU 75 HB1 GLU 75 -7.175 4.417 -4.600 528 HG2 GLU 75 HG2 GLU 75 -8.918 5.566 -5.704 529 HG3 GLU 75 HG1 GLU 75 -7.517 5.567 -6.767 530 H ASP 76 HN ASP 76 -6.811 4.220 -8.356 531 HA ASP 76 HA ASP 76 -5.556 5.461 -9.794 532 HB2 ASP 76 HB2 ASP 76 -4.210 6.329 -7.225 533 HB3 ASP 76 HB1 ASP 76 -3.868 7.045 -8.793 534 H ASP 77 HN ASP 77 -2.730 6.117 -9.526 535 HA ASP 77 HA ASP 77 -1.564 3.616 -10.305 536 HB2 ASP 77 HB2 ASP 77 -0.375 6.361 -9.876 537 HB3 ASP 77 HB1 ASP 77 0.560 4.972 -10.420 538 H GLY 78 HN GLY 78 -2.526 4.413 -7.429 539 HA2 GLY 78 HA2 GLY 78 -1.822 3.017 -5.585 540 HA3 GLY 78 HA1 GLY 78 -0.166 3.283 -6.073 541 H LEU 79 HN LEU 79 -2.421 5.914 -6.105 542 HA LEU 79 HA LEU 79 -0.852 7.285 -4.083 543 HB2 LEU 79 HB2 LEU 79 -3.156 8.203 -5.792 544 HB3 LEU 79 HB1 LEU 79 -2.295 9.223 -4.649 545 HG LEU 79 HG LEU 79 -0.972 7.856 -6.997 546 HD11 LEU 79 HD11 LEU 79 -1.041 9.992 -8.132 547 HD12 LEU 79 HD12 LEU 79 -1.925 10.706 -6.785 548 HD13 LEU 79 HD13 LEU 79 -2.679 9.449 -7.765 549 HD21 LEU 79 HD21 LEU 79 -0.075 10.109 -5.210 550 HD22 LEU 79 HD22 LEU 79 0.831 9.424 -6.558 551 HD23 LEU 79 HD23 LEU 79 0.498 8.444 -5.130 552 H VAL 80 HN VAL 80 -3.840 5.623 -4.325 553 HA VAL 80 HA VAL 80 -4.501 6.475 -1.584 554 HB VAL 80 HB VAL 80 -6.452 5.927 -3.830 555 HG11 VAL 80 HG11 VAL 80 -7.351 5.009 -1.804 556 HG12 VAL 80 HG12 VAL 80 -8.197 6.515 -2.162 557 HG13 VAL 80 HG13 VAL 80 -6.955 6.475 -0.912 558 HG21 VAL 80 HG21 VAL 80 -5.465 8.139 -3.966 559 HG22 VAL 80 HG22 VAL 80 -5.882 8.449 -2.281 560 HG23 VAL 80 HG23 VAL 80 -7.158 8.251 -3.483 561 H GLY 81 HN GLY 81 -4.245 4.760 -0.266 562 HA2 GLY 81 HA2 GLY 81 -4.469 2.107 -1.532 563 HA3 GLY 81 HA1 GLY 81 -3.416 2.474 -0.178 564 H ILE 82 HN ILE 82 -5.582 0.484 -0.629 565 HA ILE 82 HA ILE 82 -7.520 1.254 1.416 566 HB ILE 82 HB ILE 82 -7.432 -0.930 -0.637 567 HG12 ILE 82 HG12 ILE 82 -9.765 -0.105 -1.059 568 HG13 ILE 82 HG11 ILE 82 -9.481 1.152 0.139 569 HG21 ILE 82 HG21 ILE 82 -9.099 -0.919 1.860 570 HG22 ILE 82 HG22 ILE 82 -7.990 -2.169 1.298 571 HG23 ILE 82 HG23 ILE 82 -9.500 -1.873 0.434 572 HD11 ILE 82 HD11 ILE 82 -7.652 2.023 -1.219 573 HD12 ILE 82 HD12 ILE 82 -9.182 2.009 -2.099 574 HD13 ILE 82 HD13 ILE 82 -7.964 0.774 -2.427 575 H ASN 83 HN ASN 83 -7.039 0.804 3.406 576 HA ASN 83 HA ASN 83 -6.424 -0.308 5.282 577 HB2 ASN 83 HB2 ASN 83 -6.826 -2.617 3.390 578 HB3 ASN 83 HB1 ASN 83 -6.377 -2.873 5.069 579 HD21 ASN 83 HD21 ASN 83 -8.797 -3.688 3.716 580 HD22 ASN 83 HD22 ASN 83 -10.098 -2.915 4.546 581 H CYS 84 HN CYS 84 -4.399 0.886 3.855 582 HA CYS 84 HA CYS 84 -2.153 -0.887 3.647 583 HB2 CYS 84 HB2 CYS 84 -2.174 2.131 3.759 584 HB3 CYS 84 HB1 CYS 84 -0.846 1.111 3.222 585 H THR 85 HN THR 85 -2.030 -1.859 5.635 586 HA THR 85 HA THR 85 -1.777 -0.279 8.045 587 HB THR 85 HB THR 85 -1.413 -3.264 7.668 588 HG1 THR 85 HG1 THR 85 -3.686 -1.633 7.885 589 HG21 THR 85 HG21 THR 85 -1.968 -3.355 10.069 590 HG22 THR 85 HG22 THR 85 -2.002 -1.591 10.112 591 HG23 THR 85 HG23 THR 85 -0.495 -2.436 9.764 592 HA PRO 86 HA PRO 86 2.541 0.186 7.704 593 HB2 PRO 86 HB2 PRO 86 2.983 0.948 10.308 594 HB3 PRO 86 HB1 PRO 86 2.476 2.002 8.995 595 HG2 PRO 86 HG2 PRO 86 0.923 0.993 11.231 596 HG3 PRO 86 HG1 PRO 86 0.631 2.354 10.154 597 HD2 PRO 86 HD2 PRO 86 -0.621 -0.132 10.103 598 HD3 PRO 86 HD1 PRO 86 -0.779 1.177 8.948 599 H ILE 87 HN ILE 87 3.947 -1.397 7.622 600 HA ILE 87 HA ILE 87 3.568 -3.696 9.317 601 HB ILE 87 HB ILE 87 5.420 -4.608 7.768 602 HG12 ILE 87 HG12 ILE 87 4.448 -2.318 6.054 603 HG13 ILE 87 HG11 ILE 87 5.968 -2.265 6.932 604 HG21 ILE 87 HG21 ILE 87 2.670 -3.903 6.756 605 HG22 ILE 87 HG22 ILE 87 3.111 -5.324 7.704 606 HG23 ILE 87 HG23 ILE 87 3.721 -5.136 6.060 607 HD11 ILE 87 HD11 ILE 87 6.767 -4.186 5.657 608 HD12 ILE 87 HD12 ILE 87 6.304 -2.847 4.605 609 HD13 ILE 87 HD13 ILE 87 5.235 -4.239 4.784 610 HA PRO 88 HA PRO 88 7.071 -2.799 11.903 611 HB2 PRO 88 HB2 PRO 88 7.060 -5.642 12.561 612 HB3 PRO 88 HB1 PRO 88 6.693 -4.266 13.596 613 HG2 PRO 88 HG2 PRO 88 4.792 -5.983 12.826 614 HG3 PRO 88 HG1 PRO 88 4.474 -4.244 12.993 615 HD2 PRO 88 HD2 PRO 88 5.100 -5.801 10.505 616 HD3 PRO 88 HD1 PRO 88 3.792 -4.643 10.788 617 H LEU 89 HN LEU 89 9.260 -3.164 11.956 618 HA LEU 89 HA LEU 89 10.359 -4.642 9.683 619 HB2 LEU 89 HB2 LEU 89 11.767 -2.823 11.637 620 HB3 LEU 89 HB1 LEU 89 12.403 -3.420 10.113 621 HG LEU 89 HG LEU 89 10.137 -1.454 10.459 622 HD11 LEU 89 HD11 LEU 89 12.906 -1.138 9.317 623 HD12 LEU 89 HD12 LEU 89 12.326 -0.490 10.850 624 HD13 LEU 89 HD13 LEU 89 11.649 0.098 9.333 625 HD21 LEU 89 HD21 LEU 89 9.691 -2.914 8.568 626 HD22 LEU 89 HD22 LEU 89 11.307 -2.609 7.932 627 HD23 LEU 89 HD23 LEU 89 10.131 -1.298 8.016 628 H ILE 90 HN ILE 90 9.272 -5.992 12.008 629 HA ILE 90 HA ILE 90 11.681 -7.312 13.005 630 HB ILE 90 HB ILE 90 10.550 -7.468 15.254 631 HG12 ILE 90 HG12 ILE 90 8.849 -5.230 14.123 632 HG13 ILE 90 HG11 ILE 90 8.275 -6.847 14.517 633 HG21 ILE 90 HG21 ILE 90 12.429 -6.008 14.921 634 HG22 ILE 90 HG22 ILE 90 11.239 -5.174 15.921 635 HG23 ILE 90 HG23 ILE 90 11.395 -4.768 14.208 636 HD11 ILE 90 HD11 ILE 90 9.377 -4.843 16.473 637 HD12 ILE 90 HD12 ILE 90 8.789 -6.460 16.868 638 HD13 ILE 90 HD13 ILE 90 7.675 -5.246 16.238 Start of MODEL 6 1 H1 GLY 1 HT1 GLY 1 1.225 -6.811 -10.143 2 H2 GLY 1 HT2 GLY 1 2.317 -8.086 -10.343 3 H3 GLY 1 HT3 GLY 1 1.049 -7.880 -11.439 4 HA2 GLY 1 HA1 GLY 1 3.120 -7.127 -12.397 5 HA3 GLY 1 HA2 GLY 1 1.981 -5.804 -12.201 6 H SER 2 HN SER 2 2.302 -4.314 -10.456 7 HA SER 2 HA SER 2 5.104 -3.902 -9.874 8 HB2 SER 2 HB2 SER 2 2.704 -2.275 -9.002 9 HB3 SER 2 HB1 SER 2 4.391 -1.761 -8.964 10 HG SER 2 HG SER 2 4.054 -2.461 -11.409 11 H GLY 3 HN GLY 3 4.664 -6.169 -8.671 12 HA2 GLY 3 HA2 GLY 3 3.712 -5.773 -5.949 13 HA3 GLY 3 HA1 GLY 3 4.227 -7.293 -6.664 14 H TRP 4 HN TRP 4 4.946 -5.595 -4.183 15 HA TRP 4 HA TRP 4 7.798 -5.220 -4.590 16 HB2 TRP 4 HB2 TRP 4 5.917 -4.639 -2.324 17 HB3 TRP 4 HB1 TRP 4 7.660 -4.580 -2.094 18 HD1 TRP 4 HD1 TRP 4 4.804 -2.515 -3.247 19 HE1 TRP 4 HE1 TRP 4 5.650 -0.285 -4.201 20 HE3 TRP 4 HE3 TRP 4 9.773 -3.635 -3.614 21 HZ2 TRP 4 HZ2 TRP 4 8.107 0.848 -5.014 22 HZ3 TRP 4 HZ3 TRP 4 11.304 -1.925 -4.496 23 HH2 TRP 4 HH2 TRP 4 10.488 0.270 -5.183 24 H GLU 5 HN GLU 5 9.204 -5.990 -2.696 25 HA GLU 5 HA GLU 5 8.900 -8.860 -2.574 26 HB2 GLU 5 HB2 GLU 5 11.094 -7.034 -1.573 27 HB3 GLU 5 HB1 GLU 5 11.157 -8.793 -1.544 28 HG2 GLU 5 HG2 GLU 5 11.047 -7.015 -3.967 29 HG3 GLU 5 HG1 GLU 5 12.402 -8.005 -3.425 30 H SER 6 HN SER 6 7.624 -9.670 -1.075 31 HA SER 6 HA SER 6 7.094 -8.301 1.401 32 HB2 SER 6 HB2 SER 6 6.175 -11.015 0.420 33 HB3 SER 6 HB1 SER 6 5.541 -10.163 1.828 34 HG SER 6 HG SER 6 5.277 -9.525 -0.909 35 H LYS 7 HN LYS 7 9.811 -9.249 0.888 36 HA LYS 7 HA LYS 7 10.549 -11.581 2.169 37 HB2 LYS 7 HB2 LYS 7 12.779 -10.517 2.435 38 HB3 LYS 7 HB1 LYS 7 12.114 -10.337 0.819 39 HG2 LYS 7 HG2 LYS 7 12.954 -8.234 1.214 40 HG3 LYS 7 HG1 LYS 7 11.273 -8.044 1.709 41 HD2 LYS 7 HD2 LYS 7 12.020 -8.518 4.065 42 HD3 LYS 7 HD1 LYS 7 13.682 -8.402 3.482 43 HE2 LYS 7 HE2 LYS 7 13.332 -6.133 2.775 44 HE3 LYS 7 HE1 LYS 7 11.615 -6.234 3.153 45 HZ1 LYS 7 HZ1 LYS 7 12.653 -5.067 4.905 46 HZ2 LYS 7 HZ2 LYS 7 13.887 -6.219 5.056 47 HZ3 LYS 7 HZ3 LYS 7 12.309 -6.610 5.514 48 H THR 8 HN THR 8 9.426 -8.655 3.568 49 HA THR 8 HA THR 8 10.714 -8.960 6.083 50 HB THR 8 HB THR 8 10.078 -6.751 5.383 51 HG1 THR 8 HG1 THR 8 8.202 -6.989 7.408 52 HG21 THR 8 HG21 THR 8 8.104 -7.402 4.026 53 HG22 THR 8 HG22 THR 8 7.804 -6.024 5.083 54 HG23 THR 8 HG23 THR 8 7.194 -7.616 5.520 55 H GLY 9 HN GLY 9 8.065 -10.508 4.639 56 HA2 GLY 9 HA2 GLY 9 6.751 -12.222 5.440 57 HA3 GLY 9 HA1 GLY 9 7.656 -12.138 6.942 58 H SER 10 HN SER 10 6.192 -9.254 5.833 59 HA SER 10 HA SER 10 4.439 -9.333 8.175 60 HB2 SER 10 HB2 SER 10 5.230 -6.900 6.585 61 HB3 SER 10 HB1 SER 10 4.629 -6.973 8.241 62 HG SER 10 HG SER 10 6.582 -8.044 8.809 63 H CYS 11 HN CYS 11 4.201 -9.685 4.837 64 HA CYS 11 HA CYS 11 1.438 -8.702 4.852 65 HB2 CYS 11 HB2 CYS 11 3.222 -8.043 2.526 66 HB3 CYS 11 HB1 CYS 11 1.736 -7.252 3.050 67 H ASN 12 HN ASN 12 0.053 -9.838 3.612 68 HA ASN 12 HA ASN 12 1.081 -12.229 2.292 69 HB2 ASN 12 HB2 ASN 12 -1.300 -12.952 2.246 70 HB3 ASN 12 HB1 ASN 12 -0.698 -12.642 3.868 71 HD21 ASN 12 HD21 ASN 12 -1.460 -10.827 4.992 72 HD22 ASN 12 HD22 ASN 12 -2.913 -10.013 4.514 73 H THR 13 HN THR 13 -0.415 -9.197 1.546 74 HA THR 13 HA THR 13 -1.566 -10.102 -0.925 75 HB THR 13 HB THR 13 -2.184 -7.686 -1.213 76 HG1 THR 13 HG1 THR 13 -1.726 -6.263 0.448 77 HG21 THR 13 HG21 THR 13 -3.767 -9.172 -0.208 78 HG22 THR 13 HG22 THR 13 -3.760 -7.685 0.740 79 HG23 THR 13 HG23 THR 13 -2.919 -9.119 1.339 80 H GLY 14 HN GLY 14 1.352 -8.432 0.015 81 HA2 GLY 14 HA2 GLY 14 3.279 -8.211 -1.285 82 HA3 GLY 14 HA1 GLY 14 2.356 -8.724 -2.690 83 H LYS 15 HN LYS 15 0.461 -6.465 -1.372 84 HA LYS 15 HA LYS 15 1.459 -4.402 -3.166 85 HB2 LYS 15 HB2 LYS 15 -1.112 -4.663 -1.599 86 HB3 LYS 15 HB1 LYS 15 -0.710 -3.251 -2.567 87 HG2 LYS 15 HG2 LYS 15 -0.586 -4.678 -4.562 88 HG3 LYS 15 HG1 LYS 15 -1.041 -6.069 -3.577 89 HD2 LYS 15 HD2 LYS 15 -3.174 -5.049 -3.062 90 HD3 LYS 15 HD1 LYS 15 -2.716 -3.586 -3.933 91 HE2 LYS 15 HE2 LYS 15 -4.187 -4.983 -5.281 92 HE3 LYS 15 HE1 LYS 15 -2.589 -4.854 -6.010 93 HZ1 LYS 15 HZ1 LYS 15 -2.050 -7.027 -5.051 94 HZ2 LYS 15 HZ2 LYS 15 -3.360 -7.117 -6.110 95 HZ3 LYS 15 HZ3 LYS 15 -3.620 -7.153 -4.441 96 H LEU 16 HN LEU 16 3.278 -3.757 -1.999 97 HA LEU 16 HA LEU 16 2.851 -2.523 0.597 98 HB2 LEU 16 HB2 LEU 16 5.315 -3.159 -1.013 99 HB3 LEU 16 HB1 LEU 16 5.372 -2.161 0.417 100 HG LEU 16 HG LEU 16 4.478 -4.060 1.741 101 HD11 LEU 16 HD11 LEU 16 4.534 -6.297 0.761 102 HD12 LEU 16 HD12 LEU 16 4.830 -5.575 -0.822 103 HD13 LEU 16 HD13 LEU 16 3.315 -5.250 0.029 104 HD21 LEU 16 HD21 LEU 16 6.868 -3.637 1.672 105 HD22 LEU 16 HD22 LEU 16 7.011 -4.608 0.207 106 HD23 LEU 16 HD23 LEU 16 6.547 -5.370 1.727 107 H ALA 17 HN ALA 17 2.974 -0.345 0.928 108 HA ALA 17 HA ALA 17 3.881 1.387 -1.228 109 HB1 ALA 17 HB1 ALA 17 1.825 2.769 -1.120 110 HB2 ALA 17 HB2 ALA 17 1.085 1.530 -0.098 111 HB3 ALA 17 HB3 ALA 17 1.537 1.148 -1.759 112 H CYS 18 HN CYS 18 4.623 3.353 -0.514 113 HA CYS 18 HA CYS 18 4.951 3.626 2.363 114 HB2 CYS 18 HB2 CYS 18 6.088 5.238 0.070 115 HB3 CYS 18 HB1 CYS 18 6.525 5.422 1.763 116 H CYS 19 HN CYS 19 3.238 4.512 3.364 117 HA CYS 19 HA CYS 19 1.672 6.492 1.848 118 HB2 CYS 19 HB2 CYS 19 0.701 4.423 3.819 119 HB3 CYS 19 HB1 CYS 19 -0.315 5.614 3.019 120 H ASP 20 HN ASP 20 0.330 7.962 3.164 121 HA ASP 20 HA ASP 20 1.702 8.744 5.638 122 HB2 ASP 20 HB2 ASP 20 -0.181 10.280 3.843 123 HB3 ASP 20 HB1 ASP 20 0.366 10.870 5.398 124 H THR 21 HN THR 21 0.824 7.838 7.364 125 HA THR 21 HA THR 21 -1.894 6.917 7.346 126 HB THR 21 HB THR 21 -1.417 6.187 9.683 127 HG1 THR 21 HG1 THR 21 0.123 7.541 10.452 128 HG21 THR 21 HG21 THR 21 -0.966 4.731 7.744 129 HG22 THR 21 HG22 THR 21 0.163 4.444 9.066 130 HG23 THR 21 HG23 THR 21 0.675 5.374 7.657 131 H ASN 22 HN ASN 22 -0.643 9.904 7.749 132 HA ASN 22 HA ASN 22 -2.641 10.737 9.730 133 HB2 ASN 22 HB2 ASN 22 -0.349 12.257 8.464 134 HB3 ASN 22 HB1 ASN 22 -1.487 12.944 9.611 135 HD21 ASN 22 HD21 ASN 22 1.363 12.735 9.839 136 HD22 ASN 22 HD22 ASN 22 1.684 11.790 11.252 137 H LYS 23 HN LYS 23 -2.264 10.266 6.501 138 HA LYS 23 HA LYS 23 -4.101 12.443 5.757 139 HB2 LYS 23 HB2 LYS 23 -2.081 10.928 4.098 140 HB3 LYS 23 HB1 LYS 23 -3.224 12.081 3.455 141 HG2 LYS 23 HG2 LYS 23 -2.173 13.722 5.130 142 HG3 LYS 23 HG1 LYS 23 -0.856 12.560 5.189 143 HD2 LYS 23 HD2 LYS 23 -0.426 14.327 3.561 144 HD3 LYS 23 HD1 LYS 23 -0.559 12.752 2.778 145 HE2 LYS 23 HE2 LYS 23 -2.794 13.248 2.047 146 HE3 LYS 23 HE1 LYS 23 -2.815 14.744 2.976 147 HZ1 LYS 23 HZ1 LYS 23 -2.426 15.137 0.623 148 HZ2 LYS 23 HZ2 LYS 23 -1.037 14.174 0.671 149 HZ3 LYS 23 HZ3 LYS 23 -1.089 15.619 1.545 150 H LYS 24 HN LYS 24 -6.084 11.693 5.698 151 HA LYS 24 HA LYS 24 -6.529 8.894 4.981 152 HB2 LYS 24 HB2 LYS 24 -8.282 10.906 6.362 153 HB3 LYS 24 HB1 LYS 24 -8.771 9.256 6.006 154 HG2 LYS 24 HG2 LYS 24 -8.132 9.099 8.209 155 HG3 LYS 24 HG1 LYS 24 -6.646 8.633 7.382 156 HD2 LYS 24 HD2 LYS 24 -5.886 11.005 7.576 157 HD3 LYS 24 HD1 LYS 24 -7.310 11.327 8.565 158 HE2 LYS 24 HE2 LYS 24 -5.064 9.415 9.180 159 HE3 LYS 24 HE1 LYS 24 -5.409 10.938 9.994 160 HZ1 LYS 24 HZ1 LYS 24 -6.194 9.071 11.285 161 HZ2 LYS 24 HZ2 LYS 24 -7.146 8.531 9.998 162 HZ3 LYS 24 HZ3 LYS 24 -7.508 9.996 10.760 163 H VAL 25 HN VAL 25 -8.263 8.339 3.601 164 HA VAL 25 HA VAL 25 -8.996 10.446 1.668 165 HB VAL 25 HB VAL 25 -8.712 7.526 0.974 166 HG11 VAL 25 HG11 VAL 25 -10.108 8.844 -0.518 167 HG12 VAL 25 HG12 VAL 25 -8.622 8.339 -1.323 168 HG13 VAL 25 HG13 VAL 25 -8.791 9.996 -0.744 169 HG21 VAL 25 HG21 VAL 25 -6.527 8.293 1.699 170 HG22 VAL 25 HG22 VAL 25 -6.635 9.687 0.621 171 HG23 VAL 25 HG23 VAL 25 -6.547 8.055 -0.046 172 H GLN 26 HN GLN 26 -11.064 10.291 0.756 173 HA GLN 26 HA GLN 26 -13.058 9.247 2.534 174 HB2 GLN 26 HB2 GLN 26 -13.276 10.734 -0.079 175 HB3 GLN 26 HB1 GLN 26 -14.619 10.361 0.989 176 HG2 GLN 26 HG2 GLN 26 -13.702 11.738 2.724 177 HG3 GLN 26 HG1 GLN 26 -12.233 12.005 1.788 178 HE21 GLN 26 HE21 GLN 26 -14.066 13.949 2.863 179 HE22 GLN 26 HE22 GLN 26 -14.662 14.861 1.520 180 H LYS 27 HN LYS 27 -11.420 7.328 1.128 181 HA LYS 27 HA LYS 27 -11.510 5.431 -0.173 182 HB2 LYS 27 HB2 LYS 27 -13.258 3.872 0.796 183 HB3 LYS 27 HB1 LYS 27 -12.132 4.601 1.930 184 HG2 LYS 27 HG2 LYS 27 -14.669 6.041 1.512 185 HG3 LYS 27 HG1 LYS 27 -14.782 4.489 2.334 186 HD2 LYS 27 HD2 LYS 27 -12.811 6.600 3.167 187 HD3 LYS 27 HD1 LYS 27 -14.471 6.584 3.770 188 HE2 LYS 27 HE2 LYS 27 -12.708 4.177 3.913 189 HE3 LYS 27 HE1 LYS 27 -12.684 5.410 5.177 190 HZ1 LYS 27 HZ1 LYS 27 -15.099 3.913 4.304 191 HZ2 LYS 27 HZ2 LYS 27 -15.011 5.020 5.579 192 HZ3 LYS 27 HZ3 LYS 27 -14.182 3.550 5.679 193 H SER 28 HN SER 28 -11.938 5.082 -2.204 194 HA SER 28 HA SER 28 -14.678 5.498 -3.157 195 HB2 SER 28 HB2 SER 28 -12.171 6.068 -4.735 196 HB3 SER 28 HB1 SER 28 -13.831 6.425 -5.214 197 HG SER 28 HG SER 28 -12.129 7.855 -3.641 198 H THR 29 HN THR 29 -11.756 4.273 -4.639 199 HA THR 29 HA THR 29 -13.013 1.671 -5.064 200 HB THR 29 HB THR 29 -12.193 1.829 -7.498 201 HG1 THR 29 HG1 THR 29 -11.060 3.678 -7.605 202 HG21 THR 29 HG21 THR 29 -14.273 2.909 -8.246 203 HG22 THR 29 HG22 THR 29 -14.540 3.511 -6.609 204 HG23 THR 29 HG23 THR 29 -14.562 1.776 -6.926 205 H GLY 30 HN GLY 30 -11.240 0.546 -6.742 206 HA2 GLY 30 HA2 GLY 30 -8.508 1.028 -6.179 207 HA3 GLY 30 HA1 GLY 30 -9.124 -0.281 -5.170 208 H GLU 31 HN GLU 31 -7.582 -1.644 -6.396 209 HA GLU 31 HA GLU 31 -8.516 -2.203 -9.120 210 HB2 GLU 31 HB2 GLU 31 -5.973 -2.959 -7.689 211 HB3 GLU 31 HB1 GLU 31 -6.427 -3.628 -9.250 212 HG2 GLU 31 HG2 GLU 31 -6.591 -1.224 -10.059 213 HG3 GLU 31 HG1 GLU 31 -5.761 -0.785 -8.567 214 H GLU 32 HN GLU 32 -7.812 -3.841 -6.052 215 HA GLU 32 HA GLU 32 -8.996 -6.295 -7.046 216 HB2 GLU 32 HB2 GLU 32 -7.866 -5.609 -4.332 217 HB3 GLU 32 HB1 GLU 32 -8.407 -7.208 -4.826 218 HG2 GLU 32 HG2 GLU 32 -6.114 -5.646 -5.989 219 HG3 GLU 32 HG1 GLU 32 -6.009 -7.076 -4.964 220 H SER 33 HN SER 33 -9.625 -3.952 -4.468 221 HA SER 33 HA SER 33 -12.268 -5.096 -4.014 222 HB2 SER 33 HB2 SER 33 -10.828 -2.831 -2.606 223 HB3 SER 33 HB1 SER 33 -12.375 -3.522 -2.116 224 HG SER 33 HG SER 33 -11.371 -5.168 -1.256 225 H GLY 34 HN GLY 34 -11.035 -3.158 -6.238 226 HA2 GLY 34 HA2 GLY 34 -12.407 -0.771 -6.279 227 HA3 GLY 34 HA1 GLY 34 -11.937 -1.659 -7.718 228 H LEU 35 HN LEU 35 -13.545 -3.886 -7.566 229 HA LEU 35 HA LEU 35 -15.991 -2.818 -8.542 230 HB2 LEU 35 HB2 LEU 35 -15.235 -5.669 -7.884 231 HB3 LEU 35 HB1 LEU 35 -16.700 -5.199 -8.718 232 HG LEU 35 HG LEU 35 -15.150 -4.171 -10.491 233 HD11 LEU 35 HD11 LEU 35 -13.175 -5.968 -9.091 234 HD12 LEU 35 HD12 LEU 35 -13.079 -4.211 -9.227 235 HD13 LEU 35 HD13 LEU 35 -12.941 -5.215 -10.669 236 HD21 LEU 35 HD21 LEU 35 -16.476 -6.173 -10.860 237 HD22 LEU 35 HD22 LEU 35 -15.232 -7.156 -10.090 238 HD23 LEU 35 HD23 LEU 35 -14.889 -6.332 -11.610 239 H LEU 36 HN LEU 36 -15.415 -5.076 -5.842 240 HA LEU 36 HA LEU 36 -17.773 -3.964 -4.519 241 HB2 LEU 36 HB2 LEU 36 -16.460 -6.653 -4.465 242 HB3 LEU 36 HB1 LEU 36 -17.431 -6.133 -3.116 243 HG LEU 36 HG LEU 36 -18.803 -7.497 -4.501 244 HD11 LEU 36 HD11 LEU 36 -19.516 -4.622 -5.041 245 HD12 LEU 36 HD12 LEU 36 -19.880 -5.510 -3.563 246 HD13 LEU 36 HD13 LEU 36 -20.610 -6.002 -5.090 247 HD21 LEU 36 HD21 LEU 36 -17.502 -7.378 -6.552 248 HD22 LEU 36 HD22 LEU 36 -18.028 -5.713 -6.803 249 HD23 LEU 36 HD23 LEU 36 -19.201 -7.027 -6.865 250 H HIS 37 HN HIS 37 -17.032 -2.318 -3.305 251 HA HIS 37 HA HIS 37 -14.652 -2.831 -1.669 252 HB2 HIS 37 HB2 HIS 37 -14.609 -0.240 -1.493 253 HB3 HIS 37 HB1 HIS 37 -14.035 -1.012 -2.960 254 HD1 HIS 37 HD1 HIS 37 -15.592 -0.800 -5.091 255 HD2 HIS 37 HD2 HIS 37 -16.747 1.485 -1.808 256 HE1 HIS 37 HE1 HIS 37 -17.236 0.883 -5.977 257 HE2 HIS 37 HE2 HIS 37 -17.937 2.243 -3.976 258 H THR 38 HN THR 38 -17.479 -0.645 -1.375 259 HA THR 38 HA THR 38 -17.283 -0.840 1.492 260 HB THR 38 HB THR 38 -19.437 0.616 1.292 261 HG1 THR 38 HG1 THR 38 -19.503 1.688 -0.770 262 HG21 THR 38 HG21 THR 38 -17.274 1.491 1.992 263 HG22 THR 38 HG22 THR 38 -18.059 2.622 0.888 264 HG23 THR 38 HG23 THR 38 -16.750 1.590 0.310 265 H GLY 39 HN GLY 39 -18.911 -2.492 -0.986 266 HA2 GLY 39 HA2 GLY 39 -21.040 -3.483 0.708 267 HA3 GLY 39 HA1 GLY 39 -20.673 -4.019 -0.927 268 H ASP 40 HN ASP 40 -17.830 -4.337 -0.148 269 HA ASP 40 HA ASP 40 -18.047 -7.059 0.814 270 HB2 ASP 40 HB2 ASP 40 -16.536 -6.524 -1.058 271 HB3 ASP 40 HB1 ASP 40 -15.618 -5.453 -0.009 272 H VAL 41 HN VAL 41 -16.347 -4.099 1.725 273 HA VAL 41 HA VAL 41 -16.613 -4.817 4.536 274 HB VAL 41 HB VAL 41 -14.132 -3.990 4.802 275 HG11 VAL 41 HG11 VAL 41 -14.847 -6.770 3.861 276 HG12 VAL 41 HG12 VAL 41 -14.930 -6.172 5.519 277 HG13 VAL 41 HG13 VAL 41 -13.369 -6.336 4.717 278 HG21 VAL 41 HG21 VAL 41 -14.071 -5.193 2.033 279 HG22 VAL 41 HG22 VAL 41 -12.673 -4.708 2.992 280 HG23 VAL 41 HG23 VAL 41 -13.811 -3.492 2.416 281 H LEU 42 HN LEU 42 -16.976 -3.092 5.799 282 HA LEU 42 HA LEU 42 -17.025 -0.478 4.514 283 HB2 LEU 42 HB2 LEU 42 -19.077 -1.353 5.535 284 HB3 LEU 42 HB1 LEU 42 -18.255 -1.495 7.073 285 HG LEU 42 HG LEU 42 -17.931 0.968 7.051 286 HD11 LEU 42 HD11 LEU 42 -18.147 1.392 4.679 287 HD12 LEU 42 HD12 LEU 42 -19.373 2.299 5.565 288 HD13 LEU 42 HD13 LEU 42 -19.816 0.825 4.706 289 HD21 LEU 42 HD21 LEU 42 -20.768 -0.039 6.961 290 HD22 LEU 42 HD22 LEU 42 -20.240 1.473 7.697 291 HD23 LEU 42 HD23 LEU 42 -19.693 -0.066 8.359 292 H ASP 43 HN ASP 43 -15.040 -2.289 6.450 293 HA ASP 43 HA ASP 43 -14.244 -0.152 8.254 294 HB2 ASP 43 HB2 ASP 43 -12.843 -1.813 9.333 295 HB3 ASP 43 HB1 ASP 43 -14.458 -2.469 9.096 296 H GLN 44 HN GLN 44 -13.513 -0.839 5.140 297 HA GLN 44 HA GLN 44 -10.789 -0.987 4.920 298 HB2 GLN 44 HB2 GLN 44 -12.332 0.808 3.097 299 HB3 GLN 44 HB1 GLN 44 -10.943 -0.181 2.728 300 HG2 GLN 44 HG2 GLN 44 -12.335 -2.190 3.064 301 HG3 GLN 44 HG1 GLN 44 -13.736 -1.138 3.262 302 HE21 GLN 44 HE21 GLN 44 -11.448 -2.475 1.048 303 HE22 GLN 44 HE22 GLN 44 -12.216 -1.936 -0.400 304 H VAL 45 HN VAL 45 -9.149 0.287 5.248 305 HA VAL 45 HA VAL 45 -9.641 3.077 6.043 306 HB VAL 45 HB VAL 45 -7.207 1.358 6.600 307 HG11 VAL 45 HG11 VAL 45 -7.940 4.107 7.607 308 HG12 VAL 45 HG12 VAL 45 -6.663 3.730 6.450 309 HG13 VAL 45 HG13 VAL 45 -6.539 3.164 8.116 310 HG21 VAL 45 HG21 VAL 45 -9.144 0.571 7.844 311 HG22 VAL 45 HG22 VAL 45 -9.445 2.204 8.439 312 HG23 VAL 45 HG23 VAL 45 -7.984 1.344 8.927 313 H ALA 46 HN ALA 46 -9.379 4.401 4.416 314 HA ALA 46 HA ALA 46 -7.346 3.825 2.381 315 HB1 ALA 46 HB1 ALA 46 -9.667 5.748 2.308 316 HB2 ALA 46 HB2 ALA 46 -9.643 4.138 1.589 317 HB3 ALA 46 HB3 ALA 46 -8.567 5.394 0.975 318 H ILE 47 HN ILE 47 -5.517 4.904 2.447 319 HA ILE 47 HA ILE 47 -5.503 7.621 3.575 320 HB ILE 47 HB ILE 47 -3.135 7.145 4.336 321 HG12 ILE 47 HG12 ILE 47 -4.040 4.276 4.008 322 HG13 ILE 47 HG11 ILE 47 -2.786 5.071 3.061 323 HG21 ILE 47 HG21 ILE 47 -3.847 6.127 6.446 324 HG22 ILE 47 HG22 ILE 47 -5.382 5.673 5.700 325 HG23 ILE 47 HG23 ILE 47 -4.967 7.377 5.898 326 HD11 ILE 47 HD11 ILE 47 -1.782 3.685 4.749 327 HD12 ILE 47 HD12 ILE 47 -2.710 4.491 6.012 328 HD13 ILE 47 HD13 ILE 47 -1.475 5.380 5.122 329 H GLN 48 HN GLN 48 -3.927 9.036 2.714 330 HA GLN 48 HA GLN 48 -3.417 8.695 -0.084 331 HB2 GLN 48 HB2 GLN 48 -3.086 10.821 1.894 332 HB3 GLN 48 HB1 GLN 48 -1.749 10.748 0.757 333 HG2 GLN 48 HG2 GLN 48 -3.217 12.223 -0.237 334 HG3 GLN 48 HG1 GLN 48 -3.563 10.708 -1.057 335 HE21 GLN 48 HE21 GLN 48 -5.604 11.392 -1.648 336 HE22 GLN 48 HE22 GLN 48 -6.896 11.531 -0.506 337 H CYS 49 HN CYS 49 -1.510 8.276 -1.114 338 HA CYS 49 HA CYS 49 0.728 7.411 0.557 339 HB2 CYS 49 HB2 CYS 49 -1.002 5.584 -0.235 340 HB3 CYS 49 HB1 CYS 49 -0.119 5.721 -1.745 341 H THR 50 HN THR 50 2.700 6.947 -0.786 342 HA THR 50 HA THR 50 2.816 8.089 -3.402 343 HB THR 50 HB THR 50 2.778 10.194 -2.221 344 HG1 THR 50 HG1 THR 50 4.194 10.298 -3.912 345 HG21 THR 50 HG21 THR 50 4.471 10.774 -0.544 346 HG22 THR 50 HG22 THR 50 5.100 9.128 -0.618 347 HG23 THR 50 HG23 THR 50 3.468 9.421 -0.019 348 H GLN 51 HN GLN 51 4.389 7.185 -4.502 349 HA GLN 51 HA GLN 51 6.444 5.756 -2.972 350 HB2 GLN 51 HB2 GLN 51 4.681 4.289 -3.911 351 HB3 GLN 51 HB1 GLN 51 5.117 4.846 -5.520 352 HG2 GLN 51 HG2 GLN 51 6.130 2.690 -5.045 353 HG3 GLN 51 HG1 GLN 51 7.348 3.943 -5.262 354 HE21 GLN 51 HE21 GLN 51 8.912 2.809 -4.136 355 HE22 GLN 51 HE22 GLN 51 8.858 2.607 -2.419 356 H ILE 52 HN ILE 52 8.420 6.317 -3.421 357 HA ILE 52 HA ILE 52 9.197 8.056 -5.489 358 HB ILE 52 HB ILE 52 10.726 6.217 -3.656 359 HG12 ILE 52 HG12 ILE 52 10.297 9.197 -3.790 360 HG13 ILE 52 HG11 ILE 52 9.731 8.088 -2.549 361 HG21 ILE 52 HG21 ILE 52 11.975 6.488 -5.791 362 HG22 ILE 52 HG22 ILE 52 12.805 7.142 -4.382 363 HG23 ILE 52 HG23 ILE 52 11.989 8.228 -5.502 364 HD11 ILE 52 HD11 ILE 52 12.568 8.922 -3.082 365 HD12 ILE 52 HD12 ILE 52 12.099 7.680 -1.929 366 HD13 ILE 52 HD13 ILE 52 11.571 9.344 -1.691 367 HA PRO 53 HA PRO 53 9.227 5.888 -9.311 368 HB2 PRO 53 HB2 PRO 53 12.127 6.638 -9.247 369 HB3 PRO 53 HB1 PRO 53 10.971 6.753 -10.578 370 HG2 PRO 53 HG2 PRO 53 11.630 8.879 -9.051 371 HG3 PRO 53 HG1 PRO 53 10.023 8.679 -9.768 372 HD2 PRO 53 HD2 PRO 53 10.817 8.550 -6.959 373 HD3 PRO 53 HD1 PRO 53 9.195 8.664 -7.663 374 H LEU 54 HN LEU 54 9.221 3.796 -9.565 375 HA LEU 54 HA LEU 54 10.453 2.041 -7.756 376 HB2 LEU 54 HB2 LEU 54 9.262 1.302 -10.419 377 HB3 LEU 54 HB1 LEU 54 9.407 0.286 -9.000 378 HG LEU 54 HG LEU 54 7.599 2.693 -9.255 379 HD11 LEU 54 HD11 LEU 54 5.790 1.050 -9.224 380 HD12 LEU 54 HD12 LEU 54 6.975 -0.256 -9.216 381 HD13 LEU 54 HD13 LEU 54 6.852 0.813 -10.612 382 HD21 LEU 54 HD21 LEU 54 7.897 0.683 -7.031 383 HD22 LEU 54 HD22 LEU 54 6.677 1.952 -7.120 384 HD23 LEU 54 HD23 LEU 54 8.382 2.377 -6.973 385 H LEU 55 HN LEU 55 12.562 1.501 -7.742 386 HA LEU 55 HA LEU 55 13.856 0.894 -10.298 387 HB2 LEU 55 HB2 LEU 55 14.930 0.970 -7.477 388 HB3 LEU 55 HB1 LEU 55 15.875 0.524 -8.881 389 HG LEU 55 HG LEU 55 14.636 3.226 -8.369 390 HD11 LEU 55 HD11 LEU 55 16.557 2.762 -6.949 391 HD12 LEU 55 HD12 LEU 55 16.943 3.984 -8.159 392 HD13 LEU 55 HD13 LEU 55 17.512 2.328 -8.366 393 HD21 LEU 55 HD21 LEU 55 16.328 2.242 -10.664 394 HD22 LEU 55 HD22 LEU 55 15.899 3.926 -10.368 395 HD23 LEU 55 HD23 LEU 55 14.641 2.751 -10.741 396 H ILE 56 HN ILE 56 13.917 -1.145 -11.021 397 HA ILE 56 HA ILE 56 12.523 -3.158 -9.546 398 HB ILE 56 HB ILE 56 14.122 -3.552 -12.067 399 HG12 ILE 56 HG12 ILE 56 11.712 -3.489 -13.082 400 HG13 ILE 56 HG11 ILE 56 11.318 -2.565 -11.640 401 HG21 ILE 56 HG21 ILE 56 13.584 -5.610 -10.897 402 HG22 ILE 56 HG22 ILE 56 12.678 -5.492 -12.406 403 HG23 ILE 56 HG23 ILE 56 11.879 -5.161 -10.870 404 HD11 ILE 56 HD11 ILE 56 12.882 -0.852 -12.252 405 HD12 ILE 56 HD12 ILE 56 11.818 -1.175 -13.618 406 HD13 ILE 56 HD13 ILE 56 13.461 -1.813 -13.611 407 H GLY 57 HN GLY 57 13.308 -4.745 -8.341 408 HA2 GLY 57 HA2 GLY 57 14.940 -6.255 -7.546 409 HA3 GLY 57 HA1 GLY 57 16.179 -5.297 -8.343 410 H ILE 58 HN ILE 58 14.145 -3.196 -6.831 411 HA ILE 58 HA ILE 58 15.960 -2.967 -4.549 412 HB ILE 58 HB ILE 58 14.746 -1.049 -6.322 413 HG12 ILE 58 HG12 ILE 58 17.139 -1.260 -5.781 414 HG13 ILE 58 HG11 ILE 58 16.528 0.365 -5.499 415 HG21 ILE 58 HG21 ILE 58 13.087 -0.649 -4.629 416 HG22 ILE 58 HG22 ILE 58 14.225 0.700 -4.641 417 HG23 ILE 58 HG23 ILE 58 14.331 -0.541 -3.382 418 HD11 ILE 58 HD11 ILE 58 18.030 -0.331 -3.721 419 HD12 ILE 58 HD12 ILE 58 17.007 -1.728 -3.385 420 HD13 ILE 58 HD13 ILE 58 16.395 -0.100 -3.104 421 H ALA 59 HN ALA 59 15.209 -2.482 -2.532 422 HA ALA 59 HA ALA 59 12.650 -3.667 -1.805 423 HB1 ALA 59 HB1 ALA 59 13.544 -3.320 0.503 424 HB2 ALA 59 HB2 ALA 59 14.995 -2.619 -0.230 425 HB3 ALA 59 HB3 ALA 59 14.583 -4.308 -0.529 426 H ILE 60 HN ILE 60 10.935 -2.513 -1.260 427 HA ILE 60 HA ILE 60 10.506 0.133 -1.872 428 HB ILE 60 HB ILE 60 8.702 -1.469 -1.492 429 HG12 ILE 60 HG12 ILE 60 8.561 0.924 0.363 430 HG13 ILE 60 HG11 ILE 60 8.193 0.929 -1.358 431 HG21 ILE 60 HG21 ILE 60 8.061 -1.812 1.007 432 HG22 ILE 60 HG22 ILE 60 9.764 -1.417 1.316 433 HG23 ILE 60 HG23 ILE 60 9.341 -2.798 0.297 434 HD11 ILE 60 HD11 ILE 60 6.686 -0.565 0.770 435 HD12 ILE 60 HD12 ILE 60 6.318 -0.581 -0.954 436 HD13 ILE 60 HD13 ILE 60 6.171 0.917 -0.034 437 H GLU 61 HN GLU 61 11.565 -1.255 1.149 438 HA GLU 61 HA GLU 61 11.104 0.901 2.867 439 HB2 GLU 61 HB2 GLU 61 13.083 -1.357 2.931 440 HB3 GLU 61 HB1 GLU 61 12.764 -0.306 4.302 441 HG2 GLU 61 HG2 GLU 61 10.791 -1.318 4.763 442 HG3 GLU 61 HG1 GLU 61 10.455 -1.665 3.066 443 H ASP 62 HN ASP 62 13.802 0.081 0.781 444 HA ASP 62 HA ASP 62 15.399 2.290 1.820 445 HB2 ASP 62 HB2 ASP 62 16.412 0.031 1.330 446 HB3 ASP 62 HB1 ASP 62 16.105 0.335 -0.376 447 H GLU 63 HN GLU 63 13.320 1.476 -0.769 448 HA GLU 63 HA GLU 63 14.245 3.298 -2.725 449 HB2 GLU 63 HB2 GLU 63 12.749 1.340 -3.162 450 HB3 GLU 63 HB1 GLU 63 11.455 2.199 -2.349 451 HG2 GLU 63 HG2 GLU 63 11.199 2.400 -4.728 452 HG3 GLU 63 HG1 GLU 63 11.586 3.964 -4.029 453 H CYS 64 HN CYS 64 11.876 3.534 -0.111 454 HA CYS 64 HA CYS 64 11.408 6.326 -0.908 455 HB2 CYS 64 HB2 CYS 64 9.189 6.162 -0.233 456 HB3 CYS 64 HB1 CYS 64 9.488 4.603 -0.986 457 H LYS 65 HN LYS 65 10.723 7.748 0.927 458 HA LYS 65 HA LYS 65 12.141 7.050 3.410 459 HB2 LYS 65 HB2 LYS 65 11.917 9.751 2.071 460 HB3 LYS 65 HB1 LYS 65 12.592 9.489 3.673 461 HG2 LYS 65 HG2 LYS 65 13.667 8.418 1.075 462 HG3 LYS 65 HG1 LYS 65 14.364 9.706 2.058 463 HD2 LYS 65 HD2 LYS 65 14.573 8.035 3.919 464 HD3 LYS 65 HD1 LYS 65 14.103 6.790 2.765 465 HE2 LYS 65 HE2 LYS 65 16.018 7.317 1.372 466 HE3 LYS 65 HE1 LYS 65 16.478 8.621 2.464 467 HZ1 LYS 65 HZ1 LYS 65 16.837 6.992 4.207 468 HZ2 LYS 65 HZ2 LYS 65 17.780 6.625 2.853 469 HZ3 LYS 65 HZ3 LYS 65 16.378 5.739 3.168 470 H ASN 66 HN ASN 66 9.511 6.396 3.008 471 HA ASN 66 HA ASN 66 8.169 8.176 4.917 472 HB2 ASN 66 HB2 ASN 66 7.004 7.071 2.366 473 HB3 ASN 66 HB1 ASN 66 5.994 7.628 3.692 474 HD21 ASN 66 HD21 ASN 66 7.988 8.520 1.051 475 HD22 ASN 66 HD22 ASN 66 7.747 10.229 1.161 476 H THR 67 HN THR 67 5.833 6.701 5.262 477 HA THR 67 HA THR 67 6.950 4.545 6.823 478 HB THR 67 HB THR 67 4.036 5.326 6.632 479 HG1 THR 67 HG1 THR 67 6.208 6.566 7.879 480 HG21 THR 67 HG21 THR 67 4.028 4.404 8.958 481 HG22 THR 67 HG22 THR 67 5.692 3.872 8.696 482 HG23 THR 67 HG23 THR 67 4.387 3.206 7.714 483 HA PRO 68 HA PRO 68 5.932 1.560 3.718 484 HB2 PRO 68 HB2 PRO 68 6.873 -0.602 5.051 485 HB3 PRO 68 HB1 PRO 68 7.933 0.572 4.270 486 HG2 PRO 68 HG2 PRO 68 7.321 0.196 7.144 487 HG3 PRO 68 HG1 PRO 68 8.794 0.803 6.375 488 HD2 PRO 68 HD2 PRO 68 6.797 2.349 7.590 489 HD3 PRO 68 HD1 PRO 68 8.090 2.946 6.545 490 H THR 69 HN THR 69 3.903 0.914 3.410 491 HA THR 69 HA THR 69 2.554 -0.491 5.614 492 HB THR 69 HB THR 69 0.436 0.538 5.017 493 HG1 THR 69 HG1 THR 69 1.957 1.610 2.886 494 HG21 THR 69 HG21 THR 69 1.757 1.802 6.618 495 HG22 THR 69 HG22 THR 69 0.882 2.910 5.560 496 HG23 THR 69 HG23 THR 69 2.603 2.624 5.307 497 H CYS 70 HN CYS 70 1.136 -2.165 4.968 498 HA CYS 70 HA CYS 70 1.384 -2.928 2.134 499 HB2 CYS 70 HB2 CYS 70 1.171 -4.634 4.609 500 HB3 CYS 70 HB1 CYS 70 0.899 -5.272 2.986 501 H CYS 71 HN CYS 71 -0.347 -2.843 0.979 502 HA CYS 71 HA CYS 71 -2.885 -2.207 2.303 503 HB2 CYS 71 HB2 CYS 71 -2.111 -1.874 -0.600 504 HB3 CYS 71 HB1 CYS 71 -3.485 -1.154 0.220 505 H GLU 72 HN GLU 72 -4.773 -3.133 1.763 506 HA GLU 72 HA GLU 72 -4.664 -5.830 0.735 507 HB2 GLU 72 HB2 GLU 72 -6.781 -4.108 1.983 508 HB3 GLU 72 HB1 GLU 72 -7.173 -5.685 1.286 509 HG2 GLU 72 HG2 GLU 72 -5.120 -6.359 2.858 510 HG3 GLU 72 HG1 GLU 72 -5.718 -4.969 3.745 511 H ASP 73 HN ASP 73 -5.309 -2.688 -0.352 512 HA ASP 73 HA ASP 73 -5.440 -3.518 -3.069 513 HB2 ASP 73 HB2 ASP 73 -7.849 -3.816 -2.314 514 HB3 ASP 73 HB1 ASP 73 -7.893 -2.085 -2.026 515 H VAL 74 HN VAL 74 -5.274 -1.609 -4.501 516 HA VAL 74 HA VAL 74 -4.928 0.940 -3.113 517 HB VAL 74 HB VAL 74 -2.758 0.322 -5.057 518 HG11 VAL 74 HG11 VAL 74 -1.488 1.779 -3.573 519 HG12 VAL 74 HG12 VAL 74 -2.854 1.843 -2.463 520 HG13 VAL 74 HG13 VAL 74 -3.002 2.533 -4.078 521 HG21 VAL 74 HG21 VAL 74 -1.323 -0.677 -3.373 522 HG22 VAL 74 HG22 VAL 74 -2.753 -1.679 -3.625 523 HG23 VAL 74 HG23 VAL 74 -2.642 -0.644 -2.201 524 H GLU 75 HN GLU 75 -5.545 2.647 -4.301 525 HA GLU 75 HA GLU 75 -6.471 2.153 -7.034 526 HB2 GLU 75 HB2 GLU 75 -8.094 3.063 -5.443 527 HB3 GLU 75 HB1 GLU 75 -7.022 4.407 -5.094 528 HG2 GLU 75 HG2 GLU 75 -8.866 5.037 -6.555 529 HG3 GLU 75 HG1 GLU 75 -7.301 5.267 -7.326 530 H ASP 76 HN ASP 76 -6.083 3.810 -8.657 531 HA ASP 76 HA ASP 76 -4.673 4.987 -9.988 532 HB2 ASP 76 HB2 ASP 76 -3.685 6.150 -7.369 533 HB3 ASP 76 HB1 ASP 76 -3.299 6.779 -8.965 534 H ASP 77 HN ASP 77 -1.941 5.804 -9.330 535 HA ASP 77 HA ASP 77 -0.627 3.261 -9.678 536 HB2 ASP 77 HB2 ASP 77 0.463 6.076 -9.523 537 HB3 ASP 77 HB1 ASP 77 1.459 4.652 -9.799 538 H GLY 78 HN GLY 78 -1.983 4.048 -7.113 539 HA2 GLY 78 HA2 GLY 78 -1.400 2.951 -5.071 540 HA3 GLY 78 HA1 GLY 78 0.276 3.345 -5.372 541 H LEU 79 HN LEU 79 -2.109 5.792 -5.927 542 HA LEU 79 HA LEU 79 -0.937 7.442 -3.895 543 HB2 LEU 79 HB2 LEU 79 -3.221 7.858 -5.813 544 HB3 LEU 79 HB1 LEU 79 -2.708 9.071 -4.658 545 HG LEU 79 HG LEU 79 -1.865 9.478 -6.926 546 HD11 LEU 79 HD11 LEU 79 -0.633 10.362 -5.054 547 HD12 LEU 79 HD12 LEU 79 0.483 9.857 -6.321 548 HD13 LEU 79 HD13 LEU 79 0.256 8.849 -4.894 549 HD21 LEU 79 HD21 LEU 79 -1.593 7.230 -7.744 550 HD22 LEU 79 HD22 LEU 79 -0.326 6.926 -6.555 551 HD23 LEU 79 HD23 LEU 79 -0.061 8.098 -7.846 552 H VAL 80 HN VAL 80 -3.752 5.446 -4.171 553 HA VAL 80 HA VAL 80 -4.569 6.305 -1.475 554 HB VAL 80 HB VAL 80 -6.446 5.672 -3.763 555 HG11 VAL 80 HG11 VAL 80 -8.244 6.214 -2.159 556 HG12 VAL 80 HG12 VAL 80 -7.038 6.305 -0.877 557 HG13 VAL 80 HG13 VAL 80 -7.330 4.776 -1.703 558 HG21 VAL 80 HG21 VAL 80 -5.517 7.911 -3.925 559 HG22 VAL 80 HG22 VAL 80 -5.978 8.239 -2.255 560 HG23 VAL 80 HG23 VAL 80 -7.221 7.979 -3.479 561 H GLY 81 HN GLY 81 -4.257 4.617 -0.169 562 HA2 GLY 81 HA2 GLY 81 -4.499 1.931 -1.352 563 HA3 GLY 81 HA1 GLY 81 -3.482 2.330 0.022 564 H ILE 82 HN ILE 82 -5.671 0.357 -0.433 565 HA ILE 82 HA ILE 82 -7.540 1.164 1.678 566 HB ILE 82 HB ILE 82 -7.653 -0.934 -0.470 567 HG12 ILE 82 HG12 ILE 82 -9.945 0.032 -0.781 568 HG13 ILE 82 HG11 ILE 82 -9.560 1.223 0.457 569 HG21 ILE 82 HG21 ILE 82 -9.642 -1.901 0.591 570 HG22 ILE 82 HG22 ILE 82 -9.356 -0.894 2.010 571 HG23 ILE 82 HG23 ILE 82 -8.183 -2.129 1.557 572 HD11 ILE 82 HD11 ILE 82 -9.289 2.139 -1.769 573 HD12 ILE 82 HD12 ILE 82 -8.129 0.868 -2.162 574 HD13 ILE 82 HD13 ILE 82 -7.742 2.064 -0.922 575 H ASN 83 HN ASN 83 -7.068 0.530 3.628 576 HA ASN 83 HA ASN 83 -6.445 -0.739 5.404 577 HB2 ASN 83 HB2 ASN 83 -6.774 -2.939 3.362 578 HB3 ASN 83 HB1 ASN 83 -6.377 -3.265 5.032 579 HD21 ASN 83 HD21 ASN 83 -8.688 -4.195 3.772 580 HD22 ASN 83 HD22 ASN 83 -10.056 -3.453 4.527 581 H CYS 84 HN CYS 84 -4.463 0.624 4.244 582 HA CYS 84 HA CYS 84 -2.188 -1.108 3.810 583 HB2 CYS 84 HB2 CYS 84 -2.284 1.903 4.061 584 HB3 CYS 84 HB1 CYS 84 -0.946 0.944 3.438 585 H THR 85 HN THR 85 -1.822 -2.171 5.707 586 HA THR 85 HA THR 85 -1.668 -0.747 8.213 587 HB THR 85 HB THR 85 -0.824 -3.596 7.665 588 HG1 THR 85 HG1 THR 85 -3.327 -3.155 8.752 589 HG21 THR 85 HG21 THR 85 -1.778 -2.186 10.163 590 HG22 THR 85 HG22 THR 85 -0.131 -2.724 9.833 591 HG23 THR 85 HG23 THR 85 -1.422 -3.909 10.039 592 HA PRO 86 HA PRO 86 2.638 0.353 7.703 593 HB2 PRO 86 HB2 PRO 86 2.507 0.745 10.632 594 HB3 PRO 86 HB1 PRO 86 2.941 1.897 9.365 595 HG2 PRO 86 HG2 PRO 86 0.611 2.096 10.640 596 HG3 PRO 86 HG1 PRO 86 0.721 2.409 8.898 597 HD2 PRO 86 HD2 PRO 86 -0.238 -0.049 10.318 598 HD3 PRO 86 HD1 PRO 86 -0.947 0.806 8.936 599 H ILE 87 HN ILE 87 4.034 -1.247 7.434 600 HA ILE 87 HA ILE 87 4.037 -3.511 9.230 601 HB ILE 87 HB ILE 87 5.715 -4.381 7.504 602 HG12 ILE 87 HG12 ILE 87 4.530 -2.169 5.829 603 HG13 ILE 87 HG11 ILE 87 6.110 -2.037 6.584 604 HG21 ILE 87 HG21 ILE 87 3.461 -5.200 7.630 605 HG22 ILE 87 HG22 ILE 87 3.874 -4.947 5.933 606 HG23 ILE 87 HG23 ILE 87 2.855 -3.779 6.776 607 HD11 ILE 87 HD11 ILE 87 5.273 -4.077 4.539 608 HD12 ILE 87 HD12 ILE 87 6.856 -3.998 5.315 609 HD13 ILE 87 HD13 ILE 87 6.320 -2.681 4.270 610 HA PRO 88 HA PRO 88 7.720 -2.275 11.363 611 HB2 PRO 88 HB2 PRO 88 8.262 -5.118 11.784 612 HB3 PRO 88 HB1 PRO 88 7.847 -3.880 12.966 613 HG2 PRO 88 HG2 PRO 88 6.127 -5.820 12.343 614 HG3 PRO 88 HG1 PRO 88 5.577 -4.159 12.650 615 HD2 PRO 88 HD2 PRO 88 6.094 -5.503 10.014 616 HD3 PRO 88 HD1 PRO 88 4.671 -4.581 10.536 617 H LEU 89 HN LEU 89 9.894 -2.145 11.074 618 HA LEU 89 HA LEU 89 10.952 -3.136 8.560 619 HB2 LEU 89 HB2 LEU 89 12.212 -1.425 10.704 620 HB3 LEU 89 HB1 LEU 89 12.919 -1.761 9.134 621 HG LEU 89 HG LEU 89 10.363 -0.221 9.604 622 HD11 LEU 89 HD11 LEU 89 13.100 0.712 8.749 623 HD12 LEU 89 HD12 LEU 89 12.344 1.010 10.315 624 HD13 LEU 89 HD13 LEU 89 11.651 1.712 8.851 625 HD21 LEU 89 HD21 LEU 89 11.883 -0.838 7.074 626 HD22 LEU 89 HD22 LEU 89 10.553 0.312 7.198 627 HD23 LEU 89 HD23 LEU 89 10.266 -1.401 7.502 628 H ILE 90 HN ILE 90 10.413 -4.944 10.887 629 HA ILE 90 HA ILE 90 13.153 -5.893 11.327 630 HB ILE 90 HB ILE 90 12.363 -6.712 13.571 631 HG12 ILE 90 HG12 ILE 90 10.079 -4.791 13.056 632 HG13 ILE 90 HG11 ILE 90 9.924 -6.543 13.115 633 HG21 ILE 90 HG21 ILE 90 12.446 -3.753 12.983 634 HG22 ILE 90 HG22 ILE 90 13.799 -4.805 13.412 635 HG23 ILE 90 HG23 ILE 90 12.552 -4.445 14.606 636 HD11 ILE 90 HD11 ILE 90 10.637 -6.519 15.454 637 HD12 ILE 90 HD12 ILE 90 9.196 -5.536 15.193 638 HD13 ILE 90 HD13 ILE 90 10.768 -4.762 15.389 Start of MODEL 7 1 H1 GLY 1 HT1 GLY 1 -0.163 -0.755 -9.573 2 H2 GLY 1 HT2 GLY 1 -0.679 -2.303 -9.129 3 H3 GLY 1 HT3 GLY 1 0.688 -2.114 -10.103 4 HA2 GLY 1 HA1 GLY 1 1.885 -1.056 -8.314 5 HA3 GLY 1 HA2 GLY 1 0.455 -1.188 -7.297 6 H SER 2 HN SER 2 1.730 -2.385 -5.791 7 HA SER 2 HA SER 2 2.274 -4.312 -4.736 8 HB2 SER 2 HB2 SER 2 0.133 -5.110 -5.861 9 HB3 SER 2 HB1 SER 2 1.159 -5.830 -7.097 10 HG SER 2 HG SER 2 1.003 -7.452 -5.711 11 H GLY 3 HN GLY 3 3.361 -6.660 -5.446 12 HA2 GLY 3 HA2 GLY 3 5.164 -7.713 -6.468 13 HA3 GLY 3 HA1 GLY 3 5.354 -6.316 -7.515 14 H TRP 4 HN TRP 4 5.175 -5.977 -4.064 15 HA TRP 4 HA TRP 4 7.914 -4.958 -4.087 16 HB2 TRP 4 HB2 TRP 4 5.611 -4.594 -2.186 17 HB3 TRP 4 HB1 TRP 4 7.246 -4.074 -1.794 18 HD1 TRP 4 HD1 TRP 4 4.157 -2.863 -3.369 19 HE1 TRP 4 HE1 TRP 4 4.578 -0.639 -4.592 20 HE3 TRP 4 HE3 TRP 4 9.262 -2.930 -3.419 21 HZ2 TRP 4 HZ2 TRP 4 6.794 0.872 -5.485 22 HZ3 TRP 4 HZ3 TRP 4 10.457 -1.064 -4.484 23 HH2 TRP 4 HH2 TRP 4 9.249 0.796 -5.494 24 H GLU 5 HN GLU 5 9.211 -5.318 -2.118 25 HA GLU 5 HA GLU 5 9.594 -8.112 -1.799 26 HB2 GLU 5 HB2 GLU 5 10.872 -5.757 -0.393 27 HB3 GLU 5 HB1 GLU 5 11.416 -7.420 -0.238 28 HG2 GLU 5 HG2 GLU 5 12.835 -6.263 -1.774 29 HG3 GLU 5 HG1 GLU 5 11.884 -7.452 -2.661 30 H SER 6 HN SER 6 8.178 -9.240 -0.657 31 HA SER 6 HA SER 6 7.552 -8.331 2.070 32 HB2 SER 6 HB2 SER 6 5.574 -8.697 0.593 33 HB3 SER 6 HB1 SER 6 6.069 -10.379 0.396 34 HG SER 6 HG SER 6 5.600 -10.784 2.480 35 H LYS 7 HN LYS 7 9.970 -9.581 1.065 36 HA LYS 7 HA LYS 7 10.175 -12.309 1.470 37 HB2 LYS 7 HB2 LYS 7 11.919 -11.083 0.382 38 HB3 LYS 7 HB1 LYS 7 12.186 -10.083 1.799 39 HG2 LYS 7 HG2 LYS 7 12.590 -13.008 2.066 40 HG3 LYS 7 HG1 LYS 7 13.783 -12.083 1.157 41 HD2 LYS 7 HD2 LYS 7 14.050 -10.578 3.096 42 HD3 LYS 7 HD1 LYS 7 12.907 -11.571 4.000 43 HE2 LYS 7 HE2 LYS 7 15.192 -12.150 4.588 44 HE3 LYS 7 HE1 LYS 7 14.402 -13.494 3.768 45 HZ1 LYS 7 HZ1 LYS 7 15.535 -12.884 1.732 46 HZ2 LYS 7 HZ2 LYS 7 16.659 -13.145 2.967 47 HZ3 LYS 7 HZ3 LYS 7 16.272 -11.570 2.496 48 H THR 8 HN THR 8 10.196 -9.703 3.817 49 HA THR 8 HA THR 8 11.059 -11.466 5.941 50 HB THR 8 HB THR 8 11.741 -9.056 5.837 51 HG1 THR 8 HG1 THR 8 11.412 -8.737 8.127 52 HG21 THR 8 HG21 THR 8 8.880 -8.577 6.670 53 HG22 THR 8 HG22 THR 8 9.611 -8.084 5.144 54 HG23 THR 8 HG23 THR 8 10.162 -7.367 6.658 55 H GLY 9 HN GLY 9 8.215 -11.245 4.388 56 HA2 GLY 9 HA2 GLY 9 6.214 -12.273 4.968 57 HA3 GLY 9 HA1 GLY 9 6.811 -12.439 6.612 58 H SER 10 HN SER 10 6.952 -9.317 5.172 59 HA SER 10 HA SER 10 5.476 -8.231 7.329 60 HB2 SER 10 HB2 SER 10 5.774 -6.089 5.893 61 HB3 SER 10 HB1 SER 10 7.201 -6.872 6.557 62 HG SER 10 HG SER 10 7.433 -6.358 4.325 63 H CYS 11 HN CYS 11 4.625 -9.046 4.041 64 HA CYS 11 HA CYS 11 1.949 -7.916 4.533 65 HB2 CYS 11 HB2 CYS 11 3.356 -6.476 3.037 66 HB3 CYS 11 HB1 CYS 11 3.405 -7.809 1.890 67 H ASN 12 HN ASN 12 0.215 -9.030 3.703 68 HA ASN 12 HA ASN 12 0.773 -11.806 3.028 69 HB2 ASN 12 HB2 ASN 12 -1.601 -12.199 3.455 70 HB3 ASN 12 HB1 ASN 12 -0.861 -11.345 4.803 71 HD21 ASN 12 HD21 ASN 12 -1.374 -9.150 5.125 72 HD22 ASN 12 HD22 ASN 12 -2.800 -8.454 4.434 73 H THR 13 HN THR 13 -0.323 -8.908 1.494 74 HA THR 13 HA THR 13 -1.411 -10.394 -0.781 75 HB THR 13 HB THR 13 -2.141 -8.153 -1.588 76 HG1 THR 13 HG1 THR 13 -1.985 -6.480 0.181 77 HG21 THR 13 HG21 THR 13 -2.961 -8.882 1.230 78 HG22 THR 13 HG22 THR 13 -3.682 -9.482 -0.265 79 HG23 THR 13 HG23 THR 13 -3.846 -7.780 0.171 80 H GLY 14 HN GLY 14 1.268 -8.378 0.148 81 HA2 GLY 14 HA2 GLY 14 3.332 -8.308 -1.021 82 HA3 GLY 14 HA1 GLY 14 2.487 -8.789 -2.488 83 H LYS 15 HN LYS 15 0.583 -6.561 -1.055 84 HA LYS 15 HA LYS 15 1.510 -4.458 -2.847 85 HB2 LYS 15 HB2 LYS 15 -0.995 -4.742 -1.180 86 HB3 LYS 15 HB1 LYS 15 -0.636 -3.339 -2.174 87 HG2 LYS 15 HG2 LYS 15 -0.677 -4.711 -4.169 88 HG3 LYS 15 HG1 LYS 15 -0.961 -6.153 -3.193 89 HD2 LYS 15 HD2 LYS 15 -3.094 -5.318 -2.477 90 HD3 LYS 15 HD1 LYS 15 -2.794 -3.761 -3.248 91 HE2 LYS 15 HE2 LYS 15 -4.311 -5.134 -4.580 92 HE3 LYS 15 HE1 LYS 15 -2.802 -4.832 -5.435 93 HZ1 LYS 15 HZ1 LYS 15 -3.543 -7.137 -5.629 94 HZ2 LYS 15 HZ2 LYS 15 -3.451 -7.320 -3.956 95 HZ3 LYS 15 HZ3 LYS 15 -2.048 -7.034 -4.852 96 H LEU 16 HN LEU 16 3.374 -3.795 -1.683 97 HA LEU 16 HA LEU 16 2.890 -2.524 0.886 98 HB2 LEU 16 HB2 LEU 16 5.400 -3.117 -0.663 99 HB3 LEU 16 HB1 LEU 16 5.398 -2.078 0.741 100 HG LEU 16 HG LEU 16 4.469 -3.988 2.066 101 HD11 LEU 16 HD11 LEU 16 4.707 -6.232 1.136 102 HD12 LEU 16 HD12 LEU 16 5.121 -5.527 -0.428 103 HD13 LEU 16 HD13 LEU 16 3.519 -5.260 0.264 104 HD21 LEU 16 HD21 LEU 16 6.823 -3.432 2.176 105 HD22 LEU 16 HD22 LEU 16 7.139 -4.397 0.735 106 HD23 LEU 16 HD23 LEU 16 6.608 -5.182 2.222 107 H ALA 17 HN ALA 17 3.344 -0.296 1.216 108 HA ALA 17 HA ALA 17 4.110 1.355 -1.011 109 HB1 ALA 17 HB1 ALA 17 2.045 2.712 -1.019 110 HB2 ALA 17 HB2 ALA 17 1.296 1.533 0.063 111 HB3 ALA 17 HB3 ALA 17 1.775 1.055 -1.565 112 H CYS 18 HN CYS 18 4.866 3.324 -0.378 113 HA CYS 18 HA CYS 18 5.165 3.830 2.447 114 HB2 CYS 18 HB2 CYS 18 6.221 4.953 -0.072 115 HB3 CYS 18 HB1 CYS 18 6.049 6.105 1.244 116 H CYS 19 HN CYS 19 3.296 4.382 3.424 117 HA CYS 19 HA CYS 19 1.591 6.362 2.070 118 HB2 CYS 19 HB2 CYS 19 0.808 4.197 4.026 119 HB3 CYS 19 HB1 CYS 19 -0.293 5.366 3.311 120 H ASP 20 HN ASP 20 0.389 7.832 3.472 121 HA ASP 20 HA ASP 20 1.782 8.321 6.009 122 HB2 ASP 20 HB2 ASP 20 0.651 10.159 3.985 123 HB3 ASP 20 HB1 ASP 20 0.308 10.585 5.654 124 H THR 21 HN THR 21 0.747 7.698 7.752 125 HA THR 21 HA THR 21 -1.967 6.803 7.567 126 HB THR 21 HB THR 21 -1.635 6.306 10.029 127 HG1 THR 21 HG1 THR 21 0.002 7.698 10.606 128 HG21 THR 21 HG21 THR 21 0.382 5.169 8.085 129 HG22 THR 21 HG22 THR 21 -1.285 4.625 8.278 130 HG23 THR 21 HG23 THR 21 -0.134 4.419 9.597 131 H ASN 22 HN ASN 22 -0.556 9.776 8.164 132 HA ASN 22 HA ASN 22 -2.756 10.766 9.814 133 HB2 ASN 22 HB2 ASN 22 -1.491 12.799 9.995 134 HB3 ASN 22 HB1 ASN 22 -0.368 11.468 10.210 135 HD21 ASN 22 HD21 ASN 22 -1.288 14.126 8.218 136 HD22 ASN 22 HD22 ASN 22 0.067 14.055 7.148 137 H LYS 23 HN LYS 23 -1.811 10.332 6.664 138 HA LYS 23 HA LYS 23 -3.550 12.430 5.587 139 HB2 LYS 23 HB2 LYS 23 -1.355 10.747 4.389 140 HB3 LYS 23 HB1 LYS 23 -2.420 11.721 3.413 141 HG2 LYS 23 HG2 LYS 23 -1.685 13.705 4.687 142 HG3 LYS 23 HG1 LYS 23 -0.501 12.691 5.506 143 HD2 LYS 23 HD2 LYS 23 0.630 13.778 3.729 144 HD3 LYS 23 HD1 LYS 23 0.366 12.113 3.202 145 HE2 LYS 23 HE2 LYS 23 -0.184 13.538 1.371 146 HE3 LYS 23 HE1 LYS 23 -1.686 12.900 2.032 147 HZ1 LYS 23 HZ1 LYS 23 -1.771 15.293 1.512 148 HZ2 LYS 23 HZ2 LYS 23 -0.601 15.573 2.699 149 HZ3 LYS 23 HZ3 LYS 23 -2.112 14.952 3.132 150 H LYS 24 HN LYS 24 -5.568 11.793 5.298 151 HA LYS 24 HA LYS 24 -6.087 9.004 4.583 152 HB2 LYS 24 HB2 LYS 24 -7.803 11.159 5.772 153 HB3 LYS 24 HB1 LYS 24 -8.462 9.634 5.201 154 HG2 LYS 24 HG2 LYS 24 -8.220 9.358 7.494 155 HG3 LYS 24 HG1 LYS 24 -6.835 8.521 6.807 156 HD2 LYS 24 HD2 LYS 24 -5.467 10.548 7.257 157 HD3 LYS 24 HD1 LYS 24 -6.866 11.264 8.060 158 HE2 LYS 24 HE2 LYS 24 -5.443 8.727 8.864 159 HE3 LYS 24 HE1 LYS 24 -5.350 10.280 9.688 160 HZ1 LYS 24 HZ1 LYS 24 -7.819 8.662 9.373 161 HZ2 LYS 24 HZ2 LYS 24 -7.685 10.122 10.221 162 HZ3 LYS 24 HZ3 LYS 24 -6.880 8.743 10.777 163 H VAL 25 HN VAL 25 -7.860 8.597 3.063 164 HA VAL 25 HA VAL 25 -8.093 10.686 0.986 165 HB VAL 25 HB VAL 25 -8.385 7.709 0.553 166 HG11 VAL 25 HG11 VAL 25 -8.263 8.242 -1.808 167 HG12 VAL 25 HG12 VAL 25 -8.075 9.952 -1.430 168 HG13 VAL 25 HG13 VAL 25 -9.585 9.127 -1.048 169 HG21 VAL 25 HG21 VAL 25 -6.079 8.218 1.180 170 HG22 VAL 25 HG22 VAL 25 -5.996 9.453 -0.081 171 HG23 VAL 25 HG23 VAL 25 -6.192 7.753 -0.517 172 H GLN 26 HN GLN 26 -10.171 10.852 -0.043 173 HA GLN 26 HA GLN 26 -12.240 10.635 1.951 174 HB2 GLN 26 HB2 GLN 26 -12.144 11.956 -0.754 175 HB3 GLN 26 HB1 GLN 26 -13.525 12.022 0.323 176 HG2 GLN 26 HG2 GLN 26 -12.234 13.183 1.991 177 HG3 GLN 26 HG1 GLN 26 -10.774 13.012 1.019 178 HE21 GLN 26 HE21 GLN 26 -10.455 15.228 0.941 179 HE22 GLN 26 HE22 GLN 26 -11.440 16.263 -0.033 180 H LYS 27 HN LYS 27 -11.314 8.865 -0.818 181 HA LYS 27 HA LYS 27 -13.963 7.580 -0.905 182 HB2 LYS 27 HB2 LYS 27 -11.854 7.692 -3.061 183 HB3 LYS 27 HB1 LYS 27 -13.379 6.825 -3.175 184 HG2 LYS 27 HG2 LYS 27 -14.436 9.139 -2.664 185 HG3 LYS 27 HG1 LYS 27 -12.872 9.763 -3.189 186 HD2 LYS 27 HD2 LYS 27 -14.677 7.953 -4.773 187 HD3 LYS 27 HD1 LYS 27 -14.476 9.686 -5.034 188 HE2 LYS 27 HE2 LYS 27 -12.318 7.592 -5.302 189 HE3 LYS 27 HE1 LYS 27 -13.176 8.360 -6.635 190 HZ1 LYS 27 HZ1 LYS 27 -12.253 10.483 -5.980 191 HZ2 LYS 27 HZ2 LYS 27 -11.012 9.365 -6.242 192 HZ3 LYS 27 HZ3 LYS 27 -11.458 9.770 -4.665 193 H SER 28 HN SER 28 -13.975 5.251 -1.209 194 HA SER 28 HA SER 28 -11.555 3.979 -0.113 195 HB2 SER 28 HB2 SER 28 -13.139 2.349 0.982 196 HB3 SER 28 HB1 SER 28 -13.226 3.994 1.611 197 HG SER 28 HG SER 28 -15.085 2.542 0.134 198 H THR 29 HN THR 29 -12.944 4.308 -2.906 199 HA THR 29 HA THR 29 -13.487 1.631 -3.732 200 HB THR 29 HB THR 29 -13.209 2.676 -6.069 201 HG1 THR 29 HG1 THR 29 -11.985 4.524 -5.076 202 HG21 THR 29 HG21 THR 29 -15.264 3.787 -4.156 203 HG22 THR 29 HG22 THR 29 -15.388 2.275 -5.053 204 HG23 THR 29 HG23 THR 29 -15.386 3.815 -5.914 205 H GLY 30 HN GLY 30 -12.188 0.205 -4.872 206 HA2 GLY 30 HA2 GLY 30 -9.364 0.962 -5.180 207 HA3 GLY 30 HA1 GLY 30 -9.778 -0.482 -4.273 208 H GLU 31 HN GLU 31 -8.114 -0.695 -6.376 209 HA GLU 31 HA GLU 31 -9.537 -1.244 -8.823 210 HB2 GLU 31 HB2 GLU 31 -6.640 -1.671 -8.084 211 HB3 GLU 31 HB1 GLU 31 -7.311 -1.815 -9.703 212 HG2 GLU 31 HG2 GLU 31 -7.312 0.695 -8.047 213 HG3 GLU 31 HG1 GLU 31 -6.158 0.322 -9.327 214 H GLU 32 HN GLU 32 -7.771 -3.125 -6.386 215 HA GLU 32 HA GLU 32 -8.581 -5.590 -7.719 216 HB2 GLU 32 HB2 GLU 32 -6.590 -4.988 -5.548 217 HB3 GLU 32 HB1 GLU 32 -7.078 -6.634 -5.931 218 HG2 GLU 32 HG2 GLU 32 -5.866 -4.699 -7.891 219 HG3 GLU 32 HG1 GLU 32 -4.982 -5.961 -7.031 220 H SER 33 HN SER 33 -9.128 -3.750 -4.805 221 HA SER 33 HA SER 33 -10.364 -5.750 -3.262 222 HB2 SER 33 HB2 SER 33 -11.445 -3.787 -2.077 223 HB3 SER 33 HB1 SER 33 -9.684 -3.744 -2.171 224 HG SER 33 HG SER 33 -9.790 -2.207 -3.740 225 H GLY 34 HN GLY 34 -11.515 -3.910 -5.954 226 HA2 GLY 34 HA2 GLY 34 -14.281 -4.159 -5.621 227 HA3 GLY 34 HA1 GLY 34 -13.455 -4.078 -7.170 228 H LEU 35 HN LEU 35 -11.929 -6.411 -6.990 229 HA LEU 35 HA LEU 35 -14.013 -8.370 -7.520 230 HB2 LEU 35 HB2 LEU 35 -11.030 -8.539 -7.978 231 HB3 LEU 35 HB1 LEU 35 -12.209 -9.722 -8.503 232 HG LEU 35 HG LEU 35 -13.243 -7.757 -9.849 233 HD11 LEU 35 HD11 LEU 35 -10.450 -6.717 -9.398 234 HD12 LEU 35 HD12 LEU 35 -11.948 -5.962 -8.854 235 HD13 LEU 35 HD13 LEU 35 -11.600 -6.091 -10.578 236 HD21 LEU 35 HD21 LEU 35 -10.603 -8.989 -10.619 237 HD22 LEU 35 HD22 LEU 35 -11.749 -8.236 -11.729 238 HD23 LEU 35 HD23 LEU 35 -12.199 -9.702 -10.856 239 H LEU 36 HN LEU 36 -11.478 -7.707 -5.250 240 HA LEU 36 HA LEU 36 -11.273 -10.311 -4.122 241 HB2 LEU 36 HB2 LEU 36 -9.593 -8.419 -3.959 242 HB3 LEU 36 HB1 LEU 36 -10.653 -7.696 -2.765 243 HG LEU 36 HG LEU 36 -10.391 -9.738 -1.364 244 HD11 LEU 36 HD11 LEU 36 -9.820 -11.330 -3.106 245 HD12 LEU 36 HD12 LEU 36 -8.546 -11.270 -1.891 246 HD13 LEU 36 HD13 LEU 36 -8.325 -10.457 -3.440 247 HD21 LEU 36 HD21 LEU 36 -8.115 -9.218 -0.631 248 HD22 LEU 36 HD22 LEU 36 -9.049 -7.755 -0.944 249 HD23 LEU 36 HD23 LEU 36 -7.851 -8.305 -2.114 250 H HIS 37 HN HIS 37 -12.483 -11.281 -2.591 251 HA HIS 37 HA HIS 37 -15.046 -10.181 -2.011 252 HB2 HIS 37 HB2 HIS 37 -14.628 -12.611 -2.339 253 HB3 HIS 37 HB1 HIS 37 -13.742 -12.638 -0.820 254 HD1 HIS 37 HD1 HIS 37 -17.237 -12.186 -2.173 255 HD2 HIS 37 HD2 HIS 37 -15.302 -12.846 1.446 256 HE1 HIS 37 HE1 HIS 37 -19.056 -12.697 -0.515 257 HE2 HIS 37 HE2 HIS 37 -17.852 -13.225 1.631 258 H THR 38 HN THR 38 -12.017 -10.255 -0.319 259 HA THR 38 HA THR 38 -13.148 -9.479 2.217 260 HB THR 38 HB THR 38 -10.258 -9.245 1.345 261 HG1 THR 38 HG1 THR 38 -11.504 -11.462 2.639 262 HG21 THR 38 HG21 THR 38 -10.762 -8.103 3.432 263 HG22 THR 38 HG22 THR 38 -9.817 -9.555 3.759 264 HG23 THR 38 HG23 THR 38 -11.555 -9.548 4.058 265 H GLY 39 HN GLY 39 -12.229 -7.915 -0.681 266 HA2 GLY 39 HA2 GLY 39 -12.080 -5.283 0.585 267 HA3 GLY 39 HA1 GLY 39 -11.792 -5.638 -1.115 268 H ASP 40 HN ASP 40 -14.498 -7.172 0.151 269 HA ASP 40 HA ASP 40 -16.302 -5.742 -1.543 270 HB2 ASP 40 HB2 ASP 40 -16.265 -8.250 -0.529 271 HB3 ASP 40 HB1 ASP 40 -17.373 -7.485 0.598 272 H VAL 41 HN VAL 41 -15.368 -5.649 1.772 273 HA VAL 41 HA VAL 41 -17.545 -4.303 2.915 274 HB VAL 41 HB VAL 41 -15.779 -3.452 4.575 275 HG11 VAL 41 HG11 VAL 41 -15.551 -5.681 5.580 276 HG12 VAL 41 HG12 VAL 41 -16.040 -6.420 4.056 277 HG13 VAL 41 HG13 VAL 41 -17.182 -5.425 4.961 278 HG21 VAL 41 HG21 VAL 41 -13.613 -4.534 4.489 279 HG22 VAL 41 HG22 VAL 41 -13.880 -3.605 3.014 280 HG23 VAL 41 HG23 VAL 41 -14.054 -5.359 2.993 281 H LEU 42 HN LEU 42 -17.918 -2.139 3.391 282 HA LEU 42 HA LEU 42 -16.682 -0.234 1.570 283 HB2 LEU 42 HB2 LEU 42 -19.168 -0.188 3.245 284 HB3 LEU 42 HB1 LEU 42 -18.581 1.206 2.382 285 HG LEU 42 HG LEU 42 -19.432 -1.394 1.117 286 HD11 LEU 42 HD11 LEU 42 -21.309 -0.150 2.052 287 HD12 LEU 42 HD12 LEU 42 -21.340 -0.115 0.290 288 HD13 LEU 42 HD13 LEU 42 -20.789 1.298 1.190 289 HD21 LEU 42 HD21 LEU 42 -19.259 -0.144 -0.995 290 HD22 LEU 42 HD22 LEU 42 -17.702 -0.302 -0.185 291 HD23 LEU 42 HD23 LEU 42 -18.581 1.226 -0.116 292 H ASP 43 HN ASP 43 -16.350 -1.313 4.693 293 HA ASP 43 HA ASP 43 -15.847 1.268 5.906 294 HB2 ASP 43 HB2 ASP 43 -15.406 0.011 7.965 295 HB3 ASP 43 HB1 ASP 43 -16.944 -0.456 7.251 296 H GLN 44 HN GLN 44 -14.111 -0.666 3.910 297 HA GLN 44 HA GLN 44 -11.548 -0.846 4.779 298 HB2 GLN 44 HB2 GLN 44 -12.197 0.375 2.111 299 HB3 GLN 44 HB1 GLN 44 -10.805 -0.597 2.535 300 HG2 GLN 44 HG2 GLN 44 -12.235 -2.551 2.799 301 HG3 GLN 44 HG1 GLN 44 -13.641 -1.577 2.368 302 HE21 GLN 44 HE21 GLN 44 -10.831 -3.229 1.221 303 HE22 GLN 44 HE22 GLN 44 -11.156 -3.029 -0.467 304 H VAL 45 HN VAL 45 -9.826 0.509 5.110 305 HA VAL 45 HA VAL 45 -10.466 3.371 5.267 306 HB VAL 45 HB VAL 45 -8.284 1.850 6.710 307 HG11 VAL 45 HG11 VAL 45 -9.228 4.700 6.990 308 HG12 VAL 45 HG12 VAL 45 -7.681 4.168 6.333 309 HG13 VAL 45 HG13 VAL 45 -8.052 3.908 8.036 310 HG21 VAL 45 HG21 VAL 45 -10.923 2.892 7.730 311 HG22 VAL 45 HG22 VAL 45 -9.646 2.195 8.726 312 HG23 VAL 45 HG23 VAL 45 -10.475 1.199 7.530 313 H ALA 46 HN ALA 46 -9.650 4.568 3.734 314 HA ALA 46 HA ALA 46 -7.254 3.642 2.310 315 HB1 ALA 46 HB1 ALA 46 -9.375 5.599 1.444 316 HB2 ALA 46 HB2 ALA 46 -9.248 3.916 0.937 317 HB3 ALA 46 HB3 ALA 46 -7.996 5.072 0.477 318 H ILE 47 HN ILE 47 -5.433 4.593 2.877 319 HA ILE 47 HA ILE 47 -5.524 7.405 3.713 320 HB ILE 47 HB ILE 47 -3.160 7.004 4.526 321 HG12 ILE 47 HG12 ILE 47 -3.981 4.106 4.235 322 HG13 ILE 47 HG11 ILE 47 -2.732 4.917 3.294 323 HG21 ILE 47 HG21 ILE 47 -3.894 6.042 6.638 324 HG22 ILE 47 HG22 ILE 47 -5.380 5.475 5.870 325 HG23 ILE 47 HG23 ILE 47 -5.070 7.205 6.019 326 HD11 ILE 47 HD11 ILE 47 -1.715 3.603 5.029 327 HD12 ILE 47 HD12 ILE 47 -2.701 4.396 6.257 328 HD13 ILE 47 HD13 ILE 47 -1.477 5.315 5.381 329 H GLN 48 HN GLN 48 -3.982 8.861 2.892 330 HA GLN 48 HA GLN 48 -3.636 8.515 0.055 331 HB2 GLN 48 HB2 GLN 48 -4.265 10.676 1.351 332 HB3 GLN 48 HB1 GLN 48 -2.538 10.807 1.661 333 HG2 GLN 48 HG2 GLN 48 -2.650 12.021 -0.245 334 HG3 GLN 48 HG1 GLN 48 -2.417 10.416 -0.928 335 HE21 GLN 48 HE21 GLN 48 -3.375 10.962 -2.862 336 HE22 GLN 48 HE22 GLN 48 -5.085 11.179 -3.011 337 H CYS 49 HN CYS 49 -1.967 7.607 -0.819 338 HA CYS 49 HA CYS 49 0.467 7.267 0.791 339 HB2 CYS 49 HB2 CYS 49 -1.110 5.311 -0.034 340 HB3 CYS 49 HB1 CYS 49 -0.224 5.528 -1.530 341 H THR 50 HN THR 50 2.464 6.883 -0.636 342 HA THR 50 HA THR 50 2.452 8.092 -3.227 343 HB THR 50 HB THR 50 2.423 10.151 -1.943 344 HG1 THR 50 HG1 THR 50 3.743 10.204 -3.779 345 HG21 THR 50 HG21 THR 50 4.202 10.710 -0.366 346 HG22 THR 50 HG22 THR 50 4.896 9.102 -0.573 347 HG23 THR 50 HG23 THR 50 3.305 9.287 0.164 348 H GLN 51 HN GLN 51 3.980 7.237 -4.424 349 HA GLN 51 HA GLN 51 6.161 5.857 -3.029 350 HB2 GLN 51 HB2 GLN 51 4.392 4.365 -3.948 351 HB3 GLN 51 HB1 GLN 51 4.789 4.960 -5.554 352 HG2 GLN 51 HG2 GLN 51 5.857 2.808 -5.086 353 HG3 GLN 51 HG1 GLN 51 7.024 4.096 -5.378 354 HE21 GLN 51 HE21 GLN 51 8.652 2.943 -4.302 355 HE22 GLN 51 HE22 GLN 51 8.686 2.811 -2.579 356 H ILE 52 HN ILE 52 7.966 6.882 -3.402 357 HA ILE 52 HA ILE 52 8.643 8.536 -5.524 358 HB ILE 52 HB ILE 52 10.379 6.781 -3.778 359 HG12 ILE 52 HG12 ILE 52 9.687 9.722 -3.671 360 HG13 ILE 52 HG11 ILE 52 9.119 8.476 -2.566 361 HG21 ILE 52 HG21 ILE 52 11.250 9.026 -5.598 362 HG22 ILE 52 HG22 ILE 52 11.580 7.312 -5.842 363 HG23 ILE 52 HG23 ILE 52 12.279 8.156 -4.461 364 HD11 ILE 52 HD11 ILE 52 11.395 8.135 -1.777 365 HD12 ILE 52 HD12 ILE 52 10.892 9.813 -1.581 366 HD13 ILE 52 HD13 ILE 52 11.972 9.363 -2.900 367 HA PRO 53 HA PRO 53 8.611 6.117 -9.209 368 HB2 PRO 53 HB2 PRO 53 11.196 7.080 -10.028 369 HB3 PRO 53 HB1 PRO 53 9.608 7.562 -10.621 370 HG2 PRO 53 HG2 PRO 53 11.338 8.857 -8.617 371 HG3 PRO 53 HG1 PRO 53 10.048 9.556 -9.612 372 HD2 PRO 53 HD2 PRO 53 9.754 9.173 -6.965 373 HD3 PRO 53 HD1 PRO 53 8.395 8.973 -8.093 374 H LEU 54 HN LEU 54 8.845 4.024 -8.728 375 HA LEU 54 HA LEU 54 11.052 2.991 -7.320 376 HB2 LEU 54 HB2 LEU 54 9.983 0.807 -7.665 377 HB3 LEU 54 HB1 LEU 54 8.878 2.020 -7.057 378 HG LEU 54 HG LEU 54 8.327 2.262 -9.662 379 HD11 LEU 54 HD11 LEU 54 9.156 -0.620 -9.353 380 HD12 LEU 54 HD12 LEU 54 9.944 0.583 -10.373 381 HD13 LEU 54 HD13 LEU 54 8.295 0.068 -10.730 382 HD21 LEU 54 HD21 LEU 54 7.223 0.122 -7.849 383 HD22 LEU 54 HD22 LEU 54 6.431 0.766 -9.287 384 HD23 LEU 54 HD23 LEU 54 6.716 1.810 -7.894 385 H LEU 55 HN LEU 55 12.869 2.100 -7.926 386 HA LEU 55 HA LEU 55 13.416 1.674 -10.763 387 HB2 LEU 55 HB2 LEU 55 15.189 1.390 -8.333 388 HB3 LEU 55 HB1 LEU 55 15.715 1.263 -10.000 389 HG LEU 55 HG LEU 55 14.585 3.752 -8.727 390 HD11 LEU 55 HD11 LEU 55 17.417 3.069 -9.492 391 HD12 LEU 55 HD12 LEU 55 16.790 3.159 -7.847 392 HD13 LEU 55 HD13 LEU 55 16.854 4.611 -8.844 393 HD21 LEU 55 HD21 LEU 55 15.371 4.839 -10.793 394 HD22 LEU 55 HD22 LEU 55 14.095 3.662 -11.088 395 HD23 LEU 55 HD23 LEU 55 15.769 3.254 -11.452 396 H ILE 56 HN ILE 56 13.625 -0.331 -11.669 397 HA ILE 56 HA ILE 56 12.375 -2.490 -10.328 398 HB ILE 56 HB ILE 56 14.070 -2.709 -12.802 399 HG12 ILE 56 HG12 ILE 56 11.117 -2.071 -12.589 400 HG13 ILE 56 HG11 ILE 56 12.367 -0.923 -13.055 401 HG21 ILE 56 HG21 ILE 56 11.775 -4.372 -11.781 402 HG22 ILE 56 HG22 ILE 56 13.479 -4.829 -11.760 403 HG23 ILE 56 HG23 ILE 56 12.637 -4.629 -13.298 404 HD11 ILE 56 HD11 ILE 56 11.601 -3.409 -14.568 405 HD12 ILE 56 HD12 ILE 56 12.847 -2.252 -15.040 406 HD13 ILE 56 HD13 ILE 56 11.156 -1.755 -14.986 407 H GLY 57 HN GLY 57 13.169 -4.068 -9.166 408 HA2 GLY 57 HA2 GLY 57 14.835 -5.599 -8.442 409 HA3 GLY 57 HA1 GLY 57 16.066 -4.498 -9.046 410 H ILE 58 HN ILE 58 14.248 -2.337 -7.688 411 HA ILE 58 HA ILE 58 15.806 -2.392 -5.236 412 HB ILE 58 HB ILE 58 14.736 -0.312 -6.927 413 HG12 ILE 58 HG12 ILE 58 17.103 -0.629 -6.298 414 HG13 ILE 58 HG11 ILE 58 16.521 0.988 -5.917 415 HG21 ILE 58 HG21 ILE 58 14.209 -0.017 -3.978 416 HG22 ILE 58 HG22 ILE 58 13.018 0.009 -5.282 417 HG23 ILE 58 HG23 ILE 58 14.194 1.316 -5.140 418 HD11 ILE 58 HD11 ILE 58 17.926 0.098 -4.142 419 HD12 ILE 58 HD12 ILE 58 16.836 -1.275 -3.953 420 HD13 ILE 58 HD13 ILE 58 16.275 0.353 -3.577 421 H ALA 59 HN ALA 59 14.951 -1.982 -3.225 422 HA ALA 59 HA ALA 59 12.432 -3.334 -2.725 423 HB1 ALA 59 HB1 ALA 59 14.307 -4.035 -1.433 424 HB2 ALA 59 HB2 ALA 59 13.210 -3.164 -0.353 425 HB3 ALA 59 HB3 ALA 59 14.668 -2.373 -0.968 426 H ILE 60 HN ILE 60 10.702 -2.450 -1.710 427 HA ILE 60 HA ILE 60 9.951 0.201 -1.881 428 HB ILE 60 HB ILE 60 8.386 -1.586 -1.336 429 HG12 ILE 60 HG12 ILE 60 7.232 -0.518 0.696 430 HG13 ILE 60 HG11 ILE 60 8.565 0.633 0.691 431 HG21 ILE 60 HG21 ILE 60 9.687 -3.019 0.033 432 HG22 ILE 60 HG22 ILE 60 8.298 -2.504 0.991 433 HG23 ILE 60 HG23 ILE 60 9.881 -1.772 1.267 434 HD11 ILE 60 HD11 ILE 60 6.630 1.513 -0.470 435 HD12 ILE 60 HD12 ILE 60 6.653 0.138 -1.575 436 HD13 ILE 60 HD13 ILE 60 7.984 1.295 -1.577 437 H GLU 61 HN GLU 61 11.623 -1.422 0.765 438 HA GLU 61 HA GLU 61 11.548 0.724 2.601 439 HB2 GLU 61 HB2 GLU 61 13.143 -1.811 2.383 440 HB3 GLU 61 HB1 GLU 61 13.389 -0.679 3.701 441 HG2 GLU 61 HG2 GLU 61 10.731 -1.898 3.041 442 HG3 GLU 61 HG1 GLU 61 11.864 -2.591 4.200 443 H ASP 62 HN ASP 62 13.476 0.152 -0.145 444 HA ASP 62 HA ASP 62 15.570 1.969 0.839 445 HB2 ASP 62 HB2 ASP 62 15.635 -0.214 -1.231 446 HB3 ASP 62 HB1 ASP 62 16.890 1.019 -1.142 447 H GLU 63 HN GLU 63 12.915 1.800 -1.176 448 HA GLU 63 HA GLU 63 13.962 3.663 -3.155 449 HB2 GLU 63 HB2 GLU 63 12.502 1.691 -3.774 450 HB3 GLU 63 HB1 GLU 63 11.179 2.510 -2.962 451 HG2 GLU 63 HG2 GLU 63 11.101 2.862 -5.360 452 HG3 GLU 63 HG1 GLU 63 11.361 4.369 -4.490 453 H CYS 64 HN CYS 64 11.667 3.498 -0.512 454 HA CYS 64 HA CYS 64 11.215 6.383 -0.796 455 HB2 CYS 64 HB2 CYS 64 8.843 6.066 -0.416 456 HB3 CYS 64 HB1 CYS 64 9.345 5.061 -1.770 457 H LYS 65 HN LYS 65 10.862 7.504 1.167 458 HA LYS 65 HA LYS 65 11.395 5.884 3.560 459 HB2 LYS 65 HB2 LYS 65 13.351 7.260 2.817 460 HB3 LYS 65 HB1 LYS 65 12.386 8.701 3.104 461 HG2 LYS 65 HG2 LYS 65 13.938 8.176 4.951 462 HG3 LYS 65 HG1 LYS 65 12.246 8.206 5.453 463 HD2 LYS 65 HD2 LYS 65 12.160 5.772 5.356 464 HD3 LYS 65 HD1 LYS 65 13.832 5.721 4.799 465 HE2 LYS 65 HE2 LYS 65 12.927 6.855 7.441 466 HE3 LYS 65 HE1 LYS 65 13.570 5.232 7.214 467 HZ1 LYS 65 HZ1 LYS 65 15.029 7.750 6.632 468 HZ2 LYS 65 HZ2 LYS 65 15.646 6.184 6.458 469 HZ3 LYS 65 HZ3 LYS 65 15.257 6.777 7.994 470 H ASN 66 HN ASN 66 8.934 5.989 3.265 471 HA ASN 66 HA ASN 66 8.008 8.068 5.139 472 HB2 ASN 66 HB2 ASN 66 6.390 6.688 2.974 473 HB3 ASN 66 HB1 ASN 66 5.720 7.761 4.193 474 HD21 ASN 66 HD21 ASN 66 7.646 7.551 1.313 475 HD22 ASN 66 HD22 ASN 66 7.635 9.235 0.937 476 H THR 67 HN THR 67 5.491 6.626 5.623 477 HA THR 67 HA THR 67 6.594 4.430 7.156 478 HB THR 67 HB THR 67 3.683 5.229 6.963 479 HG1 THR 67 HG1 THR 67 5.035 6.926 7.820 480 HG21 THR 67 HG21 THR 67 3.730 4.051 9.247 481 HG22 THR 67 HG22 THR 67 5.291 3.394 8.723 482 HG23 THR 67 HG23 THR 67 3.828 3.039 7.805 483 HA PRO 68 HA PRO 68 5.665 1.642 3.837 484 HB2 PRO 68 HB2 PRO 68 6.830 -0.531 4.964 485 HB3 PRO 68 HB1 PRO 68 7.754 0.762 4.200 486 HG2 PRO 68 HG2 PRO 68 7.374 0.159 7.071 487 HG3 PRO 68 HG1 PRO 68 8.741 0.933 6.245 488 HD2 PRO 68 HD2 PRO 68 6.698 2.213 7.700 489 HD3 PRO 68 HD1 PRO 68 7.879 2.992 6.646 490 H THR 69 HN THR 69 3.850 0.521 3.501 491 HA THR 69 HA THR 69 2.532 -0.692 5.831 492 HB THR 69 HB THR 69 0.364 0.143 5.012 493 HG1 THR 69 HG1 THR 69 1.955 1.566 3.107 494 HG21 THR 69 HG21 THR 69 1.513 1.502 6.677 495 HG22 THR 69 HG22 THR 69 0.665 2.540 5.530 496 HG23 THR 69 HG23 THR 69 2.411 2.333 5.405 497 H CYS 70 HN CYS 70 1.135 -2.434 5.377 498 HA CYS 70 HA CYS 70 1.379 -3.601 2.687 499 HB2 CYS 70 HB2 CYS 70 2.018 -5.163 4.407 500 HB3 CYS 70 HB1 CYS 70 0.570 -4.810 5.342 501 H CYS 71 HN CYS 71 -0.213 -3.022 1.386 502 HA CYS 71 HA CYS 71 -2.775 -2.210 2.528 503 HB2 CYS 71 HB2 CYS 71 -1.814 -1.955 -0.328 504 HB3 CYS 71 HB1 CYS 71 -3.213 -1.173 0.391 505 H GLU 72 HN GLU 72 -4.701 -3.099 1.964 506 HA GLU 72 HA GLU 72 -4.677 -5.797 0.997 507 HB2 GLU 72 HB2 GLU 72 -6.249 -5.640 2.636 508 HB3 GLU 72 HB1 GLU 72 -6.559 -3.940 2.332 509 HG2 GLU 72 HG2 GLU 72 -7.954 -4.500 0.460 510 HG3 GLU 72 HG1 GLU 72 -7.592 -6.212 0.666 511 H ASP 73 HN ASP 73 -5.072 -2.651 -0.248 512 HA ASP 73 HA ASP 73 -4.978 -3.553 -2.937 513 HB2 ASP 73 HB2 ASP 73 -7.415 -3.874 -2.451 514 HB3 ASP 73 HB1 ASP 73 -7.529 -2.149 -2.128 515 H VAL 74 HN VAL 74 -4.690 -1.712 -4.419 516 HA VAL 74 HA VAL 74 -4.492 0.912 -3.145 517 HB VAL 74 HB VAL 74 -2.170 0.200 -4.880 518 HG11 VAL 74 HG11 VAL 74 -1.042 1.827 -3.521 519 HG12 VAL 74 HG12 VAL 74 -2.398 1.882 -2.397 520 HG13 VAL 74 HG13 VAL 74 -2.595 2.482 -4.043 521 HG21 VAL 74 HG21 VAL 74 -0.857 -0.637 -3.012 522 HG22 VAL 74 HG22 VAL 74 -2.246 -1.686 -3.303 523 HG23 VAL 74 HG23 VAL 74 -2.268 -0.545 -1.956 524 H GLU 75 HN GLU 75 -5.060 2.538 -4.482 525 HA GLU 75 HA GLU 75 -5.700 1.837 -7.266 526 HB2 GLU 75 HB2 GLU 75 -7.588 2.598 -5.896 527 HB3 GLU 75 HB1 GLU 75 -6.729 4.081 -5.516 528 HG2 GLU 75 HG2 GLU 75 -6.769 4.665 -7.919 529 HG3 GLU 75 HG1 GLU 75 -7.750 3.230 -8.211 530 H ASP 76 HN ASP 76 -5.346 3.462 -8.922 531 HA ASP 76 HA ASP 76 -4.121 4.966 -10.107 532 HB2 ASP 76 HB2 ASP 76 -4.784 6.419 -8.027 533 HB3 ASP 76 HB1 ASP 76 -3.096 6.220 -7.577 534 H ASP 77 HN ASP 77 -1.558 6.140 -9.169 535 HA ASP 77 HA ASP 77 0.159 3.883 -9.646 536 HB2 ASP 77 HB2 ASP 77 0.707 6.782 -9.040 537 HB3 ASP 77 HB1 ASP 77 2.002 5.596 -9.146 538 H GLY 78 HN GLY 78 -1.564 4.361 -7.101 539 HA2 GLY 78 HA2 GLY 78 -1.129 3.052 -5.133 540 HA3 GLY 78 HA1 GLY 78 0.554 3.526 -5.238 541 H LEU 79 HN LEU 79 -1.946 5.874 -5.779 542 HA LEU 79 HA LEU 79 -0.932 7.425 -3.558 543 HB2 LEU 79 HB2 LEU 79 -3.233 8.117 -5.374 544 HB3 LEU 79 HB1 LEU 79 -2.311 9.211 -4.362 545 HG LEU 79 HG LEU 79 -1.394 7.823 -6.879 546 HD11 LEU 79 HD11 LEU 79 -1.109 10.107 -7.698 547 HD12 LEU 79 HD12 LEU 79 -1.723 10.733 -6.169 548 HD13 LEU 79 HD13 LEU 79 -2.778 9.792 -7.223 549 HD21 LEU 79 HD21 LEU 79 0.443 7.795 -5.304 550 HD22 LEU 79 HD22 LEU 79 0.200 9.504 -4.950 551 HD23 LEU 79 HD23 LEU 79 0.744 9.006 -6.551 552 H VAL 80 HN VAL 80 -3.619 5.381 -4.196 553 HA VAL 80 HA VAL 80 -4.791 6.184 -1.616 554 HB VAL 80 HB VAL 80 -6.300 5.142 -4.019 555 HG11 VAL 80 HG11 VAL 80 -8.308 5.631 -2.703 556 HG12 VAL 80 HG12 VAL 80 -7.293 6.085 -1.335 557 HG13 VAL 80 HG13 VAL 80 -7.292 4.421 -1.918 558 HG21 VAL 80 HG21 VAL 80 -7.304 7.377 -4.114 559 HG22 VAL 80 HG22 VAL 80 -5.561 7.430 -4.373 560 HG23 VAL 80 HG23 VAL 80 -6.236 7.905 -2.814 561 H GLY 81 HN GLY 81 -4.206 4.646 -0.225 562 HA2 GLY 81 HA2 GLY 81 -4.135 1.872 -1.208 563 HA3 GLY 81 HA1 GLY 81 -3.202 2.479 0.153 564 H ILE 82 HN ILE 82 -5.373 0.348 -0.348 565 HA ILE 82 HA ILE 82 -7.363 1.226 1.604 566 HB ILE 82 HB ILE 82 -7.298 -0.969 -0.436 567 HG12 ILE 82 HG12 ILE 82 -9.589 -0.059 -0.920 568 HG13 ILE 82 HG11 ILE 82 -9.290 1.189 0.285 569 HG21 ILE 82 HG21 ILE 82 -9.416 -1.848 0.562 570 HG22 ILE 82 HG22 ILE 82 -9.060 -0.884 1.996 571 HG23 ILE 82 HG23 ILE 82 -7.957 -2.165 1.500 572 HD11 ILE 82 HD11 ILE 82 -7.724 0.748 -2.241 573 HD12 ILE 82 HD12 ILE 82 -7.398 1.989 -1.028 574 HD13 ILE 82 HD13 ILE 82 -8.904 2.027 -1.948 575 H ASN 83 HN ASN 83 -7.078 0.729 3.625 576 HA ASN 83 HA ASN 83 -6.627 -0.412 5.532 577 HB2 ASN 83 HB2 ASN 83 -6.949 -2.663 3.570 578 HB3 ASN 83 HB1 ASN 83 -6.536 -2.996 5.246 579 HD21 ASN 83 HD21 ASN 83 -8.941 -3.684 3.742 580 HD22 ASN 83 HD22 ASN 83 -10.253 -2.978 4.604 581 H CYS 84 HN CYS 84 -4.472 0.704 4.073 582 HA CYS 84 HA CYS 84 -2.244 -1.053 3.988 583 HB2 CYS 84 HB2 CYS 84 -2.312 1.961 4.187 584 HB3 CYS 84 HB1 CYS 84 -0.914 0.993 3.738 585 H THR 85 HN THR 85 -1.946 -2.118 5.883 586 HA THR 85 HA THR 85 -1.819 -0.643 8.380 587 HB THR 85 HB THR 85 -1.347 -3.589 7.873 588 HG1 THR 85 HG1 THR 85 -3.491 -2.715 7.301 589 HG21 THR 85 HG21 THR 85 -0.436 -2.818 10.006 590 HG22 THR 85 HG22 THR 85 -1.862 -3.822 10.270 591 HG23 THR 85 HG23 THR 85 -1.981 -2.068 10.408 592 HA PRO 86 HA PRO 86 2.509 0.215 7.923 593 HB2 PRO 86 HB2 PRO 86 2.409 0.401 10.883 594 HB3 PRO 86 HB1 PRO 86 2.958 1.593 9.702 595 HG2 PRO 86 HG2 PRO 86 0.635 1.915 10.943 596 HG3 PRO 86 HG1 PRO 86 0.790 2.294 9.217 597 HD2 PRO 86 HD2 PRO 86 -0.397 -0.122 10.527 598 HD3 PRO 86 HD1 PRO 86 -0.989 0.827 9.150 599 H ILE 87 HN ILE 87 4.157 -1.140 7.745 600 HA ILE 87 HA ILE 87 4.143 -3.576 9.356 601 HB ILE 87 HB ILE 87 5.888 -4.291 7.619 602 HG12 ILE 87 HG12 ILE 87 4.599 -2.057 6.052 603 HG13 ILE 87 HG11 ILE 87 6.214 -1.961 6.737 604 HG21 ILE 87 HG21 ILE 87 4.135 -4.971 6.044 605 HG22 ILE 87 HG22 ILE 87 3.025 -3.835 6.812 606 HG23 ILE 87 HG23 ILE 87 3.653 -5.209 7.723 607 HD11 ILE 87 HD11 ILE 87 6.296 -2.508 4.381 608 HD12 ILE 87 HD12 ILE 87 5.280 -3.923 4.656 609 HD13 ILE 87 HD13 ILE 87 6.902 -3.852 5.346 610 HA PRO 88 HA PRO 88 7.701 -2.300 11.651 611 HB2 PRO 88 HB2 PRO 88 8.538 -5.117 11.626 612 HB3 PRO 88 HB1 PRO 88 8.107 -4.099 12.994 613 HG2 PRO 88 HG2 PRO 88 6.505 -6.063 12.200 614 HG3 PRO 88 HG1 PRO 88 5.841 -4.512 12.747 615 HD2 PRO 88 HD2 PRO 88 6.279 -5.494 9.952 616 HD3 PRO 88 HD1 PRO 88 4.854 -4.701 10.647 617 H LEU 89 HN LEU 89 9.969 -2.116 11.530 618 HA LEU 89 HA LEU 89 11.012 -2.214 8.850 619 HB2 LEU 89 HB2 LEU 89 12.384 -1.457 11.426 620 HB3 LEU 89 HB1 LEU 89 12.982 -1.136 9.809 621 HG LEU 89 HG LEU 89 10.508 0.074 11.042 622 HD11 LEU 89 HD11 LEU 89 12.546 0.957 12.010 623 HD12 LEU 89 HD12 LEU 89 11.800 2.157 10.955 624 HD13 LEU 89 HD13 LEU 89 13.206 1.250 10.401 625 HD21 LEU 89 HD21 LEU 89 11.789 0.493 8.346 626 HD22 LEU 89 HD22 LEU 89 10.510 1.498 9.023 627 HD23 LEU 89 HD23 LEU 89 10.199 -0.200 8.667 628 H ILE 90 HN ILE 90 10.527 -4.612 10.716 629 HA ILE 90 HA ILE 90 13.170 -5.844 10.413 630 HB ILE 90 HB ILE 90 12.495 -7.307 12.361 631 HG12 ILE 90 HG12 ILE 90 10.415 -5.138 12.753 632 HG13 ILE 90 HG11 ILE 90 10.069 -6.801 12.296 633 HG21 ILE 90 HG21 ILE 90 12.847 -4.342 12.794 634 HG22 ILE 90 HG22 ILE 90 14.123 -5.546 12.605 635 HG23 ILE 90 HG23 ILE 90 13.087 -5.578 14.031 636 HD11 ILE 90 HD11 ILE 90 11.330 -5.922 14.883 637 HD12 ILE 90 HD12 ILE 90 10.935 -7.580 14.427 638 HD13 ILE 90 HD13 ILE 90 9.646 -6.398 14.658 Start of MODEL 8 1 H1 GLY 1 HT1 GLY 1 11.137 -5.736 -11.780 2 H2 GLY 1 HT2 GLY 1 10.518 -5.060 -10.359 3 H3 GLY 1 HT3 GLY 1 10.929 -4.063 -11.660 4 HA2 GLY 1 HA1 GLY 1 9.183 -4.996 -13.004 5 HA3 GLY 1 HA2 GLY 1 8.778 -6.099 -11.697 6 H SER 2 HN SER 2 6.683 -5.350 -11.481 7 HA SER 2 HA SER 2 6.380 -2.558 -10.615 8 HB2 SER 2 HB2 SER 2 4.236 -4.495 -11.514 9 HB3 SER 2 HB1 SER 2 4.040 -2.767 -11.216 10 HG SER 2 HG SER 2 4.702 -3.930 -13.475 11 H GLY 3 HN GLY 3 6.514 -5.716 -9.462 12 HA2 GLY 3 HA2 GLY 3 4.751 -5.242 -7.183 13 HA3 GLY 3 HA1 GLY 3 5.573 -6.748 -7.571 14 H TRP 4 HN TRP 4 5.916 -6.499 -5.132 15 HA TRP 4 HA TRP 4 8.452 -5.080 -4.718 16 HB2 TRP 4 HB2 TRP 4 6.016 -5.098 -2.954 17 HB3 TRP 4 HB1 TRP 4 7.613 -4.687 -2.332 18 HD1 TRP 4 HD1 TRP 4 4.668 -3.146 -3.926 19 HE1 TRP 4 HE1 TRP 4 5.208 -0.755 -4.710 20 HE3 TRP 4 HE3 TRP 4 9.757 -3.285 -3.500 21 HZ2 TRP 4 HZ2 TRP 4 7.493 0.852 -5.107 22 HZ3 TRP 4 HZ3 TRP 4 11.047 -1.279 -4.107 23 HH2 TRP 4 HH2 TRP 4 9.936 0.744 -4.893 24 H GLU 5 HN GLU 5 9.798 -5.889 -3.078 25 HA GLU 5 HA GLU 5 10.087 -8.689 -3.089 26 HB2 GLU 5 HB2 GLU 5 11.383 -6.589 -1.342 27 HB3 GLU 5 HB1 GLU 5 11.894 -8.269 -1.422 28 HG2 GLU 5 HG2 GLU 5 11.901 -6.347 -3.741 29 HG3 GLU 5 HG1 GLU 5 13.302 -6.762 -2.758 30 H SER 6 HN SER 6 8.855 -10.065 -2.031 31 HA SER 6 HA SER 6 7.476 -9.293 0.405 32 HB2 SER 6 HB2 SER 6 7.403 -11.913 -1.113 33 HB3 SER 6 HB1 SER 6 6.281 -11.398 0.146 34 HG SER 6 HG SER 6 6.636 -10.272 -2.436 35 H LYS 7 HN LYS 7 10.382 -9.599 0.349 36 HA LYS 7 HA LYS 7 11.383 -11.990 1.286 37 HB2 LYS 7 HB2 LYS 7 12.942 -10.362 0.639 38 HB3 LYS 7 HB1 LYS 7 12.223 -9.133 1.669 39 HG2 LYS 7 HG2 LYS 7 14.330 -9.833 2.599 40 HG3 LYS 7 HG1 LYS 7 13.018 -10.348 3.649 41 HD2 LYS 7 HD2 LYS 7 14.621 -12.134 3.444 42 HD3 LYS 7 HD1 LYS 7 13.116 -12.585 2.641 43 HE2 LYS 7 HE2 LYS 7 14.105 -11.973 0.478 44 HE3 LYS 7 HE1 LYS 7 15.609 -11.553 1.293 45 HZ1 LYS 7 HZ1 LYS 7 15.702 -13.765 0.331 46 HZ2 LYS 7 HZ2 LYS 7 14.369 -14.248 1.249 47 HZ3 LYS 7 HZ3 LYS 7 15.819 -13.841 2.017 48 H THR 8 HN THR 8 10.255 -9.237 3.229 49 HA THR 8 HA THR 8 11.003 -10.436 5.673 50 HB THR 8 HB THR 8 9.544 -8.600 6.688 51 HG1 THR 8 HG1 THR 8 9.558 -7.366 4.172 52 HG21 THR 8 HG21 THR 8 11.142 -6.831 6.071 53 HG22 THR 8 HG22 THR 8 11.734 -7.840 4.751 54 HG23 THR 8 HG23 THR 8 11.954 -8.355 6.423 55 H GLY 9 HN GLY 9 8.161 -10.652 3.717 56 HA2 GLY 9 HA2 GLY 9 6.357 -12.093 3.934 57 HA3 GLY 9 HA1 GLY 9 7.011 -12.626 5.475 58 H SER 10 HN SER 10 6.709 -9.268 5.026 59 HA SER 10 HA SER 10 5.053 -9.076 7.334 60 HB2 SER 10 HB2 SER 10 5.233 -6.577 6.728 61 HB3 SER 10 HB1 SER 10 6.710 -7.428 7.165 62 HG SER 10 HG SER 10 7.444 -7.182 5.199 63 H CYS 11 HN CYS 11 4.508 -8.858 3.908 64 HA CYS 11 HA CYS 11 1.830 -7.752 4.404 65 HB2 CYS 11 HB2 CYS 11 3.358 -6.539 2.838 66 HB3 CYS 11 HB1 CYS 11 3.304 -7.941 1.777 67 H ASN 12 HN ASN 12 0.004 -8.751 3.682 68 HA ASN 12 HA ASN 12 0.281 -11.596 3.128 69 HB2 ASN 12 HB2 ASN 12 -2.062 -11.784 3.694 70 HB3 ASN 12 HB1 ASN 12 -1.243 -10.840 4.931 71 HD21 ASN 12 HD21 ASN 12 -1.651 -8.610 5.058 72 HD22 ASN 12 HD22 ASN 12 -3.050 -7.906 4.323 73 H THR 13 HN THR 13 -0.661 -8.682 1.505 74 HA THR 13 HA THR 13 -1.969 -10.190 -0.637 75 HB THR 13 HB THR 13 -2.527 -7.814 -1.445 76 HG1 THR 13 HG1 THR 13 -2.370 -6.229 0.217 77 HG21 THR 13 HG21 THR 13 -4.387 -7.616 0.164 78 HG22 THR 13 HG22 THR 13 -3.606 -8.815 1.197 79 HG23 THR 13 HG23 THR 13 -4.182 -9.272 -0.407 80 H GLY 14 HN GLY 14 0.819 -8.195 0.018 81 HA2 GLY 14 HA2 GLY 14 2.802 -8.385 -1.303 82 HA3 GLY 14 HA1 GLY 14 1.798 -8.787 -2.686 83 H LYS 15 HN LYS 15 0.141 -6.363 -1.345 84 HA LYS 15 HA LYS 15 1.315 -4.429 -3.170 85 HB2 LYS 15 HB2 LYS 15 -1.222 -4.326 -1.526 86 HB3 LYS 15 HB1 LYS 15 -0.682 -3.034 -2.589 87 HG2 LYS 15 HG2 LYS 15 -0.705 -4.753 -4.452 88 HG3 LYS 15 HG1 LYS 15 -1.575 -5.802 -3.334 89 HD2 LYS 15 HD2 LYS 15 -3.365 -4.175 -3.147 90 HD3 LYS 15 HD1 LYS 15 -2.469 -3.037 -4.156 91 HE2 LYS 15 HE2 LYS 15 -2.522 -4.719 -5.976 92 HE3 LYS 15 HE1 LYS 15 -3.583 -5.710 -4.981 93 HZ1 LYS 15 HZ1 LYS 15 -4.825 -4.423 -6.582 94 HZ2 LYS 15 HZ2 LYS 15 -4.175 -2.984 -6.001 95 HZ3 LYS 15 HZ3 LYS 15 -5.210 -3.896 -5.020 96 H LEU 16 HN LEU 16 3.223 -3.943 -2.102 97 HA LEU 16 HA LEU 16 3.076 -2.643 0.488 98 HB2 LEU 16 HB2 LEU 16 5.339 -3.486 -1.308 99 HB3 LEU 16 HB1 LEU 16 5.608 -2.417 0.051 100 HG LEU 16 HG LEU 16 4.667 -4.187 1.543 101 HD11 LEU 16 HD11 LEU 16 4.809 -5.820 -0.969 102 HD12 LEU 16 HD12 LEU 16 3.360 -5.406 -0.042 103 HD13 LEU 16 HD13 LEU 16 4.582 -6.472 0.656 104 HD21 LEU 16 HD21 LEU 16 6.670 -5.618 1.457 105 HD22 LEU 16 HD22 LEU 16 7.058 -3.902 1.357 106 HD23 LEU 16 HD23 LEU 16 7.091 -4.899 -0.096 107 H ALA 17 HN ALA 17 2.938 -0.497 0.702 108 HA ALA 17 HA ALA 17 4.030 1.210 -1.408 109 HB1 ALA 17 HB1 ALA 17 1.996 2.645 -1.353 110 HB2 ALA 17 HB2 ALA 17 1.201 1.406 -0.373 111 HB3 ALA 17 HB3 ALA 17 1.708 1.034 -2.021 112 H CYS 18 HN CYS 18 4.554 3.315 -0.705 113 HA CYS 18 HA CYS 18 4.978 3.540 2.164 114 HB2 CYS 18 HB2 CYS 18 5.785 5.420 -0.066 115 HB3 CYS 18 HB1 CYS 18 6.332 5.481 1.602 116 H CYS 19 HN CYS 19 3.125 4.131 3.179 117 HA CYS 19 HA CYS 19 1.458 6.152 1.838 118 HB2 CYS 19 HB2 CYS 19 0.625 3.880 3.641 119 HB3 CYS 19 HB1 CYS 19 -0.466 5.102 3.009 120 H ASP 20 HN ASP 20 0.341 7.680 3.131 121 HA ASP 20 HA ASP 20 1.694 8.300 5.651 122 HB2 ASP 20 HB2 ASP 20 1.077 10.055 3.795 123 HB3 ASP 20 HB1 ASP 20 -0.535 9.899 4.453 124 H THR 21 HN THR 21 0.815 7.591 7.514 125 HA THR 21 HA THR 21 -1.808 6.416 7.472 126 HB THR 21 HB THR 21 -1.358 5.851 9.833 127 HG1 THR 21 HG1 THR 21 1.046 6.313 10.335 128 HG21 THR 21 HG21 THR 21 -0.615 4.342 8.053 129 HG22 THR 21 HG22 THR 21 0.517 4.322 9.405 130 HG23 THR 21 HG23 THR 21 0.914 5.216 7.937 131 H ASN 22 HN ASN 22 -0.728 9.552 7.910 132 HA ASN 22 HA ASN 22 -2.912 10.210 9.765 133 HB2 ASN 22 HB2 ASN 22 -0.423 11.729 8.981 134 HB3 ASN 22 HB1 ASN 22 -1.733 12.450 9.902 135 HD21 ASN 22 HD21 ASN 22 1.021 12.052 10.673 136 HD22 ASN 22 HD22 ASN 22 0.997 11.064 12.092 137 H LYS 23 HN LYS 23 -1.927 10.335 6.534 138 HA LYS 23 HA LYS 23 -3.949 12.350 5.866 139 HB2 LYS 23 HB2 LYS 23 -1.564 11.279 4.454 140 HB3 LYS 23 HB1 LYS 23 -2.860 11.943 3.505 141 HG2 LYS 23 HG2 LYS 23 -2.620 14.010 5.013 142 HG3 LYS 23 HG1 LYS 23 -1.091 13.265 5.475 143 HD2 LYS 23 HD2 LYS 23 -1.900 13.979 2.673 144 HD3 LYS 23 HD1 LYS 23 -0.741 14.859 3.678 145 HE2 LYS 23 HE2 LYS 23 0.747 13.019 3.724 146 HE3 LYS 23 HE1 LYS 23 -0.470 11.957 3.023 147 HZ1 LYS 23 HZ1 LYS 23 1.208 12.619 1.395 148 HZ2 LYS 23 HZ2 LYS 23 0.833 14.247 1.644 149 HZ3 LYS 23 HZ3 LYS 23 -0.315 13.215 0.956 150 H LYS 24 HN LYS 24 -5.733 11.839 4.932 151 HA LYS 24 HA LYS 24 -6.188 9.027 4.218 152 HB2 LYS 24 HB2 LYS 24 -8.080 11.014 5.467 153 HB3 LYS 24 HB1 LYS 24 -8.551 9.420 4.894 154 HG2 LYS 24 HG2 LYS 24 -8.297 9.184 7.180 155 HG3 LYS 24 HG1 LYS 24 -6.829 8.500 6.505 156 HD2 LYS 24 HD2 LYS 24 -5.634 10.560 7.025 157 HD3 LYS 24 HD1 LYS 24 -7.119 11.267 7.669 158 HE2 LYS 24 HE2 LYS 24 -5.735 8.806 8.736 159 HE3 LYS 24 HE1 LYS 24 -5.654 10.416 9.449 160 HZ1 LYS 24 HZ1 LYS 24 -8.060 10.330 9.785 161 HZ2 LYS 24 HZ2 LYS 24 -7.283 9.060 10.584 162 HZ3 LYS 24 HZ3 LYS 24 -8.105 8.768 9.140 163 H VAL 25 HN VAL 25 -7.932 8.645 2.672 164 HA VAL 25 HA VAL 25 -8.116 10.806 0.669 165 HB VAL 25 HB VAL 25 -8.480 7.861 0.131 166 HG11 VAL 25 HG11 VAL 25 -9.457 9.386 -1.510 167 HG12 VAL 25 HG12 VAL 25 -8.104 8.480 -2.190 168 HG13 VAL 25 HG13 VAL 25 -7.888 10.165 -1.717 169 HG21 VAL 25 HG21 VAL 25 -6.190 7.851 -0.762 170 HG22 VAL 25 HG22 VAL 25 -6.226 8.171 0.971 171 HG23 VAL 25 HG23 VAL 25 -5.963 9.495 -0.165 172 H GLN 26 HN GLN 26 -10.120 11.081 -0.391 173 HA GLN 26 HA GLN 26 -12.371 10.637 1.357 174 HB2 GLN 26 HB2 GLN 26 -12.090 12.156 -1.234 175 HB3 GLN 26 HB1 GLN 26 -13.542 12.114 -0.259 176 HG2 GLN 26 HG2 GLN 26 -10.902 13.117 0.751 177 HG3 GLN 26 HG1 GLN 26 -12.122 14.152 0.013 178 HE21 GLN 26 HE21 GLN 26 -12.382 15.358 1.874 179 HE22 GLN 26 HE22 GLN 26 -13.196 14.747 3.270 180 H LYS 27 HN LYS 27 -10.988 8.704 -0.803 181 HA LYS 27 HA LYS 27 -13.546 7.501 -1.587 182 HB2 LYS 27 HB2 LYS 27 -11.105 7.761 -3.357 183 HB3 LYS 27 HB1 LYS 27 -12.541 6.834 -3.755 184 HG2 LYS 27 HG2 LYS 27 -12.452 9.805 -3.325 185 HG3 LYS 27 HG1 LYS 27 -12.485 9.008 -4.888 186 HD2 LYS 27 HD2 LYS 27 -14.638 8.853 -2.776 187 HD3 LYS 27 HD1 LYS 27 -14.694 9.847 -4.230 188 HE2 LYS 27 HE2 LYS 27 -14.704 7.918 -5.632 189 HE3 LYS 27 HE1 LYS 27 -14.379 6.869 -4.257 190 HZ1 LYS 27 HZ1 LYS 27 -16.843 8.485 -4.589 191 HZ2 LYS 27 HZ2 LYS 27 -16.536 7.363 -3.362 192 HZ3 LYS 27 HZ3 LYS 27 -16.721 6.841 -4.959 193 H SER 28 HN SER 28 -13.696 5.543 -0.756 194 HA SER 28 HA SER 28 -11.246 3.934 -0.453 195 HB2 SER 28 HB2 SER 28 -13.608 3.899 1.441 196 HB3 SER 28 HB1 SER 28 -12.065 3.071 1.648 197 HG SER 28 HG SER 28 -12.353 5.891 1.485 198 H THR 29 HN THR 29 -11.818 3.010 -2.539 199 HA THR 29 HA THR 29 -14.130 1.194 -2.362 200 HB THR 29 HB THR 29 -12.967 2.324 -4.906 201 HG1 THR 29 HG1 THR 29 -14.074 3.845 -3.370 202 HG21 THR 29 HG21 THR 29 -15.558 0.867 -4.347 203 HG22 THR 29 HG22 THR 29 -14.153 0.195 -5.175 204 HG23 THR 29 HG23 THR 29 -15.058 1.518 -5.909 205 H GLY 30 HN GLY 30 -10.993 1.606 -3.935 206 HA2 GLY 30 HA2 GLY 30 -9.292 -0.011 -4.124 207 HA3 GLY 30 HA1 GLY 30 -10.426 -1.239 -3.580 208 H GLU 31 HN GLU 31 -8.650 -1.376 -5.870 209 HA GLU 31 HA GLU 31 -10.587 -1.431 -8.080 210 HB2 GLU 31 HB2 GLU 31 -7.606 -1.900 -8.185 211 HB3 GLU 31 HB1 GLU 31 -8.687 -1.779 -9.561 212 HG2 GLU 31 HG2 GLU 31 -9.181 0.562 -8.881 213 HG3 GLU 31 HG1 GLU 31 -7.933 0.407 -7.644 214 H GLU 32 HN GLU 32 -8.191 -3.466 -6.436 215 HA GLU 32 HA GLU 32 -8.958 -5.819 -7.878 216 HB2 GLU 32 HB2 GLU 32 -6.638 -5.426 -7.182 217 HB3 GLU 32 HB1 GLU 32 -7.139 -5.406 -5.498 218 HG2 GLU 32 HG2 GLU 32 -6.206 -7.521 -5.891 219 HG3 GLU 32 HG1 GLU 32 -7.955 -7.732 -5.825 220 H SER 33 HN SER 33 -8.866 -5.018 -4.426 221 HA SER 33 HA SER 33 -10.780 -7.024 -3.729 222 HB2 SER 33 HB2 SER 33 -9.796 -4.660 -2.105 223 HB3 SER 33 HB1 SER 33 -10.614 -6.088 -1.478 224 HG SER 33 HG SER 33 -8.056 -5.780 -1.710 225 H GLY 34 HN GLY 34 -10.844 -3.754 -4.777 226 HA2 GLY 34 HA2 GLY 34 -13.482 -3.091 -3.930 227 HA3 GLY 34 HA1 GLY 34 -12.565 -2.286 -5.194 228 H LEU 35 HN LEU 35 -12.234 -4.975 -6.560 229 HA LEU 35 HA LEU 35 -14.669 -4.963 -8.080 230 HB2 LEU 35 HB2 LEU 35 -12.175 -5.572 -8.750 231 HB3 LEU 35 HB1 LEU 35 -12.660 -7.173 -8.233 232 HG LEU 35 HG LEU 35 -14.137 -5.609 -10.341 233 HD11 LEU 35 HD11 LEU 35 -12.030 -7.728 -10.722 234 HD12 LEU 35 HD12 LEU 35 -11.817 -6.007 -11.038 235 HD13 LEU 35 HD13 LEU 35 -12.965 -6.945 -11.994 236 HD21 LEU 35 HD21 LEU 35 -14.140 -8.540 -9.628 237 HD22 LEU 35 HD22 LEU 35 -15.042 -7.799 -10.951 238 HD23 LEU 35 HD23 LEU 35 -15.429 -7.389 -9.280 239 H LEU 36 HN LEU 36 -13.166 -6.920 -5.604 240 HA LEU 36 HA LEU 36 -15.213 -8.923 -5.550 241 HB2 LEU 36 HB2 LEU 36 -12.821 -8.246 -3.876 242 HB3 LEU 36 HB1 LEU 36 -14.001 -9.391 -3.289 243 HG LEU 36 HG LEU 36 -13.596 -10.813 -5.271 244 HD11 LEU 36 HD11 LEU 36 -11.674 -10.377 -6.705 245 HD12 LEU 36 HD12 LEU 36 -11.407 -8.836 -5.890 246 HD13 LEU 36 HD13 LEU 36 -12.872 -9.091 -6.838 247 HD21 LEU 36 HD21 LEU 36 -11.120 -10.108 -3.707 248 HD22 LEU 36 HD22 LEU 36 -11.396 -11.609 -4.591 249 HD23 LEU 36 HD23 LEU 36 -12.392 -11.213 -3.190 250 H HIS 37 HN HIS 37 -16.070 -9.345 -3.124 251 HA HIS 37 HA HIS 37 -17.732 -7.062 -2.563 252 HB2 HIS 37 HB2 HIS 37 -18.889 -8.478 -0.952 253 HB3 HIS 37 HB1 HIS 37 -18.699 -9.316 -2.484 254 HD1 HIS 37 HD1 HIS 37 -17.643 -11.579 -2.406 255 HD2 HIS 37 HD2 HIS 37 -17.101 -9.455 1.128 256 HE1 HIS 37 HE1 HIS 37 -16.643 -13.215 -0.777 257 HE2 HIS 37 HE2 HIS 37 -16.224 -11.880 1.319 258 H THR 38 HN THR 38 -14.678 -7.591 -1.802 259 HA THR 38 HA THR 38 -14.531 -6.930 0.945 260 HB THR 38 HB THR 38 -12.519 -6.331 -1.230 261 HG1 THR 38 HG1 THR 38 -11.848 -8.492 0.149 262 HG21 THR 38 HG21 THR 38 -12.197 -6.705 1.748 263 HG22 THR 38 HG22 THR 38 -12.025 -5.190 0.863 264 HG23 THR 38 HG23 THR 38 -10.875 -6.501 0.600 265 H GLY 39 HN GLY 39 -14.706 -5.059 -2.018 266 HA2 GLY 39 HA2 GLY 39 -14.284 -2.517 -0.767 267 HA3 GLY 39 HA1 GLY 39 -14.853 -2.790 -2.406 268 H ASP 40 HN ASP 40 -16.656 -4.447 -0.088 269 HA ASP 40 HA ASP 40 -19.015 -2.902 -0.517 270 HB2 ASP 40 HB2 ASP 40 -19.110 -5.310 -0.070 271 HB3 ASP 40 HB1 ASP 40 -18.393 -5.061 1.510 272 H VAL 41 HN VAL 41 -16.872 -3.431 2.224 273 HA VAL 41 HA VAL 41 -18.327 -1.686 3.960 274 HB VAL 41 HB VAL 41 -16.320 -1.979 5.473 275 HG11 VAL 41 HG11 VAL 41 -17.692 -4.456 4.417 276 HG12 VAL 41 HG12 VAL 41 -18.315 -3.370 5.660 277 HG13 VAL 41 HG13 VAL 41 -16.866 -4.326 5.972 278 HG21 VAL 41 HG21 VAL 41 -14.747 -3.774 4.881 279 HG22 VAL 41 HG22 VAL 41 -14.632 -2.400 3.782 280 HG23 VAL 41 HG23 VAL 41 -15.472 -3.866 3.276 281 H LEU 42 HN LEU 42 -17.949 0.372 4.549 282 HA LEU 42 HA LEU 42 -15.965 1.917 3.108 283 HB2 LEU 42 HB2 LEU 42 -18.236 2.804 3.432 284 HB3 LEU 42 HB1 LEU 42 -18.029 2.704 5.169 285 HG LEU 42 HG LEU 42 -16.177 4.343 4.984 286 HD11 LEU 42 HD11 LEU 42 -17.142 4.562 2.141 287 HD12 LEU 42 HD12 LEU 42 -15.554 4.013 2.675 288 HD13 LEU 42 HD13 LEU 42 -16.038 5.691 2.924 289 HD21 LEU 42 HD21 LEU 42 -17.637 6.284 4.684 290 HD22 LEU 42 HD22 LEU 42 -18.418 5.030 5.645 291 HD23 LEU 42 HD23 LEU 42 -18.860 5.246 3.953 292 H ASP 43 HN ASP 43 -16.079 -0.017 5.721 293 HA ASP 43 HA ASP 43 -14.594 1.255 7.715 294 HB2 ASP 43 HB2 ASP 43 -15.704 -0.862 8.125 295 HB3 ASP 43 HB1 ASP 43 -14.712 -1.660 6.910 296 H GLN 44 HN GLN 44 -13.634 -0.244 4.705 297 HA GLN 44 HA GLN 44 -10.956 -0.640 5.001 298 HB2 GLN 44 HB2 GLN 44 -11.998 0.814 2.599 299 HB3 GLN 44 HB1 GLN 44 -10.673 -0.320 2.683 300 HG2 GLN 44 HG2 GLN 44 -12.314 -2.110 3.198 301 HG3 GLN 44 HG1 GLN 44 -13.600 -0.942 2.891 302 HE21 GLN 44 HE21 GLN 44 -13.819 -0.087 0.777 303 HE22 GLN 44 HE22 GLN 44 -13.215 -0.944 -0.597 304 H VAL 45 HN VAL 45 -9.213 0.567 5.307 305 HA VAL 45 HA VAL 45 -9.642 3.421 5.689 306 HB VAL 45 HB VAL 45 -8.678 2.266 7.577 307 HG11 VAL 45 HG11 VAL 45 -7.567 0.467 6.723 308 HG12 VAL 45 HG12 VAL 45 -6.309 1.483 7.431 309 HG13 VAL 45 HG13 VAL 45 -6.557 1.469 5.683 310 HG21 VAL 45 HG21 VAL 45 -8.094 4.596 7.279 311 HG22 VAL 45 HG22 VAL 45 -6.725 4.134 6.269 312 HG23 VAL 45 HG23 VAL 45 -6.739 3.712 7.981 313 H ALA 46 HN ALA 46 -9.395 4.545 3.944 314 HA ALA 46 HA ALA 46 -7.266 3.882 2.063 315 HB1 ALA 46 HB1 ALA 46 -9.496 4.220 1.143 316 HB2 ALA 46 HB2 ALA 46 -8.387 5.467 0.564 317 HB3 ALA 46 HB3 ALA 46 -9.549 5.838 1.840 318 H ILE 47 HN ILE 47 -5.402 4.676 2.822 319 HA ILE 47 HA ILE 47 -5.366 7.486 3.642 320 HB ILE 47 HB ILE 47 -3.035 6.989 4.456 321 HG12 ILE 47 HG12 ILE 47 -3.937 4.122 4.086 322 HG13 ILE 47 HG11 ILE 47 -2.669 4.921 3.161 323 HG21 ILE 47 HG21 ILE 47 -5.289 5.463 5.745 324 HG22 ILE 47 HG22 ILE 47 -4.984 7.191 5.920 325 HG23 ILE 47 HG23 ILE 47 -3.813 6.021 6.542 326 HD11 ILE 47 HD11 ILE 47 -1.644 3.568 4.833 327 HD12 ILE 47 HD12 ILE 47 -2.651 4.270 6.095 328 HD13 ILE 47 HD13 ILE 47 -1.428 5.256 5.293 329 H GLN 48 HN GLN 48 -3.790 8.892 2.808 330 HA GLN 48 HA GLN 48 -3.472 8.527 -0.032 331 HB2 GLN 48 HB2 GLN 48 -3.867 10.727 1.455 332 HB3 GLN 48 HB1 GLN 48 -2.112 10.777 1.363 333 HG2 GLN 48 HG2 GLN 48 -3.906 10.562 -1.040 334 HG3 GLN 48 HG1 GLN 48 -3.304 12.083 -0.396 335 HE21 GLN 48 HE21 GLN 48 -2.896 10.648 -2.972 336 HE22 GLN 48 HE22 GLN 48 -1.182 10.548 -3.164 337 H CYS 49 HN CYS 49 -1.759 7.851 -1.075 338 HA CYS 49 HA CYS 49 0.580 7.142 0.553 339 HB2 CYS 49 HB2 CYS 49 -1.116 5.347 -0.405 340 HB3 CYS 49 HB1 CYS 49 -0.175 5.578 -1.871 341 H THR 50 HN THR 50 2.586 6.836 -0.723 342 HA THR 50 HA THR 50 2.762 8.412 -3.143 343 HB THR 50 HB THR 50 2.886 10.229 -1.622 344 HG1 THR 50 HG1 THR 50 4.557 10.181 -3.242 345 HG21 THR 50 HG21 THR 50 3.257 8.958 0.425 346 HG22 THR 50 HG22 THR 50 4.401 10.295 0.294 347 HG23 THR 50 HG23 THR 50 4.922 8.647 -0.061 348 H GLN 51 HN GLN 51 4.147 7.427 -4.440 349 HA GLN 51 HA GLN 51 6.235 5.788 -3.181 350 HB2 GLN 51 HB2 GLN 51 4.156 4.780 -4.571 351 HB3 GLN 51 HB1 GLN 51 5.306 5.024 -5.883 352 HG2 GLN 51 HG2 GLN 51 5.948 3.529 -3.355 353 HG3 GLN 51 HG1 GLN 51 5.366 2.759 -4.831 354 HE21 GLN 51 HE21 GLN 51 7.932 2.624 -3.297 355 HE22 GLN 51 HE22 GLN 51 9.160 2.902 -4.476 356 H ILE 52 HN ILE 52 8.084 6.693 -3.446 357 HA ILE 52 HA ILE 52 8.717 8.598 -5.455 358 HB ILE 52 HB ILE 52 10.505 7.116 -3.522 359 HG12 ILE 52 HG12 ILE 52 9.213 9.843 -3.327 360 HG13 ILE 52 HG11 ILE 52 8.694 8.406 -2.453 361 HG21 ILE 52 HG21 ILE 52 12.118 8.887 -3.870 362 HG22 ILE 52 HG22 ILE 52 11.040 9.674 -5.022 363 HG23 ILE 52 HG23 ILE 52 11.746 8.103 -5.406 364 HD11 ILE 52 HD11 ILE 52 9.996 9.904 -1.053 365 HD12 ILE 52 HD12 ILE 52 11.356 9.763 -2.165 366 HD13 ILE 52 HD13 ILE 52 10.803 8.354 -1.265 367 HA PRO 53 HA PRO 53 9.483 6.284 -9.090 368 HB2 PRO 53 HB2 PRO 53 12.110 7.728 -8.963 369 HB3 PRO 53 HB1 PRO 53 11.041 7.473 -10.347 370 HG2 PRO 53 HG2 PRO 53 11.056 9.787 -8.977 371 HG3 PRO 53 HG1 PRO 53 9.578 9.126 -9.697 372 HD2 PRO 53 HD2 PRO 53 10.321 9.371 -6.869 373 HD3 PRO 53 HD1 PRO 53 8.728 9.086 -7.593 374 H LEU 54 HN LEU 54 10.224 4.339 -9.540 375 HA LEU 54 HA LEU 54 11.580 3.019 -7.387 376 HB2 LEU 54 HB2 LEU 54 10.439 1.765 -9.870 377 HB3 LEU 54 HB1 LEU 54 10.779 0.983 -8.341 378 HG LEU 54 HG LEU 54 8.975 2.733 -7.463 379 HD11 LEU 54 HD11 LEU 54 8.220 2.316 -10.350 380 HD12 LEU 54 HD12 LEU 54 8.626 3.850 -9.579 381 HD13 LEU 54 HD13 LEU 54 7.165 2.984 -9.105 382 HD21 LEU 54 HD21 LEU 54 8.829 0.325 -7.215 383 HD22 LEU 54 HD22 LEU 54 8.347 0.159 -8.901 384 HD23 LEU 54 HD23 LEU 54 7.281 0.974 -7.757 385 H LEU 55 HN LEU 55 13.628 2.369 -7.382 386 HA LEU 55 HA LEU 55 15.051 1.985 -9.912 387 HB2 LEU 55 HB2 LEU 55 15.979 1.710 -7.044 388 HB3 LEU 55 HB1 LEU 55 17.001 1.542 -8.456 389 HG LEU 55 HG LEU 55 15.608 4.066 -7.569 390 HD11 LEU 55 HD11 LEU 55 17.871 4.879 -7.137 391 HD12 LEU 55 HD12 LEU 55 18.522 3.299 -7.575 392 HD13 LEU 55 HD13 LEU 55 17.492 3.465 -6.153 393 HD21 LEU 55 HD21 LEU 55 15.729 3.985 -9.983 394 HD22 LEU 55 HD22 LEU 55 17.438 3.555 -9.909 395 HD23 LEU 55 HD23 LEU 55 16.904 5.145 -9.363 396 H ILE 56 HN ILE 56 15.534 -0.044 -10.691 397 HA ILE 56 HA ILE 56 13.742 -2.094 -9.912 398 HB ILE 56 HB ILE 56 16.137 -2.362 -11.716 399 HG12 ILE 56 HG12 ILE 56 14.259 -2.274 -13.511 400 HG13 ILE 56 HG11 ILE 56 13.308 -1.495 -12.256 401 HG21 ILE 56 HG21 ILE 56 15.324 -4.502 -10.931 402 HG22 ILE 56 HG22 ILE 56 14.965 -4.297 -12.645 403 HG23 ILE 56 HG23 ILE 56 13.689 -4.087 -11.446 404 HD11 ILE 56 HD11 ILE 56 15.957 -0.488 -13.266 405 HD12 ILE 56 HD12 ILE 56 14.865 0.327 -12.145 406 HD13 ILE 56 HD13 ILE 56 14.383 0.076 -13.820 407 H GLY 57 HN GLY 57 13.974 -3.769 -8.633 408 HA2 GLY 57 HA2 GLY 57 15.022 -5.459 -7.420 409 HA3 GLY 57 HA1 GLY 57 16.576 -4.756 -7.836 410 H ILE 58 HN ILE 58 14.587 -2.336 -6.677 411 HA ILE 58 HA ILE 58 16.016 -2.436 -4.136 412 HB ILE 58 HB ILE 58 15.133 -0.271 -5.877 413 HG12 ILE 58 HG12 ILE 58 17.472 -0.827 -5.303 414 HG13 ILE 58 HG11 ILE 58 17.058 0.837 -4.898 415 HG21 ILE 58 HG21 ILE 58 14.734 1.383 -4.117 416 HG22 ILE 58 HG22 ILE 58 14.781 0.099 -2.905 417 HG23 ILE 58 HG23 ILE 58 13.497 0.126 -4.113 418 HD11 ILE 58 HD11 ILE 58 16.860 0.278 -2.573 419 HD12 ILE 58 HD12 ILE 58 18.414 -0.306 -3.172 420 HD13 ILE 58 HD13 ILE 58 17.081 -1.435 -2.920 421 H ALA 59 HN ALA 59 15.045 -1.962 -2.198 422 HA ALA 59 HA ALA 59 12.454 -3.214 -1.872 423 HB1 ALA 59 HB1 ALA 59 13.081 -3.030 0.546 424 HB2 ALA 59 HB2 ALA 59 14.590 -2.272 0.018 425 HB3 ALA 59 HB3 ALA 59 14.227 -3.933 -0.450 426 H ILE 60 HN ILE 60 10.690 -2.272 -0.992 427 HA ILE 60 HA ILE 60 10.044 0.365 -1.585 428 HB ILE 60 HB ILE 60 8.401 -1.450 -1.243 429 HG12 ILE 60 HG12 ILE 60 6.738 -0.133 0.139 430 HG13 ILE 60 HG11 ILE 60 8.033 1.013 0.470 431 HG21 ILE 60 HG21 ILE 60 9.313 -2.590 0.643 432 HG22 ILE 60 HG22 ILE 60 7.708 -2.010 1.086 433 HG23 ILE 60 HG23 ILE 60 9.143 -1.161 1.663 434 HD11 ILE 60 HD11 ILE 60 6.941 0.321 -2.246 435 HD12 ILE 60 HD12 ILE 60 8.236 1.471 -1.916 436 HD13 ILE 60 HD13 ILE 60 6.603 1.788 -1.329 437 H GLU 61 HN GLU 61 11.468 -0.971 1.326 438 HA GLU 61 HA GLU 61 10.839 1.405 2.861 439 HB2 GLU 61 HB2 GLU 61 11.981 0.165 4.729 440 HB3 GLU 61 HB1 GLU 61 10.547 -0.596 4.078 441 HG2 GLU 61 HG2 GLU 61 12.136 -2.297 4.486 442 HG3 GLU 61 HG1 GLU 61 12.032 -2.094 2.745 443 H ASP 62 HN ASP 62 13.264 0.449 0.805 444 HA ASP 62 HA ASP 62 15.256 2.187 2.091 445 HB2 ASP 62 HB2 ASP 62 15.893 -0.168 1.399 446 HB3 ASP 62 HB1 ASP 62 15.671 0.342 -0.270 447 H GLU 63 HN GLU 63 13.166 1.797 -0.612 448 HA GLU 63 HA GLU 63 14.376 3.689 -2.354 449 HB2 GLU 63 HB2 GLU 63 12.841 1.831 -3.049 450 HB3 GLU 63 HB1 GLU 63 11.513 2.724 -2.325 451 HG2 GLU 63 HG2 GLU 63 11.520 3.087 -4.691 452 HG3 GLU 63 HG1 GLU 63 11.962 4.578 -3.869 453 H CYS 64 HN CYS 64 11.802 3.849 0.062 454 HA CYS 64 HA CYS 64 11.544 6.719 -0.537 455 HB2 CYS 64 HB2 CYS 64 9.240 6.616 -0.085 456 HB3 CYS 64 HB1 CYS 64 9.560 5.144 -1.000 457 H LYS 65 HN LYS 65 11.234 8.151 1.221 458 HA LYS 65 HA LYS 65 12.269 7.139 3.765 459 HB2 LYS 65 HB2 LYS 65 13.211 9.190 2.499 460 HB3 LYS 65 HB1 LYS 65 11.787 10.033 3.086 461 HG2 LYS 65 HG2 LYS 65 13.616 10.499 4.547 462 HG3 LYS 65 HG1 LYS 65 12.472 9.462 5.399 463 HD2 LYS 65 HD2 LYS 65 14.746 8.717 5.811 464 HD3 LYS 65 HD1 LYS 65 13.865 7.515 4.870 465 HE2 LYS 65 HE2 LYS 65 16.109 7.786 3.999 466 HE3 LYS 65 HE1 LYS 65 14.926 8.343 2.822 467 HZ1 LYS 65 HZ1 LYS 65 16.509 10.078 4.635 468 HZ2 LYS 65 HZ2 LYS 65 15.381 10.616 3.497 469 HZ3 LYS 65 HZ3 LYS 65 16.798 9.852 2.985 470 H ASN 66 HN ASN 66 9.607 6.542 2.942 471 HA ASN 66 HA ASN 66 8.030 8.055 4.916 472 HB2 ASN 66 HB2 ASN 66 7.213 6.880 2.265 473 HB3 ASN 66 HB1 ASN 66 6.032 7.325 3.491 474 HD21 ASN 66 HD21 ASN 66 8.249 8.449 1.105 475 HD22 ASN 66 HD22 ASN 66 7.821 10.121 1.181 476 H THR 67 HN THR 67 5.804 6.275 4.957 477 HA THR 67 HA THR 67 7.066 4.183 6.519 478 HB THR 67 HB THR 67 4.115 4.812 6.431 479 HG1 THR 67 HG1 THR 67 4.687 6.578 7.459 480 HG21 THR 67 HG21 THR 67 4.623 2.630 7.329 481 HG22 THR 67 HG22 THR 67 4.212 3.701 8.670 482 HG23 THR 67 HG23 THR 67 5.900 3.296 8.343 483 HA PRO 68 HA PRO 68 6.196 1.076 3.417 484 HB2 PRO 68 HB2 PRO 68 6.991 -0.796 5.453 485 HB3 PRO 68 HB1 PRO 68 7.846 -0.372 3.974 486 HG2 PRO 68 HG2 PRO 68 8.572 0.286 6.598 487 HG3 PRO 68 HG1 PRO 68 9.270 0.956 5.116 488 HD2 PRO 68 HD2 PRO 68 7.460 2.162 7.044 489 HD3 PRO 68 HD1 PRO 68 8.424 2.930 5.778 490 H THR 69 HN THR 69 4.071 0.532 3.196 491 HA THR 69 HA THR 69 2.784 -0.713 5.530 492 HB THR 69 HB THR 69 0.644 0.331 4.907 493 HG1 THR 69 HG1 THR 69 2.227 1.408 2.832 494 HG21 THR 69 HG21 THR 69 1.190 2.681 5.514 495 HG22 THR 69 HG22 THR 69 2.900 2.287 5.340 496 HG23 THR 69 HG23 THR 69 1.933 1.490 6.581 497 H CYS 70 HN CYS 70 1.406 -2.408 5.142 498 HA CYS 70 HA CYS 70 1.392 -3.510 2.418 499 HB2 CYS 70 HB2 CYS 70 2.080 -5.101 4.095 500 HB3 CYS 70 HB1 CYS 70 0.687 -4.720 5.103 501 H CYS 71 HN CYS 71 -0.272 -2.873 1.224 502 HA CYS 71 HA CYS 71 -2.794 -2.128 2.517 503 HB2 CYS 71 HB2 CYS 71 -1.840 -1.724 -0.327 504 HB3 CYS 71 HB1 CYS 71 -3.327 -1.080 0.356 505 H GLU 72 HN GLU 72 -4.651 -3.209 2.232 506 HA GLU 72 HA GLU 72 -4.566 -5.838 1.166 507 HB2 GLU 72 HB2 GLU 72 -5.957 -5.707 2.993 508 HB3 GLU 72 HB1 GLU 72 -6.539 -4.102 2.580 509 HG2 GLU 72 HG2 GLU 72 -8.031 -4.941 1.002 510 HG3 GLU 72 HG1 GLU 72 -7.286 -6.535 1.013 511 H ASP 73 HN ASP 73 -5.378 -2.711 0.003 512 HA ASP 73 HA ASP 73 -5.363 -3.702 -2.685 513 HB2 ASP 73 HB2 ASP 73 -7.813 -3.908 -1.847 514 HB3 ASP 73 HB1 ASP 73 -7.834 -2.152 -1.933 515 H VAL 74 HN VAL 74 -5.514 -1.804 -4.241 516 HA VAL 74 HA VAL 74 -4.926 0.771 -2.969 517 HB VAL 74 HB VAL 74 -3.025 1.223 -4.365 518 HG11 VAL 74 HG11 VAL 74 -1.390 -0.406 -3.557 519 HG12 VAL 74 HG12 VAL 74 -2.705 -1.492 -3.106 520 HG13 VAL 74 HG13 VAL 74 -2.527 0.064 -2.291 521 HG21 VAL 74 HG21 VAL 74 -2.062 -0.404 -5.907 522 HG22 VAL 74 HG22 VAL 74 -3.707 0.028 -6.374 523 HG23 VAL 74 HG23 VAL 74 -3.393 -1.511 -5.572 524 H GLU 75 HN GLU 75 -5.284 2.585 -4.370 525 HA GLU 75 HA GLU 75 -6.586 1.952 -6.930 526 HB2 GLU 75 HB2 GLU 75 -7.427 3.976 -4.870 527 HB3 GLU 75 HB1 GLU 75 -7.885 4.141 -6.558 528 HG2 GLU 75 HG2 GLU 75 -8.934 1.918 -6.452 529 HG3 GLU 75 HG1 GLU 75 -8.536 1.847 -4.742 530 H ASP 76 HN ASP 76 -6.591 3.886 -8.404 531 HA ASP 76 HA ASP 76 -5.281 5.076 -9.840 532 HB2 ASP 76 HB2 ASP 76 -4.126 6.168 -7.255 533 HB3 ASP 76 HB1 ASP 76 -3.800 6.827 -8.851 534 H ASP 77 HN ASP 77 -2.462 5.851 -9.354 535 HA ASP 77 HA ASP 77 -1.246 3.299 -9.932 536 HB2 ASP 77 HB2 ASP 77 -0.274 6.126 -9.914 537 HB3 ASP 77 HB1 ASP 77 0.903 4.816 -9.865 538 H GLY 78 HN GLY 78 -2.384 3.885 -7.232 539 HA2 GLY 78 HA2 GLY 78 -1.698 2.754 -5.252 540 HA3 GLY 78 HA1 GLY 78 -0.024 3.044 -5.702 541 H LEU 79 HN LEU 79 -2.202 5.676 -6.062 542 HA LEU 79 HA LEU 79 -0.906 7.199 -4.008 543 HB2 LEU 79 HB2 LEU 79 -3.268 7.753 -5.796 544 HB3 LEU 79 HB1 LEU 79 -2.664 8.902 -4.619 545 HG LEU 79 HG LEU 79 -1.948 9.374 -6.922 546 HD11 LEU 79 HD11 LEU 79 -0.612 10.166 -5.057 547 HD12 LEU 79 HD12 LEU 79 0.417 9.752 -6.429 548 HD13 LEU 79 HD13 LEU 79 0.296 8.654 -5.054 549 HD21 LEU 79 HD21 LEU 79 -0.367 6.831 -6.729 550 HD22 LEU 79 HD22 LEU 79 -0.266 8.022 -8.026 551 HD23 LEU 79 HD23 LEU 79 -1.756 7.112 -7.778 552 H VAL 80 HN VAL 80 -3.679 5.218 -4.269 553 HA VAL 80 HA VAL 80 -4.590 6.104 -1.616 554 HB VAL 80 HB VAL 80 -6.293 5.002 -3.855 555 HG11 VAL 80 HG11 VAL 80 -7.070 6.041 -1.136 556 HG12 VAL 80 HG12 VAL 80 -7.138 4.364 -1.672 557 HG13 VAL 80 HG13 VAL 80 -8.194 5.569 -2.410 558 HG21 VAL 80 HG21 VAL 80 -6.070 7.807 -2.780 559 HG22 VAL 80 HG22 VAL 80 -7.291 7.257 -3.926 560 HG23 VAL 80 HG23 VAL 80 -5.587 7.247 -4.380 561 H GLY 81 HN GLY 81 -4.211 4.572 -0.149 562 HA2 GLY 81 HA2 GLY 81 -4.149 1.776 -1.088 563 HA3 GLY 81 HA1 GLY 81 -3.244 2.385 0.288 564 H ILE 82 HN ILE 82 -5.473 0.311 -0.251 565 HA ILE 82 HA ILE 82 -7.415 1.208 1.744 566 HB ILE 82 HB ILE 82 -7.418 -0.954 -0.332 567 HG12 ILE 82 HG12 ILE 82 -9.717 -0.023 -0.738 568 HG13 ILE 82 HG11 ILE 82 -9.372 1.205 0.476 569 HG21 ILE 82 HG21 ILE 82 -8.069 -2.254 1.488 570 HG22 ILE 82 HG22 ILE 82 -9.587 -1.760 0.732 571 HG23 ILE 82 HG23 ILE 82 -9.019 -0.954 2.194 572 HD11 ILE 82 HD11 ILE 82 -9.031 2.066 -1.759 573 HD12 ILE 82 HD12 ILE 82 -7.867 0.779 -2.089 574 HD13 ILE 82 HD13 ILE 82 -7.507 2.004 -0.870 575 H ASN 83 HN ASN 83 -7.100 0.670 3.775 576 HA ASN 83 HA ASN 83 -6.588 -0.506 5.647 577 HB2 ASN 83 HB2 ASN 83 -7.005 -2.771 3.710 578 HB3 ASN 83 HB1 ASN 83 -6.688 -3.046 5.416 579 HD21 ASN 83 HD21 ASN 83 -9.042 -3.699 3.848 580 HD22 ASN 83 HD22 ASN 83 -10.355 -2.872 4.605 581 H CYS 84 HN CYS 84 -4.479 0.664 4.827 582 HA CYS 84 HA CYS 84 -2.326 -1.219 4.276 583 HB2 CYS 84 HB2 CYS 84 -2.214 1.788 4.531 584 HB3 CYS 84 HB1 CYS 84 -0.960 0.744 3.875 585 H THR 85 HN THR 85 -1.500 -2.226 5.965 586 HA THR 85 HA THR 85 -1.254 -0.829 8.525 587 HB THR 85 HB THR 85 -0.666 -3.723 7.856 588 HG1 THR 85 HG1 THR 85 -2.983 -2.616 7.909 589 HG21 THR 85 HG21 THR 85 -0.949 -2.295 10.505 590 HG22 THR 85 HG22 THR 85 0.534 -2.973 9.834 591 HG23 THR 85 HG23 THR 85 -0.788 -4.041 10.305 592 HA PRO 86 HA PRO 86 3.034 0.109 7.634 593 HB2 PRO 86 HB2 PRO 86 3.169 0.408 10.579 594 HB3 PRO 86 HB1 PRO 86 3.571 1.575 9.315 595 HG2 PRO 86 HG2 PRO 86 1.366 1.873 10.769 596 HG3 PRO 86 HG1 PRO 86 1.349 2.213 9.028 597 HD2 PRO 86 HD2 PRO 86 0.381 -0.217 10.487 598 HD3 PRO 86 HD1 PRO 86 -0.396 0.698 9.183 599 H ILE 87 HN ILE 87 4.504 -1.436 7.298 600 HA ILE 87 HA ILE 87 4.417 -3.783 9.014 601 HB ILE 87 HB ILE 87 5.793 -4.777 7.095 602 HG12 ILE 87 HG12 ILE 87 4.568 -2.428 5.641 603 HG13 ILE 87 HG11 ILE 87 6.279 -2.599 6.002 604 HG21 ILE 87 HG21 ILE 87 3.511 -5.405 7.609 605 HG22 ILE 87 HG22 ILE 87 3.747 -5.322 5.861 606 HG23 ILE 87 HG23 ILE 87 2.907 -4.017 6.701 607 HD11 ILE 87 HD11 ILE 87 4.635 -4.385 4.228 608 HD12 ILE 87 HD12 ILE 87 6.331 -4.645 4.634 609 HD13 ILE 87 HD13 ILE 87 5.853 -3.215 3.716 610 HA PRO 88 HA PRO 88 8.377 -2.837 10.739 611 HB2 PRO 88 HB2 PRO 88 8.611 -5.704 11.276 612 HB3 PRO 88 HB1 PRO 88 8.479 -4.370 12.416 613 HG2 PRO 88 HG2 PRO 88 6.486 -6.114 12.071 614 HG3 PRO 88 HG1 PRO 88 6.172 -4.393 12.368 615 HD2 PRO 88 HD2 PRO 88 6.181 -5.885 9.770 616 HD3 PRO 88 HD1 PRO 88 4.994 -4.728 10.390 617 H LEU 89 HN LEU 89 10.606 -3.311 10.492 618 HA LEU 89 HA LEU 89 11.287 -4.231 7.821 619 HB2 LEU 89 HB2 LEU 89 13.090 -3.135 9.978 620 HB3 LEU 89 HB1 LEU 89 13.467 -3.288 8.272 621 HG LEU 89 HG LEU 89 11.392 -1.428 9.439 622 HD11 LEU 89 HD11 LEU 89 13.649 -0.725 9.982 623 HD12 LEU 89 HD12 LEU 89 12.947 0.343 8.765 624 HD13 LEU 89 HD13 LEU 89 14.123 -0.883 8.291 625 HD21 LEU 89 HD21 LEU 89 11.276 -0.500 7.181 626 HD22 LEU 89 HD22 LEU 89 10.790 -2.193 7.206 627 HD23 LEU 89 HD23 LEU 89 12.387 -1.742 6.610 628 H ILE 90 HN ILE 90 10.455 -6.128 9.941 629 HA ILE 90 HA ILE 90 12.882 -7.756 10.078 630 HB ILE 90 HB ILE 90 12.074 -8.482 12.385 631 HG12 ILE 90 HG12 ILE 90 10.549 -5.872 12.177 632 HG13 ILE 90 HG11 ILE 90 9.819 -7.471 12.230 633 HG21 ILE 90 HG21 ILE 90 13.181 -6.565 13.478 634 HG22 ILE 90 HG22 ILE 90 13.089 -5.672 11.957 635 HG23 ILE 90 HG23 ILE 90 14.061 -7.141 12.062 636 HD11 ILE 90 HD11 ILE 90 11.465 -6.229 14.420 637 HD12 ILE 90 HD12 ILE 90 10.669 -7.802 14.476 638 HD13 ILE 90 HD13 ILE 90 9.705 -6.328 14.381 Start of MODEL 9 1 H1 GLY 1 HT1 GLY 1 8.154 -11.854 -7.473 2 H2 GLY 1 HT2 GLY 1 9.398 -11.404 -6.421 3 H3 GLY 1 HT3 GLY 1 8.598 -10.230 -7.339 4 HA2 GLY 1 HA1 GLY 1 7.352 -11.877 -5.215 5 HA3 GLY 1 HA2 GLY 1 7.862 -10.204 -5.029 6 H SER 2 HN SER 2 5.253 -10.899 -4.528 7 HA SER 2 HA SER 2 3.605 -10.484 -6.840 8 HB2 SER 2 HB2 SER 2 2.901 -10.358 -3.895 9 HB3 SER 2 HB1 SER 2 1.750 -10.451 -5.228 10 HG SER 2 HG SER 2 2.075 -12.508 -4.401 11 H GLY 3 HN GLY 3 4.757 -8.501 -7.522 12 HA2 GLY 3 HA2 GLY 3 4.361 -6.219 -7.932 13 HA3 GLY 3 HA1 GLY 3 3.438 -6.130 -6.439 14 H TRP 4 HN TRP 4 4.797 -6.570 -4.426 15 HA TRP 4 HA TRP 4 7.487 -5.413 -4.736 16 HB2 TRP 4 HB2 TRP 4 5.392 -4.927 -2.638 17 HB3 TRP 4 HB1 TRP 4 7.099 -4.702 -2.268 18 HD1 TRP 4 HD1 TRP 4 4.183 -2.993 -3.860 19 HE1 TRP 4 HE1 TRP 4 4.925 -0.714 -4.800 20 HE3 TRP 4 HE3 TRP 4 9.244 -3.579 -3.488 21 HZ2 TRP 4 HZ2 TRP 4 7.344 0.643 -5.330 22 HZ3 TRP 4 HZ3 TRP 4 10.704 -1.746 -4.237 23 HH2 TRP 4 HH2 TRP 4 9.773 0.323 -5.138 24 H GLU 5 HN GLU 5 9.117 -6.252 -3.423 25 HA GLU 5 HA GLU 5 8.956 -9.012 -2.885 26 HB2 GLU 5 HB2 GLU 5 10.981 -6.947 -2.001 27 HB3 GLU 5 HB1 GLU 5 11.176 -8.681 -1.780 28 HG2 GLU 5 HG2 GLU 5 11.028 -8.965 -4.234 29 HG3 GLU 5 HG1 GLU 5 10.970 -7.210 -4.396 30 H SER 6 HN SER 6 7.764 -9.860 -1.346 31 HA SER 6 HA SER 6 7.378 -8.376 1.152 32 HB2 SER 6 HB2 SER 6 5.795 -10.686 -0.003 33 HB3 SER 6 HB1 SER 6 5.408 -9.815 1.481 34 HG SER 6 HG SER 6 5.588 -8.625 -1.095 35 H LYS 7 HN LYS 7 9.751 -9.962 0.442 36 HA LYS 7 HA LYS 7 9.735 -12.452 1.761 37 HB2 LYS 7 HB2 LYS 7 12.186 -12.327 1.608 38 HB3 LYS 7 HB1 LYS 7 11.411 -11.915 0.090 39 HG2 LYS 7 HG2 LYS 7 13.008 -10.292 0.188 40 HG3 LYS 7 HG1 LYS 7 11.670 -9.469 0.983 41 HD2 LYS 7 HD2 LYS 7 13.644 -9.085 2.276 42 HD3 LYS 7 HD1 LYS 7 12.605 -10.194 3.173 43 HE2 LYS 7 HE2 LYS 7 13.940 -12.077 2.457 44 HE3 LYS 7 HE1 LYS 7 14.932 -11.025 1.453 45 HZ1 LYS 7 HZ1 LYS 7 15.973 -11.594 3.592 46 HZ2 LYS 7 HZ2 LYS 7 14.712 -10.810 4.404 47 HZ3 LYS 7 HZ3 LYS 7 15.749 -9.928 3.403 48 H THR 8 HN THR 8 9.821 -9.264 2.946 49 HA THR 8 HA THR 8 11.089 -9.758 5.422 50 HB THR 8 HB THR 8 10.875 -7.487 4.611 51 HG1 THR 8 HG1 THR 8 9.160 -7.303 6.798 52 HG21 THR 8 HG21 THR 8 8.825 -6.322 4.351 53 HG22 THR 8 HG22 THR 8 7.908 -7.634 5.082 54 HG23 THR 8 HG23 THR 8 8.640 -7.853 3.494 55 H GLY 9 HN GLY 9 8.075 -10.704 4.174 56 HA2 GLY 9 HA2 GLY 9 6.496 -12.101 5.107 57 HA3 GLY 9 HA1 GLY 9 7.441 -12.107 6.586 58 H SER 10 HN SER 10 6.586 -9.046 5.350 59 HA SER 10 HA SER 10 4.961 -8.637 7.730 60 HB2 SER 10 HB2 SER 10 6.034 -6.530 5.854 61 HB3 SER 10 HB1 SER 10 5.490 -6.321 7.519 62 HG SER 10 HG SER 10 7.322 -7.159 8.255 63 H CYS 11 HN CYS 11 4.458 -9.188 4.442 64 HA CYS 11 HA CYS 11 1.768 -8.046 4.643 65 HB2 CYS 11 HB2 CYS 11 3.258 -6.426 3.443 66 HB3 CYS 11 HB1 CYS 11 3.527 -7.660 2.217 67 H ASN 12 HN ASN 12 0.196 -9.189 3.585 68 HA ASN 12 HA ASN 12 0.995 -11.834 2.656 69 HB2 ASN 12 HB2 ASN 12 -1.351 -12.454 2.901 70 HB3 ASN 12 HB1 ASN 12 -0.749 -11.711 4.375 71 HD21 ASN 12 HD21 ASN 12 -1.498 -9.644 4.940 72 HD22 ASN 12 HD22 ASN 12 -2.947 -8.991 4.257 73 H THR 13 HN THR 13 -0.340 -8.887 1.394 74 HA THR 13 HA THR 13 -1.446 -10.205 -0.948 75 HB THR 13 HB THR 13 -2.132 -7.842 -1.545 76 HG1 THR 13 HG1 THR 13 -1.933 -6.314 0.174 77 HG21 THR 13 HG21 THR 13 -3.881 -7.747 0.210 78 HG22 THR 13 HG22 THR 13 -3.012 -8.997 1.107 79 HG23 THR 13 HG23 THR 13 -3.693 -9.358 -0.479 80 H GLY 14 HN GLY 14 1.284 -8.218 -0.070 81 HA2 GLY 14 HA2 GLY 14 3.279 -8.125 -1.340 82 HA3 GLY 14 HA1 GLY 14 2.360 -8.583 -2.768 83 H LYS 15 HN LYS 15 0.412 -6.384 -1.496 84 HA LYS 15 HA LYS 15 1.510 -4.250 -3.129 85 HB2 LYS 15 HB2 LYS 15 -1.111 -4.510 -1.653 86 HB3 LYS 15 HB1 LYS 15 -0.629 -3.054 -2.511 87 HG2 LYS 15 HG2 LYS 15 -0.333 -4.639 -4.534 88 HG3 LYS 15 HG1 LYS 15 -1.354 -5.737 -3.604 89 HD2 LYS 15 HD2 LYS 15 -3.101 -4.054 -3.496 90 HD3 LYS 15 HD1 LYS 15 -2.064 -2.898 -4.330 91 HE2 LYS 15 HE2 LYS 15 -1.978 -4.519 -6.238 92 HE3 LYS 15 HE1 LYS 15 -3.250 -5.429 -5.425 93 HZ1 LYS 15 HZ1 LYS 15 -4.118 -3.905 -7.112 94 HZ2 LYS 15 HZ2 LYS 15 -3.457 -2.592 -6.282 95 HZ3 LYS 15 HZ3 LYS 15 -4.696 -3.505 -5.568 96 H LEU 16 HN LEU 16 3.304 -3.697 -1.930 97 HA LEU 16 HA LEU 16 2.876 -2.510 0.691 98 HB2 LEU 16 HB2 LEU 16 5.326 -3.244 -0.896 99 HB3 LEU 16 HB1 LEU 16 5.424 -2.233 0.524 100 HG LEU 16 HG LEU 16 4.391 -4.081 1.841 101 HD11 LEU 16 HD11 LEU 16 4.813 -5.620 -0.697 102 HD12 LEU 16 HD12 LEU 16 3.271 -5.250 0.076 103 HD13 LEU 16 HD13 LEU 16 4.422 -6.327 0.871 104 HD21 LEU 16 HD21 LEU 16 6.792 -3.742 1.875 105 HD22 LEU 16 HD22 LEU 16 6.967 -4.712 0.413 106 HD23 LEU 16 HD23 LEU 16 6.418 -5.464 1.911 107 H ALA 17 HN ALA 17 2.550 -0.374 0.864 108 HA ALA 17 HA ALA 17 3.613 1.346 -1.279 109 HB1 ALA 17 HB1 ALA 17 0.914 1.611 0.038 110 HB2 ALA 17 HB2 ALA 17 1.222 1.101 -1.623 111 HB3 ALA 17 HB3 ALA 17 1.608 2.749 -1.118 112 H CYS 18 HN CYS 18 4.411 3.308 -0.687 113 HA CYS 18 HA CYS 18 4.954 3.782 2.108 114 HB2 CYS 18 HB2 CYS 18 5.503 5.526 -0.307 115 HB3 CYS 18 HB1 CYS 18 6.173 5.749 1.304 116 H CYS 19 HN CYS 19 3.405 4.641 3.377 117 HA CYS 19 HA CYS 19 1.460 6.432 2.094 118 HB2 CYS 19 HB2 CYS 19 0.864 4.161 3.983 119 HB3 CYS 19 HB1 CYS 19 -0.317 5.351 3.450 120 H ASP 20 HN ASP 20 0.395 7.921 3.403 121 HA ASP 20 HA ASP 20 1.819 8.583 5.888 122 HB2 ASP 20 HB2 ASP 20 1.497 10.360 4.075 123 HB3 ASP 20 HB1 ASP 20 -0.214 10.260 4.418 124 H THR 21 HN THR 21 0.868 7.869 7.712 125 HA THR 21 HA THR 21 -1.674 6.581 7.457 126 HB THR 21 HB THR 21 -1.325 5.936 9.842 127 HG1 THR 21 HG1 THR 21 0.608 7.853 9.625 128 HG21 THR 21 HG21 THR 21 -0.574 4.520 7.985 129 HG22 THR 21 HG22 THR 21 0.521 4.404 9.361 130 HG23 THR 21 HG23 THR 21 0.971 5.373 7.956 131 H ASN 22 HN ASN 22 -0.859 9.774 8.330 132 HA ASN 22 HA ASN 22 -3.396 10.006 9.796 133 HB2 ASN 22 HB2 ASN 22 -2.597 11.966 10.812 134 HB3 ASN 22 HB1 ASN 22 -1.238 10.866 10.820 135 HD21 ASN 22 HD21 ASN 22 -2.538 13.793 9.486 136 HD22 ASN 22 HD22 ASN 22 -1.064 14.351 8.772 137 H LYS 23 HN LYS 23 -2.048 10.264 6.880 138 HA LYS 23 HA LYS 23 -3.741 12.386 5.825 139 HB2 LYS 23 HB2 LYS 23 -1.276 11.411 5.164 140 HB3 LYS 23 HB1 LYS 23 -2.290 10.601 3.985 141 HG2 LYS 23 HG2 LYS 23 -1.613 13.459 4.286 142 HG3 LYS 23 HG1 LYS 23 -1.652 12.458 2.851 143 HD2 LYS 23 HD2 LYS 23 -4.058 12.503 2.803 144 HD3 LYS 23 HD1 LYS 23 -4.108 13.386 4.331 145 HE2 LYS 23 HE2 LYS 23 -2.710 14.407 1.904 146 HE3 LYS 23 HE1 LYS 23 -4.400 14.769 2.237 147 HZ1 LYS 23 HZ1 LYS 23 -3.687 15.761 4.345 148 HZ2 LYS 23 HZ2 LYS 23 -2.987 16.539 3.015 149 HZ3 LYS 23 HZ3 LYS 23 -2.071 15.465 3.942 150 H LYS 24 HN LYS 24 -5.830 11.785 5.632 151 HA LYS 24 HA LYS 24 -6.402 9.021 4.870 152 HB2 LYS 24 HB2 LYS 24 -8.043 11.165 6.166 153 HB3 LYS 24 HB1 LYS 24 -8.755 9.681 5.554 154 HG2 LYS 24 HG2 LYS 24 -8.462 9.334 7.842 155 HG3 LYS 24 HG1 LYS 24 -7.149 8.452 7.069 156 HD2 LYS 24 HD2 LYS 24 -5.594 10.206 7.609 157 HD3 LYS 24 HD1 LYS 24 -6.896 11.213 8.243 158 HE2 LYS 24 HE2 LYS 24 -6.048 8.545 9.366 159 HE3 LYS 24 HE1 LYS 24 -5.594 10.116 10.025 160 HZ1 LYS 24 HZ1 LYS 24 -8.358 9.044 9.819 161 HZ2 LYS 24 HZ2 LYS 24 -7.949 10.574 10.413 162 HZ3 LYS 24 HZ3 LYS 24 -7.449 9.185 11.238 163 H VAL 25 HN VAL 25 -8.173 8.613 3.427 164 HA VAL 25 HA VAL 25 -8.659 10.738 1.431 165 HB VAL 25 HB VAL 25 -8.710 7.798 0.790 166 HG11 VAL 25 HG11 VAL 25 -8.474 8.560 -1.516 167 HG12 VAL 25 HG12 VAL 25 -8.444 10.232 -0.957 168 HG13 VAL 25 HG13 VAL 25 -9.897 9.256 -0.742 169 HG21 VAL 25 HG21 VAL 25 -6.478 8.022 -0.203 170 HG22 VAL 25 HG22 VAL 25 -6.452 8.278 1.542 171 HG23 VAL 25 HG23 VAL 25 -6.367 9.656 0.447 172 H GLN 26 HN GLN 26 -10.771 10.876 0.674 173 HA GLN 26 HA GLN 26 -12.727 9.837 2.537 174 HB2 GLN 26 HB2 GLN 26 -12.861 11.878 0.327 175 HB3 GLN 26 HB1 GLN 26 -14.265 11.369 1.243 176 HG2 GLN 26 HG2 GLN 26 -13.225 12.147 3.302 177 HG3 GLN 26 HG1 GLN 26 -11.796 12.637 2.395 178 HE21 GLN 26 HE21 GLN 26 -12.041 14.770 3.086 179 HE22 GLN 26 HE22 GLN 26 -13.269 15.806 2.437 180 H LYS 27 HN LYS 27 -11.798 9.476 -0.809 181 HA LYS 27 HA LYS 27 -14.113 7.836 -1.399 182 HB2 LYS 27 HB2 LYS 27 -11.687 8.467 -3.090 183 HB3 LYS 27 HB1 LYS 27 -13.132 7.636 -3.645 184 HG2 LYS 27 HG2 LYS 27 -12.972 10.485 -2.698 185 HG3 LYS 27 HG1 LYS 27 -13.159 9.944 -4.358 186 HD2 LYS 27 HD2 LYS 27 -15.126 9.413 -2.136 187 HD3 LYS 27 HD1 LYS 27 -15.277 10.702 -3.331 188 HE2 LYS 27 HE2 LYS 27 -15.201 8.974 -5.098 189 HE3 LYS 27 HE1 LYS 27 -15.247 7.737 -3.846 190 HZ1 LYS 27 HZ1 LYS 27 -17.343 9.773 -4.379 191 HZ2 LYS 27 HZ2 LYS 27 -17.375 8.669 -3.102 192 HZ3 LYS 27 HZ3 LYS 27 -17.450 8.115 -4.696 193 H SER 28 HN SER 28 -14.182 5.763 -0.930 194 HA SER 28 HA SER 28 -11.714 4.313 -0.371 195 HB2 SER 28 HB2 SER 28 -14.579 3.394 -0.020 196 HB3 SER 28 HB1 SER 28 -13.134 2.645 0.660 197 HG SER 28 HG SER 28 -14.599 4.746 1.580 198 H THR 29 HN THR 29 -11.631 4.800 -2.893 199 HA THR 29 HA THR 29 -13.007 2.750 -4.441 200 HB THR 29 HB THR 29 -11.092 4.861 -5.450 201 HG1 THR 29 HG1 THR 29 -13.694 5.065 -4.529 202 HG21 THR 29 HG21 THR 29 -11.571 3.028 -7.009 203 HG22 THR 29 HG22 THR 29 -12.285 4.540 -7.568 204 HG23 THR 29 HG23 THR 29 -13.301 3.311 -6.815 205 H GLY 30 HN GLY 30 -12.025 0.954 -5.205 206 HA2 GLY 30 HA2 GLY 30 -9.110 0.750 -4.793 207 HA3 GLY 30 HA1 GLY 30 -10.210 -0.572 -4.432 208 H GLU 31 HN GLU 31 -8.085 -0.962 -6.079 209 HA GLU 31 HA GLU 31 -9.139 -0.938 -8.808 210 HB2 GLU 31 HB2 GLU 31 -6.947 0.025 -8.613 211 HB3 GLU 31 HB1 GLU 31 -6.364 -1.365 -7.705 212 HG2 GLU 31 HG2 GLU 31 -5.565 -1.450 -9.976 213 HG3 GLU 31 HG1 GLU 31 -6.688 -2.766 -9.642 214 H GLU 32 HN GLU 32 -7.613 -3.117 -6.433 215 HA GLU 32 HA GLU 32 -8.586 -5.408 -7.956 216 HB2 GLU 32 HB2 GLU 32 -6.723 -5.177 -5.599 217 HB3 GLU 32 HB1 GLU 32 -7.333 -6.723 -6.173 218 HG2 GLU 32 HG2 GLU 32 -5.806 -4.779 -7.881 219 HG3 GLU 32 HG1 GLU 32 -5.068 -6.117 -7.004 220 H SER 33 HN SER 33 -9.055 -3.711 -4.933 221 HA SER 33 HA SER 33 -10.674 -5.645 -3.660 222 HB2 SER 33 HB2 SER 33 -11.428 -3.716 -2.237 223 HB3 SER 33 HB1 SER 33 -9.679 -3.907 -2.342 224 HG SER 33 HG SER 33 -9.583 -2.201 -3.771 225 H GLY 34 HN GLY 34 -11.334 -3.836 -6.398 226 HA2 GLY 34 HA2 GLY 34 -14.101 -3.337 -6.091 227 HA3 GLY 34 HA1 GLY 34 -13.253 -3.524 -7.621 228 H LEU 35 HN LEU 35 -12.409 -6.024 -7.708 229 HA LEU 35 HA LEU 35 -14.870 -7.583 -7.704 230 HB2 LEU 35 HB2 LEU 35 -12.130 -8.193 -8.811 231 HB3 LEU 35 HB1 LEU 35 -13.529 -9.237 -8.976 232 HG LEU 35 HG LEU 35 -13.271 -6.458 -10.133 233 HD11 LEU 35 HD11 LEU 35 -13.224 -7.618 -12.291 234 HD12 LEU 35 HD12 LEU 35 -13.210 -9.168 -11.451 235 HD13 LEU 35 HD13 LEU 35 -11.851 -8.058 -11.276 236 HD21 LEU 35 HD21 LEU 35 -15.571 -6.950 -9.552 237 HD22 LEU 35 HD22 LEU 35 -15.471 -8.505 -10.379 238 HD23 LEU 35 HD23 LEU 35 -15.363 -7.006 -11.302 239 H LEU 36 HN LEU 36 -11.958 -7.264 -5.917 240 HA LEU 36 HA LEU 36 -12.051 -9.893 -4.725 241 HB2 LEU 36 HB2 LEU 36 -10.086 -8.071 -5.140 242 HB3 LEU 36 HB1 LEU 36 -10.444 -7.777 -3.454 243 HG LEU 36 HG LEU 36 -9.772 -10.517 -4.518 244 HD11 LEU 36 HD11 LEU 36 -7.499 -10.131 -3.712 245 HD12 LEU 36 HD12 LEU 36 -7.913 -8.458 -3.339 246 HD13 LEU 36 HD13 LEU 36 -7.919 -9.017 -5.012 247 HD21 LEU 36 HD21 LEU 36 -9.705 -9.329 -1.747 248 HD22 LEU 36 HD22 LEU 36 -9.207 -10.965 -2.178 249 HD23 LEU 36 HD23 LEU 36 -10.893 -10.479 -2.357 250 H HIS 37 HN HIS 37 -12.557 -10.329 -2.534 251 HA HIS 37 HA HIS 37 -14.791 -8.872 -1.565 252 HB2 HIS 37 HB2 HIS 37 -13.223 -11.177 -0.447 253 HB3 HIS 37 HB1 HIS 37 -14.554 -10.445 0.441 254 HD1 HIS 37 HD1 HIS 37 -16.799 -10.206 -1.340 255 HD2 HIS 37 HD2 HIS 37 -14.099 -13.342 -1.779 256 HE1 HIS 37 HE1 HIS 37 -18.032 -11.999 -2.605 257 HE2 HIS 37 HE2 HIS 37 -16.427 -13.935 -2.729 258 H THR 38 HN THR 38 -11.683 -7.961 -1.368 259 HA THR 38 HA THR 38 -11.610 -7.060 1.356 260 HB THR 38 HB THR 38 -9.663 -5.635 0.410 261 HG1 THR 38 HG1 THR 38 -8.885 -6.850 -1.585 262 HG21 THR 38 HG21 THR 38 -8.171 -7.599 0.408 263 HG22 THR 38 HG22 THR 38 -9.583 -8.652 0.328 264 HG23 THR 38 HG23 THR 38 -9.319 -7.636 1.745 265 H GLY 39 HN GLY 39 -13.152 -6.025 -1.458 266 HA2 GLY 39 HA2 GLY 39 -13.323 -3.244 -0.535 267 HA3 GLY 39 HA1 GLY 39 -13.827 -3.840 -2.110 268 H ASP 40 HN ASP 40 -14.922 -6.067 0.020 269 HA ASP 40 HA ASP 40 -17.630 -5.275 -0.239 270 HB2 ASP 40 HB2 ASP 40 -16.206 -7.477 1.175 271 HB3 ASP 40 HB1 ASP 40 -17.853 -7.111 1.680 272 H VAL 41 HN VAL 41 -15.222 -4.820 2.219 273 HA VAL 41 HA VAL 41 -17.093 -3.755 4.135 274 HB VAL 41 HB VAL 41 -14.996 -3.022 5.356 275 HG11 VAL 41 HG11 VAL 41 -16.175 -5.088 5.902 276 HG12 VAL 41 HG12 VAL 41 -14.433 -5.294 6.078 277 HG13 VAL 41 HG13 VAL 41 -15.261 -5.948 4.664 278 HG21 VAL 41 HG21 VAL 41 -13.649 -4.653 3.205 279 HG22 VAL 41 HG22 VAL 41 -12.877 -4.002 4.650 280 HG23 VAL 41 HG23 VAL 41 -13.510 -2.909 3.420 281 H LEU 42 HN LEU 42 -17.590 -1.656 4.468 282 HA LEU 42 HA LEU 42 -16.479 0.324 2.661 283 HB2 LEU 42 HB2 LEU 42 -18.762 0.359 4.609 284 HB3 LEU 42 HB1 LEU 42 -18.236 1.768 3.735 285 HG LEU 42 HG LEU 42 -19.363 -0.752 2.529 286 HD11 LEU 42 HD11 LEU 42 -21.039 0.633 3.608 287 HD12 LEU 42 HD12 LEU 42 -21.215 0.692 1.856 288 HD13 LEU 42 HD13 LEU 42 -20.475 2.043 2.713 289 HD21 LEU 42 HD21 LEU 42 -18.390 1.774 1.198 290 HD22 LEU 42 HD22 LEU 42 -19.283 0.482 0.397 291 HD23 LEU 42 HD23 LEU 42 -17.679 0.167 1.055 292 H ASP 43 HN ASP 43 -15.655 -1.031 5.451 293 HA ASP 43 HA ASP 43 -14.876 1.354 6.914 294 HB2 ASP 43 HB2 ASP 43 -14.830 -1.582 7.500 295 HB3 ASP 43 HB1 ASP 43 -13.834 -0.484 8.450 296 H GLN 44 HN GLN 44 -13.623 -0.242 4.356 297 HA GLN 44 HA GLN 44 -10.997 -0.755 4.672 298 HB2 GLN 44 HB2 GLN 44 -11.910 1.100 2.495 299 HB3 GLN 44 HB1 GLN 44 -10.589 -0.043 2.443 300 HG2 GLN 44 HG2 GLN 44 -12.098 -1.892 2.413 301 HG3 GLN 44 HG1 GLN 44 -13.481 -0.825 2.661 302 HE21 GLN 44 HE21 GLN 44 -11.212 -2.084 0.395 303 HE22 GLN 44 HE22 GLN 44 -11.915 -1.387 -1.021 304 H VAL 45 HN VAL 45 -9.188 0.297 5.154 305 HA VAL 45 HA VAL 45 -9.405 3.071 6.034 306 HB VAL 45 HB VAL 45 -7.028 1.210 6.265 307 HG11 VAL 45 HG11 VAL 45 -7.670 3.797 7.678 308 HG12 VAL 45 HG12 VAL 45 -6.443 3.569 6.432 309 HG13 VAL 45 HG13 VAL 45 -6.269 2.770 7.994 310 HG21 VAL 45 HG21 VAL 45 -7.722 0.832 8.568 311 HG22 VAL 45 HG22 VAL 45 -8.973 0.304 7.444 312 HG23 VAL 45 HG23 VAL 45 -9.152 1.829 8.314 313 H ALA 46 HN ALA 46 -9.335 4.389 4.357 314 HA ALA 46 HA ALA 46 -7.352 3.940 2.251 315 HB1 ALA 46 HB1 ALA 46 -9.668 4.236 1.546 316 HB2 ALA 46 HB2 ALA 46 -8.657 5.561 0.965 317 HB3 ALA 46 HB3 ALA 46 -9.722 5.802 2.352 318 H ILE 47 HN ILE 47 -5.474 4.818 2.739 319 HA ILE 47 HA ILE 47 -5.469 7.605 3.681 320 HB ILE 47 HB ILE 47 -3.132 7.113 4.522 321 HG12 ILE 47 HG12 ILE 47 -4.070 4.251 4.210 322 HG13 ILE 47 HG11 ILE 47 -2.766 5.011 3.303 323 HG21 ILE 47 HG21 ILE 47 -5.374 5.627 5.882 324 HG22 ILE 47 HG22 ILE 47 -5.114 7.370 5.970 325 HG23 ILE 47 HG23 ILE 47 -3.908 6.262 6.642 326 HD11 ILE 47 HD11 ILE 47 -1.876 3.618 5.061 327 HD12 ILE 47 HD12 ILE 47 -2.810 4.499 6.268 328 HD13 ILE 47 HD13 ILE 47 -1.515 5.311 5.390 329 H GLN 48 HN GLN 48 -3.652 8.897 2.914 330 HA GLN 48 HA GLN 48 -3.265 8.498 0.080 331 HB2 GLN 48 HB2 GLN 48 -2.736 10.673 2.020 332 HB3 GLN 48 HB1 GLN 48 -1.686 10.597 0.615 333 HG2 GLN 48 HG2 GLN 48 -4.670 10.650 0.498 334 HG3 GLN 48 HG1 GLN 48 -3.643 12.067 0.330 335 HE21 GLN 48 HE21 GLN 48 -4.814 9.177 -1.146 336 HE22 GLN 48 HE22 GLN 48 -4.196 9.483 -2.729 337 H CYS 49 HN CYS 49 -1.491 8.195 -0.968 338 HA CYS 49 HA CYS 49 0.875 7.294 0.490 339 HB2 CYS 49 HB2 CYS 49 -0.536 5.590 -1.571 340 HB3 CYS 49 HB1 CYS 49 0.894 5.164 -0.649 341 H THR 50 HN THR 50 2.678 6.818 -1.027 342 HA THR 50 HA THR 50 2.508 7.825 -3.699 343 HB THR 50 HB THR 50 2.622 9.969 -2.574 344 HG1 THR 50 HG1 THR 50 3.850 9.703 -4.518 345 HG21 THR 50 HG21 THR 50 3.617 9.262 -0.470 346 HG22 THR 50 HG22 THR 50 4.546 10.582 -1.179 347 HG23 THR 50 HG23 THR 50 5.142 8.927 -1.288 348 H GLN 51 HN GLN 51 4.119 6.968 -4.935 349 HA GLN 51 HA GLN 51 6.238 5.565 -3.465 350 HB2 GLN 51 HB2 GLN 51 4.277 4.288 -4.759 351 HB3 GLN 51 HB1 GLN 51 5.368 4.539 -6.117 352 HG2 GLN 51 HG2 GLN 51 6.248 3.302 -3.532 353 HG3 GLN 51 HG1 GLN 51 5.601 2.359 -4.872 354 HE21 GLN 51 HE21 GLN 51 8.289 2.503 -3.567 355 HE22 GLN 51 HE22 GLN 51 9.394 2.756 -4.868 356 H ILE 52 HN ILE 52 8.031 6.656 -3.749 357 HA ILE 52 HA ILE 52 8.711 8.279 -5.948 358 HB ILE 52 HB ILE 52 10.509 6.903 -3.943 359 HG12 ILE 52 HG12 ILE 52 9.311 9.679 -3.968 360 HG13 ILE 52 HG11 ILE 52 8.841 8.361 -2.899 361 HG21 ILE 52 HG21 ILE 52 11.717 7.649 -5.955 362 HG22 ILE 52 HG22 ILE 52 12.191 8.543 -4.511 363 HG23 ILE 52 HG23 ILE 52 11.109 9.283 -5.689 364 HD11 ILE 52 HD11 ILE 52 11.048 8.397 -1.881 365 HD12 ILE 52 HD12 ILE 52 10.263 9.972 -1.771 366 HD13 ILE 52 HD13 ILE 52 11.532 9.699 -2.965 367 HA PRO 53 HA PRO 53 9.204 5.652 -9.394 368 HB2 PRO 53 HB2 PRO 53 11.909 6.944 -9.495 369 HB3 PRO 53 HB1 PRO 53 10.766 6.643 -10.808 370 HG2 PRO 53 HG2 PRO 53 10.978 9.052 -9.619 371 HG3 PRO 53 HG1 PRO 53 9.442 8.438 -10.252 372 HD2 PRO 53 HD2 PRO 53 10.255 8.871 -7.475 373 HD3 PRO 53 HD1 PRO 53 8.637 8.573 -8.137 374 H LEU 54 HN LEU 54 9.366 3.590 -8.749 375 HA LEU 54 HA LEU 54 11.395 2.655 -7.030 376 HB2 LEU 54 HB2 LEU 54 10.324 0.451 -7.337 377 HB3 LEU 54 HB1 LEU 54 9.210 1.721 -6.875 378 HG LEU 54 HG LEU 54 8.864 1.824 -9.531 379 HD11 LEU 54 HD11 LEU 54 10.460 0.061 -10.026 380 HD12 LEU 54 HD12 LEU 54 8.823 -0.439 -10.454 381 HD13 LEU 54 HD13 LEU 54 9.575 -1.052 -8.981 382 HD21 LEU 54 HD21 LEU 54 6.887 0.427 -9.214 383 HD22 LEU 54 HD22 LEU 54 7.111 1.539 -7.864 384 HD23 LEU 54 HD23 LEU 54 7.545 -0.162 -7.687 385 H LEU 55 HN LEU 55 13.249 1.677 -7.379 386 HA LEU 55 HA LEU 55 14.042 0.982 -10.100 387 HB2 LEU 55 HB2 LEU 55 15.565 0.833 -7.492 388 HB3 LEU 55 HB1 LEU 55 16.236 0.527 -9.078 389 HG LEU 55 HG LEU 55 15.184 3.181 -8.105 390 HD11 LEU 55 HD11 LEU 55 18.001 2.245 -8.621 391 HD12 LEU 55 HD12 LEU 55 17.279 2.530 -7.038 392 HD13 LEU 55 HD13 LEU 55 17.515 3.874 -8.153 393 HD21 LEU 55 HD21 LEU 55 14.842 2.943 -10.487 394 HD22 LEU 55 HD22 LEU 55 16.507 2.406 -10.700 395 HD23 LEU 55 HD23 LEU 55 16.173 4.058 -10.184 396 H ILE 56 HN ILE 56 14.294 -1.110 -10.799 397 HA ILE 56 HA ILE 56 12.968 -3.157 -9.319 398 HB ILE 56 HB ILE 56 14.693 -3.458 -11.775 399 HG12 ILE 56 HG12 ILE 56 12.373 -3.726 -12.876 400 HG13 ILE 56 HG11 ILE 56 11.741 -2.954 -11.430 401 HG21 ILE 56 HG21 ILE 56 13.508 -5.586 -12.086 402 HG22 ILE 56 HG22 ILE 56 12.696 -5.338 -10.541 403 HG23 ILE 56 HG23 ILE 56 14.445 -5.551 -10.592 404 HD11 ILE 56 HD11 ILE 56 13.755 -1.744 -13.312 405 HD12 ILE 56 HD12 ILE 56 13.031 -0.964 -11.906 406 HD13 ILE 56 HD13 ILE 56 12.027 -1.393 -13.288 407 H GLY 57 HN GLY 57 13.793 -4.684 -8.058 408 HA2 GLY 57 HA2 GLY 57 15.522 -6.030 -7.135 409 HA3 GLY 57 HA1 GLY 57 16.703 -4.895 -7.774 410 H ILE 58 HN ILE 58 14.494 -2.895 -6.599 411 HA ILE 58 HA ILE 58 15.777 -2.799 -3.970 412 HB ILE 58 HB ILE 58 15.135 -0.763 -5.924 413 HG12 ILE 58 HG12 ILE 58 17.352 -1.228 -4.965 414 HG13 ILE 58 HG11 ILE 58 16.865 0.445 -4.726 415 HG21 ILE 58 HG21 ILE 58 13.239 -0.217 -4.553 416 HG22 ILE 58 HG22 ILE 58 14.490 1.004 -4.307 417 HG23 ILE 58 HG23 ILE 58 14.232 -0.260 -3.095 418 HD11 ILE 58 HD11 ILE 58 17.946 -0.508 -2.744 419 HD12 ILE 58 HD12 ILE 58 16.674 -1.728 -2.645 420 HD13 ILE 58 HD13 ILE 58 16.283 -0.023 -2.422 421 H ALA 59 HN ALA 59 14.601 -2.220 -2.171 422 HA ALA 59 HA ALA 59 11.940 -3.392 -2.082 423 HB1 ALA 59 HB1 ALA 59 13.957 -2.563 -0.021 424 HB2 ALA 59 HB2 ALA 59 13.481 -4.202 -0.477 425 HB3 ALA 59 HB3 ALA 59 12.349 -3.163 0.397 426 H ILE 60 HN ILE 60 10.188 -2.344 -1.060 427 HA ILE 60 HA ILE 60 9.646 0.275 -1.853 428 HB ILE 60 HB ILE 60 7.899 -1.358 -1.385 429 HG12 ILE 60 HG12 ILE 60 6.410 0.058 0.121 430 HG13 ILE 60 HG11 ILE 60 7.790 1.134 0.316 431 HG21 ILE 60 HG21 ILE 60 8.850 -2.558 0.450 432 HG22 ILE 60 HG22 ILE 60 7.294 -1.908 0.961 433 HG23 ILE 60 HG23 ILE 60 8.787 -1.129 1.482 434 HD11 ILE 60 HD11 ILE 60 6.443 0.445 -2.282 435 HD12 ILE 60 HD12 ILE 60 7.823 1.525 -2.086 436 HD13 ILE 60 HD13 ILE 60 6.264 1.949 -1.378 437 H GLU 61 HN GLU 61 10.865 -0.924 1.243 438 HA GLU 61 HA GLU 61 10.414 1.637 2.498 439 HB2 GLU 61 HB2 GLU 61 11.487 0.415 4.509 440 HB3 GLU 61 HB1 GLU 61 9.879 -0.040 3.989 441 HG2 GLU 61 HG2 GLU 61 11.100 -2.014 4.517 442 HG3 GLU 61 HG1 GLU 61 10.869 -1.966 2.780 443 H ASP 62 HN ASP 62 12.889 0.183 0.771 444 HA ASP 62 HA ASP 62 14.947 1.903 1.929 445 HB2 ASP 62 HB2 ASP 62 15.469 -0.470 1.271 446 HB3 ASP 62 HB1 ASP 62 15.173 -0.017 -0.404 447 H GLU 63 HN GLU 63 12.940 1.494 -0.880 448 HA GLU 63 HA GLU 63 14.225 3.329 -2.599 449 HB2 GLU 63 HB2 GLU 63 12.641 1.533 -3.300 450 HB3 GLU 63 HB1 GLU 63 11.330 2.450 -2.578 451 HG2 GLU 63 HG2 GLU 63 11.397 2.741 -4.982 452 HG3 GLU 63 HG1 GLU 63 11.710 4.252 -4.146 453 H CYS 64 HN CYS 64 11.589 3.635 -0.264 454 HA CYS 64 HA CYS 64 11.633 6.544 -0.732 455 HB2 CYS 64 HB2 CYS 64 9.335 6.659 -0.455 456 HB3 CYS 64 HB1 CYS 64 9.498 5.091 -1.242 457 H LYS 65 HN LYS 65 11.621 7.900 1.100 458 HA LYS 65 HA LYS 65 12.356 6.551 3.592 459 HB2 LYS 65 HB2 LYS 65 13.840 8.342 2.607 460 HB3 LYS 65 HB1 LYS 65 12.568 9.501 2.960 461 HG2 LYS 65 HG2 LYS 65 14.252 9.580 4.678 462 HG3 LYS 65 HG1 LYS 65 12.755 8.930 5.351 463 HD2 LYS 65 HD2 LYS 65 13.670 6.644 5.020 464 HD3 LYS 65 HD1 LYS 65 15.191 7.368 4.500 465 HE2 LYS 65 HE2 LYS 65 15.496 8.396 6.653 466 HE3 LYS 65 HE1 LYS 65 13.902 7.856 7.181 467 HZ1 LYS 65 HZ1 LYS 65 15.630 6.439 8.068 468 HZ2 LYS 65 HZ2 LYS 65 16.198 6.096 6.515 469 HZ3 LYS 65 HZ3 LYS 65 14.667 5.565 6.989 470 H ASN 66 HN ASN 66 9.759 6.292 2.962 471 HA ASN 66 HA ASN 66 8.408 8.042 4.912 472 HB2 ASN 66 HB2 ASN 66 7.279 6.807 2.392 473 HB3 ASN 66 HB1 ASN 66 6.291 7.556 3.636 474 HD21 ASN 66 HD21 ASN 66 8.523 8.079 1.047 475 HD22 ASN 66 HD22 ASN 66 8.303 9.787 0.925 476 H THR 67 HN THR 67 6.104 6.638 5.313 477 HA THR 67 HA THR 67 7.132 4.305 6.678 478 HB THR 67 HB THR 67 4.267 5.259 6.691 479 HG1 THR 67 HG1 THR 67 6.558 6.227 8.033 480 HG21 THR 67 HG21 THR 67 4.589 3.039 7.577 481 HG22 THR 67 HG22 THR 67 4.307 4.145 8.923 482 HG23 THR 67 HG23 THR 67 5.944 3.585 8.562 483 HA PRO 68 HA PRO 68 5.669 1.647 3.428 484 HB2 PRO 68 HB2 PRO 68 6.722 -0.624 4.419 485 HB3 PRO 68 HB1 PRO 68 7.728 0.623 3.679 486 HG2 PRO 68 HG2 PRO 68 7.344 -0.047 6.549 487 HG3 PRO 68 HG1 PRO 68 8.778 0.583 5.724 488 HD2 PRO 68 HD2 PRO 68 6.939 2.065 7.240 489 HD3 PRO 68 HD1 PRO 68 8.173 2.721 6.159 490 H THR 69 HN THR 69 3.781 0.545 3.207 491 HA THR 69 HA THR 69 2.584 -0.608 5.631 492 HB THR 69 HB THR 69 0.362 0.241 4.906 493 HG1 THR 69 HG1 THR 69 1.953 1.607 2.974 494 HG21 THR 69 HG21 THR 69 2.478 2.328 5.433 495 HG22 THR 69 HG22 THR 69 1.468 1.503 6.623 496 HG23 THR 69 HG23 THR 69 0.745 2.645 5.489 497 H CYS 70 HN CYS 70 1.222 -2.371 5.307 498 HA CYS 70 HA CYS 70 1.327 -3.618 2.659 499 HB2 CYS 70 HB2 CYS 70 1.885 -5.068 4.546 500 HB3 CYS 70 HB1 CYS 70 0.361 -4.675 5.333 501 H CYS 71 HN CYS 71 -0.276 -3.178 1.313 502 HA CYS 71 HA CYS 71 -2.852 -2.290 2.424 503 HB2 CYS 71 HB2 CYS 71 -1.763 -1.966 -0.379 504 HB3 CYS 71 HB1 CYS 71 -3.235 -1.250 0.262 505 H GLU 72 HN GLU 72 -4.638 -3.348 2.097 506 HA GLU 72 HA GLU 72 -4.657 -5.951 0.970 507 HB2 GLU 72 HB2 GLU 72 -6.768 -4.069 1.981 508 HB3 GLU 72 HB1 GLU 72 -7.191 -5.641 1.293 509 HG2 GLU 72 HG2 GLU 72 -5.331 -6.388 3.059 510 HG3 GLU 72 HG1 GLU 72 -5.915 -4.938 3.853 511 H ASP 73 HN ASP 73 -5.102 -2.790 -0.223 512 HA ASP 73 HA ASP 73 -4.916 -3.649 -2.920 513 HB2 ASP 73 HB2 ASP 73 -7.365 -4.010 -2.523 514 HB3 ASP 73 HB1 ASP 73 -7.513 -2.291 -2.180 515 H VAL 74 HN VAL 74 -4.782 -1.703 -4.375 516 HA VAL 74 HA VAL 74 -4.567 0.855 -2.994 517 HB VAL 74 HB VAL 74 -2.260 0.193 -4.788 518 HG11 VAL 74 HG11 VAL 74 -2.632 2.478 -4.051 519 HG12 VAL 74 HG12 VAL 74 -1.129 1.830 -3.387 520 HG13 VAL 74 HG13 VAL 74 -2.560 1.956 -2.369 521 HG21 VAL 74 HG21 VAL 74 -2.378 -1.643 -3.084 522 HG22 VAL 74 HG22 VAL 74 -2.188 -0.408 -1.837 523 HG23 VAL 74 HG23 VAL 74 -0.910 -0.670 -3.027 524 H GLU 75 HN GLU 75 -5.129 2.533 -4.276 525 HA GLU 75 HA GLU 75 -5.897 1.896 -7.039 526 HB2 GLU 75 HB2 GLU 75 -7.250 3.193 -4.988 527 HB3 GLU 75 HB1 GLU 75 -6.707 4.510 -6.016 528 HG2 GLU 75 HG2 GLU 75 -8.255 2.126 -7.002 529 HG3 GLU 75 HG1 GLU 75 -8.984 3.657 -6.532 530 H ASP 76 HN ASP 76 -5.579 3.600 -8.659 531 HA ASP 76 HA ASP 76 -4.209 4.888 -9.935 532 HB2 ASP 76 HB2 ASP 76 -4.592 6.427 -7.799 533 HB3 ASP 76 HB1 ASP 76 -2.886 6.093 -7.536 534 H ASP 77 HN ASP 77 -1.506 5.772 -9.292 535 HA ASP 77 HA ASP 77 -0.090 3.278 -9.586 536 HB2 ASP 77 HB2 ASP 77 0.732 6.162 -9.549 537 HB3 ASP 77 HB1 ASP 77 1.948 4.897 -9.406 538 H GLY 78 HN GLY 78 -1.554 3.905 -7.066 539 HA2 GLY 78 HA2 GLY 78 -0.988 2.830 -5.014 540 HA3 GLY 78 HA1 GLY 78 0.675 3.312 -5.250 541 H LEU 79 HN LEU 79 -1.840 5.595 -5.873 542 HA LEU 79 HA LEU 79 -0.822 7.366 -3.860 543 HB2 LEU 79 HB2 LEU 79 -3.095 7.533 -5.817 544 HB3 LEU 79 HB1 LEU 79 -2.811 8.773 -4.609 545 HG LEU 79 HG LEU 79 -1.949 9.172 -6.979 546 HD11 LEU 79 HD11 LEU 79 0.058 10.322 -6.154 547 HD12 LEU 79 HD12 LEU 79 -0.049 9.410 -4.647 548 HD13 LEU 79 HD13 LEU 79 -1.320 10.556 -5.078 549 HD21 LEU 79 HD21 LEU 79 0.291 8.307 -7.470 550 HD22 LEU 79 HD22 LEU 79 -0.917 7.025 -7.402 551 HD23 LEU 79 HD23 LEU 79 0.190 7.267 -6.050 552 H VAL 80 HN VAL 80 -3.553 5.222 -4.184 553 HA VAL 80 HA VAL 80 -4.569 6.186 -1.585 554 HB VAL 80 HB VAL 80 -6.253 5.213 -3.905 555 HG11 VAL 80 HG11 VAL 80 -8.167 5.861 -2.515 556 HG12 VAL 80 HG12 VAL 80 -7.067 6.252 -1.192 557 HG13 VAL 80 HG13 VAL 80 -7.209 4.588 -1.757 558 HG21 VAL 80 HG21 VAL 80 -5.367 7.443 -4.315 559 HG22 VAL 80 HG22 VAL 80 -5.955 7.981 -2.742 560 HG23 VAL 80 HG23 VAL 80 -7.100 7.511 -3.999 561 H GLY 81 HN GLY 81 -4.118 4.639 -0.157 562 HA2 GLY 81 HA2 GLY 81 -4.063 1.869 -1.106 563 HA3 GLY 81 HA1 GLY 81 -3.333 2.461 0.377 564 H ILE 82 HN ILE 82 -5.308 0.292 -0.351 565 HA ILE 82 HA ILE 82 -7.509 1.055 1.428 566 HB ILE 82 HB ILE 82 -7.215 -1.083 -0.661 567 HG12 ILE 82 HG12 ILE 82 -9.468 -0.201 -1.332 568 HG13 ILE 82 HG11 ILE 82 -9.294 1.034 -0.091 569 HG21 ILE 82 HG21 ILE 82 -9.270 -2.139 0.097 570 HG22 ILE 82 HG22 ILE 82 -9.327 -1.052 1.483 571 HG23 ILE 82 HG23 ILE 82 -8.017 -2.222 1.335 572 HD11 ILE 82 HD11 ILE 82 -8.722 1.901 -2.276 573 HD12 ILE 82 HD12 ILE 82 -7.493 0.648 -2.464 574 HD13 ILE 82 HD13 ILE 82 -7.312 1.882 -1.214 575 H ASN 83 HN ASN 83 -7.198 0.555 3.447 576 HA ASN 83 HA ASN 83 -6.812 -0.645 5.340 577 HB2 ASN 83 HB2 ASN 83 -6.947 -2.910 3.349 578 HB3 ASN 83 HB1 ASN 83 -6.727 -3.193 5.058 579 HD21 ASN 83 HD21 ASN 83 -8.941 -4.035 3.466 580 HD22 ASN 83 HD22 ASN 83 -10.350 -3.275 4.110 581 H CYS 84 HN CYS 84 -4.672 0.629 4.187 582 HA CYS 84 HA CYS 84 -2.392 -1.123 4.071 583 HB2 CYS 84 HB2 CYS 84 -2.495 1.895 4.180 584 HB3 CYS 84 HB1 CYS 84 -1.099 0.918 3.745 585 H THR 85 HN THR 85 -1.651 -2.005 5.869 586 HA THR 85 HA THR 85 -1.564 -0.384 8.333 587 HB THR 85 HB THR 85 -1.122 -3.370 8.040 588 HG1 THR 85 HG1 THR 85 -3.341 -2.264 7.592 589 HG21 THR 85 HG21 THR 85 -1.567 -3.376 10.470 590 HG22 THR 85 HG22 THR 85 -1.655 -1.613 10.436 591 HG23 THR 85 HG23 THR 85 -0.139 -2.427 10.055 592 HA PRO 86 HA PRO 86 2.655 0.323 7.608 593 HB2 PRO 86 HB2 PRO 86 3.313 0.985 10.219 594 HB3 PRO 86 HB1 PRO 86 2.709 2.070 8.976 595 HG2 PRO 86 HG2 PRO 86 1.325 1.004 11.286 596 HG3 PRO 86 HG1 PRO 86 0.925 2.362 10.240 597 HD2 PRO 86 HD2 PRO 86 -0.278 -0.138 10.270 598 HD3 PRO 86 HD1 PRO 86 -0.529 1.157 9.118 599 H ILE 87 HN ILE 87 4.380 -0.953 7.472 600 HA ILE 87 HA ILE 87 4.364 -3.352 9.135 601 HB ILE 87 HB ILE 87 5.833 -4.249 7.258 602 HG12 ILE 87 HG12 ILE 87 4.602 -1.943 5.751 603 HG13 ILE 87 HG11 ILE 87 6.279 -1.982 6.277 604 HG21 ILE 87 HG21 ILE 87 3.887 -4.834 5.905 605 HG22 ILE 87 HG22 ILE 87 2.965 -3.545 6.677 606 HG23 ILE 87 HG23 ILE 87 3.522 -4.921 7.629 607 HD11 ILE 87 HD11 ILE 87 6.648 -3.969 4.889 608 HD12 ILE 87 HD12 ILE 87 6.096 -2.584 3.945 609 HD13 ILE 87 HD13 ILE 87 4.972 -3.883 4.347 610 HA PRO 88 HA PRO 88 8.337 -2.257 10.831 611 HB2 PRO 88 HB2 PRO 88 8.775 -5.109 11.246 612 HB3 PRO 88 HB1 PRO 88 8.532 -3.844 12.443 613 HG2 PRO 88 HG2 PRO 88 6.705 -5.751 11.997 614 HG3 PRO 88 HG1 PRO 88 6.247 -4.092 12.425 615 HD2 PRO 88 HD2 PRO 88 6.335 -5.386 9.724 616 HD3 PRO 88 HD1 PRO 88 5.067 -4.379 10.437 617 H LEU 89 HN LEU 89 10.594 -2.703 10.548 618 HA LEU 89 HA LEU 89 11.220 -3.571 7.825 619 HB2 LEU 89 HB2 LEU 89 13.029 -2.264 9.857 620 HB3 LEU 89 HB1 LEU 89 13.327 -2.434 8.137 621 HG LEU 89 HG LEU 89 11.183 -0.706 9.381 622 HD11 LEU 89 HD11 LEU 89 12.543 1.160 8.564 623 HD12 LEU 89 HD12 LEU 89 13.782 0.022 8.037 624 HD13 LEU 89 HD13 LEU 89 13.410 0.189 9.753 625 HD21 LEU 89 HD21 LEU 89 10.861 0.145 7.107 626 HD22 LEU 89 HD22 LEU 89 10.491 -1.576 7.217 627 HD23 LEU 89 HD23 LEU 89 12.013 -1.045 6.500 628 H ILE 90 HN ILE 90 10.622 -5.412 10.092 629 HA ILE 90 HA ILE 90 13.165 -6.857 10.193 630 HB ILE 90 HB ILE 90 12.498 -7.463 12.604 631 HG12 ILE 90 HG12 ILE 90 10.964 -4.873 12.269 632 HG13 ILE 90 HG11 ILE 90 10.238 -6.457 12.524 633 HG21 ILE 90 HG21 ILE 90 13.672 -5.459 13.456 634 HG22 ILE 90 HG22 ILE 90 13.497 -4.715 11.865 635 HG23 ILE 90 HG23 ILE 90 14.466 -6.179 12.056 636 HD11 ILE 90 HD11 ILE 90 11.290 -6.579 14.722 637 HD12 ILE 90 HD12 ILE 90 10.261 -5.154 14.567 638 HD13 ILE 90 HD13 ILE 90 12.015 -4.992 14.461 Start of MODEL 10 1 H1 GLY 1 HT1 GLY 1 10.962 -10.309 -9.425 2 H2 GLY 1 HT2 GLY 1 11.222 -10.686 -7.802 3 H3 GLY 1 HT3 GLY 1 11.146 -9.072 -8.291 4 HA2 GLY 1 HA1 GLY 1 8.916 -11.022 -8.336 5 HA3 GLY 1 HA2 GLY 1 9.103 -9.687 -7.206 6 H SER 2 HN SER 2 6.812 -9.560 -8.374 7 HA SER 2 HA SER 2 6.952 -8.193 -10.924 8 HB2 SER 2 HB2 SER 2 4.422 -8.090 -10.605 9 HB3 SER 2 HB1 SER 2 5.127 -9.702 -10.725 10 HG SER 2 HG SER 2 3.895 -8.448 -8.586 11 H GLY 3 HN GLY 3 6.865 -7.387 -7.593 12 HA2 GLY 3 HA2 GLY 3 6.818 -4.557 -8.309 13 HA3 GLY 3 HA1 GLY 3 5.578 -5.110 -7.194 14 H TRP 4 HN TRP 4 6.304 -6.118 -5.186 15 HA TRP 4 HA TRP 4 8.855 -4.947 -4.309 16 HB2 TRP 4 HB2 TRP 4 6.209 -5.076 -2.872 17 HB3 TRP 4 HB1 TRP 4 7.725 -4.697 -2.063 18 HD1 TRP 4 HD1 TRP 4 4.907 -3.011 -3.640 19 HE1 TRP 4 HE1 TRP 4 5.501 -0.576 -4.237 20 HE3 TRP 4 HE3 TRP 4 9.982 -3.290 -3.170 21 HZ2 TRP 4 HZ2 TRP 4 7.829 1.006 -4.470 22 HZ3 TRP 4 HZ3 TRP 4 11.322 -1.276 -3.604 23 HH2 TRP 4 HH2 TRP 4 10.264 0.824 -4.242 24 H GLU 5 HN GLU 5 9.913 -5.967 -2.555 25 HA GLU 5 HA GLU 5 9.812 -8.837 -2.753 26 HB2 GLU 5 HB2 GLU 5 11.544 -7.129 -0.955 27 HB3 GLU 5 HB1 GLU 5 11.816 -8.811 -1.401 28 HG2 GLU 5 HG2 GLU 5 12.019 -8.026 -3.780 29 HG3 GLU 5 HG1 GLU 5 12.028 -6.379 -3.150 30 H SER 6 HN SER 6 8.485 -10.018 -1.564 31 HA SER 6 HA SER 6 7.306 -8.917 0.854 32 HB2 SER 6 HB2 SER 6 6.779 -11.557 -0.533 33 HB3 SER 6 HB1 SER 6 5.802 -10.837 0.747 34 HG SER 6 HG SER 6 6.307 -9.491 -1.690 35 H LYS 7 HN LYS 7 10.147 -9.799 0.650 36 HA LYS 7 HA LYS 7 10.829 -12.141 1.860 37 HB2 LYS 7 HB2 LYS 7 12.590 -10.780 1.139 38 HB3 LYS 7 HB1 LYS 7 11.996 -9.381 2.022 39 HG2 LYS 7 HG2 LYS 7 13.985 -10.203 3.086 40 HG3 LYS 7 HG1 LYS 7 12.605 -10.494 4.135 41 HD2 LYS 7 HD2 LYS 7 12.513 -12.795 3.464 42 HD3 LYS 7 HD1 LYS 7 13.817 -12.552 2.297 43 HE2 LYS 7 HE2 LYS 7 14.072 -12.179 5.282 44 HE3 LYS 7 HE1 LYS 7 14.567 -13.626 4.406 45 HZ1 LYS 7 HZ1 LYS 7 16.430 -12.137 4.832 46 HZ2 LYS 7 HZ2 LYS 7 15.666 -10.901 3.973 47 HZ3 LYS 7 HZ3 LYS 7 16.157 -12.303 3.172 48 H THR 8 HN THR 8 9.920 -9.153 3.504 49 HA THR 8 HA THR 8 10.527 -10.010 6.084 50 HB THR 8 HB THR 8 8.407 -7.954 5.487 51 HG1 THR 8 HG1 THR 8 11.235 -7.803 5.164 52 HG21 THR 8 HG21 THR 8 10.558 -8.152 7.602 53 HG22 THR 8 HG22 THR 8 8.842 -8.478 7.843 54 HG23 THR 8 HG23 THR 8 9.382 -6.847 7.448 55 H GLY 9 HN GLY 9 7.777 -10.665 4.085 56 HA2 GLY 9 HA2 GLY 9 6.071 -12.176 4.384 57 HA3 GLY 9 HA1 GLY 9 6.811 -12.624 5.911 58 H SER 10 HN SER 10 6.081 -9.309 5.524 59 HA SER 10 HA SER 10 4.220 -9.488 7.721 60 HB2 SER 10 HB2 SER 10 5.208 -7.031 6.267 61 HB3 SER 10 HB1 SER 10 4.448 -7.090 7.858 62 HG SER 10 HG SER 10 6.762 -6.941 7.935 63 H CYS 11 HN CYS 11 3.833 -9.635 4.397 64 HA CYS 11 HA CYS 11 1.186 -8.354 4.551 65 HB2 CYS 11 HB2 CYS 11 2.858 -8.050 2.081 66 HB3 CYS 11 HB1 CYS 11 1.592 -7.000 2.715 67 H ASN 12 HN ASN 12 -0.436 -9.297 3.336 68 HA ASN 12 HA ASN 12 0.183 -12.009 2.463 69 HB2 ASN 12 HB2 ASN 12 -2.126 -12.514 2.692 70 HB3 ASN 12 HB1 ASN 12 -1.683 -11.554 4.096 71 HD21 ASN 12 HD21 ASN 12 -2.479 -9.420 4.245 72 HD22 ASN 12 HD22 ASN 12 -3.842 -8.897 3.306 73 H THR 13 HN THR 13 -0.885 -8.972 1.117 74 HA THR 13 HA THR 13 -1.761 -10.272 -1.339 75 HB THR 13 HB THR 13 -2.446 -8.014 -2.044 76 HG1 THR 13 HG1 THR 13 -2.283 -6.464 -0.070 77 HG21 THR 13 HG21 THR 13 -4.124 -7.615 -0.213 78 HG22 THR 13 HG22 THR 13 -3.311 -8.880 0.718 79 HG23 THR 13 HG23 THR 13 -4.076 -9.268 -0.824 80 H GLY 14 HN GLY 14 0.867 -8.342 -0.122 81 HA2 GLY 14 HA2 GLY 14 3.002 -8.195 -1.091 82 HA3 GLY 14 HA1 GLY 14 2.326 -8.765 -2.610 83 H LYS 15 HN LYS 15 0.290 -6.437 -1.412 84 HA LYS 15 HA LYS 15 1.353 -4.451 -3.248 85 HB2 LYS 15 HB2 LYS 15 -1.180 -4.576 -1.606 86 HB3 LYS 15 HB1 LYS 15 -0.744 -3.178 -2.578 87 HG2 LYS 15 HG2 LYS 15 -0.719 -4.641 -4.582 88 HG3 LYS 15 HG1 LYS 15 -1.281 -5.973 -3.571 89 HD2 LYS 15 HD2 LYS 15 -3.315 -4.781 -3.053 90 HD3 LYS 15 HD1 LYS 15 -2.740 -3.356 -3.916 91 HE2 LYS 15 HE2 LYS 15 -4.273 -4.468 -5.350 92 HE3 LYS 15 HE1 LYS 15 -2.657 -4.757 -5.990 93 HZ1 LYS 15 HZ1 LYS 15 -2.697 -6.935 -4.882 94 HZ2 LYS 15 HZ2 LYS 15 -3.916 -6.775 -6.037 95 HZ3 LYS 15 HZ3 LYS 15 -4.291 -6.653 -4.396 96 H LEU 16 HN LEU 16 3.237 -3.850 -2.160 97 HA LEU 16 HA LEU 16 2.992 -2.607 0.460 98 HB2 LEU 16 HB2 LEU 16 5.327 -3.324 -1.303 99 HB3 LEU 16 HB1 LEU 16 5.515 -2.316 0.111 100 HG LEU 16 HG LEU 16 4.631 -4.177 1.507 101 HD11 LEU 16 HD11 LEU 16 4.756 -5.693 -1.071 102 HD12 LEU 16 HD12 LEU 16 3.325 -5.339 -0.091 103 HD13 LEU 16 HD13 LEU 16 4.578 -6.421 0.528 104 HD21 LEU 16 HD21 LEU 16 7.050 -4.837 -0.163 105 HD22 LEU 16 HD22 LEU 16 6.655 -5.540 1.404 106 HD23 LEU 16 HD23 LEU 16 7.033 -3.822 1.278 107 H ALA 17 HN ALA 17 3.055 -0.454 0.788 108 HA ALA 17 HA ALA 17 3.985 1.315 -1.325 109 HB1 ALA 17 HB1 ALA 17 1.928 2.674 -1.280 110 HB2 ALA 17 HB2 ALA 17 1.169 1.455 -0.253 111 HB3 ALA 17 HB3 ALA 17 1.645 1.045 -1.900 112 H CYS 18 HN CYS 18 4.661 3.303 -0.565 113 HA CYS 18 HA CYS 18 4.943 3.518 2.317 114 HB2 CYS 18 HB2 CYS 18 6.060 5.159 0.041 115 HB3 CYS 18 HB1 CYS 18 6.379 5.480 1.741 116 H CYS 19 HN CYS 19 3.211 4.289 3.329 117 HA CYS 19 HA CYS 19 1.572 6.272 1.910 118 HB2 CYS 19 HB2 CYS 19 0.746 4.205 3.948 119 HB3 CYS 19 HB1 CYS 19 -0.332 5.357 3.172 120 H ASP 20 HN ASP 20 0.427 7.843 3.196 121 HA ASP 20 HA ASP 20 1.851 8.555 5.657 122 HB2 ASP 20 HB2 ASP 20 0.036 10.130 3.839 123 HB3 ASP 20 HB1 ASP 20 0.476 10.701 5.440 124 H THR 21 HN THR 21 1.000 7.653 7.360 125 HA THR 21 HA THR 21 -1.664 6.675 7.466 126 HB THR 21 HB THR 21 -1.116 6.216 9.869 127 HG1 THR 21 HG1 THR 21 0.570 7.174 10.719 128 HG21 THR 21 HG21 THR 21 -0.637 4.559 8.141 129 HG22 THR 21 HG22 THR 21 0.623 4.542 9.374 130 HG23 THR 21 HG23 THR 21 0.920 5.322 7.822 131 H ASN 22 HN ASN 22 -0.369 9.741 7.909 132 HA ASN 22 HA ASN 22 -2.335 10.568 9.908 133 HB2 ASN 22 HB2 ASN 22 -0.002 12.053 8.676 134 HB3 ASN 22 HB1 ASN 22 -1.064 12.697 9.921 135 HD21 ASN 22 HD21 ASN 22 -0.929 11.896 12.013 136 HD22 ASN 22 HD22 ASN 22 0.423 10.960 12.551 137 H LYS 23 HN LYS 23 -1.930 10.352 6.616 138 HA LYS 23 HA LYS 23 -3.911 12.463 6.120 139 HB2 LYS 23 HB2 LYS 23 -1.583 11.496 4.522 140 HB3 LYS 23 HB1 LYS 23 -2.986 12.113 3.679 141 HG2 LYS 23 HG2 LYS 23 -2.754 14.190 5.141 142 HG3 LYS 23 HG1 LYS 23 -1.173 13.539 5.573 143 HD2 LYS 23 HD2 LYS 23 -2.079 14.111 2.761 144 HD3 LYS 23 HD1 LYS 23 -1.045 15.166 3.730 145 HE2 LYS 23 HE2 LYS 23 0.675 13.545 3.820 146 HE3 LYS 23 HE1 LYS 23 -0.391 12.302 3.173 147 HZ1 LYS 23 HZ1 LYS 23 0.597 14.689 1.697 148 HZ2 LYS 23 HZ2 LYS 23 -0.432 13.510 1.065 149 HZ3 LYS 23 HZ3 LYS 23 1.151 13.105 1.490 150 H LYS 24 HN LYS 24 -5.647 11.992 4.909 151 HA LYS 24 HA LYS 24 -6.137 9.121 4.502 152 HB2 LYS 24 HB2 LYS 24 -8.090 11.139 5.591 153 HB3 LYS 24 HB1 LYS 24 -8.396 9.425 5.345 154 HG2 LYS 24 HG2 LYS 24 -6.434 10.604 7.300 155 HG3 LYS 24 HG1 LYS 24 -8.019 9.939 7.688 156 HD2 LYS 24 HD2 LYS 24 -7.158 7.797 6.553 157 HD3 LYS 24 HD1 LYS 24 -5.565 8.533 6.730 158 HE2 LYS 24 HE2 LYS 24 -7.482 8.071 9.006 159 HE3 LYS 24 HE1 LYS 24 -6.183 6.967 8.568 160 HZ1 LYS 24 HZ1 LYS 24 -5.814 9.794 9.388 161 HZ2 LYS 24 HZ2 LYS 24 -4.579 8.692 9.035 162 HZ3 LYS 24 HZ3 LYS 24 -5.570 8.452 10.384 163 H VAL 25 HN VAL 25 -7.706 8.575 2.931 164 HA VAL 25 HA VAL 25 -8.241 10.699 0.946 165 HB VAL 25 HB VAL 25 -8.371 7.767 0.307 166 HG11 VAL 25 HG11 VAL 25 -7.951 8.526 -1.967 167 HG12 VAL 25 HG12 VAL 25 -7.809 10.187 -1.394 168 HG13 VAL 25 HG13 VAL 25 -9.351 9.340 -1.270 169 HG21 VAL 25 HG21 VAL 25 -6.075 7.806 -0.502 170 HG22 VAL 25 HG22 VAL 25 -6.140 8.115 1.230 171 HG23 VAL 25 HG23 VAL 25 -5.868 9.450 0.105 172 H GLN 26 HN GLN 26 -10.347 10.769 0.043 173 HA GLN 26 HA GLN 26 -12.398 9.580 1.734 174 HB2 GLN 26 HB2 GLN 26 -12.477 11.711 -0.393 175 HB3 GLN 26 HB1 GLN 26 -13.902 11.095 0.412 176 HG2 GLN 26 HG2 GLN 26 -12.942 11.821 2.574 177 HG3 GLN 26 HG1 GLN 26 -11.597 12.536 1.687 178 HE21 GLN 26 HE21 GLN 26 -14.898 12.547 0.533 179 HE22 GLN 26 HE22 GLN 26 -15.156 14.246 0.708 180 H LYS 27 HN LYS 27 -10.792 8.136 -0.369 181 HA LYS 27 HA LYS 27 -13.064 7.110 -1.918 182 HB2 LYS 27 HB2 LYS 27 -10.238 7.576 -2.873 183 HB3 LYS 27 HB1 LYS 27 -11.429 6.650 -3.770 184 HG2 LYS 27 HG2 LYS 27 -11.747 9.535 -2.992 185 HG3 LYS 27 HG1 LYS 27 -11.173 8.987 -4.561 186 HD2 LYS 27 HD2 LYS 27 -13.879 8.438 -3.339 187 HD3 LYS 27 HD1 LYS 27 -13.534 9.565 -4.650 188 HE2 LYS 27 HE2 LYS 27 -12.851 7.763 -6.086 189 HE3 LYS 27 HE1 LYS 27 -13.006 6.615 -4.761 190 HZ1 LYS 27 HZ1 LYS 27 -14.895 6.607 -6.339 191 HZ2 LYS 27 HZ2 LYS 27 -15.270 8.182 -5.856 192 HZ3 LYS 27 HZ3 LYS 27 -15.356 6.912 -4.741 193 H SER 28 HN SER 28 -13.342 4.989 -1.877 194 HA SER 28 HA SER 28 -11.281 3.336 -0.574 195 HB2 SER 28 HB2 SER 28 -13.588 3.753 0.538 196 HB3 SER 28 HB1 SER 28 -14.216 2.660 -0.688 197 HG SER 28 HG SER 28 -13.724 1.438 1.086 198 H THR 29 HN THR 29 -11.068 3.881 -3.205 199 HA THR 29 HA THR 29 -12.215 1.601 -4.645 200 HB THR 29 HB THR 29 -11.402 3.118 -6.653 201 HG1 THR 29 HG1 THR 29 -10.610 4.935 -5.885 202 HG21 THR 29 HG21 THR 29 -13.623 4.174 -6.685 203 HG22 THR 29 HG22 THR 29 -13.860 3.712 -5.000 204 HG23 THR 29 HG23 THR 29 -13.720 2.470 -6.243 205 H GLY 30 HN GLY 30 -10.786 0.862 -6.543 206 HA2 GLY 30 HA2 GLY 30 -8.036 1.050 -6.598 207 HA3 GLY 30 HA1 GLY 30 -8.394 -0.167 -5.382 208 H GLU 31 HN GLU 31 -7.511 -1.867 -6.546 209 HA GLU 31 HA GLU 31 -8.394 -2.342 -9.280 210 HB2 GLU 31 HB2 GLU 31 -6.513 -3.861 -7.471 211 HB3 GLU 31 HB1 GLU 31 -6.881 -4.335 -9.122 212 HG2 GLU 31 HG2 GLU 31 -5.992 -2.168 -9.899 213 HG3 GLU 31 HG1 GLU 31 -5.541 -1.793 -8.237 214 H GLU 32 HN GLU 32 -8.508 -4.066 -6.177 215 HA GLU 32 HA GLU 32 -10.631 -5.765 -7.265 216 HB2 GLU 32 HB2 GLU 32 -8.966 -6.148 -4.774 217 HB3 GLU 32 HB1 GLU 32 -10.128 -7.292 -5.427 218 HG2 GLU 32 HG2 GLU 32 -7.594 -6.406 -6.788 219 HG3 GLU 32 HG1 GLU 32 -7.819 -7.925 -5.923 220 H SER 33 HN SER 33 -9.695 -3.895 -4.408 221 HA SER 33 HA SER 33 -12.237 -4.008 -3.147 222 HB2 SER 33 HB2 SER 33 -10.016 -3.367 -2.073 223 HB3 SER 33 HB1 SER 33 -10.214 -1.783 -2.822 224 HG SER 33 HG SER 33 -11.395 -2.818 -0.602 225 H GLY 34 HN GLY 34 -10.998 -2.171 -5.784 226 HA2 GLY 34 HA2 GLY 34 -12.705 0.036 -5.815 227 HA3 GLY 34 HA1 GLY 34 -12.065 -0.755 -7.248 228 H LEU 35 HN LEU 35 -13.254 -3.282 -6.851 229 HA LEU 35 HA LEU 35 -15.965 -2.742 -7.684 230 HB2 LEU 35 HB2 LEU 35 -14.581 -5.385 -7.200 231 HB3 LEU 35 HB1 LEU 35 -16.106 -5.154 -8.031 232 HG LEU 35 HG LEU 35 -13.431 -4.146 -9.002 233 HD11 LEU 35 HD11 LEU 35 -13.652 -5.880 -10.718 234 HD12 LEU 35 HD12 LEU 35 -15.112 -6.469 -9.926 235 HD13 LEU 35 HD13 LEU 35 -13.560 -6.568 -9.097 236 HD21 LEU 35 HD21 LEU 35 -14.636 -3.668 -11.084 237 HD22 LEU 35 HD22 LEU 35 -15.269 -2.730 -9.732 238 HD23 LEU 35 HD23 LEU 35 -16.149 -4.144 -10.312 239 H LEU 36 HN LEU 36 -14.509 -4.809 -5.166 240 HA LEU 36 HA LEU 36 -16.951 -4.482 -3.593 241 HB2 LEU 36 HB2 LEU 36 -14.839 -6.626 -3.620 242 HB3 LEU 36 HB1 LEU 36 -16.146 -6.552 -2.467 243 HG LEU 36 HG LEU 36 -16.507 -6.835 -5.445 244 HD11 LEU 36 HD11 LEU 36 -16.729 -8.881 -3.249 245 HD12 LEU 36 HD12 LEU 36 -15.470 -8.810 -4.482 246 HD13 LEU 36 HD13 LEU 36 -17.140 -9.139 -4.945 247 HD21 LEU 36 HD21 LEU 36 -18.466 -6.974 -3.157 248 HD22 LEU 36 HD22 LEU 36 -18.829 -7.400 -4.828 249 HD23 LEU 36 HD23 LEU 36 -18.398 -5.742 -4.416 250 H HIS 37 HN HIS 37 -16.439 -2.610 -2.432 251 HA HIS 37 HA HIS 37 -14.170 -2.951 -0.595 252 HB2 HIS 37 HB2 HIS 37 -14.509 -0.401 -0.186 253 HB3 HIS 37 HB1 HIS 37 -13.642 -0.945 -1.611 254 HD1 HIS 37 HD1 HIS 37 -14.867 -0.681 -3.906 255 HD2 HIS 37 HD2 HIS 37 -16.818 1.057 -0.673 256 HE1 HIS 37 HE1 HIS 37 -16.576 0.875 -4.904 257 HE2 HIS 37 HE2 HIS 37 -17.810 1.843 -2.931 258 H THR 38 HN THR 38 -17.235 -1.155 -0.509 259 HA THR 38 HA THR 38 -17.468 -1.472 2.310 260 HB THR 38 HB THR 38 -19.560 -0.594 0.301 261 HG1 THR 38 HG1 THR 38 -18.814 1.531 0.890 262 HG21 THR 38 HG21 THR 38 -20.494 -1.151 2.498 263 HG22 THR 38 HG22 THR 38 -20.580 0.583 2.183 264 HG23 THR 38 HG23 THR 38 -19.341 -0.058 3.264 265 H GLY 39 HN GLY 39 -18.473 -3.278 -0.455 266 HA2 GLY 39 HA2 GLY 39 -20.619 -4.661 0.851 267 HA3 GLY 39 HA1 GLY 39 -19.938 -5.053 -0.720 268 H ASP 40 HN ASP 40 -17.348 -4.894 1.200 269 HA ASP 40 HA ASP 40 -17.596 -7.696 2.076 270 HB2 ASP 40 HB2 ASP 40 -15.948 -7.340 0.229 271 HB3 ASP 40 HB1 ASP 40 -15.054 -6.256 1.284 272 H VAL 41 HN VAL 41 -16.020 -4.596 2.702 273 HA VAL 41 HA VAL 41 -16.256 -5.016 5.568 274 HB VAL 41 HB VAL 41 -13.746 -4.280 5.757 275 HG11 VAL 41 HG11 VAL 41 -14.542 -7.111 5.077 276 HG12 VAL 41 HG12 VAL 41 -14.647 -6.354 6.666 277 HG13 VAL 41 HG13 VAL 41 -13.072 -6.633 5.923 278 HG21 VAL 41 HG21 VAL 41 -13.459 -4.033 3.313 279 HG22 VAL 41 HG22 VAL 41 -13.713 -5.770 3.135 280 HG23 VAL 41 HG23 VAL 41 -12.314 -5.172 4.028 281 H LEU 42 HN LEU 42 -16.705 -3.181 6.564 282 HA LEU 42 HA LEU 42 -16.500 -0.678 5.093 283 HB2 LEU 42 HB2 LEU 42 -18.128 -1.733 7.275 284 HB3 LEU 42 HB1 LEU 42 -17.588 -0.091 7.552 285 HG LEU 42 HG LEU 42 -19.047 -0.973 5.066 286 HD11 LEU 42 HD11 LEU 42 -20.491 -1.251 7.001 287 HD12 LEU 42 HD12 LEU 42 -21.007 0.133 6.038 288 HD13 LEU 42 HD13 LEU 42 -20.113 0.387 7.536 289 HD21 LEU 42 HD21 LEU 42 -17.674 1.009 4.760 290 HD22 LEU 42 HD22 LEU 42 -18.393 1.749 6.190 291 HD23 LEU 42 HD23 LEU 42 -19.382 1.444 4.763 292 H ASP 43 HN ASP 43 -14.632 -2.414 7.232 293 HA ASP 43 HA ASP 43 -13.720 -0.162 8.809 294 HB2 ASP 43 HB2 ASP 43 -12.425 -1.739 10.063 295 HB3 ASP 43 HB1 ASP 43 -14.010 -2.451 9.786 296 H GLN 44 HN GLN 44 -13.012 -1.170 5.752 297 HA GLN 44 HA GLN 44 -10.268 -1.170 5.565 298 HB2 GLN 44 HB2 GLN 44 -12.130 0.140 3.590 299 HB3 GLN 44 HB1 GLN 44 -10.501 -0.412 3.275 300 HG2 GLN 44 HG2 GLN 44 -11.268 -2.728 3.827 301 HG3 GLN 44 HG1 GLN 44 -12.911 -2.098 3.862 302 HE21 GLN 44 HE21 GLN 44 -12.465 -0.233 1.684 303 HE22 GLN 44 HE22 GLN 44 -12.361 -1.168 0.237 304 H VAL 45 HN VAL 45 -8.723 0.372 5.303 305 HA VAL 45 HA VAL 45 -9.497 3.085 6.065 306 HB VAL 45 HB VAL 45 -8.192 1.902 7.793 307 HG11 VAL 45 HG11 VAL 45 -6.801 0.467 6.706 308 HG12 VAL 45 HG12 VAL 45 -5.706 1.707 7.318 309 HG13 VAL 45 HG13 VAL 45 -6.191 1.712 5.620 310 HG21 VAL 45 HG21 VAL 45 -6.539 3.695 8.171 311 HG22 VAL 45 HG22 VAL 45 -8.127 4.316 7.722 312 HG23 VAL 45 HG23 VAL 45 -6.830 4.271 6.528 313 H ALA 46 HN ALA 46 -9.156 4.583 4.633 314 HA ALA 46 HA ALA 46 -7.373 3.990 2.377 315 HB1 ALA 46 HB1 ALA 46 -8.633 5.729 1.170 316 HB2 ALA 46 HB2 ALA 46 -9.658 5.946 2.591 317 HB3 ALA 46 HB3 ALA 46 -9.666 4.410 1.726 318 H ILE 47 HN ILE 47 -5.410 4.705 3.015 319 HA ILE 47 HA ILE 47 -5.268 7.486 3.929 320 HB ILE 47 HB ILE 47 -2.936 6.974 4.638 321 HG12 ILE 47 HG12 ILE 47 -3.780 4.110 4.139 322 HG13 ILE 47 HG11 ILE 47 -2.534 4.988 3.254 323 HG21 ILE 47 HG21 ILE 47 -3.592 6.017 6.705 324 HG22 ILE 47 HG22 ILE 47 -4.990 5.234 5.965 325 HG23 ILE 47 HG23 ILE 47 -4.941 6.988 6.114 326 HD11 ILE 47 HD11 ILE 47 -1.295 5.238 5.398 327 HD12 ILE 47 HD12 ILE 47 -1.462 3.575 4.842 328 HD13 ILE 47 HD13 ILE 47 -2.485 4.175 6.147 329 H GLN 48 HN GLN 48 -3.818 8.898 3.004 330 HA GLN 48 HA GLN 48 -3.614 8.547 0.154 331 HB2 GLN 48 HB2 GLN 48 -4.084 10.731 1.506 332 HB3 GLN 48 HB1 GLN 48 -2.332 10.803 1.677 333 HG2 GLN 48 HG2 GLN 48 -2.606 12.029 -0.222 334 HG3 GLN 48 HG1 GLN 48 -2.386 10.420 -0.898 335 HE21 GLN 48 HE21 GLN 48 -3.479 10.889 -2.778 336 HE22 GLN 48 HE22 GLN 48 -5.195 11.095 -2.819 337 H CYS 49 HN CYS 49 -1.989 7.650 -0.842 338 HA CYS 49 HA CYS 49 0.493 7.194 0.668 339 HB2 CYS 49 HB2 CYS 49 -1.201 5.283 0.054 340 HB3 CYS 49 HB1 CYS 49 -0.458 5.411 -1.530 341 H THR 50 HN THR 50 2.430 6.824 -0.715 342 HA THR 50 HA THR 50 2.316 7.555 -3.464 343 HB THR 50 HB THR 50 2.190 9.815 -2.541 344 HG1 THR 50 HG1 THR 50 3.588 10.552 -3.972 345 HG21 THR 50 HG21 THR 50 4.040 10.750 -1.239 346 HG22 THR 50 HG22 THR 50 4.808 9.163 -1.197 347 HG23 THR 50 HG23 THR 50 3.262 9.414 -0.391 348 H GLN 51 HN GLN 51 3.940 6.651 -4.544 349 HA GLN 51 HA GLN 51 6.160 5.601 -2.938 350 HB2 GLN 51 HB2 GLN 51 4.513 3.890 -3.651 351 HB3 GLN 51 HB1 GLN 51 4.868 4.293 -5.326 352 HG2 GLN 51 HG2 GLN 51 6.083 2.304 -4.625 353 HG3 GLN 51 HG1 GLN 51 7.175 3.626 -5.034 354 HE21 GLN 51 HE21 GLN 51 8.866 2.825 -3.827 355 HE22 GLN 51 HE22 GLN 51 8.865 2.815 -2.098 356 H ILE 52 HN ILE 52 8.039 6.371 -3.484 357 HA ILE 52 HA ILE 52 8.623 7.822 -5.823 358 HB ILE 52 HB ILE 52 10.380 6.471 -3.777 359 HG12 ILE 52 HG12 ILE 52 9.678 9.361 -4.313 360 HG13 ILE 52 HG11 ILE 52 9.108 8.377 -2.968 361 HG21 ILE 52 HG21 ILE 52 11.284 8.279 -6.014 362 HG22 ILE 52 HG22 ILE 52 11.607 6.551 -5.892 363 HG23 ILE 52 HG23 ILE 52 12.292 7.661 -4.706 364 HD11 ILE 52 HD11 ILE 52 11.963 9.187 -3.462 365 HD12 ILE 52 HD12 ILE 52 11.371 8.243 -2.097 366 HD13 ILE 52 HD13 ILE 52 10.865 9.920 -2.293 367 HA PRO 53 HA PRO 53 8.848 4.804 -9.047 368 HB2 PRO 53 HB2 PRO 53 11.276 5.867 -10.100 369 HB3 PRO 53 HB1 PRO 53 9.633 6.154 -10.671 370 HG2 PRO 53 HG2 PRO 53 11.333 7.809 -8.904 371 HG3 PRO 53 HG1 PRO 53 10.022 8.299 -9.990 372 HD2 PRO 53 HD2 PRO 53 9.714 8.291 -7.326 373 HD3 PRO 53 HD1 PRO 53 8.381 7.841 -8.413 374 H LEU 54 HN LEU 54 9.383 2.832 -8.562 375 HA LEU 54 HA LEU 54 11.628 2.287 -6.870 376 HB2 LEU 54 HB2 LEU 54 10.667 0.058 -6.680 377 HB3 LEU 54 HB1 LEU 54 9.480 1.306 -6.366 378 HG LEU 54 HG LEU 54 8.962 0.898 -8.963 379 HD11 LEU 54 HD11 LEU 54 9.051 -1.503 -9.453 380 HD12 LEU 54 HD12 LEU 54 9.953 -1.769 -7.962 381 HD13 LEU 54 HD13 LEU 54 10.662 -0.812 -9.263 382 HD21 LEU 54 HD21 LEU 54 7.154 -0.607 -8.237 383 HD22 LEU 54 HD22 LEU 54 7.323 0.803 -7.191 384 HD23 LEU 54 HD23 LEU 54 7.940 -0.764 -6.667 385 H LEU 55 HN LEU 55 13.435 1.187 -7.321 386 HA LEU 55 HA LEU 55 13.819 0.142 -10.029 387 HB2 LEU 55 HB2 LEU 55 15.676 0.483 -7.678 388 HB3 LEU 55 HB1 LEU 55 16.127 -0.422 -9.106 389 HG LEU 55 HG LEU 55 15.682 1.690 -10.440 390 HD11 LEU 55 HD11 LEU 55 15.709 2.924 -7.696 391 HD12 LEU 55 HD12 LEU 55 14.340 2.880 -8.808 392 HD13 LEU 55 HD13 LEU 55 15.786 3.802 -9.224 393 HD21 LEU 55 HD21 LEU 55 17.879 1.718 -8.381 394 HD22 LEU 55 HD22 LEU 55 17.852 2.663 -9.869 395 HD23 LEU 55 HD23 LEU 55 17.924 0.903 -9.943 396 H ILE 56 HN ILE 56 13.790 -2.008 -10.484 397 HA ILE 56 HA ILE 56 12.466 -3.709 -8.641 398 HB ILE 56 HB ILE 56 13.866 -4.489 -11.192 399 HG12 ILE 56 HG12 ILE 56 11.422 -4.596 -12.025 400 HG13 ILE 56 HG11 ILE 56 11.045 -3.590 -10.636 401 HG21 ILE 56 HG21 ILE 56 12.443 -6.481 -11.136 402 HG22 ILE 56 HG22 ILE 56 11.817 -5.972 -9.567 403 HG23 ILE 56 HG23 ILE 56 13.520 -6.392 -9.741 404 HD11 ILE 56 HD11 ILE 56 12.468 -1.837 -11.480 405 HD12 ILE 56 HD12 ILE 56 11.309 -2.317 -12.717 406 HD13 ILE 56 HD13 ILE 56 12.983 -2.861 -12.818 407 H GLY 57 HN GLY 57 13.222 -5.180 -7.283 408 HA2 GLY 57 HA2 GLY 57 14.853 -6.675 -6.395 409 HA3 GLY 57 HA1 GLY 57 16.095 -5.777 -7.256 410 H ILE 58 HN ILE 58 14.277 -3.411 -6.072 411 HA ILE 58 HA ILE 58 15.941 -3.161 -3.687 412 HB ILE 58 HB ILE 58 14.952 -1.282 -5.644 413 HG12 ILE 58 HG12 ILE 58 17.306 -1.633 -5.012 414 HG13 ILE 58 HG11 ILE 58 16.817 0.046 -4.834 415 HG21 ILE 58 HG21 ILE 58 14.495 -0.536 -2.760 416 HG22 ILE 58 HG22 ILE 58 13.278 -0.647 -4.034 417 HG23 ILE 58 HG23 ILE 58 14.513 0.609 -4.108 418 HD11 ILE 58 HD11 ILE 58 18.211 -0.666 -2.977 419 HD12 ILE 58 HD12 ILE 58 17.074 -1.962 -2.603 420 HD13 ILE 58 HD13 ILE 58 16.582 -0.280 -2.423 421 H ALA 59 HN ALA 59 15.161 -2.566 -1.755 422 HA ALA 59 HA ALA 59 12.562 -3.580 -1.029 423 HB1 ALA 59 HB1 ALA 59 14.451 -4.088 0.368 424 HB2 ALA 59 HB2 ALA 59 13.367 -3.023 1.266 425 HB3 ALA 59 HB3 ALA 59 14.838 -2.376 0.531 426 H ILE 60 HN ILE 60 10.830 -2.408 -0.574 427 HA ILE 60 HA ILE 60 10.424 0.160 -1.533 428 HB ILE 60 HB ILE 60 8.611 -1.433 -1.094 429 HG12 ILE 60 HG12 ILE 60 8.331 1.161 0.444 430 HG13 ILE 60 HG11 ILE 60 8.070 0.949 -1.285 431 HG21 ILE 60 HG21 ILE 60 9.301 -2.458 0.940 432 HG22 ILE 60 HG22 ILE 60 7.770 -1.647 1.273 433 HG23 ILE 60 HG23 ILE 60 9.293 -0.918 1.802 434 HD11 ILE 60 HD11 ILE 60 6.464 -0.349 0.897 435 HD12 ILE 60 HD12 ILE 60 6.189 -0.507 -0.838 436 HD13 ILE 60 HD13 ILE 60 5.979 1.057 -0.050 437 H GLU 61 HN GLU 61 11.437 -0.889 1.605 438 HA GLU 61 HA GLU 61 10.815 1.517 2.984 439 HB2 GLU 61 HB2 GLU 61 12.357 0.337 4.744 440 HB3 GLU 61 HB1 GLU 61 10.759 -0.296 4.397 441 HG2 GLU 61 HG2 GLU 61 11.642 -2.028 3.044 442 HG3 GLU 61 HG1 GLU 61 13.248 -1.308 3.052 443 H ASP 62 HN ASP 62 13.472 0.486 1.078 444 HA ASP 62 HA ASP 62 15.044 2.776 2.057 445 HB2 ASP 62 HB2 ASP 62 15.893 0.211 0.730 446 HB3 ASP 62 HB1 ASP 62 16.941 1.628 0.740 447 H GLU 63 HN GLU 63 12.853 2.128 -0.177 448 HA GLU 63 HA GLU 63 14.209 3.429 -2.412 449 HB2 GLU 63 HB2 GLU 63 12.745 1.401 -2.756 450 HB3 GLU 63 HB1 GLU 63 11.375 2.386 -2.278 451 HG2 GLU 63 HG2 GLU 63 11.523 2.224 -4.687 452 HG3 GLU 63 HG1 GLU 63 11.772 3.875 -4.143 453 H CYS 64 HN CYS 64 11.588 3.912 -0.125 454 HA CYS 64 HA CYS 64 11.019 6.538 -1.313 455 HB2 CYS 64 HB2 CYS 64 8.851 6.361 -0.361 456 HB3 CYS 64 HB1 CYS 64 9.207 4.781 -1.055 457 H LYS 65 HN LYS 65 9.978 7.996 0.591 458 HA LYS 65 HA LYS 65 11.768 7.848 2.924 459 HB2 LYS 65 HB2 LYS 65 12.357 9.650 1.228 460 HB3 LYS 65 HB1 LYS 65 10.839 10.427 1.648 461 HG2 LYS 65 HG2 LYS 65 12.608 11.489 2.848 462 HG3 LYS 65 HG1 LYS 65 11.633 10.568 3.996 463 HD2 LYS 65 HD2 LYS 65 13.275 8.747 3.905 464 HD3 LYS 65 HD1 LYS 65 14.253 9.691 2.784 465 HE2 LYS 65 HE2 LYS 65 15.083 9.826 5.099 466 HE3 LYS 65 HE1 LYS 65 14.600 11.396 4.461 467 HZ1 LYS 65 HZ1 LYS 65 12.891 9.705 6.199 468 HZ2 LYS 65 HZ2 LYS 65 12.576 11.288 5.694 469 HZ3 LYS 65 HZ3 LYS 65 13.851 10.980 6.756 470 H ASN 66 HN ASN 66 9.151 6.757 2.670 471 HA ASN 66 HA ASN 66 7.806 8.295 4.771 472 HB2 ASN 66 HB2 ASN 66 6.527 7.257 2.250 473 HB3 ASN 66 HB1 ASN 66 5.584 7.561 3.703 474 HD21 ASN 66 HD21 ASN 66 7.231 8.947 1.018 475 HD22 ASN 66 HD22 ASN 66 6.793 10.590 1.331 476 H THR 67 HN THR 67 5.659 6.603 5.230 477 HA THR 67 HA THR 67 7.084 4.546 6.632 478 HB THR 67 HB THR 67 4.132 5.181 6.641 479 HG1 THR 67 HG1 THR 67 4.988 6.862 7.681 480 HG21 THR 67 HG21 THR 67 4.180 3.875 8.782 481 HG22 THR 67 HG22 THR 67 5.825 3.373 8.374 482 HG23 THR 67 HG23 THR 67 4.477 2.906 7.340 483 HA PRO 68 HA PRO 68 6.341 1.293 3.665 484 HB2 PRO 68 HB2 PRO 68 7.092 -0.470 5.838 485 HB3 PRO 68 HB1 PRO 68 7.950 -0.152 4.334 486 HG2 PRO 68 HG2 PRO 68 8.706 0.682 6.879 487 HG3 PRO 68 HG1 PRO 68 9.348 1.303 5.351 488 HD2 PRO 68 HD2 PRO 68 7.531 2.548 7.260 489 HD3 PRO 68 HD1 PRO 68 8.463 3.283 5.951 490 H THR 69 HN THR 69 4.225 0.779 3.373 491 HA THR 69 HA THR 69 2.894 -0.637 5.579 492 HB THR 69 HB THR 69 0.757 0.385 5.070 493 HG1 THR 69 HG1 THR 69 2.191 1.506 2.915 494 HG21 THR 69 HG21 THR 69 1.171 2.760 5.639 495 HG22 THR 69 HG22 THR 69 2.895 2.497 5.372 496 HG23 THR 69 HG23 THR 69 2.063 1.643 6.672 497 H CYS 70 HN CYS 70 1.236 -2.129 4.834 498 HA CYS 70 HA CYS 70 1.489 -2.810 1.979 499 HB2 CYS 70 HB2 CYS 70 1.290 -4.649 4.357 500 HB3 CYS 70 HB1 CYS 70 0.983 -5.179 2.701 501 H CYS 71 HN CYS 71 -0.281 -2.736 0.876 502 HA CYS 71 HA CYS 71 -2.778 -2.124 2.299 503 HB2 CYS 71 HB2 CYS 71 -2.041 -1.635 -0.589 504 HB3 CYS 71 HB1 CYS 71 -3.428 -0.983 0.266 505 H GLU 72 HN GLU 72 -4.601 -3.150 1.916 506 HA GLU 72 HA GLU 72 -4.501 -5.756 0.741 507 HB2 GLU 72 HB2 GLU 72 -6.673 -4.084 1.975 508 HB3 GLU 72 HB1 GLU 72 -6.952 -5.726 1.378 509 HG2 GLU 72 HG2 GLU 72 -5.150 -4.832 3.612 510 HG3 GLU 72 HG1 GLU 72 -6.600 -5.822 3.728 511 H ASP 73 HN ASP 73 -5.232 -2.585 -0.268 512 HA ASP 73 HA ASP 73 -5.312 -3.405 -3.006 513 HB2 ASP 73 HB2 ASP 73 -7.762 -3.550 -2.048 514 HB3 ASP 73 HB1 ASP 73 -7.706 -1.796 -2.221 515 H VAL 74 HN VAL 74 -5.099 -1.503 -4.433 516 HA VAL 74 HA VAL 74 -4.853 1.092 -3.156 517 HB VAL 74 HB VAL 74 -2.497 0.532 -4.853 518 HG11 VAL 74 HG11 VAL 74 -1.403 1.987 -3.273 519 HG12 VAL 74 HG12 VAL 74 -2.801 1.921 -2.205 520 HG13 VAL 74 HG13 VAL 74 -2.938 2.688 -3.786 521 HG21 VAL 74 HG21 VAL 74 -1.168 -0.462 -3.069 522 HG22 VAL 74 HG22 VAL 74 -2.499 -1.521 -3.534 523 HG23 VAL 74 HG23 VAL 74 -2.607 -0.571 -2.053 524 H GLU 75 HN GLU 75 -5.570 2.632 -4.510 525 HA GLU 75 HA GLU 75 -5.931 1.927 -7.331 526 HB2 GLU 75 HB2 GLU 75 -7.852 2.842 -5.955 527 HB3 GLU 75 HB1 GLU 75 -6.986 4.369 -5.900 528 HG2 GLU 75 HG2 GLU 75 -7.150 4.643 -8.255 529 HG3 GLU 75 HG1 GLU 75 -7.764 3.005 -8.462 530 H ASP 76 HN ASP 76 -5.551 3.731 -8.929 531 HA ASP 76 HA ASP 76 -4.107 5.094 -10.032 532 HB2 ASP 76 HB2 ASP 76 -3.347 6.034 -7.250 533 HB3 ASP 76 HB1 ASP 76 -2.813 6.792 -8.743 534 H ASP 77 HN ASP 77 -1.417 5.847 -9.225 535 HA ASP 77 HA ASP 77 -0.025 3.393 -9.676 536 HB2 ASP 77 HB2 ASP 77 0.845 5.596 -10.440 537 HB3 ASP 77 HB1 ASP 77 1.096 6.057 -8.760 538 H GLY 78 HN GLY 78 -1.633 4.323 -7.068 539 HA2 GLY 78 HA2 GLY 78 -1.405 2.828 -5.125 540 HA3 GLY 78 HA1 GLY 78 0.312 3.176 -5.168 541 H LEU 79 HN LEU 79 -1.967 5.715 -5.815 542 HA LEU 79 HA LEU 79 -0.989 7.233 -3.588 543 HB2 LEU 79 HB2 LEU 79 -3.094 7.780 -5.675 544 HB3 LEU 79 HB1 LEU 79 -2.682 8.915 -4.406 545 HG LEU 79 HG LEU 79 -1.674 9.418 -6.616 546 HD11 LEU 79 HD11 LEU 79 -0.689 10.313 -4.601 547 HD12 LEU 79 HD12 LEU 79 0.568 9.912 -5.770 548 HD13 LEU 79 HD13 LEU 79 0.270 8.847 -4.396 549 HD21 LEU 79 HD21 LEU 79 -1.217 7.176 -7.408 550 HD22 LEU 79 HD22 LEU 79 -0.023 6.955 -6.130 551 HD23 LEU 79 HD23 LEU 79 0.251 8.150 -7.398 552 H VAL 80 HN VAL 80 -3.863 5.360 -4.272 553 HA VAL 80 HA VAL 80 -4.948 6.225 -1.671 554 HB VAL 80 HB VAL 80 -6.502 5.273 -4.086 555 HG11 VAL 80 HG11 VAL 80 -7.466 6.209 -1.385 556 HG12 VAL 80 HG12 VAL 80 -7.562 4.565 -2.016 557 HG13 VAL 80 HG13 VAL 80 -8.494 5.855 -2.773 558 HG21 VAL 80 HG21 VAL 80 -6.166 7.997 -2.845 559 HG22 VAL 80 HG22 VAL 80 -7.418 7.603 -4.027 560 HG23 VAL 80 HG23 VAL 80 -5.715 7.490 -4.474 561 H GLY 81 HN GLY 81 -4.374 4.672 -0.276 562 HA2 GLY 81 HA2 GLY 81 -4.468 1.891 -1.223 563 HA3 GLY 81 HA1 GLY 81 -3.487 2.468 0.114 564 H ILE 82 HN ILE 82 -5.698 0.420 -0.363 565 HA ILE 82 HA ILE 82 -7.538 1.168 1.789 566 HB ILE 82 HB ILE 82 -7.602 -0.851 -0.418 567 HG12 ILE 82 HG12 ILE 82 -9.947 -0.041 -0.611 568 HG13 ILE 82 HG11 ILE 82 -9.642 1.058 0.732 569 HG21 ILE 82 HG21 ILE 82 -9.174 -1.117 2.133 570 HG22 ILE 82 HG22 ILE 82 -7.975 -2.245 1.501 571 HG23 ILE 82 HG23 ILE 82 -9.502 -2.010 0.649 572 HD11 ILE 82 HD11 ILE 82 -9.495 2.197 -1.405 573 HD12 ILE 82 HD12 ILE 82 -8.232 1.080 -1.927 574 HD13 ILE 82 HD13 ILE 82 -7.934 2.188 -0.585 575 H ASN 83 HN ASN 83 -7.073 0.508 3.782 576 HA ASN 83 HA ASN 83 -6.397 -0.779 5.528 577 HB2 ASN 83 HB2 ASN 83 -6.854 -2.833 3.404 578 HB3 ASN 83 HB1 ASN 83 -6.137 -3.329 4.926 579 HD21 ASN 83 HD21 ASN 83 -8.661 -4.113 3.831 580 HD22 ASN 83 HD22 ASN 83 -9.870 -3.614 4.960 581 H CYS 84 HN CYS 84 -4.420 0.655 4.406 582 HA CYS 84 HA CYS 84 -2.148 -1.049 3.856 583 HB2 CYS 84 HB2 CYS 84 -2.237 1.945 4.231 584 HB3 CYS 84 HB1 CYS 84 -0.902 1.014 3.564 585 H THR 85 HN THR 85 -1.844 -2.199 5.710 586 HA THR 85 HA THR 85 -1.571 -0.911 8.266 587 HB THR 85 HB THR 85 -0.757 -3.730 7.546 588 HG1 THR 85 HG1 THR 85 -2.885 -4.317 7.985 589 HG21 THR 85 HG21 THR 85 -1.283 -4.171 9.912 590 HG22 THR 85 HG22 THR 85 -1.659 -2.461 10.137 591 HG23 THR 85 HG23 THR 85 -0.014 -2.957 9.741 592 HA PRO 86 HA PRO 86 2.749 0.122 7.693 593 HB2 PRO 86 HB2 PRO 86 2.692 0.455 10.625 594 HB3 PRO 86 HB1 PRO 86 3.102 1.629 9.372 595 HG2 PRO 86 HG2 PRO 86 0.811 1.818 10.732 596 HG3 PRO 86 HG1 PRO 86 0.880 2.195 9.000 597 HD2 PRO 86 HD2 PRO 86 -0.076 -0.301 10.353 598 HD3 PRO 86 HD1 PRO 86 -0.810 0.614 9.024 599 H ILE 87 HN ILE 87 4.011 -1.575 7.331 600 HA ILE 87 HA ILE 87 3.784 -3.926 8.954 601 HB ILE 87 HB ILE 87 5.484 -4.817 7.285 602 HG12 ILE 87 HG12 ILE 87 4.701 -2.332 5.757 603 HG13 ILE 87 HG11 ILE 87 6.240 -2.509 6.590 604 HG21 ILE 87 HG21 ILE 87 3.741 -5.071 5.550 605 HG22 ILE 87 HG22 ILE 87 2.782 -3.847 6.385 606 HG23 ILE 87 HG23 ILE 87 3.152 -5.377 7.185 607 HD11 ILE 87 HD11 ILE 87 6.789 -4.411 5.164 608 HD12 ILE 87 HD12 ILE 87 6.461 -2.958 4.220 609 HD13 ILE 87 HD13 ILE 87 5.244 -4.229 4.332 610 HA PRO 88 HA PRO 88 7.472 -3.304 11.357 611 HB2 PRO 88 HB2 PRO 88 7.617 -6.219 11.550 612 HB3 PRO 88 HB1 PRO 88 7.310 -5.041 12.823 613 HG2 PRO 88 HG2 PRO 88 5.392 -6.685 11.970 614 HG3 PRO 88 HG1 PRO 88 5.040 -5.001 12.406 615 HD2 PRO 88 HD2 PRO 88 5.507 -6.172 9.681 616 HD3 PRO 88 HD1 PRO 88 4.184 -5.126 10.231 617 H LEU 89 HN LEU 89 9.649 -3.488 11.131 618 HA LEU 89 HA LEU 89 10.587 -4.415 8.527 619 HB2 LEU 89 HB2 LEU 89 12.068 -2.914 10.684 620 HB3 LEU 89 HB1 LEU 89 12.589 -3.136 9.022 621 HG LEU 89 HG LEU 89 10.224 -1.495 9.939 622 HD11 LEU 89 HD11 LEU 89 11.506 0.397 9.110 623 HD12 LEU 89 HD12 LEU 89 12.841 -0.677 8.695 624 HD13 LEU 89 HD13 LEU 89 12.384 -0.451 10.383 625 HD21 LEU 89 HD21 LEU 89 10.021 -0.833 7.586 626 HD22 LEU 89 HD22 LEU 89 9.740 -2.559 7.810 627 HD23 LEU 89 HD23 LEU 89 11.279 -1.994 7.158 628 H ILE 90 HN ILE 90 9.898 -6.443 10.355 629 HA ILE 90 HA ILE 90 12.524 -7.539 11.025 630 HB ILE 90 HB ILE 90 11.541 -8.473 13.117 631 HG12 ILE 90 HG12 ILE 90 9.323 -6.489 12.575 632 HG13 ILE 90 HG11 ILE 90 9.154 -8.238 12.473 633 HG21 ILE 90 HG21 ILE 90 12.992 -6.610 13.309 634 HG22 ILE 90 HG22 ILE 90 11.604 -6.258 14.337 635 HG23 ILE 90 HG23 ILE 90 11.747 -5.488 12.752 636 HD11 ILE 90 HD11 ILE 90 9.798 -6.656 14.949 637 HD12 ILE 90 HD12 ILE 90 9.660 -8.411 14.860 638 HD13 ILE 90 HD13 ILE 90 8.249 -7.400 14.552 Start of MODEL 11 1 H1 GLY 1 HT1 GLY 1 5.260 -1.573 -10.335 2 H2 GLY 1 HT2 GLY 1 5.217 -2.396 -11.810 3 H3 GLY 1 HT3 GLY 1 6.083 -3.041 -10.509 4 HA2 GLY 1 HA1 GLY 1 3.140 -2.702 -10.654 5 HA3 GLY 1 HA2 GLY 1 4.009 -4.223 -10.789 6 H SER 2 HN SER 2 2.920 -5.099 -9.002 7 HA SER 2 HA SER 2 3.459 -3.810 -6.419 8 HB2 SER 2 HB2 SER 2 1.074 -4.276 -7.013 9 HB3 SER 2 HB1 SER 2 1.459 -5.997 -7.048 10 HG SER 2 HG SER 2 2.207 -5.650 -4.807 11 H GLY 3 HN GLY 3 5.434 -5.346 -7.901 12 HA2 GLY 3 HA2 GLY 3 5.688 -7.807 -6.338 13 HA3 GLY 3 HA1 GLY 3 6.701 -7.329 -7.693 14 H TRP 4 HN TRP 4 6.016 -6.746 -4.293 15 HA TRP 4 HA TRP 4 8.581 -5.348 -4.054 16 HB2 TRP 4 HB2 TRP 4 6.137 -5.396 -2.291 17 HB3 TRP 4 HB1 TRP 4 7.676 -4.741 -1.743 18 HD1 TRP 4 HD1 TRP 4 4.594 -3.748 -3.545 19 HE1 TRP 4 HE1 TRP 4 4.882 -1.398 -4.564 20 HE3 TRP 4 HE3 TRP 4 9.645 -3.237 -2.992 21 HZ2 TRP 4 HZ2 TRP 4 6.981 0.418 -5.081 22 HZ3 TRP 4 HZ3 TRP 4 10.718 -1.169 -3.776 23 HH2 TRP 4 HH2 TRP 4 9.414 0.621 -4.799 24 H GLU 5 HN GLU 5 9.261 -5.709 -1.490 25 HA GLU 5 HA GLU 5 10.539 -8.184 -1.478 26 HB2 GLU 5 HB2 GLU 5 10.990 -7.618 0.965 27 HB3 GLU 5 HB1 GLU 5 11.548 -6.464 -0.239 28 HG2 GLU 5 HG2 GLU 5 9.657 -5.033 0.202 29 HG3 GLU 5 HG1 GLU 5 8.997 -6.218 1.326 30 H SER 6 HN SER 6 9.640 -10.096 -1.310 31 HA SER 6 HA SER 6 7.197 -10.409 0.267 32 HB2 SER 6 HB2 SER 6 8.475 -12.316 -1.705 33 HB3 SER 6 HB1 SER 6 6.880 -12.486 -0.969 34 HG SER 6 HG SER 6 7.740 -10.418 -2.726 35 H LYS 7 HN LYS 7 10.546 -11.129 0.332 36 HA LYS 7 HA LYS 7 10.495 -13.515 1.841 37 HB2 LYS 7 HB2 LYS 7 12.804 -13.313 2.044 38 HB3 LYS 7 HB1 LYS 7 12.464 -12.463 0.550 39 HG2 LYS 7 HG2 LYS 7 12.872 -11.121 3.217 40 HG3 LYS 7 HG1 LYS 7 14.127 -11.336 2.001 41 HD2 LYS 7 HD2 LYS 7 12.792 -10.008 0.416 42 HD3 LYS 7 HD1 LYS 7 11.571 -9.771 1.667 43 HE2 LYS 7 HE2 LYS 7 14.447 -8.866 1.811 44 HE3 LYS 7 HE1 LYS 7 13.063 -7.832 1.470 45 HZ1 LYS 7 HZ1 LYS 7 13.697 -7.642 3.770 46 HZ2 LYS 7 HZ2 LYS 7 13.568 -9.312 3.996 47 HZ3 LYS 7 HZ3 LYS 7 12.181 -8.391 3.674 48 H THR 8 HN THR 8 9.823 -10.306 2.699 49 HA THR 8 HA THR 8 10.654 -10.407 5.417 50 HB THR 8 HB THR 8 8.534 -8.578 4.298 51 HG1 THR 8 HG1 THR 8 10.306 -7.219 3.670 52 HG21 THR 8 HG21 THR 8 9.474 -6.999 5.931 53 HG22 THR 8 HG22 THR 8 10.636 -8.223 6.444 54 HG23 THR 8 HG23 THR 8 8.912 -8.474 6.719 55 H GLY 9 HN GLY 9 7.757 -11.289 3.675 56 HA2 GLY 9 HA2 GLY 9 5.963 -12.572 4.326 57 HA3 GLY 9 HA1 GLY 9 6.798 -12.866 5.845 58 H SER 10 HN SER 10 6.315 -9.601 4.923 59 HA SER 10 HA SER 10 4.794 -9.210 7.349 60 HB2 SER 10 HB2 SER 10 5.183 -6.779 6.788 61 HB3 SER 10 HB1 SER 10 6.644 -7.739 6.991 62 HG SER 10 HG SER 10 6.747 -6.427 5.122 63 H CYS 11 HN CYS 11 4.172 -9.454 4.005 64 HA CYS 11 HA CYS 11 1.482 -8.321 4.410 65 HB2 CYS 11 HB2 CYS 11 3.094 -6.817 3.143 66 HB3 CYS 11 HB1 CYS 11 3.075 -8.026 1.865 67 H ASN 12 HN ASN 12 -0.202 -9.348 3.365 68 HA ASN 12 HA ASN 12 0.352 -12.076 2.485 69 HB2 ASN 12 HB2 ASN 12 -2.355 -10.766 2.778 70 HB3 ASN 12 HB1 ASN 12 -1.994 -12.484 2.743 71 HD21 ASN 12 HD21 ASN 12 -2.029 -9.603 4.615 72 HD22 ASN 12 HD22 ASN 12 -1.750 -10.339 6.149 73 H THR 13 HN THR 13 -0.749 -9.027 1.257 74 HA THR 13 HA THR 13 -1.785 -10.196 -1.190 75 HB THR 13 HB THR 13 -2.460 -7.874 -1.716 76 HG1 THR 13 HG1 THR 13 -2.092 -6.284 -0.031 77 HG21 THR 13 HG21 THR 13 -3.168 -8.809 1.077 78 HG22 THR 13 HG22 THR 13 -3.978 -9.279 -0.419 79 HG23 THR 13 HG23 THR 13 -4.072 -7.612 0.144 80 H GLY 14 HN GLY 14 0.962 -8.398 -0.042 81 HA2 GLY 14 HA2 GLY 14 3.065 -8.404 -1.110 82 HA3 GLY 14 HA1 GLY 14 2.265 -8.773 -2.632 83 H LYS 15 HN LYS 15 0.498 -6.417 -1.147 84 HA LYS 15 HA LYS 15 1.665 -4.390 -2.885 85 HB2 LYS 15 HB2 LYS 15 -0.868 -4.303 -1.232 86 HB3 LYS 15 HB1 LYS 15 -0.360 -3.088 -2.397 87 HG2 LYS 15 HG2 LYS 15 -0.478 -4.824 -4.170 88 HG3 LYS 15 HG1 LYS 15 -1.145 -5.934 -2.973 89 HD2 LYS 15 HD2 LYS 15 -3.041 -4.441 -2.622 90 HD3 LYS 15 HD1 LYS 15 -2.357 -3.291 -3.771 91 HE2 LYS 15 HE2 LYS 15 -2.497 -5.011 -5.529 92 HE3 LYS 15 HE1 LYS 15 -3.258 -6.094 -4.369 93 HZ1 LYS 15 HZ1 LYS 15 -5.149 -4.749 -4.260 94 HZ2 LYS 15 HZ2 LYS 15 -4.777 -4.851 -5.908 95 HZ3 LYS 15 HZ3 LYS 15 -4.392 -3.454 -5.042 96 H LEU 16 HN LEU 16 3.551 -3.970 -1.694 97 HA LEU 16 HA LEU 16 3.206 -2.698 0.898 98 HB2 LEU 16 HB2 LEU 16 5.609 -3.638 -0.646 99 HB3 LEU 16 HB1 LEU 16 5.768 -2.592 0.744 100 HG LEU 16 HG LEU 16 4.562 -4.329 2.090 101 HD11 LEU 16 HD11 LEU 16 5.004 -5.972 -0.382 102 HD12 LEU 16 HD12 LEU 16 3.454 -5.492 0.313 103 HD13 LEU 16 HD13 LEU 16 4.508 -6.602 1.191 104 HD21 LEU 16 HD21 LEU 16 6.513 -5.802 2.290 105 HD22 LEU 16 HD22 LEU 16 6.972 -4.101 2.212 106 HD23 LEU 16 HD23 LEU 16 7.159 -5.130 0.792 107 H ALA 17 HN ALA 17 2.448 -0.670 0.568 108 HA ALA 17 HA ALA 17 3.905 1.001 -1.373 109 HB1 ALA 17 HB1 ALA 17 1.912 2.440 -1.435 110 HB2 ALA 17 HB2 ALA 17 1.092 1.333 -0.331 111 HB3 ALA 17 HB3 ALA 17 1.553 0.788 -1.943 112 H CYS 18 HN CYS 18 4.707 2.949 -0.734 113 HA CYS 18 HA CYS 18 4.931 3.453 2.093 114 HB2 CYS 18 HB2 CYS 18 5.894 4.971 -0.337 115 HB3 CYS 18 HB1 CYS 18 6.200 5.488 1.317 116 H CYS 19 HN CYS 19 3.282 4.290 3.166 117 HA CYS 19 HA CYS 19 1.594 6.272 1.805 118 HB2 CYS 19 HB2 CYS 19 0.644 4.036 3.597 119 HB3 CYS 19 HB1 CYS 19 -0.376 5.257 2.847 120 H ASP 20 HN ASP 20 0.520 7.771 3.127 121 HA ASP 20 HA ASP 20 1.896 8.306 5.655 122 HB2 ASP 20 HB2 ASP 20 0.086 9.992 3.928 123 HB3 ASP 20 HB1 ASP 20 0.635 10.502 5.516 124 H THR 21 HN THR 21 0.994 7.453 7.377 125 HA THR 21 HA THR 21 -1.734 6.606 7.423 126 HB THR 21 HB THR 21 -1.242 5.970 9.771 127 HG1 THR 21 HG1 THR 21 0.534 6.687 10.730 128 HG21 THR 21 HG21 THR 21 0.886 5.143 7.792 129 HG22 THR 21 HG22 THR 21 -0.723 4.434 7.921 130 HG23 THR 21 HG23 THR 21 0.425 4.263 9.249 131 H ASN 22 HN ASN 22 -0.238 9.553 7.922 132 HA ASN 22 HA ASN 22 -2.110 10.478 9.961 133 HB2 ASN 22 HB2 ASN 22 0.181 11.938 8.624 134 HB3 ASN 22 HB1 ASN 22 -0.748 12.507 10.004 135 HD21 ASN 22 HD21 ASN 22 -0.460 11.508 12.018 136 HD22 ASN 22 HD22 ASN 22 0.948 10.568 12.365 137 H LYS 23 HN LYS 23 -1.872 10.170 6.687 138 HA LYS 23 HA LYS 23 -3.757 12.372 6.223 139 HB2 LYS 23 HB2 LYS 23 -1.479 11.367 4.591 140 HB3 LYS 23 HB1 LYS 23 -2.856 12.080 3.785 141 HG2 LYS 23 HG2 LYS 23 -2.535 14.082 5.313 142 HG3 LYS 23 HG1 LYS 23 -0.999 13.338 5.742 143 HD2 LYS 23 HD2 LYS 23 -1.850 14.158 2.982 144 HD3 LYS 23 HD1 LYS 23 -0.651 14.973 3.998 145 HE2 LYS 23 HE2 LYS 23 0.785 13.084 3.945 146 HE3 LYS 23 HE1 LYS 23 -0.467 12.105 3.189 147 HZ1 LYS 23 HZ1 LYS 23 1.128 12.752 1.540 148 HZ2 LYS 23 HZ2 LYS 23 1.008 14.379 1.974 149 HZ3 LYS 23 HZ3 LYS 23 -0.301 13.605 1.231 150 H LYS 24 HN LYS 24 -5.611 11.876 5.466 151 HA LYS 24 HA LYS 24 -6.133 9.034 4.908 152 HB2 LYS 24 HB2 LYS 24 -7.930 11.087 6.188 153 HB3 LYS 24 HB1 LYS 24 -8.385 9.431 5.846 154 HG2 LYS 24 HG2 LYS 24 -7.901 9.487 8.129 155 HG3 LYS 24 HG1 LYS 24 -6.488 8.747 7.390 156 HD2 LYS 24 HD2 LYS 24 -5.223 10.745 7.625 157 HD3 LYS 24 HD1 LYS 24 -6.657 11.682 8.046 158 HE2 LYS 24 HE2 LYS 24 -5.255 11.182 10.004 159 HE3 LYS 24 HE1 LYS 24 -6.866 10.483 10.138 160 HZ1 LYS 24 HZ1 LYS 24 -5.939 8.352 9.443 161 HZ2 LYS 24 HZ2 LYS 24 -5.197 8.917 10.851 162 HZ3 LYS 24 HZ3 LYS 24 -4.390 9.028 9.370 163 H VAL 25 HN VAL 25 -7.766 8.520 3.432 164 HA VAL 25 HA VAL 25 -8.506 10.679 1.561 165 HB VAL 25 HB VAL 25 -8.452 7.747 0.868 166 HG11 VAL 25 HG11 VAL 25 -8.413 10.225 -0.842 167 HG12 VAL 25 HG12 VAL 25 -9.795 9.159 -0.577 168 HG13 VAL 25 HG13 VAL 25 -8.372 8.564 -1.434 169 HG21 VAL 25 HG21 VAL 25 -6.284 8.097 -0.214 170 HG22 VAL 25 HG22 VAL 25 -6.187 8.362 1.526 171 HG23 VAL 25 HG23 VAL 25 -6.227 9.741 0.426 172 H GLN 26 HN GLN 26 -10.668 10.634 0.761 173 HA GLN 26 HA GLN 26 -12.506 9.478 2.708 174 HB2 GLN 26 HB2 GLN 26 -12.925 11.644 0.649 175 HB3 GLN 26 HB1 GLN 26 -14.086 11.142 1.856 176 HG2 GLN 26 HG2 GLN 26 -11.428 12.450 2.348 177 HG3 GLN 26 HG1 GLN 26 -13.019 13.176 2.560 178 HE21 GLN 26 HE21 GLN 26 -10.833 12.804 4.461 179 HE22 GLN 26 HE22 GLN 26 -11.492 11.898 5.782 180 H LYS 27 HN LYS 27 -11.347 7.875 0.565 181 HA LYS 27 HA LYS 27 -13.819 7.176 -0.860 182 HB2 LYS 27 HB2 LYS 27 -11.040 7.207 -2.049 183 HB3 LYS 27 HB1 LYS 27 -12.498 6.648 -2.858 184 HG2 LYS 27 HG2 LYS 27 -12.530 9.398 -1.773 185 HG3 LYS 27 HG1 LYS 27 -11.521 9.093 -3.189 186 HD2 LYS 27 HD2 LYS 27 -13.809 9.856 -3.742 187 HD3 LYS 27 HD1 LYS 27 -13.415 8.289 -4.434 188 HE2 LYS 27 HE2 LYS 27 -14.715 7.169 -2.759 189 HE3 LYS 27 HE1 LYS 27 -14.970 8.677 -1.885 190 HZ1 LYS 27 HZ1 LYS 27 -16.229 9.512 -3.774 191 HZ2 LYS 27 HZ2 LYS 27 -16.904 8.074 -3.196 192 HZ3 LYS 27 HZ3 LYS 27 -15.979 8.062 -4.609 193 H SER 28 HN SER 28 -14.406 5.191 -0.296 194 HA SER 28 HA SER 28 -12.308 3.219 0.319 195 HB2 SER 28 HB2 SER 28 -15.210 3.218 1.191 196 HB3 SER 28 HB1 SER 28 -13.975 2.055 1.674 197 HG SER 28 HG SER 28 -12.825 4.064 2.441 198 H THR 29 HN THR 29 -12.563 3.509 -2.252 199 HA THR 29 HA THR 29 -14.570 1.639 -3.239 200 HB THR 29 HB THR 29 -13.491 2.536 -5.497 201 HG1 THR 29 HG1 THR 29 -12.154 4.129 -5.128 202 HG21 THR 29 HG21 THR 29 -15.420 4.098 -3.776 203 HG22 THR 29 HG22 THR 29 -15.833 2.784 -4.878 204 HG23 THR 29 HG23 THR 29 -15.207 4.304 -5.514 205 H GLY 30 HN GLY 30 -11.569 2.201 -4.929 206 HA2 GLY 30 HA2 GLY 30 -9.741 0.800 -5.278 207 HA3 GLY 30 HA1 GLY 30 -10.401 -0.321 -4.094 208 H GLU 31 HN GLU 31 -9.280 -1.018 -6.651 209 HA GLU 31 HA GLU 31 -11.634 -1.776 -8.218 210 HB2 GLU 31 HB2 GLU 31 -8.704 -2.028 -8.900 211 HB3 GLU 31 HB1 GLU 31 -10.037 -2.437 -9.966 212 HG2 GLU 31 HG2 GLU 31 -10.766 -0.079 -9.895 213 HG3 GLU 31 HG1 GLU 31 -9.343 0.297 -8.923 214 H GLU 32 HN GLU 32 -8.736 -3.257 -6.752 215 HA GLU 32 HA GLU 32 -9.666 -5.882 -7.450 216 HB2 GLU 32 HB2 GLU 32 -7.326 -4.981 -5.768 217 HB3 GLU 32 HB1 GLU 32 -7.661 -6.659 -6.182 218 HG2 GLU 32 HG2 GLU 32 -7.488 -6.085 -8.567 219 HG3 GLU 32 HG1 GLU 32 -7.091 -4.428 -8.124 220 H SER 33 HN SER 33 -9.760 -3.812 -4.618 221 HA SER 33 HA SER 33 -10.827 -5.502 -2.722 222 HB2 SER 33 HB2 SER 33 -11.825 -2.731 -3.424 223 HB3 SER 33 HB1 SER 33 -12.151 -3.580 -1.914 224 HG SER 33 HG SER 33 -9.683 -2.610 -2.902 225 H GLY 34 HN GLY 34 -12.375 -4.329 -5.662 226 HA2 GLY 34 HA2 GLY 34 -14.994 -5.262 -4.899 227 HA3 GLY 34 HA1 GLY 34 -14.527 -4.632 -6.470 228 H LEU 35 HN LEU 35 -12.276 -6.544 -6.647 229 HA LEU 35 HA LEU 35 -13.728 -8.653 -7.929 230 HB2 LEU 35 HB2 LEU 35 -10.770 -8.290 -7.445 231 HB3 LEU 35 HB1 LEU 35 -11.469 -9.552 -8.442 232 HG LEU 35 HG LEU 35 -11.694 -6.590 -8.986 233 HD11 LEU 35 HD11 LEU 35 -10.170 -7.033 -10.843 234 HD12 LEU 35 HD12 LEU 35 -10.012 -8.709 -10.316 235 HD13 LEU 35 HD13 LEU 35 -9.418 -7.402 -9.292 236 HD21 LEU 35 HD21 LEU 35 -12.551 -8.990 -10.596 237 HD22 LEU 35 HD22 LEU 35 -12.575 -7.321 -11.160 238 HD23 LEU 35 HD23 LEU 35 -13.611 -7.813 -9.822 239 H LEU 36 HN LEU 36 -12.184 -8.195 -4.884 240 HA LEU 36 HA LEU 36 -12.519 -11.041 -4.229 241 HB2 LEU 36 HB2 LEU 36 -10.236 -9.805 -4.093 242 HB3 LEU 36 HB1 LEU 36 -10.896 -9.077 -2.643 243 HG LEU 36 HG LEU 36 -11.186 -11.340 -1.673 244 HD11 LEU 36 HD11 LEU 36 -10.050 -13.232 -2.756 245 HD12 LEU 36 HD12 LEU 36 -9.742 -12.221 -4.168 246 HD13 LEU 36 HD13 LEU 36 -11.396 -12.626 -3.718 247 HD21 LEU 36 HD21 LEU 36 -9.181 -10.001 -1.227 248 HD22 LEU 36 HD22 LEU 36 -8.391 -10.740 -2.618 249 HD23 LEU 36 HD23 LEU 36 -8.834 -11.728 -1.229 250 H HIS 37 HN HIS 37 -13.085 -11.376 -1.833 251 HA HIS 37 HA HIS 37 -15.414 -9.779 -1.234 252 HB2 HIS 37 HB2 HIS 37 -14.199 -12.172 0.148 253 HB3 HIS 37 HB1 HIS 37 -15.617 -11.331 0.760 254 HD1 HIS 37 HD1 HIS 37 -15.036 -14.306 -0.793 255 HD2 HIS 37 HD2 HIS 37 -17.440 -11.085 -1.844 256 HE1 HIS 37 HE1 HIS 37 -16.776 -15.241 -2.348 257 HE2 HIS 37 HE2 HIS 37 -18.083 -13.233 -3.128 258 H THR 38 HN THR 38 -12.342 -9.088 -0.829 259 HA THR 38 HA THR 38 -12.189 -8.315 1.900 260 HB THR 38 HB THR 38 -10.254 -6.880 0.995 261 HG1 THR 38 HG1 THR 38 -9.828 -7.019 -1.102 262 HG21 THR 38 HG21 THR 38 -8.818 -8.858 0.718 263 HG22 THR 38 HG22 THR 38 -10.254 -9.870 0.566 264 HG23 THR 38 HG23 THR 38 -9.918 -9.040 2.084 265 H GLY 39 HN GLY 39 -13.305 -6.788 -1.036 266 HA2 GLY 39 HA2 GLY 39 -13.483 -4.156 0.140 267 HA3 GLY 39 HA1 GLY 39 -14.076 -4.635 -1.442 268 H ASP 40 HN ASP 40 -15.077 -6.700 1.025 269 HA ASP 40 HA ASP 40 -17.811 -5.814 0.779 270 HB2 ASP 40 HB2 ASP 40 -16.428 -8.153 2.016 271 HB3 ASP 40 HB1 ASP 40 -18.061 -7.761 2.531 272 H VAL 41 HN VAL 41 -15.220 -5.388 2.958 273 HA VAL 41 HA VAL 41 -16.923 -4.459 5.120 274 HB VAL 41 HB VAL 41 -14.679 -3.804 6.173 275 HG11 VAL 41 HG11 VAL 41 -14.213 -6.123 6.846 276 HG12 VAL 41 HG12 VAL 41 -15.223 -6.708 5.523 277 HG13 VAL 41 HG13 VAL 41 -15.944 -5.787 6.842 278 HG21 VAL 41 HG21 VAL 41 -13.660 -5.502 3.897 279 HG22 VAL 41 HG22 VAL 41 -12.716 -4.974 5.288 280 HG23 VAL 41 HG23 VAL 41 -13.343 -3.787 4.148 281 H LEU 42 HN LEU 42 -17.192 -2.357 5.741 282 HA LEU 42 HA LEU 42 -16.423 -0.324 3.818 283 HB2 LEU 42 HB2 LEU 42 -18.337 -0.413 6.119 284 HB3 LEU 42 HB1 LEU 42 -17.944 1.071 5.298 285 HG LEU 42 HG LEU 42 -19.165 -1.339 3.962 286 HD11 LEU 42 HD11 LEU 42 -20.463 1.235 4.846 287 HD12 LEU 42 HD12 LEU 42 -20.694 -0.345 5.592 288 HD13 LEU 42 HD13 LEU 42 -21.240 -0.064 3.940 289 HD21 LEU 42 HD21 LEU 42 -17.878 0.044 2.433 290 HD22 LEU 42 HD22 LEU 42 -18.726 1.485 2.994 291 HD23 LEU 42 HD23 LEU 42 -19.604 0.228 2.122 292 H ASP 43 HN ASP 43 -15.201 -1.663 6.592 293 HA ASP 43 HA ASP 43 -14.289 0.779 7.831 294 HB2 ASP 43 HB2 ASP 43 -13.171 -0.654 9.460 295 HB3 ASP 43 HB1 ASP 43 -14.841 -1.161 9.235 296 H GLN 44 HN GLN 44 -13.261 -0.982 5.188 297 HA GLN 44 HA GLN 44 -10.550 -1.035 5.196 298 HB2 GLN 44 HB2 GLN 44 -12.057 0.233 2.930 299 HB3 GLN 44 HB1 GLN 44 -10.543 -0.631 2.847 300 HG2 GLN 44 HG2 GLN 44 -11.717 -2.706 3.459 301 HG3 GLN 44 HG1 GLN 44 -13.241 -1.818 3.426 302 HE21 GLN 44 HE21 GLN 44 -10.706 -3.246 1.544 303 HE22 GLN 44 HE22 GLN 44 -11.461 -3.045 0.000 304 H VAL 45 HN VAL 45 -8.925 0.371 5.273 305 HA VAL 45 HA VAL 45 -9.647 3.146 5.783 306 HB VAL 45 HB VAL 45 -8.519 1.997 7.612 307 HG11 VAL 45 HG11 VAL 45 -6.426 1.532 5.586 308 HG12 VAL 45 HG12 VAL 45 -7.146 0.424 6.759 309 HG13 VAL 45 HG13 VAL 45 -6.003 1.656 7.294 310 HG21 VAL 45 HG21 VAL 45 -8.280 4.403 7.427 311 HG22 VAL 45 HG22 VAL 45 -6.881 4.193 6.375 312 HG23 VAL 45 HG23 VAL 45 -6.798 3.687 8.061 313 H ALA 46 HN ALA 46 -9.248 4.585 4.338 314 HA ALA 46 HA ALA 46 -7.267 4.017 2.253 315 HB1 ALA 46 HB1 ALA 46 -9.457 6.088 2.279 316 HB2 ALA 46 HB2 ALA 46 -9.575 4.493 1.536 317 HB3 ALA 46 HB3 ALA 46 -8.418 5.671 0.917 318 H ILE 47 HN ILE 47 -5.345 4.898 2.533 319 HA ILE 47 HA ILE 47 -5.210 7.637 3.606 320 HB ILE 47 HB ILE 47 -2.887 7.076 4.400 321 HG12 ILE 47 HG12 ILE 47 -3.837 4.230 4.006 322 HG13 ILE 47 HG11 ILE 47 -2.560 5.021 3.089 323 HG21 ILE 47 HG21 ILE 47 -5.177 5.619 5.708 324 HG22 ILE 47 HG22 ILE 47 -4.733 7.310 5.946 325 HG23 ILE 47 HG23 ILE 47 -3.643 6.029 6.481 326 HD11 ILE 47 HD11 ILE 47 -2.535 4.351 6.020 327 HD12 ILE 47 HD12 ILE 47 -1.290 5.289 5.198 328 HD13 ILE 47 HD13 ILE 47 -1.570 3.609 4.745 329 H GLN 48 HN GLN 48 -3.357 8.878 2.817 330 HA GLN 48 HA GLN 48 -3.107 8.587 -0.026 331 HB2 GLN 48 HB2 GLN 48 -2.382 10.606 1.968 332 HB3 GLN 48 HB1 GLN 48 -1.199 10.443 0.679 333 HG2 GLN 48 HG2 GLN 48 -2.620 12.084 -0.101 334 HG3 GLN 48 HG1 GLN 48 -3.199 10.638 -0.910 335 HE21 GLN 48 HE21 GLN 48 -5.208 11.587 -1.240 336 HE22 GLN 48 HE22 GLN 48 -6.349 11.770 0.044 337 H CYS 49 HN CYS 49 -1.616 7.778 -1.186 338 HA CYS 49 HA CYS 49 0.778 6.710 0.135 339 HB2 CYS 49 HB2 CYS 49 -0.947 5.395 -1.968 340 HB3 CYS 49 HB1 CYS 49 0.573 4.762 -1.371 341 H THR 50 HN THR 50 2.663 6.617 -1.139 342 HA THR 50 HA THR 50 2.666 7.571 -3.830 343 HB THR 50 HB THR 50 2.400 9.737 -2.769 344 HG1 THR 50 HG1 THR 50 3.706 10.047 -4.459 345 HG21 THR 50 HG21 THR 50 4.885 9.048 -1.206 346 HG22 THR 50 HG22 THR 50 3.254 9.187 -0.554 347 HG23 THR 50 HG23 THR 50 4.068 10.610 -1.201 348 H GLN 51 HN GLN 51 4.411 6.874 -4.884 349 HA GLN 51 HA GLN 51 6.563 5.745 -3.245 350 HB2 GLN 51 HB2 GLN 51 4.989 4.074 -4.236 351 HB3 GLN 51 HB1 GLN 51 5.519 4.603 -5.827 352 HG2 GLN 51 HG2 GLN 51 6.658 2.557 -5.057 353 HG3 GLN 51 HG1 GLN 51 7.752 3.897 -5.395 354 HE21 GLN 51 HE21 GLN 51 9.324 2.828 -4.095 355 HE22 GLN 51 HE22 GLN 51 9.244 2.952 -2.368 356 H ILE 52 HN ILE 52 8.322 6.838 -3.530 357 HA ILE 52 HA ILE 52 9.042 8.491 -5.658 358 HB ILE 52 HB ILE 52 10.822 6.949 -3.749 359 HG12 ILE 52 HG12 ILE 52 9.618 9.717 -3.582 360 HG13 ILE 52 HG11 ILE 52 9.229 8.338 -2.561 361 HG21 ILE 52 HG21 ILE 52 12.535 8.578 -4.211 362 HG22 ILE 52 HG22 ILE 52 11.463 9.451 -5.302 363 HG23 ILE 52 HG23 ILE 52 12.026 7.834 -5.726 364 HD11 ILE 52 HD11 ILE 52 11.869 9.771 -2.669 365 HD12 ILE 52 HD12 ILE 52 11.494 8.385 -1.649 366 HD13 ILE 52 HD13 ILE 52 10.654 9.915 -1.400 367 HA PRO 53 HA PRO 53 9.651 6.090 -9.277 368 HB2 PRO 53 HB2 PRO 53 12.447 7.166 -9.106 369 HB3 PRO 53 HB1 PRO 53 11.398 7.000 -10.521 370 HG2 PRO 53 HG2 PRO 53 11.649 9.340 -9.248 371 HG3 PRO 53 HG1 PRO 53 10.106 8.825 -9.947 372 HD2 PRO 53 HD2 PRO 53 10.879 9.076 -7.124 373 HD3 PRO 53 HD1 PRO 53 9.263 8.991 -7.843 374 H LEU 54 HN LEU 54 9.988 4.049 -9.570 375 HA LEU 54 HA LEU 54 10.922 2.421 -7.520 376 HB2 LEU 54 HB2 LEU 54 10.501 1.647 -10.400 377 HB3 LEU 54 HB1 LEU 54 10.478 0.574 -9.016 378 HG LEU 54 HG LEU 54 8.470 2.768 -9.544 379 HD11 LEU 54 HD11 LEU 54 6.927 0.956 -10.043 380 HD12 LEU 54 HD12 LEU 54 8.222 -0.221 -9.829 381 HD13 LEU 54 HD13 LEU 54 8.297 0.943 -11.152 382 HD21 LEU 54 HD21 LEU 54 8.770 2.324 -7.164 383 HD22 LEU 54 HD22 LEU 54 8.521 0.601 -7.447 384 HD23 LEU 54 HD23 LEU 54 7.204 1.739 -7.726 385 H LEU 55 HN LEU 55 12.759 1.436 -7.083 386 HA LEU 55 HA LEU 55 14.982 1.647 -8.999 387 HB2 LEU 55 HB2 LEU 55 14.970 1.282 -6.003 388 HB3 LEU 55 HB1 LEU 55 16.411 1.231 -6.994 389 HG LEU 55 HG LEU 55 14.609 3.634 -6.704 390 HD11 LEU 55 HD11 LEU 55 16.442 4.579 -5.381 391 HD12 LEU 55 HD12 LEU 55 17.290 3.035 -5.466 392 HD13 LEU 55 HD13 LEU 55 15.747 3.148 -4.619 393 HD21 LEU 55 HD21 LEU 55 17.284 3.270 -8.048 394 HD22 LEU 55 HD22 LEU 55 16.477 4.817 -7.792 395 HD23 LEU 55 HD23 LEU 55 15.743 3.604 -8.840 396 H ILE 56 HN ILE 56 15.868 -0.195 -9.776 397 HA ILE 56 HA ILE 56 14.399 -2.610 -9.515 398 HB ILE 56 HB ILE 56 17.162 -2.374 -10.680 399 HG12 ILE 56 HG12 ILE 56 14.524 -1.866 -12.075 400 HG13 ILE 56 HG11 ILE 56 15.678 -0.616 -11.627 401 HG21 ILE 56 HG21 ILE 56 16.351 -4.637 -10.399 402 HG22 ILE 56 HG22 ILE 56 16.399 -4.219 -12.113 403 HG23 ILE 56 HG23 ILE 56 14.861 -4.231 -11.249 404 HD11 ILE 56 HD11 ILE 56 16.167 -2.854 -13.579 405 HD12 ILE 56 HD12 ILE 56 17.326 -1.604 -13.131 406 HD13 ILE 56 HD13 ILE 56 15.846 -1.168 -13.982 407 H GLY 57 HN GLY 57 14.703 -4.316 -8.273 408 HA2 GLY 57 HA2 GLY 57 15.554 -5.726 -6.678 409 HA3 GLY 57 HA1 GLY 57 17.145 -5.134 -7.127 410 H ILE 58 HN ILE 58 14.723 -2.903 -6.010 411 HA ILE 58 HA ILE 58 16.263 -2.627 -3.530 412 HB ILE 58 HB ILE 58 15.379 -0.689 -5.492 413 HG12 ILE 58 HG12 ILE 58 17.701 -1.084 -4.764 414 HG13 ILE 58 HG11 ILE 58 17.206 0.591 -4.558 415 HG21 ILE 58 HG21 ILE 58 13.641 -0.125 -3.939 416 HG22 ILE 58 HG22 ILE 58 14.883 1.127 -3.889 417 HG23 ILE 58 HG23 ILE 58 14.794 -0.082 -2.605 418 HD11 ILE 58 HD11 ILE 58 18.507 -0.199 -2.658 419 HD12 ILE 58 HD12 ILE 58 17.332 -1.484 -2.378 420 HD13 ILE 58 HD13 ILE 58 16.860 0.201 -2.177 421 H ALA 59 HN ALA 59 15.262 -2.090 -1.660 422 HA ALA 59 HA ALA 59 12.742 -3.394 -1.208 423 HB1 ALA 59 HB1 ALA 59 14.737 -2.002 0.553 424 HB2 ALA 59 HB2 ALA 59 14.493 -3.738 0.361 425 HB3 ALA 59 HB3 ALA 59 13.266 -2.760 1.166 426 H ILE 60 HN ILE 60 10.874 -2.472 -0.434 427 HA ILE 60 HA ILE 60 10.064 0.016 -1.422 428 HB ILE 60 HB ILE 60 8.470 -1.741 -0.901 429 HG12 ILE 60 HG12 ILE 60 6.800 -0.430 0.437 430 HG13 ILE 60 HG11 ILE 60 8.068 0.743 0.771 431 HG21 ILE 60 HG21 ILE 60 9.536 -2.744 1.018 432 HG22 ILE 60 HG22 ILE 60 7.875 -2.307 1.419 433 HG23 ILE 60 HG23 ILE 60 9.212 -1.306 1.989 434 HD11 ILE 60 HD11 ILE 60 8.272 1.208 -1.603 435 HD12 ILE 60 HD12 ILE 60 6.620 1.465 -1.040 436 HD13 ILE 60 HD13 ILE 60 7.025 0.010 -1.950 437 H GLU 61 HN GLU 61 11.254 -0.875 1.790 438 HA GLU 61 HA GLU 61 10.569 1.712 2.858 439 HB2 GLU 61 HB2 GLU 61 11.589 0.800 4.975 440 HB3 GLU 61 HB1 GLU 61 10.195 -0.060 4.359 441 HG2 GLU 61 HG2 GLU 61 11.715 -1.685 5.117 442 HG3 GLU 61 HG1 GLU 61 11.791 -1.728 3.364 443 H ASP 62 HN ASP 62 13.120 0.568 1.094 444 HA ASP 62 HA ASP 62 14.945 2.580 2.219 445 HB2 ASP 62 HB2 ASP 62 15.870 0.290 1.972 446 HB3 ASP 62 HB1 ASP 62 15.557 0.372 0.240 447 H GLU 63 HN GLU 63 13.080 1.662 -0.534 448 HA GLU 63 HA GLU 63 14.246 3.367 -2.460 449 HB2 GLU 63 HB2 GLU 63 12.806 1.396 -2.957 450 HB3 GLU 63 HB1 GLU 63 11.424 2.294 -2.350 451 HG2 GLU 63 HG2 GLU 63 11.616 3.894 -4.102 452 HG3 GLU 63 HG1 GLU 63 13.126 3.192 -4.645 453 H CYS 64 HN CYS 64 11.653 3.772 -0.125 454 HA CYS 64 HA CYS 64 11.306 6.543 -1.057 455 HB2 CYS 64 HB2 CYS 64 9.052 6.431 -0.499 456 HB3 CYS 64 HB1 CYS 64 9.360 4.791 -1.069 457 H LYS 65 HN LYS 65 10.351 7.911 0.911 458 HA LYS 65 HA LYS 65 11.884 7.240 3.329 459 HB2 LYS 65 HB2 LYS 65 11.710 9.886 1.904 460 HB3 LYS 65 HB1 LYS 65 12.133 9.781 3.607 461 HG2 LYS 65 HG2 LYS 65 13.628 8.376 1.406 462 HG3 LYS 65 HG1 LYS 65 14.089 9.935 2.098 463 HD2 LYS 65 HD2 LYS 65 14.336 8.914 4.289 464 HD3 LYS 65 HD1 LYS 65 13.802 7.362 3.650 465 HE2 LYS 65 HE2 LYS 65 16.278 8.855 2.801 466 HE3 LYS 65 HE1 LYS 65 16.240 7.476 3.895 467 HZ1 LYS 65 HZ1 LYS 65 15.402 7.457 1.046 468 HZ2 LYS 65 HZ2 LYS 65 15.331 6.132 2.095 469 HZ3 LYS 65 HZ3 LYS 65 16.828 6.793 1.667 470 H ASN 66 HN ASN 66 9.099 6.797 2.608 471 HA ASN 66 HA ASN 66 7.724 8.522 4.554 472 HB2 ASN 66 HB2 ASN 66 6.897 8.021 2.092 473 HB3 ASN 66 HB1 ASN 66 6.274 6.566 2.843 474 HD21 ASN 66 HD21 ASN 66 4.977 8.931 1.670 475 HD22 ASN 66 HD22 ASN 66 3.865 9.495 2.872 476 H THR 67 HN THR 67 5.642 6.282 4.580 477 HA THR 67 HA THR 67 7.055 4.477 6.432 478 HB THR 67 HB THR 67 4.113 5.194 6.504 479 HG1 THR 67 HG1 THR 67 6.383 6.323 7.705 480 HG21 THR 67 HG21 THR 67 4.246 4.161 8.769 481 HG22 THR 67 HG22 THR 67 5.900 3.662 8.398 482 HG23 THR 67 HG23 THR 67 4.553 3.018 7.461 483 HA PRO 68 HA PRO 68 5.881 1.373 3.487 484 HB2 PRO 68 HB2 PRO 68 6.901 -0.752 4.836 485 HB3 PRO 68 HB1 PRO 68 7.905 0.390 3.945 486 HG2 PRO 68 HG2 PRO 68 7.494 0.116 6.862 487 HG3 PRO 68 HG1 PRO 68 8.904 0.710 5.975 488 HD2 PRO 68 HD2 PRO 68 6.984 2.275 7.278 489 HD3 PRO 68 HD1 PRO 68 8.195 2.847 6.126 490 H THR 69 HN THR 69 3.884 0.580 3.269 491 HA THR 69 HA THR 69 2.617 -0.631 5.628 492 HB THR 69 HB THR 69 0.462 0.352 4.992 493 HG1 THR 69 HG1 THR 69 1.999 1.406 2.856 494 HG21 THR 69 HG21 THR 69 0.937 2.728 5.495 495 HG22 THR 69 HG22 THR 69 2.656 2.410 5.267 496 HG23 THR 69 HG23 THR 69 1.780 1.623 6.580 497 H CYS 70 HN CYS 70 1.262 -2.363 5.245 498 HA CYS 70 HA CYS 70 1.397 -3.547 2.567 499 HB2 CYS 70 HB2 CYS 70 2.016 -5.098 4.260 500 HB3 CYS 70 HB1 CYS 70 0.667 -4.632 5.289 501 H CYS 71 HN CYS 71 -0.175 -2.849 1.268 502 HA CYS 71 HA CYS 71 -2.777 -2.132 2.389 503 HB2 CYS 71 HB2 CYS 71 -1.748 -1.782 -0.434 504 HB3 CYS 71 HB1 CYS 71 -3.214 -1.086 0.238 505 H GLU 72 HN GLU 72 -4.661 -3.098 1.851 506 HA GLU 72 HA GLU 72 -4.543 -5.776 0.847 507 HB2 GLU 72 HB2 GLU 72 -6.047 -5.639 2.566 508 HB3 GLU 72 HB1 GLU 72 -6.504 -3.990 2.186 509 HG2 GLU 72 HG2 GLU 72 -7.868 -4.753 0.375 510 HG3 GLU 72 HG1 GLU 72 -7.380 -6.421 0.676 511 H ASP 73 HN ASP 73 -5.357 -2.624 -0.299 512 HA ASP 73 HA ASP 73 -5.335 -3.521 -3.045 513 HB2 ASP 73 HB2 ASP 73 -7.740 -3.801 -2.281 514 HB3 ASP 73 HB1 ASP 73 -7.788 -2.054 -2.077 515 H VAL 74 HN VAL 74 -5.221 -1.591 -4.505 516 HA VAL 74 HA VAL 74 -4.931 0.984 -3.132 517 HB VAL 74 HB VAL 74 -2.865 0.319 -5.198 518 HG11 VAL 74 HG11 VAL 74 -1.611 2.059 -4.095 519 HG12 VAL 74 HG12 VAL 74 -2.830 2.169 -2.827 520 HG13 VAL 74 HG13 VAL 74 -3.235 2.635 -4.478 521 HG21 VAL 74 HG21 VAL 74 -2.514 -0.229 -2.250 522 HG22 VAL 74 HG22 VAL 74 -1.272 -0.366 -3.495 523 HG23 VAL 74 HG23 VAL 74 -2.657 -1.458 -3.504 524 H GLU 75 HN GLU 75 -5.753 2.640 -4.296 525 HA GLU 75 HA GLU 75 -6.768 1.961 -6.974 526 HB2 GLU 75 HB2 GLU 75 -8.410 2.562 -5.148 527 HB3 GLU 75 HB1 GLU 75 -7.733 4.184 -5.170 528 HG2 GLU 75 HG2 GLU 75 -8.397 4.451 -7.491 529 HG3 GLU 75 HG1 GLU 75 -9.036 2.809 -7.509 530 H ASP 76 HN ASP 76 -6.925 3.809 -8.512 531 HA ASP 76 HA ASP 76 -5.976 5.420 -9.794 532 HB2 ASP 76 HB2 ASP 76 -4.814 6.343 -7.154 533 HB3 ASP 76 HB1 ASP 76 -4.611 7.217 -8.666 534 H ASP 77 HN ASP 77 -3.299 6.537 -9.464 535 HA ASP 77 HA ASP 77 -1.731 4.472 -10.602 536 HB2 ASP 77 HB2 ASP 77 -1.352 6.892 -11.004 537 HB3 ASP 77 HB1 ASP 77 -0.811 7.068 -9.339 538 H GLY 78 HN GLY 78 -2.720 4.876 -7.491 539 HA2 GLY 78 HA2 GLY 78 -1.955 3.170 -5.889 540 HA3 GLY 78 HA1 GLY 78 -0.316 3.586 -6.366 541 H LEU 79 HN LEU 79 -2.724 6.048 -6.061 542 HA LEU 79 HA LEU 79 -1.112 7.299 -3.986 543 HB2 LEU 79 HB2 LEU 79 -3.460 8.415 -5.509 544 HB3 LEU 79 HB1 LEU 79 -2.344 9.316 -4.502 545 HG LEU 79 HG LEU 79 -1.627 7.917 -7.083 546 HD11 LEU 79 HD11 LEU 79 -1.953 10.852 -6.484 547 HD12 LEU 79 HD12 LEU 79 -3.073 9.862 -7.420 548 HD13 LEU 79 HD13 LEU 79 -1.440 10.147 -8.017 549 HD21 LEU 79 HD21 LEU 79 0.497 9.115 -6.868 550 HD22 LEU 79 HD22 LEU 79 0.240 7.998 -5.528 551 HD23 LEU 79 HD23 LEU 79 -0.010 9.726 -5.295 552 H VAL 80 HN VAL 80 -3.964 5.491 -4.233 553 HA VAL 80 HA VAL 80 -4.753 6.342 -1.526 554 HB VAL 80 HB VAL 80 -6.625 5.509 -3.754 555 HG11 VAL 80 HG11 VAL 80 -7.386 4.667 -1.600 556 HG12 VAL 80 HG12 VAL 80 -8.427 5.977 -2.157 557 HG13 VAL 80 HG13 VAL 80 -7.227 6.278 -0.899 558 HG21 VAL 80 HG21 VAL 80 -5.853 7.774 -4.051 559 HG22 VAL 80 HG22 VAL 80 -6.231 8.159 -2.373 560 HG23 VAL 80 HG23 VAL 80 -7.530 7.792 -3.508 561 H GLY 81 HN GLY 81 -4.132 4.732 -0.241 562 HA2 GLY 81 HA2 GLY 81 -4.253 1.987 -1.260 563 HA3 GLY 81 HA1 GLY 81 -3.354 2.524 0.151 564 H ILE 82 HN ILE 82 -5.378 0.370 -0.301 565 HA ILE 82 HA ILE 82 -7.410 1.192 1.654 566 HB ILE 82 HB ILE 82 -7.363 -0.887 -0.496 567 HG12 ILE 82 HG12 ILE 82 -9.728 -0.051 -0.778 568 HG13 ILE 82 HG11 ILE 82 -9.372 1.151 0.459 569 HG21 ILE 82 HG21 ILE 82 -9.417 -1.905 0.537 570 HG22 ILE 82 HG22 ILE 82 -8.975 -1.073 2.028 571 HG23 ILE 82 HG23 ILE 82 -7.889 -2.272 1.335 572 HD11 ILE 82 HD11 ILE 82 -9.158 2.088 -1.757 573 HD12 ILE 82 HD12 ILE 82 -7.964 0.858 -2.175 574 HD13 ILE 82 HD13 ILE 82 -7.598 2.057 -0.931 575 H ASN 83 HN ASN 83 -7.150 0.558 3.668 576 HA ASN 83 HA ASN 83 -6.563 -0.643 5.498 577 HB2 ASN 83 HB2 ASN 83 -6.947 -2.801 3.456 578 HB3 ASN 83 HB1 ASN 83 -6.387 -3.210 5.076 579 HD21 ASN 83 HD21 ASN 83 -8.914 -3.795 3.643 580 HD22 ASN 83 HD22 ASN 83 -10.151 -3.217 4.696 581 H CYS 84 HN CYS 84 -4.531 0.689 4.398 582 HA CYS 84 HA CYS 84 -2.263 -1.042 3.957 583 HB2 CYS 84 HB2 CYS 84 -2.415 1.962 4.226 584 HB3 CYS 84 HB1 CYS 84 -0.999 1.054 3.712 585 H THR 85 HN THR 85 -1.941 -2.157 5.827 586 HA THR 85 HA THR 85 -1.675 -0.768 8.346 587 HB THR 85 HB THR 85 -1.105 -3.671 7.724 588 HG1 THR 85 HG1 THR 85 -3.462 -2.237 8.003 589 HG21 THR 85 HG21 THR 85 -1.556 -3.977 10.132 590 HG22 THR 85 HG22 THR 85 -1.728 -2.228 10.307 591 HG23 THR 85 HG23 THR 85 -0.172 -2.921 9.848 592 HA PRO 86 HA PRO 86 2.633 0.139 7.624 593 HB2 PRO 86 HB2 PRO 86 2.665 0.668 10.527 594 HB3 PRO 86 HB1 PRO 86 3.049 1.751 9.185 595 HG2 PRO 86 HG2 PRO 86 0.799 2.051 10.586 596 HG3 PRO 86 HG1 PRO 86 0.825 2.303 8.830 597 HD2 PRO 86 HD2 PRO 86 -0.121 -0.079 10.384 598 HD3 PRO 86 HD1 PRO 86 -0.875 0.743 9.006 599 H ILE 87 HN ILE 87 4.334 -1.161 7.614 600 HA ILE 87 HA ILE 87 4.345 -3.409 9.459 601 HB ILE 87 HB ILE 87 6.067 -4.297 7.764 602 HG12 ILE 87 HG12 ILE 87 4.626 -2.348 5.968 603 HG13 ILE 87 HG11 ILE 87 6.239 -2.049 6.600 604 HG21 ILE 87 HG21 ILE 87 3.911 -5.293 8.069 605 HG22 ILE 87 HG22 ILE 87 4.218 -5.154 6.335 606 HG23 ILE 87 HG23 ILE 87 3.139 -4.011 7.134 607 HD11 ILE 87 HD11 ILE 87 6.399 -2.892 4.366 608 HD12 ILE 87 HD12 ILE 87 5.393 -4.284 4.775 609 HD13 ILE 87 HD13 ILE 87 7.002 -4.123 5.480 610 HA PRO 88 HA PRO 88 7.879 -1.631 11.439 611 HB2 PRO 88 HB2 PRO 88 8.362 -4.257 12.597 612 HB3 PRO 88 HB1 PRO 88 7.815 -2.784 13.391 613 HG2 PRO 88 HG2 PRO 88 6.206 -4.904 13.083 614 HG3 PRO 88 HG1 PRO 88 5.596 -3.240 12.985 615 HD2 PRO 88 HD2 PRO 88 6.359 -5.094 10.749 616 HD3 PRO 88 HD1 PRO 88 4.881 -4.139 10.947 617 H LEU 89 HN LEU 89 10.118 -1.741 11.491 618 HA LEU 89 HA LEU 89 11.321 -3.384 9.385 619 HB2 LEU 89 HB2 LEU 89 12.491 -1.077 10.936 620 HB3 LEU 89 HB1 LEU 89 13.204 -1.850 9.532 621 HG LEU 89 HG LEU 89 10.662 -0.220 9.554 622 HD11 LEU 89 HD11 LEU 89 11.944 1.362 8.210 623 HD12 LEU 89 HD12 LEU 89 13.379 0.348 8.378 624 HD13 LEU 89 HD13 LEU 89 12.676 1.128 9.798 625 HD21 LEU 89 HD21 LEU 89 12.093 -1.567 7.267 626 HD22 LEU 89 HD22 LEU 89 10.716 -0.475 7.120 627 HD23 LEU 89 HD23 LEU 89 10.527 -2.029 7.932 628 H ILE 90 HN ILE 90 10.554 -4.330 12.102 629 HA ILE 90 HA ILE 90 13.215 -5.035 13.123 630 HB ILE 90 HB ILE 90 12.174 -5.034 15.415 631 HG12 ILE 90 HG12 ILE 90 10.002 -3.473 13.995 632 HG13 ILE 90 HG11 ILE 90 9.811 -5.065 14.719 633 HG21 ILE 90 HG21 ILE 90 13.675 -3.285 14.777 634 HG22 ILE 90 HG22 ILE 90 12.319 -2.547 15.628 635 HG23 ILE 90 HG23 ILE 90 12.410 -2.457 13.867 636 HD11 ILE 90 HD11 ILE 90 10.450 -2.516 16.184 637 HD12 ILE 90 HD12 ILE 90 10.277 -4.109 16.919 638 HD13 ILE 90 HD13 ILE 90 8.892 -3.340 16.147 Start of MODEL 12 1 H1 GLY 1 HT1 GLY 1 9.592 -8.681 -10.925 2 H2 GLY 1 HT2 GLY 1 9.634 -7.759 -9.512 3 H3 GLY 1 HT3 GLY 1 10.546 -7.286 -10.853 4 HA2 GLY 1 HA1 GLY 1 8.570 -5.915 -10.626 5 HA3 GLY 1 HA2 GLY 1 8.551 -6.849 -12.116 6 H SER 2 HN SER 2 6.191 -5.938 -11.368 7 HA SER 2 HA SER 2 4.047 -6.497 -10.907 8 HB2 SER 2 HB2 SER 2 4.558 -8.433 -12.377 9 HB3 SER 2 HB1 SER 2 5.060 -9.352 -10.960 10 HG SER 2 HG SER 2 2.527 -8.704 -11.856 11 H GLY 3 HN GLY 3 4.150 -5.501 -8.872 12 HA2 GLY 3 HA2 GLY 3 3.387 -5.741 -6.633 13 HA3 GLY 3 HA1 GLY 3 4.017 -7.385 -6.624 14 H TRP 4 HN TRP 4 4.853 -6.424 -4.496 15 HA TRP 4 HA TRP 4 7.470 -5.175 -5.016 16 HB2 TRP 4 HB2 TRP 4 5.533 -4.795 -2.769 17 HB3 TRP 4 HB1 TRP 4 7.251 -4.530 -2.502 18 HD1 TRP 4 HD1 TRP 4 4.194 -2.909 -3.926 19 HE1 TRP 4 HE1 TRP 4 4.803 -0.582 -4.829 20 HE3 TRP 4 HE3 TRP 4 9.284 -3.297 -3.767 21 HZ2 TRP 4 HZ2 TRP 4 7.146 0.891 -5.418 22 HZ3 TRP 4 HZ3 TRP 4 10.639 -1.389 -4.524 23 HH2 TRP 4 HH2 TRP 4 9.593 0.663 -5.330 24 H GLU 5 HN GLU 5 9.074 -5.625 -3.296 25 HA GLU 5 HA GLU 5 9.516 -8.392 -3.014 26 HB2 GLU 5 HB2 GLU 5 10.827 -6.155 -1.465 27 HB3 GLU 5 HB1 GLU 5 11.469 -7.769 -1.735 28 HG2 GLU 5 HG2 GLU 5 11.055 -5.622 -3.799 29 HG3 GLU 5 HG1 GLU 5 12.587 -6.205 -3.159 30 H SER 6 HN SER 6 8.498 -9.700 -1.647 31 HA SER 6 HA SER 6 7.595 -8.623 0.936 32 HB2 SER 6 HB2 SER 6 5.893 -9.693 -0.653 33 HB3 SER 6 HB1 SER 6 6.693 -11.227 -0.312 34 HG SER 6 HG SER 6 5.700 -11.298 1.536 35 H LYS 7 HN LYS 7 10.284 -9.413 0.181 36 HA LYS 7 HA LYS 7 11.002 -11.942 1.116 37 HB2 LYS 7 HB2 LYS 7 12.487 -10.630 -0.260 38 HB3 LYS 7 HB1 LYS 7 12.578 -9.403 0.983 39 HG2 LYS 7 HG2 LYS 7 14.571 -10.890 0.840 40 HG3 LYS 7 HG1 LYS 7 13.806 -10.831 2.432 41 HD2 LYS 7 HD2 LYS 7 12.573 -12.884 1.868 42 HD3 LYS 7 HD1 LYS 7 13.464 -12.980 0.346 43 HE2 LYS 7 HE2 LYS 7 15.568 -13.106 1.618 44 HE3 LYS 7 HE1 LYS 7 14.646 -13.067 3.120 45 HZ1 LYS 7 HZ1 LYS 7 15.245 -15.319 2.529 46 HZ2 LYS 7 HZ2 LYS 7 14.476 -15.173 1.034 47 HZ3 LYS 7 HZ3 LYS 7 13.566 -15.133 2.460 48 H THR 8 HN THR 8 10.693 -8.867 2.742 49 HA THR 8 HA THR 8 11.680 -9.652 5.256 50 HB THR 8 HB THR 8 9.554 -7.547 4.860 51 HG1 THR 8 HG1 THR 8 11.178 -6.143 4.197 52 HG21 THR 8 HG21 THR 8 11.914 -7.751 6.738 53 HG22 THR 8 HG22 THR 8 10.228 -8.034 7.169 54 HG23 THR 8 HG23 THR 8 10.754 -6.424 6.678 55 H GLY 9 HN GLY 9 8.680 -10.253 3.657 56 HA2 GLY 9 HA2 GLY 9 7.000 -11.721 4.215 57 HA3 GLY 9 HA1 GLY 9 7.897 -12.120 5.669 58 H SER 10 HN SER 10 7.241 -8.798 5.208 59 HA SER 10 HA SER 10 5.654 -8.810 7.605 60 HB2 SER 10 HB2 SER 10 6.391 -6.442 5.884 61 HB3 SER 10 HB1 SER 10 5.931 -6.433 7.586 62 HG SER 10 HG SER 10 8.091 -6.372 7.678 63 H CYS 11 HN CYS 11 4.967 -8.829 4.250 64 HA CYS 11 HA CYS 11 2.269 -7.765 4.776 65 HB2 CYS 11 HB2 CYS 11 3.617 -6.349 3.268 66 HB3 CYS 11 HB1 CYS 11 3.822 -7.718 2.184 67 H ASN 12 HN ASN 12 0.515 -8.911 4.053 68 HA ASN 12 HA ASN 12 1.056 -11.689 3.358 69 HB2 ASN 12 HB2 ASN 12 -1.285 -12.108 3.928 70 HB3 ASN 12 HB1 ASN 12 -0.460 -11.269 5.235 71 HD21 ASN 12 HD21 ASN 12 -0.969 -9.090 5.629 72 HD22 ASN 12 HD22 ASN 12 -2.434 -8.385 5.037 73 H THR 13 HN THR 13 -0.164 -8.807 1.889 74 HA THR 13 HA THR 13 -1.547 -10.307 -0.194 75 HB THR 13 HB THR 13 -2.235 -8.011 -0.975 76 HG1 THR 13 HG1 THR 13 -1.861 -6.320 0.595 77 HG21 THR 13 HG21 THR 13 -3.806 -7.646 0.903 78 HG22 THR 13 HG22 THR 13 -2.881 -8.797 1.871 79 HG23 THR 13 HG23 THR 13 -3.719 -9.337 0.416 80 H GLY 14 HN GLY 14 1.303 -8.366 0.289 81 HA2 GLY 14 HA2 GLY 14 3.181 -8.338 -1.134 82 HA3 GLY 14 HA1 GLY 14 2.175 -8.974 -2.427 83 H LYS 15 HN LYS 15 0.373 -6.630 -1.071 84 HA LYS 15 HA LYS 15 1.142 -4.697 -3.119 85 HB2 LYS 15 HB2 LYS 15 -1.260 -4.874 -1.287 86 HB3 LYS 15 HB1 LYS 15 -0.977 -3.539 -2.393 87 HG2 LYS 15 HG2 LYS 15 -1.113 -5.058 -4.289 88 HG3 LYS 15 HG1 LYS 15 -1.345 -6.422 -3.191 89 HD2 LYS 15 HD2 LYS 15 -3.434 -5.533 -2.424 90 HD3 LYS 15 HD1 LYS 15 -3.171 -4.025 -3.299 91 HE2 LYS 15 HE2 LYS 15 -4.768 -5.449 -4.463 92 HE3 LYS 15 HE1 LYS 15 -3.306 -5.223 -5.415 93 HZ1 LYS 15 HZ1 LYS 15 -3.900 -7.611 -3.755 94 HZ2 LYS 15 HZ2 LYS 15 -2.554 -7.399 -4.756 95 HZ3 LYS 15 HZ3 LYS 15 -4.095 -7.521 -5.430 96 H LEU 16 HN LEU 16 3.042 -3.931 -2.160 97 HA LEU 16 HA LEU 16 2.794 -2.618 0.418 98 HB2 LEU 16 HB2 LEU 16 5.140 -3.336 -1.311 99 HB3 LEU 16 HB1 LEU 16 5.297 -2.222 0.025 100 HG LEU 16 HG LEU 16 4.436 -4.014 1.534 101 HD11 LEU 16 HD11 LEU 16 3.263 -5.372 -0.016 102 HD12 LEU 16 HD12 LEU 16 4.569 -6.330 0.688 103 HD13 LEU 16 HD13 LEU 16 4.733 -5.674 -0.943 104 HD21 LEU 16 HD21 LEU 16 6.535 -5.290 1.568 105 HD22 LEU 16 HD22 LEU 16 6.810 -3.556 1.399 106 HD23 LEU 16 HD23 LEU 16 6.954 -4.614 -0.005 107 H ALA 17 HN ALA 17 2.913 -0.496 0.700 108 HA ALA 17 HA ALA 17 3.739 1.246 -1.475 109 HB1 ALA 17 HB1 ALA 17 1.021 1.435 -0.157 110 HB2 ALA 17 HB2 ALA 17 1.343 1.062 -1.851 111 HB3 ALA 17 HB3 ALA 17 1.718 2.667 -1.215 112 H CYS 18 HN CYS 18 4.303 3.381 -0.648 113 HA CYS 18 HA CYS 18 4.736 3.346 2.252 114 HB2 CYS 18 HB2 CYS 18 5.918 5.088 0.086 115 HB3 CYS 18 HB1 CYS 18 6.225 5.293 1.803 116 H CYS 19 HN CYS 19 2.947 4.040 3.236 117 HA CYS 19 HA CYS 19 1.461 6.235 1.976 118 HB2 CYS 19 HB2 CYS 19 0.449 4.017 3.750 119 HB3 CYS 19 HB1 CYS 19 -0.537 5.312 3.081 120 H ASP 20 HN ASP 20 0.389 7.757 3.344 121 HA ASP 20 HA ASP 20 1.757 8.131 5.908 122 HB2 ASP 20 HB2 ASP 20 0.126 10.047 4.231 123 HB3 ASP 20 HB1 ASP 20 0.749 10.430 5.824 124 H THR 21 HN THR 21 0.756 7.265 7.546 125 HA THR 21 HA THR 21 -1.967 6.449 7.428 126 HB THR 21 HB THR 21 -1.586 5.796 9.826 127 HG1 THR 21 HG1 THR 21 0.069 6.710 10.778 128 HG21 THR 21 HG21 THR 21 0.477 4.856 7.827 129 HG22 THR 21 HG22 THR 21 -1.166 4.231 7.988 130 HG23 THR 21 HG23 THR 21 -0.003 4.004 9.294 131 H ASN 22 HN ASN 22 -0.564 9.397 8.078 132 HA ASN 22 HA ASN 22 -2.683 10.244 9.913 133 HB2 ASN 22 HB2 ASN 22 -0.181 11.691 9.011 134 HB3 ASN 22 HB1 ASN 22 -1.326 12.275 10.208 135 HD21 ASN 22 HD21 ASN 22 -1.463 11.207 12.212 136 HD22 ASN 22 HD22 ASN 22 -0.149 10.255 12.805 137 H LYS 23 HN LYS 23 -2.008 10.007 6.715 138 HA LYS 23 HA LYS 23 -3.642 12.338 6.008 139 HB2 LYS 23 HB2 LYS 23 -1.523 10.925 4.386 140 HB3 LYS 23 HB1 LYS 23 -2.504 12.248 3.816 141 HG2 LYS 23 HG2 LYS 23 -1.532 13.678 5.560 142 HG3 LYS 23 HG1 LYS 23 -0.467 12.354 6.016 143 HD2 LYS 23 HD2 LYS 23 0.780 13.774 4.584 144 HD3 LYS 23 HD1 LYS 23 0.327 12.365 3.619 145 HE2 LYS 23 HE2 LYS 23 -0.065 14.286 2.268 146 HE3 LYS 23 HE1 LYS 23 -1.633 13.678 2.796 147 HZ1 LYS 23 HZ1 LYS 23 -1.712 15.378 4.486 148 HZ2 LYS 23 HZ2 LYS 23 -1.491 16.086 2.969 149 HZ3 LYS 23 HZ3 LYS 23 -0.187 15.951 4.034 150 H LYS 24 HN LYS 24 -5.596 11.833 5.289 151 HA LYS 24 HA LYS 24 -5.927 9.161 4.195 152 HB2 LYS 24 HB2 LYS 24 -8.092 9.047 5.468 153 HB3 LYS 24 HB1 LYS 24 -6.580 8.877 6.355 154 HG2 LYS 24 HG2 LYS 24 -6.944 11.513 6.556 155 HG3 LYS 24 HG1 LYS 24 -8.622 10.951 6.535 156 HD2 LYS 24 HD2 LYS 24 -6.476 9.750 8.231 157 HD3 LYS 24 HD1 LYS 24 -7.531 11.048 8.814 158 HE2 LYS 24 HE2 LYS 24 -8.419 8.330 7.832 159 HE3 LYS 24 HE1 LYS 24 -8.319 8.825 9.520 160 HZ1 LYS 24 HZ1 LYS 24 -9.980 10.532 9.064 161 HZ2 LYS 24 HZ2 LYS 24 -10.573 8.987 8.715 162 HZ3 LYS 24 HZ3 LYS 24 -10.095 10.011 7.459 163 H VAL 25 HN VAL 25 -7.762 8.785 2.892 164 HA VAL 25 HA VAL 25 -8.391 11.171 1.308 165 HB VAL 25 HB VAL 25 -8.864 8.309 0.501 166 HG11 VAL 25 HG11 VAL 25 -8.417 10.790 -1.147 167 HG12 VAL 25 HG12 VAL 25 -9.976 10.027 -0.839 168 HG13 VAL 25 HG13 VAL 25 -8.744 9.172 -1.765 169 HG21 VAL 25 HG21 VAL 25 -6.699 8.330 -0.629 170 HG22 VAL 25 HG22 VAL 25 -6.511 8.520 1.113 171 HG23 VAL 25 HG23 VAL 25 -6.356 9.919 0.051 172 H GLN 26 HN GLN 26 -10.495 11.562 0.600 173 HA GLN 26 HA GLN 26 -12.573 10.690 2.431 174 HB2 GLN 26 HB2 GLN 26 -12.490 12.820 0.294 175 HB3 GLN 26 HB1 GLN 26 -13.876 12.502 1.317 176 HG2 GLN 26 HG2 GLN 26 -12.717 13.190 3.261 177 HG3 GLN 26 HG1 GLN 26 -11.176 13.222 2.407 178 HE21 GLN 26 HE21 GLN 26 -10.801 15.350 2.981 179 HE22 GLN 26 HE22 GLN 26 -11.655 16.667 2.254 180 H LYS 27 HN LYS 27 -11.310 9.273 -0.013 181 HA LYS 27 HA LYS 27 -13.845 8.239 -1.074 182 HB2 LYS 27 HB2 LYS 27 -11.311 8.807 -2.633 183 HB3 LYS 27 HB1 LYS 27 -12.658 7.873 -3.259 184 HG2 LYS 27 HG2 LYS 27 -12.868 10.728 -2.364 185 HG3 LYS 27 HG1 LYS 27 -12.581 10.243 -4.027 186 HD2 LYS 27 HD2 LYS 27 -14.988 9.539 -2.350 187 HD3 LYS 27 HD1 LYS 27 -14.935 10.754 -3.628 188 HE2 LYS 27 HE2 LYS 27 -14.379 7.833 -4.001 189 HE3 LYS 27 HE1 LYS 27 -15.919 8.605 -4.362 190 HZ1 LYS 27 HZ1 LYS 27 -13.317 9.233 -5.653 191 HZ2 LYS 27 HZ2 LYS 27 -14.791 9.975 -6.009 192 HZ3 LYS 27 HZ3 LYS 27 -14.567 8.334 -6.350 193 H SER 28 HN SER 28 -13.875 5.996 -1.316 194 HA SER 28 HA SER 28 -11.425 4.542 -0.663 195 HB2 SER 28 HB2 SER 28 -12.718 4.921 1.433 196 HB3 SER 28 HB1 SER 28 -14.060 4.023 0.736 197 HG SER 28 HG SER 28 -12.123 3.022 2.107 198 H THR 29 HN THR 29 -11.511 4.108 -2.890 199 HA THR 29 HA THR 29 -13.527 2.101 -3.664 200 HB THR 29 HB THR 29 -11.896 3.736 -5.608 201 HG1 THR 29 HG1 THR 29 -13.819 4.633 -3.978 202 HG21 THR 29 HG21 THR 29 -12.966 1.709 -6.483 203 HG22 THR 29 HG22 THR 29 -13.710 3.159 -7.155 204 HG23 THR 29 HG23 THR 29 -14.525 2.266 -5.872 205 H GLY 30 HN GLY 30 -12.796 0.193 -4.624 206 HA2 GLY 30 HA2 GLY 30 -9.891 -0.252 -4.350 207 HA3 GLY 30 HA1 GLY 30 -11.109 -1.477 -4.025 208 H GLU 31 HN GLU 31 -8.826 -1.516 -5.866 209 HA GLU 31 HA GLU 31 -10.158 -1.659 -8.464 210 HB2 GLU 31 HB2 GLU 31 -8.050 -0.425 -8.394 211 HB3 GLU 31 HB1 GLU 31 -7.237 -1.824 -7.701 212 HG2 GLU 31 HG2 GLU 31 -7.764 -3.086 -9.727 213 HG3 GLU 31 HG1 GLU 31 -8.462 -1.635 -10.438 214 H GLU 32 HN GLU 32 -8.029 -3.568 -6.342 215 HA GLU 32 HA GLU 32 -8.873 -6.010 -7.684 216 HB2 GLU 32 HB2 GLU 32 -6.792 -5.439 -5.579 217 HB3 GLU 32 HB1 GLU 32 -7.232 -7.074 -6.054 218 HG2 GLU 32 HG2 GLU 32 -6.169 -4.963 -7.918 219 HG3 GLU 32 HG1 GLU 32 -5.212 -6.256 -7.191 220 H SER 33 HN SER 33 -9.244 -4.262 -4.689 221 HA SER 33 HA SER 33 -10.680 -6.278 -3.290 222 HB2 SER 33 HB2 SER 33 -9.671 -4.310 -2.169 223 HB3 SER 33 HB1 SER 33 -10.822 -3.262 -2.993 224 HG SER 33 HG SER 33 -11.507 -3.761 -0.876 225 H GLY 34 HN GLY 34 -11.432 -4.206 -5.898 226 HA2 GLY 34 HA2 GLY 34 -14.246 -4.003 -5.564 227 HA3 GLY 34 HA1 GLY 34 -13.356 -3.735 -7.055 228 H LEU 35 HN LEU 35 -12.200 -6.537 -6.752 229 HA LEU 35 HA LEU 35 -14.120 -7.912 -8.307 230 HB2 LEU 35 HB2 LEU 35 -11.754 -8.378 -8.543 231 HB3 LEU 35 HB1 LEU 35 -11.643 -8.855 -6.859 232 HG LEU 35 HG LEU 35 -13.192 -10.739 -7.372 233 HD11 LEU 35 HD11 LEU 35 -14.232 -9.876 -9.374 234 HD12 LEU 35 HD12 LEU 35 -13.437 -11.410 -9.724 235 HD13 LEU 35 HD13 LEU 35 -12.683 -9.893 -10.216 236 HD21 LEU 35 HD21 LEU 35 -11.485 -12.129 -8.416 237 HD22 LEU 35 HD22 LEU 35 -10.778 -11.062 -7.203 238 HD23 LEU 35 HD23 LEU 35 -10.607 -10.684 -8.917 239 H LEU 36 HN LEU 36 -13.261 -7.873 -4.921 240 HA LEU 36 HA LEU 36 -15.242 -9.895 -4.272 241 HB2 LEU 36 HB2 LEU 36 -13.166 -8.401 -2.678 242 HB3 LEU 36 HB1 LEU 36 -14.384 -9.391 -1.921 243 HG LEU 36 HG LEU 36 -12.404 -10.687 -2.009 244 HD11 LEU 36 HD11 LEU 36 -14.466 -11.884 -2.570 245 HD12 LEU 36 HD12 LEU 36 -13.050 -12.593 -3.341 246 HD13 LEU 36 HD13 LEU 36 -14.158 -11.595 -4.282 247 HD21 LEU 36 HD21 LEU 36 -11.177 -11.132 -4.080 248 HD22 LEU 36 HD22 LEU 36 -11.187 -9.413 -3.681 249 HD23 LEU 36 HD23 LEU 36 -12.249 -10.033 -4.948 250 H HIS 37 HN HIS 37 -16.552 -9.262 -2.201 251 HA HIS 37 HA HIS 37 -18.033 -6.875 -2.871 252 HB2 HIS 37 HB2 HIS 37 -18.400 -8.967 -0.724 253 HB3 HIS 37 HB1 HIS 37 -19.457 -7.570 -0.898 254 HD1 HIS 37 HD1 HIS 37 -19.179 -10.991 -1.917 255 HD2 HIS 37 HD2 HIS 37 -20.643 -7.509 -3.646 256 HE1 HIS 37 HE1 HIS 37 -20.689 -11.744 -3.777 257 HE2 HIS 37 HE2 HIS 37 -21.405 -9.619 -4.926 258 H THR 38 HN THR 38 -15.233 -7.264 -1.379 259 HA THR 38 HA THR 38 -15.562 -5.676 0.970 260 HB THR 38 HB THR 38 -13.019 -5.559 0.842 261 HG1 THR 38 HG1 THR 38 -12.552 -5.940 -1.269 262 HG21 THR 38 HG21 THR 38 -12.736 -7.904 1.499 263 HG22 THR 38 HG22 THR 38 -14.318 -8.286 0.820 264 HG23 THR 38 HG23 THR 38 -14.193 -7.213 2.215 265 H GLY 39 HN GLY 39 -15.027 -5.038 -2.392 266 HA2 GLY 39 HA2 GLY 39 -13.917 -2.421 -2.058 267 HA3 GLY 39 HA1 GLY 39 -14.559 -3.097 -3.547 268 H ASP 40 HN ASP 40 -17.042 -3.651 -1.705 269 HA ASP 40 HA ASP 40 -18.484 -1.348 -2.617 270 HB2 ASP 40 HB2 ASP 40 -19.284 -3.773 -1.017 271 HB3 ASP 40 HB1 ASP 40 -20.405 -2.463 -1.359 272 H VAL 41 HN VAL 41 -17.237 -2.484 0.461 273 HA VAL 41 HA VAL 41 -18.658 -0.515 1.981 274 HB VAL 41 HB VAL 41 -17.037 -1.165 3.843 275 HG11 VAL 41 HG11 VAL 41 -18.777 -3.291 2.581 276 HG12 VAL 41 HG12 VAL 41 -19.313 -2.030 3.689 277 HG13 VAL 41 HG13 VAL 41 -18.212 -3.287 4.251 278 HG21 VAL 41 HG21 VAL 41 -15.255 -2.063 2.449 279 HG22 VAL 41 HG22 VAL 41 -16.333 -3.331 1.867 280 HG23 VAL 41 HG23 VAL 41 -15.862 -3.286 3.566 281 H LEU 42 HN LEU 42 -18.081 1.441 2.573 282 HA LEU 42 HA LEU 42 -15.608 2.573 1.601 283 HB2 LEU 42 HB2 LEU 42 -17.876 3.804 3.146 284 HB3 LEU 42 HB1 LEU 42 -16.572 4.665 2.379 285 HG LEU 42 HG LEU 42 -18.725 3.097 0.977 286 HD11 LEU 42 HD11 LEU 42 -19.505 5.209 1.892 287 HD12 LEU 42 HD12 LEU 42 -19.428 5.272 0.131 288 HD13 LEU 42 HD13 LEU 42 -18.178 6.056 1.097 289 HD21 LEU 42 HD21 LEU 42 -16.627 2.920 -0.233 290 HD22 LEU 42 HD22 LEU 42 -16.416 4.668 -0.160 291 HD23 LEU 42 HD23 LEU 42 -17.745 3.980 -1.092 292 H ASP 43 HN ASP 43 -16.540 0.812 4.158 293 HA ASP 43 HA ASP 43 -15.449 2.079 6.407 294 HB2 ASP 43 HB2 ASP 43 -16.899 0.101 6.553 295 HB3 ASP 43 HB1 ASP 43 -15.651 -0.879 5.788 296 H GLN 44 HN GLN 44 -14.006 0.203 3.836 297 HA GLN 44 HA GLN 44 -11.514 -0.400 4.760 298 HB2 GLN 44 HB2 GLN 44 -11.874 0.858 2.066 299 HB3 GLN 44 HB1 GLN 44 -10.748 -0.391 2.544 300 HG2 GLN 44 HG2 GLN 44 -12.632 -1.941 2.849 301 HG3 GLN 44 HG1 GLN 44 -13.717 -0.689 2.245 302 HE21 GLN 44 HE21 GLN 44 -13.568 -0.057 0.069 303 HE22 GLN 44 HE22 GLN 44 -12.826 -1.072 -1.115 304 H VAL 45 HN VAL 45 -9.670 0.667 5.196 305 HA VAL 45 HA VAL 45 -9.879 3.524 5.593 306 HB VAL 45 HB VAL 45 -7.573 1.678 6.247 307 HG11 VAL 45 HG11 VAL 45 -6.833 3.485 7.723 308 HG12 VAL 45 HG12 VAL 45 -8.171 4.489 7.165 309 HG13 VAL 45 HG13 VAL 45 -6.899 4.014 6.041 310 HG21 VAL 45 HG21 VAL 45 -9.631 1.080 7.446 311 HG22 VAL 45 HG22 VAL 45 -9.746 2.734 8.048 312 HG23 VAL 45 HG23 VAL 45 -8.392 1.713 8.529 313 H ALA 46 HN ALA 46 -9.437 4.819 4.019 314 HA ALA 46 HA ALA 46 -7.422 4.072 2.018 315 HB1 ALA 46 HB1 ALA 46 -8.514 5.688 0.558 316 HB2 ALA 46 HB2 ALA 46 -9.611 6.142 1.863 317 HB3 ALA 46 HB3 ALA 46 -9.684 4.520 1.173 318 H ILE 47 HN ILE 47 -5.498 4.827 2.655 319 HA ILE 47 HA ILE 47 -5.392 7.601 3.598 320 HB ILE 47 HB ILE 47 -3.076 6.991 4.430 321 HG12 ILE 47 HG12 ILE 47 -4.166 4.193 4.048 322 HG13 ILE 47 HG11 ILE 47 -2.819 4.900 3.163 323 HG21 ILE 47 HG21 ILE 47 -3.949 6.044 6.513 324 HG22 ILE 47 HG22 ILE 47 -5.472 5.675 5.697 325 HG23 ILE 47 HG23 ILE 47 -4.969 7.356 5.909 326 HD11 ILE 47 HD11 ILE 47 -2.899 4.352 6.120 327 HD12 ILE 47 HD12 ILE 47 -1.550 5.071 5.241 328 HD13 ILE 47 HD13 ILE 47 -2.038 3.409 4.904 329 H GLN 48 HN GLN 48 -3.710 8.951 2.872 330 HA GLN 48 HA GLN 48 -3.253 8.700 0.058 331 HB2 GLN 48 HB2 GLN 48 -2.840 10.764 2.106 332 HB3 GLN 48 HB1 GLN 48 -1.631 10.755 0.829 333 HG2 GLN 48 HG2 GLN 48 -4.591 10.856 0.404 334 HG3 GLN 48 HG1 GLN 48 -3.511 12.244 0.335 335 HE21 GLN 48 HE21 GLN 48 -5.261 11.117 -1.713 336 HE22 GLN 48 HE22 GLN 48 -4.239 10.713 -3.052 337 H CYS 49 HN CYS 49 -1.387 8.457 -1.002 338 HA CYS 49 HA CYS 49 0.879 7.356 0.476 339 HB2 CYS 49 HB2 CYS 49 -1.080 5.666 -0.181 340 HB3 CYS 49 HB1 CYS 49 -0.242 5.695 -1.724 341 H THR 50 HN THR 50 2.672 6.748 -1.094 342 HA THR 50 HA THR 50 2.600 7.987 -3.676 343 HB THR 50 HB THR 50 2.877 9.991 -2.281 344 HG1 THR 50 HG1 THR 50 3.909 10.188 -4.221 345 HG21 THR 50 HG21 THR 50 4.917 10.311 -0.965 346 HG22 THR 50 HG22 THR 50 5.404 8.654 -1.324 347 HG23 THR 50 HG23 THR 50 3.962 8.959 -0.358 348 H GLN 51 HN GLN 51 4.487 7.562 -4.900 349 HA GLN 51 HA GLN 51 6.278 5.573 -3.684 350 HB2 GLN 51 HB2 GLN 51 4.497 5.014 -5.637 351 HB3 GLN 51 HB1 GLN 51 5.863 5.524 -6.619 352 HG2 GLN 51 HG2 GLN 51 6.046 3.425 -4.481 353 HG3 GLN 51 HG1 GLN 51 5.706 3.067 -6.172 354 HE21 GLN 51 HE21 GLN 51 7.959 2.436 -4.321 355 HE22 GLN 51 HE22 GLN 51 9.384 2.925 -5.159 356 H ILE 52 HN ILE 52 8.345 6.177 -3.650 357 HA ILE 52 HA ILE 52 9.126 8.558 -5.150 358 HB ILE 52 HB ILE 52 10.503 7.065 -2.914 359 HG12 ILE 52 HG12 ILE 52 9.085 9.731 -3.033 360 HG13 ILE 52 HG11 ILE 52 8.546 8.292 -2.177 361 HG21 ILE 52 HG21 ILE 52 11.365 9.635 -4.224 362 HG22 ILE 52 HG22 ILE 52 12.142 8.070 -4.448 363 HG23 ILE 52 HG23 ILE 52 12.150 8.840 -2.861 364 HD11 ILE 52 HD11 ILE 52 11.022 9.874 -1.531 365 HD12 ILE 52 HD12 ILE 52 10.406 8.484 -0.642 366 HD13 ILE 52 HD13 ILE 52 9.482 9.981 -0.681 367 HA PRO 53 HA PRO 53 10.842 6.603 -8.659 368 HB2 PRO 53 HB2 PRO 53 13.216 8.252 -7.861 369 HB3 PRO 53 HB1 PRO 53 12.503 8.023 -9.462 370 HG2 PRO 53 HG2 PRO 53 11.988 10.206 -7.973 371 HG3 PRO 53 HG1 PRO 53 10.782 9.494 -9.057 372 HD2 PRO 53 HD2 PRO 53 10.831 9.559 -6.127 373 HD3 PRO 53 HD1 PRO 53 9.488 9.183 -7.223 374 H LEU 54 HN LEU 54 11.120 4.508 -8.119 375 HA LEU 54 HA LEU 54 13.062 3.649 -6.222 376 HB2 LEU 54 HB2 LEU 54 12.219 1.400 -6.721 377 HB3 LEU 54 HB1 LEU 54 10.928 2.525 -6.358 378 HG LEU 54 HG LEU 54 10.886 2.726 -9.026 379 HD11 LEU 54 HD11 LEU 54 12.719 1.184 -9.408 380 HD12 LEU 54 HD12 LEU 54 11.212 0.520 -10.037 381 HD13 LEU 54 HD13 LEU 54 11.869 -0.076 -8.514 382 HD21 LEU 54 HD21 LEU 54 8.998 2.147 -7.591 383 HD22 LEU 54 HD22 LEU 54 9.603 0.495 -7.459 384 HD23 LEU 54 HD23 LEU 54 9.061 1.114 -9.019 385 H LEU 55 HN LEU 55 14.981 2.692 -6.551 386 HA LEU 55 HA LEU 55 16.168 2.701 -9.166 387 HB2 LEU 55 HB2 LEU 55 17.134 1.585 -6.535 388 HB3 LEU 55 HB1 LEU 55 18.081 1.599 -8.008 389 HG LEU 55 HG LEU 55 18.892 3.414 -6.831 390 HD11 LEU 55 HD11 LEU 55 18.211 5.406 -8.022 391 HD12 LEU 55 HD12 LEU 55 16.755 4.586 -8.583 392 HD13 LEU 55 HD13 LEU 55 18.341 4.028 -9.113 393 HD21 LEU 55 HD21 LEU 55 16.068 4.181 -6.125 394 HD22 LEU 55 HD22 LEU 55 17.518 5.081 -5.677 395 HD23 LEU 55 HD23 LEU 55 17.257 3.456 -5.042 396 H ILE 56 HN ILE 56 16.518 0.907 -10.483 397 HA ILE 56 HA ILE 56 14.547 -1.093 -10.349 398 HB ILE 56 HB ILE 56 17.108 -1.319 -11.909 399 HG12 ILE 56 HG12 ILE 56 14.533 0.046 -12.726 400 HG13 ILE 56 HG11 ILE 56 16.024 0.879 -12.307 401 HG21 ILE 56 HG21 ILE 56 15.730 -2.639 -13.454 402 HG22 ILE 56 HG22 ILE 56 14.356 -2.452 -12.365 403 HG23 ILE 56 HG23 ILE 56 15.782 -3.347 -11.839 404 HD11 ILE 56 HD11 ILE 56 17.139 -0.154 -14.214 405 HD12 ILE 56 HD12 ILE 56 15.719 0.769 -14.708 406 HD13 ILE 56 HD13 ILE 56 15.642 -0.992 -14.632 407 H GLY 57 HN GLY 57 14.475 -2.996 -9.408 408 HA2 GLY 57 HA2 GLY 57 15.202 -4.962 -8.401 409 HA3 GLY 57 HA1 GLY 57 16.858 -4.413 -8.589 410 H ILE 58 HN ILE 58 15.140 -1.932 -7.204 411 HA ILE 58 HA ILE 58 16.213 -2.648 -4.588 412 HB ILE 58 HB ILE 58 15.929 -0.165 -6.030 413 HG12 ILE 58 HG12 ILE 58 18.021 -1.069 -5.136 414 HG13 ILE 58 HG11 ILE 58 17.694 0.537 -4.495 415 HG21 ILE 58 HG21 ILE 58 14.895 -0.173 -3.203 416 HG22 ILE 58 HG22 ILE 58 14.035 0.341 -4.657 417 HG23 ILE 58 HG23 ILE 58 15.413 1.274 -4.074 418 HD11 ILE 58 HD11 ILE 58 16.886 -0.464 -2.415 419 HD12 ILE 58 HD12 ILE 58 18.547 -0.935 -2.766 420 HD13 ILE 58 HD13 ILE 58 17.230 -2.070 -3.055 421 H ALA 59 HN ALA 59 15.073 -2.327 -2.701 422 HA ALA 59 HA ALA 59 12.344 -3.258 -2.872 423 HB1 ALA 59 HB1 ALA 59 12.611 -3.536 -0.428 424 HB2 ALA 59 HB2 ALA 59 14.219 -2.814 -0.563 425 HB3 ALA 59 HB3 ALA 59 13.870 -4.348 -1.361 426 H ILE 60 HN ILE 60 10.591 -2.271 -1.834 427 HA ILE 60 HA ILE 60 10.186 0.457 -2.078 428 HB ILE 60 HB ILE 60 8.361 -1.145 -1.800 429 HG12 ILE 60 HG12 ILE 60 8.422 0.910 0.421 430 HG13 ILE 60 HG11 ILE 60 7.944 1.210 -1.246 431 HG21 ILE 60 HG21 ILE 60 9.178 -2.730 -0.281 432 HG22 ILE 60 HG22 ILE 60 7.864 -1.930 0.583 433 HG23 ILE 60 HG23 ILE 60 9.548 -1.511 0.942 434 HD11 ILE 60 HD11 ILE 60 6.538 -0.585 0.710 435 HD12 ILE 60 HD12 ILE 60 6.063 -0.322 -0.969 436 HD13 ILE 60 HD13 ILE 60 6.014 1.014 0.181 437 H GLU 61 HN GLU 61 11.378 -1.398 0.636 438 HA GLU 61 HA GLU 61 11.176 0.535 2.654 439 HB2 GLU 61 HB2 GLU 61 12.848 -1.932 2.285 440 HB3 GLU 61 HB1 GLU 61 12.898 -0.985 3.763 441 HG2 GLU 61 HG2 GLU 61 10.617 -1.472 4.232 442 HG3 GLU 61 HG1 GLU 61 10.391 -2.196 2.639 443 H ASP 62 HN ASP 62 13.331 0.307 0.022 444 HA ASP 62 HA ASP 62 15.289 2.022 1.391 445 HB2 ASP 62 HB2 ASP 62 15.610 0.078 -0.879 446 HB3 ASP 62 HB1 ASP 62 16.812 1.323 -0.551 447 H GLU 63 HN GLU 63 12.791 2.160 -0.827 448 HA GLU 63 HA GLU 63 14.106 4.193 -2.446 449 HB2 GLU 63 HB2 GLU 63 12.053 4.125 -3.857 450 HB3 GLU 63 HB1 GLU 63 12.931 2.611 -3.769 451 HG2 GLU 63 HG2 GLU 63 10.787 1.903 -3.584 452 HG3 GLU 63 HG1 GLU 63 11.237 2.048 -1.893 453 H CYS 64 HN CYS 64 11.624 3.893 -0.010 454 HA CYS 64 HA CYS 64 11.015 6.746 -0.375 455 HB2 CYS 64 HB2 CYS 64 8.807 6.359 0.282 456 HB3 CYS 64 HB1 CYS 64 9.186 4.926 -0.670 457 H LYS 65 HN LYS 65 10.658 8.038 1.494 458 HA LYS 65 HA LYS 65 11.836 6.957 3.963 459 HB2 LYS 65 HB2 LYS 65 13.011 8.920 2.946 460 HB3 LYS 65 HB1 LYS 65 11.544 9.864 3.156 461 HG2 LYS 65 HG2 LYS 65 13.116 10.370 4.916 462 HG3 LYS 65 HG1 LYS 65 11.708 9.551 5.590 463 HD2 LYS 65 HD2 LYS 65 13.591 8.583 6.637 464 HD3 LYS 65 HD1 LYS 65 13.047 7.410 5.440 465 HE2 LYS 65 HE2 LYS 65 15.449 7.574 5.362 466 HE3 LYS 65 HE1 LYS 65 14.772 8.254 3.884 467 HZ1 LYS 65 HZ1 LYS 65 15.107 10.456 4.743 468 HZ2 LYS 65 HZ2 LYS 65 16.567 9.608 4.844 469 HZ3 LYS 65 HZ3 LYS 65 15.634 9.852 6.233 470 H ASN 66 HN ASN 66 9.114 6.661 2.921 471 HA ASN 66 HA ASN 66 7.570 8.078 4.982 472 HB2 ASN 66 HB2 ASN 66 6.799 6.829 2.370 473 HB3 ASN 66 HB1 ASN 66 5.592 7.166 3.600 474 HD21 ASN 66 HD21 ASN 66 4.525 8.703 2.491 475 HD22 ASN 66 HD22 ASN 66 5.188 10.246 2.085 476 H THR 67 HN THR 67 5.417 6.308 5.192 477 HA THR 67 HA THR 67 6.714 4.309 6.829 478 HB THR 67 HB THR 67 3.757 4.909 6.631 479 HG1 THR 67 HG1 THR 67 5.809 5.927 8.334 480 HG21 THR 67 HG21 THR 67 4.181 2.723 7.562 481 HG22 THR 67 HG22 THR 67 3.742 3.812 8.881 482 HG23 THR 67 HG23 THR 67 5.433 3.368 8.622 483 HA PRO 68 HA PRO 68 6.117 1.021 3.873 484 HB2 PRO 68 HB2 PRO 68 6.588 -0.685 6.184 485 HB3 PRO 68 HB1 PRO 68 7.562 -0.504 4.728 486 HG2 PRO 68 HG2 PRO 68 8.224 0.421 7.253 487 HG3 PRO 68 HG1 PRO 68 8.954 0.966 5.735 488 HD2 PRO 68 HD2 PRO 68 7.078 2.331 7.511 489 HD3 PRO 68 HD1 PRO 68 8.115 2.995 6.242 490 H THR 69 HN THR 69 4.017 0.635 3.403 491 HA THR 69 HA THR 69 2.343 -0.440 5.569 492 HB THR 69 HB THR 69 0.449 0.597 4.012 493 HG1 THR 69 HG1 THR 69 2.353 1.488 2.693 494 HG21 THR 69 HG21 THR 69 0.364 2.562 5.437 495 HG22 THR 69 HG22 THR 69 2.018 2.260 5.974 496 HG23 THR 69 HG23 THR 69 0.736 1.119 6.386 497 H CYS 70 HN CYS 70 1.161 -2.215 5.151 498 HA CYS 70 HA CYS 70 1.386 -3.445 2.481 499 HB2 CYS 70 HB2 CYS 70 2.172 -4.878 4.262 500 HB3 CYS 70 HB1 CYS 70 0.718 -4.593 5.207 501 H CYS 71 HN CYS 71 -0.289 -2.871 1.224 502 HA CYS 71 HA CYS 71 -2.832 -2.095 2.434 503 HB2 CYS 71 HB2 CYS 71 -1.770 -1.977 -0.395 504 HB3 CYS 71 HB1 CYS 71 -3.426 -1.578 0.007 505 H GLU 72 HN GLU 72 -4.767 -3.156 2.096 506 HA GLU 72 HA GLU 72 -4.685 -5.878 1.221 507 HB2 GLU 72 HB2 GLU 72 -6.272 -5.693 2.849 508 HB3 GLU 72 HB1 GLU 72 -6.672 -4.028 2.433 509 HG2 GLU 72 HG2 GLU 72 -8.078 -4.698 0.702 510 HG3 GLU 72 HG1 GLU 72 -7.445 -6.339 0.691 511 H ASP 73 HN ASP 73 -5.342 -2.784 -0.093 512 HA ASP 73 HA ASP 73 -5.151 -3.782 -2.770 513 HB2 ASP 73 HB2 ASP 73 -7.609 -4.055 -2.190 514 HB3 ASP 73 HB1 ASP 73 -7.684 -2.305 -2.049 515 H VAL 74 HN VAL 74 -4.899 -1.942 -4.295 516 HA VAL 74 HA VAL 74 -4.639 0.666 -2.980 517 HB VAL 74 HB VAL 74 -2.472 -0.062 -4.917 518 HG11 VAL 74 HG11 VAL 74 -2.838 2.247 -4.119 519 HG12 VAL 74 HG12 VAL 74 -1.241 1.608 -3.721 520 HG13 VAL 74 HG13 VAL 74 -2.488 1.700 -2.479 521 HG21 VAL 74 HG21 VAL 74 -1.024 -0.855 -3.143 522 HG22 VAL 74 HG22 VAL 74 -2.450 -1.889 -3.252 523 HG23 VAL 74 HG23 VAL 74 -2.327 -0.682 -1.967 524 H GLU 75 HN GLU 75 -5.192 2.370 -4.246 525 HA GLU 75 HA GLU 75 -6.148 1.715 -6.952 526 HB2 GLU 75 HB2 GLU 75 -7.860 2.502 -5.356 527 HB3 GLU 75 HB1 GLU 75 -6.947 3.983 -5.118 528 HG2 GLU 75 HG2 GLU 75 -7.321 4.634 -7.406 529 HG3 GLU 75 HG1 GLU 75 -8.129 3.105 -7.738 530 H ASP 76 HN ASP 76 -5.851 3.279 -8.629 531 HA ASP 76 HA ASP 76 -4.662 4.721 -9.927 532 HB2 ASP 76 HB2 ASP 76 -5.085 6.198 -7.744 533 HB3 ASP 76 HB1 ASP 76 -3.347 6.015 -7.572 534 H ASP 77 HN ASP 77 -2.022 5.816 -9.340 535 HA ASP 77 HA ASP 77 -0.349 3.563 -9.851 536 HB2 ASP 77 HB2 ASP 77 0.116 6.466 -9.315 537 HB3 ASP 77 HB1 ASP 77 1.475 5.359 -9.169 538 H GLY 78 HN GLY 78 -1.887 4.326 -7.115 539 HA2 GLY 78 HA2 GLY 78 -1.429 2.937 -5.176 540 HA3 GLY 78 HA1 GLY 78 0.273 3.283 -5.401 541 H LEU 79 HN LEU 79 -2.067 5.800 -5.852 542 HA LEU 79 HA LEU 79 -0.862 7.356 -3.753 543 HB2 LEU 79 HB2 LEU 79 -3.306 8.042 -5.374 544 HB3 LEU 79 HB1 LEU 79 -2.287 9.147 -4.472 545 HG LEU 79 HG LEU 79 -1.565 7.661 -7.000 546 HD11 LEU 79 HD11 LEU 79 -3.002 9.558 -7.386 547 HD12 LEU 79 HD12 LEU 79 -1.367 9.930 -7.932 548 HD13 LEU 79 HD13 LEU 79 -1.960 10.588 -6.407 549 HD21 LEU 79 HD21 LEU 79 0.567 8.869 -6.897 550 HD22 LEU 79 HD22 LEU 79 0.374 7.773 -5.531 551 HD23 LEU 79 HD23 LEU 79 0.127 9.505 -5.314 552 H VAL 80 HN VAL 80 -3.661 5.380 -4.123 553 HA VAL 80 HA VAL 80 -4.562 6.192 -1.439 554 HB VAL 80 HB VAL 80 -6.335 5.228 -3.695 555 HG11 VAL 80 HG11 VAL 80 -7.002 6.209 -0.924 556 HG12 VAL 80 HG12 VAL 80 -7.168 4.559 -1.523 557 HG13 VAL 80 HG13 VAL 80 -8.179 5.844 -2.184 558 HG21 VAL 80 HG21 VAL 80 -5.566 7.470 -4.169 559 HG22 VAL 80 HG22 VAL 80 -6.002 7.995 -2.544 560 HG23 VAL 80 HG23 VAL 80 -7.261 7.516 -3.681 561 H GLY 81 HN GLY 81 -3.968 4.594 -0.112 562 HA2 GLY 81 HA2 GLY 81 -4.031 1.843 -1.145 563 HA3 GLY 81 HA1 GLY 81 -3.100 2.378 0.245 564 H ILE 82 HN ILE 82 -5.328 0.332 -0.347 565 HA ILE 82 HA ILE 82 -7.363 1.228 1.546 566 HB ILE 82 HB ILE 82 -7.255 -1.015 -0.452 567 HG12 ILE 82 HG12 ILE 82 -9.462 -0.018 -1.123 568 HG13 ILE 82 HG11 ILE 82 -9.175 1.267 0.047 569 HG21 ILE 82 HG21 ILE 82 -8.104 -2.123 1.444 570 HG22 ILE 82 HG22 ILE 82 -9.502 -1.716 0.446 571 HG23 ILE 82 HG23 ILE 82 -9.127 -0.757 1.876 572 HD11 ILE 82 HD11 ILE 82 -7.467 0.631 -2.342 573 HD12 ILE 82 HD12 ILE 82 -7.163 1.910 -1.163 574 HD13 ILE 82 HD13 ILE 82 -8.597 1.979 -2.191 575 H ASN 83 HN ASN 83 -7.079 0.766 3.569 576 HA ASN 83 HA ASN 83 -6.676 -0.373 5.500 577 HB2 ASN 83 HB2 ASN 83 -7.155 -2.647 3.592 578 HB3 ASN 83 HB1 ASN 83 -6.825 -2.936 5.291 579 HD21 ASN 83 HD21 ASN 83 -9.196 -3.525 3.748 580 HD22 ASN 83 HD22 ASN 83 -10.489 -2.679 4.514 581 H CYS 84 HN CYS 84 -4.460 0.604 4.232 582 HA CYS 84 HA CYS 84 -2.417 -1.406 4.071 583 HB2 CYS 84 HB2 CYS 84 -2.689 1.275 3.232 584 HB3 CYS 84 HB1 CYS 84 -1.377 1.232 4.384 585 H THR 85 HN THR 85 -1.942 -2.400 5.883 586 HA THR 85 HA THR 85 -1.803 -1.014 8.413 587 HB THR 85 HB THR 85 -0.954 -3.847 7.779 588 HG1 THR 85 HG1 THR 85 -3.377 -3.594 8.989 589 HG21 THR 85 HG21 THR 85 -0.179 -3.013 9.939 590 HG22 THR 85 HG22 THR 85 -1.441 -4.228 10.161 591 HG23 THR 85 HG23 THR 85 -1.821 -2.516 10.346 592 HA PRO 86 HA PRO 86 2.463 0.183 7.846 593 HB2 PRO 86 HB2 PRO 86 2.395 0.371 10.807 594 HB3 PRO 86 HB1 PRO 86 2.824 1.603 9.616 595 HG2 PRO 86 HG2 PRO 86 0.511 1.748 10.916 596 HG3 PRO 86 HG1 PRO 86 0.597 2.138 9.187 597 HD2 PRO 86 HD2 PRO 86 -0.349 -0.377 10.508 598 HD3 PRO 86 HD1 PRO 86 -1.077 0.539 9.175 599 H ILE 87 HN ILE 87 4.020 -1.267 7.541 600 HA ILE 87 HA ILE 87 4.070 -3.616 9.276 601 HB ILE 87 HB ILE 87 5.375 -4.606 7.315 602 HG12 ILE 87 HG12 ILE 87 3.992 -2.361 5.845 603 HG13 ILE 87 HG11 ILE 87 5.723 -2.431 6.151 604 HG21 ILE 87 HG21 ILE 87 3.308 -5.288 6.226 605 HG22 ILE 87 HG22 ILE 87 2.459 -3.949 6.999 606 HG23 ILE 87 HG23 ILE 87 3.125 -5.256 7.981 607 HD11 ILE 87 HD11 ILE 87 5.160 -3.129 3.884 608 HD12 ILE 87 HD12 ILE 87 4.156 -4.425 4.534 609 HD13 ILE 87 HD13 ILE 87 5.898 -4.440 4.804 610 HA PRO 88 HA PRO 88 8.091 -2.475 10.562 611 HB2 PRO 88 HB2 PRO 88 8.714 -4.627 11.928 612 HB3 PRO 88 HB1 PRO 88 7.307 -3.671 12.382 613 HG2 PRO 88 HG2 PRO 88 7.456 -6.207 10.871 614 HG3 PRO 88 HG1 PRO 88 6.320 -5.741 12.147 615 HD2 PRO 88 HD2 PRO 88 5.871 -5.592 9.432 616 HD3 PRO 88 HD1 PRO 88 4.936 -4.713 10.642 617 H LEU 89 HN LEU 89 10.329 -3.023 10.400 618 HA LEU 89 HA LEU 89 10.908 -4.061 7.752 619 HB2 LEU 89 HB2 LEU 89 12.843 -2.885 9.739 620 HB3 LEU 89 HB1 LEU 89 13.034 -3.002 7.999 621 HG LEU 89 HG LEU 89 11.047 -1.227 9.424 622 HD11 LEU 89 HD11 LEU 89 13.573 -0.530 7.939 623 HD12 LEU 89 HD12 LEU 89 13.366 -0.491 9.690 624 HD13 LEU 89 HD13 LEU 89 12.440 0.608 8.668 625 HD21 LEU 89 HD21 LEU 89 10.648 -0.269 7.205 626 HD22 LEU 89 HD22 LEU 89 10.200 -1.973 7.272 627 HD23 LEU 89 HD23 LEU 89 11.705 -1.486 6.493 628 H ILE 90 HN ILE 90 10.238 -5.840 10.064 629 HA ILE 90 HA ILE 90 12.673 -7.464 10.072 630 HB ILE 90 HB ILE 90 12.076 -8.090 12.461 631 HG12 ILE 90 HG12 ILE 90 10.521 -5.500 12.297 632 HG13 ILE 90 HG11 ILE 90 9.800 -7.099 12.443 633 HG21 ILE 90 HG21 ILE 90 13.246 -6.117 13.380 634 HG22 ILE 90 HG22 ILE 90 13.023 -5.298 11.830 635 HG23 ILE 90 HG23 ILE 90 14.012 -6.755 11.926 636 HD11 ILE 90 HD11 ILE 90 9.848 -5.925 14.574 637 HD12 ILE 90 HD12 ILE 90 11.604 -5.798 14.468 638 HD13 ILE 90 HD13 ILE 90 10.842 -7.380 14.618 Start of MODEL 13 1 H1 GLY 1 HT1 GLY 1 4.031 -10.306 -10.852 2 H2 GLY 1 HT2 GLY 1 3.514 -11.912 -10.774 3 H3 GLY 1 HT3 GLY 1 5.048 -11.546 -11.381 4 HA2 GLY 1 HA1 GLY 1 5.168 -12.428 -9.126 5 HA3 GLY 1 HA2 GLY 1 5.786 -10.785 -9.244 6 H SER 2 HN SER 2 5.388 -10.711 -6.927 7 HA SER 2 HA SER 2 2.599 -10.607 -6.101 8 HB2 SER 2 HB2 SER 2 3.671 -10.147 -3.832 9 HB3 SER 2 HB1 SER 2 4.036 -11.716 -4.552 10 HG SER 2 HG SER 2 5.691 -9.472 -4.202 11 H GLY 3 HN GLY 3 4.875 -8.549 -7.402 12 HA2 GLY 3 HA2 GLY 3 4.343 -6.261 -7.913 13 HA3 GLY 3 HA1 GLY 3 3.458 -6.172 -6.392 14 H TRP 4 HN TRP 4 4.709 -6.349 -4.411 15 HA TRP 4 HA TRP 4 7.485 -5.431 -4.734 16 HB2 TRP 4 HB2 TRP 4 5.440 -4.933 -2.588 17 HB3 TRP 4 HB1 TRP 4 7.159 -4.748 -2.257 18 HD1 TRP 4 HD1 TRP 4 4.259 -3.065 -4.025 19 HE1 TRP 4 HE1 TRP 4 5.017 -0.740 -4.831 20 HE3 TRP 4 HE3 TRP 4 9.265 -3.496 -3.121 21 HZ2 TRP 4 HZ2 TRP 4 7.425 0.703 -5.066 22 HZ3 TRP 4 HZ3 TRP 4 10.730 -1.599 -3.669 23 HH2 TRP 4 HH2 TRP 4 9.827 0.456 -4.623 24 H GLU 5 HN GLU 5 8.900 -6.144 -2.830 25 HA GLU 5 HA GLU 5 8.791 -9.005 -2.778 26 HB2 GLU 5 HB2 GLU 5 10.680 -7.080 -1.415 27 HB3 GLU 5 HB1 GLU 5 10.873 -8.828 -1.439 28 HG2 GLU 5 HG2 GLU 5 10.888 -8.629 -3.973 29 HG3 GLU 5 HG1 GLU 5 11.092 -6.895 -3.718 30 H SER 6 HN SER 6 7.319 -9.927 -1.513 31 HA SER 6 HA SER 6 6.905 -8.939 1.201 32 HB2 SER 6 HB2 SER 6 5.554 -11.229 -0.253 33 HB3 SER 6 HB1 SER 6 5.067 -10.550 1.300 34 HG SER 6 HG SER 6 4.001 -9.829 -0.791 35 H LYS 7 HN LYS 7 9.274 -10.474 -0.066 36 HA LYS 7 HA LYS 7 9.491 -13.005 1.096 37 HB2 LYS 7 HB2 LYS 7 11.927 -12.748 0.711 38 HB3 LYS 7 HB1 LYS 7 10.961 -12.320 -0.692 39 HG2 LYS 7 HG2 LYS 7 12.458 -10.600 -0.695 40 HG3 LYS 7 HG1 LYS 7 11.182 -9.900 0.303 41 HD2 LYS 7 HD2 LYS 7 12.385 -10.603 2.316 42 HD3 LYS 7 HD1 LYS 7 13.679 -11.253 1.307 43 HE2 LYS 7 HE2 LYS 7 12.804 -8.364 1.372 44 HE3 LYS 7 HE1 LYS 7 14.207 -9.018 2.213 45 HZ1 LYS 7 HZ1 LYS 7 14.978 -9.769 -0.064 46 HZ2 LYS 7 HZ2 LYS 7 15.033 -8.111 0.248 47 HZ3 LYS 7 HZ3 LYS 7 13.789 -8.741 -0.709 48 H THR 8 HN THR 8 9.707 -9.898 2.494 49 HA THR 8 HA THR 8 11.290 -10.591 4.753 50 HB THR 8 HB THR 8 9.303 -8.334 4.689 51 HG1 THR 8 HG1 THR 8 11.151 -7.163 3.675 52 HG21 THR 8 HG21 THR 8 10.572 -8.701 6.760 53 HG22 THR 8 HG22 THR 8 11.029 -7.183 5.988 54 HG23 THR 8 HG23 THR 8 12.081 -8.592 5.854 55 H GLY 9 HN GLY 9 8.068 -11.224 3.856 56 HA2 GLY 9 HA2 GLY 9 6.449 -12.428 5.008 57 HA3 GLY 9 HA1 GLY 9 7.444 -12.333 6.455 58 H SER 10 HN SER 10 6.898 -9.405 4.801 59 HA SER 10 HA SER 10 5.553 -8.370 7.133 60 HB2 SER 10 HB2 SER 10 5.911 -6.174 5.824 61 HB3 SER 10 HB1 SER 10 7.332 -7.026 6.422 62 HG SER 10 HG SER 10 7.585 -6.404 4.239 63 H CYS 11 HN CYS 11 4.755 -9.124 3.839 64 HA CYS 11 HA CYS 11 2.069 -7.976 4.268 65 HB2 CYS 11 HB2 CYS 11 3.557 -6.567 2.783 66 HB3 CYS 11 HB1 CYS 11 3.555 -7.907 1.641 67 H ASN 12 HN ASN 12 0.402 -9.075 3.555 68 HA ASN 12 HA ASN 12 0.854 -11.833 2.758 69 HB2 ASN 12 HB2 ASN 12 -1.736 -11.859 3.117 70 HB3 ASN 12 HB1 ASN 12 -0.663 -11.785 4.509 71 HD21 ASN 12 HD21 ASN 12 -2.658 -9.850 2.383 72 HD22 ASN 12 HD22 ASN 12 -2.989 -8.591 3.516 73 H THR 13 HN THR 13 -0.430 -8.855 1.458 74 HA THR 13 HA THR 13 -1.661 -10.246 -0.787 75 HB THR 13 HB THR 13 -2.129 -7.685 -1.368 76 HG1 THR 13 HG1 THR 13 -1.959 -6.375 0.335 77 HG21 THR 13 HG21 THR 13 -3.591 -9.216 0.789 78 HG22 THR 13 HG22 THR 13 -3.833 -9.406 -0.946 79 HG23 THR 13 HG23 THR 13 -4.246 -7.883 -0.160 80 H GLY 14 HN GLY 14 1.095 -8.210 -0.080 81 HA2 GLY 14 HA2 GLY 14 3.067 -8.351 -1.420 82 HA3 GLY 14 HA1 GLY 14 2.056 -8.725 -2.808 83 H LYS 15 HN LYS 15 0.365 -6.346 -1.486 84 HA LYS 15 HA LYS 15 1.586 -4.377 -3.244 85 HB2 LYS 15 HB2 LYS 15 -1.017 -4.317 -1.706 86 HB3 LYS 15 HB1 LYS 15 -0.459 -3.035 -2.771 87 HG2 LYS 15 HG2 LYS 15 -0.436 -4.738 -4.626 88 HG3 LYS 15 HG1 LYS 15 -1.269 -5.833 -3.518 89 HD2 LYS 15 HD2 LYS 15 -3.095 -4.236 -3.288 90 HD3 LYS 15 HD1 LYS 15 -2.249 -3.103 -4.340 91 HE2 LYS 15 HE2 LYS 15 -2.331 -4.809 -6.135 92 HE3 LYS 15 HE1 LYS 15 -3.340 -5.803 -5.088 93 HZ1 LYS 15 HZ1 LYS 15 -5.037 -4.131 -5.125 94 HZ2 LYS 15 HZ2 LYS 15 -4.584 -4.454 -6.729 95 HZ3 LYS 15 HZ3 LYS 15 -4.032 -3.057 -5.958 96 H LEU 16 HN LEU 16 3.436 -3.892 -2.017 97 HA LEU 16 HA LEU 16 3.049 -2.593 0.545 98 HB2 LEU 16 HB2 LEU 16 5.484 -3.276 -1.088 99 HB3 LEU 16 HB1 LEU 16 5.579 -2.239 0.314 100 HG LEU 16 HG LEU 16 4.642 -4.097 1.688 101 HD11 LEU 16 HD11 LEU 16 5.085 -5.700 -0.811 102 HD12 LEU 16 HD12 LEU 16 3.527 -5.316 -0.078 103 HD13 LEU 16 HD13 LEU 16 4.676 -6.347 0.776 104 HD21 LEU 16 HD21 LEU 16 7.026 -3.680 1.659 105 HD22 LEU 16 HD22 LEU 16 7.202 -4.659 0.204 106 HD23 LEU 16 HD23 LEU 16 6.717 -5.415 1.721 107 H ALA 17 HN ALA 17 3.204 -0.406 0.869 108 HA ALA 17 HA ALA 17 3.895 1.283 -1.409 109 HB1 ALA 17 HB1 ALA 17 1.855 2.626 -1.168 110 HB2 ALA 17 HB2 ALA 17 1.252 1.482 0.035 111 HB3 ALA 17 HB3 ALA 17 1.494 0.961 -1.633 112 H CYS 18 HN CYS 18 4.391 3.432 -0.836 113 HA CYS 18 HA CYS 18 5.038 3.844 1.975 114 HB2 CYS 18 HB2 CYS 18 5.498 5.690 -0.380 115 HB3 CYS 18 HB1 CYS 18 6.212 5.829 1.222 116 H CYS 19 HN CYS 19 3.302 4.401 3.158 117 HA CYS 19 HA CYS 19 1.409 6.295 1.953 118 HB2 CYS 19 HB2 CYS 19 0.759 3.934 3.708 119 HB3 CYS 19 HB1 CYS 19 -0.404 5.137 3.163 120 H ASP 20 HN ASP 20 0.551 7.871 3.201 121 HA ASP 20 HA ASP 20 1.947 8.369 5.721 122 HB2 ASP 20 HB2 ASP 20 0.249 10.112 3.942 123 HB3 ASP 20 HB1 ASP 20 0.810 10.637 5.519 124 H THR 21 HN THR 21 1.002 7.514 7.411 125 HA THR 21 HA THR 21 -1.753 6.772 7.441 126 HB THR 21 HB THR 21 -1.249 6.117 9.824 127 HG1 THR 21 HG1 THR 21 0.984 6.202 10.413 128 HG21 THR 21 HG21 THR 21 0.606 5.086 7.673 129 HG22 THR 21 HG22 THR 21 -1.030 4.515 7.999 130 HG23 THR 21 HG23 THR 21 0.245 4.263 9.190 131 H ASN 22 HN ASN 22 -0.217 9.658 7.962 132 HA ASN 22 HA ASN 22 -2.059 10.658 9.987 133 HB2 ASN 22 HB2 ASN 22 -0.696 12.640 9.988 134 HB3 ASN 22 HB1 ASN 22 0.389 11.258 9.967 135 HD21 ASN 22 HD21 ASN 22 -0.654 14.069 8.332 136 HD22 ASN 22 HD22 ASN 22 0.435 13.959 6.993 137 H LYS 23 HN LYS 23 -1.601 10.447 6.650 138 HA LYS 23 HA LYS 23 -3.617 12.499 6.094 139 HB2 LYS 23 HB2 LYS 23 -1.363 11.352 4.541 140 HB3 LYS 23 HB1 LYS 23 -2.791 11.827 3.653 141 HG2 LYS 23 HG2 LYS 23 -2.541 14.072 4.919 142 HG3 LYS 23 HG1 LYS 23 -0.898 13.503 5.213 143 HD2 LYS 23 HD2 LYS 23 -2.179 13.783 2.502 144 HD3 LYS 23 HD1 LYS 23 -1.024 14.914 3.210 145 HE2 LYS 23 HE2 LYS 23 -0.391 12.016 2.934 146 HE3 LYS 23 HE1 LYS 23 -0.156 13.117 1.575 147 HZ1 LYS 23 HZ1 LYS 23 1.059 13.517 4.255 148 HZ2 LYS 23 HZ2 LYS 23 1.415 14.365 2.839 149 HZ3 LYS 23 HZ3 LYS 23 1.848 12.731 2.982 150 H LYS 24 HN LYS 24 -5.455 12.030 5.189 151 HA LYS 24 HA LYS 24 -6.079 9.176 4.814 152 HB2 LYS 24 HB2 LYS 24 -7.888 11.328 5.907 153 HB3 LYS 24 HB1 LYS 24 -8.297 9.629 5.710 154 HG2 LYS 24 HG2 LYS 24 -6.214 10.734 7.580 155 HG3 LYS 24 HG1 LYS 24 -7.828 10.191 8.033 156 HD2 LYS 24 HD2 LYS 24 -5.636 8.498 6.850 157 HD3 LYS 24 HD1 LYS 24 -6.178 8.476 8.526 158 HE2 LYS 24 HE2 LYS 24 -7.836 7.723 6.117 159 HE3 LYS 24 HE1 LYS 24 -7.105 6.598 7.257 160 HZ1 LYS 24 HZ1 LYS 24 -8.490 7.474 9.000 161 HZ2 LYS 24 HZ2 LYS 24 -9.462 6.990 7.707 162 HZ3 LYS 24 HZ3 LYS 24 -9.151 8.631 7.961 163 H VAL 25 HN VAL 25 -7.796 8.726 3.291 164 HA VAL 25 HA VAL 25 -8.044 10.835 1.245 165 HB VAL 25 HB VAL 25 -8.306 7.865 0.780 166 HG11 VAL 25 HG11 VAL 25 -7.970 10.158 -1.145 167 HG12 VAL 25 HG12 VAL 25 -9.459 9.260 -0.851 168 HG13 VAL 25 HG13 VAL 25 -8.069 8.451 -1.576 169 HG21 VAL 25 HG21 VAL 25 -5.919 9.637 0.271 170 HG22 VAL 25 HG22 VAL 25 -6.071 7.947 -0.207 171 HG23 VAL 25 HG23 VAL 25 -6.031 8.379 1.501 172 H GLN 26 HN GLN 26 -10.014 11.054 0.183 173 HA GLN 26 HA GLN 26 -12.305 10.766 1.879 174 HB2 GLN 26 HB2 GLN 26 -13.424 12.026 0.073 175 HB3 GLN 26 HB1 GLN 26 -11.942 12.801 0.608 176 HG2 GLN 26 HG2 GLN 26 -10.784 11.750 -1.332 177 HG3 GLN 26 HG1 GLN 26 -12.352 11.179 -1.892 178 HE21 GLN 26 HE21 GLN 26 -10.454 12.983 -3.153 179 HE22 GLN 26 HE22 GLN 26 -11.307 14.458 -3.442 180 H LYS 27 HN LYS 27 -11.234 8.235 0.892 181 HA LYS 27 HA LYS 27 -13.492 7.319 -0.741 182 HB2 LYS 27 HB2 LYS 27 -10.574 6.725 -1.255 183 HB3 LYS 27 HB1 LYS 27 -11.909 5.928 -2.071 184 HG2 LYS 27 HG2 LYS 27 -11.476 8.893 -2.151 185 HG3 LYS 27 HG1 LYS 27 -10.794 7.794 -3.342 186 HD2 LYS 27 HD2 LYS 27 -13.735 8.081 -2.725 187 HD3 LYS 27 HD1 LYS 27 -12.907 8.859 -4.075 188 HE2 LYS 27 HE2 LYS 27 -12.299 6.707 -4.981 189 HE3 LYS 27 HE1 LYS 27 -13.018 5.905 -3.592 190 HZ1 LYS 27 HZ1 LYS 27 -15.178 6.793 -4.268 191 HZ2 LYS 27 HZ2 LYS 27 -14.497 5.820 -5.470 192 HZ3 LYS 27 HZ3 LYS 27 -14.463 7.501 -5.630 193 H SER 28 HN SER 28 -13.848 5.019 -0.663 194 HA SER 28 HA SER 28 -12.414 3.485 1.355 195 HB2 SER 28 HB2 SER 28 -14.364 4.630 2.492 196 HB3 SER 28 HB1 SER 28 -15.435 3.722 1.431 197 HG SER 28 HG SER 28 -15.143 2.011 2.615 198 H THR 29 HN THR 29 -12.795 3.605 -1.563 199 HA THR 29 HA THR 29 -14.261 1.136 -2.132 200 HB THR 29 HB THR 29 -13.933 1.927 -4.547 201 HG1 THR 29 HG1 THR 29 -12.392 3.496 -4.383 202 HG21 THR 29 HG21 THR 29 -16.077 2.104 -3.395 203 HG22 THR 29 HG22 THR 29 -15.795 3.528 -4.396 204 HG23 THR 29 HG23 THR 29 -15.566 3.618 -2.650 205 H GLY 30 HN GLY 30 -13.315 -0.587 -3.149 206 HA2 GLY 30 HA2 GLY 30 -10.407 -0.413 -3.642 207 HA3 GLY 30 HA1 GLY 30 -11.208 -1.870 -3.060 208 H GLU 31 HN GLU 31 -9.599 -1.708 -5.415 209 HA GLU 31 HA GLU 31 -11.582 -1.813 -7.576 210 HB2 GLU 31 HB2 GLU 31 -8.568 -1.704 -7.730 211 HB3 GLU 31 HB1 GLU 31 -9.655 -1.739 -9.111 212 HG2 GLU 31 HG2 GLU 31 -10.677 0.382 -8.160 213 HG3 GLU 31 HG1 GLU 31 -9.274 0.448 -7.097 214 H GLU 32 HN GLU 32 -8.830 -3.665 -6.284 215 HA GLU 32 HA GLU 32 -9.754 -6.002 -7.773 216 HB2 GLU 32 HB2 GLU 32 -7.215 -5.488 -6.222 217 HB3 GLU 32 HB1 GLU 32 -7.611 -7.030 -6.971 218 HG2 GLU 32 HG2 GLU 32 -7.675 -5.959 -9.158 219 HG3 GLU 32 HG1 GLU 32 -7.286 -4.409 -8.414 220 H SER 33 HN SER 33 -9.327 -4.779 -4.523 221 HA SER 33 HA SER 33 -9.839 -7.119 -3.077 222 HB2 SER 33 HB2 SER 33 -10.695 -5.501 -1.299 223 HB3 SER 33 HB1 SER 33 -9.053 -5.226 -1.879 224 HG SER 33 HG SER 33 -9.771 -3.522 -3.112 225 H GLY 34 HN GLY 34 -11.970 -5.052 -4.867 226 HA2 GLY 34 HA2 GLY 34 -14.425 -5.837 -3.704 227 HA3 GLY 34 HA1 GLY 34 -14.221 -5.152 -5.309 228 H LEU 35 HN LEU 35 -12.383 -7.335 -6.119 229 HA LEU 35 HA LEU 35 -14.424 -9.252 -6.875 230 HB2 LEU 35 HB2 LEU 35 -11.539 -8.876 -7.635 231 HB3 LEU 35 HB1 LEU 35 -12.409 -10.329 -8.078 232 HG LEU 35 HG LEU 35 -12.414 -8.862 -9.957 233 HD11 LEU 35 HD11 LEU 35 -14.486 -10.109 -9.504 234 HD12 LEU 35 HD12 LEU 35 -14.767 -8.605 -10.379 235 HD13 LEU 35 HD13 LEU 35 -15.125 -8.699 -8.657 236 HD21 LEU 35 HD21 LEU 35 -13.363 -6.602 -9.879 237 HD22 LEU 35 HD22 LEU 35 -11.948 -6.760 -8.839 238 HD23 LEU 35 HD23 LEU 35 -13.565 -6.755 -8.133 239 H LEU 36 HN LEU 36 -11.791 -8.968 -4.678 240 HA LEU 36 HA LEU 36 -11.779 -11.785 -3.992 241 HB2 LEU 36 HB2 LEU 36 -9.759 -10.197 -3.995 242 HB3 LEU 36 HB1 LEU 36 -10.424 -9.537 -2.515 243 HG LEU 36 HG LEU 36 -10.210 -11.722 -1.430 244 HD11 LEU 36 HD11 LEU 36 -9.035 -12.579 -4.070 245 HD12 LEU 36 HD12 LEU 36 -10.500 -13.198 -3.307 246 HD13 LEU 36 HD13 LEU 36 -8.927 -13.508 -2.575 247 HD21 LEU 36 HD21 LEU 36 -7.761 -11.796 -1.341 248 HD22 LEU 36 HD22 LEU 36 -8.375 -10.145 -1.265 249 HD23 LEU 36 HD23 LEU 36 -7.687 -10.763 -2.767 250 H HIS 37 HN HIS 37 -12.023 -12.280 -1.540 251 HA HIS 37 HA HIS 37 -14.605 -11.176 -0.788 252 HB2 HIS 37 HB2 HIS 37 -13.026 -13.542 0.200 253 HB3 HIS 37 HB1 HIS 37 -14.480 -12.980 1.017 254 HD1 HIS 37 HD1 HIS 37 -14.180 -15.780 -0.424 255 HD2 HIS 37 HD2 HIS 37 -16.023 -12.407 -2.005 256 HE1 HIS 37 HE1 HIS 37 -15.809 -16.637 -2.135 257 HE2 HIS 37 HE2 HIS 37 -17.045 -14.596 -2.929 258 H THR 38 HN THR 38 -11.601 -10.168 -0.316 259 HA THR 38 HA THR 38 -11.744 -9.491 2.481 260 HB THR 38 HB THR 38 -9.745 -8.021 1.861 261 HG1 THR 38 HG1 THR 38 -8.984 -8.139 -0.160 262 HG21 THR 38 HG21 THR 38 -8.218 -9.926 1.720 263 HG22 THR 38 HG22 THR 38 -9.562 -10.982 1.297 264 HG23 THR 38 HG23 THR 38 -9.498 -10.234 2.891 265 H GLY 39 HN GLY 39 -12.485 -7.998 -0.588 266 HA2 GLY 39 HA2 GLY 39 -12.783 -5.346 0.478 267 HA3 GLY 39 HA1 GLY 39 -13.235 -5.880 -1.133 268 H ASP 40 HN ASP 40 -14.508 -7.841 1.293 269 HA ASP 40 HA ASP 40 -17.189 -6.962 0.838 270 HB2 ASP 40 HB2 ASP 40 -15.882 -9.076 2.485 271 HB3 ASP 40 HB1 ASP 40 -17.515 -8.586 2.916 272 H VAL 41 HN VAL 41 -14.708 -6.274 3.128 273 HA VAL 41 HA VAL 41 -16.400 -5.208 5.169 274 HB VAL 41 HB VAL 41 -14.273 -4.105 5.995 275 HG11 VAL 41 HG11 VAL 41 -15.041 -6.233 6.874 276 HG12 VAL 41 HG12 VAL 41 -13.285 -6.252 6.719 277 HG13 VAL 41 HG13 VAL 41 -14.284 -7.090 5.533 278 HG21 VAL 41 HG21 VAL 41 -12.173 -4.807 5.028 279 HG22 VAL 41 HG22 VAL 41 -13.150 -3.996 3.805 280 HG23 VAL 41 HG23 VAL 41 -13.018 -5.752 3.804 281 H LEU 42 HN LEU 42 -17.039 -3.163 5.566 282 HA LEU 42 HA LEU 42 -16.743 -1.224 3.427 283 HB2 LEU 42 HB2 LEU 42 -18.489 -1.213 5.872 284 HB3 LEU 42 HB1 LEU 42 -18.577 -0.097 4.540 285 HG LEU 42 HG LEU 42 -19.205 -3.041 4.406 286 HD11 LEU 42 HD11 LEU 42 -20.901 -1.779 5.604 287 HD12 LEU 42 HD12 LEU 42 -21.505 -2.292 4.029 288 HD13 LEU 42 HD13 LEU 42 -20.999 -0.621 4.278 289 HD21 LEU 42 HD21 LEU 42 -19.396 -0.906 2.287 290 HD22 LEU 42 HD22 LEU 42 -19.983 -2.560 2.133 291 HD23 LEU 42 HD23 LEU 42 -18.257 -2.250 2.311 292 H ASP 43 HN ASP 43 -15.232 -2.048 6.237 293 HA ASP 43 HA ASP 43 -14.823 0.656 7.232 294 HB2 ASP 43 HB2 ASP 43 -13.744 -0.362 9.140 295 HB3 ASP 43 HB1 ASP 43 -15.262 -1.197 8.826 296 H GLN 44 HN GLN 44 -13.442 -1.135 4.858 297 HA GLN 44 HA GLN 44 -10.754 -1.089 5.018 298 HB2 GLN 44 HB2 GLN 44 -12.156 0.116 2.646 299 HB3 GLN 44 HB1 GLN 44 -10.617 -0.708 2.666 300 HG2 GLN 44 HG2 GLN 44 -11.737 -2.806 3.210 301 HG3 GLN 44 HG1 GLN 44 -13.295 -1.980 3.163 302 HE21 GLN 44 HE21 GLN 44 -10.693 -3.318 1.307 303 HE22 GLN 44 HE22 GLN 44 -11.446 -3.155 -0.243 304 H VAL 45 HN VAL 45 -9.151 0.324 5.103 305 HA VAL 45 HA VAL 45 -9.854 3.108 5.559 306 HB VAL 45 HB VAL 45 -8.624 1.819 7.345 307 HG11 VAL 45 HG11 VAL 45 -7.213 0.610 5.752 308 HG12 VAL 45 HG12 VAL 45 -6.329 1.327 7.098 309 HG13 VAL 45 HG13 VAL 45 -6.289 2.085 5.503 310 HG21 VAL 45 HG21 VAL 45 -8.633 4.242 7.360 311 HG22 VAL 45 HG22 VAL 45 -7.288 4.276 6.220 312 HG23 VAL 45 HG23 VAL 45 -7.047 3.646 7.850 313 H ALA 46 HN ALA 46 -9.082 4.673 4.330 314 HA ALA 46 HA ALA 46 -7.205 3.943 2.183 315 HB1 ALA 46 HB1 ALA 46 -8.292 5.595 0.769 316 HB2 ALA 46 HB2 ALA 46 -9.400 6.009 2.076 317 HB3 ALA 46 HB3 ALA 46 -9.463 4.408 1.341 318 H ILE 47 HN ILE 47 -5.290 4.730 2.664 319 HA ILE 47 HA ILE 47 -5.141 7.472 3.718 320 HB ILE 47 HB ILE 47 -2.799 6.807 4.463 321 HG12 ILE 47 HG12 ILE 47 -3.964 4.041 4.058 322 HG13 ILE 47 HG11 ILE 47 -2.593 4.724 3.189 323 HG21 ILE 47 HG21 ILE 47 -4.711 7.167 5.959 324 HG22 ILE 47 HG22 ILE 47 -3.612 5.926 6.562 325 HG23 ILE 47 HG23 ILE 47 -5.139 5.463 5.806 326 HD11 ILE 47 HD11 ILE 47 -1.311 4.804 5.253 327 HD12 ILE 47 HD12 ILE 47 -1.889 3.168 4.930 328 HD13 ILE 47 HD13 ILE 47 -2.689 4.164 6.147 329 H GLN 48 HN GLN 48 -3.194 8.671 3.042 330 HA GLN 48 HA GLN 48 -3.107 8.581 0.150 331 HB2 GLN 48 HB2 GLN 48 -3.067 10.606 1.999 332 HB3 GLN 48 HB1 GLN 48 -1.378 10.509 1.545 333 HG2 GLN 48 HG2 GLN 48 -3.618 10.803 -0.428 334 HG3 GLN 48 HG1 GLN 48 -2.727 12.154 0.256 335 HE21 GLN 48 HE21 GLN 48 -2.658 9.505 -1.956 336 HE22 GLN 48 HE22 GLN 48 -1.157 9.908 -2.717 337 H CYS 49 HN CYS 49 -1.551 7.934 -1.069 338 HA CYS 49 HA CYS 49 0.918 6.986 0.195 339 HB2 CYS 49 HB2 CYS 49 -0.704 5.495 -1.873 340 HB3 CYS 49 HB1 CYS 49 0.759 4.939 -1.083 341 H THR 50 HN THR 50 2.703 6.742 -1.249 342 HA THR 50 HA THR 50 2.565 7.888 -3.886 343 HB THR 50 HB THR 50 2.609 9.946 -2.617 344 HG1 THR 50 HG1 THR 50 4.541 10.828 -3.454 345 HG21 THR 50 HG21 THR 50 4.391 10.476 -1.044 346 HG22 THR 50 HG22 THR 50 5.088 8.874 -1.277 347 HG23 THR 50 HG23 THR 50 3.503 9.045 -0.525 348 H GLN 51 HN GLN 51 4.269 7.162 -5.133 349 HA GLN 51 HA GLN 51 6.294 5.622 -3.665 350 HB2 GLN 51 HB2 GLN 51 4.362 4.497 -5.196 351 HB3 GLN 51 HB1 GLN 51 5.641 4.700 -6.387 352 HG2 GLN 51 HG2 GLN 51 6.038 3.357 -3.727 353 HG3 GLN 51 HG1 GLN 51 5.623 2.496 -5.207 354 HE21 GLN 51 HE21 GLN 51 8.020 2.497 -3.416 355 HE22 GLN 51 HE22 GLN 51 9.362 2.742 -4.475 356 H ILE 52 HN ILE 52 8.172 6.504 -3.848 357 HA ILE 52 HA ILE 52 8.946 8.247 -5.998 358 HB ILE 52 HB ILE 52 10.600 7.082 -3.741 359 HG12 ILE 52 HG12 ILE 52 9.110 9.710 -3.928 360 HG13 ILE 52 HG11 ILE 52 8.651 8.337 -2.927 361 HG21 ILE 52 HG21 ILE 52 11.937 7.975 -5.609 362 HG22 ILE 52 HG22 ILE 52 12.122 8.932 -4.140 363 HG23 ILE 52 HG23 ILE 52 11.100 9.519 -5.450 364 HD11 ILE 52 HD11 ILE 52 9.742 10.086 -1.636 365 HD12 ILE 52 HD12 ILE 52 11.177 9.936 -2.648 366 HD13 ILE 52 HD13 ILE 52 10.678 8.591 -1.623 367 HA PRO 53 HA PRO 53 10.128 5.435 -9.154 368 HB2 PRO 53 HB2 PRO 53 12.810 6.543 -9.313 369 HB3 PRO 53 HB1 PRO 53 11.481 6.681 -10.462 370 HG2 PRO 53 HG2 PRO 53 12.349 8.561 -8.390 371 HG3 PRO 53 HG1 PRO 53 11.305 8.841 -9.793 372 HD2 PRO 53 HD2 PRO 53 10.361 8.862 -7.264 373 HD3 PRO 53 HD1 PRO 53 9.386 8.278 -8.629 374 H LEU 54 HN LEU 54 10.560 3.409 -8.810 375 HA LEU 54 HA LEU 54 12.392 2.687 -6.680 376 HB2 LEU 54 HB2 LEU 54 11.134 0.606 -6.550 377 HB3 LEU 54 HB1 LEU 54 10.071 1.994 -6.422 378 HG LEU 54 HG LEU 54 9.902 1.528 -9.079 379 HD11 LEU 54 HD11 LEU 54 9.685 -0.875 -9.453 380 HD12 LEU 54 HD12 LEU 54 10.263 -1.185 -7.817 381 HD13 LEU 54 HD13 LEU 54 11.333 -0.439 -9.002 382 HD21 LEU 54 HD21 LEU 54 7.771 0.474 -8.632 383 HD22 LEU 54 HD22 LEU 54 8.047 1.798 -7.499 384 HD23 LEU 54 HD23 LEU 54 8.265 0.127 -6.975 385 H LEU 55 HN LEU 55 14.099 1.364 -6.957 386 HA LEU 55 HA LEU 55 14.776 0.379 -9.592 387 HB2 LEU 55 HB2 LEU 55 16.004 -0.199 -6.886 388 HB3 LEU 55 HB1 LEU 55 16.677 -0.690 -8.426 389 HG LEU 55 HG LEU 55 16.327 2.162 -7.513 390 HD11 LEU 55 HD11 LEU 55 18.043 1.038 -6.234 391 HD12 LEU 55 HD12 LEU 55 18.777 2.169 -7.370 392 HD13 LEU 55 HD13 LEU 55 18.788 0.440 -7.715 393 HD21 LEU 55 HD21 LEU 55 16.159 1.930 -9.937 394 HD22 LEU 55 HD22 LEU 55 17.674 1.028 -9.961 395 HD23 LEU 55 HD23 LEU 55 17.666 2.725 -9.481 396 H ILE 56 HN ILE 56 14.376 -1.669 -10.350 397 HA ILE 56 HA ILE 56 12.346 -3.163 -9.038 398 HB ILE 56 HB ILE 56 14.105 -4.166 -11.259 399 HG12 ILE 56 HG12 ILE 56 11.521 -2.597 -11.440 400 HG13 ILE 56 HG11 ILE 56 13.114 -2.002 -11.896 401 HG21 ILE 56 HG21 ILE 56 12.788 -5.873 -10.152 402 HG22 ILE 56 HG22 ILE 56 12.177 -5.583 -11.782 403 HG23 ILE 56 HG23 ILE 56 11.324 -4.918 -10.390 404 HD11 ILE 56 HD11 ILE 56 13.223 -3.717 -13.651 405 HD12 ILE 56 HD12 ILE 56 11.855 -2.624 -13.856 406 HD13 ILE 56 HD13 ILE 56 11.601 -4.246 -13.211 407 H GLY 57 HN GLY 57 12.479 -4.771 -7.657 408 HA2 GLY 57 HA2 GLY 57 13.435 -6.597 -6.526 409 HA3 GLY 57 HA1 GLY 57 14.981 -6.215 -7.270 410 H ILE 58 HN ILE 58 13.558 -3.437 -6.103 411 HA ILE 58 HA ILE 58 15.219 -3.490 -3.701 412 HB ILE 58 HB ILE 58 14.541 -1.473 -5.634 413 HG12 ILE 58 HG12 ILE 58 16.797 -2.074 -4.867 414 HG13 ILE 58 HG11 ILE 58 16.476 -0.352 -4.692 415 HG21 ILE 58 HG21 ILE 58 13.968 -0.722 -2.776 416 HG22 ILE 58 HG22 ILE 58 12.848 -0.669 -4.140 417 HG23 ILE 58 HG23 ILE 58 14.223 0.436 -4.088 418 HD11 ILE 58 HD11 ILE 58 16.408 -2.405 -2.489 419 HD12 ILE 58 HD12 ILE 58 16.050 -0.689 -2.302 420 HD13 ILE 58 HD13 ILE 58 17.671 -1.206 -2.768 421 H ALA 59 HN ALA 59 14.410 -2.593 -1.757 422 HA ALA 59 HA ALA 59 11.741 -3.546 -1.142 423 HB1 ALA 59 HB1 ALA 59 13.977 -2.485 0.573 424 HB2 ALA 59 HB2 ALA 59 13.594 -4.182 0.282 425 HB3 ALA 59 HB3 ALA 59 12.468 -3.165 1.186 426 H ILE 60 HN ILE 60 10.080 -2.317 -0.547 427 HA ILE 60 HA ILE 60 9.693 0.292 -1.401 428 HB ILE 60 HB ILE 60 7.901 -1.330 -0.859 429 HG12 ILE 60 HG12 ILE 60 6.377 0.287 0.376 430 HG13 ILE 60 HG11 ILE 60 7.772 1.351 0.525 431 HG21 ILE 60 HG21 ILE 60 8.741 -0.795 1.982 432 HG22 ILE 60 HG22 ILE 60 8.675 -2.341 1.133 433 HG23 ILE 60 HG23 ILE 60 7.180 -1.500 1.548 434 HD11 ILE 60 HD11 ILE 60 6.567 0.383 -2.053 435 HD12 ILE 60 HD12 ILE 60 7.949 1.466 -1.896 436 HD13 ILE 60 HD13 ILE 60 6.357 1.983 -1.341 437 H GLU 61 HN GLU 61 10.785 -0.850 1.754 438 HA GLU 61 HA GLU 61 10.456 1.711 3.009 439 HB2 GLU 61 HB2 GLU 61 11.682 0.515 4.910 440 HB3 GLU 61 HB1 GLU 61 10.110 -0.114 4.440 441 HG2 GLU 61 HG2 GLU 61 11.051 -1.956 3.341 442 HG3 GLU 61 HG1 GLU 61 12.659 -1.241 3.343 443 H ASP 62 HN ASP 62 12.906 0.208 1.176 444 HA ASP 62 HA ASP 62 14.954 2.016 2.247 445 HB2 ASP 62 HB2 ASP 62 15.175 -0.433 0.490 446 HB3 ASP 62 HB1 ASP 62 16.532 0.633 0.840 447 H GLU 63 HN GLU 63 12.658 1.965 -0.085 448 HA GLU 63 HA GLU 63 14.305 3.342 -2.071 449 HB2 GLU 63 HB2 GLU 63 12.835 1.404 -2.749 450 HB3 GLU 63 HB1 GLU 63 11.448 2.418 -2.372 451 HG2 GLU 63 HG2 GLU 63 11.964 2.403 -4.759 452 HG3 GLU 63 HG1 GLU 63 12.109 4.007 -4.050 453 H CYS 64 HN CYS 64 11.902 3.870 0.325 454 HA CYS 64 HA CYS 64 11.725 6.669 -0.519 455 HB2 CYS 64 HB2 CYS 64 9.385 6.742 -0.352 456 HB3 CYS 64 HB1 CYS 64 9.697 5.216 -1.181 457 H LYS 65 HN LYS 65 11.151 8.132 1.236 458 HA LYS 65 HA LYS 65 12.057 7.076 3.822 459 HB2 LYS 65 HB2 LYS 65 12.067 9.890 2.726 460 HB3 LYS 65 HB1 LYS 65 12.530 9.470 4.368 461 HG2 LYS 65 HG2 LYS 65 13.883 8.554 1.841 462 HG3 LYS 65 HG1 LYS 65 14.495 9.741 2.995 463 HD2 LYS 65 HD2 LYS 65 14.433 7.943 4.739 464 HD3 LYS 65 HD1 LYS 65 14.045 6.799 3.456 465 HE2 LYS 65 HE2 LYS 65 16.129 7.288 2.335 466 HE3 LYS 65 HE1 LYS 65 16.509 8.529 3.526 467 HZ1 LYS 65 HZ1 LYS 65 16.208 5.636 4.097 468 HZ2 LYS 65 HZ2 LYS 65 16.603 6.829 5.225 469 HZ3 LYS 65 HZ3 LYS 65 17.676 6.462 3.974 470 H ASN 66 HN ASN 66 9.494 6.511 3.193 471 HA ASN 66 HA ASN 66 7.977 8.253 5.020 472 HB2 ASN 66 HB2 ASN 66 7.089 6.987 2.444 473 HB3 ASN 66 HB1 ASN 66 5.926 7.429 3.686 474 HD21 ASN 66 HD21 ASN 66 4.920 9.030 2.639 475 HD22 ASN 66 HD22 ASN 66 5.666 10.507 2.146 476 H THR 67 HN THR 67 5.702 6.642 5.242 477 HA THR 67 HA THR 67 6.792 4.475 6.827 478 HB THR 67 HB THR 67 3.889 5.271 6.510 479 HG1 THR 67 HG1 THR 67 5.952 6.477 7.849 480 HG21 THR 67 HG21 THR 67 4.139 3.052 7.407 481 HG22 THR 67 HG22 THR 67 3.701 4.134 8.732 482 HG23 THR 67 HG23 THR 67 5.374 3.599 8.538 483 HA PRO 68 HA PRO 68 5.880 1.582 3.577 484 HB2 PRO 68 HB2 PRO 68 6.853 -0.598 4.848 485 HB3 PRO 68 HB1 PRO 68 7.899 0.621 4.123 486 HG2 PRO 68 HG2 PRO 68 7.269 0.127 6.974 487 HG3 PRO 68 HG1 PRO 68 8.732 0.803 6.244 488 HD2 PRO 68 HD2 PRO 68 6.657 2.238 7.486 489 HD3 PRO 68 HD1 PRO 68 7.970 2.912 6.516 490 H THR 69 HN THR 69 3.922 0.764 3.214 491 HA THR 69 HA THR 69 2.505 -0.505 5.464 492 HB THR 69 HB THR 69 0.419 0.243 4.079 493 HG1 THR 69 HG1 THR 69 0.903 1.425 2.416 494 HG21 THR 69 HG21 THR 69 1.971 2.366 5.559 495 HG22 THR 69 HG22 THR 69 0.984 1.119 6.331 496 HG23 THR 69 HG23 THR 69 0.228 2.317 5.272 497 H CYS 70 HN CYS 70 1.186 -2.275 4.978 498 HA CYS 70 HA CYS 70 1.537 -3.477 2.311 499 HB2 CYS 70 HB2 CYS 70 2.276 -5.008 3.979 500 HB3 CYS 70 HB1 CYS 70 0.894 -4.668 5.013 501 H CYS 71 HN CYS 71 -0.092 -2.767 1.047 502 HA CYS 71 HA CYS 71 -2.694 -2.159 2.196 503 HB2 CYS 71 HB2 CYS 71 -1.616 -1.918 -0.625 504 HB3 CYS 71 HB1 CYS 71 -3.269 -1.542 -0.189 505 H GLU 72 HN GLU 72 -4.542 -3.306 1.851 506 HA GLU 72 HA GLU 72 -4.402 -5.967 0.829 507 HB2 GLU 72 HB2 GLU 72 -5.946 -5.834 2.524 508 HB3 GLU 72 HB1 GLU 72 -6.405 -4.187 2.126 509 HG2 GLU 72 HG2 GLU 72 -7.692 -4.991 0.251 510 HG3 GLU 72 HG1 GLU 72 -7.228 -6.649 0.630 511 H ASP 73 HN ASP 73 -5.255 -2.807 -0.275 512 HA ASP 73 HA ASP 73 -5.170 -3.658 -3.029 513 HB2 ASP 73 HB2 ASP 73 -7.612 -3.903 -2.130 514 HB3 ASP 73 HB1 ASP 73 -7.633 -2.148 -2.209 515 H VAL 74 HN VAL 74 -5.161 -1.680 -4.471 516 HA VAL 74 HA VAL 74 -4.839 0.849 -3.013 517 HB VAL 74 HB VAL 74 -2.883 0.275 -5.216 518 HG11 VAL 74 HG11 VAL 74 -1.575 1.969 -4.074 519 HG12 VAL 74 HG12 VAL 74 -2.781 2.055 -2.793 520 HG13 VAL 74 HG13 VAL 74 -3.199 2.559 -4.430 521 HG21 VAL 74 HG21 VAL 74 -1.220 -0.528 -3.691 522 HG22 VAL 74 HG22 VAL 74 -2.649 -1.547 -3.512 523 HG23 VAL 74 HG23 VAL 74 -2.299 -0.302 -2.314 524 H GLU 75 HN GLU 75 -5.698 2.552 -4.073 525 HA GLU 75 HA GLU 75 -6.852 2.018 -6.729 526 HB2 GLU 75 HB2 GLU 75 -8.365 2.563 -4.745 527 HB3 GLU 75 HB1 GLU 75 -7.692 4.184 -4.793 528 HG2 GLU 75 HG2 GLU 75 -8.539 4.487 -7.051 529 HG3 GLU 75 HG1 GLU 75 -9.183 2.846 -7.039 530 H ASP 76 HN ASP 76 -7.061 4.011 -8.129 531 HA ASP 76 HA ASP 76 -6.139 5.693 -9.351 532 HB2 ASP 76 HB2 ASP 76 -5.996 6.725 -6.884 533 HB3 ASP 76 HB1 ASP 76 -4.275 6.536 -7.176 534 H ASP 77 HN ASP 77 -3.375 6.659 -9.152 535 HA ASP 77 HA ASP 77 -1.999 4.420 -10.338 536 HB2 ASP 77 HB2 ASP 77 -1.111 7.226 -9.664 537 HB3 ASP 77 HB1 ASP 77 -0.029 6.029 -10.362 538 H GLY 78 HN GLY 78 -2.849 4.301 -7.481 539 HA2 GLY 78 HA2 GLY 78 -1.843 3.009 -5.781 540 HA3 GLY 78 HA1 GLY 78 -0.265 3.508 -6.360 541 H LEU 79 HN LEU 79 -2.768 5.870 -5.967 542 HA LEU 79 HA LEU 79 -1.131 7.209 -3.967 543 HB2 LEU 79 HB2 LEU 79 -3.696 8.202 -5.189 544 HB3 LEU 79 HB1 LEU 79 -2.479 9.144 -4.352 545 HG LEU 79 HG LEU 79 -2.271 7.895 -7.087 546 HD11 LEU 79 HD11 LEU 79 -2.190 10.748 -6.118 547 HD12 LEU 79 HD12 LEU 79 -3.505 9.976 -7.004 548 HD13 LEU 79 HD13 LEU 79 -1.942 10.225 -7.783 549 HD21 LEU 79 HD21 LEU 79 -0.010 8.855 -7.182 550 HD22 LEU 79 HD22 LEU 79 -0.142 7.615 -5.936 551 HD23 LEU 79 HD23 LEU 79 -0.143 9.319 -5.485 552 H VAL 80 HN VAL 80 -3.883 5.224 -4.067 553 HA VAL 80 HA VAL 80 -4.651 6.098 -1.362 554 HB VAL 80 HB VAL 80 -6.539 5.179 -3.539 555 HG11 VAL 80 HG11 VAL 80 -8.316 5.758 -1.969 556 HG12 VAL 80 HG12 VAL 80 -7.110 6.163 -0.749 557 HG13 VAL 80 HG13 VAL 80 -7.270 4.500 -1.311 558 HG21 VAL 80 HG21 VAL 80 -5.749 7.403 -4.015 559 HG22 VAL 80 HG22 VAL 80 -6.070 7.913 -2.358 560 HG23 VAL 80 HG23 VAL 80 -7.409 7.496 -3.428 561 H GLY 81 HN GLY 81 -3.878 4.496 -0.110 562 HA2 GLY 81 HA2 GLY 81 -4.010 1.748 -1.105 563 HA3 GLY 81 HA1 GLY 81 -3.084 2.299 0.280 564 H ILE 82 HN ILE 82 -5.283 0.218 -0.333 565 HA ILE 82 HA ILE 82 -7.278 1.009 1.661 566 HB ILE 82 HB ILE 82 -7.235 -1.040 -0.523 567 HG12 ILE 82 HG12 ILE 82 -9.535 -0.104 -0.907 568 HG13 ILE 82 HG11 ILE 82 -9.215 1.055 0.378 569 HG21 ILE 82 HG21 ILE 82 -9.003 -1.151 1.903 570 HG22 ILE 82 HG22 ILE 82 -7.868 -2.376 1.342 571 HG23 ILE 82 HG23 ILE 82 -9.321 -2.024 0.404 572 HD11 ILE 82 HD11 ILE 82 -7.337 1.937 -0.899 573 HD12 ILE 82 HD12 ILE 82 -8.853 2.042 -1.797 574 HD13 ILE 82 HD13 ILE 82 -7.681 0.782 -2.189 575 H ASN 83 HN ASN 83 -7.196 0.255 3.637 576 HA ASN 83 HA ASN 83 -6.613 -0.967 5.482 577 HB2 ASN 83 HB2 ASN 83 -6.957 -3.100 3.398 578 HB3 ASN 83 HB1 ASN 83 -6.531 -3.510 5.054 579 HD21 ASN 83 HD21 ASN 83 -8.919 -4.155 3.537 580 HD22 ASN 83 HD22 ASN 83 -10.235 -3.498 4.430 581 H CYS 84 HN CYS 84 -4.525 0.329 4.366 582 HA CYS 84 HA CYS 84 -2.335 -1.539 4.001 583 HB2 CYS 84 HB2 CYS 84 -2.839 1.037 3.046 584 HB3 CYS 84 HB1 CYS 84 -1.563 1.224 4.219 585 H THR 85 HN THR 85 -1.728 -2.437 5.853 586 HA THR 85 HA THR 85 -1.591 -0.912 8.307 587 HB THR 85 HB THR 85 -0.550 -3.713 7.855 588 HG1 THR 85 HG1 THR 85 -3.133 -2.751 7.823 589 HG21 THR 85 HG21 THR 85 -1.141 -3.946 10.255 590 HG22 THR 85 HG22 THR 85 -1.581 -2.236 10.281 591 HG23 THR 85 HG23 THR 85 0.086 -2.713 9.969 592 HA PRO 86 HA PRO 86 2.508 0.390 7.546 593 HB2 PRO 86 HB2 PRO 86 2.949 1.469 10.022 594 HB3 PRO 86 HB1 PRO 86 2.105 2.260 8.697 595 HG2 PRO 86 HG2 PRO 86 1.021 1.150 11.148 596 HG3 PRO 86 HG1 PRO 86 0.332 2.300 10.005 597 HD2 PRO 86 HD2 PRO 86 -0.274 -0.427 10.262 598 HD3 PRO 86 HD1 PRO 86 -0.885 0.718 9.082 599 H ILE 87 HN ILE 87 4.013 -1.125 7.383 600 HA ILE 87 HA ILE 87 4.337 -3.093 9.448 601 HB ILE 87 HB ILE 87 6.127 -3.942 7.805 602 HG12 ILE 87 HG12 ILE 87 4.568 -2.160 5.929 603 HG13 ILE 87 HG11 ILE 87 6.169 -1.759 6.528 604 HG21 ILE 87 HG21 ILE 87 3.217 -3.890 7.030 605 HG22 ILE 87 HG22 ILE 87 3.962 -4.991 8.191 606 HG23 ILE 87 HG23 ILE 87 4.409 -5.071 6.486 607 HD11 ILE 87 HD11 ILE 87 5.420 -4.112 4.810 608 HD12 ILE 87 HD12 ILE 87 7.031 -3.815 5.467 609 HD13 ILE 87 HD13 ILE 87 6.324 -2.678 4.316 610 HA PRO 88 HA PRO 88 7.752 -1.061 11.413 611 HB2 PRO 88 HB2 PRO 88 8.441 -3.706 12.456 612 HB3 PRO 88 HB1 PRO 88 7.901 -2.278 13.330 613 HG2 PRO 88 HG2 PRO 88 6.335 -4.423 13.077 614 HG3 PRO 88 HG1 PRO 88 5.665 -2.781 13.021 615 HD2 PRO 88 HD2 PRO 88 6.353 -4.609 10.747 616 HD3 PRO 88 HD1 PRO 88 4.879 -3.670 11.011 617 H LEU 89 HN LEU 89 10.038 -1.067 11.452 618 HA LEU 89 HA LEU 89 11.207 -2.265 9.065 619 HB2 LEU 89 HB2 LEU 89 12.383 -0.309 11.039 620 HB3 LEU 89 HB1 LEU 89 13.074 -0.754 9.488 621 HG LEU 89 HG LEU 89 10.495 0.766 9.897 622 HD11 LEU 89 HD11 LEU 89 11.705 2.628 8.906 623 HD12 LEU 89 HD12 LEU 89 13.164 1.642 8.807 624 HD13 LEU 89 HD13 LEU 89 12.496 2.076 10.381 625 HD21 LEU 89 HD21 LEU 89 10.336 -0.638 7.934 626 HD22 LEU 89 HD22 LEU 89 11.907 -0.072 7.368 627 HD23 LEU 89 HD23 LEU 89 10.545 1.045 7.449 628 H ILE 90 HN ILE 90 10.617 -3.856 11.504 629 HA ILE 90 HA ILE 90 13.354 -4.678 12.151 630 HB ILE 90 HB ILE 90 12.498 -5.318 14.417 631 HG12 ILE 90 HG12 ILE 90 10.148 -3.578 13.630 632 HG13 ILE 90 HG11 ILE 90 10.081 -5.322 13.848 633 HG21 ILE 90 HG21 ILE 90 12.517 -2.956 15.255 634 HG22 ILE 90 HG22 ILE 90 12.474 -2.423 13.569 635 HG23 ILE 90 HG23 ILE 90 13.844 -3.362 14.168 636 HD11 ILE 90 HD11 ILE 90 10.649 -5.050 16.203 637 HD12 ILE 90 HD12 ILE 90 9.192 -4.150 15.777 638 HD13 ILE 90 HD13 ILE 90 10.726 -3.302 15.982 Start of MODEL 14 1 H1 GLY 1 HT1 GLY 1 -0.469 -7.860 -11.301 2 H2 GLY 1 HT2 GLY 1 0.566 -7.167 -10.160 3 H3 GLY 1 HT3 GLY 1 -0.005 -8.742 -9.937 4 HA2 GLY 1 HA1 GLY 1 1.204 -9.504 -11.863 5 HA3 GLY 1 HA2 GLY 1 1.774 -7.864 -12.132 6 H SER 2 HN SER 2 3.450 -7.064 -10.928 7 HA SER 2 HA SER 2 4.918 -9.061 -9.386 8 HB2 SER 2 HB2 SER 2 6.764 -7.278 -9.575 9 HB3 SER 2 HB1 SER 2 6.281 -8.101 -11.059 10 HG SER 2 HG SER 2 6.375 -5.886 -11.434 11 H GLY 3 HN GLY 3 5.025 -8.984 -7.239 12 HA2 GLY 3 HA2 GLY 3 3.977 -6.606 -5.880 13 HA3 GLY 3 HA1 GLY 3 4.164 -8.201 -5.166 14 H TRP 4 HN TRP 4 5.051 -6.239 -3.664 15 HA TRP 4 HA TRP 4 7.825 -5.630 -4.201 16 HB2 TRP 4 HB2 TRP 4 5.890 -4.933 -2.031 17 HB3 TRP 4 HB1 TRP 4 7.612 -4.680 -1.782 18 HD1 TRP 4 HD1 TRP 4 4.604 -3.194 -3.482 19 HE1 TRP 4 HE1 TRP 4 5.283 -0.986 -4.617 20 HE3 TRP 4 HE3 TRP 4 9.676 -3.600 -3.056 21 HZ2 TRP 4 HZ2 TRP 4 7.665 0.388 -5.259 22 HZ3 TRP 4 HZ3 TRP 4 11.086 -1.800 -3.960 23 HH2 TRP 4 HH2 TRP 4 10.101 0.152 -5.039 24 H GLU 5 HN GLU 5 9.185 -5.771 -1.989 25 HA GLU 5 HA GLU 5 9.649 -8.584 -1.630 26 HB2 GLU 5 HB2 GLU 5 10.956 -6.227 -0.251 27 HB3 GLU 5 HB1 GLU 5 11.555 -7.878 -0.272 28 HG2 GLU 5 HG2 GLU 5 11.289 -6.085 -2.679 29 HG3 GLU 5 HG1 GLU 5 12.780 -6.415 -1.802 30 H SER 6 HN SER 6 8.278 -9.655 -0.353 31 HA SER 6 HA SER 6 7.496 -8.435 2.212 32 HB2 SER 6 HB2 SER 6 5.665 -9.037 0.550 33 HB3 SER 6 HB1 SER 6 6.094 -10.725 0.816 34 HG SER 6 HG SER 6 4.567 -10.426 2.299 35 H LYS 7 HN LYS 7 9.990 -9.775 1.641 36 HA LYS 7 HA LYS 7 10.029 -12.496 2.226 37 HB2 LYS 7 HB2 LYS 7 12.440 -12.204 2.581 38 HB3 LYS 7 HB1 LYS 7 11.879 -11.375 1.141 39 HG2 LYS 7 HG2 LYS 7 13.210 -9.750 1.993 40 HG3 LYS 7 HG1 LYS 7 11.706 -9.344 2.815 41 HD2 LYS 7 HD2 LYS 7 13.438 -9.285 4.446 42 HD3 LYS 7 HD1 LYS 7 12.478 -10.736 4.741 43 HE2 LYS 7 HE2 LYS 7 14.131 -12.099 3.628 44 HE3 LYS 7 HE1 LYS 7 15.065 -10.668 3.205 45 HZ1 LYS 7 HZ1 LYS 7 15.360 -10.259 5.603 46 HZ2 LYS 7 HZ2 LYS 7 16.042 -11.720 5.100 47 HZ3 LYS 7 HZ3 LYS 7 14.575 -11.719 5.935 48 H THR 8 HN THR 8 9.772 -9.802 4.406 49 HA THR 8 HA THR 8 10.616 -11.449 6.647 50 HB THR 8 HB THR 8 11.223 -8.960 6.370 51 HG1 THR 8 HG1 THR 8 11.243 -8.711 8.624 52 HG21 THR 8 HG21 THR 8 8.958 -8.139 5.905 53 HG22 THR 8 HG22 THR 8 9.641 -7.371 7.338 54 HG23 THR 8 HG23 THR 8 8.444 -8.654 7.511 55 H GLY 9 HN GLY 9 7.903 -11.372 4.935 56 HA2 GLY 9 HA2 GLY 9 5.815 -12.252 5.430 57 HA3 GLY 9 HA1 GLY 9 6.284 -12.329 7.122 58 H SER 10 HN SER 10 6.701 -9.349 5.479 59 HA SER 10 HA SER 10 5.208 -7.998 7.464 60 HB2 SER 10 HB2 SER 10 5.739 -5.998 5.919 61 HB3 SER 10 HB1 SER 10 7.084 -6.856 6.664 62 HG SER 10 HG SER 10 7.238 -6.421 4.328 63 H CYS 11 HN CYS 11 4.462 -9.017 4.209 64 HA CYS 11 HA CYS 11 1.818 -7.765 4.539 65 HB2 CYS 11 HB2 CYS 11 3.318 -6.444 3.016 66 HB3 CYS 11 HB1 CYS 11 3.342 -7.835 1.936 67 H ASN 12 HN ASN 12 0.099 -8.912 3.845 68 HA ASN 12 HA ASN 12 0.588 -11.683 3.097 69 HB2 ASN 12 HB2 ASN 12 -1.730 -12.091 3.658 70 HB3 ASN 12 HB1 ASN 12 -0.974 -11.177 4.960 71 HD21 ASN 12 HD21 ASN 12 -1.568 -9.003 5.253 72 HD22 ASN 12 HD22 ASN 12 -3.023 -8.368 4.565 73 H THR 13 HN THR 13 -0.638 -8.743 1.712 74 HA THR 13 HA THR 13 -1.938 -10.185 -0.462 75 HB THR 13 HB THR 13 -2.567 -7.736 -1.104 76 HG1 THR 13 HG1 THR 13 -2.124 -6.240 0.367 77 HG21 THR 13 HG21 THR 13 -4.451 -7.824 0.523 78 HG22 THR 13 HG22 THR 13 -3.626 -9.153 1.346 79 HG23 THR 13 HG23 THR 13 -4.182 -9.351 -0.317 80 H GLY 14 HN GLY 14 0.807 -8.048 0.090 81 HA2 GLY 14 HA2 GLY 14 2.755 -8.355 -1.295 82 HA3 GLY 14 HA1 GLY 14 1.688 -8.732 -2.637 83 H LYS 15 HN LYS 15 0.011 -6.300 -1.648 84 HA LYS 15 HA LYS 15 1.410 -4.411 -3.343 85 HB2 LYS 15 HB2 LYS 15 -1.301 -4.338 -2.022 86 HB3 LYS 15 HB1 LYS 15 -0.627 -2.949 -2.860 87 HG2 LYS 15 HG2 LYS 15 -0.393 -4.535 -4.871 88 HG3 LYS 15 HG1 LYS 15 -1.511 -5.578 -3.985 89 HD2 LYS 15 HD2 LYS 15 -3.129 -3.738 -3.868 90 HD3 LYS 15 HD1 LYS 15 -2.008 -2.699 -4.745 91 HE2 LYS 15 HE2 LYS 15 -2.101 -4.285 -6.636 92 HE3 LYS 15 HE1 LYS 15 -3.337 -5.194 -5.772 93 HZ1 LYS 15 HZ1 LYS 15 -3.581 -2.348 -6.581 94 HZ2 LYS 15 HZ2 LYS 15 -4.795 -3.293 -5.864 95 HZ3 LYS 15 HZ3 LYS 15 -4.248 -3.646 -7.430 96 H LEU 16 HN LEU 16 3.207 -3.894 -2.061 97 HA LEU 16 HA LEU 16 2.721 -2.493 0.432 98 HB2 LEU 16 HB2 LEU 16 5.217 -3.288 -1.044 99 HB3 LEU 16 HB1 LEU 16 5.264 -2.197 0.319 100 HG LEU 16 HG LEU 16 4.220 -3.984 1.711 101 HD11 LEU 16 HD11 LEU 16 4.799 -5.717 -0.670 102 HD12 LEU 16 HD12 LEU 16 3.198 -5.246 -0.104 103 HD13 LEU 16 HD13 LEU 16 4.230 -6.258 0.907 104 HD21 LEU 16 HD21 LEU 16 6.840 -4.657 0.390 105 HD22 LEU 16 HD22 LEU 16 6.268 -5.300 1.929 106 HD23 LEU 16 HD23 LEU 16 6.616 -3.579 1.767 107 H ALA 17 HN ALA 17 2.838 -0.304 0.666 108 HA ALA 17 HA ALA 17 3.941 1.289 -1.514 109 HB1 ALA 17 HB1 ALA 17 1.957 2.785 -1.527 110 HB2 ALA 17 HB2 ALA 17 1.116 1.609 -0.510 111 HB3 ALA 17 HB3 ALA 17 1.622 1.161 -2.140 112 H CYS 18 HN CYS 18 4.544 3.386 -0.892 113 HA CYS 18 HA CYS 18 5.014 3.700 1.958 114 HB2 CYS 18 HB2 CYS 18 5.815 5.525 -0.317 115 HB3 CYS 18 HB1 CYS 18 6.466 5.524 1.317 116 H CYS 19 HN CYS 19 3.254 4.408 3.046 117 HA CYS 19 HA CYS 19 1.528 6.380 1.701 118 HB2 CYS 19 HB2 CYS 19 0.710 4.149 3.559 119 HB3 CYS 19 HB1 CYS 19 -0.377 5.338 2.861 120 H ASP 20 HN ASP 20 0.234 7.763 3.129 121 HA ASP 20 HA ASP 20 1.627 8.373 5.640 122 HB2 ASP 20 HB2 ASP 20 -0.179 9.941 3.824 123 HB3 ASP 20 HB1 ASP 20 0.005 10.424 5.503 124 H THR 21 HN THR 21 0.853 7.064 7.168 125 HA THR 21 HA THR 21 -1.777 5.997 7.150 126 HB THR 21 HB THR 21 -1.150 5.047 9.357 127 HG1 THR 21 HG1 THR 21 0.214 6.485 10.288 128 HG21 THR 21 HG21 THR 21 0.669 3.636 8.533 129 HG22 THR 21 HG22 THR 21 0.975 4.780 7.227 130 HG23 THR 21 HG23 THR 21 -0.544 3.887 7.278 131 H ASN 22 HN ASN 22 -0.745 9.025 8.027 132 HA ASN 22 HA ASN 22 -2.619 9.272 10.278 133 HB2 ASN 22 HB2 ASN 22 -1.391 11.256 10.896 134 HB3 ASN 22 HB1 ASN 22 -0.244 9.957 10.621 135 HD21 ASN 22 HD21 ASN 22 0.111 12.862 10.552 136 HD22 ASN 22 HD22 ASN 22 0.760 13.213 8.989 137 H LYS 23 HN LYS 23 -2.204 9.737 7.089 138 HA LYS 23 HA LYS 23 -4.204 11.868 6.921 139 HB2 LYS 23 HB2 LYS 23 -2.293 12.818 6.024 140 HB3 LYS 23 HB1 LYS 23 -1.731 11.300 5.349 141 HG2 LYS 23 HG2 LYS 23 -2.342 12.637 3.532 142 HG3 LYS 23 HG1 LYS 23 -3.608 11.436 3.756 143 HD2 LYS 23 HD2 LYS 23 -5.094 13.036 4.695 144 HD3 LYS 23 HD1 LYS 23 -3.803 14.229 4.858 145 HE2 LYS 23 HE2 LYS 23 -3.623 14.319 2.405 146 HE3 LYS 23 HE1 LYS 23 -4.944 13.162 2.279 147 HZ1 LYS 23 HZ1 LYS 23 -5.154 15.841 3.542 148 HZ2 LYS 23 HZ2 LYS 23 -6.416 14.745 3.302 149 HZ3 LYS 23 HZ3 LYS 23 -5.664 15.466 1.975 150 H LYS 24 HN LYS 24 -6.032 10.774 6.711 151 HA LYS 24 HA LYS 24 -6.260 8.442 5.029 152 HB2 LYS 24 HB2 LYS 24 -8.070 9.896 6.916 153 HB3 LYS 24 HB1 LYS 24 -8.747 8.756 5.764 154 HG2 LYS 24 HG2 LYS 24 -8.451 7.584 7.783 155 HG3 LYS 24 HG1 LYS 24 -7.180 7.043 6.695 156 HD2 LYS 24 HD2 LYS 24 -5.554 8.409 7.823 157 HD3 LYS 24 HD1 LYS 24 -6.811 9.138 8.828 158 HE2 LYS 24 HE2 LYS 24 -7.292 6.937 9.804 159 HE3 LYS 24 HE1 LYS 24 -6.017 6.227 8.816 160 HZ1 LYS 24 HZ1 LYS 24 -5.344 6.716 11.124 161 HZ2 LYS 24 HZ2 LYS 24 -5.568 8.365 10.826 162 HZ3 LYS 24 HZ3 LYS 24 -4.382 7.502 9.976 163 H VAL 25 HN VAL 25 -8.206 8.330 3.581 164 HA VAL 25 HA VAL 25 -8.585 10.854 2.101 165 HB VAL 25 HB VAL 25 -8.713 8.083 0.909 166 HG11 VAL 25 HG11 VAL 25 -8.530 10.795 -0.388 167 HG12 VAL 25 HG12 VAL 25 -9.968 9.779 -0.308 168 HG13 VAL 25 HG13 VAL 25 -8.562 9.248 -1.232 169 HG21 VAL 25 HG21 VAL 25 -6.406 10.031 0.793 170 HG22 VAL 25 HG22 VAL 25 -6.509 8.481 -0.047 171 HG23 VAL 25 HG23 VAL 25 -6.442 8.525 1.715 172 H GLN 26 HN GLN 26 -10.691 11.144 1.172 173 HA GLN 26 HA GLN 26 -12.727 10.422 3.036 174 HB2 GLN 26 HB2 GLN 26 -14.159 11.835 1.608 175 HB3 GLN 26 HB1 GLN 26 -12.682 12.641 2.100 176 HG2 GLN 26 HG2 GLN 26 -11.714 12.160 -0.097 177 HG3 GLN 26 HG1 GLN 26 -13.215 11.372 -0.577 178 HE21 GLN 26 HE21 GLN 26 -15.043 12.624 -0.962 179 HE22 GLN 26 HE22 GLN 26 -14.952 14.334 -1.204 180 H LYS 27 HN LYS 27 -11.675 8.186 1.313 181 HA LYS 27 HA LYS 27 -14.240 7.358 0.168 182 HB2 LYS 27 HB2 LYS 27 -11.611 7.249 -1.292 183 HB3 LYS 27 HB1 LYS 27 -13.102 6.492 -1.839 184 HG2 LYS 27 HG2 LYS 27 -14.122 8.834 -1.690 185 HG3 LYS 27 HG1 LYS 27 -12.455 9.411 -1.617 186 HD2 LYS 27 HD2 LYS 27 -13.718 7.754 -3.786 187 HD3 LYS 27 HD1 LYS 27 -13.245 9.449 -3.906 188 HE2 LYS 27 HE2 LYS 27 -10.896 8.791 -3.556 189 HE3 LYS 27 HE1 LYS 27 -11.393 7.101 -3.492 190 HZ1 LYS 27 HZ1 LYS 27 -10.685 7.403 -5.665 191 HZ2 LYS 27 HZ2 LYS 27 -11.405 8.933 -5.802 192 HZ3 LYS 27 HZ3 LYS 27 -12.370 7.547 -5.789 193 H SER 28 HN SER 28 -14.411 5.070 -0.211 194 HA SER 28 HA SER 28 -12.407 3.413 1.145 195 HB2 SER 28 HB2 SER 28 -14.352 2.045 2.041 196 HB3 SER 28 HB1 SER 28 -14.146 3.634 2.776 197 HG SER 28 HG SER 28 -16.151 2.687 1.086 198 H THR 29 HN THR 29 -12.619 3.911 -1.570 199 HA THR 29 HA THR 29 -14.076 1.731 -2.807 200 HB THR 29 HB THR 29 -13.049 2.786 -4.917 201 HG1 THR 29 HG1 THR 29 -11.623 4.294 -4.504 202 HG21 THR 29 HG21 THR 29 -14.728 4.554 -4.944 203 HG22 THR 29 HG22 THR 29 -14.889 4.449 -3.192 204 HG23 THR 29 HG23 THR 29 -15.385 3.095 -4.206 205 H GLY 30 HN GLY 30 -12.581 0.931 -4.882 206 HA2 GLY 30 HA2 GLY 30 -9.847 0.454 -4.337 207 HA3 GLY 30 HA1 GLY 30 -10.801 -0.937 -3.839 208 H GLU 31 HN GLU 31 -8.806 -0.633 -5.996 209 HA GLU 31 HA GLU 31 -10.313 -0.736 -8.464 210 HB2 GLU 31 HB2 GLU 31 -7.384 -1.179 -7.860 211 HB3 GLU 31 HB1 GLU 31 -8.075 -1.200 -9.476 212 HG2 GLU 31 HG2 GLU 31 -8.200 1.153 -7.610 213 HG3 GLU 31 HG1 GLU 31 -6.981 0.936 -8.865 214 H GLU 32 HN GLU 32 -8.308 -2.963 -6.562 215 HA GLU 32 HA GLU 32 -9.406 -5.208 -8.072 216 HB2 GLU 32 HB2 GLU 32 -7.139 -5.090 -6.077 217 HB3 GLU 32 HB1 GLU 32 -7.675 -6.550 -6.895 218 HG2 GLU 32 HG2 GLU 32 -6.499 -4.101 -8.189 219 HG3 GLU 32 HG1 GLU 32 -5.708 -5.661 -7.968 220 H SER 33 HN SER 33 -9.146 -3.888 -4.815 221 HA SER 33 HA SER 33 -10.591 -5.961 -3.524 222 HB2 SER 33 HB2 SER 33 -9.196 -4.256 -2.336 223 HB3 SER 33 HB1 SER 33 -10.423 -3.047 -2.707 224 HG SER 33 HG SER 33 -10.947 -3.769 -0.713 225 H GLY 34 HN GLY 34 -11.525 -3.180 -5.393 226 HA2 GLY 34 HA2 GLY 34 -14.258 -3.105 -4.585 227 HA3 GLY 34 HA1 GLY 34 -13.581 -2.352 -6.020 228 H LEU 35 HN LEU 35 -12.492 -5.153 -6.681 229 HA LEU 35 HA LEU 35 -14.822 -6.028 -8.167 230 HB2 LEU 35 HB2 LEU 35 -12.017 -7.150 -8.065 231 HB3 LEU 35 HB1 LEU 35 -13.273 -7.652 -9.180 232 HG LEU 35 HG LEU 35 -12.037 -4.899 -9.077 233 HD11 LEU 35 HD11 LEU 35 -10.466 -6.563 -9.888 234 HD12 LEU 35 HD12 LEU 35 -11.012 -5.530 -11.208 235 HD13 LEU 35 HD13 LEU 35 -11.665 -7.158 -11.035 236 HD21 LEU 35 HD21 LEU 35 -14.011 -6.118 -11.004 237 HD22 LEU 35 HD22 LEU 35 -13.248 -4.537 -11.175 238 HD23 LEU 35 HD23 LEU 35 -14.350 -4.844 -9.833 239 H LEU 36 HN LEU 36 -12.937 -6.939 -5.411 240 HA LEU 36 HA LEU 36 -14.298 -9.488 -5.091 241 HB2 LEU 36 HB2 LEU 36 -11.825 -9.053 -4.611 242 HB3 LEU 36 HB1 LEU 36 -12.360 -8.175 -3.194 243 HG LEU 36 HG LEU 36 -13.421 -10.238 -2.337 244 HD11 LEU 36 HD11 LEU 36 -12.139 -11.511 -4.751 245 HD12 LEU 36 HD12 LEU 36 -13.868 -11.368 -4.435 246 HD13 LEU 36 HD13 LEU 36 -12.863 -12.383 -3.401 247 HD21 LEU 36 HD21 LEU 36 -11.349 -11.382 -1.757 248 HD22 LEU 36 HD22 LEU 36 -11.153 -9.631 -1.668 249 HD23 LEU 36 HD23 LEU 36 -10.506 -10.522 -3.046 250 H HIS 37 HN HIS 37 -15.086 -9.888 -2.704 251 HA HIS 37 HA HIS 37 -17.153 -7.976 -2.196 252 HB2 HIS 37 HB2 HIS 37 -17.466 -10.419 -1.879 253 HB3 HIS 37 HB1 HIS 37 -16.328 -10.373 -0.540 254 HD1 HIS 37 HD1 HIS 37 -19.734 -8.996 -1.501 255 HD2 HIS 37 HD2 HIS 37 -17.445 -9.788 1.881 256 HE1 HIS 37 HE1 HIS 37 -21.259 -8.603 0.462 257 HE2 HIS 37 HE2 HIS 37 -19.896 -9.235 2.483 258 H THR 38 HN THR 38 -13.940 -8.053 -1.344 259 HA THR 38 HA THR 38 -14.029 -7.094 1.318 260 HB THR 38 HB THR 38 -11.671 -6.267 0.736 261 HG1 THR 38 HG1 THR 38 -11.471 -6.150 -1.388 262 HG21 THR 38 HG21 THR 38 -12.375 -9.178 0.343 263 HG22 THR 38 HG22 THR 38 -12.062 -8.378 1.883 264 HG23 THR 38 HG23 THR 38 -10.764 -8.558 0.703 265 H GLY 39 HN GLY 39 -14.511 -5.587 -1.758 266 HA2 GLY 39 HA2 GLY 39 -13.945 -2.913 -0.818 267 HA3 GLY 39 HA1 GLY 39 -14.576 -3.355 -2.395 268 H ASP 40 HN ASP 40 -16.495 -4.956 -0.336 269 HA ASP 40 HA ASP 40 -18.730 -3.271 -0.778 270 HB2 ASP 40 HB2 ASP 40 -18.896 -5.720 -0.536 271 HB3 ASP 40 HB1 ASP 40 -18.440 -5.565 1.147 272 H VAL 41 HN VAL 41 -16.434 -3.551 1.762 273 HA VAL 41 HA VAL 41 -18.181 -2.359 3.741 274 HB VAL 41 HB VAL 41 -16.218 -2.661 5.273 275 HG11 VAL 41 HG11 VAL 41 -18.024 -4.306 5.114 276 HG12 VAL 41 HG12 VAL 41 -16.477 -5.111 5.366 277 HG13 VAL 41 HG13 VAL 41 -17.209 -5.090 3.760 278 HG21 VAL 41 HG21 VAL 41 -14.400 -4.123 4.513 279 HG22 VAL 41 HG22 VAL 41 -14.429 -2.592 3.638 280 HG23 VAL 41 HG23 VAL 41 -15.042 -4.057 2.873 281 H LEU 42 HN LEU 42 -17.919 -0.457 4.755 282 HA LEU 42 HA LEU 42 -16.252 1.574 3.562 283 HB2 LEU 42 HB2 LEU 42 -18.454 2.221 4.244 284 HB3 LEU 42 HB1 LEU 42 -18.228 1.526 5.830 285 HG LEU 42 HG LEU 42 -16.538 3.283 6.311 286 HD11 LEU 42 HD11 LEU 42 -16.437 5.248 4.876 287 HD12 LEU 42 HD12 LEU 42 -17.513 4.468 3.720 288 HD13 LEU 42 HD13 LEU 42 -15.905 3.808 4.012 289 HD21 LEU 42 HD21 LEU 42 -19.271 4.282 5.531 290 HD22 LEU 42 HD22 LEU 42 -18.158 5.073 6.647 291 HD23 LEU 42 HD23 LEU 42 -18.851 3.503 7.055 292 H ASP 43 HN ASP 43 -15.926 -0.869 5.775 293 HA ASP 43 HA ASP 43 -14.352 0.205 7.820 294 HB2 ASP 43 HB2 ASP 43 -14.260 -2.568 6.609 295 HB3 ASP 43 HB1 ASP 43 -13.465 -2.105 8.107 296 H GLN 44 HN GLN 44 -13.546 -0.744 4.540 297 HA GLN 44 HA GLN 44 -10.820 -0.949 4.658 298 HB2 GLN 44 HB2 GLN 44 -12.098 0.640 2.473 299 HB3 GLN 44 HB1 GLN 44 -10.676 -0.371 2.383 300 HG2 GLN 44 HG2 GLN 44 -12.271 -2.305 2.914 301 HG3 GLN 44 HG1 GLN 44 -13.545 -1.181 2.441 302 HE21 GLN 44 HE21 GLN 44 -13.548 -0.372 0.288 303 HE22 GLN 44 HE22 GLN 44 -12.763 -1.243 -0.980 304 H VAL 45 HN VAL 45 -9.215 0.336 5.112 305 HA VAL 45 HA VAL 45 -9.793 3.157 5.665 306 HB VAL 45 HB VAL 45 -7.353 1.575 6.498 307 HG11 VAL 45 HG11 VAL 45 -7.010 3.430 8.076 308 HG12 VAL 45 HG12 VAL 45 -8.400 4.262 7.384 309 HG13 VAL 45 HG13 VAL 45 -6.968 3.968 6.398 310 HG21 VAL 45 HG21 VAL 45 -9.815 2.246 8.108 311 HG22 VAL 45 HG22 VAL 45 -8.358 1.468 8.724 312 HG23 VAL 45 HG23 VAL 45 -9.361 0.643 7.531 313 H ALA 46 HN ALA 46 -9.443 4.386 3.986 314 HA ALA 46 HA ALA 46 -7.244 3.803 2.151 315 HB1 ALA 46 HB1 ALA 46 -8.294 5.533 0.740 316 HB2 ALA 46 HB2 ALA 46 -9.520 5.774 1.988 317 HB3 ALA 46 HB3 ALA 46 -9.406 4.225 1.151 318 H ILE 47 HN ILE 47 -5.372 4.790 2.393 319 HA ILE 47 HA ILE 47 -5.360 7.478 3.589 320 HB ILE 47 HB ILE 47 -3.037 6.992 4.383 321 HG12 ILE 47 HG12 ILE 47 -3.802 4.127 3.778 322 HG13 ILE 47 HG11 ILE 47 -2.569 5.060 2.932 323 HG21 ILE 47 HG21 ILE 47 -3.767 5.689 6.357 324 HG22 ILE 47 HG22 ILE 47 -5.289 5.355 5.529 325 HG23 ILE 47 HG23 ILE 47 -4.853 7.014 5.942 326 HD11 ILE 47 HD11 ILE 47 -2.535 4.121 5.785 327 HD12 ILE 47 HD12 ILE 47 -1.391 5.293 5.134 328 HD13 ILE 47 HD13 ILE 47 -1.449 3.661 4.475 329 H GLN 48 HN GLN 48 -3.631 8.856 2.899 330 HA GLN 48 HA GLN 48 -3.330 8.825 0.048 331 HB2 GLN 48 HB2 GLN 48 -3.276 10.750 1.992 332 HB3 GLN 48 HB1 GLN 48 -1.575 10.591 1.616 333 HG2 GLN 48 HG2 GLN 48 -3.671 11.055 -0.476 334 HG3 GLN 48 HG1 GLN 48 -2.819 12.358 0.343 335 HE21 GLN 48 HE21 GLN 48 -2.642 9.867 -2.032 336 HE22 GLN 48 HE22 GLN 48 -1.064 10.253 -2.632 337 H CYS 49 HN CYS 49 -1.516 8.352 -1.148 338 HA CYS 49 HA CYS 49 0.808 7.324 0.277 339 HB2 CYS 49 HB2 CYS 49 -1.082 5.570 -0.329 340 HB3 CYS 49 HB1 CYS 49 -0.315 5.650 -1.903 341 H THR 50 HN THR 50 2.648 6.993 -1.053 342 HA THR 50 HA THR 50 2.632 7.673 -3.809 343 HB THR 50 HB THR 50 2.504 9.953 -3.052 344 HG1 THR 50 HG1 THR 50 4.873 10.530 -3.669 345 HG21 THR 50 HG21 THR 50 4.910 9.337 -1.343 346 HG22 THR 50 HG22 THR 50 3.277 9.666 -0.766 347 HG23 THR 50 HG23 THR 50 4.200 10.935 -1.572 348 H GLN 51 HN GLN 51 4.138 6.441 -4.683 349 HA GLN 51 HA GLN 51 6.434 5.713 -3.005 350 HB2 GLN 51 HB2 GLN 51 4.522 3.978 -3.624 351 HB3 GLN 51 HB1 GLN 51 5.457 3.841 -5.107 352 HG2 GLN 51 HG2 GLN 51 6.786 3.601 -2.445 353 HG3 GLN 51 HG1 GLN 51 5.942 2.227 -3.155 354 HE21 GLN 51 HE21 GLN 51 8.812 2.693 -2.571 355 HE22 GLN 51 HE22 GLN 51 9.641 2.412 -4.076 356 H ILE 52 HN ILE 52 8.199 6.564 -3.750 357 HA ILE 52 HA ILE 52 8.711 7.751 -6.189 358 HB ILE 52 HB ILE 52 10.673 6.353 -4.357 359 HG12 ILE 52 HG12 ILE 52 9.728 9.226 -4.418 360 HG13 ILE 52 HG11 ILE 52 9.292 8.025 -3.208 361 HG21 ILE 52 HG21 ILE 52 11.194 8.568 -6.334 362 HG22 ILE 52 HG22 ILE 52 11.602 6.873 -6.592 363 HG23 ILE 52 HG23 ILE 52 12.379 7.780 -5.294 364 HD11 ILE 52 HD11 ILE 52 11.643 7.885 -2.532 365 HD12 ILE 52 HD12 ILE 52 10.986 9.511 -2.358 366 HD13 ILE 52 HD13 ILE 52 12.040 9.126 -3.718 367 HA PRO 53 HA PRO 53 8.607 4.810 -9.459 368 HB2 PRO 53 HB2 PRO 53 11.395 5.779 -9.942 369 HB3 PRO 53 HB1 PRO 53 10.075 5.541 -11.092 370 HG2 PRO 53 HG2 PRO 53 10.744 7.973 -10.065 371 HG3 PRO 53 HG1 PRO 53 9.111 7.553 -10.601 372 HD2 PRO 53 HD2 PRO 53 10.065 8.079 -7.914 373 HD3 PRO 53 HD1 PRO 53 8.401 7.843 -8.477 374 H LEU 54 HN LEU 54 8.682 2.769 -8.850 375 HA LEU 54 HA LEU 54 10.419 1.733 -6.960 376 HB2 LEU 54 HB2 LEU 54 9.410 -0.479 -7.587 377 HB3 LEU 54 HB1 LEU 54 8.294 0.783 -7.116 378 HG LEU 54 HG LEU 54 8.028 1.170 -9.678 379 HD11 LEU 54 HD11 LEU 54 8.305 -0.841 -11.019 380 HD12 LEU 54 HD12 LEU 54 9.041 -1.667 -9.645 381 HD13 LEU 54 HD13 LEU 54 9.854 -0.287 -10.384 382 HD21 LEU 54 HD21 LEU 54 6.905 -1.270 -8.309 383 HD22 LEU 54 HD22 LEU 54 6.231 -0.486 -9.737 384 HD23 LEU 54 HD23 LEU 54 6.267 0.370 -8.197 385 H LEU 55 HN LEU 55 12.151 0.512 -6.926 386 HA LEU 55 HA LEU 55 13.416 -0.235 -9.479 387 HB2 LEU 55 HB2 LEU 55 14.603 0.203 -6.736 388 HB3 LEU 55 HB1 LEU 55 15.501 -0.356 -8.131 389 HG LEU 55 HG LEU 55 14.113 2.316 -7.956 390 HD11 LEU 55 HD11 LEU 55 16.339 3.262 -7.712 391 HD12 LEU 55 HD12 LEU 55 17.038 1.644 -7.696 392 HD13 LEU 55 HD13 LEU 55 15.981 2.160 -6.382 393 HD21 LEU 55 HD21 LEU 55 16.035 1.181 -9.981 394 HD22 LEU 55 HD22 LEU 55 15.411 2.829 -9.964 395 HD23 LEU 55 HD23 LEU 55 14.315 1.475 -10.227 396 H ILE 56 HN ILE 56 13.179 -2.341 -9.948 397 HA ILE 56 HA ILE 56 12.119 -4.202 -8.129 398 HB ILE 56 HB ILE 56 13.555 -4.751 -10.703 399 HG12 ILE 56 HG12 ILE 56 11.679 -3.302 -11.091 400 HG13 ILE 56 HG11 ILE 56 11.260 -4.924 -11.609 401 HG21 ILE 56 HG21 ILE 56 12.350 -6.879 -10.713 402 HG22 ILE 56 HG22 ILE 56 11.691 -6.501 -9.121 403 HG23 ILE 56 HG23 ILE 56 13.425 -6.746 -9.322 404 HD11 ILE 56 HD11 ILE 56 10.031 -5.276 -9.540 405 HD12 ILE 56 HD12 ILE 56 9.413 -3.898 -10.451 406 HD13 ILE 56 HD13 ILE 56 10.432 -3.636 -9.037 407 H GLY 57 HN GLY 57 12.993 -5.764 -6.941 408 HA2 GLY 57 HA2 GLY 57 14.717 -7.168 -6.135 409 HA3 GLY 57 HA1 GLY 57 15.894 -6.135 -6.929 410 H ILE 58 HN ILE 58 14.458 -3.733 -5.712 411 HA ILE 58 HA ILE 58 15.932 -3.869 -3.191 412 HB ILE 58 HB ILE 58 15.474 -1.797 -5.147 413 HG12 ILE 58 HG12 ILE 58 17.662 -2.576 -4.382 414 HG13 ILE 58 HG11 ILE 58 17.472 -0.848 -4.121 415 HG21 ILE 58 HG21 ILE 58 14.976 -1.009 -2.283 416 HG22 ILE 58 HG22 ILE 58 13.825 -0.906 -3.618 417 HG23 ILE 58 HG23 ILE 58 15.267 0.110 -3.618 418 HD11 ILE 58 HD11 ILE 58 17.236 -3.005 -2.033 419 HD12 ILE 58 HD12 ILE 58 16.963 -1.286 -1.755 420 HD13 ILE 58 HD13 ILE 58 18.563 -1.860 -2.225 421 H ALA 59 HN ALA 59 15.126 -3.105 -1.290 422 HA ALA 59 HA ALA 59 12.394 -3.795 -0.756 423 HB1 ALA 59 HB1 ALA 59 14.604 -2.711 0.975 424 HB2 ALA 59 HB2 ALA 59 14.103 -4.397 0.826 425 HB3 ALA 59 HB3 ALA 59 13.020 -3.215 1.578 426 H ILE 60 HN ILE 60 10.753 -2.487 -0.800 427 HA ILE 60 HA ILE 60 10.707 0.165 -1.582 428 HB ILE 60 HB ILE 60 8.750 -1.343 -1.594 429 HG12 ILE 60 HG12 ILE 60 8.303 1.184 0.018 430 HG13 ILE 60 HG11 ILE 60 8.412 1.090 -1.736 431 HG21 ILE 60 HG21 ILE 60 8.693 -2.570 0.327 432 HG22 ILE 60 HG22 ILE 60 7.526 -1.322 0.769 433 HG23 ILE 60 HG23 ILE 60 9.204 -1.220 1.348 434 HD11 ILE 60 HD11 ILE 60 6.409 -0.290 -1.791 435 HD12 ILE 60 HD12 ILE 60 6.112 1.259 -1.004 436 HD13 ILE 60 HD13 ILE 60 6.298 -0.201 -0.033 437 H GLU 61 HN GLU 61 11.059 -1.270 1.534 438 HA GLU 61 HA GLU 61 10.250 0.814 3.198 439 HB2 GLU 61 HB2 GLU 61 12.276 -1.345 3.664 440 HB3 GLU 61 HB1 GLU 61 11.456 -0.444 4.931 441 HG2 GLU 61 HG2 GLU 61 10.051 -2.185 4.942 442 HG3 GLU 61 HG1 GLU 61 9.395 -1.470 3.470 443 H ASP 62 HN ASP 62 13.273 0.207 1.570 444 HA ASP 62 HA ASP 62 14.486 2.525 2.919 445 HB2 ASP 62 HB2 ASP 62 15.808 0.463 3.050 446 HB3 ASP 62 HB1 ASP 62 15.784 0.321 1.294 447 H GLU 63 HN GLU 63 13.144 1.419 -0.004 448 HA GLU 63 HA GLU 63 14.696 2.867 -1.865 449 HB2 GLU 63 HB2 GLU 63 13.180 0.918 -2.384 450 HB3 GLU 63 HB1 GLU 63 11.822 2.014 -2.182 451 HG2 GLU 63 HG2 GLU 63 12.800 3.444 -3.944 452 HG3 GLU 63 HG1 GLU 63 14.007 2.191 -4.228 453 H CYS 64 HN CYS 64 11.706 3.580 -0.154 454 HA CYS 64 HA CYS 64 11.661 6.232 -1.410 455 HB2 CYS 64 HB2 CYS 64 9.333 6.322 -0.883 456 HB3 CYS 64 HB1 CYS 64 9.642 4.737 -1.582 457 H LYS 65 HN LYS 65 10.321 7.735 0.383 458 HA LYS 65 HA LYS 65 11.808 7.472 2.894 459 HB2 LYS 65 HB2 LYS 65 11.580 9.960 1.202 460 HB3 LYS 65 HB1 LYS 65 12.142 9.964 2.869 461 HG2 LYS 65 HG2 LYS 65 13.436 8.383 0.655 462 HG3 LYS 65 HG1 LYS 65 13.967 9.980 1.181 463 HD2 LYS 65 HD2 LYS 65 14.507 9.163 3.359 464 HD3 LYS 65 HD1 LYS 65 13.748 7.610 3.025 465 HE2 LYS 65 HE2 LYS 65 16.128 8.656 1.507 466 HE3 LYS 65 HE1 LYS 65 16.262 7.635 2.937 467 HZ1 LYS 65 HZ1 LYS 65 14.958 5.938 1.758 468 HZ2 LYS 65 HZ2 LYS 65 16.406 6.298 0.966 469 HZ3 LYS 65 HZ3 LYS 65 14.946 6.913 0.374 470 H ASN 66 HN ASN 66 9.236 6.656 2.516 471 HA ASN 66 HA ASN 66 7.893 8.385 4.455 472 HB2 ASN 66 HB2 ASN 66 6.604 7.240 1.970 473 HB3 ASN 66 HB1 ASN 66 5.680 7.814 3.349 474 HD21 ASN 66 HD21 ASN 66 7.589 8.687 0.614 475 HD22 ASN 66 HD22 ASN 66 7.291 10.387 0.676 476 H THR 67 HN THR 67 5.666 6.784 4.949 477 HA THR 67 HA THR 67 6.993 4.631 6.307 478 HB THR 67 HB THR 67 4.038 5.233 6.328 479 HG1 THR 67 HG1 THR 67 6.213 6.413 7.647 480 HG21 THR 67 HG21 THR 67 5.860 3.664 8.160 481 HG22 THR 67 HG22 THR 67 4.566 3.023 7.149 482 HG23 THR 67 HG23 THR 67 4.179 4.058 8.526 483 HA PRO 68 HA PRO 68 6.025 1.569 3.194 484 HB2 PRO 68 HB2 PRO 68 7.004 -0.377 5.025 485 HB3 PRO 68 HB1 PRO 68 7.809 0.237 3.586 486 HG2 PRO 68 HG2 PRO 68 8.475 0.695 6.296 487 HG3 PRO 68 HG1 PRO 68 9.218 1.433 4.870 488 HD2 PRO 68 HD2 PRO 68 7.401 2.567 6.808 489 HD3 PRO 68 HD1 PRO 68 8.332 3.382 5.545 490 H THR 69 HN THR 69 4.011 0.742 3.031 491 HA THR 69 HA THR 69 2.847 -0.481 5.436 492 HB THR 69 HB THR 69 0.622 0.406 4.782 493 HG1 THR 69 HG1 THR 69 2.175 1.623 2.756 494 HG21 THR 69 HG21 THR 69 1.077 2.825 5.360 495 HG22 THR 69 HG22 THR 69 2.793 2.415 5.351 496 HG23 THR 69 HG23 THR 69 1.703 1.633 6.502 497 H CYS 70 HN CYS 70 1.481 -2.229 5.091 498 HA CYS 70 HA CYS 70 1.561 -3.432 2.424 499 HB2 CYS 70 HB2 CYS 70 2.139 -4.978 4.157 500 HB3 CYS 70 HB1 CYS 70 0.764 -4.492 5.140 501 H CYS 71 HN CYS 71 -0.029 -2.877 1.096 502 HA CYS 71 HA CYS 71 -2.620 -2.099 2.221 503 HB2 CYS 71 HB2 CYS 71 -1.574 -1.757 -0.599 504 HB3 CYS 71 HB1 CYS 71 -3.058 -1.080 0.053 505 H GLU 72 HN GLU 72 -4.461 -3.144 1.758 506 HA GLU 72 HA GLU 72 -4.284 -5.794 0.705 507 HB2 GLU 72 HB2 GLU 72 -5.770 -5.745 2.434 508 HB3 GLU 72 HB1 GLU 72 -6.294 -4.103 2.100 509 HG2 GLU 72 HG2 GLU 72 -7.759 -4.807 0.438 510 HG3 GLU 72 HG1 GLU 72 -7.045 -6.417 0.358 511 H ASP 73 HN ASP 73 -5.153 -2.657 -0.404 512 HA ASP 73 HA ASP 73 -4.903 -3.498 -3.125 513 HB2 ASP 73 HB2 ASP 73 -7.323 -3.987 -2.641 514 HB3 ASP 73 HB1 ASP 73 -7.549 -2.268 -2.336 515 H VAL 74 HN VAL 74 -5.014 -1.495 -4.580 516 HA VAL 74 HA VAL 74 -4.772 1.013 -3.089 517 HB VAL 74 HB VAL 74 -2.693 0.530 -5.191 518 HG11 VAL 74 HG11 VAL 74 -3.049 2.768 -4.311 519 HG12 VAL 74 HG12 VAL 74 -1.451 2.156 -3.878 520 HG13 VAL 74 HG13 VAL 74 -2.739 2.182 -2.679 521 HG21 VAL 74 HG21 VAL 74 -1.101 -0.337 -3.625 522 HG22 VAL 74 HG22 VAL 74 -2.521 -1.382 -3.592 523 HG23 VAL 74 HG23 VAL 74 -2.259 -0.211 -2.301 524 H GLU 75 HN GLU 75 -5.564 2.733 -4.169 525 HA GLU 75 HA GLU 75 -6.617 2.253 -6.866 526 HB2 GLU 75 HB2 GLU 75 -8.168 2.964 -5.003 527 HB3 GLU 75 HB1 GLU 75 -7.315 4.498 -4.964 528 HG2 GLU 75 HG2 GLU 75 -7.980 4.939 -7.266 529 HG3 GLU 75 HG1 GLU 75 -8.819 3.389 -7.322 530 H ASP 76 HN ASP 76 -6.591 4.189 -8.339 531 HA ASP 76 HA ASP 76 -5.364 5.534 -9.685 532 HB2 ASP 76 HB2 ASP 76 -4.067 6.442 -7.094 533 HB3 ASP 76 HB1 ASP 76 -3.848 7.215 -8.655 534 H ASP 77 HN ASP 77 -2.578 6.294 -9.364 535 HA ASP 77 HA ASP 77 -1.321 3.827 -10.134 536 HB2 ASP 77 HB2 ASP 77 -0.785 6.094 -11.121 537 HB3 ASP 77 HB1 ASP 77 0.016 6.488 -9.606 538 H GLY 78 HN GLY 78 -2.297 4.712 -7.277 539 HA2 GLY 78 HA2 GLY 78 -1.538 3.260 -5.439 540 HA3 GLY 78 HA1 GLY 78 0.094 3.736 -5.854 541 H LEU 79 HN LEU 79 -2.406 6.117 -5.990 542 HA LEU 79 HA LEU 79 -1.097 7.654 -3.937 543 HB2 LEU 79 HB2 LEU 79 -3.486 8.181 -5.695 544 HB3 LEU 79 HB1 LEU 79 -2.888 9.326 -4.516 545 HG LEU 79 HG LEU 79 -2.213 9.848 -6.811 546 HD11 LEU 79 HD11 LEU 79 0.141 10.269 -6.350 547 HD12 LEU 79 HD12 LEU 79 0.086 9.118 -5.016 548 HD13 LEU 79 HD13 LEU 79 -0.857 10.606 -4.936 549 HD21 LEU 79 HD21 LEU 79 -1.997 7.625 -7.740 550 HD22 LEU 79 HD22 LEU 79 -0.607 7.313 -6.700 551 HD23 LEU 79 HD23 LEU 79 -0.507 8.544 -7.958 552 H VAL 80 HN VAL 80 -3.866 5.610 -4.154 553 HA VAL 80 HA VAL 80 -4.614 6.423 -1.427 554 HB VAL 80 HB VAL 80 -6.551 5.724 -3.644 555 HG11 VAL 80 HG11 VAL 80 -7.306 4.841 -1.506 556 HG12 VAL 80 HG12 VAL 80 -8.308 6.205 -2.002 557 HG13 VAL 80 HG13 VAL 80 -7.077 6.421 -0.758 558 HG21 VAL 80 HG21 VAL 80 -6.041 8.318 -2.195 559 HG22 VAL 80 HG22 VAL 80 -7.375 8.030 -3.310 560 HG23 VAL 80 HG23 VAL 80 -5.711 7.975 -3.893 561 H GLY 81 HN GLY 81 -4.027 4.766 -0.195 562 HA2 GLY 81 HA2 GLY 81 -4.138 2.069 -1.339 563 HA3 GLY 81 HA1 GLY 81 -3.210 2.547 0.073 564 H ILE 82 HN ILE 82 -5.202 0.386 -0.412 565 HA ILE 82 HA ILE 82 -7.282 1.138 1.511 566 HB ILE 82 HB ILE 82 -7.105 -1.038 -0.555 567 HG12 ILE 82 HG12 ILE 82 -9.389 -0.171 -1.115 568 HG13 ILE 82 HG11 ILE 82 -9.149 1.090 0.088 569 HG21 ILE 82 HG21 ILE 82 -9.209 -1.974 0.367 570 HG22 ILE 82 HG22 ILE 82 -8.984 -0.957 1.790 571 HG23 ILE 82 HG23 ILE 82 -7.803 -2.206 1.403 572 HD11 ILE 82 HD11 ILE 82 -7.241 1.923 -1.170 573 HD12 ILE 82 HD12 ILE 82 -8.714 1.911 -2.145 574 HD13 ILE 82 HD13 ILE 82 -7.488 0.661 -2.379 575 H ASN 83 HN ASN 83 -6.898 0.636 3.516 576 HA ASN 83 HA ASN 83 -6.407 -0.558 5.390 577 HB2 ASN 83 HB2 ASN 83 -6.685 -2.766 3.365 578 HB3 ASN 83 HB1 ASN 83 -6.279 -3.126 5.036 579 HD21 ASN 83 HD21 ASN 83 -8.646 -3.870 3.540 580 HD22 ASN 83 HD22 ASN 83 -9.986 -3.186 4.384 581 H CYS 84 HN CYS 84 -4.333 0.742 4.232 582 HA CYS 84 HA CYS 84 -2.062 -1.006 3.912 583 HB2 CYS 84 HB2 CYS 84 -2.184 2.006 4.059 584 HB3 CYS 84 HB1 CYS 84 -0.809 1.052 3.518 585 H THR 85 HN THR 85 -1.569 -1.997 5.800 586 HA THR 85 HA THR 85 -1.296 -0.438 8.250 587 HB THR 85 HB THR 85 -0.674 -3.373 7.829 588 HG1 THR 85 HG1 THR 85 -3.087 -2.010 7.999 589 HG21 THR 85 HG21 THR 85 0.226 -2.484 9.889 590 HG22 THR 85 HG22 THR 85 -1.183 -3.479 10.267 591 HG23 THR 85 HG23 THR 85 -1.314 -1.718 10.272 592 HA PRO 86 HA PRO 86 2.904 0.426 7.489 593 HB2 PRO 86 HB2 PRO 86 3.531 1.170 10.070 594 HB3 PRO 86 HB1 PRO 86 2.838 2.202 8.826 595 HG2 PRO 86 HG2 PRO 86 1.562 1.046 11.163 596 HG3 PRO 86 HG1 PRO 86 1.075 2.397 10.145 597 HD2 PRO 86 HD2 PRO 86 0.003 -0.163 10.155 598 HD3 PRO 86 HD1 PRO 86 -0.334 1.132 9.026 599 H ILE 87 HN ILE 87 4.604 -0.861 7.332 600 HA ILE 87 HA ILE 87 4.742 -3.153 9.144 601 HB ILE 87 HB ILE 87 6.154 -4.127 7.273 602 HG12 ILE 87 HG12 ILE 87 4.860 -1.925 5.664 603 HG13 ILE 87 HG11 ILE 87 6.541 -1.900 6.169 604 HG21 ILE 87 HG21 ILE 87 4.159 -4.740 5.945 605 HG22 ILE 87 HG22 ILE 87 3.250 -3.489 6.794 606 HG23 ILE 87 HG23 ILE 87 3.900 -4.867 7.684 607 HD11 ILE 87 HD11 ILE 87 5.264 -3.953 4.382 608 HD12 ILE 87 HD12 ILE 87 6.954 -3.933 4.884 609 HD13 ILE 87 HD13 ILE 87 6.321 -2.637 3.871 610 HA PRO 88 HA PRO 88 8.655 -1.827 10.724 611 HB2 PRO 88 HB2 PRO 88 9.486 -4.639 10.785 612 HB3 PRO 88 HB1 PRO 88 9.229 -3.527 12.124 613 HG2 PRO 88 HG2 PRO 88 7.555 -5.547 11.676 614 HG3 PRO 88 HG1 PRO 88 6.959 -3.962 12.213 615 HD2 PRO 88 HD2 PRO 88 7.032 -5.107 9.441 616 HD3 PRO 88 HD1 PRO 88 5.696 -4.296 10.278 617 H LEU 89 HN LEU 89 10.836 -1.606 10.216 618 HA LEU 89 HA LEU 89 11.482 -2.051 7.425 619 HB2 LEU 89 HB2 LEU 89 13.164 -0.794 9.592 620 HB3 LEU 89 HB1 LEU 89 13.413 -0.660 7.862 621 HG LEU 89 HG LEU 89 11.030 0.466 9.335 622 HD11 LEU 89 HD11 LEU 89 12.070 2.637 8.982 623 HD12 LEU 89 HD12 LEU 89 13.482 1.857 8.269 624 HD13 LEU 89 HD13 LEU 89 13.098 1.600 9.972 625 HD21 LEU 89 HD21 LEU 89 11.986 0.840 6.501 626 HD22 LEU 89 HD22 LEU 89 10.615 1.659 7.247 627 HD23 LEU 89 HD23 LEU 89 10.572 -0.087 7.003 628 H ILE 90 HN ILE 90 11.363 -4.337 9.339 629 HA ILE 90 HA ILE 90 14.129 -5.259 9.090 630 HB ILE 90 HB ILE 90 13.810 -6.470 11.271 631 HG12 ILE 90 HG12 ILE 90 11.473 -4.564 11.536 632 HG13 ILE 90 HG11 ILE 90 11.357 -6.314 11.399 633 HG21 ILE 90 HG21 ILE 90 14.295 -4.464 12.634 634 HG22 ILE 90 HG22 ILE 90 13.786 -3.454 11.278 635 HG23 ILE 90 HG23 ILE 90 15.197 -4.501 11.120 636 HD11 ILE 90 HD11 ILE 90 12.522 -6.557 13.526 637 HD12 ILE 90 HD12 ILE 90 11.062 -5.584 13.691 638 HD13 ILE 90 HD13 ILE 90 12.643 -4.804 13.660 Start of MODEL 15 1 H1 GLY 1 HT1 GLY 1 8.455 -9.997 -5.955 2 H2 GLY 1 HT2 GLY 1 8.146 -11.659 -5.897 3 H3 GLY 1 HT3 GLY 1 8.879 -10.887 -4.578 4 HA2 GLY 1 HA1 GLY 1 6.503 -11.378 -4.207 5 HA3 GLY 1 HA2 GLY 1 6.904 -9.670 -4.084 6 H SER 2 HN SER 2 4.325 -10.191 -4.493 7 HA SER 2 HA SER 2 3.551 -10.376 -7.212 8 HB2 SER 2 HB2 SER 2 1.379 -9.365 -6.326 9 HB3 SER 2 HB1 SER 2 1.897 -10.871 -5.568 10 HG SER 2 HG SER 2 1.299 -9.386 -3.978 11 H GLY 3 HN GLY 3 3.687 -7.593 -5.011 12 HA2 GLY 3 HA2 GLY 3 4.265 -5.890 -7.356 13 HA3 GLY 3 HA1 GLY 3 3.465 -5.316 -5.896 14 H TRP 4 HN TRP 4 5.014 -6.483 -3.962 15 HA TRP 4 HA TRP 4 7.756 -5.550 -4.444 16 HB2 TRP 4 HB2 TRP 4 5.966 -4.795 -2.131 17 HB3 TRP 4 HB1 TRP 4 7.712 -4.588 -2.103 18 HD1 TRP 4 HD1 TRP 4 4.587 -3.246 -3.919 19 HE1 TRP 4 HE1 TRP 4 5.142 -0.906 -4.835 20 HE3 TRP 4 HE3 TRP 4 9.567 -3.091 -2.789 21 HZ2 TRP 4 HZ2 TRP 4 7.394 0.770 -5.067 22 HZ3 TRP 4 HZ3 TRP 4 10.851 -1.083 -3.395 23 HH2 TRP 4 HH2 TRP 4 9.784 0.805 -4.509 24 H GLU 5 HN GLU 5 9.283 -6.385 -2.834 25 HA GLU 5 HA GLU 5 8.936 -9.145 -2.366 26 HB2 GLU 5 HB2 GLU 5 10.997 -7.120 -1.561 27 HB3 GLU 5 HB1 GLU 5 11.042 -8.742 -0.877 28 HG2 GLU 5 HG2 GLU 5 11.053 -8.137 -3.825 29 HG3 GLU 5 HG1 GLU 5 12.495 -8.448 -2.859 30 H SER 6 HN SER 6 7.564 -9.953 -0.962 31 HA SER 6 HA SER 6 7.113 -8.561 1.585 32 HB2 SER 6 HB2 SER 6 5.408 -10.719 0.323 33 HB3 SER 6 HB1 SER 6 4.976 -9.666 1.669 34 HG SER 6 HG SER 6 5.737 -8.398 -0.682 35 H LYS 7 HN LYS 7 9.380 -10.341 0.939 36 HA LYS 7 HA LYS 7 9.070 -12.929 1.925 37 HB2 LYS 7 HB2 LYS 7 11.442 -13.086 1.996 38 HB3 LYS 7 HB1 LYS 7 11.043 -12.057 0.632 39 HG2 LYS 7 HG2 LYS 7 11.735 -10.874 3.294 40 HG3 LYS 7 HG1 LYS 7 12.991 -11.393 2.174 41 HD2 LYS 7 HD2 LYS 7 12.225 -9.866 0.500 42 HD3 LYS 7 HD1 LYS 7 10.792 -9.466 1.449 43 HE2 LYS 7 HE2 LYS 7 12.531 -7.722 1.573 44 HE3 LYS 7 HE1 LYS 7 12.156 -8.423 3.145 45 HZ1 LYS 7 HZ1 LYS 7 14.528 -8.152 2.847 46 HZ2 LYS 7 HZ2 LYS 7 14.501 -9.113 1.457 47 HZ3 LYS 7 HZ3 LYS 7 14.143 -9.794 2.962 48 H THR 8 HN THR 8 9.052 -10.004 3.646 49 HA THR 8 HA THR 8 10.111 -10.938 6.122 50 HB THR 8 HB THR 8 8.991 -8.887 7.057 51 HG1 THR 8 HG1 THR 8 8.106 -7.443 5.452 52 HG21 THR 8 HG21 THR 8 11.291 -8.811 6.208 53 HG22 THR 8 HG22 THR 8 10.444 -7.298 5.891 54 HG23 THR 8 HG23 THR 8 10.682 -8.464 4.591 55 H GLY 9 HN GLY 9 7.198 -11.452 4.480 56 HA2 GLY 9 HA2 GLY 9 5.286 -12.589 5.069 57 HA3 GLY 9 HA1 GLY 9 6.031 -12.933 6.624 58 H SER 10 HN SER 10 6.119 -9.664 5.941 59 HA SER 10 HA SER 10 4.155 -9.170 8.009 60 HB2 SER 10 HB2 SER 10 6.453 -8.097 7.942 61 HB3 SER 10 HB1 SER 10 5.872 -7.135 6.584 62 HG SER 10 HG SER 10 4.468 -7.228 9.030 63 H CYS 11 HN CYS 11 4.170 -9.308 4.647 64 HA CYS 11 HA CYS 11 1.703 -7.700 4.594 65 HB2 CYS 11 HB2 CYS 11 3.557 -6.617 3.335 66 HB3 CYS 11 HB1 CYS 11 3.658 -8.046 2.311 67 H ASN 12 HN ASN 12 -0.027 -8.556 3.615 68 HA ASN 12 HA ASN 12 0.091 -11.420 3.084 69 HB2 ASN 12 HB2 ASN 12 -2.536 -10.915 3.021 70 HB3 ASN 12 HB1 ASN 12 -1.652 -11.165 4.522 71 HD21 ASN 12 HD21 ASN 12 -2.958 -8.722 2.365 72 HD22 ASN 12 HD22 ASN 12 -3.098 -7.480 3.557 73 H THR 13 HN THR 13 -0.586 -8.420 1.416 74 HA THR 13 HA THR 13 -1.658 -9.904 -0.876 75 HB THR 13 HB THR 13 -2.100 -7.410 -1.625 76 HG1 THR 13 HG1 THR 13 -2.127 -5.982 0.024 77 HG21 THR 13 HG21 THR 13 -3.834 -9.090 -1.182 78 HG22 THR 13 HG22 THR 13 -4.288 -7.516 -0.529 79 HG23 THR 13 HG23 THR 13 -3.693 -8.779 0.548 80 H GLY 14 HN GLY 14 1.107 -8.138 0.143 81 HA2 GLY 14 HA2 GLY 14 3.174 -8.183 -0.957 82 HA3 GLY 14 HA1 GLY 14 2.353 -8.659 -2.435 83 H LYS 15 HN LYS 15 0.682 -6.116 -1.111 84 HA LYS 15 HA LYS 15 1.942 -4.249 -2.961 85 HB2 LYS 15 HB2 LYS 15 -0.660 -4.177 -1.459 86 HB3 LYS 15 HB1 LYS 15 -0.025 -2.769 -2.295 87 HG2 LYS 15 HG2 LYS 15 -0.001 -4.105 -4.389 88 HG3 LYS 15 HG1 LYS 15 -0.815 -5.397 -3.505 89 HD2 LYS 15 HD2 LYS 15 -2.647 -3.840 -2.957 90 HD3 LYS 15 HD1 LYS 15 -1.826 -2.584 -3.877 91 HE2 LYS 15 HE2 LYS 15 -2.889 -5.167 -4.964 92 HE3 LYS 15 HE1 LYS 15 -3.623 -3.585 -5.166 93 HZ1 LYS 15 HZ1 LYS 15 -1.608 -2.886 -6.354 94 HZ2 LYS 15 HZ2 LYS 15 -2.404 -4.162 -7.130 95 HZ3 LYS 15 HZ3 LYS 15 -0.994 -4.458 -6.238 96 H LEU 16 HN LEU 16 3.832 -3.789 -1.776 97 HA LEU 16 HA LEU 16 3.510 -2.463 0.787 98 HB2 LEU 16 HB2 LEU 16 5.917 -3.314 -0.814 99 HB3 LEU 16 HB1 LEU 16 6.051 -2.310 0.607 100 HG LEU 16 HG LEU 16 5.016 -4.109 1.952 101 HD11 LEU 16 HD11 LEU 16 5.249 -5.725 -0.569 102 HD12 LEU 16 HD12 LEU 16 3.750 -5.198 0.196 103 HD13 LEU 16 HD13 LEU 16 4.810 -6.340 1.025 104 HD21 LEU 16 HD21 LEU 16 7.477 -4.884 0.397 105 HD22 LEU 16 HD22 LEU 16 6.957 -5.617 1.914 106 HD23 LEU 16 HD23 LEU 16 7.427 -3.918 1.872 107 H ALA 17 HN ALA 17 2.913 -0.384 0.667 108 HA ALA 17 HA ALA 17 4.219 1.278 -1.387 109 HB1 ALA 17 HB1 ALA 17 1.916 0.981 -2.028 110 HB2 ALA 17 HB2 ALA 17 2.147 2.645 -1.470 111 HB3 ALA 17 HB3 ALA 17 1.369 1.456 -0.420 112 H CYS 18 HN CYS 18 4.938 3.272 -0.794 113 HA CYS 18 HA CYS 18 5.220 3.798 2.029 114 HB2 CYS 18 HB2 CYS 18 6.007 5.464 -0.374 115 HB3 CYS 18 HB1 CYS 18 6.493 5.775 1.287 116 H CYS 19 HN CYS 19 3.368 4.417 3.015 117 HA CYS 19 HA CYS 19 1.623 6.287 1.557 118 HB2 CYS 19 HB2 CYS 19 0.887 4.141 3.547 119 HB3 CYS 19 HB1 CYS 19 -0.245 5.296 2.861 120 H ASP 20 HN ASP 20 0.419 7.804 2.776 121 HA ASP 20 HA ASP 20 1.758 8.729 5.193 122 HB2 ASP 20 HB2 ASP 20 -0.313 9.944 3.358 123 HB3 ASP 20 HB1 ASP 20 0.109 10.671 4.901 124 H THR 21 HN THR 21 1.101 7.387 6.806 125 HA THR 21 HA THR 21 -1.434 6.165 6.933 126 HB THR 21 HB THR 21 -0.737 5.556 9.274 127 HG1 THR 21 HG1 THR 21 0.687 7.565 9.337 128 HG21 THR 21 HG21 THR 21 1.232 5.045 7.040 129 HG22 THR 21 HG22 THR 21 -0.212 4.097 7.400 130 HG23 THR 21 HG23 THR 21 1.136 4.122 8.539 131 H ASN 22 HN ASN 22 -0.575 9.339 7.692 132 HA ASN 22 HA ASN 22 -2.544 9.514 9.874 133 HB2 ASN 22 HB2 ASN 22 -0.241 11.358 9.186 134 HB3 ASN 22 HB1 ASN 22 -1.350 11.566 10.534 135 HD21 ASN 22 HD21 ASN 22 -1.153 10.263 12.334 136 HD22 ASN 22 HD22 ASN 22 0.228 9.260 12.610 137 H LYS 23 HN LYS 23 -2.235 9.833 6.734 138 HA LYS 23 HA LYS 23 -4.061 12.114 6.533 139 HB2 LYS 23 HB2 LYS 23 -2.049 12.921 5.652 140 HB3 LYS 23 HB1 LYS 23 -1.657 11.384 4.897 141 HG2 LYS 23 HG2 LYS 23 -2.252 12.913 3.192 142 HG3 LYS 23 HG1 LYS 23 -3.532 11.718 3.383 143 HD2 LYS 23 HD2 LYS 23 -4.859 13.309 4.666 144 HD3 LYS 23 HD1 LYS 23 -3.576 14.499 4.519 145 HE2 LYS 23 HE2 LYS 23 -3.825 14.496 2.103 146 HE3 LYS 23 HE1 LYS 23 -5.103 13.308 2.261 147 HZ1 LYS 23 HZ1 LYS 23 -6.019 15.503 1.974 148 HZ2 LYS 23 HZ2 LYS 23 -5.176 16.067 3.327 149 HZ3 LYS 23 HZ3 LYS 23 -6.402 14.919 3.516 150 H LYS 24 HN LYS 24 -5.924 11.168 6.304 151 HA LYS 24 HA LYS 24 -6.174 8.617 4.948 152 HB2 LYS 24 HB2 LYS 24 -8.036 10.256 6.650 153 HB3 LYS 24 HB1 LYS 24 -8.552 8.787 5.838 154 HG2 LYS 24 HG2 LYS 24 -8.069 8.219 8.087 155 HG3 LYS 24 HG1 LYS 24 -6.755 7.573 7.106 156 HD2 LYS 24 HD2 LYS 24 -5.280 9.303 7.789 157 HD3 LYS 24 HD1 LYS 24 -6.593 10.234 8.507 158 HE2 LYS 24 HE2 LYS 24 -5.247 9.140 10.220 159 HE3 LYS 24 HE1 LYS 24 -6.893 8.517 10.211 160 HZ1 LYS 24 HZ1 LYS 24 -6.111 6.580 8.989 161 HZ2 LYS 24 HZ2 LYS 24 -5.277 6.747 10.449 162 HZ3 LYS 24 HZ3 LYS 24 -4.528 7.184 8.999 163 H VAL 25 HN VAL 25 -8.101 8.270 3.558 164 HA VAL 25 HA VAL 25 -8.541 10.590 1.773 165 HB VAL 25 HB VAL 25 -8.758 7.725 0.892 166 HG11 VAL 25 HG11 VAL 25 -8.329 8.672 -1.320 167 HG12 VAL 25 HG12 VAL 25 -8.214 10.278 -0.603 168 HG13 VAL 25 HG13 VAL 25 -9.741 9.398 -0.554 169 HG21 VAL 25 HG21 VAL 25 -6.254 9.402 0.767 170 HG22 VAL 25 HG22 VAL 25 -6.475 7.800 0.060 171 HG23 VAL 25 HG23 VAL 25 -6.506 8.001 1.811 172 H GLN 26 HN GLN 26 -10.608 10.864 0.913 173 HA GLN 26 HA GLN 26 -12.803 9.728 2.389 174 HB2 GLN 26 HB2 GLN 26 -12.670 11.658 0.071 175 HB3 GLN 26 HB1 GLN 26 -14.169 11.138 0.809 176 HG2 GLN 26 HG2 GLN 26 -13.444 12.087 2.946 177 HG3 GLN 26 HG1 GLN 26 -11.945 12.614 2.189 178 HE21 GLN 26 HE21 GLN 26 -13.309 13.329 -0.312 179 HE22 GLN 26 HE22 GLN 26 -14.139 14.810 0.016 180 H LYS 27 HN LYS 27 -11.495 9.603 -0.883 181 HA LYS 27 HA LYS 27 -13.279 7.616 -1.866 182 HB2 LYS 27 HB2 LYS 27 -10.454 8.317 -2.702 183 HB3 LYS 27 HB1 LYS 27 -11.551 7.301 -3.620 184 HG2 LYS 27 HG2 LYS 27 -12.209 10.131 -2.911 185 HG3 LYS 27 HG1 LYS 27 -11.316 9.715 -4.367 186 HD2 LYS 27 HD2 LYS 27 -14.076 8.734 -3.638 187 HD3 LYS 27 HD1 LYS 27 -13.715 10.017 -4.796 188 HE2 LYS 27 HE2 LYS 27 -12.795 7.170 -4.994 189 HE3 LYS 27 HE1 LYS 27 -14.145 7.856 -5.891 190 HZ1 LYS 27 HZ1 LYS 27 -11.289 8.654 -6.103 191 HZ2 LYS 27 HZ2 LYS 27 -12.562 9.409 -6.920 192 HZ3 LYS 27 HZ3 LYS 27 -12.178 7.799 -7.258 193 H SER 28 HN SER 28 -13.351 5.510 -1.274 194 HA SER 28 HA SER 28 -10.902 4.171 -0.451 195 HB2 SER 28 HB2 SER 28 -13.288 4.333 1.405 196 HB3 SER 28 HB1 SER 28 -11.780 3.470 1.709 197 HG SER 28 HG SER 28 -11.200 5.996 1.074 198 H THR 29 HN THR 29 -11.492 3.069 -2.498 199 HA THR 29 HA THR 29 -13.207 0.803 -1.813 200 HB THR 29 HB THR 29 -13.231 2.071 -4.547 201 HG1 THR 29 HG1 THR 29 -14.672 2.599 -2.241 202 HG21 THR 29 HG21 THR 29 -14.914 -0.092 -3.281 203 HG22 THR 29 HG22 THR 29 -13.718 -0.312 -4.558 204 HG23 THR 29 HG23 THR 29 -15.189 0.608 -4.876 205 H GLY 30 HN GLY 30 -11.053 1.919 -4.397 206 HA2 GLY 30 HA2 GLY 30 -8.886 0.812 -4.692 207 HA3 GLY 30 HA1 GLY 30 -9.668 -0.691 -4.217 208 H GLU 31 HN GLU 31 -8.194 -0.506 -6.564 209 HA GLU 31 HA GLU 31 -10.242 -0.378 -8.655 210 HB2 GLU 31 HB2 GLU 31 -7.240 -0.366 -8.802 211 HB3 GLU 31 HB1 GLU 31 -8.252 -0.599 -10.219 212 HG2 GLU 31 HG2 GLU 31 -9.396 1.598 -9.431 213 HG3 GLU 31 HG1 GLU 31 -7.900 1.827 -8.525 214 H GLU 32 HN GLU 32 -7.862 -2.608 -7.263 215 HA GLU 32 HA GLU 32 -8.527 -4.628 -9.212 216 HB2 GLU 32 HB2 GLU 32 -6.652 -4.591 -6.866 217 HB3 GLU 32 HB1 GLU 32 -6.955 -6.047 -7.802 218 HG2 GLU 32 HG2 GLU 32 -6.189 -4.873 -9.826 219 HG3 GLU 32 HG1 GLU 32 -5.814 -3.463 -8.835 220 H SER 33 HN SER 33 -8.752 -4.399 -5.675 221 HA SER 33 HA SER 33 -10.603 -6.651 -5.659 222 HB2 SER 33 HB2 SER 33 -9.530 -5.018 -3.342 223 HB3 SER 33 HB1 SER 33 -10.409 -6.543 -3.229 224 HG SER 33 HG SER 33 -8.685 -7.572 -4.255 225 H GLY 34 HN GLY 34 -10.540 -3.202 -5.329 226 HA2 GLY 34 HA2 GLY 34 -13.158 -2.956 -4.179 227 HA3 GLY 34 HA1 GLY 34 -12.158 -1.654 -4.795 228 H LEU 35 HN LEU 35 -13.352 -4.508 -6.545 229 HA LEU 35 HA LEU 35 -14.278 -3.038 -8.754 230 HB2 LEU 35 HB2 LEU 35 -15.172 -5.754 -7.779 231 HB3 LEU 35 HB1 LEU 35 -15.501 -5.093 -9.368 232 HG LEU 35 HG LEU 35 -12.765 -5.753 -8.276 233 HD11 LEU 35 HD11 LEU 35 -14.422 -7.111 -10.393 234 HD12 LEU 35 HD12 LEU 35 -14.095 -7.734 -8.777 235 HD13 LEU 35 HD13 LEU 35 -12.776 -7.539 -9.930 236 HD21 LEU 35 HD21 LEU 35 -12.012 -5.313 -10.577 237 HD22 LEU 35 HD22 LEU 35 -12.655 -3.872 -9.791 238 HD23 LEU 35 HD23 LEU 35 -13.629 -4.738 -10.981 239 H LEU 36 HN LEU 36 -16.109 -4.531 -6.095 240 HA LEU 36 HA LEU 36 -18.382 -2.813 -6.634 241 HB2 LEU 36 HB2 LEU 36 -17.870 -5.045 -4.683 242 HB3 LEU 36 HB1 LEU 36 -19.338 -4.102 -4.690 243 HG LEU 36 HG LEU 36 -18.360 -5.825 -6.962 244 HD11 LEU 36 HD11 LEU 36 -20.252 -7.255 -6.390 245 HD12 LEU 36 HD12 LEU 36 -20.622 -6.218 -5.014 246 HD13 LEU 36 HD13 LEU 36 -19.113 -7.129 -5.050 247 HD21 LEU 36 HD21 LEU 36 -20.572 -5.389 -7.937 248 HD22 LEU 36 HD22 LEU 36 -19.617 -3.917 -7.781 249 HD23 LEU 36 HD23 LEU 36 -20.913 -4.251 -6.633 250 H HIS 37 HN HIS 37 -19.170 -1.315 -5.088 251 HA HIS 37 HA HIS 37 -17.010 -0.274 -3.398 252 HB2 HIS 37 HB2 HIS 37 -19.459 1.082 -4.534 253 HB3 HIS 37 HB1 HIS 37 -18.349 1.853 -3.409 254 HD1 HIS 37 HD1 HIS 37 -16.817 3.374 -4.604 255 HD2 HIS 37 HD2 HIS 37 -17.737 0.022 -6.882 256 HE1 HIS 37 HE1 HIS 37 -15.563 3.659 -6.761 257 HE2 HIS 37 HE2 HIS 37 -16.009 1.544 -8.053 258 H THR 38 HN THR 38 -20.571 -0.122 -3.211 259 HA THR 38 HA THR 38 -20.446 0.098 -0.360 260 HB THR 38 HB THR 38 -22.884 -0.372 -2.093 261 HG1 THR 38 HG1 THR 38 -22.450 1.574 -2.807 262 HG21 THR 38 HG21 THR 38 -24.089 0.735 -0.265 263 HG22 THR 38 HG22 THR 38 -22.588 0.868 0.650 264 HG23 THR 38 HG23 THR 38 -23.272 -0.720 0.306 265 H GLY 39 HN GLY 39 -20.622 -2.511 -2.574 266 HA2 GLY 39 HA2 GLY 39 -21.737 -4.306 -0.543 267 HA3 GLY 39 HA1 GLY 39 -21.530 -4.687 -2.244 268 H ASP 40 HN ASP 40 -18.735 -3.223 -1.291 269 HA ASP 40 HA ASP 40 -17.563 -5.815 -0.522 270 HB2 ASP 40 HB2 ASP 40 -17.023 -4.868 -2.873 271 HB3 ASP 40 HB1 ASP 40 -15.989 -3.739 -2.005 272 H VAL 41 HN VAL 41 -17.275 -2.295 -0.263 273 HA VAL 41 HA VAL 41 -15.292 -2.615 1.833 274 HB VAL 41 HB VAL 41 -14.842 -0.341 1.736 275 HG11 VAL 41 HG11 VAL 41 -15.734 -1.135 -1.028 276 HG12 VAL 41 HG12 VAL 41 -14.151 -1.408 -0.300 277 HG13 VAL 41 HG13 VAL 41 -14.687 0.233 -0.657 278 HG21 VAL 41 HG21 VAL 41 -17.094 0.515 2.069 279 HG22 VAL 41 HG22 VAL 41 -17.501 0.140 0.394 280 HG23 VAL 41 HG23 VAL 41 -16.285 1.369 0.754 281 H LEU 42 HN LEU 42 -15.765 -2.775 3.871 282 HA LEU 42 HA LEU 42 -18.280 -1.674 4.865 283 HB2 LEU 42 HB2 LEU 42 -16.729 -4.089 5.744 284 HB3 LEU 42 HB1 LEU 42 -18.115 -3.452 6.576 285 HG LEU 42 HG LEU 42 -18.099 -4.606 3.797 286 HD11 LEU 42 HD11 LEU 42 -19.291 -5.638 6.365 287 HD12 LEU 42 HD12 LEU 42 -17.864 -6.281 5.553 288 HD13 LEU 42 HD13 LEU 42 -19.442 -6.387 4.776 289 HD21 LEU 42 HD21 LEU 42 -19.723 -2.815 3.950 290 HD22 LEU 42 HD22 LEU 42 -20.376 -3.501 5.436 291 HD23 LEU 42 HD23 LEU 42 -20.545 -4.374 3.913 292 H ASP 43 HN ASP 43 -14.854 -2.166 5.394 293 HA ASP 43 HA ASP 43 -14.892 -0.149 7.511 294 HB2 ASP 43 HB2 ASP 43 -13.634 -1.505 9.041 295 HB3 ASP 43 HB1 ASP 43 -15.044 -2.435 8.544 296 H GLN 44 HN GLN 44 -13.592 -1.047 4.640 297 HA GLN 44 HA GLN 44 -10.864 -1.071 4.963 298 HB2 GLN 44 HB2 GLN 44 -12.238 0.239 2.644 299 HB3 GLN 44 HB1 GLN 44 -10.649 -0.489 2.661 300 HG2 GLN 44 HG2 GLN 44 -11.773 -2.683 3.156 301 HG3 GLN 44 HG1 GLN 44 -13.301 -1.882 2.803 302 HE21 GLN 44 HE21 GLN 44 -12.082 -0.212 0.709 303 HE22 GLN 44 HE22 GLN 44 -11.852 -1.255 -0.649 304 H VAL 45 HN VAL 45 -9.339 0.378 5.269 305 HA VAL 45 HA VAL 45 -10.137 3.189 5.585 306 HB VAL 45 HB VAL 45 -7.880 1.713 6.964 307 HG11 VAL 45 HG11 VAL 45 -7.271 4.025 6.530 308 HG12 VAL 45 HG12 VAL 45 -7.582 3.790 8.250 309 HG13 VAL 45 HG13 VAL 45 -8.789 4.579 7.236 310 HG21 VAL 45 HG21 VAL 45 -10.456 2.827 8.070 311 HG22 VAL 45 HG22 VAL 45 -9.169 2.070 9.008 312 HG23 VAL 45 HG23 VAL 45 -10.085 1.120 7.837 313 H ALA 46 HN ALA 46 -9.334 4.528 4.173 314 HA ALA 46 HA ALA 46 -7.058 3.650 2.537 315 HB1 ALA 46 HB1 ALA 46 -9.178 5.679 1.857 316 HB2 ALA 46 HB2 ALA 46 -9.184 3.992 1.344 317 HB3 ALA 46 HB3 ALA 46 -7.910 5.077 0.789 318 H ILE 47 HN ILE 47 -5.255 4.775 2.507 319 HA ILE 47 HA ILE 47 -5.258 7.512 3.582 320 HB ILE 47 HB ILE 47 -2.866 7.061 4.283 321 HG12 ILE 47 HG12 ILE 47 -3.763 4.186 3.977 322 HG13 ILE 47 HG11 ILE 47 -2.536 4.989 3.003 323 HG21 ILE 47 HG21 ILE 47 -3.523 6.023 6.411 324 HG22 ILE 47 HG22 ILE 47 -5.080 5.592 5.699 325 HG23 ILE 47 HG23 ILE 47 -4.641 7.289 5.899 326 HD11 ILE 47 HD11 ILE 47 -1.483 3.608 4.661 327 HD12 ILE 47 HD12 ILE 47 -2.391 4.399 5.949 328 HD13 ILE 47 HD13 ILE 47 -1.181 5.302 5.037 329 H GLN 48 HN GLN 48 -3.694 8.930 2.662 330 HA GLN 48 HA GLN 48 -3.389 8.595 -0.154 331 HB2 GLN 48 HB2 GLN 48 -2.808 10.692 1.804 332 HB3 GLN 48 HB1 GLN 48 -1.607 10.590 0.531 333 HG2 GLN 48 HG2 GLN 48 -3.190 12.161 -0.194 334 HG3 GLN 48 HG1 GLN 48 -3.500 10.700 -1.117 335 HE21 GLN 48 HE21 GLN 48 -4.432 10.899 2.181 336 HE22 GLN 48 HE22 GLN 48 -6.131 11.055 1.926 337 H CYS 49 HN CYS 49 -1.610 8.085 -1.330 338 HA CYS 49 HA CYS 49 0.768 7.230 0.143 339 HB2 CYS 49 HB2 CYS 49 -1.043 5.373 -0.405 340 HB3 CYS 49 HB1 CYS 49 -0.267 5.419 -1.979 341 H THR 50 HN THR 50 2.631 6.884 -1.208 342 HA THR 50 HA THR 50 2.589 7.712 -3.940 343 HB THR 50 HB THR 50 2.398 9.928 -2.905 344 HG1 THR 50 HG1 THR 50 3.576 10.105 -4.718 345 HG21 THR 50 HG21 THR 50 4.186 10.811 -1.496 346 HG22 THR 50 HG22 THR 50 4.992 9.243 -1.530 347 HG23 THR 50 HG23 THR 50 3.422 9.410 -0.748 348 H GLN 51 HN GLN 51 4.452 7.100 -4.990 349 HA GLN 51 HA GLN 51 6.401 5.754 -3.265 350 HB2 GLN 51 HB2 GLN 51 4.905 4.339 -4.766 351 HB3 GLN 51 HB1 GLN 51 5.793 5.023 -6.123 352 HG2 GLN 51 HG2 GLN 51 6.679 2.840 -5.469 353 HG3 GLN 51 HG1 GLN 51 7.864 4.125 -5.252 354 HE21 GLN 51 HE21 GLN 51 9.062 2.974 -3.792 355 HE22 GLN 51 HE22 GLN 51 8.495 2.747 -2.176 356 H ILE 52 HN ILE 52 8.555 5.737 -3.952 357 HA ILE 52 HA ILE 52 9.419 8.140 -5.323 358 HB ILE 52 HB ILE 52 10.883 5.922 -3.873 359 HG12 ILE 52 HG12 ILE 52 9.560 7.311 -2.418 360 HG13 ILE 52 HG11 ILE 52 11.269 7.635 -2.168 361 HG21 ILE 52 HG21 ILE 52 12.268 6.961 -5.672 362 HG22 ILE 52 HG22 ILE 52 12.910 7.141 -4.041 363 HG23 ILE 52 HG23 ILE 52 12.101 8.499 -4.821 364 HD11 ILE 52 HD11 ILE 52 11.073 9.639 -3.547 365 HD12 ILE 52 HD12 ILE 52 10.005 9.677 -2.145 366 HD13 ILE 52 HD13 ILE 52 9.353 9.316 -3.740 367 HA PRO 53 HA PRO 53 10.365 6.486 -9.440 368 HB2 PRO 53 HB2 PRO 53 13.172 7.110 -8.674 369 HB3 PRO 53 HB1 PRO 53 12.282 7.550 -10.132 370 HG2 PRO 53 HG2 PRO 53 12.748 9.212 -7.944 371 HG3 PRO 53 HG1 PRO 53 11.550 9.484 -9.216 372 HD2 PRO 53 HD2 PRO 53 11.066 8.930 -6.465 373 HD3 PRO 53 HD1 PRO 53 9.869 9.078 -7.762 374 H LEU 54 HN LEU 54 10.289 4.355 -9.638 375 HA LEU 54 HA LEU 54 11.001 2.609 -7.593 376 HB2 LEU 54 HB2 LEU 54 10.353 2.019 -10.474 377 HB3 LEU 54 HB1 LEU 54 10.424 0.818 -9.202 378 HG LEU 54 HG LEU 54 8.493 3.136 -9.272 379 HD11 LEU 54 HD11 LEU 54 8.055 0.213 -9.868 380 HD12 LEU 54 HD12 LEU 54 8.022 1.531 -11.040 381 HD13 LEU 54 HD13 LEU 54 6.799 1.449 -9.772 382 HD21 LEU 54 HD21 LEU 54 8.686 0.753 -7.436 383 HD22 LEU 54 HD22 LEU 54 7.375 1.931 -7.448 384 HD23 LEU 54 HD23 LEU 54 9.007 2.433 -7.008 385 H LEU 55 HN LEU 55 12.712 1.480 -7.101 386 HA LEU 55 HA LEU 55 14.921 1.295 -9.034 387 HB2 LEU 55 HB2 LEU 55 14.873 0.962 -6.034 388 HB3 LEU 55 HB1 LEU 55 16.283 0.687 -7.034 389 HG LEU 55 HG LEU 55 14.865 3.333 -6.719 390 HD11 LEU 55 HD11 LEU 55 16.847 4.003 -5.465 391 HD12 LEU 55 HD12 LEU 55 17.491 2.366 -5.601 392 HD13 LEU 55 HD13 LEU 55 16.015 2.661 -4.682 393 HD21 LEU 55 HD21 LEU 55 16.831 4.236 -7.893 394 HD22 LEU 55 HD22 LEU 55 15.897 3.132 -8.900 395 HD23 LEU 55 HD23 LEU 55 17.405 2.591 -8.164 396 H ILE 56 HN ILE 56 15.339 -0.624 -9.920 397 HA ILE 56 HA ILE 56 13.505 -2.747 -9.614 398 HB ILE 56 HB ILE 56 16.217 -3.042 -10.869 399 HG12 ILE 56 HG12 ILE 56 13.736 -1.917 -12.188 400 HG13 ILE 56 HG11 ILE 56 15.111 -0.946 -11.678 401 HG21 ILE 56 HG21 ILE 56 15.060 -4.616 -12.331 402 HG22 ILE 56 HG22 ILE 56 13.546 -4.289 -11.489 403 HG23 ILE 56 HG23 ILE 56 14.880 -5.066 -10.635 404 HD11 ILE 56 HD11 ILE 56 16.542 -2.131 -13.246 405 HD12 ILE 56 HD12 ILE 56 15.163 -1.400 -14.066 406 HD13 ILE 56 HD13 ILE 56 15.179 -3.133 -13.741 407 H GLY 57 HN GLY 57 13.502 -4.466 -8.360 408 HA2 GLY 57 HA2 GLY 57 14.158 -6.093 -6.882 409 HA3 GLY 57 HA1 GLY 57 15.816 -5.750 -7.341 410 H ILE 58 HN ILE 58 14.085 -3.031 -6.207 411 HA ILE 58 HA ILE 58 15.599 -3.188 -3.716 412 HB ILE 58 HB ILE 58 14.974 -1.036 -5.526 413 HG12 ILE 58 HG12 ILE 58 17.214 -1.714 -4.755 414 HG13 ILE 58 HG11 ILE 58 16.892 -0.012 -4.451 415 HG21 ILE 58 HG21 ILE 58 14.330 -0.556 -2.625 416 HG22 ILE 58 HG22 ILE 58 13.254 -0.352 -4.011 417 HG23 ILE 58 HG23 ILE 58 14.635 0.724 -3.805 418 HD11 ILE 58 HD11 ILE 58 18.039 -1.052 -2.575 419 HD12 ILE 58 HD12 ILE 58 16.730 -2.224 -2.411 420 HD13 ILE 58 HD13 ILE 58 16.424 -0.515 -2.111 421 H ALA 59 HN ALA 59 14.711 -2.564 -1.773 422 HA ALA 59 HA ALA 59 12.004 -3.534 -1.378 423 HB1 ALA 59 HB1 ALA 59 12.676 -3.461 1.005 424 HB2 ALA 59 HB2 ALA 59 14.231 -2.786 0.502 425 HB3 ALA 59 HB3 ALA 59 13.771 -4.413 -0.001 426 H ILE 60 HN ILE 60 10.422 -2.416 -0.363 427 HA ILE 60 HA ILE 60 9.903 0.201 -1.091 428 HB ILE 60 HB ILE 60 8.220 -1.496 -0.463 429 HG12 ILE 60 HG12 ILE 60 6.749 0.043 0.925 430 HG13 ILE 60 HG11 ILE 60 8.120 1.149 0.980 431 HG21 ILE 60 HG21 ILE 60 9.158 -0.967 2.351 432 HG22 ILE 60 HG22 ILE 60 9.247 -2.490 1.461 433 HG23 ILE 60 HG23 ILE 60 7.679 -1.833 1.933 434 HD11 ILE 60 HD11 ILE 60 6.596 1.789 -0.765 435 HD12 ILE 60 HD12 ILE 60 6.708 0.182 -1.487 436 HD13 ILE 60 HD13 ILE 60 8.119 1.238 -1.464 437 H GLU 61 HN GLU 61 11.446 -0.965 1.854 438 HA GLU 61 HA GLU 61 11.018 1.577 3.175 439 HB2 GLU 61 HB2 GLU 61 12.248 0.424 5.088 440 HB3 GLU 61 HB1 GLU 61 10.670 -0.197 4.650 441 HG2 GLU 61 HG2 GLU 61 12.158 -2.015 5.127 442 HG3 GLU 61 HG1 GLU 61 11.756 -2.026 3.414 443 H ASP 62 HN ASP 62 13.252 0.390 1.065 444 HA ASP 62 HA ASP 62 15.373 2.111 2.165 445 HB2 ASP 62 HB2 ASP 62 15.871 -0.346 1.676 446 HB3 ASP 62 HB1 ASP 62 15.715 0.066 -0.029 447 H GLU 63 HN GLU 63 13.219 1.565 -0.482 448 HA GLU 63 HA GLU 63 14.506 3.231 -2.389 449 HB2 GLU 63 HB2 GLU 63 12.779 1.421 -2.849 450 HB3 GLU 63 HB1 GLU 63 11.568 2.557 -2.280 451 HG2 GLU 63 HG2 GLU 63 12.239 4.125 -4.029 452 HG3 GLU 63 HG1 GLU 63 13.408 2.953 -4.621 453 H CYS 64 HN CYS 64 12.021 3.746 0.059 454 HA CYS 64 HA CYS 64 12.001 6.599 -0.672 455 HB2 CYS 64 HB2 CYS 64 9.700 6.710 -0.389 456 HB3 CYS 64 HB1 CYS 64 9.892 5.107 -1.089 457 H LYS 65 HN LYS 65 11.224 7.991 1.217 458 HA LYS 65 HA LYS 65 12.425 7.005 3.718 459 HB2 LYS 65 HB2 LYS 65 12.216 9.847 2.698 460 HB3 LYS 65 HB1 LYS 65 12.904 9.369 4.244 461 HG2 LYS 65 HG2 LYS 65 13.965 8.500 1.565 462 HG3 LYS 65 HG1 LYS 65 14.597 9.848 2.511 463 HD2 LYS 65 HD2 LYS 65 15.225 8.368 4.300 464 HD3 LYS 65 HD1 LYS 65 14.445 7.004 3.498 465 HE2 LYS 65 HE2 LYS 65 16.857 6.927 3.185 466 HE3 LYS 65 HE1 LYS 65 16.033 7.182 1.650 467 HZ1 LYS 65 HZ1 LYS 65 16.525 9.567 1.870 468 HZ2 LYS 65 HZ2 LYS 65 17.926 8.624 1.797 469 HZ3 LYS 65 HZ3 LYS 65 17.406 9.248 3.278 470 H ASN 66 HN ASN 66 9.661 6.729 2.762 471 HA ASN 66 HA ASN 66 8.220 8.324 4.772 472 HB2 ASN 66 HB2 ASN 66 7.435 7.151 2.140 473 HB3 ASN 66 HB1 ASN 66 6.199 7.297 3.381 474 HD21 ASN 66 HD21 ASN 66 8.303 9.001 1.208 475 HD22 ASN 66 HD22 ASN 66 7.571 10.554 1.406 476 H THR 67 HN THR 67 5.934 6.617 4.881 477 HA THR 67 HA THR 67 7.068 4.486 6.518 478 HB THR 67 HB THR 67 4.163 5.302 6.372 479 HG1 THR 67 HG1 THR 67 6.344 6.456 7.696 480 HG21 THR 67 HG21 THR 67 5.807 3.749 8.376 481 HG22 THR 67 HG22 THR 67 4.516 3.123 7.352 482 HG23 THR 67 HG23 THR 67 4.139 4.262 8.647 483 HA PRO 68 HA PRO 68 5.892 1.628 3.321 484 HB2 PRO 68 HB2 PRO 68 6.962 -0.561 4.471 485 HB3 PRO 68 HB1 PRO 68 7.961 0.683 3.721 486 HG2 PRO 68 HG2 PRO 68 7.469 0.131 6.594 487 HG3 PRO 68 HG1 PRO 68 8.910 0.790 5.805 488 HD2 PRO 68 HD2 PRO 68 6.937 2.248 7.169 489 HD3 PRO 68 HD1 PRO 68 8.196 2.914 6.124 490 H THR 69 HN THR 69 3.966 0.658 3.064 491 HA THR 69 HA THR 69 2.720 -0.574 5.425 492 HB THR 69 HB THR 69 0.542 0.331 4.766 493 HG1 THR 69 HG1 THR 69 2.053 1.628 2.718 494 HG21 THR 69 HG21 THR 69 1.838 1.653 6.351 495 HG22 THR 69 HG22 THR 69 0.918 2.712 5.281 496 HG23 THR 69 HG23 THR 69 2.649 2.483 5.022 497 H CYS 70 HN CYS 70 1.158 -2.205 4.950 498 HA CYS 70 HA CYS 70 1.440 -3.405 2.276 499 HB2 CYS 70 HB2 CYS 70 2.084 -4.909 4.074 500 HB3 CYS 70 HB1 CYS 70 0.563 -4.614 4.911 501 H CYS 71 HN CYS 71 -0.128 -2.540 1.034 502 HA CYS 71 HA CYS 71 -2.768 -2.017 2.140 503 HB2 CYS 71 HB2 CYS 71 -1.768 -1.612 -0.687 504 HB3 CYS 71 HB1 CYS 71 -3.241 -0.954 0.012 505 H GLU 72 HN GLU 72 -4.546 -3.194 1.788 506 HA GLU 72 HA GLU 72 -4.261 -5.810 0.686 507 HB2 GLU 72 HB2 GLU 72 -5.626 -5.859 2.516 508 HB3 GLU 72 HB1 GLU 72 -6.300 -4.270 2.199 509 HG2 GLU 72 HG2 GLU 72 -7.817 -5.103 0.662 510 HG3 GLU 72 HG1 GLU 72 -6.960 -6.631 0.495 511 H ASP 73 HN ASP 73 -5.429 -2.735 -0.360 512 HA ASP 73 HA ASP 73 -5.333 -3.646 -3.083 513 HB2 ASP 73 HB2 ASP 73 -7.759 -4.059 -2.338 514 HB3 ASP 73 HB1 ASP 73 -7.906 -2.310 -2.235 515 H VAL 74 HN VAL 74 -5.694 -1.696 -4.565 516 HA VAL 74 HA VAL 74 -5.116 0.825 -3.176 517 HB VAL 74 HB VAL 74 -3.418 1.433 -4.815 518 HG11 VAL 74 HG11 VAL 74 -2.890 -1.181 -3.418 519 HG12 VAL 74 HG12 VAL 74 -2.612 0.444 -2.784 520 HG13 VAL 74 HG13 VAL 74 -1.637 -0.159 -4.124 521 HG21 VAL 74 HG21 VAL 74 -2.502 -0.191 -6.385 522 HG22 VAL 74 HG22 VAL 74 -4.211 0.107 -6.704 523 HG23 VAL 74 HG23 VAL 74 -3.712 -1.371 -5.879 524 H GLU 75 HN GLU 75 -5.926 2.649 -4.159 525 HA GLU 75 HA GLU 75 -7.469 2.209 -6.628 526 HB2 GLU 75 HB2 GLU 75 -8.604 3.006 -4.383 527 HB3 GLU 75 HB1 GLU 75 -7.946 4.571 -4.846 528 HG2 GLU 75 HG2 GLU 75 -9.152 4.506 -6.934 529 HG3 GLU 75 HG1 GLU 75 -9.739 2.884 -6.575 530 H ASP 76 HN ASP 76 -7.367 3.922 -8.222 531 HA ASP 76 HA ASP 76 -6.104 5.138 -9.669 532 HB2 ASP 76 HB2 ASP 76 -5.021 6.280 -7.083 533 HB3 ASP 76 HB1 ASP 76 -4.502 6.848 -8.665 534 H ASP 77 HN ASP 77 -3.283 5.862 -9.373 535 HA ASP 77 HA ASP 77 -2.190 3.234 -9.862 536 HB2 ASP 77 HB2 ASP 77 -1.615 5.306 -11.223 537 HB3 ASP 77 HB1 ASP 77 -0.638 5.820 -9.852 538 H GLY 78 HN GLY 78 -3.032 4.106 -7.124 539 HA2 GLY 78 HA2 GLY 78 -2.176 3.011 -5.176 540 HA3 GLY 78 HA1 GLY 78 -0.552 3.260 -5.793 541 H LEU 79 HN LEU 79 -2.745 5.923 -5.989 542 HA LEU 79 HA LEU 79 -1.193 7.361 -4.003 543 HB2 LEU 79 HB2 LEU 79 -3.555 8.260 -5.658 544 HB3 LEU 79 HB1 LEU 79 -2.600 9.295 -4.616 545 HG LEU 79 HG LEU 79 -1.644 7.911 -7.125 546 HD11 LEU 79 HD11 LEU 79 -2.124 10.819 -6.492 547 HD12 LEU 79 HD12 LEU 79 -3.105 9.807 -7.552 548 HD13 LEU 79 HD13 LEU 79 -1.440 10.189 -7.991 549 HD21 LEU 79 HD21 LEU 79 -0.170 9.737 -5.230 550 HD22 LEU 79 HD22 LEU 79 0.433 9.166 -6.786 551 HD23 LEU 79 HD23 LEU 79 0.142 8.019 -5.479 552 H VAL 80 HN VAL 80 -4.048 5.565 -4.174 553 HA VAL 80 HA VAL 80 -4.720 6.367 -1.431 554 HB VAL 80 HB VAL 80 -6.649 5.755 -3.681 555 HG11 VAL 80 HG11 VAL 80 -7.406 4.659 -1.640 556 HG12 VAL 80 HG12 VAL 80 -8.442 6.030 -2.037 557 HG13 VAL 80 HG13 VAL 80 -7.242 6.174 -0.756 558 HG21 VAL 80 HG21 VAL 80 -6.262 8.213 -1.970 559 HG22 VAL 80 HG22 VAL 80 -7.523 7.998 -3.188 560 HG23 VAL 80 HG23 VAL 80 -5.828 8.042 -3.672 561 H GLY 81 HN GLY 81 -4.196 4.677 -0.186 562 HA2 GLY 81 HA2 GLY 81 -4.309 1.997 -1.393 563 HA3 GLY 81 HA1 GLY 81 -3.337 2.448 -0.002 564 H ILE 82 HN ILE 82 -5.447 0.349 -0.540 565 HA ILE 82 HA ILE 82 -7.425 1.062 1.493 566 HB ILE 82 HB ILE 82 -7.306 -1.067 -0.619 567 HG12 ILE 82 HG12 ILE 82 -9.636 -0.244 -1.042 568 HG13 ILE 82 HG11 ILE 82 -9.374 0.980 0.197 569 HG21 ILE 82 HG21 ILE 82 -7.868 -2.309 1.353 570 HG22 ILE 82 HG22 ILE 82 -9.315 -2.118 0.361 571 HG23 ILE 82 HG23 ILE 82 -9.094 -1.124 1.800 572 HD11 ILE 82 HD11 ILE 82 -7.536 1.900 -1.111 573 HD12 ILE 82 HD12 ILE 82 -9.049 1.890 -2.024 574 HD13 ILE 82 HD13 ILE 82 -7.811 0.674 -2.352 575 H ASN 83 HN ASN 83 -6.990 0.541 3.491 576 HA ASN 83 HA ASN 83 -6.420 -0.653 5.341 577 HB2 ASN 83 HB2 ASN 83 -6.697 -2.908 3.361 578 HB3 ASN 83 HB1 ASN 83 -6.392 -3.185 5.066 579 HD21 ASN 83 HD21 ASN 83 -8.661 -4.023 3.525 580 HD22 ASN 83 HD22 ASN 83 -10.049 -3.281 4.240 581 H CYS 84 HN CYS 84 -4.367 0.640 4.337 582 HA CYS 84 HA CYS 84 -2.135 -1.115 3.803 583 HB2 CYS 84 HB2 CYS 84 -2.177 1.879 4.183 584 HB3 CYS 84 HB1 CYS 84 -0.859 0.927 3.512 585 H THR 85 HN THR 85 -1.866 -2.271 5.674 586 HA THR 85 HA THR 85 -1.555 -1.033 8.238 587 HB THR 85 HB THR 85 -0.731 -3.807 7.354 588 HG1 THR 85 HG1 THR 85 -2.776 -4.377 7.608 589 HG21 THR 85 HG21 THR 85 0.290 -3.172 9.464 590 HG22 THR 85 HG22 THR 85 -0.986 -4.357 9.754 591 HG23 THR 85 HG23 THR 85 -1.273 -2.650 10.091 592 HA PRO 86 HA PRO 86 2.653 0.288 7.547 593 HB2 PRO 86 HB2 PRO 86 2.746 0.599 10.472 594 HB3 PRO 86 HB1 PRO 86 2.947 1.815 9.211 595 HG2 PRO 86 HG2 PRO 86 0.749 1.735 10.745 596 HG3 PRO 86 HG1 PRO 86 0.675 2.194 9.035 597 HD2 PRO 86 HD2 PRO 86 -0.010 -0.418 10.327 598 HD3 PRO 86 HD1 PRO 86 -0.860 0.474 9.055 599 H ILE 87 HN ILE 87 4.288 -1.044 7.238 600 HA ILE 87 HA ILE 87 4.576 -3.379 8.968 601 HB ILE 87 HB ILE 87 6.041 -4.201 7.084 602 HG12 ILE 87 HG12 ILE 87 4.748 -1.944 5.559 603 HG13 ILE 87 HG11 ILE 87 6.417 -1.924 6.107 604 HG21 ILE 87 HG21 ILE 87 4.136 -4.839 5.672 605 HG22 ILE 87 HG22 ILE 87 3.148 -3.624 6.484 606 HG23 ILE 87 HG23 ILE 87 3.776 -5.001 7.391 607 HD11 ILE 87 HD11 ILE 87 5.208 -3.874 4.164 608 HD12 ILE 87 HD12 ILE 87 6.881 -3.886 4.723 609 HD13 ILE 87 HD13 ILE 87 6.278 -2.527 3.773 610 HA PRO 88 HA PRO 88 8.387 -1.940 10.668 611 HB2 PRO 88 HB2 PRO 88 9.443 -4.666 10.515 612 HB3 PRO 88 HB1 PRO 88 9.062 -3.701 11.934 613 HG2 PRO 88 HG2 PRO 88 7.583 -5.815 11.258 614 HG3 PRO 88 HG1 PRO 88 6.843 -4.351 11.935 615 HD2 PRO 88 HD2 PRO 88 7.042 -5.210 9.071 616 HD3 PRO 88 HD1 PRO 88 5.637 -4.587 9.955 617 H LEU 89 HN LEU 89 10.672 -1.774 10.341 618 HA LEU 89 HA LEU 89 11.380 -1.799 7.509 619 HB2 LEU 89 HB2 LEU 89 12.923 -0.673 9.849 620 HB3 LEU 89 HB1 LEU 89 13.196 -0.337 8.151 621 HG LEU 89 HG LEU 89 10.709 0.470 9.660 622 HD11 LEU 89 HD11 LEU 89 11.624 2.729 9.598 623 HD12 LEU 89 HD12 LEU 89 13.104 2.118 8.862 624 HD13 LEU 89 HD13 LEU 89 12.676 1.645 10.506 625 HD21 LEU 89 HD21 LEU 89 10.392 0.156 7.248 626 HD22 LEU 89 HD22 LEU 89 11.724 1.269 6.936 627 HD23 LEU 89 HD23 LEU 89 10.254 1.849 7.716 628 H ILE 90 HN ILE 90 11.332 -4.260 9.200 629 HA ILE 90 HA ILE 90 14.167 -4.980 9.029 630 HB ILE 90 HB ILE 90 13.765 -6.408 11.093 631 HG12 ILE 90 HG12 ILE 90 11.425 -4.511 11.412 632 HG13 ILE 90 HG11 ILE 90 11.297 -6.238 11.101 633 HG21 ILE 90 HG21 ILE 90 15.158 -4.438 11.136 634 HG22 ILE 90 HG22 ILE 90 14.197 -4.511 12.613 635 HG23 ILE 90 HG23 ILE 90 13.741 -3.402 11.316 636 HD11 ILE 90 HD11 ILE 90 10.902 -5.732 13.434 637 HD12 ILE 90 HD12 ILE 90 12.486 -4.965 13.552 638 HD13 ILE 90 HD13 ILE 90 12.367 -6.697 13.245 Start of MODEL 16 1 H1 GLY 1 HT1 GLY 1 1.177 -4.699 -12.960 2 H2 GLY 1 HT2 GLY 1 2.314 -5.786 -12.342 3 H3 GLY 1 HT3 GLY 1 2.823 -4.468 -13.264 4 HA2 GLY 1 HA1 GLY 1 2.027 -2.940 -11.567 5 HA3 GLY 1 HA2 GLY 1 1.529 -4.324 -10.602 6 H SER 2 HN SER 2 3.166 -2.684 -9.358 7 HA SER 2 HA SER 2 5.932 -3.321 -9.816 8 HB2 SER 2 HB2 SER 2 5.260 -1.093 -8.995 9 HB3 SER 2 HB1 SER 2 4.618 -1.830 -7.529 10 HG SER 2 HG SER 2 6.574 -2.038 -6.761 11 H GLY 3 HN GLY 3 6.300 -5.467 -9.478 12 HA2 GLY 3 HA2 GLY 3 5.343 -6.888 -7.192 13 HA3 GLY 3 HA1 GLY 3 6.606 -7.421 -8.294 14 H TRP 4 HN TRP 4 5.920 -6.200 -5.222 15 HA TRP 4 HA TRP 4 8.573 -5.087 -4.820 16 HB2 TRP 4 HB2 TRP 4 6.063 -5.115 -3.185 17 HB3 TRP 4 HB1 TRP 4 7.607 -4.689 -2.453 18 HD1 TRP 4 HD1 TRP 4 4.786 -3.185 -4.282 19 HE1 TRP 4 HE1 TRP 4 5.370 -0.795 -5.028 20 HE3 TRP 4 HE3 TRP 4 9.820 -3.305 -3.456 21 HZ2 TRP 4 HZ2 TRP 4 7.682 0.822 -5.248 22 HZ3 TRP 4 HZ3 TRP 4 11.151 -1.299 -3.963 23 HH2 TRP 4 HH2 TRP 4 10.103 0.720 -4.839 24 H GLU 5 HN GLU 5 9.284 -5.571 -2.375 25 HA GLU 5 HA GLU 5 10.406 -8.132 -2.492 26 HB2 GLU 5 HB2 GLU 5 10.260 -6.050 -0.330 27 HB3 GLU 5 HB1 GLU 5 11.067 -7.593 -0.074 28 HG2 GLU 5 HG2 GLU 5 11.745 -5.625 -2.247 29 HG3 GLU 5 HG1 GLU 5 12.616 -5.806 -0.722 30 H SER 6 HN SER 6 9.265 -9.894 -2.355 31 HA SER 6 HA SER 6 7.125 -10.093 -0.368 32 HB2 SER 6 HB2 SER 6 6.734 -10.692 -2.815 33 HB3 SER 6 HB1 SER 6 7.796 -12.074 -2.556 34 HG SER 6 HG SER 6 5.222 -11.922 -2.071 35 H LYS 7 HN LYS 7 10.347 -10.992 -1.000 36 HA LYS 7 HA LYS 7 10.437 -13.431 0.451 37 HB2 LYS 7 HB2 LYS 7 12.826 -13.276 0.282 38 HB3 LYS 7 HB1 LYS 7 12.136 -12.733 -1.236 39 HG2 LYS 7 HG2 LYS 7 13.788 -11.179 -0.907 40 HG3 LYS 7 HG1 LYS 7 12.404 -10.356 -0.186 41 HD2 LYS 7 HD2 LYS 7 13.106 -11.032 2.026 42 HD3 LYS 7 HD1 LYS 7 14.420 -11.994 1.354 43 HE2 LYS 7 HE2 LYS 7 15.273 -9.900 2.223 44 HE3 LYS 7 HE1 LYS 7 15.451 -9.951 0.473 45 HZ1 LYS 7 HZ1 LYS 7 14.608 -7.812 1.481 46 HZ2 LYS 7 HZ2 LYS 7 13.146 -8.617 1.769 47 HZ3 LYS 7 HZ3 LYS 7 13.720 -8.432 0.181 48 H THR 8 HN THR 8 10.197 -10.194 1.414 49 HA THR 8 HA THR 8 11.623 -10.361 3.869 50 HB THR 8 HB THR 8 9.469 -8.378 3.123 51 HG1 THR 8 HG1 THR 8 11.451 -7.136 2.487 52 HG21 THR 8 HG21 THR 8 10.667 -6.881 4.641 53 HG22 THR 8 HG22 THR 8 11.833 -8.156 4.993 54 HG23 THR 8 HG23 THR 8 10.150 -8.340 5.486 55 H GLY 9 HN GLY 9 8.367 -11.091 2.864 56 HA2 GLY 9 HA2 GLY 9 6.759 -12.339 3.936 57 HA3 GLY 9 HA1 GLY 9 7.908 -12.603 5.237 58 H SER 10 HN SER 10 7.299 -9.343 4.396 59 HA SER 10 HA SER 10 6.190 -8.933 7.042 60 HB2 SER 10 HB2 SER 10 8.083 -7.556 6.028 61 HB3 SER 10 HB1 SER 10 6.858 -6.812 5.004 62 HG SER 10 HG SER 10 7.528 -6.070 7.399 63 H CYS 11 HN CYS 11 5.168 -8.861 3.728 64 HA CYS 11 HA CYS 11 2.537 -7.839 4.582 65 HB2 CYS 11 HB2 CYS 11 3.597 -6.317 3.024 66 HB3 CYS 11 HB1 CYS 11 3.925 -7.634 1.906 67 H ASN 12 HN ASN 12 0.714 -8.955 4.005 68 HA ASN 12 HA ASN 12 1.175 -11.712 3.181 69 HB2 ASN 12 HB2 ASN 12 -1.106 -12.138 3.987 70 HB3 ASN 12 HB1 ASN 12 -0.116 -11.369 5.222 71 HD21 ASN 12 HD21 ASN 12 -0.571 -9.243 5.825 72 HD22 ASN 12 HD22 ASN 12 -2.075 -8.485 5.427 73 H THR 13 HN THR 13 -0.208 -8.796 1.929 74 HA THR 13 HA THR 13 -1.819 -10.239 -0.026 75 HB THR 13 HB THR 13 -2.578 -7.956 -0.701 76 HG1 THR 13 HG1 THR 13 -1.920 -6.207 0.595 77 HG21 THR 13 HG21 THR 13 -2.807 -8.714 2.213 78 HG22 THR 13 HG22 THR 13 -3.890 -9.182 0.903 79 HG23 THR 13 HG23 THR 13 -3.811 -7.500 1.422 80 H GLY 14 HN GLY 14 1.108 -8.357 0.173 81 HA2 GLY 14 HA2 GLY 14 2.858 -8.585 -1.423 82 HA3 GLY 14 HA1 GLY 14 1.658 -9.018 -2.632 83 H LYS 15 HN LYS 15 0.277 -6.535 -1.088 84 HA LYS 15 HA LYS 15 1.187 -4.639 -3.115 85 HB2 LYS 15 HB2 LYS 15 -1.132 -4.466 -1.186 86 HB3 LYS 15 HB1 LYS 15 -0.762 -3.291 -2.436 87 HG2 LYS 15 HG2 LYS 15 -1.071 -5.132 -4.116 88 HG3 LYS 15 HG1 LYS 15 -1.686 -6.128 -2.792 89 HD2 LYS 15 HD2 LYS 15 -3.436 -4.514 -2.351 90 HD3 LYS 15 HD1 LYS 15 -2.791 -3.442 -3.589 91 HE2 LYS 15 HE2 LYS 15 -4.565 -4.486 -4.654 92 HE3 LYS 15 HE1 LYS 15 -3.163 -5.400 -5.196 93 HZ1 LYS 15 HZ1 LYS 15 -4.974 -6.857 -4.588 94 HZ2 LYS 15 HZ2 LYS 15 -5.038 -6.195 -3.032 95 HZ3 LYS 15 HZ3 LYS 15 -3.679 -7.079 -3.526 96 H LEU 16 HN LEU 16 3.180 -4.024 -2.243 97 HA LEU 16 HA LEU 16 3.167 -2.745 0.367 98 HB2 LEU 16 HB2 LEU 16 5.368 -3.536 -1.524 99 HB3 LEU 16 HB1 LEU 16 5.658 -2.516 -0.136 100 HG LEU 16 HG LEU 16 4.789 -4.338 1.322 101 HD11 LEU 16 HD11 LEU 16 3.411 -5.526 -0.188 102 HD12 LEU 16 HD12 LEU 16 4.712 -6.608 0.324 103 HD13 LEU 16 HD13 LEU 16 4.771 -5.846 -1.268 104 HD21 LEU 16 HD21 LEU 16 7.182 -4.040 1.022 105 HD22 LEU 16 HD22 LEU 16 7.139 -5.041 -0.429 106 HD23 LEU 16 HD23 LEU 16 6.783 -5.753 1.144 107 H ALA 17 HN ALA 17 2.592 -0.678 0.409 108 HA ALA 17 HA ALA 17 3.724 1.092 -1.656 109 HB1 ALA 17 HB1 ALA 17 0.977 1.302 -0.423 110 HB2 ALA 17 HB2 ALA 17 1.347 0.878 -2.095 111 HB3 ALA 17 HB3 ALA 17 1.707 2.500 -1.494 112 H CYS 18 HN CYS 18 4.366 3.137 -0.955 113 HA CYS 18 HA CYS 18 4.847 3.403 1.885 114 HB2 CYS 18 HB2 CYS 18 5.458 5.349 -0.350 115 HB3 CYS 18 HB1 CYS 18 6.059 5.420 1.293 116 H CYS 19 HN CYS 19 3.113 3.955 3.042 117 HA CYS 19 HA CYS 19 1.294 5.944 1.882 118 HB2 CYS 19 HB2 CYS 19 0.705 3.662 3.760 119 HB3 CYS 19 HB1 CYS 19 -0.458 4.914 3.336 120 H ASP 20 HN ASP 20 0.546 7.594 3.115 121 HA ASP 20 HA ASP 20 2.174 8.167 5.479 122 HB2 ASP 20 HB2 ASP 20 0.542 9.905 3.646 123 HB3 ASP 20 HB1 ASP 20 1.188 10.503 5.162 124 H THR 21 HN THR 21 1.251 7.526 7.288 125 HA THR 21 HA THR 21 -1.583 7.152 7.516 126 HB THR 21 HB THR 21 -1.127 6.474 9.821 127 HG1 THR 21 HG1 THR 21 1.326 6.440 10.254 128 HG21 THR 21 HG21 THR 21 -0.758 4.842 8.023 129 HG22 THR 21 HG22 THR 21 0.359 4.583 9.365 130 HG23 THR 21 HG23 THR 21 0.920 5.371 7.890 131 H ASN 22 HN ASN 22 0.380 9.791 7.666 132 HA ASN 22 HA ASN 22 -1.121 11.261 9.680 133 HB2 ASN 22 HB2 ASN 22 1.138 12.097 7.841 134 HB3 ASN 22 HB1 ASN 22 0.413 13.127 9.068 135 HD21 ASN 22 HD21 ASN 22 3.154 12.035 8.680 136 HD22 ASN 22 HD22 ASN 22 3.551 11.282 10.188 137 H LYS 23 HN LYS 23 -1.396 10.397 6.514 138 HA LYS 23 HA LYS 23 -3.112 12.693 5.855 139 HB2 LYS 23 HB2 LYS 23 -1.037 11.279 4.298 140 HB3 LYS 23 HB1 LYS 23 -2.502 11.680 3.433 141 HG2 LYS 23 HG2 LYS 23 -2.177 14.060 4.201 142 HG3 LYS 23 HG1 LYS 23 -0.590 13.548 4.784 143 HD2 LYS 23 HD2 LYS 23 -1.547 13.286 1.941 144 HD3 LYS 23 HD1 LYS 23 -0.470 14.552 2.542 145 HE2 LYS 23 HE2 LYS 23 1.224 13.006 3.058 146 HE3 LYS 23 HE1 LYS 23 0.119 11.649 2.886 147 HZ1 LYS 23 HZ1 LYS 23 1.659 11.870 1.011 148 HZ2 LYS 23 HZ2 LYS 23 1.015 13.397 0.658 149 HZ3 LYS 23 HZ3 LYS 23 0.045 12.018 0.517 150 H LYS 24 HN LYS 24 -5.037 12.251 4.908 151 HA LYS 24 HA LYS 24 -5.840 9.427 4.884 152 HB2 LYS 24 HB2 LYS 24 -7.422 11.746 5.982 153 HB3 LYS 24 HB1 LYS 24 -7.959 10.072 5.920 154 HG2 LYS 24 HG2 LYS 24 -5.667 11.153 7.543 155 HG3 LYS 24 HG1 LYS 24 -7.250 10.682 8.151 156 HD2 LYS 24 HD2 LYS 24 -6.764 8.375 7.207 157 HD3 LYS 24 HD1 LYS 24 -5.106 8.933 6.982 158 HE2 LYS 24 HE2 LYS 24 -5.257 7.738 9.066 159 HE3 LYS 24 HE1 LYS 24 -4.990 9.449 9.398 160 HZ1 LYS 24 HZ1 LYS 24 -7.326 9.707 9.882 161 HZ2 LYS 24 HZ2 LYS 24 -6.686 8.470 10.841 162 HZ3 LYS 24 HZ3 LYS 24 -7.628 8.088 9.489 163 H VAL 25 HN VAL 25 -7.674 8.944 3.596 164 HA VAL 25 HA VAL 25 -8.435 11.000 1.618 165 HB VAL 25 HB VAL 25 -8.475 8.034 1.067 166 HG11 VAL 25 HG11 VAL 25 -9.905 9.407 -0.337 167 HG12 VAL 25 HG12 VAL 25 -8.571 8.730 -1.271 168 HG13 VAL 25 HG13 VAL 25 -8.528 10.420 -0.769 169 HG21 VAL 25 HG21 VAL 25 -6.265 9.952 0.340 170 HG22 VAL 25 HG22 VAL 25 -6.399 8.276 -0.192 171 HG23 VAL 25 HG23 VAL 25 -6.157 8.642 1.515 172 H GLN 26 HN GLN 26 -10.671 10.951 1.026 173 HA GLN 26 HA GLN 26 -12.390 10.146 3.159 174 HB2 GLN 26 HB2 GLN 26 -14.172 11.078 1.815 175 HB3 GLN 26 HB1 GLN 26 -12.838 12.211 1.982 176 HG2 GLN 26 HG2 GLN 26 -12.055 11.516 -0.273 177 HG3 GLN 26 HG1 GLN 26 -13.503 10.524 -0.424 178 HE21 GLN 26 HE21 GLN 26 -12.618 12.759 -2.050 179 HE22 GLN 26 HE22 GLN 26 -13.880 13.939 -1.981 180 H LYS 27 HN LYS 27 -11.142 7.952 1.937 181 HA LYS 27 HA LYS 27 -11.294 6.090 0.620 182 HB2 LYS 27 HB2 LYS 27 -14.050 5.840 1.654 183 HB3 LYS 27 HB1 LYS 27 -12.756 4.647 1.618 184 HG2 LYS 27 HG2 LYS 27 -11.597 6.158 3.329 185 HG3 LYS 27 HG1 LYS 27 -13.185 6.928 3.520 186 HD2 LYS 27 HD2 LYS 27 -12.586 3.988 3.834 187 HD3 LYS 27 HD1 LYS 27 -12.765 5.126 5.173 188 HE2 LYS 27 HE2 LYS 27 -15.074 5.584 4.422 189 HE3 LYS 27 HE1 LYS 27 -14.879 4.378 3.152 190 HZ1 LYS 27 HZ1 LYS 27 -16.023 3.457 5.059 191 HZ2 LYS 27 HZ2 LYS 27 -14.732 3.861 6.072 192 HZ3 LYS 27 HZ3 LYS 27 -14.523 2.699 4.862 193 H SER 28 HN SER 28 -11.478 6.031 -1.512 194 HA SER 28 HA SER 28 -13.898 7.070 -2.777 195 HB2 SER 28 HB2 SER 28 -12.448 6.948 -4.871 196 HB3 SER 28 HB1 SER 28 -11.959 8.128 -3.656 197 HG SER 28 HG SER 28 -10.409 6.366 -4.687 198 H THR 29 HN THR 29 -11.638 4.729 -3.942 199 HA THR 29 HA THR 29 -13.342 2.454 -3.570 200 HB THR 29 HB THR 29 -13.067 2.046 -6.205 201 HG1 THR 29 HG1 THR 29 -12.178 4.115 -6.607 202 HG21 THR 29 HG21 THR 29 -15.338 3.601 -4.969 203 HG22 THR 29 HG22 THR 29 -15.164 1.846 -4.975 204 HG23 THR 29 HG23 THR 29 -15.408 2.713 -6.491 205 H GLY 30 HN GLY 30 -12.221 0.653 -5.215 206 HA2 GLY 30 HA2 GLY 30 -9.316 1.056 -5.136 207 HA3 GLY 30 HA1 GLY 30 -9.998 -0.353 -4.333 208 H GLU 31 HN GLU 31 -8.610 0.689 -7.141 209 HA GLU 31 HA GLU 31 -10.181 -0.622 -9.085 210 HB2 GLU 31 HB2 GLU 31 -7.276 0.191 -9.087 211 HB3 GLU 31 HB1 GLU 31 -8.078 -0.515 -10.485 212 HG2 GLU 31 HG2 GLU 31 -9.686 1.337 -10.480 213 HG3 GLU 31 HG1 GLU 31 -8.845 2.049 -9.107 214 H GLU 32 HN GLU 32 -7.598 -1.712 -6.974 215 HA GLU 32 HA GLU 32 -7.455 -4.329 -8.119 216 HB2 GLU 32 HB2 GLU 32 -6.632 -3.373 -5.372 217 HB3 GLU 32 HB1 GLU 32 -6.180 -4.906 -6.103 218 HG2 GLU 32 HG2 GLU 32 -5.407 -2.176 -7.103 219 HG3 GLU 32 HG1 GLU 32 -4.368 -3.290 -6.220 220 H SER 33 HN SER 33 -9.100 -2.871 -5.356 221 HA SER 33 HA SER 33 -10.384 -5.054 -4.261 222 HB2 SER 33 HB2 SER 33 -11.524 -2.267 -4.581 223 HB3 SER 33 HB1 SER 33 -12.040 -3.471 -3.404 224 HG SER 33 HG SER 33 -9.771 -3.411 -2.665 225 H GLY 34 HN GLY 34 -11.087 -3.387 -7.233 226 HA2 GLY 34 HA2 GLY 34 -13.751 -4.375 -7.539 227 HA3 GLY 34 HA1 GLY 34 -12.767 -3.627 -8.785 228 H LEU 35 HN LEU 35 -10.589 -5.594 -8.364 229 HA LEU 35 HA LEU 35 -11.726 -7.722 -10.001 230 HB2 LEU 35 HB2 LEU 35 -8.865 -7.132 -9.230 231 HB3 LEU 35 HB1 LEU 35 -9.369 -8.410 -10.319 232 HG LEU 35 HG LEU 35 -9.728 -5.453 -10.809 233 HD11 LEU 35 HD11 LEU 35 -8.040 -5.749 -12.537 234 HD12 LEU 35 HD12 LEU 35 -7.851 -7.441 -12.075 235 HD13 LEU 35 HD13 LEU 35 -7.398 -6.164 -10.948 236 HD21 LEU 35 HD21 LEU 35 -10.340 -7.832 -12.559 237 HD22 LEU 35 HD22 LEU 35 -10.409 -6.144 -13.066 238 HD23 LEU 35 HD23 LEU 35 -11.517 -6.741 -11.829 239 H LEU 36 HN LEU 36 -10.412 -7.153 -6.844 240 HA LEU 36 HA LEU 36 -10.438 -9.973 -6.155 241 HB2 LEU 36 HB2 LEU 36 -9.491 -7.456 -4.848 242 HB3 LEU 36 HB1 LEU 36 -9.780 -8.876 -3.873 243 HG LEU 36 HG LEU 36 -8.148 -10.128 -5.273 244 HD11 LEU 36 HD11 LEU 36 -8.301 -8.812 -7.311 245 HD12 LEU 36 HD12 LEU 36 -6.638 -8.879 -6.727 246 HD13 LEU 36 HD13 LEU 36 -7.600 -7.422 -6.481 247 HD21 LEU 36 HD21 LEU 36 -7.092 -7.618 -3.987 248 HD22 LEU 36 HD22 LEU 36 -6.169 -9.082 -4.322 249 HD23 LEU 36 HD23 LEU 36 -7.489 -9.121 -3.155 250 H HIS 37 HN HIS 37 -11.339 -10.254 -3.745 251 HA HIS 37 HA HIS 37 -14.101 -9.253 -3.845 252 HB2 HIS 37 HB2 HIS 37 -12.918 -11.697 -2.531 253 HB3 HIS 37 HB1 HIS 37 -14.558 -11.141 -2.213 254 HD1 HIS 37 HD1 HIS 37 -16.099 -10.973 -4.486 255 HD2 HIS 37 HD2 HIS 37 -12.725 -13.391 -4.635 256 HE1 HIS 37 HE1 HIS 37 -16.471 -12.530 -6.422 257 HE2 HIS 37 HE2 HIS 37 -14.474 -14.064 -6.417 258 H THR 38 HN THR 38 -11.301 -8.459 -2.461 259 HA THR 38 HA THR 38 -12.031 -8.125 0.272 260 HB THR 38 HB THR 38 -10.006 -6.408 0.022 261 HG1 THR 38 HG1 THR 38 -9.268 -6.399 -1.963 262 HG21 THR 38 HG21 THR 38 -8.464 -8.293 0.366 263 HG22 THR 38 HG22 THR 38 -9.718 -9.410 -0.171 264 HG23 THR 38 HG23 THR 38 -9.940 -8.485 1.313 265 H GLY 39 HN GLY 39 -12.836 -6.456 -2.562 266 HA2 GLY 39 HA2 GLY 39 -13.197 -3.860 -1.334 267 HA3 GLY 39 HA1 GLY 39 -13.626 -4.314 -2.975 268 H ASP 40 HN ASP 40 -14.762 -6.473 -0.638 269 HA ASP 40 HA ASP 40 -17.492 -5.809 -1.206 270 HB2 ASP 40 HB2 ASP 40 -16.509 -8.131 -0.741 271 HB3 ASP 40 HB1 ASP 40 -16.538 -7.676 0.957 272 H VAL 41 HN VAL 41 -15.317 -5.486 1.524 273 HA VAL 41 HA VAL 41 -17.351 -4.476 3.287 274 HB VAL 41 HB VAL 41 -15.375 -3.979 4.804 275 HG11 VAL 41 HG11 VAL 41 -15.053 -6.353 5.358 276 HG12 VAL 41 HG12 VAL 41 -15.777 -6.808 3.814 277 HG13 VAL 41 HG13 VAL 41 -16.747 -5.984 5.035 278 HG21 VAL 41 HG21 VAL 41 -13.260 -5.037 4.245 279 HG22 VAL 41 HG22 VAL 41 -13.681 -3.821 3.043 280 HG23 VAL 41 HG23 VAL 41 -13.900 -5.532 2.679 281 H LEU 42 HN LEU 42 -17.772 -2.431 3.882 282 HA LEU 42 HA LEU 42 -16.453 -0.216 2.576 283 HB2 LEU 42 HB2 LEU 42 -18.638 -0.389 4.634 284 HB3 LEU 42 HB1 LEU 42 -18.063 1.101 3.944 285 HG LEU 42 HG LEU 42 -19.378 -1.120 2.394 286 HD11 LEU 42 HD11 LEU 42 -21.275 0.425 2.234 287 HD12 LEU 42 HD12 LEU 42 -20.447 1.541 3.319 288 HD13 LEU 42 HD13 LEU 42 -20.945 -0.047 3.900 289 HD21 LEU 42 HD21 LEU 42 -18.538 1.660 1.574 290 HD22 LEU 42 HD22 LEU 42 -19.482 0.545 0.587 291 HD23 LEU 42 HD23 LEU 42 -17.823 0.144 1.026 292 H ASP 43 HN ASP 43 -15.970 -2.166 5.181 293 HA ASP 43 HA ASP 43 -15.132 -0.462 7.245 294 HB2 ASP 43 HB2 ASP 43 -15.691 -2.833 7.560 295 HB3 ASP 43 HB1 ASP 43 -14.288 -3.298 6.606 296 H GLN 44 HN GLN 44 -13.671 -1.206 4.279 297 HA GLN 44 HA GLN 44 -10.977 -1.114 4.702 298 HB2 GLN 44 HB2 GLN 44 -12.413 0.361 2.508 299 HB3 GLN 44 HB1 GLN 44 -10.738 -0.140 2.493 300 HG2 GLN 44 HG2 GLN 44 -11.420 -2.477 2.509 301 HG3 GLN 44 HG1 GLN 44 -13.112 -1.983 2.543 302 HE21 GLN 44 HE21 GLN 44 -11.600 -3.550 0.566 303 HE22 GLN 44 HE22 GLN 44 -11.803 -2.720 -0.935 304 H VAL 45 HN VAL 45 -9.427 0.449 4.890 305 HA VAL 45 HA VAL 45 -10.320 3.169 5.573 306 HB VAL 45 HB VAL 45 -7.898 1.709 6.664 307 HG11 VAL 45 HG11 VAL 45 -7.696 3.632 8.177 308 HG12 VAL 45 HG12 VAL 45 -9.032 4.420 7.338 309 HG13 VAL 45 HG13 VAL 45 -7.523 4.099 6.485 310 HG21 VAL 45 HG21 VAL 45 -10.485 2.427 8.038 311 HG22 VAL 45 HG22 VAL 45 -9.075 1.696 8.805 312 HG23 VAL 45 HG23 VAL 45 -9.973 0.803 7.578 313 H ALA 46 HN ALA 46 -9.486 4.738 4.352 314 HA ALA 46 HA ALA 46 -7.391 3.974 2.427 315 HB1 ALA 46 HB1 ALA 46 -8.338 5.664 0.931 316 HB2 ALA 46 HB2 ALA 46 -9.573 6.031 2.137 317 HB3 ALA 46 HB3 ALA 46 -9.530 4.440 1.378 318 H ILE 47 HN ILE 47 -5.494 4.761 2.966 319 HA ILE 47 HA ILE 47 -5.358 7.561 3.847 320 HB ILE 47 HB ILE 47 -3.001 7.035 4.545 321 HG12 ILE 47 HG12 ILE 47 -3.932 4.184 4.152 322 HG13 ILE 47 HG11 ILE 47 -2.635 4.990 3.274 323 HG21 ILE 47 HG21 ILE 47 -5.134 5.474 5.980 324 HG22 ILE 47 HG22 ILE 47 -4.892 7.216 6.107 325 HG23 ILE 47 HG23 ILE 47 -3.635 6.110 6.666 326 HD11 ILE 47 HD11 ILE 47 -1.389 5.213 5.391 327 HD12 ILE 47 HD12 ILE 47 -1.705 3.537 4.952 328 HD13 ILE 47 HD13 ILE 47 -2.667 4.315 6.208 329 H GLN 48 HN GLN 48 -3.382 8.717 3.028 330 HA GLN 48 HA GLN 48 -3.372 8.362 0.129 331 HB2 GLN 48 HB2 GLN 48 -3.705 10.594 1.536 332 HB3 GLN 48 HB1 GLN 48 -1.949 10.610 1.498 333 HG2 GLN 48 HG2 GLN 48 -3.655 10.399 -0.966 334 HG3 GLN 48 HG1 GLN 48 -3.086 11.927 -0.300 335 HE21 GLN 48 HE21 GLN 48 -2.563 10.533 -2.858 336 HE22 GLN 48 HE22 GLN 48 -0.842 10.426 -2.974 337 H CYS 49 HN CYS 49 -1.773 7.653 -0.987 338 HA CYS 49 HA CYS 49 0.717 6.991 0.425 339 HB2 CYS 49 HB2 CYS 49 -0.653 5.321 -1.684 340 HB3 CYS 49 HB1 CYS 49 0.731 4.878 -0.702 341 H THR 50 HN THR 50 2.566 6.639 -1.014 342 HA THR 50 HA THR 50 2.455 7.629 -3.695 343 HB THR 50 HB THR 50 2.399 9.771 -2.480 344 HG1 THR 50 HG1 THR 50 4.005 10.708 -3.681 345 HG21 THR 50 HG21 THR 50 5.048 8.885 -1.344 346 HG22 THR 50 HG22 THR 50 3.547 9.089 -0.444 347 HG23 THR 50 HG23 THR 50 4.338 10.491 -1.166 348 H GLN 51 HN GLN 51 4.298 7.031 -4.859 349 HA GLN 51 HA GLN 51 6.303 5.591 -3.267 350 HB2 GLN 51 HB2 GLN 51 4.571 4.351 -4.880 351 HB3 GLN 51 HB1 GLN 51 5.798 4.754 -6.075 352 HG2 GLN 51 HG2 GLN 51 6.431 3.347 -3.502 353 HG3 GLN 51 HG1 GLN 51 5.991 2.490 -4.977 354 HE21 GLN 51 HE21 GLN 51 8.502 2.647 -3.343 355 HE22 GLN 51 HE22 GLN 51 9.740 3.033 -4.485 356 H ILE 52 HN ILE 52 8.155 6.560 -3.304 357 HA ILE 52 HA ILE 52 8.970 8.460 -5.272 358 HB ILE 52 HB ILE 52 10.523 7.120 -3.052 359 HG12 ILE 52 HG12 ILE 52 9.150 9.813 -3.173 360 HG13 ILE 52 HG11 ILE 52 8.573 8.409 -2.282 361 HG21 ILE 52 HG21 ILE 52 12.137 8.909 -3.262 362 HG22 ILE 52 HG22 ILE 52 11.214 9.617 -4.586 363 HG23 ILE 52 HG23 ILE 52 11.989 8.047 -4.794 364 HD11 ILE 52 HD11 ILE 52 9.668 10.064 -0.850 365 HD12 ILE 52 HD12 ILE 52 11.163 9.839 -1.760 366 HD13 ILE 52 HD13 ILE 52 10.488 8.505 -0.828 367 HA PRO 53 HA PRO 53 10.272 6.076 -8.694 368 HB2 PRO 53 HB2 PRO 53 12.843 7.559 -8.284 369 HB3 PRO 53 HB1 PRO 53 11.947 7.263 -9.777 370 HG2 PRO 53 HG2 PRO 53 11.793 9.602 -8.431 371 HG3 PRO 53 HG1 PRO 53 10.443 8.945 -9.368 372 HD2 PRO 53 HD2 PRO 53 10.703 9.247 -6.476 373 HD3 PRO 53 HD1 PRO 53 9.262 8.872 -7.438 374 H LEU 54 HN LEU 54 10.626 4.013 -8.408 375 HA LEU 54 HA LEU 54 12.454 3.079 -6.396 376 HB2 LEU 54 HB2 LEU 54 11.360 0.917 -6.714 377 HB3 LEU 54 HB1 LEU 54 10.205 2.198 -6.409 378 HG LEU 54 HG LEU 54 10.122 2.220 -9.084 379 HD11 LEU 54 HD11 LEU 54 10.767 -0.645 -8.402 380 HD12 LEU 54 HD12 LEU 54 11.778 0.447 -9.348 381 HD13 LEU 54 HD13 LEU 54 10.201 -0.050 -9.963 382 HD21 LEU 54 HD21 LEU 54 8.132 0.820 -8.934 383 HD22 LEU 54 HD22 LEU 54 8.216 1.956 -7.587 384 HD23 LEU 54 HD23 LEU 54 8.638 0.262 -7.338 385 H LEU 55 HN LEU 55 14.249 1.903 -6.686 386 HA LEU 55 HA LEU 55 15.126 1.299 -9.407 387 HB2 LEU 55 HB2 LEU 55 16.519 0.820 -6.766 388 HB3 LEU 55 HB1 LEU 55 17.235 0.675 -8.358 389 HG LEU 55 HG LEU 55 16.299 3.224 -7.044 390 HD11 LEU 55 HD11 LEU 55 18.656 3.827 -7.087 391 HD12 LEU 55 HD12 LEU 55 19.054 2.257 -7.783 392 HD13 LEU 55 HD13 LEU 55 18.391 2.356 -6.153 393 HD21 LEU 55 HD21 LEU 55 15.870 3.300 -9.437 394 HD22 LEU 55 HD22 LEU 55 17.528 2.801 -9.763 395 HD23 LEU 55 HD23 LEU 55 17.211 4.362 -9.008 396 H ILE 56 HN ILE 56 15.504 -0.830 -10.120 397 HA ILE 56 HA ILE 56 13.606 -2.717 -9.153 398 HB ILE 56 HB ILE 56 15.874 -3.244 -11.057 399 HG12 ILE 56 HG12 ILE 56 13.063 -2.305 -11.656 400 HG13 ILE 56 HG11 ILE 56 14.517 -1.326 -11.807 401 HG21 ILE 56 HG21 ILE 56 14.430 -5.029 -11.915 402 HG22 ILE 56 HG22 ILE 56 13.246 -4.654 -10.663 403 HG23 ILE 56 HG23 ILE 56 14.838 -5.264 -10.215 404 HD11 ILE 56 HD11 ILE 56 13.881 -3.797 -13.404 405 HD12 ILE 56 HD12 ILE 56 15.334 -2.809 -13.562 406 HD13 ILE 56 HD13 ILE 56 13.758 -2.131 -13.968 407 H GLY 57 HN GLY 57 13.822 -4.334 -7.783 408 HA2 GLY 57 HA2 GLY 57 14.880 -6.011 -6.541 409 HA3 GLY 57 HA1 GLY 57 16.436 -5.362 -7.035 410 H ILE 58 HN ILE 58 14.666 -2.779 -6.054 411 HA ILE 58 HA ILE 58 16.044 -2.768 -3.485 412 HB ILE 58 HB ILE 58 15.366 -0.751 -5.430 413 HG12 ILE 58 HG12 ILE 58 17.613 -1.227 -4.547 414 HG13 ILE 58 HG11 ILE 58 17.165 0.462 -4.331 415 HG21 ILE 58 HG21 ILE 58 13.539 -0.120 -4.003 416 HG22 ILE 58 HG22 ILE 58 14.825 1.079 -3.860 417 HG23 ILE 58 HG23 ILE 58 14.594 -0.128 -2.589 418 HD11 ILE 58 HD11 ILE 58 16.642 0.026 -1.987 419 HD12 ILE 58 HD12 ILE 58 18.306 -0.414 -2.372 420 HD13 ILE 58 HD13 ILE 58 17.079 -1.669 -2.202 421 H ALA 59 HN ALA 59 15.046 -2.059 -1.598 422 HA ALA 59 HA ALA 59 12.443 -3.239 -1.207 423 HB1 ALA 59 HB1 ALA 59 14.373 -1.948 0.704 424 HB2 ALA 59 HB2 ALA 59 14.275 -3.670 0.336 425 HB3 ALA 59 HB3 ALA 59 12.936 -2.866 1.161 426 H ILE 60 HN ILE 60 10.612 -2.217 -0.969 427 HA ILE 60 HA ILE 60 10.010 0.387 -1.632 428 HB ILE 60 HB ILE 60 8.337 -1.390 -1.450 429 HG12 ILE 60 HG12 ILE 60 6.580 -0.146 -0.064 430 HG13 ILE 60 HG11 ILE 60 7.843 1.030 0.281 431 HG21 ILE 60 HG21 ILE 60 7.475 -2.029 0.819 432 HG22 ILE 60 HG22 ILE 60 8.900 -1.241 1.505 433 HG23 ILE 60 HG23 ILE 60 9.087 -2.626 0.426 434 HD11 ILE 60 HD11 ILE 60 8.079 1.483 -2.092 435 HD12 ILE 60 HD12 ILE 60 6.420 1.742 -1.552 436 HD13 ILE 60 HD13 ILE 60 6.838 0.285 -2.452 437 H GLU 61 HN GLU 61 10.850 -0.922 1.500 438 HA GLU 61 HA GLU 61 10.064 1.317 3.044 439 HB2 GLU 61 HB2 GLU 61 11.355 0.130 4.844 440 HB3 GLU 61 HB1 GLU 61 10.113 -0.838 4.066 441 HG2 GLU 61 HG2 GLU 61 11.750 -1.995 2.755 442 HG3 GLU 61 HG1 GLU 61 13.018 -0.925 3.330 443 H ASP 62 HN ASP 62 13.076 0.346 1.526 444 HA ASP 62 HA ASP 62 14.552 2.460 2.887 445 HB2 ASP 62 HB2 ASP 62 15.469 0.368 0.900 446 HB3 ASP 62 HB1 ASP 62 16.523 1.555 1.660 447 H GLU 63 HN GLU 63 12.967 1.855 -0.095 448 HA GLU 63 HA GLU 63 14.496 3.640 -1.697 449 HB2 GLU 63 HB2 GLU 63 13.131 1.741 -2.579 450 HB3 GLU 63 HB1 GLU 63 11.685 2.655 -2.177 451 HG2 GLU 63 HG2 GLU 63 12.237 2.854 -4.528 452 HG3 GLU 63 HG1 GLU 63 12.343 4.407 -3.710 453 H CYS 64 HN CYS 64 11.507 3.925 0.162 454 HA CYS 64 HA CYS 64 11.332 6.726 -0.698 455 HB2 CYS 64 HB2 CYS 64 8.980 6.634 -0.209 456 HB3 CYS 64 HB1 CYS 64 9.390 5.220 -1.179 457 H LYS 65 HN LYS 65 10.758 8.333 0.890 458 HA LYS 65 HA LYS 65 11.804 7.696 3.548 459 HB2 LYS 65 HB2 LYS 65 12.747 9.636 2.251 460 HB3 LYS 65 HB1 LYS 65 11.178 10.417 2.369 461 HG2 LYS 65 HG2 LYS 65 12.698 11.303 4.026 462 HG3 LYS 65 HG1 LYS 65 11.384 10.425 4.813 463 HD2 LYS 65 HD2 LYS 65 13.450 9.850 5.896 464 HD3 LYS 65 HD1 LYS 65 12.880 8.455 4.985 465 HE2 LYS 65 HE2 LYS 65 14.430 9.035 3.164 466 HE3 LYS 65 HE1 LYS 65 15.024 10.388 4.124 467 HZ1 LYS 65 HZ1 LYS 65 15.758 8.817 5.808 468 HZ2 LYS 65 HZ2 LYS 65 16.472 8.471 4.317 469 HZ3 LYS 65 HZ3 LYS 65 15.193 7.521 4.881 470 H ASN 66 HN ASN 66 9.646 6.483 3.415 471 HA ASN 66 HA ASN 66 7.497 8.094 4.596 472 HB2 ASN 66 HB2 ASN 66 7.267 6.191 2.264 473 HB3 ASN 66 HB1 ASN 66 5.880 6.824 3.140 474 HD21 ASN 66 HD21 ASN 66 5.154 8.840 2.681 475 HD22 ASN 66 HD22 ASN 66 5.818 9.846 1.443 476 H THR 67 HN THR 67 5.629 6.162 4.943 477 HA THR 67 HA THR 67 7.048 4.061 6.409 478 HB THR 67 HB THR 67 4.128 4.822 6.642 479 HG1 THR 67 HG1 THR 67 6.457 5.805 7.872 480 HG21 THR 67 HG21 THR 67 4.493 2.583 7.381 481 HG22 THR 67 HG22 THR 67 4.401 3.587 8.831 482 HG23 THR 67 HG23 THR 67 5.970 3.038 8.229 483 HA PRO 68 HA PRO 68 5.713 1.357 3.160 484 HB2 PRO 68 HB2 PRO 68 6.854 -0.895 4.168 485 HB3 PRO 68 HB1 PRO 68 7.770 0.357 3.332 486 HG2 PRO 68 HG2 PRO 68 7.627 -0.266 6.215 487 HG3 PRO 68 HG1 PRO 68 8.940 0.476 5.284 488 HD2 PRO 68 HD2 PRO 68 7.091 1.799 6.936 489 HD3 PRO 68 HD1 PRO 68 8.202 2.551 5.789 490 H THR 69 HN THR 69 3.814 0.354 2.934 491 HA THR 69 HA THR 69 2.640 -0.893 5.325 492 HB THR 69 HB THR 69 0.416 -0.017 4.590 493 HG1 THR 69 HG1 THR 69 2.071 1.218 2.670 494 HG21 THR 69 HG21 THR 69 2.524 2.042 5.255 495 HG22 THR 69 HG22 THR 69 1.568 1.102 6.401 496 HG23 THR 69 HG23 THR 69 0.785 2.302 5.378 497 H CYS 70 HN CYS 70 1.256 -2.600 4.992 498 HA CYS 70 HA CYS 70 1.344 -3.859 2.339 499 HB2 CYS 70 HB2 CYS 70 2.042 -5.222 4.275 500 HB3 CYS 70 HB1 CYS 70 0.486 -4.944 5.042 501 H CYS 71 HN CYS 71 -0.262 -2.918 1.161 502 HA CYS 71 HA CYS 71 -2.801 -2.267 2.407 503 HB2 CYS 71 HB2 CYS 71 -1.969 -1.948 -0.483 504 HB3 CYS 71 HB1 CYS 71 -3.366 -1.221 0.293 505 H GLU 72 HN GLU 72 -4.699 -3.268 2.067 506 HA GLU 72 HA GLU 72 -4.839 -5.899 1.084 507 HB2 GLU 72 HB2 GLU 72 -6.498 -4.093 2.442 508 HB3 GLU 72 HB1 GLU 72 -7.361 -4.480 0.961 509 HG2 GLU 72 HG2 GLU 72 -7.231 -6.831 1.484 510 HG3 GLU 72 HG1 GLU 72 -6.298 -6.474 2.936 511 H ASP 73 HN ASP 73 -5.720 -2.772 -0.233 512 HA ASP 73 HA ASP 73 -5.283 -3.660 -2.961 513 HB2 ASP 73 HB2 ASP 73 -7.949 -2.626 -2.002 514 HB3 ASP 73 HB1 ASP 73 -7.463 -2.624 -3.692 515 H VAL 74 HN VAL 74 -5.428 -1.696 -4.453 516 HA VAL 74 HA VAL 74 -5.155 0.848 -3.044 517 HB VAL 74 HB VAL 74 -3.114 0.302 -5.174 518 HG11 VAL 74 HG11 VAL 74 -1.810 1.905 -3.864 519 HG12 VAL 74 HG12 VAL 74 -3.125 2.006 -2.697 520 HG13 VAL 74 HG13 VAL 74 -3.375 2.555 -4.353 521 HG21 VAL 74 HG21 VAL 74 -1.486 -0.481 -3.543 522 HG22 VAL 74 HG22 VAL 74 -2.848 -1.595 -3.648 523 HG23 VAL 74 HG23 VAL 74 -2.724 -0.480 -2.286 524 H GLU 75 HN GLU 75 -5.383 2.693 -4.484 525 HA GLU 75 HA GLU 75 -6.570 2.017 -7.096 526 HB2 GLU 75 HB2 GLU 75 -8.277 2.843 -5.535 527 HB3 GLU 75 HB1 GLU 75 -7.323 4.288 -5.245 528 HG2 GLU 75 HG2 GLU 75 -7.664 5.061 -7.463 529 HG3 GLU 75 HG1 GLU 75 -8.380 3.529 -7.948 530 H ASP 76 HN ASP 76 -6.275 3.615 -8.776 531 HA ASP 76 HA ASP 76 -5.032 5.001 -10.070 532 HB2 ASP 76 HB2 ASP 76 -4.131 6.114 -7.403 533 HB3 ASP 76 HB1 ASP 76 -3.623 6.779 -8.950 534 H ASP 77 HN ASP 77 -2.305 5.917 -9.412 535 HA ASP 77 HA ASP 77 -0.870 3.513 -10.048 536 HB2 ASP 77 HB2 ASP 77 1.105 4.918 -10.107 537 HB3 ASP 77 HB1 ASP 77 -0.209 5.753 -10.926 538 H GLY 78 HN GLY 78 -2.187 4.541 -7.285 539 HA2 GLY 78 HA2 GLY 78 -1.768 3.037 -5.384 540 HA3 GLY 78 HA1 GLY 78 -0.064 3.352 -5.621 541 H LEU 79 HN LEU 79 -2.356 5.943 -5.978 542 HA LEU 79 HA LEU 79 -1.093 7.385 -3.831 543 HB2 LEU 79 HB2 LEU 79 -3.449 8.124 -5.558 544 HB3 LEU 79 HB1 LEU 79 -2.662 9.194 -4.410 545 HG LEU 79 HG LEU 79 -1.396 8.018 -6.892 546 HD11 LEU 79 HD11 LEU 79 -2.292 10.825 -6.260 547 HD12 LEU 79 HD12 LEU 79 -3.052 9.720 -7.404 548 HD13 LEU 79 HD13 LEU 79 -1.424 10.322 -7.710 549 HD21 LEU 79 HD21 LEU 79 -0.312 9.959 -4.858 550 HD22 LEU 79 HD22 LEU 79 0.469 9.529 -6.378 551 HD23 LEU 79 HD23 LEU 79 0.242 8.309 -5.128 552 H VAL 80 HN VAL 80 -3.967 5.497 -4.197 553 HA VAL 80 HA VAL 80 -4.798 6.326 -1.495 554 HB VAL 80 HB VAL 80 -6.645 5.622 -3.786 555 HG11 VAL 80 HG11 VAL 80 -7.267 6.467 -0.959 556 HG12 VAL 80 HG12 VAL 80 -7.525 4.865 -1.651 557 HG13 VAL 80 HG13 VAL 80 -8.450 6.243 -2.248 558 HG21 VAL 80 HG21 VAL 80 -7.371 7.959 -3.656 559 HG22 VAL 80 HG22 VAL 80 -5.655 7.838 -4.050 560 HG23 VAL 80 HG23 VAL 80 -6.156 8.267 -2.415 561 H GLY 81 HN GLY 81 -4.341 4.672 -0.203 562 HA2 GLY 81 HA2 GLY 81 -4.472 1.968 -1.341 563 HA3 GLY 81 HA1 GLY 81 -3.513 2.436 0.052 564 H ILE 82 HN ILE 82 -5.513 0.313 -0.393 565 HA ILE 82 HA ILE 82 -7.600 1.059 1.521 566 HB ILE 82 HB ILE 82 -7.360 -1.086 -0.557 567 HG12 ILE 82 HG12 ILE 82 -9.698 -0.353 -1.047 568 HG13 ILE 82 HG11 ILE 82 -9.542 0.858 0.218 569 HG21 ILE 82 HG21 ILE 82 -7.910 -2.297 1.488 570 HG22 ILE 82 HG22 ILE 82 -9.266 -2.286 0.359 571 HG23 ILE 82 HG23 ILE 82 -9.279 -1.217 1.762 572 HD11 ILE 82 HD11 ILE 82 -7.883 0.699 -2.285 573 HD12 ILE 82 HD12 ILE 82 -7.727 1.913 -1.016 574 HD13 ILE 82 HD13 ILE 82 -9.205 1.826 -1.976 575 H ASN 83 HN ASN 83 -7.195 0.619 3.552 576 HA ASN 83 HA ASN 83 -6.631 -0.484 5.459 577 HB2 ASN 83 HB2 ASN 83 -6.911 -2.824 3.581 578 HB3 ASN 83 HB1 ASN 83 -6.576 -3.036 5.289 579 HD21 ASN 83 HD21 ASN 83 -8.896 -3.866 3.720 580 HD22 ASN 83 HD22 ASN 83 -10.260 -3.122 4.477 581 H CYS 84 HN CYS 84 -4.545 0.722 4.192 582 HA CYS 84 HA CYS 84 -2.329 -1.070 3.886 583 HB2 CYS 84 HB2 CYS 84 -2.396 1.945 4.068 584 HB3 CYS 84 HB1 CYS 84 -1.012 0.980 3.568 585 H THR 85 HN THR 85 -1.925 -2.139 5.750 586 HA THR 85 HA THR 85 -1.565 -0.690 8.242 587 HB THR 85 HB THR 85 -1.089 -3.624 7.671 588 HG1 THR 85 HG1 THR 85 -3.412 -2.170 7.901 589 HG21 THR 85 HG21 THR 85 -1.632 -2.147 10.251 590 HG22 THR 85 HG22 THR 85 -0.079 -2.819 9.753 591 HG23 THR 85 HG23 THR 85 -1.439 -3.892 10.085 592 HA PRO 86 HA PRO 86 2.782 0.040 7.502 593 HB2 PRO 86 HB2 PRO 86 2.869 0.208 10.463 594 HB3 PRO 86 HB1 PRO 86 3.374 1.395 9.256 595 HG2 PRO 86 HG2 PRO 86 1.148 1.774 10.656 596 HG3 PRO 86 HG1 PRO 86 1.200 2.168 8.928 597 HD2 PRO 86 HD2 PRO 86 0.037 -0.235 10.285 598 HD3 PRO 86 HD1 PRO 86 -0.628 0.758 8.973 599 H ILE 87 HN ILE 87 3.991 -1.661 6.986 600 HA ILE 87 HA ILE 87 4.002 -4.042 8.587 601 HB ILE 87 HB ILE 87 5.699 -4.778 6.813 602 HG12 ILE 87 HG12 ILE 87 4.569 -2.363 5.392 603 HG13 ILE 87 HG11 ILE 87 6.206 -2.467 6.027 604 HG21 ILE 87 HG21 ILE 87 3.410 -5.549 6.905 605 HG22 ILE 87 HG22 ILE 87 3.913 -5.295 5.234 606 HG23 ILE 87 HG23 ILE 87 2.873 -4.112 6.032 607 HD11 ILE 87 HD11 ILE 87 6.669 -4.322 4.500 608 HD12 ILE 87 HD12 ILE 87 6.170 -2.864 3.641 609 HD13 ILE 87 HD13 ILE 87 5.031 -4.193 3.860 610 HA PRO 88 HA PRO 88 7.573 -2.964 10.941 611 HB2 PRO 88 HB2 PRO 88 7.988 -5.846 11.283 612 HB3 PRO 88 HB1 PRO 88 7.599 -4.628 12.495 613 HG2 PRO 88 HG2 PRO 88 5.800 -6.446 11.771 614 HG3 PRO 88 HG1 PRO 88 5.328 -4.763 12.083 615 HD2 PRO 88 HD2 PRO 88 5.899 -6.089 9.448 616 HD3 PRO 88 HD1 PRO 88 4.486 -5.122 9.917 617 H LEU 89 HN LEU 89 9.706 -2.825 10.682 618 HA LEU 89 HA LEU 89 10.827 -3.898 8.214 619 HB2 LEU 89 HB2 LEU 89 12.084 -1.996 10.185 620 HB3 LEU 89 HB1 LEU 89 12.563 -2.268 8.521 621 HG LEU 89 HG LEU 89 10.027 -0.922 9.448 622 HD11 LEU 89 HD11 LEU 89 11.992 0.472 9.703 623 HD12 LEU 89 HD12 LEU 89 10.990 1.056 8.374 624 HD13 LEU 89 HD13 LEU 89 12.462 0.146 8.035 625 HD21 LEU 89 HD21 LEU 89 9.608 -2.211 7.434 626 HD22 LEU 89 HD22 LEU 89 11.013 -1.481 6.656 627 HD23 LEU 89 HD23 LEU 89 9.619 -0.486 7.074 628 H ILE 90 HN ILE 90 10.322 -5.695 10.385 629 HA ILE 90 HA ILE 90 13.053 -6.473 11.087 630 HB ILE 90 HB ILE 90 12.204 -7.092 13.379 631 HG12 ILE 90 HG12 ILE 90 9.922 -5.265 12.585 632 HG13 ILE 90 HG11 ILE 90 9.797 -6.988 12.920 633 HG21 ILE 90 HG21 ILE 90 12.315 -4.188 12.571 634 HG22 ILE 90 HG22 ILE 90 13.663 -5.209 13.080 635 HG23 ILE 90 HG23 ILE 90 12.409 -4.765 14.238 636 HD11 ILE 90 HD11 ILE 90 10.451 -6.582 15.235 637 HD12 ILE 90 HD12 ILE 90 9.010 -5.667 14.791 638 HD13 ILE 90 HD13 ILE 90 10.572 -4.857 14.895 Start of MODEL 17 1 H1 GLY 1 HT1 GLY 1 1.923 0.425 -6.888 2 H2 GLY 1 HT2 GLY 1 3.476 -0.236 -6.930 3 H3 GLY 1 HT3 GLY 1 3.236 1.321 -6.318 4 HA2 GLY 1 HA1 GLY 1 3.576 -0.265 -4.527 5 HA3 GLY 1 HA2 GLY 1 1.978 0.467 -4.468 6 H SER 2 HN SER 2 3.299 -2.173 -6.462 7 HA SER 2 HA SER 2 1.585 -4.099 -5.155 8 HB2 SER 2 HB2 SER 2 0.062 -3.004 -6.764 9 HB3 SER 2 HB1 SER 2 1.179 -3.383 -8.071 10 HG SER 2 HG SER 2 -0.035 -5.103 -8.202 11 H GLY 3 HN GLY 3 2.606 -6.004 -5.110 12 HA2 GLY 3 HA2 GLY 3 3.786 -7.829 -5.979 13 HA3 GLY 3 HA1 GLY 3 4.237 -6.848 -7.365 14 H TRP 4 HN TRP 4 4.664 -5.710 -4.110 15 HA TRP 4 HA TRP 4 7.464 -5.299 -4.597 16 HB2 TRP 4 HB2 TRP 4 5.562 -4.611 -2.406 17 HB3 TRP 4 HB1 TRP 4 7.291 -4.557 -2.078 18 HD1 TRP 4 HD1 TRP 4 4.543 -2.511 -3.472 19 HE1 TRP 4 HE1 TRP 4 5.494 -0.371 -4.539 20 HE3 TRP 4 HE3 TRP 4 9.486 -3.791 -3.604 21 HZ2 TRP 4 HZ2 TRP 4 8.002 0.637 -5.338 22 HZ3 TRP 4 HZ3 TRP 4 11.096 -2.184 -4.538 23 HH2 TRP 4 HH2 TRP 4 10.368 -0.014 -5.385 24 H GLU 5 HN GLU 5 9.108 -5.911 -3.025 25 HA GLU 5 HA GLU 5 9.177 -8.719 -2.727 26 HB2 GLU 5 HB2 GLU 5 10.998 -6.583 -1.603 27 HB3 GLU 5 HB1 GLU 5 11.338 -8.306 -1.572 28 HG2 GLU 5 HG2 GLU 5 10.962 -6.663 -4.067 29 HG3 GLU 5 HG1 GLU 5 12.515 -7.127 -3.376 30 H SER 6 HN SER 6 8.007 -9.754 -1.308 31 HA SER 6 HA SER 6 7.372 -8.552 1.271 32 HB2 SER 6 HB2 SER 6 6.340 -11.102 0.002 33 HB3 SER 6 HB1 SER 6 5.718 -10.344 1.469 34 HG SER 6 HG SER 6 5.798 -9.058 -1.061 35 H LYS 7 HN LYS 7 10.027 -9.562 0.566 36 HA LYS 7 HA LYS 7 10.846 -11.929 1.576 37 HB2 LYS 7 HB2 LYS 7 12.422 -10.508 0.580 38 HB3 LYS 7 HB1 LYS 7 12.078 -9.224 1.713 39 HG2 LYS 7 HG2 LYS 7 14.255 -10.252 2.121 40 HG3 LYS 7 HG1 LYS 7 13.166 -10.443 3.492 41 HD2 LYS 7 HD2 LYS 7 14.338 -12.513 3.106 42 HD3 LYS 7 HD1 LYS 7 12.629 -12.712 2.711 43 HE2 LYS 7 HE2 LYS 7 13.119 -12.479 0.350 44 HE3 LYS 7 HE1 LYS 7 14.816 -12.169 0.708 45 HZ1 LYS 7 HZ1 LYS 7 14.415 -14.458 0.003 46 HZ2 LYS 7 HZ2 LYS 7 13.383 -14.696 1.319 47 HZ3 LYS 7 HZ3 LYS 7 15.026 -14.393 1.578 48 H THR 8 HN THR 8 10.251 -9.028 3.502 49 HA THR 8 HA THR 8 11.026 -10.071 5.986 50 HB THR 8 HB THR 8 9.497 -8.233 6.900 51 HG1 THR 8 HG1 THR 8 9.419 -6.971 4.472 52 HG21 THR 8 HG21 THR 8 11.900 -7.922 6.590 53 HG22 THR 8 HG22 THR 8 11.019 -6.452 6.172 54 HG23 THR 8 HG23 THR 8 11.636 -7.504 4.898 55 H GLY 9 HN GLY 9 8.162 -10.554 4.131 56 HA2 GLY 9 HA2 GLY 9 6.367 -11.961 4.523 57 HA3 GLY 9 HA1 GLY 9 7.057 -12.345 6.093 58 H SER 10 HN SER 10 6.966 -9.062 5.731 59 HA SER 10 HA SER 10 5.032 -8.748 7.774 60 HB2 SER 10 HB2 SER 10 6.270 -6.639 5.994 61 HB3 SER 10 HB1 SER 10 5.469 -6.366 7.541 62 HG SER 10 HG SER 10 7.810 -6.462 7.639 63 H CYS 11 HN CYS 11 4.691 -9.056 4.402 64 HA CYS 11 HA CYS 11 1.946 -8.025 4.619 65 HB2 CYS 11 HB2 CYS 11 3.410 -6.404 3.400 66 HB3 CYS 11 HB1 CYS 11 3.735 -7.656 2.206 67 H ASN 12 HN ASN 12 0.409 -9.181 3.597 68 HA ASN 12 HA ASN 12 1.191 -11.851 2.743 69 HB2 ASN 12 HB2 ASN 12 -1.338 -12.247 2.935 70 HB3 ASN 12 HB1 ASN 12 -0.433 -11.968 4.418 71 HD21 ASN 12 HD21 ASN 12 -2.140 -11.226 5.584 72 HD22 ASN 12 HD22 ASN 12 -2.938 -9.724 5.268 73 H THR 13 HN THR 13 -0.258 -8.956 1.455 74 HA THR 13 HA THR 13 -1.275 -10.336 -0.886 75 HB THR 13 HB THR 13 -1.916 -7.936 -1.554 76 HG1 THR 13 HG1 THR 13 -1.861 -6.429 0.122 77 HG21 THR 13 HG21 THR 13 -3.862 -7.950 -0.054 78 HG22 THR 13 HG22 THR 13 -3.070 -9.160 0.956 79 HG23 THR 13 HG23 THR 13 -3.529 -9.557 -0.699 80 H GLY 14 HN GLY 14 1.421 -8.335 0.012 81 HA2 GLY 14 HA2 GLY 14 3.412 -8.104 -1.212 82 HA3 GLY 14 HA1 GLY 14 2.578 -8.711 -2.638 83 H LYS 15 HN LYS 15 0.600 -6.490 -1.233 84 HA LYS 15 HA LYS 15 1.471 -4.416 -3.095 85 HB2 LYS 15 HB2 LYS 15 -1.111 -5.159 -1.844 86 HB3 LYS 15 HB1 LYS 15 -0.839 -3.440 -2.100 87 HG2 LYS 15 HG2 LYS 15 -0.542 -3.765 -4.445 88 HG3 LYS 15 HG1 LYS 15 -0.562 -5.518 -4.255 89 HD2 LYS 15 HD2 LYS 15 -2.859 -5.549 -3.767 90 HD3 LYS 15 HD1 LYS 15 -2.898 -3.812 -3.446 91 HE2 LYS 15 HE2 LYS 15 -2.749 -3.269 -5.706 92 HE3 LYS 15 HE1 LYS 15 -2.151 -4.865 -6.151 93 HZ1 LYS 15 HZ1 LYS 15 -4.917 -4.164 -5.311 94 HZ2 LYS 15 HZ2 LYS 15 -4.365 -5.745 -5.576 95 HZ3 LYS 15 HZ3 LYS 15 -4.404 -4.641 -6.853 96 H LEU 16 HN LEU 16 3.233 -3.672 -1.945 97 HA LEU 16 HA LEU 16 2.746 -2.432 0.637 98 HB2 LEU 16 HB2 LEU 16 5.244 -2.991 -0.952 99 HB3 LEU 16 HB1 LEU 16 5.252 -1.973 0.467 100 HG LEU 16 HG LEU 16 4.412 -3.896 1.800 101 HD11 LEU 16 HD11 LEU 16 4.546 -6.129 0.860 102 HD12 LEU 16 HD12 LEU 16 4.938 -5.445 -0.718 103 HD13 LEU 16 HD13 LEU 16 3.360 -5.138 0.009 104 HD21 LEU 16 HD21 LEU 16 6.541 -5.091 1.853 105 HD22 LEU 16 HD22 LEU 16 6.788 -3.348 1.742 106 HD23 LEU 16 HD23 LEU 16 6.991 -4.361 0.312 107 H ALA 17 HN ALA 17 2.691 -0.253 0.908 108 HA ALA 17 HA ALA 17 3.637 1.442 -1.281 109 HB1 ALA 17 HB1 ALA 17 1.252 1.256 -1.671 110 HB2 ALA 17 HB2 ALA 17 1.651 2.887 -1.116 111 HB3 ALA 17 HB3 ALA 17 0.921 1.725 -0.003 112 H CYS 18 HN CYS 18 4.480 3.367 -0.649 113 HA CYS 18 HA CYS 18 4.994 3.774 2.161 114 HB2 CYS 18 HB2 CYS 18 5.658 5.614 -0.150 115 HB3 CYS 18 HB1 CYS 18 6.407 5.586 1.443 116 H CYS 19 HN CYS 19 3.316 4.535 3.333 117 HA CYS 19 HA CYS 19 1.577 6.514 2.035 118 HB2 CYS 19 HB2 CYS 19 0.687 4.301 3.881 119 HB3 CYS 19 HB1 CYS 19 -0.353 5.493 3.108 120 H ASP 20 HN ASP 20 0.421 7.932 3.420 121 HA ASP 20 HA ASP 20 1.890 8.502 5.900 122 HB2 ASP 20 HB2 ASP 20 0.207 10.219 4.083 123 HB3 ASP 20 HB1 ASP 20 0.688 10.755 5.684 124 H THR 21 HN THR 21 0.930 7.959 7.731 125 HA THR 21 HA THR 21 -1.763 6.943 7.648 126 HB THR 21 HB THR 21 -1.349 6.331 10.025 127 HG1 THR 21 HG1 THR 21 0.131 7.608 10.909 128 HG21 THR 21 HG21 THR 21 0.367 4.642 9.555 129 HG22 THR 21 HG22 THR 21 0.822 5.510 8.088 130 HG23 THR 21 HG23 THR 21 -0.777 4.778 8.220 131 H ASN 22 HN ASN 22 -0.491 9.970 8.095 132 HA ASN 22 HA ASN 22 -2.549 10.828 9.986 133 HB2 ASN 22 HB2 ASN 22 -1.353 12.919 10.105 134 HB3 ASN 22 HB1 ASN 22 -0.197 11.610 10.274 135 HD21 ASN 22 HD21 ASN 22 0.067 14.427 9.374 136 HD22 ASN 22 HD22 ASN 22 0.867 14.329 7.843 137 H LYS 23 HN LYS 23 -1.768 10.694 6.714 138 HA LYS 23 HA LYS 23 -3.843 12.629 5.986 139 HB2 LYS 23 HB2 LYS 23 -1.438 11.546 4.603 140 HB3 LYS 23 HB1 LYS 23 -2.785 12.097 3.635 141 HG2 LYS 23 HG2 LYS 23 -2.633 14.297 4.831 142 HG3 LYS 23 HG1 LYS 23 -1.152 13.692 5.579 143 HD2 LYS 23 HD2 LYS 23 -1.605 13.932 2.611 144 HD3 LYS 23 HD1 LYS 23 -0.689 15.078 3.601 145 HE2 LYS 23 HE2 LYS 23 0.927 13.455 4.149 146 HE3 LYS 23 HE1 LYS 23 -0.084 12.156 3.526 147 HZ1 LYS 23 HZ1 LYS 23 0.242 13.069 1.288 148 HZ2 LYS 23 HZ2 LYS 23 1.705 12.628 2.012 149 HZ3 LYS 23 HZ3 LYS 23 1.264 14.261 1.922 150 H LYS 24 HN LYS 24 -5.530 12.081 4.798 151 HA LYS 24 HA LYS 24 -6.023 9.205 4.447 152 HB2 LYS 24 HB2 LYS 24 -8.006 11.212 5.514 153 HB3 LYS 24 HB1 LYS 24 -8.253 9.477 5.340 154 HG2 LYS 24 HG2 LYS 24 -6.331 10.817 7.229 155 HG3 LYS 24 HG1 LYS 24 -7.882 10.096 7.652 156 HD2 LYS 24 HD2 LYS 24 -7.011 7.919 6.775 157 HD3 LYS 24 HD1 LYS 24 -5.439 8.697 6.595 158 HE2 LYS 24 HE2 LYS 24 -5.441 7.506 8.667 159 HE3 LYS 24 HE1 LYS 24 -5.493 9.230 9.023 160 HZ1 LYS 24 HZ1 LYS 24 -7.825 7.387 9.050 161 HZ2 LYS 24 HZ2 LYS 24 -7.874 9.043 9.398 162 HZ3 LYS 24 HZ3 LYS 24 -7.029 7.992 10.413 163 H VAL 25 HN VAL 25 -7.620 8.678 2.868 164 HA VAL 25 HA VAL 25 -8.039 10.821 0.878 165 HB VAL 25 HB VAL 25 -8.211 7.877 0.294 166 HG11 VAL 25 HG11 VAL 25 -7.831 8.590 -2.006 167 HG12 VAL 25 HG12 VAL 25 -7.737 10.266 -1.472 168 HG13 VAL 25 HG13 VAL 25 -9.247 9.372 -1.309 169 HG21 VAL 25 HG21 VAL 25 -5.919 7.941 -0.553 170 HG22 VAL 25 HG22 VAL 25 -5.967 8.288 1.172 171 HG23 VAL 25 HG23 VAL 25 -5.737 9.604 0.014 172 H GLN 26 HN GLN 26 -10.104 10.987 -0.091 173 HA GLN 26 HA GLN 26 -12.180 10.397 1.825 174 HB2 GLN 26 HB2 GLN 26 -12.359 11.944 -0.760 175 HB3 GLN 26 HB1 GLN 26 -13.516 11.951 0.554 176 HG2 GLN 26 HG2 GLN 26 -10.718 13.039 0.622 177 HG3 GLN 26 HG1 GLN 26 -12.217 13.968 0.613 178 HE21 GLN 26 HE21 GLN 26 -10.037 13.960 2.536 179 HE22 GLN 26 HE22 GLN 26 -10.739 13.551 4.061 180 H LYS 27 HN LYS 27 -11.444 9.665 -1.556 181 HA LYS 27 HA LYS 27 -13.788 7.924 -1.697 182 HB2 LYS 27 HB2 LYS 27 -11.811 8.749 -3.814 183 HB3 LYS 27 HB1 LYS 27 -13.193 7.692 -4.084 184 HG2 LYS 27 HG2 LYS 27 -14.596 9.627 -3.151 185 HG3 LYS 27 HG1 LYS 27 -13.160 10.613 -3.433 186 HD2 LYS 27 HD2 LYS 27 -14.548 8.926 -5.495 187 HD3 LYS 27 HD1 LYS 27 -14.744 10.672 -5.323 188 HE2 LYS 27 HE2 LYS 27 -12.334 10.957 -5.736 189 HE3 LYS 27 HE1 LYS 27 -12.178 9.216 -5.960 190 HZ1 LYS 27 HZ1 LYS 27 -12.336 10.371 -8.071 191 HZ2 LYS 27 HZ2 LYS 27 -13.829 11.032 -7.634 192 HZ3 LYS 27 HZ3 LYS 27 -13.674 9.363 -7.850 193 H SER 28 HN SER 28 -13.658 5.793 -1.457 194 HA SER 28 HA SER 28 -11.082 4.452 -1.788 195 HB2 SER 28 HB2 SER 28 -11.400 3.289 0.402 196 HB3 SER 28 HB1 SER 28 -11.123 5.023 0.569 197 HG SER 28 HG SER 28 -13.743 3.981 0.428 198 H THR 29 HN THR 29 -11.540 2.927 -3.256 199 HA THR 29 HA THR 29 -13.694 1.066 -2.583 200 HB THR 29 HB THR 29 -13.226 2.057 -5.399 201 HG1 THR 29 HG1 THR 29 -14.515 3.242 -3.420 202 HG21 THR 29 HG21 THR 29 -15.380 0.293 -4.221 203 HG22 THR 29 HG22 THR 29 -14.081 -0.230 -5.293 204 HG23 THR 29 HG23 THR 29 -15.326 0.868 -5.886 205 H GLY 30 HN GLY 30 -10.945 1.716 -4.688 206 HA2 GLY 30 HA2 GLY 30 -8.992 0.361 -4.748 207 HA3 GLY 30 HA1 GLY 30 -9.939 -0.989 -4.133 208 H GLU 31 HN GLU 31 -8.340 -1.503 -6.221 209 HA GLU 31 HA GLU 31 -10.069 -1.426 -8.592 210 HB2 GLU 31 HB2 GLU 31 -7.196 -2.348 -8.426 211 HB3 GLU 31 HB1 GLU 31 -8.124 -2.029 -9.885 212 HG2 GLU 31 HG2 GLU 31 -8.309 0.358 -9.087 213 HG3 GLU 31 HG1 GLU 31 -7.098 -0.053 -7.874 214 H GLU 32 HN GLU 32 -8.081 -3.662 -6.683 215 HA GLU 32 HA GLU 32 -9.342 -5.957 -7.905 216 HB2 GLU 32 HB2 GLU 32 -7.339 -5.797 -5.650 217 HB3 GLU 32 HB1 GLU 32 -7.853 -7.272 -6.457 218 HG2 GLU 32 HG2 GLU 32 -6.407 -4.980 -7.763 219 HG3 GLU 32 HG1 GLU 32 -5.674 -6.495 -7.243 220 H SER 33 HN SER 33 -9.188 -4.417 -4.720 221 HA SER 33 HA SER 33 -11.172 -6.170 -3.605 222 HB2 SER 33 HB2 SER 33 -11.147 -4.642 -1.681 223 HB3 SER 33 HB1 SER 33 -9.504 -5.048 -2.173 224 HG SER 33 HG SER 33 -9.499 -3.021 -3.345 225 H GLY 34 HN GLY 34 -11.149 -3.280 -5.457 226 HA2 GLY 34 HA2 GLY 34 -13.685 -2.250 -4.728 227 HA3 GLY 34 HA1 GLY 34 -12.776 -1.835 -6.170 228 H LEU 35 HN LEU 35 -12.659 -4.538 -7.199 229 HA LEU 35 HA LEU 35 -15.193 -4.632 -8.498 230 HB2 LEU 35 HB2 LEU 35 -13.120 -5.220 -9.654 231 HB3 LEU 35 HB1 LEU 35 -12.851 -6.541 -8.530 232 HG LEU 35 HG LEU 35 -14.969 -7.566 -9.353 233 HD11 LEU 35 HD11 LEU 35 -14.744 -5.430 -11.465 234 HD12 LEU 35 HD12 LEU 35 -16.030 -5.590 -10.269 235 HD13 LEU 35 HD13 LEU 35 -15.835 -6.814 -11.523 236 HD21 LEU 35 HD21 LEU 35 -13.983 -8.419 -11.427 237 HD22 LEU 35 HD22 LEU 35 -12.804 -8.352 -10.119 238 HD23 LEU 35 HD23 LEU 35 -12.788 -7.123 -11.382 239 H LEU 36 HN LEU 36 -13.769 -6.081 -5.737 240 HA LEU 36 HA LEU 36 -15.761 -8.196 -5.564 241 HB2 LEU 36 HB2 LEU 36 -13.316 -8.528 -5.007 242 HB3 LEU 36 HB1 LEU 36 -13.574 -7.508 -3.606 243 HG LEU 36 HG LEU 36 -15.255 -9.147 -2.775 244 HD11 LEU 36 HD11 LEU 36 -14.255 -10.821 -5.075 245 HD12 LEU 36 HD12 LEU 36 -15.873 -10.142 -4.915 246 HD13 LEU 36 HD13 LEU 36 -15.318 -11.371 -3.781 247 HD21 LEU 36 HD21 LEU 36 -12.495 -10.225 -3.320 248 HD22 LEU 36 HD22 LEU 36 -13.610 -10.828 -2.094 249 HD23 LEU 36 HD23 LEU 36 -12.964 -9.192 -1.971 250 H HIS 37 HN HIS 37 -16.843 -8.458 -3.368 251 HA HIS 37 HA HIS 37 -18.374 -6.199 -2.729 252 HB2 HIS 37 HB2 HIS 37 -19.159 -7.535 -0.765 253 HB3 HIS 37 HB1 HIS 37 -19.262 -8.392 -2.296 254 HD1 HIS 37 HD1 HIS 37 -18.029 -10.583 -2.482 255 HD2 HIS 37 HD2 HIS 37 -17.038 -8.454 0.947 256 HE1 HIS 37 HE1 HIS 37 -16.600 -12.131 -1.108 257 HE2 HIS 37 HE2 HIS 37 -16.180 -10.890 1.040 258 H THR 38 HN THR 38 -15.225 -6.996 -1.768 259 HA THR 38 HA THR 38 -15.133 -5.852 0.805 260 HB THR 38 HB THR 38 -12.627 -5.566 0.156 261 HG1 THR 38 HG1 THR 38 -13.083 -5.738 -2.138 262 HG21 THR 38 HG21 THR 38 -13.464 -7.357 1.592 263 HG22 THR 38 HG22 THR 38 -12.239 -7.973 0.482 264 HG23 THR 38 HG23 THR 38 -13.947 -8.285 0.172 265 H GLY 39 HN GLY 39 -15.305 -4.448 -2.337 266 HA2 GLY 39 HA2 GLY 39 -14.265 -1.878 -1.413 267 HA3 GLY 39 HA1 GLY 39 -14.724 -2.283 -3.059 268 H ASP 40 HN ASP 40 -17.050 -3.330 -0.883 269 HA ASP 40 HA ASP 40 -18.788 -1.096 -1.601 270 HB2 ASP 40 HB2 ASP 40 -19.184 -3.921 -1.004 271 HB3 ASP 40 HB1 ASP 40 -20.315 -2.887 -0.135 272 H VAL 41 HN VAL 41 -16.935 -2.222 0.994 273 HA VAL 41 HA VAL 41 -18.538 -0.831 2.990 274 HB VAL 41 HB VAL 41 -16.653 -1.624 4.560 275 HG11 VAL 41 HG11 VAL 41 -18.879 -2.596 4.563 276 HG12 VAL 41 HG12 VAL 41 -17.669 -3.865 4.745 277 HG13 VAL 41 HG13 VAL 41 -18.460 -3.619 3.189 278 HG21 VAL 41 HG21 VAL 41 -15.020 -2.185 2.846 279 HG22 VAL 41 HG22 VAL 41 -16.109 -3.407 2.189 280 HG23 VAL 41 HG23 VAL 41 -15.434 -3.605 3.805 281 H LEU 42 HN LEU 42 -18.018 1.071 3.872 282 HA LEU 42 HA LEU 42 -15.736 2.521 2.880 283 HB2 LEU 42 HB2 LEU 42 -18.031 3.155 4.688 284 HB3 LEU 42 HB1 LEU 42 -16.655 4.219 4.609 285 HG LEU 42 HG LEU 42 -18.372 5.089 3.186 286 HD11 LEU 42 HD11 LEU 42 -16.240 3.803 1.493 287 HD12 LEU 42 HD12 LEU 42 -16.083 5.320 2.375 288 HD13 LEU 42 HD13 LEU 42 -17.233 5.188 1.045 289 HD21 LEU 42 HD21 LEU 42 -19.252 3.812 1.276 290 HD22 LEU 42 HD22 LEU 42 -19.674 3.088 2.827 291 HD23 LEU 42 HD23 LEU 42 -18.384 2.389 1.850 292 H ASP 43 HN ASP 43 -16.193 0.204 5.065 293 HA ASP 43 HA ASP 43 -14.744 0.991 7.333 294 HB2 ASP 43 HB2 ASP 43 -16.142 -1.057 7.197 295 HB3 ASP 43 HB1 ASP 43 -14.957 -1.770 6.107 296 H GLN 44 HN GLN 44 -13.769 -0.093 4.158 297 HA GLN 44 HA GLN 44 -11.132 -0.730 4.452 298 HB2 GLN 44 HB2 GLN 44 -12.038 1.182 2.321 299 HB3 GLN 44 HB1 GLN 44 -10.737 0.023 2.231 300 HG2 GLN 44 HG2 GLN 44 -12.296 -1.807 2.194 301 HG3 GLN 44 HG1 GLN 44 -13.648 -0.696 2.416 302 HE21 GLN 44 HE21 GLN 44 -11.331 -1.972 0.181 303 HE22 GLN 44 HE22 GLN 44 -12.007 -1.272 -1.247 304 H VAL 45 HN VAL 45 -9.301 0.322 4.939 305 HA VAL 45 HA VAL 45 -9.543 3.117 5.786 306 HB VAL 45 HB VAL 45 -7.317 1.131 6.305 307 HG11 VAL 45 HG11 VAL 45 -6.471 3.415 6.240 308 HG12 VAL 45 HG12 VAL 45 -6.461 2.794 7.890 309 HG13 VAL 45 HG13 VAL 45 -7.717 3.922 7.380 310 HG21 VAL 45 HG21 VAL 45 -8.141 1.146 8.614 311 HG22 VAL 45 HG22 VAL 45 -9.372 0.569 7.489 312 HG23 VAL 45 HG23 VAL 45 -9.462 2.209 8.132 313 H ALA 46 HN ALA 46 -9.216 4.469 4.197 314 HA ALA 46 HA ALA 46 -7.151 3.881 2.197 315 HB1 ALA 46 HB1 ALA 46 -9.318 4.268 1.246 316 HB2 ALA 46 HB2 ALA 46 -8.285 5.652 0.866 317 HB3 ALA 46 HB3 ALA 46 -9.494 5.771 2.148 318 H ILE 47 HN ILE 47 -5.302 4.591 3.091 319 HA ILE 47 HA ILE 47 -5.226 7.395 3.933 320 HB ILE 47 HB ILE 47 -2.909 6.892 4.730 321 HG12 ILE 47 HG12 ILE 47 -3.741 4.022 4.228 322 HG13 ILE 47 HG11 ILE 47 -2.473 4.887 3.366 323 HG21 ILE 47 HG21 ILE 47 -5.099 5.232 5.954 324 HG22 ILE 47 HG22 ILE 47 -4.886 6.967 6.179 325 HG23 ILE 47 HG23 ILE 47 -3.657 5.844 6.768 326 HD11 ILE 47 HD11 ILE 47 -1.521 3.422 5.042 327 HD12 ILE 47 HD12 ILE 47 -2.477 4.207 6.299 328 HD13 ILE 47 HD13 ILE 47 -1.217 5.108 5.459 329 H GLN 48 HN GLN 48 -3.606 8.767 3.106 330 HA GLN 48 HA GLN 48 -3.409 8.463 0.244 331 HB2 GLN 48 HB2 GLN 48 -3.877 10.632 1.557 332 HB3 GLN 48 HB1 GLN 48 -2.147 10.655 1.885 333 HG2 GLN 48 HG2 GLN 48 -2.147 11.895 0.003 334 HG3 GLN 48 HG1 GLN 48 -2.042 10.294 -0.718 335 HE21 GLN 48 HE21 GLN 48 -2.950 10.906 -2.624 336 HE22 GLN 48 HE22 GLN 48 -4.629 11.294 -2.782 337 H CYS 49 HN CYS 49 -1.807 7.771 -0.865 338 HA CYS 49 HA CYS 49 0.668 7.110 0.556 339 HB2 CYS 49 HB2 CYS 49 -0.684 5.648 -1.711 340 HB3 CYS 49 HB1 CYS 49 0.807 5.171 -0.925 341 H THR 50 HN THR 50 2.602 7.024 -0.704 342 HA THR 50 HA THR 50 2.719 8.304 -3.265 343 HB THR 50 HB THR 50 2.509 10.362 -2.167 344 HG1 THR 50 HG1 THR 50 5.297 9.794 -2.356 345 HG21 THR 50 HG21 THR 50 3.678 10.975 -0.116 346 HG22 THR 50 HG22 THR 50 4.432 9.383 -0.061 347 HG23 THR 50 HG23 THR 50 2.686 9.537 0.130 348 H GLN 51 HN GLN 51 4.227 7.160 -4.244 349 HA GLN 51 HA GLN 51 6.451 6.126 -2.628 350 HB2 GLN 51 HB2 GLN 51 4.507 4.584 -3.501 351 HB3 GLN 51 HB1 GLN 51 5.401 4.658 -5.013 352 HG2 GLN 51 HG2 GLN 51 6.888 3.985 -2.543 353 HG3 GLN 51 HG1 GLN 51 5.822 2.764 -3.234 354 HE21 GLN 51 HE21 GLN 51 8.755 2.884 -2.999 355 HE22 GLN 51 HE22 GLN 51 9.366 2.684 -4.614 356 H ILE 52 HN ILE 52 8.434 6.436 -3.351 357 HA ILE 52 HA ILE 52 9.015 8.270 -5.398 358 HB ILE 52 HB ILE 52 10.742 6.371 -3.808 359 HG12 ILE 52 HG12 ILE 52 10.217 9.339 -3.671 360 HG13 ILE 52 HG11 ILE 52 9.788 8.118 -2.479 361 HG21 ILE 52 HG21 ILE 52 11.838 6.811 -5.971 362 HG22 ILE 52 HG22 ILE 52 12.720 7.504 -4.611 363 HG23 ILE 52 HG23 ILE 52 11.742 8.543 -5.646 364 HD11 ILE 52 HD11 ILE 52 12.216 7.729 -2.109 365 HD12 ILE 52 HD12 ILE 52 11.665 9.345 -1.674 366 HD13 ILE 52 HD13 ILE 52 12.545 9.088 -3.181 367 HA PRO 53 HA PRO 53 9.085 6.119 -9.305 368 HB2 PRO 53 HB2 PRO 53 11.833 6.911 -9.745 369 HB3 PRO 53 HB1 PRO 53 10.371 7.503 -10.534 370 HG2 PRO 53 HG2 PRO 53 11.882 8.656 -8.298 371 HG3 PRO 53 HG1 PRO 53 10.724 9.431 -9.390 372 HD2 PRO 53 HD2 PRO 53 10.152 8.955 -6.801 373 HD3 PRO 53 HD1 PRO 53 8.911 8.863 -8.069 374 H LEU 54 HN LEU 54 9.471 4.096 -9.816 375 HA LEU 54 HA LEU 54 10.576 2.348 -7.953 376 HB2 LEU 54 HB2 LEU 54 9.938 1.864 -10.860 377 HB3 LEU 54 HB1 LEU 54 10.226 0.612 -9.668 378 HG LEU 54 HG LEU 54 7.932 2.575 -9.632 379 HD11 LEU 54 HD11 LEU 54 6.555 0.620 -10.133 380 HD12 LEU 54 HD12 LEU 54 8.006 -0.375 -10.249 381 HD13 LEU 54 HD13 LEU 54 7.732 0.923 -11.412 382 HD21 LEU 54 HD21 LEU 54 8.585 1.962 -7.384 383 HD22 LEU 54 HD22 LEU 54 8.587 0.254 -7.824 384 HD23 LEU 54 HD23 LEU 54 7.075 1.159 -7.812 385 H LEU 55 HN LEU 55 12.568 1.743 -7.546 386 HA LEU 55 HA LEU 55 14.552 1.759 -9.722 387 HB2 LEU 55 HB2 LEU 55 14.957 1.649 -6.727 388 HB3 LEU 55 HB1 LEU 55 16.225 1.703 -7.930 389 HG LEU 55 HG LEU 55 14.240 3.899 -7.359 390 HD11 LEU 55 HD11 LEU 55 15.928 3.641 -5.621 391 HD12 LEU 55 HD12 LEU 55 16.167 5.128 -6.537 392 HD13 LEU 55 HD13 LEU 55 17.200 3.731 -6.839 393 HD21 LEU 55 HD21 LEU 55 16.507 3.750 -9.336 394 HD22 LEU 55 HD22 LEU 55 15.640 5.222 -8.912 395 HD23 LEU 55 HD23 LEU 55 14.790 3.896 -9.702 396 H ILE 56 HN ILE 56 14.675 -0.212 -10.637 397 HA ILE 56 HA ILE 56 13.368 -2.435 -9.479 398 HB ILE 56 HB ILE 56 15.316 -2.585 -11.767 399 HG12 ILE 56 HG12 ILE 56 12.368 -1.895 -11.865 400 HG13 ILE 56 HG11 ILE 56 13.681 -0.761 -12.160 401 HG21 ILE 56 HG21 ILE 56 12.887 -4.219 -11.050 402 HG22 ILE 56 HG22 ILE 56 14.567 -4.718 -10.870 403 HG23 ILE 56 HG23 ILE 56 13.896 -4.451 -12.478 404 HD11 ILE 56 HD11 ILE 56 13.072 -3.204 -13.808 405 HD12 ILE 56 HD12 ILE 56 14.359 -2.038 -14.113 406 HD13 ILE 56 HD13 ILE 56 12.672 -1.540 -14.232 407 H GLY 57 HN GLY 57 14.084 -4.118 -8.375 408 HA2 GLY 57 HA2 GLY 57 15.702 -5.680 -7.622 409 HA3 GLY 57 HA1 GLY 57 16.966 -4.527 -8.032 410 H ILE 58 HN ILE 58 14.946 -2.543 -6.635 411 HA ILE 58 HA ILE 58 16.180 -2.947 -4.011 412 HB ILE 58 HB ILE 58 15.766 -0.623 -5.678 413 HG12 ILE 58 HG12 ILE 58 17.920 -1.409 -4.779 414 HG13 ILE 58 HG11 ILE 58 17.584 0.261 -4.341 415 HG21 ILE 58 HG21 ILE 58 14.889 -0.377 -2.810 416 HG22 ILE 58 HG22 ILE 58 13.913 -0.078 -4.251 417 HG23 ILE 58 HG23 ILE 58 15.270 0.983 -3.872 418 HD11 ILE 58 HD11 ILE 58 18.541 -0.960 -2.475 419 HD12 ILE 58 HD12 ILE 58 17.230 -2.137 -2.553 420 HD13 ILE 58 HD13 ILE 58 16.887 -0.465 -2.113 421 H ALA 59 HN ALA 59 15.076 -2.561 -2.153 422 HA ALA 59 HA ALA 59 12.332 -3.460 -2.121 423 HB1 ALA 59 HB1 ALA 59 14.319 -2.757 0.030 424 HB2 ALA 59 HB2 ALA 59 13.909 -4.374 -0.544 425 HB3 ALA 59 HB3 ALA 59 12.713 -3.423 0.341 426 H ILE 60 HN ILE 60 10.583 -2.288 -1.537 427 HA ILE 60 HA ILE 60 10.446 0.414 -2.182 428 HB ILE 60 HB ILE 60 8.491 -1.052 -2.217 429 HG12 ILE 60 HG12 ILE 60 8.177 1.300 -0.334 430 HG13 ILE 60 HG11 ILE 60 8.147 1.372 -2.092 431 HG21 ILE 60 HG21 ILE 60 7.330 -1.456 0.033 432 HG22 ILE 60 HG22 ILE 60 8.908 -1.111 0.764 433 HG23 ILE 60 HG23 ILE 60 8.725 -2.457 -0.363 434 HD11 ILE 60 HD11 ILE 60 6.125 0.018 -2.114 435 HD12 ILE 60 HD12 ILE 60 5.915 1.489 -1.166 436 HD13 ILE 60 HD13 ILE 60 6.156 -0.057 -0.353 437 H GLU 61 HN GLU 61 10.802 -1.138 0.941 438 HA GLU 61 HA GLU 61 10.217 1.201 2.459 439 HB2 GLU 61 HB2 GLU 61 11.087 -0.201 4.366 440 HB3 GLU 61 HB1 GLU 61 9.750 -0.895 3.464 441 HG2 GLU 61 HG2 GLU 61 12.501 -1.630 2.652 442 HG3 GLU 61 HG1 GLU 61 11.866 -2.302 4.143 443 H ASP 62 HN ASP 62 12.950 0.145 0.786 444 HA ASP 62 HA ASP 62 14.660 2.028 2.276 445 HB2 ASP 62 HB2 ASP 62 15.513 -0.313 2.059 446 HB3 ASP 62 HB1 ASP 62 15.504 -0.119 0.310 447 H GLU 63 HN GLU 63 12.942 1.463 -0.599 448 HA GLU 63 HA GLU 63 14.452 3.139 -2.348 449 HB2 GLU 63 HB2 GLU 63 12.881 1.273 -3.035 450 HB3 GLU 63 HB1 GLU 63 11.552 2.329 -2.590 451 HG2 GLU 63 HG2 GLU 63 12.167 3.908 -4.276 452 HG3 GLU 63 HG1 GLU 63 13.623 2.995 -4.661 453 H CYS 64 HN CYS 64 11.594 3.524 -0.311 454 HA CYS 64 HA CYS 64 11.612 6.402 -0.918 455 HB2 CYS 64 HB2 CYS 64 9.308 6.481 -0.384 456 HB3 CYS 64 HB1 CYS 64 9.510 5.027 -1.354 457 H LYS 65 HN LYS 65 10.636 7.660 1.095 458 HA LYS 65 HA LYS 65 12.119 6.741 3.469 459 HB2 LYS 65 HB2 LYS 65 11.881 9.561 2.416 460 HB3 LYS 65 HB1 LYS 65 12.640 9.115 3.934 461 HG2 LYS 65 HG2 LYS 65 13.557 8.125 1.247 462 HG3 LYS 65 HG1 LYS 65 14.220 9.541 2.058 463 HD2 LYS 65 HD2 LYS 65 14.189 6.767 3.242 464 HD3 LYS 65 HD1 LYS 65 15.558 7.459 2.373 465 HE2 LYS 65 HE2 LYS 65 14.320 8.569 4.891 466 HE3 LYS 65 HE1 LYS 65 15.824 7.659 4.800 467 HZ1 LYS 65 HZ1 LYS 65 16.744 9.423 3.401 468 HZ2 LYS 65 HZ2 LYS 65 16.265 10.015 4.909 469 HZ3 LYS 65 HZ3 LYS 65 15.306 10.304 3.547 470 H ASN 66 HN ASN 66 9.236 6.558 2.712 471 HA ASN 66 HA ASN 66 8.149 8.053 5.005 472 HB2 ASN 66 HB2 ASN 66 6.842 7.210 2.431 473 HB3 ASN 66 HB1 ASN 66 5.884 7.557 3.860 474 HD21 ASN 66 HD21 ASN 66 7.850 8.883 1.343 475 HD22 ASN 66 HD22 ASN 66 7.517 10.545 1.680 476 H THR 67 HN THR 67 5.803 6.640 5.396 477 HA THR 67 HA THR 67 6.898 4.360 6.761 478 HB THR 67 HB THR 67 3.985 5.167 6.639 479 HG1 THR 67 HG1 THR 67 6.130 6.100 8.266 480 HG21 THR 67 HG21 THR 67 4.285 2.964 7.529 481 HG22 THR 67 HG22 THR 67 3.997 4.042 8.896 482 HG23 THR 67 HG23 THR 67 5.635 3.490 8.530 483 HA PRO 68 HA PRO 68 5.740 1.542 3.524 484 HB2 PRO 68 HB2 PRO 68 6.808 -0.662 4.668 485 HB3 PRO 68 HB1 PRO 68 7.799 0.575 3.894 486 HG2 PRO 68 HG2 PRO 68 7.376 0.021 6.772 487 HG3 PRO 68 HG1 PRO 68 8.788 0.703 5.952 488 HD2 PRO 68 HD2 PRO 68 6.821 2.125 7.371 489 HD3 PRO 68 HD1 PRO 68 8.059 2.812 6.316 490 H THR 69 HN THR 69 3.787 0.622 3.278 491 HA THR 69 HA THR 69 2.552 -0.611 5.643 492 HB THR 69 HB THR 69 0.375 0.307 4.974 493 HG1 THR 69 HG1 THR 69 1.908 1.609 2.948 494 HG21 THR 69 HG21 THR 69 0.769 2.676 5.520 495 HG22 THR 69 HG22 THR 69 2.497 2.439 5.262 496 HG23 THR 69 HG23 THR 69 1.678 1.600 6.580 497 H CYS 70 HN CYS 70 1.237 -2.386 5.268 498 HA CYS 70 HA CYS 70 1.369 -3.559 2.583 499 HB2 CYS 70 HB2 CYS 70 2.036 -5.053 4.383 500 HB3 CYS 70 HB1 CYS 70 0.535 -4.740 5.245 501 H CYS 71 HN CYS 71 -0.231 -3.004 1.297 502 HA CYS 71 HA CYS 71 -2.846 -2.332 2.436 503 HB2 CYS 71 HB2 CYS 71 -1.821 -1.951 -0.388 504 HB3 CYS 71 HB1 CYS 71 -3.290 -1.266 0.300 505 H GLU 72 HN GLU 72 -4.676 -3.423 1.928 506 HA GLU 72 HA GLU 72 -4.434 -6.059 0.862 507 HB2 GLU 72 HB2 GLU 72 -6.098 -6.122 2.390 508 HB3 GLU 72 HB1 GLU 72 -6.508 -4.423 2.174 509 HG2 GLU 72 HG2 GLU 72 -7.887 -4.883 0.360 510 HG3 GLU 72 HG1 GLU 72 -7.215 -6.491 0.129 511 H ASP 73 HN ASP 73 -5.195 -2.938 -0.315 512 HA ASP 73 HA ASP 73 -4.967 -3.809 -3.037 513 HB2 ASP 73 HB2 ASP 73 -7.410 -4.217 -2.437 514 HB3 ASP 73 HB1 ASP 73 -7.560 -2.476 -2.264 515 H VAL 74 HN VAL 74 -5.028 -1.860 -4.499 516 HA VAL 74 HA VAL 74 -4.760 0.676 -3.061 517 HB VAL 74 HB VAL 74 -2.760 0.086 -5.229 518 HG11 VAL 74 HG11 VAL 74 -1.514 1.850 -4.160 519 HG12 VAL 74 HG12 VAL 74 -2.687 1.924 -2.847 520 HG13 VAL 74 HG13 VAL 74 -3.163 2.392 -4.479 521 HG21 VAL 74 HG21 VAL 74 -1.099 -0.541 -3.550 522 HG22 VAL 74 HG22 VAL 74 -2.435 -1.691 -3.570 523 HG23 VAL 74 HG23 VAL 74 -2.333 -0.479 -2.291 524 H GLU 75 HN GLU 75 -5.501 2.408 -4.175 525 HA GLU 75 HA GLU 75 -6.772 1.837 -6.770 526 HB2 GLU 75 HB2 GLU 75 -8.150 2.458 -4.685 527 HB3 GLU 75 HB1 GLU 75 -7.497 4.073 -4.883 528 HG2 GLU 75 HG2 GLU 75 -8.491 4.204 -7.108 529 HG3 GLU 75 HG1 GLU 75 -9.153 2.582 -6.900 530 H ASP 76 HN ASP 76 -6.941 3.743 -8.240 531 HA ASP 76 HA ASP 76 -5.953 5.299 -9.577 532 HB2 ASP 76 HB2 ASP 76 -5.866 6.546 -7.209 533 HB3 ASP 76 HB1 ASP 76 -4.143 6.297 -7.417 534 H ASP 77 HN ASP 77 -3.206 6.278 -9.348 535 HA ASP 77 HA ASP 77 -1.773 4.079 -10.467 536 HB2 ASP 77 HB2 ASP 77 -1.295 6.418 -11.084 537 HB3 ASP 77 HB1 ASP 77 -0.751 6.741 -9.441 538 H GLY 78 HN GLY 78 -2.655 4.693 -7.376 539 HA2 GLY 78 HA2 GLY 78 -1.868 3.035 -5.721 540 HA3 GLY 78 HA1 GLY 78 -0.241 3.437 -6.234 541 H LEU 79 HN LEU 79 -2.611 5.947 -5.975 542 HA LEU 79 HA LEU 79 -1.063 7.215 -3.869 543 HB2 LEU 79 HB2 LEU 79 -3.598 8.247 -5.113 544 HB3 LEU 79 HB1 LEU 79 -2.365 9.162 -4.268 545 HG LEU 79 HG LEU 79 -2.150 7.893 -6.999 546 HD11 LEU 79 HD11 LEU 79 -3.431 9.942 -6.971 547 HD12 LEU 79 HD12 LEU 79 -1.869 10.217 -7.742 548 HD13 LEU 79 HD13 LEU 79 -2.146 10.768 -6.089 549 HD21 LEU 79 HD21 LEU 79 -0.059 9.389 -5.407 550 HD22 LEU 79 HD22 LEU 79 0.093 8.908 -7.096 551 HD23 LEU 79 HD23 LEU 79 -0.019 7.680 -5.836 552 H VAL 80 HN VAL 80 -3.859 5.299 -4.157 553 HA VAL 80 HA VAL 80 -4.749 6.115 -1.470 554 HB VAL 80 HB VAL 80 -6.523 5.176 -3.725 555 HG11 VAL 80 HG11 VAL 80 -7.394 4.595 -1.539 556 HG12 VAL 80 HG12 VAL 80 -8.363 5.878 -2.264 557 HG13 VAL 80 HG13 VAL 80 -7.198 6.261 -0.997 558 HG21 VAL 80 HG21 VAL 80 -5.694 7.350 -4.289 559 HG22 VAL 80 HG22 VAL 80 -6.024 7.949 -2.665 560 HG23 VAL 80 HG23 VAL 80 -7.359 7.522 -3.736 561 H GLY 81 HN GLY 81 -3.944 4.474 -0.252 562 HA2 GLY 81 HA2 GLY 81 -4.105 1.749 -1.282 563 HA3 GLY 81 HA1 GLY 81 -3.263 2.261 0.172 564 H ILE 82 HN ILE 82 -5.397 0.183 -0.513 565 HA ILE 82 HA ILE 82 -7.465 1.000 1.384 566 HB ILE 82 HB ILE 82 -7.319 -1.190 -0.673 567 HG12 ILE 82 HG12 ILE 82 -9.557 -0.234 -1.295 568 HG13 ILE 82 HG11 ILE 82 -9.290 1.028 -0.099 569 HG21 ILE 82 HG21 ILE 82 -9.410 -2.120 0.178 570 HG22 ILE 82 HG22 ILE 82 -9.340 -1.016 1.550 571 HG23 ILE 82 HG23 ILE 82 -8.105 -2.259 1.357 572 HD11 ILE 82 HD11 ILE 82 -8.754 1.796 -2.332 573 HD12 ILE 82 HD12 ILE 82 -7.577 0.490 -2.508 574 HD13 ILE 82 HD13 ILE 82 -7.317 1.762 -1.308 575 H ASN 83 HN ASN 83 -7.114 0.511 3.394 576 HA ASN 83 HA ASN 83 -6.702 -0.683 5.288 577 HB2 ASN 83 HB2 ASN 83 -6.951 -2.932 3.302 578 HB3 ASN 83 HB1 ASN 83 -6.644 -3.242 5.002 579 HD21 ASN 83 HD21 ASN 83 -8.957 -3.965 3.379 580 HD22 ASN 83 HD22 ASN 83 -10.317 -3.233 4.148 581 H CYS 84 HN CYS 84 -4.598 0.592 4.458 582 HA CYS 84 HA CYS 84 -2.346 -1.201 4.078 583 HB2 CYS 84 HB2 CYS 84 -2.412 1.814 4.274 584 HB3 CYS 84 HB1 CYS 84 -1.046 0.836 3.753 585 H THR 85 HN THR 85 -1.712 -2.195 5.872 586 HA THR 85 HA THR 85 -1.601 -0.752 8.408 587 HB THR 85 HB THR 85 -0.984 -3.654 7.797 588 HG1 THR 85 HG1 THR 85 -3.140 -3.454 7.495 589 HG21 THR 85 HG21 THR 85 0.104 -2.873 9.841 590 HG22 THR 85 HG22 THR 85 -1.219 -3.977 10.223 591 HG23 THR 85 HG23 THR 85 -1.432 -2.238 10.428 592 HA PRO 86 HA PRO 86 2.701 0.274 7.783 593 HB2 PRO 86 HB2 PRO 86 2.709 0.452 10.744 594 HB3 PRO 86 HB1 PRO 86 3.157 1.669 9.546 595 HG2 PRO 86 HG2 PRO 86 0.879 1.894 10.894 596 HG3 PRO 86 HG1 PRO 86 0.944 2.291 9.167 597 HD2 PRO 86 HD2 PRO 86 -0.080 -0.188 10.497 598 HD3 PRO 86 HD1 PRO 86 -0.784 0.757 9.174 599 H ILE 87 HN ILE 87 4.215 -1.194 7.419 600 HA ILE 87 HA ILE 87 4.160 -3.655 8.968 601 HB ILE 87 HB ILE 87 5.645 -4.462 7.060 602 HG12 ILE 87 HG12 ILE 87 4.509 -2.014 5.709 603 HG13 ILE 87 HG11 ILE 87 6.177 -2.152 6.246 604 HG21 ILE 87 HG21 ILE 87 2.811 -3.639 6.467 605 HG22 ILE 87 HG22 ILE 87 3.305 -5.081 7.357 606 HG23 ILE 87 HG23 ILE 87 3.716 -4.914 5.650 607 HD11 ILE 87 HD11 ILE 87 6.489 -4.044 4.719 608 HD12 ILE 87 HD12 ILE 87 6.006 -2.571 3.879 609 HD13 ILE 87 HD13 ILE 87 4.826 -3.851 4.166 610 HA PRO 88 HA PRO 88 8.140 -2.830 10.794 611 HB2 PRO 88 HB2 PRO 88 8.406 -5.735 11.025 612 HB3 PRO 88 HB1 PRO 88 8.266 -4.531 12.301 613 HG2 PRO 88 HG2 PRO 88 6.289 -6.246 11.802 614 HG3 PRO 88 HG1 PRO 88 5.959 -4.560 12.249 615 HD2 PRO 88 HD2 PRO 88 6.026 -5.795 9.513 616 HD3 PRO 88 HD1 PRO 88 4.776 -4.765 10.234 617 H LEU 89 HN LEU 89 10.308 -3.044 10.306 618 HA LEU 89 HA LEU 89 10.878 -3.953 7.598 619 HB2 LEU 89 HB2 LEU 89 12.668 -2.546 9.578 620 HB3 LEU 89 HB1 LEU 89 12.991 -2.777 7.869 621 HG LEU 89 HG LEU 89 10.795 -1.059 9.031 622 HD11 LEU 89 HD11 LEU 89 13.015 -0.102 9.332 623 HD12 LEU 89 HD12 LEU 89 12.092 0.803 8.133 624 HD13 LEU 89 HD13 LEU 89 13.350 -0.319 7.613 625 HD21 LEU 89 HD21 LEU 89 10.453 -0.326 6.711 626 HD22 LEU 89 HD22 LEU 89 10.096 -2.038 6.929 627 HD23 LEU 89 HD23 LEU 89 11.608 -1.543 6.168 628 H ILE 90 HN ILE 90 10.447 -5.740 9.966 629 HA ILE 90 HA ILE 90 13.050 -7.090 9.983 630 HB ILE 90 HB ILE 90 12.471 -7.833 12.322 631 HG12 ILE 90 HG12 ILE 90 10.455 -5.581 12.122 632 HG13 ILE 90 HG11 ILE 90 10.058 -7.291 12.241 633 HG21 ILE 90 HG21 ILE 90 14.155 -6.165 11.947 634 HG22 ILE 90 HG22 ILE 90 13.182 -5.670 13.331 635 HG23 ILE 90 HG23 ILE 90 12.932 -4.906 11.758 636 HD11 ILE 90 HD11 ILE 90 9.791 -6.165 14.371 637 HD12 ILE 90 HD12 ILE 90 11.482 -5.662 14.330 638 HD13 ILE 90 HD13 ILE 90 11.074 -7.373 14.452 Start of MODEL 18 1 H1 GLY 1 HT1 GLY 1 -0.247 -7.129 -8.823 2 H2 GLY 1 HT2 GLY 1 -1.274 -6.009 -8.090 3 H3 GLY 1 HT3 GLY 1 -1.492 -7.660 -7.810 4 HA2 GLY 1 HA1 GLY 1 -0.451 -6.676 -5.901 5 HA3 GLY 1 HA2 GLY 1 0.675 -7.760 -6.710 6 H SER 2 HN SER 2 2.577 -6.798 -6.157 7 HA SER 2 HA SER 2 3.249 -4.440 -7.649 8 HB2 SER 2 HB2 SER 2 4.118 -3.193 -5.673 9 HB3 SER 2 HB1 SER 2 2.365 -3.370 -5.657 10 HG SER 2 HG SER 2 2.899 -5.350 -4.317 11 H GLY 3 HN GLY 3 5.511 -4.154 -7.859 12 HA2 GLY 3 HA2 GLY 3 6.971 -6.635 -7.603 13 HA3 GLY 3 HA1 GLY 3 7.540 -5.156 -8.365 14 H TRP 4 HN TRP 4 6.671 -6.363 -5.138 15 HA TRP 4 HA TRP 4 9.085 -5.049 -4.096 16 HB2 TRP 4 HB2 TRP 4 6.322 -5.068 -2.884 17 HB3 TRP 4 HB1 TRP 4 7.769 -4.604 -1.995 18 HD1 TRP 4 HD1 TRP 4 5.104 -3.152 -4.062 19 HE1 TRP 4 HE1 TRP 4 5.697 -0.748 -4.764 20 HE3 TRP 4 HE3 TRP 4 10.042 -3.157 -2.799 21 HZ2 TRP 4 HZ2 TRP 4 7.973 0.922 -4.772 22 HZ3 TRP 4 HZ3 TRP 4 11.357 -1.120 -3.179 23 HH2 TRP 4 HH2 TRP 4 10.346 0.875 -4.149 24 H GLU 5 HN GLU 5 10.038 -6.023 -2.288 25 HA GLU 5 HA GLU 5 9.893 -8.866 -2.296 26 HB2 GLU 5 HB2 GLU 5 11.400 -6.897 -0.572 27 HB3 GLU 5 HB1 GLU 5 11.557 -8.638 -0.408 28 HG2 GLU 5 HG2 GLU 5 12.164 -7.084 -2.907 29 HG3 GLU 5 HG1 GLU 5 13.360 -7.633 -1.733 30 H SER 6 HN SER 6 8.161 -9.817 -1.464 31 HA SER 6 HA SER 6 7.293 -9.044 1.244 32 HB2 SER 6 HB2 SER 6 5.776 -10.684 -0.806 33 HB3 SER 6 HB1 SER 6 5.158 -10.088 0.736 34 HG SER 6 HG SER 6 6.151 -8.354 -1.264 35 H LYS 7 HN LYS 7 9.526 -10.806 0.169 36 HA LYS 7 HA LYS 7 8.919 -13.513 0.560 37 HB2 LYS 7 HB2 LYS 7 10.792 -12.929 -0.764 38 HB3 LYS 7 HB1 LYS 7 11.482 -11.986 0.535 39 HG2 LYS 7 HG2 LYS 7 12.629 -14.142 0.127 40 HG3 LYS 7 HG1 LYS 7 12.032 -13.945 1.775 41 HD2 LYS 7 HD2 LYS 7 10.047 -15.259 1.187 42 HD3 LYS 7 HD1 LYS 7 10.709 -15.516 -0.432 43 HE2 LYS 7 HE2 LYS 7 11.141 -17.439 1.009 44 HE3 LYS 7 HE1 LYS 7 12.643 -16.649 0.536 45 HZ1 LYS 7 HZ1 LYS 7 12.668 -15.527 2.690 46 HZ2 LYS 7 HZ2 LYS 7 12.677 -17.207 2.869 47 HZ3 LYS 7 HZ3 LYS 7 11.253 -16.339 3.142 48 H THR 8 HN THR 8 10.047 -11.037 2.731 49 HA THR 8 HA THR 8 10.695 -12.685 4.921 50 HB THR 8 HB THR 8 10.294 -10.571 6.275 51 HG1 THR 8 HG1 THR 8 10.143 -8.670 4.831 52 HG21 THR 8 HG21 THR 8 12.505 -11.161 5.447 53 HG22 THR 8 HG22 THR 8 12.254 -9.421 5.328 54 HG23 THR 8 HG23 THR 8 12.136 -10.429 3.887 55 H GLY 9 HN GLY 9 7.669 -11.625 3.637 56 HA2 GLY 9 HA2 GLY 9 5.606 -12.630 4.250 57 HA3 GLY 9 HA1 GLY 9 6.282 -12.985 5.834 58 H SER 10 HN SER 10 6.911 -9.854 4.638 59 HA SER 10 HA SER 10 5.659 -8.620 6.832 60 HB2 SER 10 HB2 SER 10 6.170 -6.500 5.459 61 HB3 SER 10 HB1 SER 10 7.534 -7.507 5.933 62 HG SER 10 HG SER 10 7.850 -7.186 3.806 63 H CYS 11 HN CYS 11 4.570 -9.253 3.582 64 HA CYS 11 HA CYS 11 2.063 -7.844 4.214 65 HB2 CYS 11 HB2 CYS 11 3.491 -6.622 2.560 66 HB3 CYS 11 HB1 CYS 11 3.353 -8.009 1.486 67 H ASN 12 HN ASN 12 0.178 -8.831 3.640 68 HA ASN 12 HA ASN 12 0.391 -11.651 2.942 69 HB2 ASN 12 HB2 ASN 12 -1.982 -11.787 3.641 70 HB3 ASN 12 HB1 ASN 12 -0.936 -11.153 4.903 71 HD21 ASN 12 HD21 ASN 12 -1.088 -8.975 5.477 72 HD22 ASN 12 HD22 ASN 12 -2.466 -8.021 5.048 73 H THR 13 HN THR 13 -0.741 -8.661 1.586 74 HA THR 13 HA THR 13 -2.253 -10.071 -0.474 75 HB THR 13 HB THR 13 -2.791 -7.588 -1.110 76 HG1 THR 13 HG1 THR 13 -2.286 -6.123 0.392 77 HG21 THR 13 HG21 THR 13 -3.847 -8.857 1.423 78 HG22 THR 13 HG22 THR 13 -4.407 -9.206 -0.212 79 HG23 THR 13 HG23 THR 13 -4.654 -7.604 0.480 80 H GLY 14 HN GLY 14 0.738 -8.437 -0.035 81 HA2 GLY 14 HA2 GLY 14 2.536 -8.436 -1.512 82 HA3 GLY 14 HA1 GLY 14 1.466 -9.037 -2.770 83 H LYS 15 HN LYS 15 0.461 -6.260 -0.989 84 HA LYS 15 HA LYS 15 1.234 -4.529 -3.249 85 HB2 LYS 15 HB2 LYS 15 -1.109 -4.207 -1.363 86 HB3 LYS 15 HB1 LYS 15 -0.681 -3.100 -2.655 87 HG2 LYS 15 HG2 LYS 15 -1.110 -4.930 -4.285 88 HG3 LYS 15 HG1 LYS 15 -1.688 -5.921 -2.940 89 HD2 LYS 15 HD2 LYS 15 -3.416 -4.310 -2.440 90 HD3 LYS 15 HD1 LYS 15 -2.791 -3.212 -3.665 91 HE2 LYS 15 HE2 LYS 15 -4.577 -4.179 -4.747 92 HE3 LYS 15 HE1 LYS 15 -3.228 -5.166 -5.288 93 HZ1 LYS 15 HZ1 LYS 15 -5.197 -5.852 -3.173 94 HZ2 LYS 15 HZ2 LYS 15 -3.836 -6.788 -3.547 95 HZ3 LYS 15 HZ3 LYS 15 -5.052 -6.570 -4.697 96 H LEU 16 HN LEU 16 3.219 -3.853 -2.360 97 HA LEU 16 HA LEU 16 3.114 -2.591 0.265 98 HB2 LEU 16 HB2 LEU 16 5.384 -3.479 -1.490 99 HB3 LEU 16 HB1 LEU 16 5.641 -2.425 -0.120 100 HG LEU 16 HG LEU 16 4.587 -4.184 1.325 101 HD11 LEU 16 HD11 LEU 16 3.358 -5.370 -0.353 102 HD12 LEU 16 HD12 LEU 16 4.506 -6.459 0.431 103 HD13 LEU 16 HD13 LEU 16 4.852 -5.818 -1.176 104 HD21 LEU 16 HD21 LEU 16 6.577 -5.579 1.412 105 HD22 LEU 16 HD22 LEU 16 7.013 -3.885 1.192 106 HD23 LEU 16 HD23 LEU 16 7.070 -4.995 -0.175 107 H ALA 17 HN ALA 17 3.158 -0.459 0.531 108 HA ALA 17 HA ALA 17 4.230 1.273 -1.544 109 HB1 ALA 17 HB1 ALA 17 1.353 1.424 -0.642 110 HB2 ALA 17 HB2 ALA 17 1.940 1.076 -2.269 111 HB3 ALA 17 HB3 ALA 17 2.177 2.681 -1.570 112 H CYS 18 HN CYS 18 4.844 3.297 -0.777 113 HA CYS 18 HA CYS 18 5.042 3.543 2.103 114 HB2 CYS 18 HB2 CYS 18 6.097 5.259 -0.149 115 HB3 CYS 18 HB1 CYS 18 6.382 5.577 1.558 116 H CYS 19 HN CYS 19 3.248 4.196 3.074 117 HA CYS 19 HA CYS 19 1.606 6.267 1.765 118 HB2 CYS 19 HB2 CYS 19 0.710 4.058 3.630 119 HB3 CYS 19 HB1 CYS 19 -0.334 5.240 2.854 120 H ASP 20 HN ASP 20 0.487 7.758 3.245 121 HA ASP 20 HA ASP 20 1.962 8.096 5.768 122 HB2 ASP 20 HB2 ASP 20 1.391 10.066 4.015 123 HB3 ASP 20 HB1 ASP 20 -0.105 10.052 4.922 124 H THR 21 HN THR 21 0.992 7.649 7.669 125 HA THR 21 HA THR 21 -1.679 6.553 7.550 126 HB THR 21 HB THR 21 -1.285 6.016 9.956 127 HG1 THR 21 HG1 THR 21 0.400 6.871 10.924 128 HG21 THR 21 HG21 THR 21 0.837 5.088 8.015 129 HG22 THR 21 HG22 THR 21 -0.772 4.390 8.206 130 HG23 THR 21 HG23 THR 21 0.400 4.279 9.519 131 H ASN 22 HN ASN 22 -0.488 9.603 7.874 132 HA ASN 22 HA ASN 22 -2.682 10.459 9.634 133 HB2 ASN 22 HB2 ASN 22 -0.180 11.908 8.736 134 HB3 ASN 22 HB1 ASN 22 -1.466 12.651 9.674 135 HD21 ASN 22 HD21 ASN 22 -1.738 12.071 11.825 136 HD22 ASN 22 HD22 ASN 22 -0.518 11.223 12.711 137 H LYS 23 HN LYS 23 -1.639 10.212 6.453 138 HA LYS 23 HA LYS 23 -3.457 12.288 5.478 139 HB2 LYS 23 HB2 LYS 23 -1.544 10.498 3.964 140 HB3 LYS 23 HB1 LYS 23 -2.499 11.770 3.266 141 HG2 LYS 23 HG2 LYS 23 -1.286 13.382 4.717 142 HG3 LYS 23 HG1 LYS 23 -0.223 12.066 5.190 143 HD2 LYS 23 HD2 LYS 23 0.889 13.191 3.440 144 HD3 LYS 23 HD1 LYS 23 0.199 11.741 2.704 145 HE2 LYS 23 HE2 LYS 23 -0.264 13.516 1.212 146 HE3 LYS 23 HE1 LYS 23 -1.774 13.159 2.051 147 HZ1 LYS 23 HZ1 LYS 23 -1.428 15.525 1.922 148 HZ2 LYS 23 HZ2 LYS 23 0.077 15.392 2.676 149 HZ3 LYS 23 HZ3 LYS 23 -1.333 15.031 3.537 150 H LYS 24 HN LYS 24 -5.476 11.525 5.646 151 HA LYS 24 HA LYS 24 -6.066 8.853 4.639 152 HB2 LYS 24 HB2 LYS 24 -7.680 10.900 6.120 153 HB3 LYS 24 HB1 LYS 24 -8.407 9.456 5.434 154 HG2 LYS 24 HG2 LYS 24 -8.054 8.973 7.697 155 HG3 LYS 24 HG1 LYS 24 -6.772 8.132 6.834 156 HD2 LYS 24 HD2 LYS 24 -5.252 10.026 7.367 157 HD3 LYS 24 HD1 LYS 24 -6.544 10.739 8.333 158 HE2 LYS 24 HE2 LYS 24 -5.198 8.079 8.796 159 HE3 LYS 24 HE1 LYS 24 -5.008 9.539 9.766 160 HZ1 LYS 24 HZ1 LYS 24 -7.374 9.390 10.331 161 HZ2 LYS 24 HZ2 LYS 24 -6.520 8.023 10.831 162 HZ3 LYS 24 HZ3 LYS 24 -7.496 7.950 9.456 163 H VAL 25 HN VAL 25 -7.831 8.583 3.120 164 HA VAL 25 HA VAL 25 -8.044 10.856 1.243 165 HB VAL 25 HB VAL 25 -8.435 7.965 0.487 166 HG11 VAL 25 HG11 VAL 25 -9.404 9.657 -0.994 167 HG12 VAL 25 HG12 VAL 25 -8.108 8.758 -1.779 168 HG13 VAL 25 HG13 VAL 25 -7.814 10.391 -1.185 169 HG21 VAL 25 HG21 VAL 25 -6.134 8.255 1.337 170 HG22 VAL 25 HG22 VAL 25 -5.874 9.548 0.161 171 HG23 VAL 25 HG23 VAL 25 -6.178 7.898 -0.386 172 H GLN 26 HN GLN 26 -10.071 11.248 0.305 173 HA GLN 26 HA GLN 26 -12.256 10.706 2.064 174 HB2 GLN 26 HB2 GLN 26 -13.542 12.135 0.518 175 HB3 GLN 26 HB1 GLN 26 -12.072 12.898 1.083 176 HG2 GLN 26 HG2 GLN 26 -10.988 12.421 -1.021 177 HG3 GLN 26 HG1 GLN 26 -12.416 11.559 -1.585 178 HE21 GLN 26 HE21 GLN 26 -12.629 12.946 -3.353 179 HE22 GLN 26 HE22 GLN 26 -13.227 14.559 -3.173 180 H LYS 27 HN LYS 27 -11.157 9.477 -0.995 181 HA LYS 27 HA LYS 27 -13.615 7.967 -1.376 182 HB2 LYS 27 HB2 LYS 27 -11.091 7.963 -3.043 183 HB3 LYS 27 HB1 LYS 27 -12.644 7.273 -3.493 184 HG2 LYS 27 HG2 LYS 27 -12.109 10.200 -3.034 185 HG3 LYS 27 HG1 LYS 27 -12.214 9.414 -4.604 186 HD2 LYS 27 HD2 LYS 27 -14.457 9.367 -2.597 187 HD3 LYS 27 HD1 LYS 27 -14.289 10.629 -3.820 188 HE2 LYS 27 HE2 LYS 27 -14.269 8.874 -5.548 189 HE3 LYS 27 HE1 LYS 27 -14.588 7.672 -4.304 190 HZ1 LYS 27 HZ1 LYS 27 -16.681 8.719 -3.825 191 HZ2 LYS 27 HZ2 LYS 27 -16.609 8.394 -5.483 192 HZ3 LYS 27 HZ3 LYS 27 -16.369 9.971 -4.916 193 H SER 28 HN SER 28 -13.833 5.899 -0.789 194 HA SER 28 HA SER 28 -11.419 4.380 -0.083 195 HB2 SER 28 HB2 SER 28 -13.945 4.517 1.582 196 HB3 SER 28 HB1 SER 28 -12.514 3.548 1.937 197 HG SER 28 HG SER 28 -11.863 6.142 1.514 198 H THR 29 HN THR 29 -13.083 4.346 -2.422 199 HA THR 29 HA THR 29 -14.795 2.064 -2.337 200 HB THR 29 HB THR 29 -13.589 3.379 -4.773 201 HG1 THR 29 HG1 THR 29 -16.173 4.042 -3.984 202 HG21 THR 29 HG21 THR 29 -14.677 1.230 -5.206 203 HG22 THR 29 HG22 THR 29 -15.617 2.556 -5.890 204 HG23 THR 29 HG23 THR 29 -16.133 1.793 -4.386 205 H GLY 30 HN GLY 30 -11.672 2.695 -3.904 206 HA2 GLY 30 HA2 GLY 30 -9.801 1.298 -3.918 207 HA3 GLY 30 HA1 GLY 30 -10.763 0.036 -3.165 208 H GLU 31 HN GLU 31 -9.296 1.041 -5.984 209 HA GLU 31 HA GLU 31 -11.058 -0.111 -7.890 210 HB2 GLU 31 HB2 GLU 31 -8.184 0.751 -7.971 211 HB3 GLU 31 HB1 GLU 31 -8.926 -0.068 -9.338 212 HG2 GLU 31 HG2 GLU 31 -10.543 1.664 -9.593 213 HG3 GLU 31 HG1 GLU 31 -10.023 2.436 -8.098 214 H GLU 32 HN GLU 32 -8.046 -1.297 -6.360 215 HA GLU 32 HA GLU 32 -8.279 -3.877 -7.555 216 HB2 GLU 32 HB2 GLU 32 -6.715 -2.926 -5.151 217 HB3 GLU 32 HB1 GLU 32 -6.597 -4.549 -5.817 218 HG2 GLU 32 HG2 GLU 32 -5.920 -1.990 -7.252 219 HG3 GLU 32 HG1 GLU 32 -4.771 -3.150 -6.587 220 H SER 33 HN SER 33 -9.374 -2.398 -4.590 221 HA SER 33 HA SER 33 -10.346 -4.530 -3.160 222 HB2 SER 33 HB2 SER 33 -11.816 -1.918 -3.544 223 HB3 SER 33 HB1 SER 33 -11.889 -2.989 -2.145 224 HG SER 33 HG SER 33 -10.192 -2.042 -1.386 225 H GLY 34 HN GLY 34 -11.747 -2.972 -6.001 226 HA2 GLY 34 HA2 GLY 34 -14.248 -4.318 -5.910 227 HA3 GLY 34 HA1 GLY 34 -13.553 -3.527 -7.316 228 H LEU 35 HN LEU 35 -11.112 -5.230 -7.071 229 HA LEU 35 HA LEU 35 -12.082 -7.479 -8.609 230 HB2 LEU 35 HB2 LEU 35 -9.271 -6.840 -7.706 231 HB3 LEU 35 HB1 LEU 35 -9.727 -8.002 -8.936 232 HG LEU 35 HG LEU 35 -10.105 -5.012 -9.137 233 HD11 LEU 35 HD11 LEU 35 -7.755 -5.707 -9.236 234 HD12 LEU 35 HD12 LEU 35 -8.331 -5.094 -10.785 235 HD13 LEU 35 HD13 LEU 35 -8.152 -6.829 -10.537 236 HD21 LEU 35 HD21 LEU 35 -11.818 -6.227 -10.358 237 HD22 LEU 35 HD22 LEU 35 -10.585 -7.212 -11.144 238 HD23 LEU 35 HD23 LEU 35 -10.677 -5.483 -11.476 239 H LEU 36 HN LEU 36 -10.856 -6.802 -5.433 240 HA LEU 36 HA LEU 36 -10.910 -9.597 -4.652 241 HB2 LEU 36 HB2 LEU 36 -10.012 -7.045 -3.367 242 HB3 LEU 36 HB1 LEU 36 -10.339 -8.445 -2.378 243 HG LEU 36 HG LEU 36 -7.974 -8.307 -2.808 244 HD11 LEU 36 HD11 LEU 36 -7.558 -10.490 -3.761 245 HD12 LEU 36 HD12 LEU 36 -9.177 -10.517 -4.458 246 HD13 LEU 36 HD13 LEU 36 -8.971 -10.537 -2.708 247 HD21 LEU 36 HD21 LEU 36 -8.682 -8.362 -5.737 248 HD22 LEU 36 HD22 LEU 36 -7.053 -8.457 -5.070 249 HD23 LEU 36 HD23 LEU 36 -8.012 -6.994 -4.849 250 H HIS 37 HN HIS 37 -11.906 -9.728 -2.225 251 HA HIS 37 HA HIS 37 -14.709 -9.103 -2.548 252 HB2 HIS 37 HB2 HIS 37 -14.034 -11.265 -1.607 253 HB3 HIS 37 HB1 HIS 37 -13.234 -10.449 -0.272 254 HD1 HIS 37 HD1 HIS 37 -14.574 -10.403 1.794 255 HD2 HIS 37 HD2 HIS 37 -16.975 -10.558 -1.596 256 HE1 HIS 37 HE1 HIS 37 -16.935 -10.527 2.644 257 HE2 HIS 37 HE2 HIS 37 -18.355 -10.791 0.582 258 H THR 38 HN THR 38 -12.044 -7.486 -1.338 259 HA THR 38 HA THR 38 -13.024 -6.312 1.020 260 HB THR 38 HB THR 38 -11.198 -4.623 -0.515 261 HG1 THR 38 HG1 THR 38 -9.688 -6.082 -0.966 262 HG21 THR 38 HG21 THR 38 -9.847 -4.848 1.510 263 HG22 THR 38 HG22 THR 38 -10.916 -6.122 2.095 264 HG23 THR 38 HG23 THR 38 -11.521 -4.475 1.921 265 H GLY 39 HN GLY 39 -13.548 -5.563 -2.334 266 HA2 GLY 39 HA2 GLY 39 -14.332 -2.860 -2.061 267 HA3 GLY 39 HA1 GLY 39 -14.747 -3.920 -3.398 268 H ASP 40 HN ASP 40 -15.837 -5.635 -0.952 269 HA ASP 40 HA ASP 40 -18.561 -4.937 -1.261 270 HB2 ASP 40 HB2 ASP 40 -17.804 -7.205 -0.662 271 HB3 ASP 40 HB1 ASP 40 -17.247 -6.595 0.881 272 H VAL 41 HN VAL 41 -16.064 -4.003 0.958 273 HA VAL 41 HA VAL 41 -18.039 -2.573 2.603 274 HB VAL 41 HB VAL 41 -16.229 -2.469 4.346 275 HG11 VAL 41 HG11 VAL 41 -17.189 -5.198 3.455 276 HG12 VAL 41 HG12 VAL 41 -18.043 -4.075 4.516 277 HG13 VAL 41 HG13 VAL 41 -16.541 -4.824 5.055 278 HG21 VAL 41 HG21 VAL 41 -14.311 -2.868 2.894 279 HG22 VAL 41 HG22 VAL 41 -14.891 -4.498 2.558 280 HG23 VAL 41 HG23 VAL 41 -14.386 -4.060 4.189 281 H LEU 42 HN LEU 42 -17.853 -0.431 2.971 282 HA LEU 42 HA LEU 42 -15.700 1.002 1.634 283 HB2 LEU 42 HB2 LEU 42 -18.352 1.843 2.752 284 HB3 LEU 42 HB1 LEU 42 -17.150 2.985 2.221 285 HG LEU 42 HG LEU 42 -18.547 0.939 0.504 286 HD11 LEU 42 HD11 LEU 42 -18.708 3.948 0.552 287 HD12 LEU 42 HD12 LEU 42 -19.953 2.829 1.107 288 HD13 LEU 42 HD13 LEU 42 -19.518 2.889 -0.602 289 HD21 LEU 42 HD21 LEU 42 -17.379 2.025 -1.377 290 HD22 LEU 42 HD22 LEU 42 -16.272 1.216 -0.269 291 HD23 LEU 42 HD23 LEU 42 -16.440 2.972 -0.223 292 H ASP 43 HN ASP 43 -16.068 -0.482 4.395 293 HA ASP 43 HA ASP 43 -15.245 1.549 6.266 294 HB2 ASP 43 HB2 ASP 43 -15.554 -1.441 6.455 295 HB3 ASP 43 HB1 ASP 43 -14.816 -0.507 7.751 296 H GLN 44 HN GLN 44 -13.741 -0.273 3.900 297 HA GLN 44 HA GLN 44 -11.210 -0.818 4.720 298 HB2 GLN 44 HB2 GLN 44 -11.714 0.753 2.209 299 HB3 GLN 44 HB1 GLN 44 -10.457 -0.426 2.506 300 HG2 GLN 44 HG2 GLN 44 -12.139 -2.199 2.584 301 HG3 GLN 44 HG1 GLN 44 -13.393 -1.007 2.245 302 HE21 GLN 44 HE21 GLN 44 -13.432 -0.011 0.203 303 HE22 GLN 44 HE22 GLN 44 -12.673 -0.733 -1.169 304 H VAL 45 HN VAL 45 -9.390 0.304 5.224 305 HA VAL 45 HA VAL 45 -9.741 3.127 5.870 306 HB VAL 45 HB VAL 45 -7.416 1.291 6.494 307 HG11 VAL 45 HG11 VAL 45 -8.092 4.022 7.586 308 HG12 VAL 45 HG12 VAL 45 -6.786 3.656 6.459 309 HG13 VAL 45 HG13 VAL 45 -6.746 3.006 8.098 310 HG21 VAL 45 HG21 VAL 45 -9.453 0.544 7.593 311 HG22 VAL 45 HG22 VAL 45 -9.725 2.168 8.227 312 HG23 VAL 45 HG23 VAL 45 -8.333 1.230 8.769 313 H ALA 46 HN ALA 46 -9.411 4.436 4.241 314 HA ALA 46 HA ALA 46 -7.333 3.837 2.273 315 HB1 ALA 46 HB1 ALA 46 -9.580 5.844 2.218 316 HB2 ALA 46 HB2 ALA 46 -9.548 4.284 1.395 317 HB3 ALA 46 HB3 ALA 46 -8.431 5.563 0.908 318 H ILE 47 HN ILE 47 -5.408 4.614 2.803 319 HA ILE 47 HA ILE 47 -5.298 7.409 3.696 320 HB ILE 47 HB ILE 47 -2.957 6.909 4.456 321 HG12 ILE 47 HG12 ILE 47 -3.865 4.035 4.176 322 HG13 ILE 47 HG11 ILE 47 -2.627 4.818 3.197 323 HG21 ILE 47 HG21 ILE 47 -4.817 7.160 5.995 324 HG22 ILE 47 HG22 ILE 47 -3.668 5.954 6.582 325 HG23 ILE 47 HG23 ILE 47 -5.191 5.441 5.844 326 HD11 ILE 47 HD11 ILE 47 -2.518 4.243 6.147 327 HD12 ILE 47 HD12 ILE 47 -1.323 5.206 5.277 328 HD13 ILE 47 HD13 ILE 47 -1.549 3.507 4.872 329 H GLN 48 HN GLN 48 -3.764 8.771 2.778 330 HA GLN 48 HA GLN 48 -3.500 8.356 -0.051 331 HB2 GLN 48 HB2 GLN 48 -3.956 10.570 1.264 332 HB3 GLN 48 HB1 GLN 48 -2.205 10.617 1.443 333 HG2 GLN 48 HG2 GLN 48 -2.388 11.792 -0.481 334 HG3 GLN 48 HG1 GLN 48 -2.309 10.164 -1.143 335 HE21 GLN 48 HE21 GLN 48 -3.382 10.708 -3.002 336 HE22 GLN 48 HE22 GLN 48 -5.079 11.037 -3.030 337 H CYS 49 HN CYS 49 -1.724 7.843 -1.164 338 HA CYS 49 HA CYS 49 0.665 7.167 0.408 339 HB2 CYS 49 HB2 CYS 49 -1.044 5.293 -0.344 340 HB3 CYS 49 HB1 CYS 49 -0.210 5.468 -1.877 341 H THR 50 HN THR 50 2.607 6.837 -0.958 342 HA THR 50 HA THR 50 2.596 7.798 -3.645 343 HB THR 50 HB THR 50 2.516 9.972 -2.553 344 HG1 THR 50 HG1 THR 50 4.260 10.845 -3.601 345 HG21 THR 50 HG21 THR 50 5.022 9.105 -1.119 346 HG22 THR 50 HG22 THR 50 3.439 9.352 -0.385 347 HG23 THR 50 HG23 THR 50 4.314 10.721 -1.071 348 H GLN 51 HN GLN 51 4.172 6.828 -4.724 349 HA GLN 51 HA GLN 51 6.321 5.641 -3.121 350 HB2 GLN 51 HB2 GLN 51 4.570 4.044 -3.935 351 HB3 GLN 51 HB1 GLN 51 5.074 4.425 -5.578 352 HG2 GLN 51 HG2 GLN 51 6.107 2.361 -4.764 353 HG3 GLN 51 HG1 GLN 51 7.295 3.610 -5.137 354 HE21 GLN 51 HE21 GLN 51 8.852 2.666 -3.789 355 HE22 GLN 51 HE22 GLN 51 8.745 2.759 -2.069 356 H ILE 52 HN ILE 52 8.282 6.134 -3.681 357 HA ILE 52 HA ILE 52 8.959 7.623 -6.006 358 HB ILE 52 HB ILE 52 10.554 6.230 -3.862 359 HG12 ILE 52 HG12 ILE 52 10.181 9.133 -4.608 360 HG13 ILE 52 HG11 ILE 52 9.400 8.298 -3.270 361 HG21 ILE 52 HG21 ILE 52 11.860 6.068 -5.936 362 HG22 ILE 52 HG22 ILE 52 12.606 7.165 -4.775 363 HG23 ILE 52 HG23 ILE 52 11.718 7.813 -6.153 364 HD11 ILE 52 HD11 ILE 52 11.242 9.664 -2.497 365 HD12 ILE 52 HD12 ILE 52 12.349 8.799 -3.564 366 HD13 ILE 52 HD13 ILE 52 11.576 7.955 -2.224 367 HA PRO 53 HA PRO 53 9.117 4.581 -9.213 368 HB2 PRO 53 HB2 PRO 53 11.657 5.422 -10.186 369 HB3 PRO 53 HB1 PRO 53 10.067 5.878 -10.798 370 HG2 PRO 53 HG2 PRO 53 11.864 7.330 -8.938 371 HG3 PRO 53 HG1 PRO 53 10.684 7.970 -10.095 372 HD2 PRO 53 HD2 PRO 53 10.200 8.002 -7.465 373 HD3 PRO 53 HD1 PRO 53 8.900 7.660 -8.631 374 H LEU 54 HN LEU 54 9.476 2.559 -8.612 375 HA LEU 54 HA LEU 54 11.465 1.906 -6.721 376 HB2 LEU 54 HB2 LEU 54 10.588 -0.393 -6.920 377 HB3 LEU 54 HB1 LEU 54 9.355 0.809 -6.610 378 HG LEU 54 HG LEU 54 9.078 0.709 -9.244 379 HD11 LEU 54 HD11 LEU 54 9.388 -1.540 -10.111 380 HD12 LEU 54 HD12 LEU 54 10.125 -2.040 -8.590 381 HD13 LEU 54 HD13 LEU 54 10.930 -0.846 -9.608 382 HD21 LEU 54 HD21 LEU 54 7.325 0.247 -7.631 383 HD22 LEU 54 HD22 LEU 54 7.993 -1.359 -7.339 384 HD23 LEU 54 HD23 LEU 54 7.313 -0.961 -8.917 385 H LEU 55 HN LEU 55 13.363 0.955 -6.872 386 HA LEU 55 HA LEU 55 14.365 0.061 -9.465 387 HB2 LEU 55 HB2 LEU 55 15.684 0.082 -6.743 388 HB3 LEU 55 HB1 LEU 55 16.474 -0.287 -8.260 389 HG LEU 55 HG LEU 55 15.325 2.390 -7.480 390 HD11 LEU 55 HD11 LEU 55 17.362 1.822 -6.265 391 HD12 LEU 55 HD12 LEU 55 17.641 3.124 -7.421 392 HD13 LEU 55 HD13 LEU 55 18.181 1.486 -7.789 393 HD21 LEU 55 HD21 LEU 55 16.436 3.186 -9.537 394 HD22 LEU 55 HD22 LEU 55 15.116 2.065 -9.858 395 HD23 LEU 55 HD23 LEU 55 16.786 1.511 -9.964 396 H ILE 56 HN ILE 56 14.995 -2.124 -9.825 397 HA ILE 56 HA ILE 56 13.232 -4.001 -8.607 398 HB ILE 56 HB ILE 56 15.493 -4.401 -10.552 399 HG12 ILE 56 HG12 ILE 56 13.585 -4.902 -12.130 400 HG13 ILE 56 HG11 ILE 56 12.492 -4.317 -10.888 401 HG21 ILE 56 HG21 ILE 56 13.473 -6.409 -9.600 402 HG22 ILE 56 HG22 ILE 56 15.208 -6.436 -9.288 403 HG23 ILE 56 HG23 ILE 56 14.602 -6.653 -10.931 404 HD11 ILE 56 HD11 ILE 56 12.917 -2.644 -12.605 405 HD12 ILE 56 HD12 ILE 56 14.642 -2.702 -12.240 406 HD13 ILE 56 HD13 ILE 56 13.503 -2.112 -11.031 407 H GLY 57 HN GLY 57 13.643 -5.572 -7.178 408 HA2 GLY 57 HA2 GLY 57 14.739 -6.791 -5.554 409 HA3 GLY 57 HA1 GLY 57 16.260 -6.211 -6.213 410 H ILE 58 HN ILE 58 14.247 -3.610 -5.579 411 HA ILE 58 HA ILE 58 15.845 -2.989 -3.221 412 HB ILE 58 HB ILE 58 14.736 -1.429 -5.378 413 HG12 ILE 58 HG12 ILE 58 17.100 -1.505 -4.684 414 HG13 ILE 58 HG11 ILE 58 16.471 0.138 -4.711 415 HG21 ILE 58 HG21 ILE 58 14.094 -0.480 -2.598 416 HG22 ILE 58 HG22 ILE 58 12.994 -0.686 -3.965 417 HG23 ILE 58 HG23 ILE 58 14.197 0.600 -3.994 418 HD11 ILE 58 HD11 ILE 58 17.885 -0.249 -2.772 419 HD12 ILE 58 HD12 ILE 58 16.833 -1.566 -2.255 420 HD13 ILE 58 HD13 ILE 58 16.223 0.087 -2.288 421 H ALA 59 HN ALA 59 14.942 -2.051 -1.381 422 HA ALA 59 HA ALA 59 12.514 -3.398 -0.533 423 HB1 ALA 59 HB1 ALA 59 14.471 -3.573 0.860 424 HB2 ALA 59 HB2 ALA 59 13.249 -2.621 1.709 425 HB3 ALA 59 HB3 ALA 59 14.617 -1.818 0.928 426 H ILE 60 HN ILE 60 10.654 -2.430 -0.099 427 HA ILE 60 HA ILE 60 9.829 0.023 -1.062 428 HB ILE 60 HB ILE 60 8.307 -1.774 -0.384 429 HG12 ILE 60 HG12 ILE 60 6.638 -0.382 0.934 430 HG13 ILE 60 HG11 ILE 60 7.869 0.876 0.989 431 HG21 ILE 60 HG21 ILE 60 7.752 -2.087 2.022 432 HG22 ILE 60 HG22 ILE 60 9.141 -1.071 2.426 433 HG23 ILE 60 HG23 ILE 60 9.380 -2.602 1.582 434 HD11 ILE 60 HD11 ILE 60 7.890 0.955 -1.446 435 HD12 ILE 60 HD12 ILE 60 6.285 1.277 -0.792 436 HD13 ILE 60 HD13 ILE 60 6.650 -0.298 -1.494 437 H GLU 61 HN GLU 61 11.080 -0.743 2.136 438 HA GLU 61 HA GLU 61 10.433 1.780 3.290 439 HB2 GLU 61 HB2 GLU 61 11.944 0.891 5.141 440 HB3 GLU 61 HB1 GLU 61 10.510 -0.053 4.764 441 HG2 GLU 61 HG2 GLU 61 11.729 -1.721 3.708 442 HG3 GLU 61 HG1 GLU 61 13.135 -0.688 3.483 443 H ASP 62 HN ASP 62 13.155 0.504 1.563 444 HA ASP 62 HA ASP 62 14.887 2.658 2.512 445 HB2 ASP 62 HB2 ASP 62 15.708 0.286 2.457 446 HB3 ASP 62 HB1 ASP 62 15.608 0.351 0.700 447 H GLU 63 HN GLU 63 13.041 1.677 -0.219 448 HA GLU 63 HA GLU 63 14.309 3.241 -2.213 449 HB2 GLU 63 HB2 GLU 63 12.658 1.400 -2.654 450 HB3 GLU 63 HB1 GLU 63 11.396 2.442 -2.029 451 HG2 GLU 63 HG2 GLU 63 11.378 2.486 -4.432 452 HG3 GLU 63 HG1 GLU 63 11.857 4.054 -3.802 453 H CYS 64 HN CYS 64 11.888 3.869 0.218 454 HA CYS 64 HA CYS 64 11.598 6.620 -0.788 455 HB2 CYS 64 HB2 CYS 64 9.318 6.548 -0.308 456 HB3 CYS 64 HB1 CYS 64 9.629 4.916 -0.901 457 H LYS 65 HN LYS 65 10.672 8.068 1.099 458 HA LYS 65 HA LYS 65 11.949 7.285 3.628 459 HB2 LYS 65 HB2 LYS 65 13.105 9.154 2.286 460 HB3 LYS 65 HB1 LYS 65 11.731 10.154 2.734 461 HG2 LYS 65 HG2 LYS 65 13.553 10.551 4.253 462 HG3 LYS 65 HG1 LYS 65 12.246 9.731 5.112 463 HD2 LYS 65 HD2 LYS 65 13.431 7.584 4.761 464 HD3 LYS 65 HD1 LYS 65 14.765 8.472 4.029 465 HE2 LYS 65 HE2 LYS 65 15.104 9.688 6.116 466 HE3 LYS 65 HE1 LYS 65 13.754 8.822 6.847 467 HZ1 LYS 65 HZ1 LYS 65 15.877 7.855 7.473 468 HZ2 LYS 65 HZ2 LYS 65 16.262 7.582 5.849 469 HZ3 LYS 65 HZ3 LYS 65 14.970 6.755 6.562 470 H ASN 66 HN ASN 66 9.356 6.690 2.954 471 HA ASN 66 HA ASN 66 7.880 8.326 4.904 472 HB2 ASN 66 HB2 ASN 66 6.911 7.212 2.273 473 HB3 ASN 66 HB1 ASN 66 5.791 7.615 3.569 474 HD21 ASN 66 HD21 ASN 66 7.926 8.833 1.140 475 HD22 ASN 66 HD22 ASN 66 7.469 10.493 1.275 476 H THR 67 HN THR 67 5.602 6.616 5.033 477 HA THR 67 HA THR 67 6.846 4.511 6.590 478 HB THR 67 HB THR 67 3.887 5.071 6.357 479 HG1 THR 67 HG1 THR 67 5.710 6.702 7.316 480 HG21 THR 67 HG21 THR 67 4.379 2.931 7.331 481 HG22 THR 67 HG22 THR 67 3.914 4.022 8.637 482 HG23 THR 67 HG23 THR 67 5.617 3.633 8.370 483 HA PRO 68 HA PRO 68 6.071 1.585 3.344 484 HB2 PRO 68 HB2 PRO 68 7.237 -0.525 4.570 485 HB3 PRO 68 HB1 PRO 68 8.175 0.775 3.834 486 HG2 PRO 68 HG2 PRO 68 7.634 0.220 6.695 487 HG3 PRO 68 HG1 PRO 68 9.040 0.990 5.944 488 HD2 PRO 68 HD2 PRO 68 6.914 2.292 7.234 489 HD3 PRO 68 HD1 PRO 68 8.145 3.050 6.220 490 H THR 69 HN THR 69 4.112 0.656 3.051 491 HA THR 69 HA THR 69 2.918 -0.691 5.376 492 HB THR 69 HB THR 69 0.719 0.196 4.786 493 HG1 THR 69 HG1 THR 69 2.179 1.416 2.679 494 HG21 THR 69 HG21 THR 69 1.970 1.495 6.397 495 HG22 THR 69 HG22 THR 69 1.088 2.591 5.333 496 HG23 THR 69 HG23 THR 69 2.818 2.344 5.104 497 H CYS 70 HN CYS 70 1.570 -2.412 4.973 498 HA CYS 70 HA CYS 70 1.601 -3.528 2.259 499 HB2 CYS 70 HB2 CYS 70 2.298 -5.121 3.907 500 HB3 CYS 70 HB1 CYS 70 0.957 -4.712 4.968 501 H CYS 71 HN CYS 71 0.005 -2.562 1.141 502 HA CYS 71 HA CYS 71 -2.577 -2.025 2.358 503 HB2 CYS 71 HB2 CYS 71 -1.694 -1.663 -0.512 504 HB3 CYS 71 HB1 CYS 71 -3.148 -1.010 0.224 505 H GLU 72 HN GLU 72 -4.291 -3.199 2.209 506 HA GLU 72 HA GLU 72 -4.287 -5.807 1.175 507 HB2 GLU 72 HB2 GLU 72 -6.436 -3.918 2.095 508 HB3 GLU 72 HB1 GLU 72 -6.832 -5.530 1.495 509 HG2 GLU 72 HG2 GLU 72 -5.281 -6.416 3.245 510 HG3 GLU 72 HG1 GLU 72 -5.165 -4.784 3.877 511 H ASP 73 HN ASP 73 -5.392 -2.723 -0.056 512 HA ASP 73 HA ASP 73 -5.347 -3.663 -2.794 513 HB2 ASP 73 HB2 ASP 73 -7.907 -2.813 -1.450 514 HB3 ASP 73 HB1 ASP 73 -7.676 -2.709 -3.195 515 H VAL 74 HN VAL 74 -5.749 -1.758 -4.295 516 HA VAL 74 HA VAL 74 -5.144 0.782 -2.952 517 HB VAL 74 HB VAL 74 -3.467 1.382 -4.564 518 HG11 VAL 74 HG11 VAL 74 -2.897 -1.376 -3.499 519 HG12 VAL 74 HG12 VAL 74 -2.686 0.141 -2.623 520 HG13 VAL 74 HG13 VAL 74 -1.691 -0.208 -4.037 521 HG21 VAL 74 HG21 VAL 74 -4.400 0.215 -6.513 522 HG22 VAL 74 HG22 VAL 74 -3.843 -1.319 -5.845 523 HG23 VAL 74 HG23 VAL 74 -2.673 -0.083 -6.316 524 H GLU 75 HN GLU 75 -5.604 2.649 -4.226 525 HA GLU 75 HA GLU 75 -7.310 2.228 -6.578 526 HB2 GLU 75 HB2 GLU 75 -8.694 2.811 -4.602 527 HB3 GLU 75 HB1 GLU 75 -7.750 4.267 -4.381 528 HG2 GLU 75 HG2 GLU 75 -8.547 5.169 -6.452 529 HG3 GLU 75 HG1 GLU 75 -9.377 3.661 -6.823 530 H ASP 76 HN ASP 76 -7.242 4.100 -8.073 531 HA ASP 76 HA ASP 76 -6.040 5.518 -9.384 532 HB2 ASP 76 HB2 ASP 76 -4.911 6.232 -6.691 533 HB3 ASP 76 HB1 ASP 76 -4.170 6.883 -8.144 534 H ASP 77 HN ASP 77 -3.216 6.115 -9.255 535 HA ASP 77 HA ASP 77 -2.092 3.657 -10.181 536 HB2 ASP 77 HB2 ASP 77 -1.341 5.801 -11.088 537 HB3 ASP 77 HB1 ASP 77 -0.774 6.299 -9.500 538 H GLY 78 HN GLY 78 -2.834 4.597 -7.159 539 HA2 GLY 78 HA2 GLY 78 -2.125 3.069 -5.350 540 HA3 GLY 78 HA1 GLY 78 -0.485 3.285 -5.943 541 H LEU 79 HN LEU 79 -2.572 6.013 -5.981 542 HA LEU 79 HA LEU 79 -1.038 7.323 -3.895 543 HB2 LEU 79 HB2 LEU 79 -3.392 8.341 -5.489 544 HB3 LEU 79 HB1 LEU 79 -2.351 9.303 -4.457 545 HG LEU 79 HG LEU 79 -1.465 7.887 -6.976 546 HD11 LEU 79 HD11 LEU 79 -2.026 10.807 -6.480 547 HD12 LEU 79 HD12 LEU 79 -3.006 9.714 -7.456 548 HD13 LEU 79 HD13 LEU 79 -1.365 10.113 -7.960 549 HD21 LEU 79 HD21 LEU 79 0.328 8.137 -5.358 550 HD22 LEU 79 HD22 LEU 79 -0.045 9.850 -5.181 551 HD23 LEU 79 HD23 LEU 79 0.568 9.234 -6.716 552 H VAL 80 HN VAL 80 -3.877 5.540 -4.207 553 HA VAL 80 HA VAL 80 -4.738 6.358 -1.515 554 HB VAL 80 HB VAL 80 -6.477 5.371 -3.780 555 HG11 VAL 80 HG11 VAL 80 -8.362 5.849 -2.277 556 HG12 VAL 80 HG12 VAL 80 -7.221 6.237 -0.991 557 HG13 VAL 80 HG13 VAL 80 -7.300 4.597 -1.633 558 HG21 VAL 80 HG21 VAL 80 -6.244 8.105 -2.543 559 HG22 VAL 80 HG22 VAL 80 -7.492 7.620 -3.691 560 HG23 VAL 80 HG23 VAL 80 -5.799 7.641 -4.185 561 H GLY 81 HN GLY 81 -4.207 4.766 -0.145 562 HA2 GLY 81 HA2 GLY 81 -4.158 2.024 -1.221 563 HA3 GLY 81 HA1 GLY 81 -3.210 2.580 0.144 564 H ILE 82 HN ILE 82 -5.308 0.442 -0.356 565 HA ILE 82 HA ILE 82 -7.290 1.189 1.660 566 HB ILE 82 HB ILE 82 -7.206 -0.851 -0.526 567 HG12 ILE 82 HG12 ILE 82 -9.531 -0.030 -0.887 568 HG13 ILE 82 HG11 ILE 82 -9.312 1.078 0.458 569 HG21 ILE 82 HG21 ILE 82 -9.271 -1.898 0.485 570 HG22 ILE 82 HG22 ILE 82 -8.816 -1.105 1.994 571 HG23 ILE 82 HG23 ILE 82 -7.734 -2.286 1.261 572 HD11 ILE 82 HD11 ILE 82 -7.745 1.087 -2.108 573 HD12 ILE 82 HD12 ILE 82 -7.521 2.200 -0.759 574 HD13 ILE 82 HD13 ILE 82 -9.034 2.207 -1.665 575 H ASN 83 HN ASN 83 -6.911 0.616 3.661 576 HA ASN 83 HA ASN 83 -6.403 -0.612 5.498 577 HB2 ASN 83 HB2 ASN 83 -6.722 -2.845 3.489 578 HB3 ASN 83 HB1 ASN 83 -6.473 -3.135 5.193 579 HD21 ASN 83 HD21 ASN 83 -8.764 -3.838 3.582 580 HD22 ASN 83 HD22 ASN 83 -10.124 -3.038 4.286 581 H CYS 84 HN CYS 84 -4.291 0.599 4.315 582 HA CYS 84 HA CYS 84 -2.101 -1.208 3.918 583 HB2 CYS 84 HB2 CYS 84 -2.040 1.776 4.355 584 HB3 CYS 84 HB1 CYS 84 -0.758 0.792 3.662 585 H THR 85 HN THR 85 -1.481 -2.361 5.624 586 HA THR 85 HA THR 85 -1.274 -1.127 8.250 587 HB THR 85 HB THR 85 -0.622 -3.952 7.378 588 HG1 THR 85 HG1 THR 85 -2.802 -3.784 7.224 589 HG21 THR 85 HG21 THR 85 -0.752 -4.453 9.801 590 HG22 THR 85 HG22 THR 85 -0.907 -2.724 10.124 591 HG23 THR 85 HG23 THR 85 0.573 -3.358 9.405 592 HA PRO 86 HA PRO 86 2.949 0.082 7.480 593 HB2 PRO 86 HB2 PRO 86 3.051 0.276 10.434 594 HB3 PRO 86 HB1 PRO 86 3.372 1.516 9.217 595 HG2 PRO 86 HG2 PRO 86 1.149 1.596 10.675 596 HG3 PRO 86 HG1 PRO 86 1.114 2.015 8.953 597 HD2 PRO 86 HD2 PRO 86 0.303 -0.539 10.292 598 HD3 PRO 86 HD1 PRO 86 -0.523 0.379 9.020 599 H ILE 87 HN ILE 87 4.516 -1.330 7.081 600 HA ILE 87 HA ILE 87 4.763 -3.697 8.746 601 HB ILE 87 HB ILE 87 6.494 -4.317 6.954 602 HG12 ILE 87 HG12 ILE 87 5.018 -2.181 5.418 603 HG13 ILE 87 HG11 ILE 87 6.651 -1.987 6.040 604 HG21 ILE 87 HG21 ILE 87 4.734 -5.114 5.438 605 HG22 ILE 87 HG22 ILE 87 3.580 -4.056 6.252 606 HG23 ILE 87 HG23 ILE 87 4.337 -5.382 7.135 607 HD11 ILE 87 HD11 ILE 87 5.729 -3.976 3.980 608 HD12 ILE 87 HD12 ILE 87 7.359 -3.904 4.651 609 HD13 ILE 87 HD13 ILE 87 6.733 -2.549 3.711 610 HA PRO 88 HA PRO 88 8.250 -2.161 10.965 611 HB2 PRO 88 HB2 PRO 88 9.235 -4.929 11.005 612 HB3 PRO 88 HB1 PRO 88 8.765 -3.895 12.349 613 HG2 PRO 88 HG2 PRO 88 7.259 -5.961 11.624 614 HG3 PRO 88 HG1 PRO 88 6.522 -4.431 12.137 615 HD2 PRO 88 HD2 PRO 88 6.975 -5.470 9.365 616 HD3 PRO 88 HD1 PRO 88 5.524 -4.724 10.056 617 H LEU 89 HN LEU 89 10.478 -1.792 10.779 618 HA LEU 89 HA LEU 89 11.539 -2.034 8.110 619 HB2 LEU 89 HB2 LEU 89 12.850 -0.981 10.619 620 HB3 LEU 89 HB1 LEU 89 13.429 -0.752 8.979 621 HG LEU 89 HG LEU 89 10.869 0.385 10.108 622 HD11 LEU 89 HD11 LEU 89 13.458 1.727 9.351 623 HD12 LEU 89 HD12 LEU 89 12.879 1.454 10.993 624 HD13 LEU 89 HD13 LEU 89 11.994 2.533 9.914 625 HD21 LEU 89 HD21 LEU 89 12.152 0.728 7.400 626 HD22 LEU 89 HD22 LEU 89 10.755 1.625 7.992 627 HD23 LEU 89 HD23 LEU 89 10.641 -0.117 7.741 628 H ILE 90 HN ILE 90 11.152 -4.422 9.899 629 HA ILE 90 HA ILE 90 13.882 -5.460 9.755 630 HB ILE 90 HB ILE 90 13.362 -6.841 11.775 631 HG12 ILE 90 HG12 ILE 90 11.056 -4.911 12.114 632 HG13 ILE 90 HG11 ILE 90 10.878 -6.595 11.639 633 HG21 ILE 90 HG21 ILE 90 13.706 -4.966 13.372 634 HG22 ILE 90 HG22 ILE 90 13.367 -3.836 12.056 635 HG23 ILE 90 HG23 ILE 90 14.770 -4.905 11.966 636 HD11 ILE 90 HD11 ILE 90 11.814 -7.302 13.769 637 HD12 ILE 90 HD12 ILE 90 10.402 -6.270 14.000 638 HD13 ILE 90 HD13 ILE 90 12.023 -5.616 14.244 Start of MODEL 19 1 H1 GLY 1 HT1 GLY 1 2.922 -3.586 -11.899 2 H2 GLY 1 HT2 GLY 1 1.800 -4.567 -11.101 3 H3 GLY 1 HT3 GLY 1 2.153 -4.844 -12.730 4 HA2 GLY 1 HA1 GLY 1 3.250 -6.483 -11.369 5 HA3 GLY 1 HA2 GLY 1 4.423 -5.444 -12.162 6 H SER 2 HN SER 2 5.998 -4.757 -10.918 7 HA SER 2 HA SER 2 7.267 -4.319 -9.094 8 HB2 SER 2 HB2 SER 2 6.250 -2.566 -7.571 9 HB3 SER 2 HB1 SER 2 6.274 -2.173 -9.288 10 HG SER 2 HG SER 2 4.021 -3.388 -8.088 11 H GLY 3 HN GLY 3 6.856 -6.716 -8.600 12 HA2 GLY 3 HA2 GLY 3 5.313 -7.336 -6.275 13 HA3 GLY 3 HA1 GLY 3 6.556 -8.349 -7.002 14 H TRP 4 HN TRP 4 5.764 -6.483 -4.351 15 HA TRP 4 HA TRP 4 8.434 -5.567 -3.761 16 HB2 TRP 4 HB2 TRP 4 5.791 -5.328 -2.364 17 HB3 TRP 4 HB1 TRP 4 7.288 -4.864 -1.565 18 HD1 TRP 4 HD1 TRP 4 4.616 -3.332 -3.443 19 HE1 TRP 4 HE1 TRP 4 5.355 -1.093 -4.489 20 HE3 TRP 4 HE3 TRP 4 9.676 -3.858 -2.977 21 HZ2 TRP 4 HZ2 TRP 4 7.771 0.245 -5.061 22 HZ3 TRP 4 HZ3 TRP 4 11.131 -2.057 -3.804 23 HH2 TRP 4 HH2 TRP 4 10.195 -0.049 -4.825 24 H GLU 5 HN GLU 5 9.359 -5.956 -1.595 25 HA GLU 5 HA GLU 5 9.639 -8.799 -1.238 26 HB2 GLU 5 HB2 GLU 5 11.022 -6.462 0.090 27 HB3 GLU 5 HB1 GLU 5 11.452 -8.151 0.332 28 HG2 GLU 5 HG2 GLU 5 11.581 -6.644 -2.271 29 HG3 GLU 5 HG1 GLU 5 12.949 -7.076 -1.248 30 H SER 6 HN SER 6 8.187 -9.805 -0.050 31 HA SER 6 HA SER 6 7.228 -8.546 2.423 32 HB2 SER 6 HB2 SER 6 5.538 -9.304 0.697 33 HB3 SER 6 HB1 SER 6 6.058 -10.958 1.013 34 HG SER 6 HG SER 6 4.385 -10.689 2.362 35 H LYS 7 HN LYS 7 9.826 -9.757 2.073 36 HA LYS 7 HA LYS 7 10.060 -12.395 2.860 37 HB2 LYS 7 HB2 LYS 7 12.368 -11.822 3.511 38 HB3 LYS 7 HB1 LYS 7 11.920 -11.162 1.948 39 HG2 LYS 7 HG2 LYS 7 12.950 -9.346 2.825 40 HG3 LYS 7 HG1 LYS 7 11.314 -9.055 3.414 41 HD2 LYS 7 HD2 LYS 7 11.916 -10.155 5.536 42 HD3 LYS 7 HD1 LYS 7 13.571 -10.329 4.949 43 HE2 LYS 7 HE2 LYS 7 12.098 -7.728 5.362 44 HE3 LYS 7 HE1 LYS 7 13.355 -8.383 6.409 45 HZ1 LYS 7 HZ1 LYS 7 13.719 -7.605 3.566 46 HZ2 LYS 7 HZ2 LYS 7 14.924 -8.206 4.590 47 HZ3 LYS 7 HZ3 LYS 7 14.220 -6.703 4.906 48 H THR 8 HN THR 8 9.335 -9.636 4.845 49 HA THR 8 HA THR 8 10.036 -10.917 7.312 50 HB THR 8 HB THR 8 8.256 -8.504 6.898 51 HG1 THR 8 HG1 THR 8 10.834 -8.028 7.724 52 HG21 THR 8 HG21 THR 8 8.940 -7.902 9.176 53 HG22 THR 8 HG22 THR 8 9.860 -9.401 9.295 54 HG23 THR 8 HG23 THR 8 8.104 -9.455 9.146 55 H GLY 9 HN GLY 9 7.476 -11.308 5.159 56 HA2 GLY 9 HA2 GLY 9 5.442 -12.430 5.390 57 HA3 GLY 9 HA1 GLY 9 5.736 -12.548 7.126 58 H SER 10 HN SER 10 6.208 -9.556 5.619 59 HA SER 10 HA SER 10 4.609 -8.269 7.553 60 HB2 SER 10 HB2 SER 10 5.332 -6.256 6.013 61 HB3 SER 10 HB1 SER 10 6.520 -7.101 7.002 62 HG SER 10 HG SER 10 7.255 -6.886 4.851 63 H CYS 11 HN CYS 11 4.092 -9.109 4.206 64 HA CYS 11 HA CYS 11 1.508 -7.695 4.344 65 HB2 CYS 11 HB2 CYS 11 3.273 -6.614 2.869 66 HB3 CYS 11 HB1 CYS 11 3.128 -8.021 1.822 67 H ASN 12 HN ASN 12 -0.263 -8.712 3.500 68 HA ASN 12 HA ASN 12 0.053 -11.561 2.991 69 HB2 ASN 12 HB2 ASN 12 -2.370 -11.709 3.260 70 HB3 ASN 12 HB1 ASN 12 -1.647 -10.860 4.620 71 HD21 ASN 12 HD21 ASN 12 -1.997 -8.629 4.832 72 HD22 ASN 12 HD22 ASN 12 -3.298 -7.839 4.007 73 H THR 13 HN THR 13 -0.755 -8.642 1.279 74 HA THR 13 HA THR 13 -1.785 -10.153 -1.005 75 HB THR 13 HB THR 13 -2.243 -7.831 -1.920 76 HG1 THR 13 HG1 THR 13 -2.240 -6.190 -0.194 77 HG21 THR 13 HG21 THR 13 -4.188 -7.460 -0.446 78 HG22 THR 13 HG22 THR 13 -3.516 -8.614 0.708 79 HG23 THR 13 HG23 THR 13 -4.011 -9.155 -0.897 80 H GLY 14 HN GLY 14 0.954 -8.241 -0.016 81 HA2 GLY 14 HA2 GLY 14 3.061 -8.295 -1.104 82 HA3 GLY 14 HA1 GLY 14 2.251 -8.777 -2.589 83 H LYS 15 HN LYS 15 0.436 -6.398 -1.240 84 HA LYS 15 HA LYS 15 1.509 -4.385 -3.053 85 HB2 LYS 15 HB2 LYS 15 -1.017 -4.562 -1.414 86 HB3 LYS 15 HB1 LYS 15 -0.555 -3.104 -2.274 87 HG2 LYS 15 HG2 LYS 15 -0.765 -4.179 -4.380 88 HG3 LYS 15 HG1 LYS 15 -0.934 -5.766 -3.622 89 HD2 LYS 15 HD2 LYS 15 -3.083 -5.301 -2.845 90 HD3 LYS 15 HD1 LYS 15 -2.862 -3.560 -2.989 91 HE2 LYS 15 HE2 LYS 15 -4.387 -4.509 -4.692 92 HE3 LYS 15 HE1 LYS 15 -2.990 -3.688 -5.379 93 HZ1 LYS 15 HZ1 LYS 15 -3.213 -6.627 -5.036 94 HZ2 LYS 15 HZ2 LYS 15 -1.963 -5.791 -5.814 95 HZ3 LYS 15 HZ3 LYS 15 -3.519 -5.797 -6.482 96 H LEU 16 HN LEU 16 3.420 -3.839 -1.899 97 HA LEU 16 HA LEU 16 3.061 -2.566 0.689 98 HB2 LEU 16 HB2 LEU 16 5.478 -3.367 -0.910 99 HB3 LEU 16 HB1 LEU 16 5.609 -2.304 0.470 100 HG LEU 16 HG LEU 16 4.565 -4.093 1.867 101 HD11 LEU 16 HD11 LEU 16 4.986 -5.760 -0.592 102 HD12 LEU 16 HD12 LEU 16 3.435 -5.310 0.117 103 HD13 LEU 16 HD13 LEU 16 4.539 -6.364 1.003 104 HD21 LEU 16 HD21 LEU 16 6.587 -5.478 1.978 105 HD22 LEU 16 HD22 LEU 16 6.966 -3.759 1.871 106 HD23 LEU 16 HD23 LEU 16 7.130 -4.789 0.449 107 H ALA 17 HN ALA 17 2.758 -0.444 0.840 108 HA ALA 17 HA ALA 17 3.775 1.275 -1.321 109 HB1 ALA 17 HB1 ALA 17 1.705 2.623 -1.176 110 HB2 ALA 17 HB2 ALA 17 1.037 1.429 -0.060 111 HB3 ALA 17 HB3 ALA 17 1.405 0.971 -1.722 112 H CYS 18 HN CYS 18 4.497 3.287 -0.697 113 HA CYS 18 HA CYS 18 5.039 3.649 2.134 114 HB2 CYS 18 HB2 CYS 18 5.693 5.505 -0.160 115 HB3 CYS 18 HB1 CYS 18 6.410 5.505 1.445 116 H CYS 19 HN CYS 19 3.280 4.316 3.269 117 HA CYS 19 HA CYS 19 1.551 6.337 2.003 118 HB2 CYS 19 HB2 CYS 19 0.746 4.126 3.896 119 HB3 CYS 19 HB1 CYS 19 -0.336 5.316 3.188 120 H ASP 20 HN ASP 20 0.433 7.813 3.419 121 HA ASP 20 HA ASP 20 1.847 8.279 5.950 122 HB2 ASP 20 HB2 ASP 20 0.055 10.122 4.348 123 HB3 ASP 20 HB1 ASP 20 0.810 10.535 5.876 124 H THR 21 HN THR 21 0.876 7.508 7.685 125 HA THR 21 HA THR 21 -1.752 6.412 7.498 126 HB THR 21 HB THR 21 -1.369 5.714 9.849 127 HG1 THR 21 HG1 THR 21 0.070 6.837 10.928 128 HG21 THR 21 HG21 THR 21 0.471 4.176 9.355 129 HG22 THR 21 HG22 THR 21 0.923 5.154 7.958 130 HG23 THR 21 HG23 THR 21 -0.627 4.309 7.982 131 H ASN 22 HN ASN 22 -0.568 9.468 8.453 132 HA ASN 22 HA ASN 22 -2.935 10.011 10.096 133 HB2 ASN 22 HB2 ASN 22 -0.410 11.609 9.626 134 HB3 ASN 22 HB1 ASN 22 -1.777 12.190 10.566 135 HD21 ASN 22 HD21 ASN 22 0.955 11.725 11.405 136 HD22 ASN 22 HD22 ASN 22 0.877 10.575 12.694 137 H LYS 23 HN LYS 23 -2.084 9.970 7.006 138 HA LYS 23 HA LYS 23 -3.736 12.280 6.249 139 HB2 LYS 23 HB2 LYS 23 -1.526 10.828 4.812 140 HB3 LYS 23 HB1 LYS 23 -2.600 11.948 4.011 141 HG2 LYS 23 HG2 LYS 23 -1.822 13.749 5.337 142 HG3 LYS 23 HG1 LYS 23 -0.882 12.680 6.365 143 HD2 LYS 23 HD2 LYS 23 0.525 13.865 4.754 144 HD3 LYS 23 HD1 LYS 23 0.534 12.127 4.457 145 HE2 LYS 23 HE2 LYS 23 -1.406 12.672 2.823 146 HE3 LYS 23 HE1 LYS 23 -0.767 14.311 2.895 147 HZ1 LYS 23 HZ1 LYS 23 0.959 11.983 2.262 148 HZ2 LYS 23 HZ2 LYS 23 1.286 13.629 2.018 149 HZ3 LYS 23 HZ3 LYS 23 0.132 12.849 1.060 150 H LYS 24 HN LYS 24 -5.722 11.501 6.081 151 HA LYS 24 HA LYS 24 -6.139 8.812 5.036 152 HB2 LYS 24 HB2 LYS 24 -7.867 10.724 6.566 153 HB3 LYS 24 HB1 LYS 24 -8.523 9.271 5.831 154 HG2 LYS 24 HG2 LYS 24 -8.132 8.752 8.087 155 HG3 LYS 24 HG1 LYS 24 -6.835 7.979 7.184 156 HD2 LYS 24 HD2 LYS 24 -5.277 9.663 7.837 157 HD3 LYS 24 HD1 LYS 24 -6.558 10.659 8.526 158 HE2 LYS 24 HE2 LYS 24 -5.732 7.935 9.524 159 HE3 LYS 24 HE1 LYS 24 -5.263 9.471 10.250 160 HZ1 LYS 24 HZ1 LYS 24 -7.119 8.512 11.428 161 HZ2 LYS 24 HZ2 LYS 24 -8.035 8.426 10.009 162 HZ3 LYS 24 HZ3 LYS 24 -7.617 9.931 10.654 163 H VAL 25 HN VAL 25 -7.893 8.413 3.597 164 HA VAL 25 HA VAL 25 -8.707 10.685 1.905 165 HB VAL 25 HB VAL 25 -8.327 7.893 0.845 166 HG11 VAL 25 HG11 VAL 25 -8.590 10.555 -0.527 167 HG12 VAL 25 HG12 VAL 25 -9.807 9.283 -0.446 168 HG13 VAL 25 HG13 VAL 25 -8.312 9.016 -1.338 169 HG21 VAL 25 HG21 VAL 25 -6.135 8.638 1.593 170 HG22 VAL 25 HG22 VAL 25 -6.321 10.146 0.695 171 HG23 VAL 25 HG23 VAL 25 -6.211 8.609 -0.167 172 H GLN 26 HN GLN 26 -10.864 10.592 1.243 173 HA GLN 26 HA GLN 26 -12.499 8.985 3.020 174 HB2 GLN 26 HB2 GLN 26 -13.205 11.302 1.221 175 HB3 GLN 26 HB1 GLN 26 -14.307 10.511 2.327 176 HG2 GLN 26 HG2 GLN 26 -11.786 11.912 3.162 177 HG3 GLN 26 HG1 GLN 26 -13.386 12.646 3.171 178 HE21 GLN 26 HE21 GLN 26 -13.328 13.008 5.371 179 HE22 GLN 26 HE22 GLN 26 -13.482 11.734 6.529 180 H LYS 27 HN LYS 27 -11.662 9.207 -0.318 181 HA LYS 27 HA LYS 27 -13.865 7.411 -1.030 182 HB2 LYS 27 HB2 LYS 27 -12.058 9.138 -2.709 183 HB3 LYS 27 HB1 LYS 27 -13.123 7.929 -3.405 184 HG2 LYS 27 HG2 LYS 27 -14.026 10.240 -1.711 185 HG3 LYS 27 HG1 LYS 27 -14.052 10.220 -3.468 186 HD2 LYS 27 HD2 LYS 27 -15.605 8.412 -1.610 187 HD3 LYS 27 HD1 LYS 27 -16.253 9.722 -2.594 188 HE2 LYS 27 HE2 LYS 27 -15.675 8.563 -4.616 189 HE3 LYS 27 HE1 LYS 27 -14.849 7.313 -3.693 190 HZ1 LYS 27 HZ1 LYS 27 -17.759 7.876 -3.585 191 HZ2 LYS 27 HZ2 LYS 27 -16.956 6.658 -2.735 192 HZ3 LYS 27 HZ3 LYS 27 -17.039 6.596 -4.419 193 H SER 28 HN SER 28 -13.481 5.349 -1.112 194 HA SER 28 HA SER 28 -10.834 4.406 -1.976 195 HB2 SER 28 HB2 SER 28 -11.277 2.413 -0.448 196 HB3 SER 28 HB1 SER 28 -10.938 3.938 0.366 197 HG SER 28 HG SER 28 -13.606 3.360 -0.196 198 H THR 29 HN THR 29 -10.947 3.244 -3.792 199 HA THR 29 HA THR 29 -13.572 2.459 -4.764 200 HB THR 29 HB THR 29 -10.930 2.185 -6.199 201 HG1 THR 29 HG1 THR 29 -12.381 4.423 -5.573 202 HG21 THR 29 HG21 THR 29 -12.789 0.916 -7.159 203 HG22 THR 29 HG22 THR 29 -12.335 2.258 -8.210 204 HG23 THR 29 HG23 THR 29 -13.775 2.376 -7.199 205 H GLY 30 HN GLY 30 -10.389 0.953 -4.320 206 HA2 GLY 30 HA2 GLY 30 -9.802 -1.242 -3.964 207 HA3 GLY 30 HA1 GLY 30 -11.444 -1.503 -3.386 208 H GLU 31 HN GLU 31 -9.574 -1.099 -6.374 209 HA GLU 31 HA GLU 31 -11.718 -2.170 -7.956 210 HB2 GLU 31 HB2 GLU 31 -8.887 -1.515 -8.780 211 HB3 GLU 31 HB1 GLU 31 -10.228 -1.856 -9.864 212 HG2 GLU 31 HG2 GLU 31 -11.381 0.134 -8.699 213 HG3 GLU 31 HG1 GLU 31 -9.759 0.545 -8.148 214 H GLU 32 HN GLU 32 -8.812 -3.448 -6.474 215 HA GLU 32 HA GLU 32 -9.202 -5.934 -7.965 216 HB2 GLU 32 HB2 GLU 32 -6.932 -5.078 -6.174 217 HB3 GLU 32 HB1 GLU 32 -7.051 -6.655 -6.942 218 HG2 GLU 32 HG2 GLU 32 -7.318 -5.169 -9.111 219 HG3 GLU 32 HG1 GLU 32 -6.433 -4.010 -8.122 220 H SER 33 HN SER 33 -9.164 -4.624 -4.704 221 HA SER 33 HA SER 33 -9.763 -7.042 -3.368 222 HB2 SER 33 HB2 SER 33 -10.640 -5.505 -1.563 223 HB3 SER 33 HB1 SER 33 -8.989 -5.172 -2.077 224 HG SER 33 HG SER 33 -9.726 -3.437 -3.279 225 H GLY 34 HN GLY 34 -11.693 -4.687 -5.075 226 HA2 GLY 34 HA2 GLY 34 -14.245 -5.642 -4.301 227 HA3 GLY 34 HA1 GLY 34 -13.886 -4.686 -5.729 228 H LEU 35 HN LEU 35 -11.986 -6.598 -6.813 229 HA LEU 35 HA LEU 35 -13.783 -8.374 -8.143 230 HB2 LEU 35 HB2 LEU 35 -10.763 -8.323 -8.078 231 HB3 LEU 35 HB1 LEU 35 -11.724 -9.315 -9.158 232 HG LEU 35 HG LEU 35 -11.713 -6.296 -9.129 233 HD11 LEU 35 HD11 LEU 35 -10.449 -8.235 -11.057 234 HD12 LEU 35 HD12 LEU 35 -9.593 -7.207 -9.909 235 HD13 LEU 35 HD13 LEU 35 -10.501 -6.484 -11.236 236 HD21 LEU 35 HD21 LEU 35 -12.959 -6.516 -11.229 237 HD22 LEU 35 HD22 LEU 35 -13.841 -7.207 -9.869 238 HD23 LEU 35 HD23 LEU 35 -13.011 -8.265 -11.010 239 H LEU 36 HN LEU 36 -11.489 -8.628 -5.517 240 HA LEU 36 HA LEU 36 -11.847 -11.424 -5.083 241 HB2 LEU 36 HB2 LEU 36 -10.810 -9.266 -3.250 242 HB3 LEU 36 HB1 LEU 36 -10.634 -10.986 -3.017 243 HG LEU 36 HG LEU 36 -9.387 -9.378 -5.237 244 HD11 LEU 36 HD11 LEU 36 -8.352 -8.984 -3.070 245 HD12 LEU 36 HD12 LEU 36 -7.283 -9.918 -4.116 246 HD13 LEU 36 HD13 LEU 36 -8.178 -10.722 -2.826 247 HD21 LEU 36 HD21 LEU 36 -9.958 -11.631 -5.982 248 HD22 LEU 36 HD22 LEU 36 -9.133 -12.311 -4.580 249 HD23 LEU 36 HD23 LEU 36 -8.212 -11.445 -5.810 250 H HIS 37 HN HIS 37 -12.500 -11.911 -2.574 251 HA HIS 37 HA HIS 37 -15.287 -11.283 -2.445 252 HB2 HIS 37 HB2 HIS 37 -15.371 -12.633 -0.440 253 HB3 HIS 37 HB1 HIS 37 -14.373 -13.446 -1.635 254 HD1 HIS 37 HD1 HIS 37 -14.085 -11.513 1.604 255 HD2 HIS 37 HD2 HIS 37 -11.810 -14.008 -0.821 256 HE1 HIS 37 HE1 HIS 37 -12.017 -12.045 2.927 257 HE2 HIS 37 HE2 HIS 37 -10.562 -13.359 1.345 258 H THR 38 HN THR 38 -12.728 -9.419 -1.732 259 HA THR 38 HA THR 38 -13.565 -8.296 0.779 260 HB THR 38 HB THR 38 -11.551 -7.142 -1.148 261 HG1 THR 38 HG1 THR 38 -10.622 -8.761 0.892 262 HG21 THR 38 HG21 THR 38 -12.136 -5.732 0.769 263 HG22 THR 38 HG22 THR 38 -10.480 -6.323 0.901 264 HG23 THR 38 HG23 THR 38 -11.759 -7.061 1.865 265 H GLY 39 HN GLY 39 -14.764 -8.008 -2.296 266 HA2 GLY 39 HA2 GLY 39 -15.116 -5.196 -2.535 267 HA3 GLY 39 HA1 GLY 39 -16.021 -6.428 -3.404 268 H ASP 40 HN ASP 40 -16.597 -7.487 -0.534 269 HA ASP 40 HA ASP 40 -19.167 -6.236 -0.349 270 HB2 ASP 40 HB2 ASP 40 -17.790 -8.458 1.104 271 HB3 ASP 40 HB1 ASP 40 -19.246 -7.746 1.790 272 H VAL 41 HN VAL 41 -16.127 -5.896 1.356 273 HA VAL 41 HA VAL 41 -17.416 -4.574 3.591 274 HB VAL 41 HB VAL 41 -15.076 -4.224 4.453 275 HG11 VAL 41 HG11 VAL 41 -14.789 -6.583 5.082 276 HG12 VAL 41 HG12 VAL 41 -15.933 -7.055 3.827 277 HG13 VAL 41 HG13 VAL 41 -16.475 -6.080 5.193 278 HG21 VAL 41 HG21 VAL 41 -13.289 -5.556 3.437 279 HG22 VAL 41 HG22 VAL 41 -13.879 -4.311 2.338 280 HG23 VAL 41 HG23 VAL 41 -14.365 -5.990 2.111 281 H LEU 42 HN LEU 42 -17.538 -2.495 3.977 282 HA LEU 42 HA LEU 42 -16.256 -0.635 2.112 283 HB2 LEU 42 HB2 LEU 42 -18.683 -0.520 2.122 284 HB3 LEU 42 HB1 LEU 42 -18.687 -0.348 3.863 285 HG LEU 42 HG LEU 42 -17.506 1.818 3.598 286 HD11 LEU 42 HD11 LEU 42 -16.508 1.460 1.416 287 HD12 LEU 42 HD12 LEU 42 -17.533 2.896 1.393 288 HD13 LEU 42 HD13 LEU 42 -18.108 1.391 0.676 289 HD21 LEU 42 HD21 LEU 42 -19.490 3.057 2.861 290 HD22 LEU 42 HD22 LEU 42 -19.901 1.740 3.959 291 HD23 LEU 42 HD23 LEU 42 -20.174 1.560 2.227 292 H ASP 43 HN ASP 43 -15.876 -2.014 5.028 293 HA ASP 43 HA ASP 43 -15.271 0.218 6.697 294 HB2 ASP 43 HB2 ASP 43 -15.972 -1.964 7.610 295 HB3 ASP 43 HB1 ASP 43 -14.491 -2.692 7.000 296 H GLN 44 HN GLN 44 -13.655 -1.241 4.148 297 HA GLN 44 HA GLN 44 -10.999 -1.122 4.595 298 HB2 GLN 44 HB2 GLN 44 -12.406 0.112 2.242 299 HB3 GLN 44 HB1 GLN 44 -10.707 -0.292 2.296 300 HG2 GLN 44 HG2 GLN 44 -11.220 -2.639 2.482 301 HG3 GLN 44 HG1 GLN 44 -12.943 -2.284 2.555 302 HE21 GLN 44 HE21 GLN 44 -11.259 -3.834 0.641 303 HE22 GLN 44 HE22 GLN 44 -11.665 -3.200 -0.913 304 H VAL 45 HN VAL 45 -9.405 0.398 4.701 305 HA VAL 45 HA VAL 45 -10.268 3.164 5.242 306 HB VAL 45 HB VAL 45 -7.932 1.691 6.487 307 HG11 VAL 45 HG11 VAL 45 -7.716 3.672 7.917 308 HG12 VAL 45 HG12 VAL 45 -9.003 4.464 7.006 309 HG13 VAL 45 HG13 VAL 45 -7.477 4.066 6.214 310 HG21 VAL 45 HG21 VAL 45 -10.531 2.570 7.735 311 HG22 VAL 45 HG22 VAL 45 -9.188 1.783 8.564 312 HG23 VAL 45 HG23 VAL 45 -10.095 0.909 7.330 313 H ALA 46 HN ALA 46 -9.560 4.554 3.815 314 HA ALA 46 HA ALA 46 -7.243 3.860 2.166 315 HB1 ALA 46 HB1 ALA 46 -8.064 5.749 0.729 316 HB2 ALA 46 HB2 ALA 46 -9.477 5.838 1.785 317 HB3 ALA 46 HB3 ALA 46 -9.154 4.372 0.863 318 H ILE 47 HN ILE 47 -5.356 4.785 2.572 319 HA ILE 47 HA ILE 47 -5.380 7.484 3.737 320 HB ILE 47 HB ILE 47 -3.050 7.009 4.552 321 HG12 ILE 47 HG12 ILE 47 -3.841 4.138 4.030 322 HG13 ILE 47 HG11 ILE 47 -2.582 5.029 3.176 323 HG21 ILE 47 HG21 ILE 47 -5.281 5.386 5.755 324 HG22 ILE 47 HG22 ILE 47 -4.938 7.089 6.060 325 HG23 ILE 47 HG23 ILE 47 -3.787 5.854 6.573 326 HD11 ILE 47 HD11 ILE 47 -1.429 5.314 5.383 327 HD12 ILE 47 HD12 ILE 47 -1.511 3.661 4.783 328 HD13 ILE 47 HD13 ILE 47 -2.604 4.188 6.062 329 H GLN 48 HN GLN 48 -3.802 8.929 3.030 330 HA GLN 48 HA GLN 48 -3.374 8.861 0.198 331 HB2 GLN 48 HB2 GLN 48 -3.722 10.852 1.927 332 HB3 GLN 48 HB1 GLN 48 -1.973 10.788 2.008 333 HG2 GLN 48 HG2 GLN 48 -3.619 11.249 -0.465 334 HG3 GLN 48 HG1 GLN 48 -2.728 12.464 0.434 335 HE21 GLN 48 HE21 GLN 48 -2.580 9.969 -1.897 336 HE22 GLN 48 HE22 GLN 48 -0.901 10.120 -2.288 337 H CYS 49 HN CYS 49 -1.613 8.224 -0.873 338 HA CYS 49 HA CYS 49 0.715 7.350 0.681 339 HB2 CYS 49 HB2 CYS 49 -1.110 5.560 0.157 340 HB3 CYS 49 HB1 CYS 49 -0.468 5.629 -1.473 341 H THR 50 HN THR 50 2.541 6.680 -0.839 342 HA THR 50 HA THR 50 2.459 7.705 -3.514 343 HB THR 50 HB THR 50 2.802 9.804 -2.274 344 HG1 THR 50 HG1 THR 50 3.809 10.060 -4.138 345 HG21 THR 50 HG21 THR 50 4.893 10.185 -1.059 346 HG22 THR 50 HG22 THR 50 5.335 8.494 -1.297 347 HG23 THR 50 HG23 THR 50 3.933 8.908 -0.311 348 H GLN 51 HN GLN 51 3.984 6.743 -4.777 349 HA GLN 51 HA GLN 51 5.967 5.074 -3.382 350 HB2 GLN 51 HB2 GLN 51 3.831 4.139 -4.788 351 HB3 GLN 51 HB1 GLN 51 5.067 4.165 -6.033 352 HG2 GLN 51 HG2 GLN 51 5.482 2.831 -3.375 353 HG3 GLN 51 HG1 GLN 51 4.762 2.004 -4.752 354 HE21 GLN 51 HE21 GLN 51 7.682 3.041 -3.273 355 HE22 GLN 51 HE22 GLN 51 8.775 2.482 -4.512 356 H ILE 52 HN ILE 52 8.002 5.208 -4.056 357 HA ILE 52 HA ILE 52 8.727 7.336 -5.853 358 HB ILE 52 HB ILE 52 10.312 5.429 -4.131 359 HG12 ILE 52 HG12 ILE 52 9.025 7.029 -2.883 360 HG13 ILE 52 HG11 ILE 52 10.730 7.439 -2.782 361 HG21 ILE 52 HG21 ILE 52 12.299 6.722 -4.566 362 HG22 ILE 52 HG22 ILE 52 11.405 7.789 -5.646 363 HG23 ILE 52 HG23 ILE 52 11.656 6.101 -6.088 364 HD11 ILE 52 HD11 ILE 52 9.456 9.429 -3.065 365 HD12 ILE 52 HD12 ILE 52 8.654 8.762 -4.485 366 HD13 ILE 52 HD13 ILE 52 10.377 9.128 -4.538 367 HA PRO 53 HA PRO 53 9.350 5.251 -9.760 368 HB2 PRO 53 HB2 PRO 53 12.140 6.034 -9.808 369 HB3 PRO 53 HB1 PRO 53 10.806 6.625 -10.799 370 HG2 PRO 53 HG2 PRO 53 11.991 7.792 -8.385 371 HG3 PRO 53 HG1 PRO 53 10.968 8.552 -9.612 372 HD2 PRO 53 HD2 PRO 53 10.098 8.057 -7.103 373 HD3 PRO 53 HD1 PRO 53 9.018 7.985 -8.511 374 H LEU 54 HN LEU 54 9.725 3.205 -10.159 375 HA LEU 54 HA LEU 54 10.663 1.471 -8.197 376 HB2 LEU 54 HB2 LEU 54 10.224 0.975 -11.136 377 HB3 LEU 54 HB1 LEU 54 10.434 -0.278 -9.929 378 HG LEU 54 HG LEU 54 8.169 1.718 -9.911 379 HD11 LEU 54 HD11 LEU 54 8.210 -1.141 -10.865 380 HD12 LEU 54 HD12 LEU 54 8.028 0.290 -11.880 381 HD13 LEU 54 HD13 LEU 54 6.777 -0.126 -10.708 382 HD21 LEU 54 HD21 LEU 54 8.706 0.805 -7.718 383 HD22 LEU 54 HD22 LEU 54 8.633 -0.832 -8.369 384 HD23 LEU 54 HD23 LEU 54 7.175 0.158 -8.304 385 H LEU 55 HN LEU 55 12.619 0.971 -7.585 386 HA LEU 55 HA LEU 55 14.777 0.829 -9.586 387 HB2 LEU 55 HB2 LEU 55 14.874 0.933 -6.567 388 HB3 LEU 55 HB1 LEU 55 16.274 0.732 -7.595 389 HG LEU 55 HG LEU 55 14.477 3.154 -7.537 390 HD11 LEU 55 HD11 LEU 55 15.833 2.957 -5.528 391 HD12 LEU 55 HD12 LEU 55 16.420 4.270 -6.547 392 HD13 LEU 55 HD13 LEU 55 17.280 2.732 -6.510 393 HD21 LEU 55 HD21 LEU 55 17.031 2.636 -9.053 394 HD22 LEU 55 HD22 LEU 55 16.160 4.169 -8.987 395 HD23 LEU 55 HD23 LEU 55 15.417 2.764 -9.749 396 H ILE 56 HN ILE 56 15.578 -1.130 -10.125 397 HA ILE 56 HA ILE 56 14.115 -3.441 -9.357 398 HB ILE 56 HB ILE 56 16.671 -3.223 -10.932 399 HG12 ILE 56 HG12 ILE 56 15.095 -3.797 -12.857 400 HG13 ILE 56 HG11 ILE 56 13.776 -3.425 -11.760 401 HG21 ILE 56 HG21 ILE 56 16.475 -5.432 -9.957 402 HG22 ILE 56 HG22 ILE 56 16.228 -5.499 -11.702 403 HG23 ILE 56 HG23 ILE 56 14.845 -5.589 -10.611 404 HD11 ILE 56 HD11 ILE 56 15.935 -1.507 -12.607 405 HD12 ILE 56 HD12 ILE 56 14.554 -1.139 -11.572 406 HD13 ILE 56 HD13 ILE 56 14.300 -1.572 -13.263 407 H GLY 57 HN GLY 57 14.580 -5.009 -7.979 408 HA2 GLY 57 HA2 GLY 57 15.657 -6.247 -6.367 409 HA3 GLY 57 HA1 GLY 57 17.155 -5.466 -6.842 410 H ILE 58 HN ILE 58 14.713 -3.241 -6.058 411 HA ILE 58 HA ILE 58 16.077 -2.767 -3.515 412 HB ILE 58 HB ILE 58 15.199 -1.009 -5.656 413 HG12 ILE 58 HG12 ILE 58 17.508 -1.235 -4.960 414 HG13 ILE 58 HG11 ILE 58 16.960 0.414 -4.682 415 HG21 ILE 58 HG21 ILE 58 14.661 0.916 -4.188 416 HG22 ILE 58 HG22 ILE 58 14.544 -0.207 -2.829 417 HG23 ILE 58 HG23 ILE 58 13.427 -0.345 -4.188 418 HD11 ILE 58 HD11 ILE 58 18.232 -0.205 -2.794 419 HD12 ILE 58 HD12 ILE 58 17.404 -1.753 -2.649 420 HD13 ILE 58 HD13 ILE 58 16.543 -0.258 -2.282 421 H ALA 59 HN ALA 59 14.937 -1.967 -1.753 422 HA ALA 59 HA ALA 59 12.418 -3.354 -1.326 423 HB1 ALA 59 HB1 ALA 59 14.439 -2.015 0.449 424 HB2 ALA 59 HB2 ALA 59 14.110 -3.744 0.290 425 HB3 ALA 59 HB3 ALA 59 12.924 -2.687 1.059 426 H ILE 60 HN ILE 60 10.538 -2.345 -0.626 427 HA ILE 60 HA ILE 60 9.814 0.150 -1.619 428 HB ILE 60 HB ILE 60 8.187 -1.561 -0.970 429 HG12 ILE 60 HG12 ILE 60 6.580 -0.089 0.315 430 HG13 ILE 60 HG11 ILE 60 7.885 1.085 0.456 431 HG21 ILE 60 HG21 ILE 60 9.097 -0.966 1.836 432 HG22 ILE 60 HG22 ILE 60 9.133 -2.508 0.977 433 HG23 ILE 60 HG23 ILE 60 7.589 -1.805 1.458 434 HD11 ILE 60 HD11 ILE 60 6.372 1.634 -1.361 435 HD12 ILE 60 HD12 ILE 60 6.703 0.075 -2.118 436 HD13 ILE 60 HD13 ILE 60 7.989 1.272 -1.963 437 H GLU 61 HN GLU 61 10.977 -0.704 1.618 438 HA GLU 61 HA GLU 61 10.509 1.887 2.718 439 HB2 GLU 61 HB2 GLU 61 11.755 1.002 4.665 440 HB3 GLU 61 HB1 GLU 61 10.458 -0.060 4.146 441 HG2 GLU 61 HG2 GLU 61 11.981 -1.565 3.133 442 HG3 GLU 61 HG1 GLU 61 13.319 -0.443 3.338 443 H ASP 62 HN ASP 62 13.052 0.456 0.925 444 HA ASP 62 HA ASP 62 15.060 2.371 1.821 445 HB2 ASP 62 HB2 ASP 62 15.618 -0.044 1.373 446 HB3 ASP 62 HB1 ASP 62 15.277 0.248 -0.327 447 H GLU 63 HN GLU 63 13.006 1.636 -0.887 448 HA GLU 63 HA GLU 63 14.190 3.334 -2.806 449 HB2 GLU 63 HB2 GLU 63 12.555 1.381 -3.136 450 HB3 GLU 63 HB1 GLU 63 11.292 2.514 -2.698 451 HG2 GLU 63 HG2 GLU 63 11.793 3.887 -4.583 452 HG3 GLU 63 HG1 GLU 63 13.189 2.898 -4.989 453 H CYS 64 HN CYS 64 11.769 3.781 -0.328 454 HA CYS 64 HA CYS 64 11.460 6.586 -1.165 455 HB2 CYS 64 HB2 CYS 64 9.165 6.494 -0.663 456 HB3 CYS 64 HB1 CYS 64 9.481 4.976 -1.486 457 H LYS 65 HN LYS 65 10.553 7.932 0.764 458 HA LYS 65 HA LYS 65 11.993 7.107 3.195 459 HB2 LYS 65 HB2 LYS 65 11.716 9.888 2.048 460 HB3 LYS 65 HB1 LYS 65 12.420 9.514 3.615 461 HG2 LYS 65 HG2 LYS 65 13.469 8.519 0.978 462 HG3 LYS 65 HG1 LYS 65 14.115 9.891 1.882 463 HD2 LYS 65 HD2 LYS 65 14.654 8.430 3.750 464 HD3 LYS 65 HD1 LYS 65 13.944 7.059 2.903 465 HE2 LYS 65 HE2 LYS 65 16.368 7.026 2.716 466 HE3 LYS 65 HE1 LYS 65 15.629 7.286 1.138 467 HZ1 LYS 65 HZ1 LYS 65 16.780 9.408 2.869 468 HZ2 LYS 65 HZ2 LYS 65 16.096 9.639 1.339 469 HZ3 LYS 65 HZ3 LYS 65 17.522 8.747 1.498 470 H ASN 66 HN ASN 66 9.098 6.945 2.296 471 HA ASN 66 HA ASN 66 7.916 8.343 4.595 472 HB2 ASN 66 HB2 ASN 66 6.697 7.197 2.092 473 HB3 ASN 66 HB1 ASN 66 5.713 7.573 3.498 474 HD21 ASN 66 HD21 ASN 66 7.623 8.865 0.903 475 HD22 ASN 66 HD22 ASN 66 7.115 10.507 1.083 476 H THR 67 HN THR 67 5.734 6.668 5.077 477 HA THR 67 HA THR 67 7.121 4.542 6.440 478 HB THR 67 HB THR 67 4.192 5.290 6.597 479 HG1 THR 67 HG1 THR 67 5.997 5.684 8.709 480 HG21 THR 67 HG21 THR 67 5.913 3.342 8.134 481 HG22 THR 67 HG22 THR 67 4.439 3.004 7.224 482 HG23 THR 67 HG23 THR 67 4.355 3.927 8.727 483 HA PRO 68 HA PRO 68 6.069 1.499 3.349 484 HB2 PRO 68 HB2 PRO 68 7.116 -0.439 5.171 485 HB3 PRO 68 HB1 PRO 68 7.851 0.152 3.685 486 HG2 PRO 68 HG2 PRO 68 8.662 0.652 6.336 487 HG3 PRO 68 HG1 PRO 68 9.303 1.401 4.865 488 HD2 PRO 68 HD2 PRO 68 7.571 2.496 6.909 489 HD3 PRO 68 HD1 PRO 68 8.429 3.331 5.610 490 H THR 69 HN THR 69 4.045 0.726 3.238 491 HA THR 69 HA THR 69 2.941 -0.600 5.620 492 HB THR 69 HB THR 69 0.720 0.333 5.132 493 HG1 THR 69 HG1 THR 69 2.107 1.553 2.973 494 HG21 THR 69 HG21 THR 69 2.855 2.455 5.366 495 HG22 THR 69 HG22 THR 69 2.049 1.616 6.691 496 HG23 THR 69 HG23 THR 69 1.138 2.721 5.663 497 H CYS 70 HN CYS 70 1.441 -2.288 5.177 498 HA CYS 70 HA CYS 70 1.499 -3.312 2.424 499 HB2 CYS 70 HB2 CYS 70 2.102 -5.003 4.006 500 HB3 CYS 70 HB1 CYS 70 0.752 -4.593 5.058 501 H CYS 71 HN CYS 71 -0.149 -2.790 1.170 502 HA CYS 71 HA CYS 71 -2.716 -2.068 2.412 503 HB2 CYS 71 HB2 CYS 71 -1.789 -1.579 -0.427 504 HB3 CYS 71 HB1 CYS 71 -3.225 -0.917 0.342 505 H GLU 72 HN GLU 72 -4.564 -3.130 1.904 506 HA GLU 72 HA GLU 72 -4.284 -5.744 0.791 507 HB2 GLU 72 HB2 GLU 72 -5.701 -5.769 2.585 508 HB3 GLU 72 HB1 GLU 72 -6.351 -4.171 2.247 509 HG2 GLU 72 HG2 GLU 72 -7.781 -5.009 0.599 510 HG3 GLU 72 HG1 GLU 72 -6.978 -6.580 0.583 511 H ASP 73 HN ASP 73 -5.244 -2.623 -0.266 512 HA ASP 73 HA ASP 73 -5.135 -3.506 -3.005 513 HB2 ASP 73 HB2 ASP 73 -7.598 -3.730 -2.208 514 HB3 ASP 73 HB1 ASP 73 -7.605 -1.972 -2.254 515 H VAL 74 HN VAL 74 -4.996 -1.589 -4.463 516 HA VAL 74 HA VAL 74 -4.703 0.996 -3.143 517 HB VAL 74 HB VAL 74 -2.424 0.375 -4.934 518 HG11 VAL 74 HG11 VAL 74 -2.764 2.576 -3.936 519 HG12 VAL 74 HG12 VAL 74 -1.237 1.849 -3.432 520 HG13 VAL 74 HG13 VAL 74 -2.611 1.866 -2.331 521 HG21 VAL 74 HG21 VAL 74 -2.390 -1.640 -3.575 522 HG22 VAL 74 HG22 VAL 74 -2.487 -0.669 -2.106 523 HG23 VAL 74 HG23 VAL 74 -1.054 -0.576 -3.130 524 H GLU 75 HN GLU 75 -5.491 2.553 -4.427 525 HA GLU 75 HA GLU 75 -5.969 1.962 -7.245 526 HB2 GLU 75 HB2 GLU 75 -6.921 4.122 -5.395 527 HB3 GLU 75 HB1 GLU 75 -7.007 4.353 -7.133 528 HG2 GLU 75 HG2 GLU 75 -9.095 3.551 -6.659 529 HG3 GLU 75 HG1 GLU 75 -8.245 2.077 -7.114 530 H ASP 76 HN ASP 76 -5.528 3.689 -8.842 531 HA ASP 76 HA ASP 76 -4.145 5.097 -9.971 532 HB2 ASP 76 HB2 ASP 76 -3.325 5.992 -7.196 533 HB3 ASP 76 HB1 ASP 76 -2.888 6.814 -8.689 534 H ASP 77 HN ASP 77 -1.478 5.943 -9.098 535 HA ASP 77 HA ASP 77 -0.007 3.524 -9.618 536 HB2 ASP 77 HB2 ASP 77 0.859 6.355 -9.031 537 HB3 ASP 77 HB1 ASP 77 2.006 5.038 -9.243 538 H GLY 78 HN GLY 78 -1.557 4.415 -6.986 539 HA2 GLY 78 HA2 GLY 78 -1.144 3.033 -5.006 540 HA3 GLY 78 HA1 GLY 78 0.551 3.445 -5.167 541 H LEU 79 HN LEU 79 -1.879 5.881 -5.704 542 HA LEU 79 HA LEU 79 -0.779 7.401 -3.495 543 HB2 LEU 79 HB2 LEU 79 -2.962 8.160 -5.433 544 HB3 LEU 79 HB1 LEU 79 -2.171 9.234 -4.295 545 HG LEU 79 HG LEU 79 -0.883 7.900 -6.685 546 HD11 LEU 79 HD11 LEU 79 -2.369 9.719 -7.298 547 HD12 LEU 79 HD12 LEU 79 -0.685 10.194 -7.527 548 HD13 LEU 79 HD13 LEU 79 -1.584 10.778 -6.126 549 HD21 LEU 79 HD21 LEU 79 1.077 9.265 -6.129 550 HD22 LEU 79 HD22 LEU 79 0.708 8.097 -4.861 551 HD23 LEU 79 HD23 LEU 79 0.281 9.794 -4.648 552 H VAL 80 HN VAL 80 -3.541 5.457 -4.096 553 HA VAL 80 HA VAL 80 -4.636 6.300 -1.498 554 HB VAL 80 HB VAL 80 -6.302 5.529 -3.906 555 HG11 VAL 80 HG11 VAL 80 -8.212 6.173 -2.508 556 HG12 VAL 80 HG12 VAL 80 -7.119 6.462 -1.155 557 HG13 VAL 80 HG13 VAL 80 -7.309 4.832 -1.801 558 HG21 VAL 80 HG21 VAL 80 -5.928 8.222 -2.595 559 HG22 VAL 80 HG22 VAL 80 -7.068 7.860 -3.890 560 HG23 VAL 80 HG23 VAL 80 -5.333 7.748 -4.186 561 H GLY 81 HN GLY 81 -4.081 4.638 -0.236 562 HA2 GLY 81 HA2 GLY 81 -4.294 1.928 -1.344 563 HA3 GLY 81 HA1 GLY 81 -3.313 2.384 0.038 564 H ILE 82 HN ILE 82 -5.501 0.385 -0.496 565 HA ILE 82 HA ILE 82 -7.465 1.151 1.529 566 HB ILE 82 HB ILE 82 -7.371 -0.924 -0.616 567 HG12 ILE 82 HG12 ILE 82 -9.759 -0.190 -0.878 568 HG13 ILE 82 HG11 ILE 82 -9.477 0.985 0.402 569 HG21 ILE 82 HG21 ILE 82 -9.027 -1.197 1.880 570 HG22 ILE 82 HG22 ILE 82 -7.791 -2.307 1.290 571 HG23 ILE 82 HG23 ILE 82 -9.297 -2.107 0.394 572 HD11 ILE 82 HD11 ILE 82 -7.761 2.046 -0.957 573 HD12 ILE 82 HD12 ILE 82 -9.322 2.007 -1.782 574 HD13 ILE 82 HD13 ILE 82 -8.052 0.869 -2.238 575 H ASN 83 HN ASN 83 -7.076 0.637 3.538 576 HA ASN 83 HA ASN 83 -6.561 -0.539 5.404 577 HB2 ASN 83 HB2 ASN 83 -6.810 -2.792 3.424 578 HB3 ASN 83 HB1 ASN 83 -6.456 -3.090 5.117 579 HD21 ASN 83 HD21 ASN 83 -8.761 -3.933 3.629 580 HD22 ASN 83 HD22 ASN 83 -10.134 -3.201 4.383 581 H CYS 84 HN CYS 84 -4.489 0.766 4.369 582 HA CYS 84 HA CYS 84 -2.210 -0.976 4.055 583 HB2 CYS 84 HB2 CYS 84 -2.297 2.027 4.353 584 HB3 CYS 84 HB1 CYS 84 -0.928 1.075 3.795 585 H THR 85 HN THR 85 -1.422 -1.950 5.765 586 HA THR 85 HA THR 85 -1.349 -0.536 8.341 587 HB THR 85 HB THR 85 -0.901 -3.481 7.805 588 HG1 THR 85 HG1 THR 85 -3.241 -1.986 8.392 589 HG21 THR 85 HG21 THR 85 -1.478 -1.966 10.355 590 HG22 THR 85 HG22 THR 85 0.067 -2.687 9.904 591 HG23 THR 85 HG23 THR 85 -1.330 -3.718 10.212 592 HA PRO 86 HA PRO 86 2.987 0.203 7.638 593 HB2 PRO 86 HB2 PRO 86 3.061 0.415 10.594 594 HB3 PRO 86 HB1 PRO 86 3.564 1.585 9.369 595 HG2 PRO 86 HG2 PRO 86 1.330 1.971 10.746 596 HG3 PRO 86 HG1 PRO 86 1.392 2.334 9.012 597 HD2 PRO 86 HD2 PRO 86 0.232 -0.051 10.403 598 HD3 PRO 86 HD1 PRO 86 -0.430 0.915 9.070 599 H ILE 87 HN ILE 87 4.502 -1.246 7.332 600 HA ILE 87 HA ILE 87 4.424 -3.725 8.853 601 HB ILE 87 HB ILE 87 5.976 -4.500 7.011 602 HG12 ILE 87 HG12 ILE 87 5.021 -2.014 5.603 603 HG13 ILE 87 HG11 ILE 87 6.603 -2.125 6.359 604 HG21 ILE 87 HG21 ILE 87 4.125 -4.707 5.374 605 HG22 ILE 87 HG22 ILE 87 3.203 -3.545 6.328 606 HG23 ILE 87 HG23 ILE 87 3.649 -5.103 7.025 607 HD11 ILE 87 HD11 ILE 87 6.762 -2.539 3.989 608 HD12 ILE 87 HD12 ILE 87 5.571 -3.836 4.113 609 HD13 ILE 87 HD13 ILE 87 7.149 -4.009 4.884 610 HA PRO 88 HA PRO 88 8.199 -3.020 10.993 611 HB2 PRO 88 HB2 PRO 88 9.142 -5.718 10.350 612 HB3 PRO 88 HB1 PRO 88 8.672 -5.049 11.910 613 HG2 PRO 88 HG2 PRO 88 7.160 -6.868 10.696 614 HG3 PRO 88 HG1 PRO 88 6.425 -5.505 11.565 615 HD2 PRO 88 HD2 PRO 88 6.960 -5.784 8.621 616 HD3 PRO 88 HD1 PRO 88 5.447 -5.321 9.432 617 H LEU 89 HN LEU 89 10.338 -2.528 10.770 618 HA LEU 89 HA LEU 89 11.330 -2.406 8.024 619 HB2 LEU 89 HB2 LEU 89 12.422 -1.167 10.551 620 HB3 LEU 89 HB1 LEU 89 12.948 -0.815 8.916 621 HG LEU 89 HG LEU 89 10.223 -0.173 10.047 622 HD11 LEU 89 HD11 LEU 89 10.959 2.149 9.911 623 HD12 LEU 89 HD12 LEU 89 12.553 1.618 9.373 624 HD13 LEU 89 HD13 LEU 89 11.989 1.216 10.995 625 HD21 LEU 89 HD21 LEU 89 10.107 -0.640 7.670 626 HD22 LEU 89 HD22 LEU 89 11.457 0.453 7.367 627 HD23 LEU 89 HD23 LEU 89 9.924 1.090 7.960 628 H ILE 90 HN ILE 90 11.341 -4.959 9.329 629 HA ILE 90 HA ILE 90 14.218 -5.387 9.661 630 HB ILE 90 HB ILE 90 13.702 -6.962 11.544 631 HG12 ILE 90 HG12 ILE 90 11.038 -5.525 11.504 632 HG13 ILE 90 HG11 ILE 90 11.293 -7.229 11.142 633 HG21 ILE 90 HG21 ILE 90 13.496 -5.147 13.227 634 HG22 ILE 90 HG22 ILE 90 13.127 -4.023 11.913 635 HG23 ILE 90 HG23 ILE 90 14.701 -4.819 11.981 636 HD11 ILE 90 HD11 ILE 90 10.409 -6.909 13.384 637 HD12 ILE 90 HD12 ILE 90 11.798 -5.903 13.796 638 HD13 ILE 90 HD13 ILE 90 12.024 -7.613 13.430 Start of MODEL 20 1 H1 GLY 1 HT1 GLY 1 7.605 -12.567 -9.008 2 H2 GLY 1 HT2 GLY 1 6.202 -12.278 -9.907 3 H3 GLY 1 HT3 GLY 1 6.085 -12.695 -8.275 4 HA2 GLY 1 HA1 GLY 1 7.175 -10.639 -7.640 5 HA3 GLY 1 HA2 GLY 1 7.293 -10.206 -9.340 6 H SER 2 HN SER 2 5.850 -8.752 -9.912 7 HA SER 2 HA SER 2 3.957 -7.534 -10.094 8 HB2 SER 2 HB2 SER 2 3.019 -9.753 -10.779 9 HB3 SER 2 HB1 SER 2 2.519 -10.011 -9.109 10 HG SER 2 HG SER 2 1.120 -8.285 -9.268 11 H GLY 3 HN GLY 3 5.447 -7.344 -7.716 12 HA2 GLY 3 HA2 GLY 3 3.608 -5.894 -6.113 13 HA3 GLY 3 HA1 GLY 3 4.025 -7.418 -5.340 14 H TRP 4 HN TRP 4 5.555 -7.190 -3.887 15 HA TRP 4 HA TRP 4 7.922 -5.618 -4.554 16 HB2 TRP 4 HB2 TRP 4 6.070 -5.141 -2.271 17 HB3 TRP 4 HB1 TRP 4 7.796 -4.924 -1.999 18 HD1 TRP 4 HD1 TRP 4 4.812 -3.286 -3.612 19 HE1 TRP 4 HE1 TRP 4 5.520 -1.001 -4.569 20 HE3 TRP 4 HE3 TRP 4 9.869 -3.744 -3.119 21 HZ2 TRP 4 HZ2 TRP 4 7.917 0.407 -5.056 22 HZ3 TRP 4 HZ3 TRP 4 11.302 -1.889 -3.857 23 HH2 TRP 4 HH2 TRP 4 10.346 0.144 -4.806 24 H GLU 5 HN GLU 5 9.707 -6.007 -3.014 25 HA GLU 5 HA GLU 5 10.144 -8.752 -2.541 26 HB2 GLU 5 HB2 GLU 5 11.751 -6.637 -2.823 27 HB3 GLU 5 HB1 GLU 5 11.683 -6.661 -1.070 28 HG2 GLU 5 HG2 GLU 5 12.440 -9.059 -2.700 29 HG3 GLU 5 HG1 GLU 5 13.613 -7.867 -2.143 30 H SER 6 HN SER 6 9.112 -9.893 -1.024 31 HA SER 6 HA SER 6 7.933 -8.418 1.228 32 HB2 SER 6 HB2 SER 6 7.012 -10.993 -0.065 33 HB3 SER 6 HB1 SER 6 6.172 -10.112 1.207 34 HG SER 6 HG SER 6 6.810 -8.944 -1.295 35 H LYS 7 HN LYS 7 10.635 -9.632 1.226 36 HA LYS 7 HA LYS 7 10.859 -12.068 2.455 37 HB2 LYS 7 HB2 LYS 7 13.037 -11.496 3.052 38 HB3 LYS 7 HB1 LYS 7 12.702 -10.466 1.672 39 HG2 LYS 7 HG2 LYS 7 12.466 -9.557 4.531 40 HG3 LYS 7 HG1 LYS 7 13.918 -9.364 3.555 41 HD2 LYS 7 HD2 LYS 7 12.663 -7.998 1.957 42 HD3 LYS 7 HD1 LYS 7 11.202 -8.208 2.925 43 HE2 LYS 7 HE2 LYS 7 12.181 -7.018 4.765 44 HE3 LYS 7 HE1 LYS 7 13.744 -6.955 3.955 45 HZ1 LYS 7 HZ1 LYS 7 12.456 -4.857 3.853 46 HZ2 LYS 7 HZ2 LYS 7 11.287 -5.656 2.921 47 HZ3 LYS 7 HZ3 LYS 7 12.858 -5.481 2.330 48 H THR 8 HN THR 8 9.660 -9.165 3.913 49 HA THR 8 HA THR 8 10.218 -9.877 6.609 50 HB THR 8 HB THR 8 9.938 -7.565 6.165 51 HG1 THR 8 HG1 THR 8 9.047 -8.269 8.172 52 HG21 THR 8 HG21 THR 8 8.584 -7.678 4.151 53 HG22 THR 8 HG22 THR 8 7.833 -6.595 5.323 54 HG23 THR 8 HG23 THR 8 7.194 -8.221 5.088 55 H GLY 9 HN GLY 9 7.605 -10.585 4.403 56 HA2 GLY 9 HA2 GLY 9 5.915 -12.135 4.584 57 HA3 GLY 9 HA1 GLY 9 6.602 -12.628 6.122 58 H SER 10 HN SER 10 6.107 -9.374 6.289 59 HA SER 10 HA SER 10 3.955 -9.708 8.136 60 HB2 SER 10 HB2 SER 10 5.236 -7.160 7.138 61 HB3 SER 10 HB1 SER 10 4.236 -7.337 8.581 62 HG SER 10 HG SER 10 6.892 -7.908 8.197 63 H CYS 11 HN CYS 11 4.094 -9.094 4.787 64 HA CYS 11 HA CYS 11 1.448 -7.807 4.841 65 HB2 CYS 11 HB2 CYS 11 3.246 -6.671 3.556 66 HB3 CYS 11 HB1 CYS 11 3.395 -8.097 2.538 67 H ASN 12 HN ASN 12 -0.311 -8.762 3.894 68 HA ASN 12 HA ASN 12 0.014 -11.586 3.247 69 HB2 ASN 12 HB2 ASN 12 -2.515 -11.630 3.385 70 HB3 ASN 12 HB1 ASN 12 -1.650 -11.293 4.875 71 HD21 ASN 12 HD21 ASN 12 -2.303 -9.000 2.252 72 HD22 ASN 12 HD22 ASN 12 -3.320 -7.966 3.194 73 H THR 13 HN THR 13 -0.544 -8.629 1.603 74 HA THR 13 HA THR 13 -1.771 -10.041 -0.666 75 HB THR 13 HB THR 13 -2.091 -7.568 -1.457 76 HG1 THR 13 HG1 THR 13 -2.074 -6.080 0.201 77 HG21 THR 13 HG21 THR 13 -3.681 -8.679 0.864 78 HG22 THR 13 HG22 THR 13 -3.904 -9.122 -0.827 79 HG23 THR 13 HG23 THR 13 -4.234 -7.473 -0.298 80 H GLY 14 HN GLY 14 1.016 -8.149 0.268 81 HA2 GLY 14 HA2 GLY 14 3.103 -8.338 -0.858 82 HA3 GLY 14 HA1 GLY 14 2.239 -8.785 -2.323 83 H LYS 15 HN LYS 15 0.499 -6.324 -1.137 84 HA LYS 15 HA LYS 15 1.740 -4.412 -2.939 85 HB2 LYS 15 HB2 LYS 15 -0.798 -4.192 -1.301 86 HB3 LYS 15 HB1 LYS 15 -0.271 -3.050 -2.530 87 HG2 LYS 15 HG2 LYS 15 -0.567 -4.672 -4.259 88 HG3 LYS 15 HG1 LYS 15 -0.866 -5.948 -3.079 89 HD2 LYS 15 HD2 LYS 15 -2.899 -4.736 -2.347 90 HD3 LYS 15 HD1 LYS 15 -2.612 -3.545 -3.618 91 HE2 LYS 15 HE2 LYS 15 -2.863 -5.206 -5.316 92 HE3 LYS 15 HE1 LYS 15 -2.927 -6.483 -4.116 93 HZ1 LYS 15 HZ1 LYS 15 -5.118 -6.110 -4.813 94 HZ2 LYS 15 HZ2 LYS 15 -4.983 -4.427 -4.655 95 HZ3 LYS 15 HZ3 LYS 15 -5.000 -5.414 -3.272 96 H LEU 16 HN LEU 16 3.630 -3.941 -1.773 97 HA LEU 16 HA LEU 16 3.348 -2.640 0.805 98 HB2 LEU 16 HB2 LEU 16 5.702 -3.512 -0.847 99 HB3 LEU 16 HB1 LEU 16 5.898 -2.464 0.535 100 HG LEU 16 HG LEU 16 4.869 -4.221 1.962 101 HD11 LEU 16 HD11 LEU 16 4.719 -6.494 1.089 102 HD12 LEU 16 HD12 LEU 16 5.068 -5.881 -0.529 103 HD13 LEU 16 HD13 LEU 16 3.588 -5.391 0.300 104 HD21 LEU 16 HD21 LEU 16 6.830 -5.685 1.980 105 HD22 LEU 16 HD22 LEU 16 7.285 -3.989 1.823 106 HD23 LEU 16 HD23 LEU 16 7.316 -5.045 0.410 107 H ALA 17 HN ALA 17 2.583 -0.607 0.588 108 HA ALA 17 HA ALA 17 3.908 1.114 -1.407 109 HB1 ALA 17 HB1 ALA 17 1.533 0.870 -1.872 110 HB2 ALA 17 HB2 ALA 17 1.893 2.522 -1.362 111 HB3 ALA 17 HB3 ALA 17 1.142 1.391 -0.233 112 H CYS 18 HN CYS 18 4.427 3.228 -0.809 113 HA CYS 18 HA CYS 18 4.946 3.622 2.020 114 HB2 CYS 18 HB2 CYS 18 5.602 5.362 -0.367 115 HB3 CYS 18 HB1 CYS 18 6.191 5.600 1.270 116 H CYS 19 HN CYS 19 3.220 4.311 3.165 117 HA CYS 19 HA CYS 19 1.452 6.284 1.886 118 HB2 CYS 19 HB2 CYS 19 0.623 3.920 3.568 119 HB3 CYS 19 HB1 CYS 19 -0.466 5.156 2.950 120 H ASP 20 HN ASP 20 0.397 7.759 3.200 121 HA ASP 20 HA ASP 20 1.663 8.228 5.793 122 HB2 ASP 20 HB2 ASP 20 0.110 9.914 3.876 123 HB3 ASP 20 HB1 ASP 20 0.101 10.362 5.576 124 H THR 21 HN THR 21 0.742 7.078 7.368 125 HA THR 21 HA THR 21 -2.001 6.303 7.324 126 HB THR 21 HB THR 21 -1.571 5.396 9.571 127 HG1 THR 21 HG1 THR 21 1.124 6.230 9.363 128 HG21 THR 21 HG21 THR 21 -0.917 4.108 7.570 129 HG22 THR 21 HG22 THR 21 0.132 3.781 8.946 130 HG23 THR 21 HG23 THR 21 0.691 4.833 7.645 131 H ASN 22 HN ASN 22 -0.622 9.225 7.981 132 HA ASN 22 HA ASN 22 -2.413 9.930 10.187 133 HB2 ASN 22 HB2 ASN 22 -1.045 11.880 10.477 134 HB3 ASN 22 HB1 ASN 22 0.040 10.516 10.266 135 HD21 ASN 22 HD21 ASN 22 -1.080 13.500 8.967 136 HD22 ASN 22 HD22 ASN 22 0.052 13.599 7.663 137 H LYS 23 HN LYS 23 -1.905 10.210 6.866 138 HA LYS 23 HA LYS 23 -3.907 12.324 6.576 139 HB2 LYS 23 HB2 LYS 23 -2.124 13.138 5.394 140 HB3 LYS 23 HB1 LYS 23 -1.480 11.539 5.070 141 HG2 LYS 23 HG2 LYS 23 -2.127 12.381 2.995 142 HG3 LYS 23 HG1 LYS 23 -3.366 11.233 3.495 143 HD2 LYS 23 HD2 LYS 23 -4.841 13.041 4.147 144 HD3 LYS 23 HD1 LYS 23 -3.588 14.228 3.781 145 HE2 LYS 23 HE2 LYS 23 -3.643 13.522 1.428 146 HE3 LYS 23 HE1 LYS 23 -4.914 12.364 1.812 147 HZ1 LYS 23 HZ1 LYS 23 -5.111 15.315 2.063 148 HZ2 LYS 23 HZ2 LYS 23 -6.331 14.222 2.475 149 HZ3 LYS 23 HZ3 LYS 23 -5.835 14.370 0.865 150 H LYS 24 HN LYS 24 -5.855 11.608 6.222 151 HA LYS 24 HA LYS 24 -6.210 8.931 5.095 152 HB2 LYS 24 HB2 LYS 24 -8.020 10.697 6.726 153 HB3 LYS 24 HB1 LYS 24 -8.523 9.153 6.057 154 HG2 LYS 24 HG2 LYS 24 -7.979 8.599 8.219 155 HG3 LYS 24 HG1 LYS 24 -6.483 8.222 7.369 156 HD2 LYS 24 HD2 LYS 24 -5.550 10.375 8.057 157 HD3 LYS 24 HD1 LYS 24 -7.055 10.765 8.891 158 HE2 LYS 24 HE2 LYS 24 -6.719 8.749 10.308 159 HE3 LYS 24 HE1 LYS 24 -5.149 8.521 9.540 160 HZ1 LYS 24 HZ1 LYS 24 -5.992 10.844 11.185 161 HZ2 LYS 24 HZ2 LYS 24 -4.522 10.748 10.361 162 HZ3 LYS 24 HZ3 LYS 24 -4.862 9.662 11.611 163 H VAL 25 HN VAL 25 -8.036 8.541 3.708 164 HA VAL 25 HA VAL 25 -8.912 10.864 2.109 165 HB VAL 25 HB VAL 25 -8.581 8.097 0.965 166 HG11 VAL 25 HG11 VAL 25 -8.757 10.798 -0.353 167 HG12 VAL 25 HG12 VAL 25 -10.059 9.613 -0.237 168 HG13 VAL 25 HG13 VAL 25 -8.614 9.246 -1.179 169 HG21 VAL 25 HG21 VAL 25 -6.375 8.791 1.718 170 HG22 VAL 25 HG22 VAL 25 -6.548 10.321 0.857 171 HG23 VAL 25 HG23 VAL 25 -6.467 8.805 -0.042 172 H GLN 26 HN GLN 26 -11.085 10.738 1.374 173 HA GLN 26 HA GLN 26 -12.732 8.984 3.023 174 HB2 GLN 26 HB2 GLN 26 -13.377 11.494 1.486 175 HB3 GLN 26 HB1 GLN 26 -14.558 10.550 2.369 176 HG2 GLN 26 HG2 GLN 26 -13.208 10.919 4.433 177 HG3 GLN 26 HG1 GLN 26 -12.195 12.018 3.498 178 HE21 GLN 26 HE21 GLN 26 -13.050 13.985 2.808 179 HE22 GLN 26 HE22 GLN 26 -14.480 14.655 3.511 180 H LYS 27 HN LYS 27 -11.364 8.245 0.437 181 HA LYS 27 HA LYS 27 -13.743 7.107 -0.851 182 HB2 LYS 27 HB2 LYS 27 -11.396 8.416 -2.236 183 HB3 LYS 27 HB1 LYS 27 -12.543 7.375 -3.062 184 HG2 LYS 27 HG2 LYS 27 -13.269 9.913 -1.631 185 HG3 LYS 27 HG1 LYS 27 -12.987 9.795 -3.361 186 HD2 LYS 27 HD2 LYS 27 -15.151 8.419 -1.770 187 HD3 LYS 27 HD1 LYS 27 -15.360 9.748 -2.911 188 HE2 LYS 27 HE2 LYS 27 -14.556 8.326 -4.720 189 HE3 LYS 27 HE1 LYS 27 -14.323 7.014 -3.572 190 HZ1 LYS 27 HZ1 LYS 27 -16.392 6.816 -4.843 191 HZ2 LYS 27 HZ2 LYS 27 -16.936 8.271 -4.176 192 HZ3 LYS 27 HZ3 LYS 27 -16.674 6.930 -3.181 193 H SER 28 HN SER 28 -13.607 4.961 -0.806 194 HA SER 28 HA SER 28 -11.007 3.689 -1.208 195 HB2 SER 28 HB2 SER 28 -11.443 2.122 0.674 196 HB3 SER 28 HB1 SER 28 -11.255 3.788 1.217 197 HG SER 28 HG SER 28 -13.731 2.465 0.770 198 H THR 29 HN THR 29 -11.828 3.157 -3.284 199 HA THR 29 HA THR 29 -13.981 1.155 -3.255 200 HB THR 29 HB THR 29 -12.901 2.666 -5.637 201 HG1 THR 29 HG1 THR 29 -14.617 3.429 -3.678 202 HG21 THR 29 HG21 THR 29 -13.926 0.533 -6.221 203 HG22 THR 29 HG22 THR 29 -14.954 1.871 -6.737 204 HG23 THR 29 HG23 THR 29 -15.363 0.952 -5.288 205 H GLY 30 HN GLY 30 -10.847 1.897 -4.678 206 HA2 GLY 30 HA2 GLY 30 -9.020 0.392 -4.690 207 HA3 GLY 30 HA1 GLY 30 -10.145 -0.943 -4.494 208 H GLU 31 HN GLU 31 -8.094 -1.004 -6.328 209 HA GLU 31 HA GLU 31 -9.448 -0.719 -8.917 210 HB2 GLU 31 HB2 GLU 31 -6.553 -1.148 -8.186 211 HB3 GLU 31 HB1 GLU 31 -7.150 -1.289 -9.834 212 HG2 GLU 31 HG2 GLU 31 -7.466 1.179 -8.154 213 HG3 GLU 31 HG1 GLU 31 -6.121 0.913 -9.260 214 H GLU 32 HN GLU 32 -7.722 -3.040 -6.874 215 HA GLU 32 HA GLU 32 -8.555 -5.231 -8.577 216 HB2 GLU 32 HB2 GLU 32 -6.276 -5.313 -7.837 217 HB3 GLU 32 HB1 GLU 32 -6.758 -5.071 -6.163 218 HG2 GLU 32 HG2 GLU 32 -7.746 -7.225 -6.067 219 HG3 GLU 32 HG1 GLU 32 -7.510 -7.477 -7.794 220 H SER 33 HN SER 33 -8.948 -4.039 -5.266 221 HA SER 33 HA SER 33 -11.103 -5.913 -4.747 222 HB2 SER 33 HB2 SER 33 -10.118 -3.516 -3.177 223 HB3 SER 33 HB1 SER 33 -11.366 -4.632 -2.625 224 HG SER 33 HG SER 33 -9.643 -5.553 -1.781 225 H GLY 34 HN GLY 34 -10.890 -3.422 -6.738 226 HA2 GLY 34 HA2 GLY 34 -12.890 -1.600 -6.098 227 HA3 GLY 34 HA1 GLY 34 -12.348 -1.968 -7.724 228 H LEU 35 HN LEU 35 -13.168 -4.709 -7.753 229 HA LEU 35 HA LEU 35 -15.879 -4.270 -8.527 230 HB2 LEU 35 HB2 LEU 35 -14.204 -6.775 -8.382 231 HB3 LEU 35 HB1 LEU 35 -15.865 -6.769 -8.936 232 HG LEU 35 HG LEU 35 -15.139 -5.130 -10.731 233 HD11 LEU 35 HD11 LEU 35 -12.399 -6.031 -9.863 234 HD12 LEU 35 HD12 LEU 35 -13.046 -4.396 -9.732 235 HD13 LEU 35 HD13 LEU 35 -12.770 -5.110 -11.320 236 HD21 LEU 35 HD21 LEU 35 -14.231 -6.892 -12.158 237 HD22 LEU 35 HD22 LEU 35 -15.587 -7.473 -11.192 238 HD23 LEU 35 HD23 LEU 35 -13.935 -7.892 -10.735 239 H LEU 36 HN LEU 36 -14.485 -6.597 -6.215 240 HA LEU 36 HA LEU 36 -16.956 -6.325 -4.646 241 HB2 LEU 36 HB2 LEU 36 -16.608 -8.557 -5.598 242 HB3 LEU 36 HB1 LEU 36 -15.043 -8.650 -4.817 243 HG LEU 36 HG LEU 36 -16.106 -8.673 -2.623 244 HD11 LEU 36 HD11 LEU 36 -18.050 -7.299 -3.092 245 HD12 LEU 36 HD12 LEU 36 -18.550 -8.859 -2.438 246 HD13 LEU 36 HD13 LEU 36 -18.694 -8.541 -4.166 247 HD21 LEU 36 HD21 LEU 36 -15.718 -10.785 -3.753 248 HD22 LEU 36 HD22 LEU 36 -17.281 -10.658 -4.561 249 HD23 LEU 36 HD23 LEU 36 -17.206 -10.858 -2.812 250 H HIS 37 HN HIS 37 -16.298 -4.627 -3.338 251 HA HIS 37 HA HIS 37 -14.071 -5.286 -1.543 252 HB2 HIS 37 HB2 HIS 37 -13.815 -2.872 -1.073 253 HB3 HIS 37 HB1 HIS 37 -13.509 -3.284 -2.751 254 HD1 HIS 37 HD1 HIS 37 -15.287 -0.934 -0.688 255 HD2 HIS 37 HD2 HIS 37 -15.835 -2.576 -4.471 256 HE1 HIS 37 HE1 HIS 37 -16.880 0.610 -1.872 257 HE2 HIS 37 HE2 HIS 37 -17.158 -0.369 -4.179 258 H THR 38 HN THR 38 -17.312 -3.870 -1.659 259 HA THR 38 HA THR 38 -17.511 -3.402 1.116 260 HB THR 38 HB THR 38 -19.837 -3.883 -0.747 261 HG1 THR 38 HG1 THR 38 -19.344 -2.079 -1.742 262 HG21 THR 38 HG21 THR 38 -20.393 -3.631 1.624 263 HG22 THR 38 HG22 THR 38 -20.958 -2.244 0.691 264 HG23 THR 38 HG23 THR 38 -19.501 -2.110 1.677 265 H GLY 39 HN GLY 39 -18.237 -6.170 -0.897 266 HA2 GLY 39 HA2 GLY 39 -19.711 -7.600 1.083 267 HA3 GLY 39 HA1 GLY 39 -19.035 -8.278 -0.391 268 H ASP 40 HN ASP 40 -16.439 -6.931 0.726 269 HA ASP 40 HA ASP 40 -15.657 -9.235 2.359 270 HB2 ASP 40 HB2 ASP 40 -14.301 -8.767 0.349 271 HB3 ASP 40 HB1 ASP 40 -13.960 -7.156 0.957 272 H VAL 41 HN VAL 41 -15.326 -5.716 2.185 273 HA VAL 41 HA VAL 41 -15.552 -5.459 5.057 274 HB VAL 41 HB VAL 41 -13.377 -3.997 5.028 275 HG11 VAL 41 HG11 VAL 41 -13.282 -7.010 5.140 276 HG12 VAL 41 HG12 VAL 41 -13.692 -5.927 6.469 277 HG13 VAL 41 HG13 VAL 41 -12.061 -5.921 5.800 278 HG21 VAL 41 HG21 VAL 41 -12.989 -4.286 2.611 279 HG22 VAL 41 HG22 VAL 41 -12.744 -6.013 2.877 280 HG23 VAL 41 HG23 VAL 41 -11.627 -4.846 3.586 281 H LEU 42 HN LEU 42 -16.393 -3.554 5.636 282 HA LEU 42 HA LEU 42 -16.525 -1.403 3.652 283 HB2 LEU 42 HB2 LEU 42 -18.681 -2.135 4.442 284 HB3 LEU 42 HB1 LEU 42 -18.158 -2.004 6.105 285 HG LEU 42 HG LEU 42 -17.995 0.438 5.846 286 HD11 LEU 42 HD11 LEU 42 -19.027 1.500 3.881 287 HD12 LEU 42 HD12 LEU 42 -19.181 -0.086 3.126 288 HD13 LEU 42 HD13 LEU 42 -17.584 0.577 3.465 289 HD21 LEU 42 HD21 LEU 42 -20.674 -0.753 5.142 290 HD22 LEU 42 HD22 LEU 42 -20.412 0.866 5.789 291 HD23 LEU 42 HD23 LEU 42 -20.014 -0.548 6.765 292 H ASP 43 HN ASP 43 -14.817 -2.456 6.245 293 HA ASP 43 HA ASP 43 -14.434 0.080 7.589 294 HB2 ASP 43 HB2 ASP 43 -14.581 -2.015 8.879 295 HB3 ASP 43 HB1 ASP 43 -13.141 -2.615 8.065 296 H GLN 44 HN GLN 44 -13.296 -1.078 4.783 297 HA GLN 44 HA GLN 44 -10.571 -1.030 4.772 298 HB2 GLN 44 HB2 GLN 44 -12.126 0.336 2.603 299 HB3 GLN 44 HB1 GLN 44 -10.629 -0.555 2.467 300 HG2 GLN 44 HG2 GLN 44 -11.830 -2.627 3.002 301 HG3 GLN 44 HG1 GLN 44 -13.339 -1.718 3.037 302 HE21 GLN 44 HE21 GLN 44 -10.866 -3.105 1.058 303 HE22 GLN 44 HE22 GLN 44 -11.650 -2.841 -0.461 304 H VAL 45 HN VAL 45 -9.019 0.435 4.887 305 HA VAL 45 HA VAL 45 -9.817 3.178 5.464 306 HB VAL 45 HB VAL 45 -8.669 1.993 7.289 307 HG11 VAL 45 HG11 VAL 45 -6.143 1.776 6.979 308 HG12 VAL 45 HG12 VAL 45 -6.550 1.691 5.262 309 HG13 VAL 45 HG13 VAL 45 -7.228 0.521 6.393 310 HG21 VAL 45 HG21 VAL 45 -7.134 4.311 6.135 311 HG22 VAL 45 HG22 VAL 45 -7.034 3.751 7.804 312 HG23 VAL 45 HG23 VAL 45 -8.546 4.415 7.186 313 H ALA 46 HN ALA 46 -9.265 4.715 4.160 314 HA ALA 46 HA ALA 46 -7.301 4.149 2.046 315 HB1 ALA 46 HB1 ALA 46 -8.395 5.980 0.810 316 HB2 ALA 46 HB2 ALA 46 -9.545 6.161 2.137 317 HB3 ALA 46 HB3 ALA 46 -9.505 4.668 1.201 318 H ILE 47 HN ILE 47 -5.406 5.070 2.256 319 HA ILE 47 HA ILE 47 -5.264 7.761 3.420 320 HB ILE 47 HB ILE 47 -2.996 7.173 4.319 321 HG12 ILE 47 HG12 ILE 47 -3.936 4.336 3.837 322 HG13 ILE 47 HG11 ILE 47 -2.605 5.135 3.004 323 HG21 ILE 47 HG21 ILE 47 -5.375 5.740 5.481 324 HG22 ILE 47 HG22 ILE 47 -4.875 7.402 5.797 325 HG23 ILE 47 HG23 ILE 47 -3.867 6.060 6.339 326 HD11 ILE 47 HD11 ILE 47 -1.474 5.379 5.210 327 HD12 ILE 47 HD12 ILE 47 -1.689 3.716 4.675 328 HD13 ILE 47 HD13 ILE 47 -2.754 4.387 5.911 329 H GLN 48 HN GLN 48 -3.308 8.939 2.724 330 HA GLN 48 HA GLN 48 -3.045 8.646 -0.135 331 HB2 GLN 48 HB2 GLN 48 -2.728 10.756 1.753 332 HB3 GLN 48 HB1 GLN 48 -1.219 10.587 0.873 333 HG2 GLN 48 HG2 GLN 48 -3.900 10.850 -0.454 334 HG3 GLN 48 HG1 GLN 48 -2.844 12.209 -0.094 335 HE21 GLN 48 HE21 GLN 48 -3.808 11.217 -2.657 336 HE22 GLN 48 HE22 GLN 48 -2.397 10.875 -3.592 337 H CYS 49 HN CYS 49 -1.389 8.048 -1.278 338 HA CYS 49 HA CYS 49 0.925 6.931 0.132 339 HB2 CYS 49 HB2 CYS 49 -0.701 5.566 -2.022 340 HB3 CYS 49 HB1 CYS 49 0.754 4.934 -1.279 341 H THR 50 HN THR 50 2.799 6.669 -1.190 342 HA THR 50 HA THR 50 2.821 7.804 -3.832 343 HB THR 50 HB THR 50 2.853 9.869 -2.559 344 HG1 THR 50 HG1 THR 50 4.934 10.656 -3.303 345 HG21 THR 50 HG21 THR 50 3.701 9.023 -0.444 346 HG22 THR 50 HG22 THR 50 4.673 10.386 -1.000 347 HG23 THR 50 HG23 THR 50 5.279 8.740 -1.175 348 H GLN 51 HN GLN 51 4.361 6.837 -4.994 349 HA GLN 51 HA GLN 51 6.477 5.449 -3.503 350 HB2 GLN 51 HB2 GLN 51 4.484 4.147 -4.718 351 HB3 GLN 51 HB1 GLN 51 5.547 4.347 -6.107 352 HG2 GLN 51 HG2 GLN 51 6.473 3.181 -3.505 353 HG3 GLN 51 HG1 GLN 51 5.787 2.203 -4.799 354 HE21 GLN 51 HE21 GLN 51 8.489 2.337 -3.555 355 HE22 GLN 51 HE22 GLN 51 9.582 2.534 -4.877 356 H ILE 52 HN ILE 52 8.288 6.491 -3.861 357 HA ILE 52 HA ILE 52 8.914 8.009 -6.155 358 HB ILE 52 HB ILE 52 10.680 6.818 -4.020 359 HG12 ILE 52 HG12 ILE 52 9.601 9.600 -4.472 360 HG13 ILE 52 HG11 ILE 52 9.144 8.489 -3.183 361 HG21 ILE 52 HG21 ILE 52 11.978 7.162 -6.066 362 HG22 ILE 52 HG22 ILE 52 12.455 8.291 -4.798 363 HG23 ILE 52 HG23 ILE 52 11.431 8.838 -6.123 364 HD11 ILE 52 HD11 ILE 52 11.354 8.653 -2.223 365 HD12 ILE 52 HD12 ILE 52 10.654 10.259 -2.424 366 HD13 ILE 52 HD13 ILE 52 11.880 9.684 -3.552 367 HA PRO 53 HA PRO 53 9.393 5.154 -9.421 368 HB2 PRO 53 HB2 PRO 53 11.984 6.621 -9.748 369 HB3 PRO 53 HB1 PRO 53 10.778 6.193 -10.965 370 HG2 PRO 53 HG2 PRO 53 10.944 8.667 -9.871 371 HG3 PRO 53 HG1 PRO 53 9.425 7.962 -10.443 372 HD2 PRO 53 HD2 PRO 53 10.262 8.554 -7.711 373 HD3 PRO 53 HD1 PRO 53 8.658 8.106 -8.323 374 H LEU 54 HN LEU 54 9.730 3.201 -8.525 375 HA LEU 54 HA LEU 54 11.974 2.538 -6.954 376 HB2 LEU 54 HB2 LEU 54 11.014 0.286 -6.933 377 HB3 LEU 54 HB1 LEU 54 9.820 1.517 -6.575 378 HG LEU 54 HG LEU 54 9.455 1.253 -9.250 379 HD11 LEU 54 HD11 LEU 54 11.075 -0.558 -9.442 380 HD12 LEU 54 HD12 LEU 54 9.444 -1.127 -9.793 381 HD13 LEU 54 HD13 LEU 54 10.188 -1.492 -8.238 382 HD21 LEU 54 HD21 LEU 54 8.175 -0.398 -7.079 383 HD22 LEU 54 HD22 LEU 54 7.508 -0.115 -8.686 384 HD23 LEU 54 HD23 LEU 54 7.710 1.231 -7.566 385 H LEU 55 HN LEU 55 13.847 1.621 -7.429 386 HA LEU 55 HA LEU 55 14.318 0.649 -10.147 387 HB2 LEU 55 HB2 LEU 55 16.172 1.004 -7.786 388 HB3 LEU 55 HB1 LEU 55 16.667 0.381 -9.345 389 HG LEU 55 HG LEU 55 15.624 3.159 -8.799 390 HD11 LEU 55 HD11 LEU 55 17.874 3.871 -9.382 391 HD12 LEU 55 HD12 LEU 55 18.365 2.189 -9.585 392 HD13 LEU 55 HD13 LEU 55 17.897 2.785 -7.994 393 HD21 LEU 55 HD21 LEU 55 16.192 3.603 -11.146 394 HD22 LEU 55 HD22 LEU 55 14.915 2.399 -10.993 395 HD23 LEU 55 HD23 LEU 55 16.561 1.895 -11.369 396 H ILE 56 HN ILE 56 14.101 -1.445 -10.606 397 HA ILE 56 HA ILE 56 12.967 -3.196 -8.750 398 HB ILE 56 HB ILE 56 14.353 -4.001 -11.299 399 HG12 ILE 56 HG12 ILE 56 11.485 -3.138 -10.846 400 HG13 ILE 56 HG11 ILE 56 12.713 -2.182 -11.665 401 HG21 ILE 56 HG21 ILE 56 12.782 -5.882 -11.275 402 HG22 ILE 56 HG22 ILE 56 12.134 -5.314 -9.736 403 HG23 ILE 56 HG23 ILE 56 13.803 -5.874 -9.836 404 HD11 ILE 56 HD11 ILE 56 12.845 -3.839 -13.430 405 HD12 ILE 56 HD12 ILE 56 11.191 -3.264 -13.231 406 HD13 ILE 56 HD13 ILE 56 11.659 -4.840 -12.595 407 H GLY 57 HN GLY 57 13.718 -4.707 -7.451 408 HA2 GLY 57 HA2 GLY 57 15.419 -6.211 -6.642 409 HA3 GLY 57 HA1 GLY 57 16.629 -5.119 -7.302 410 H ILE 58 HN ILE 58 15.026 -2.799 -6.285 411 HA ILE 58 HA ILE 58 16.243 -2.741 -3.654 412 HB ILE 58 HB ILE 58 15.575 -0.781 -5.650 413 HG12 ILE 58 HG12 ILE 58 17.786 -1.158 -4.627 414 HG13 ILE 58 HG11 ILE 58 17.269 0.517 -4.493 415 HG21 ILE 58 HG21 ILE 58 14.871 1.056 -4.146 416 HG22 ILE 58 HG22 ILE 58 14.621 -0.140 -2.866 417 HG23 ILE 58 HG23 ILE 58 13.648 -0.201 -4.337 418 HD11 ILE 58 HD11 ILE 58 17.137 -1.546 -2.307 419 HD12 ILE 58 HD12 ILE 58 16.625 0.134 -2.173 420 HD13 ILE 58 HD13 ILE 58 18.324 -0.250 -2.446 421 H ALA 59 HN ALA 59 15.158 -2.029 -1.813 422 HA ALA 59 HA ALA 59 12.552 -3.256 -1.500 423 HB1 ALA 59 HB1 ALA 59 12.990 -2.910 0.883 424 HB2 ALA 59 HB2 ALA 59 14.440 -1.989 0.471 425 HB3 ALA 59 HB3 ALA 59 14.347 -3.705 0.083 426 H ILE 60 HN ILE 60 10.729 -2.243 -0.888 427 HA ILE 60 HA ILE 60 10.094 0.354 -1.632 428 HB ILE 60 HB ILE 60 8.432 -1.407 -1.235 429 HG12 ILE 60 HG12 ILE 60 6.791 -0.071 0.172 430 HG13 ILE 60 HG11 ILE 60 8.091 1.084 0.441 431 HG21 ILE 60 HG21 ILE 60 9.265 -1.125 1.644 432 HG22 ILE 60 HG22 ILE 60 9.310 -2.568 0.627 433 HG23 ILE 60 HG23 ILE 60 7.761 -1.903 1.144 434 HD11 ILE 60 HD11 ILE 60 6.608 1.802 -1.337 435 HD12 ILE 60 HD12 ILE 60 6.947 0.319 -2.232 436 HD13 ILE 60 HD13 ILE 60 8.233 1.493 -1.950 437 H GLU 61 HN GLU 61 11.339 -0.896 1.366 438 HA GLU 61 HA GLU 61 10.695 1.380 2.967 439 HB2 GLU 61 HB2 GLU 61 12.225 0.118 4.614 440 HB3 GLU 61 HB1 GLU 61 10.713 -0.635 4.141 441 HG2 GLU 61 HG2 GLU 61 11.780 -2.164 2.733 442 HG3 GLU 61 HG1 GLU 61 13.281 -1.248 2.727 443 H ASP 62 HN ASP 62 13.249 0.597 0.853 444 HA ASP 62 HA ASP 62 15.024 2.575 2.116 445 HB2 ASP 62 HB2 ASP 62 15.633 0.435 0.064 446 HB3 ASP 62 HB1 ASP 62 16.803 1.602 0.670 447 H GLU 63 HN GLU 63 13.085 1.907 -0.635 448 HA GLU 63 HA GLU 63 14.401 3.661 -2.463 449 HB2 GLU 63 HB2 GLU 63 13.033 1.675 -3.111 450 HB3 GLU 63 HB1 GLU 63 11.597 2.537 -2.585 451 HG2 GLU 63 HG2 GLU 63 11.813 2.654 -4.978 452 HG3 GLU 63 HG1 GLU 63 12.018 4.247 -4.270 453 H CYS 64 HN CYS 64 11.652 3.948 -0.265 454 HA CYS 64 HA CYS 64 11.357 6.758 -1.110 455 HB2 CYS 64 HB2 CYS 64 9.061 6.644 -0.645 456 HB3 CYS 64 HB1 CYS 64 9.404 5.086 -1.386 457 H LYS 65 HN LYS 65 10.386 8.128 0.769 458 HA LYS 65 HA LYS 65 11.751 7.386 3.271 459 HB2 LYS 65 HB2 LYS 65 11.323 10.155 2.134 460 HB3 LYS 65 HB1 LYS 65 12.020 9.805 3.707 461 HG2 LYS 65 HG2 LYS 65 13.186 8.942 1.074 462 HG3 LYS 65 HG1 LYS 65 13.719 10.329 2.024 463 HD2 LYS 65 HD2 LYS 65 14.365 8.888 3.849 464 HD3 LYS 65 HD1 LYS 65 13.707 7.483 3.014 465 HE2 LYS 65 HE2 LYS 65 16.117 7.534 2.787 466 HE3 LYS 65 HE1 LYS 65 15.355 7.797 1.220 467 HZ1 LYS 65 HZ1 LYS 65 16.470 9.913 2.976 468 HZ2 LYS 65 HZ2 LYS 65 15.745 10.167 1.470 469 HZ3 LYS 65 HZ3 LYS 65 17.196 9.310 1.575 470 H ASN 66 HN ASN 66 9.225 6.489 2.841 471 HA ASN 66 HA ASN 66 7.784 7.979 4.914 472 HB2 ASN 66 HB2 ASN 66 6.620 6.975 2.323 473 HB3 ASN 66 HB1 ASN 66 5.623 7.300 3.726 474 HD21 ASN 66 HD21 ASN 66 7.546 8.671 1.196 475 HD22 ASN 66 HD22 ASN 66 7.050 10.309 1.431 476 H THR 67 HN THR 67 5.674 6.320 5.319 477 HA THR 67 HA THR 67 7.041 4.152 6.596 478 HB THR 67 HB THR 67 4.067 4.680 6.633 479 HG1 THR 67 HG1 THR 67 6.197 5.771 8.191 480 HG21 THR 67 HG21 THR 67 4.697 2.492 7.459 481 HG22 THR 67 HG22 THR 67 4.253 3.518 8.825 482 HG23 THR 67 HG23 THR 67 5.953 3.198 8.474 483 HA PRO 68 HA PRO 68 6.170 1.056 3.481 484 HB2 PRO 68 HB2 PRO 68 6.908 -0.804 5.579 485 HB3 PRO 68 HB1 PRO 68 7.741 -0.469 4.065 486 HG2 PRO 68 HG2 PRO 68 8.596 0.255 6.609 487 HG3 PRO 68 HG1 PRO 68 9.205 0.922 5.087 488 HD2 PRO 68 HD2 PRO 68 7.466 2.125 7.101 489 HD3 PRO 68 HD1 PRO 68 8.394 2.896 5.808 490 H THR 69 HN THR 69 4.032 0.589 3.226 491 HA THR 69 HA THR 69 2.678 -0.624 5.542 492 HB THR 69 HB THR 69 0.569 0.456 4.835 493 HG1 THR 69 HG1 THR 69 2.257 1.462 2.818 494 HG21 THR 69 HG21 THR 69 1.128 2.766 5.523 495 HG22 THR 69 HG22 THR 69 2.841 2.374 5.367 496 HG23 THR 69 HG23 THR 69 1.853 1.549 6.574 497 H CYS 70 HN CYS 70 1.360 -2.343 5.156 498 HA CYS 70 HA CYS 70 1.426 -3.496 2.471 499 HB2 CYS 70 HB2 CYS 70 1.965 -5.029 4.267 500 HB3 CYS 70 HB1 CYS 70 0.487 -4.607 5.125 501 H CYS 71 HN CYS 71 -0.092 -2.673 1.188 502 HA CYS 71 HA CYS 71 -2.725 -2.028 2.269 503 HB2 CYS 71 HB2 CYS 71 -1.665 -1.658 -0.540 504 HB3 CYS 71 HB1 CYS 71 -3.144 -0.977 0.121 505 H GLU 72 HN GLU 72 -4.480 -3.231 1.943 506 HA GLU 72 HA GLU 72 -4.352 -5.816 0.836 507 HB2 GLU 72 HB2 GLU 72 -6.091 -5.790 2.270 508 HB3 GLU 72 HB1 GLU 72 -6.344 -4.064 2.083 509 HG2 GLU 72 HG2 GLU 72 -7.576 -4.447 0.045 510 HG3 GLU 72 HG1 GLU 72 -7.286 -6.179 0.179 511 H ASP 73 HN ASP 73 -5.365 -2.690 -0.361 512 HA ASP 73 HA ASP 73 -4.886 -3.586 -3.080 513 HB2 ASP 73 HB2 ASP 73 -7.382 -3.927 -2.603 514 HB3 ASP 73 HB1 ASP 73 -7.490 -2.176 -2.471 515 H VAL 74 HN VAL 74 -4.863 -1.612 -4.549 516 HA VAL 74 HA VAL 74 -4.638 0.905 -3.062 517 HB VAL 74 HB VAL 74 -2.657 0.398 -5.253 518 HG11 VAL 74 HG11 VAL 74 -3.024 2.662 -4.393 519 HG12 VAL 74 HG12 VAL 74 -1.383 2.089 -4.082 520 HG13 VAL 74 HG13 VAL 74 -2.571 2.113 -2.780 521 HG21 VAL 74 HG21 VAL 74 -0.985 -0.332 -3.624 522 HG22 VAL 74 HG22 VAL 74 -2.326 -1.474 -3.706 523 HG23 VAL 74 HG23 VAL 74 -2.212 -0.339 -2.357 524 H GLU 75 HN GLU 75 -5.523 2.596 -4.080 525 HA GLU 75 HA GLU 75 -6.752 2.060 -6.692 526 HB2 GLU 75 HB2 GLU 75 -8.069 2.738 -4.521 527 HB3 GLU 75 HB1 GLU 75 -7.518 4.358 -4.923 528 HG2 GLU 75 HG2 GLU 75 -8.574 4.135 -7.136 529 HG3 GLU 75 HG1 GLU 75 -9.185 2.553 -6.659 530 H ASP 76 HN ASP 76 -6.970 4.030 -8.128 531 HA ASP 76 HA ASP 76 -6.005 5.634 -9.412 532 HB2 ASP 76 HB2 ASP 76 -5.057 6.395 -6.682 533 HB3 ASP 76 HB1 ASP 76 -4.291 7.164 -8.062 534 H ASP 77 HN ASP 77 -3.328 6.680 -9.301 535 HA ASP 77 HA ASP 77 -1.837 4.460 -10.324 536 HB2 ASP 77 HB2 ASP 77 -1.296 7.370 -9.924 537 HB3 ASP 77 HB1 ASP 77 0.074 6.289 -10.151 538 H GLY 78 HN GLY 78 -2.718 4.411 -7.472 539 HA2 GLY 78 HA2 GLY 78 -1.706 3.237 -5.705 540 HA3 GLY 78 HA1 GLY 78 -0.129 3.711 -6.312 541 H LEU 79 HN LEU 79 -2.627 6.079 -6.062 542 HA LEU 79 HA LEU 79 -1.020 7.527 -4.118 543 HB2 LEU 79 HB2 LEU 79 -3.495 8.383 -5.614 544 HB3 LEU 79 HB1 LEU 79 -2.486 9.419 -4.624 545 HG LEU 79 HG LEU 79 -1.667 8.075 -7.202 546 HD11 LEU 79 HD11 LEU 79 -2.160 10.975 -6.545 547 HD12 LEU 79 HD12 LEU 79 -3.205 9.940 -7.517 548 HD13 LEU 79 HD13 LEU 79 -1.586 10.343 -8.087 549 HD21 LEU 79 HD21 LEU 79 -0.127 9.917 -5.378 550 HD22 LEU 79 HD22 LEU 79 0.393 9.398 -6.979 551 HD23 LEU 79 HD23 LEU 79 0.218 8.215 -5.685 552 H VAL 80 HN VAL 80 -3.836 5.605 -4.191 553 HA VAL 80 HA VAL 80 -4.468 6.433 -1.440 554 HB VAL 80 HB VAL 80 -6.518 5.783 -3.573 555 HG11 VAL 80 HG11 VAL 80 -6.887 6.547 -0.679 556 HG12 VAL 80 HG12 VAL 80 -7.180 4.955 -1.378 557 HG13 VAL 80 HG13 VAL 80 -8.179 6.328 -1.858 558 HG21 VAL 80 HG21 VAL 80 -7.247 8.100 -3.311 559 HG22 VAL 80 HG22 VAL 80 -5.567 8.020 -3.843 560 HG23 VAL 80 HG23 VAL 80 -5.943 8.386 -2.160 561 H GLY 81 HN GLY 81 -3.950 4.725 -0.223 562 HA2 GLY 81 HA2 GLY 81 -4.174 2.055 -1.412 563 HA3 GLY 81 HA1 GLY 81 -3.240 2.465 0.018 564 H ILE 82 HN ILE 82 -5.307 0.400 -0.523 565 HA ILE 82 HA ILE 82 -7.367 1.161 1.422 566 HB ILE 82 HB ILE 82 -7.215 -0.971 -0.686 567 HG12 ILE 82 HG12 ILE 82 -9.539 -0.153 -1.152 568 HG13 ILE 82 HG11 ILE 82 -9.301 1.074 0.088 569 HG21 ILE 82 HG21 ILE 82 -7.816 -2.239 1.230 570 HG22 ILE 82 HG22 ILE 82 -9.278 -1.984 0.275 571 HG23 ILE 82 HG23 ILE 82 -8.995 -1.032 1.731 572 HD11 ILE 82 HD11 ILE 82 -8.937 1.984 -2.124 573 HD12 ILE 82 HD12 ILE 82 -7.697 0.766 -2.433 574 HD13 ILE 82 HD13 ILE 82 -7.440 1.992 -1.189 575 H ASN 83 HN ASN 83 -7.045 0.593 3.447 576 HA ASN 83 HA ASN 83 -6.459 -0.590 5.298 577 HB2 ASN 83 HB2 ASN 83 -6.762 -2.807 3.294 578 HB3 ASN 83 HB1 ASN 83 -6.321 -3.146 4.959 579 HD21 ASN 83 HD21 ASN 83 -8.686 -3.958 3.534 580 HD22 ASN 83 HD22 ASN 83 -10.026 -3.299 4.396 581 H CYS 84 HN CYS 84 -4.410 0.742 4.463 582 HA CYS 84 HA CYS 84 -2.150 -0.994 3.882 583 HB2 CYS 84 HB2 CYS 84 -2.287 2.007 4.191 584 HB3 CYS 84 HB1 CYS 84 -0.891 1.099 3.626 585 H THR 85 HN THR 85 -1.704 -2.117 5.696 586 HA THR 85 HA THR 85 -1.490 -0.774 8.261 587 HB THR 85 HB THR 85 -0.865 -3.665 7.648 588 HG1 THR 85 HG1 THR 85 -3.339 -2.328 8.006 589 HG21 THR 85 HG21 THR 85 -1.501 -3.992 10.000 590 HG22 THR 85 HG22 THR 85 -1.782 -2.259 10.161 591 HG23 THR 85 HG23 THR 85 -0.156 -2.861 9.847 592 HA PRO 86 HA PRO 86 2.872 0.051 7.704 593 HB2 PRO 86 HB2 PRO 86 2.819 0.308 10.653 594 HB3 PRO 86 HB1 PRO 86 3.328 1.482 9.435 595 HG2 PRO 86 HG2 PRO 86 1.037 1.811 10.741 596 HG3 PRO 86 HG1 PRO 86 1.151 2.171 9.010 597 HD2 PRO 86 HD2 PRO 86 0.018 -0.248 10.364 598 HD3 PRO 86 HD1 PRO 86 -0.638 0.703 9.019 599 H ILE 87 HN ILE 87 4.273 -1.537 7.396 600 HA ILE 87 HA ILE 87 4.135 -3.901 9.091 601 HB ILE 87 HB ILE 87 5.628 -4.839 7.214 602 HG12 ILE 87 HG12 ILE 87 4.430 -2.490 5.738 603 HG13 ILE 87 HG11 ILE 87 6.112 -2.586 6.232 604 HG21 ILE 87 HG21 ILE 87 3.646 -5.334 5.830 605 HG22 ILE 87 HG22 ILE 87 2.748 -4.109 6.728 606 HG23 ILE 87 HG23 ILE 87 3.352 -5.546 7.557 607 HD11 ILE 87 HD11 ILE 87 6.416 -4.543 4.812 608 HD12 ILE 87 HD12 ILE 87 5.834 -3.157 3.891 609 HD13 ILE 87 HD13 ILE 87 4.722 -4.455 4.330 610 HA PRO 88 HA PRO 88 8.126 -3.146 10.933 611 HB2 PRO 88 HB2 PRO 88 8.421 -6.065 11.009 612 HB3 PRO 88 HB1 PRO 88 8.338 -4.923 12.344 613 HG2 PRO 88 HG2 PRO 88 6.330 -6.594 11.849 614 HG3 PRO 88 HG1 PRO 88 6.022 -4.923 12.364 615 HD2 PRO 88 HD2 PRO 88 5.974 -6.083 9.599 616 HD3 PRO 88 HD1 PRO 88 4.781 -5.036 10.390 617 H LEU 89 HN LEU 89 10.374 -3.578 10.596 618 HA LEU 89 HA LEU 89 10.967 -4.067 7.778 619 HB2 LEU 89 HB2 LEU 89 12.750 -3.040 9.986 620 HB3 LEU 89 HB1 LEU 89 13.124 -3.045 8.272 621 HG LEU 89 HG LEU 89 10.955 -1.411 9.592 622 HD11 LEU 89 HD11 LEU 89 13.179 -0.593 10.114 623 HD12 LEU 89 HD12 LEU 89 12.368 0.498 8.989 624 HD13 LEU 89 HD13 LEU 89 13.606 -0.612 8.404 625 HD21 LEU 89 HD21 LEU 89 10.312 -2.058 7.342 626 HD22 LEU 89 HD22 LEU 89 11.869 -1.512 6.720 627 HD23 LEU 89 HD23 LEU 89 10.730 -0.346 7.392 628 H ILE 90 HN ILE 90 10.399 -6.225 9.759 629 HA ILE 90 HA ILE 90 12.970 -7.637 9.637 630 HB ILE 90 HB ILE 90 12.345 -8.752 11.773 631 HG12 ILE 90 HG12 ILE 90 10.234 -6.586 11.911 632 HG13 ILE 90 HG11 ILE 90 9.911 -8.299 11.665 633 HG21 ILE 90 HG21 ILE 90 12.689 -5.755 11.777 634 HG22 ILE 90 HG22 ILE 90 13.958 -6.982 11.805 635 HG23 ILE 90 HG23 ILE 90 12.900 -6.780 13.201 636 HD11 ILE 90 HD11 ILE 90 9.504 -7.634 13.961 637 HD12 ILE 90 HD12 ILE 90 11.169 -7.075 14.105 638 HD13 ILE 90 HD13 ILE 90 10.833 -8.788 13.865
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