NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
617357 | 5unk | 30239 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 ALA 1 HT1 ALA 1 61.250 8.618 0.071 2 H2 ALA 1 HT2 ALA 1 62.177 8.603 1.494 3 H3 ALA 1 HT3 ALA 1 60.666 9.377 1.474 4 HA ALA 1 HA ALA 1 59.543 7.278 1.131 5 HB1 ALA 1 HB1 ALA 1 61.381 6.306 -0.236 6 HB2 ALA 1 HB2 ALA 1 62.398 6.127 1.235 7 HB3 ALA 1 HB3 ALA 1 60.885 5.159 1.058 8 H SER 2 HN SER 2 62.442 6.860 3.256 9 HA SER 2 HA SER 2 61.021 5.414 5.125 10 HB2 SER 2 HB1 SER 2 63.440 5.107 4.740 11 HB3 SER 2 HB2 SER 2 63.795 6.770 5.305 12 HG SER 2 HG SER 2 64.128 4.969 6.823 13 H MET 3 HN MET 3 61.861 8.848 5.101 14 HA MET 3 HA MET 3 61.351 9.489 7.749 15 HB2 MET 3 HB1 MET 3 62.649 10.812 6.029 16 HB3 MET 3 HB2 MET 3 61.132 11.196 5.177 17 HG2 MET 3 HG1 MET 3 61.748 13.171 6.472 18 HG3 MET 3 HG2 MET 3 60.367 12.425 7.340 19 HE1 MET 3 HE1 MET 3 61.483 11.915 10.809 20 HE2 MET 3 HE2 MET 3 60.325 12.764 9.729 21 HE3 MET 3 HE3 MET 3 60.575 10.992 9.563 22 H VAL 4 HN VAL 4 59.147 8.608 5.317 23 HA VAL 4 HA VAL 4 56.958 8.695 4.898 24 HB VAL 4 HB VAL 4 56.527 10.075 7.538 25 HG11 VAL 4 HG11 VAL 4 54.162 9.185 7.205 26 HG12 VAL 4 HG12 VAL 4 54.613 10.365 5.937 27 HG13 VAL 4 HG13 VAL 4 54.623 8.598 5.569 28 HG21 VAL 4 HG21 VAL 4 55.859 7.700 8.285 29 HG22 VAL 4 HG22 VAL 4 56.425 7.068 6.695 30 HG23 VAL 4 HG23 VAL 4 57.594 7.802 7.852 31 H LEU 5 HN LEU 5 57.762 9.945 3.219 32 HA LEU 5 HA LEU 5 58.293 12.677 3.376 33 HB2 LEU 5 HB1 LEU 5 59.368 10.997 1.852 34 HB3 LEU 5 HB2 LEU 5 57.819 10.735 1.017 35 HG LEU 5 HG LEU 5 57.898 13.179 0.244 36 HD11 LEU 5 HD11 LEU 5 60.166 14.337 0.436 37 HD12 LEU 5 HD12 LEU 5 59.401 14.079 2.046 38 HD13 LEU 5 HD13 LEU 5 60.743 13.006 1.500 39 HD21 LEU 5 HD21 LEU 5 59.662 12.784 -1.489 40 HD22 LEU 5 HD22 LEU 5 60.322 11.409 -0.547 41 HD23 LEU 5 HD23 LEU 5 58.659 11.310 -1.230 42 H SER 6 HN SER 6 55.471 10.844 2.038 43 HA SER 6 HA SER 6 53.996 13.373 1.938 44 HB2 SER 6 HB1 SER 6 53.447 10.615 0.617 45 HB3 SER 6 HB2 SER 6 52.329 12.007 0.472 46 HG SER 6 HG SER 6 53.884 11.616 -1.310 47 HA PRO 7 HA PRO 7 52.869 11.371 5.688 48 HB2 PRO 7 HB2 PRO 7 51.417 13.272 6.997 49 HB3 PRO 7 HB1 PRO 7 53.187 13.422 6.662 50 HG2 PRO 7 HG2 PRO 7 51.006 14.656 4.950 51 HG3 PRO 7 HG1 PRO 7 52.468 15.453 5.668 52 HD2 PRO 7 HD2 PRO 7 52.482 14.405 3.101 53 HD3 PRO 7 HD1 PRO 7 53.968 14.409 4.171 54 H ARG 8 HN ARG 8 50.104 12.459 3.512 55 HA ARG 8 HA ARG 8 48.411 10.620 4.964 56 HB2 ARG 8 HB1 ARG 8 48.153 12.014 2.251 57 HB3 ARG 8 HB2 ARG 8 46.906 10.892 2.846 58 HG2 ARG 8 HG1 ARG 8 46.753 12.488 4.949 59 HG3 ARG 8 HG2 ARG 8 47.766 13.624 4.040 60 HD2 ARG 8 HD1 ARG 8 45.392 14.252 3.707 61 HD3 ARG 8 HD2 ARG 8 46.087 13.706 2.126 62 HE ARG 8 HE ARG 8 44.877 11.580 3.763 63 HH11 ARG 8 HH11 ARG 8 42.885 13.307 0.594 64 HH12 ARG 8 HH12 ARG 8 44.067 14.172 1.545 65 HH21 ARG 8 HH21 ARG 8 42.504 11.003 1.115 66 HH22 ARG 8 HH22 ARG 8 43.442 10.283 2.379 67 H ASP 9 HN ASP 9 50.326 10.501 1.820 68 HA ASP 9 HA ASP 9 48.864 8.177 1.118 69 HB2 ASP 9 HB1 ASP 9 51.196 9.718 -0.194 70 HB3 ASP 9 HB2 ASP 9 50.398 8.309 -0.975 71 H GLU 10 HN GLU 10 52.344 8.835 2.080 72 HA GLU 10 HA GLU 10 53.136 6.170 1.631 73 HB2 GLU 10 HB1 GLU 10 54.702 8.145 1.735 74 HB3 GLU 10 HB2 GLU 10 54.335 8.343 3.463 75 HG2 GLU 10 HG1 GLU 10 56.479 7.185 3.281 76 HG3 GLU 10 HG2 GLU 10 55.301 5.937 3.838 77 H ARG 11 HN ARG 11 51.914 7.934 4.442 78 HA ARG 11 HA ARG 11 52.400 5.965 6.402 79 HB2 ARG 11 HB1 ARG 11 51.905 8.499 6.626 80 HB3 ARG 11 HB2 ARG 11 50.186 8.120 6.365 81 HG2 ARG 11 HG1 ARG 11 50.251 8.138 8.705 82 HG3 ARG 11 HG2 ARG 11 50.582 6.418 8.435 83 HD2 ARG 11 HD1 ARG 11 53.099 6.864 8.425 84 HD3 ARG 11 HD2 ARG 11 52.781 8.575 8.926 85 HE ARG 11 HE ARG 11 51.390 6.665 10.596 86 HH11 ARG 11 HH11 ARG 11 53.781 7.122 13.271 87 HH12 ARG 11 HH12 ARG 11 52.199 6.539 12.814 88 HH21 ARG 11 HH21 ARG 11 55.116 8.154 11.581 89 HH22 ARG 11 HH22 ARG 11 54.482 8.245 9.974 90 H THR 12 HN THR 12 49.419 6.698 4.463 91 HA THR 12 HA THR 12 47.909 4.595 5.501 92 HB THR 12 HB THR 12 47.802 6.002 2.809 93 HG1 THR 12 HG1 THR 12 46.053 7.081 3.820 94 HG21 THR 12 HG21 THR 12 45.402 5.158 2.644 95 HG22 THR 12 HG22 THR 12 46.477 3.739 2.879 96 HG23 THR 12 HG23 THR 12 45.526 4.385 4.265 97 H LEU 13 HN LEU 13 50.152 4.696 2.640 98 HA LEU 13 HA LEU 13 49.427 2.211 1.657 99 HB2 LEU 13 HB1 LEU 13 50.665 3.967 0.388 100 HB3 LEU 13 HB2 LEU 13 52.059 3.823 1.485 101 HG LEU 13 HG LEU 13 51.102 1.417 -0.089 102 HD11 LEU 13 HD11 LEU 13 52.656 2.178 -2.027 103 HD12 LEU 13 HD12 LEU 13 51.211 3.231 -1.802 104 HD13 LEU 13 HD13 LEU 13 52.824 3.768 -1.202 105 HD21 LEU 13 HD21 LEU 13 53.547 0.818 -0.225 106 HD22 LEU 13 HD22 LEU 13 53.976 2.293 0.697 107 HD23 LEU 13 HD23 LEU 13 52.990 1.006 1.477 108 H VAL 14 HN VAL 14 52.098 3.073 4.024 109 HA VAL 14 HA VAL 14 53.092 0.448 4.066 110 HB VAL 14 HB VAL 14 54.381 1.063 6.016 111 HG11 VAL 14 HG11 VAL 14 55.696 2.899 4.786 112 HG12 VAL 14 HG12 VAL 14 55.231 1.564 3.689 113 HG13 VAL 14 HG13 VAL 14 54.309 3.115 3.663 114 HG21 VAL 14 HG21 VAL 14 54.381 3.426 6.852 115 HG22 VAL 14 HG22 VAL 14 52.885 3.749 5.902 116 HG23 VAL 14 HG23 VAL 14 52.871 2.546 7.242 117 H ARG 15 HN ARG 15 50.640 2.133 6.139 118 HA ARG 15 HA ARG 15 50.293 -0.030 7.910 119 HB2 ARG 15 HB1 ARG 15 49.473 2.264 8.347 120 HB3 ARG 15 HB2 ARG 15 48.382 2.202 6.942 121 HG2 ARG 15 HG1 ARG 15 47.010 1.885 8.911 122 HG3 ARG 15 HG2 ARG 15 47.108 0.291 8.140 123 HD2 ARG 15 HD1 ARG 15 47.381 -0.156 10.470 124 HD3 ARG 15 HD2 ARG 15 49.041 -0.336 9.769 125 HE ARG 15 HE ARG 15 49.714 1.703 10.687 126 HH11 ARG 15 HH11 ARG 15 48.150 3.272 13.524 127 HH12 ARG 15 HH12 ARG 15 49.636 2.992 12.649 128 HH21 ARG 15 HH21 ARG 15 46.190 2.143 12.781 129 HH22 ARG 15 HH22 ARG 15 46.301 1.125 11.387 130 H LYS 16 HN LYS 16 48.477 0.736 4.786 131 HA LYS 16 HA LYS 16 46.757 -1.420 5.213 132 HB2 LYS 16 HB1 LYS 16 47.387 0.224 2.752 133 HB3 LYS 16 HB2 LYS 16 46.234 -1.134 2.686 134 HG2 LYS 16 HG1 LYS 16 44.978 0.021 4.685 135 HG3 LYS 16 HG2 LYS 16 46.063 1.430 4.440 136 HD2 LYS 16 HD1 LYS 16 45.202 1.724 2.128 137 HD3 LYS 16 HD2 LYS 16 44.233 0.218 2.265 138 HE2 LYS 16 HE1 LYS 16 42.933 1.308 4.210 139 HE3 LYS 16 HE2 LYS 16 43.810 2.846 3.861 140 HZ1 LYS 16 HZ1 LYS 16 41.682 2.745 2.743 141 HZ2 LYS 16 HZ2 LYS 16 42.945 2.762 1.608 142 HZ3 LYS 16 HZ3 LYS 16 42.123 1.317 1.939 143 H VAL 17 HN VAL 17 49.835 -1.277 3.178 144 HA VAL 17 HA VAL 17 49.291 -3.731 1.962 145 HB VAL 17 HB VAL 17 50.778 -2.005 1.059 146 HG11 VAL 17 HG11 VAL 17 53.196 -1.998 1.784 147 HG12 VAL 17 HG12 VAL 17 52.120 -1.361 3.064 148 HG13 VAL 17 HG13 VAL 17 52.777 -3.036 3.191 149 HG21 VAL 17 HG21 VAL 17 52.441 -3.673 0.140 150 HG22 VAL 17 HG22 VAL 17 51.882 -4.869 1.367 151 HG23 VAL 17 HG23 VAL 17 50.751 -4.266 0.102 152 H GLN 18 HN GLN 18 51.067 -2.966 5.031 153 HA GLN 18 HA GLN 18 51.919 -5.637 5.342 154 HB2 GLN 18 HB1 GLN 18 51.849 -3.179 7.130 155 HB3 GLN 18 HB2 GLN 18 52.495 -4.731 7.722 156 HG2 GLN 18 HG1 GLN 18 54.214 -4.741 5.800 157 HG3 GLN 18 HG2 GLN 18 53.525 -3.209 5.168 158 HE21 GLN 18 HE21 GLN 18 54.963 -1.316 7.973 159 HE22 GLN 18 HE22 GLN 18 53.398 -1.485 7.203 160 H ILE 19 HN ILE 19 49.131 -3.725 6.839 161 HA ILE 19 HA ILE 19 48.332 -5.917 8.390 162 HB ILE 19 HB ILE 19 46.951 -3.433 7.404 163 HG12 ILE 19 HG11 ILE 19 48.745 -2.949 8.982 164 HG13 ILE 19 HG12 ILE 19 47.163 -2.630 9.761 165 HG21 ILE 19 HG21 ILE 19 45.065 -3.917 9.035 166 HG22 ILE 19 HG22 ILE 19 45.228 -5.323 7.936 167 HG23 ILE 19 HG23 ILE 19 45.892 -5.408 9.608 168 HD11 ILE 19 HD11 ILE 19 48.692 -3.672 11.367 169 HD12 ILE 19 HD12 ILE 19 47.341 -4.809 11.012 170 HD13 ILE 19 HD13 ILE 19 48.966 -5.078 10.281 171 H ASN 20 HN ASN 20 47.279 -4.850 5.040 172 HA ASN 20 HA ASN 20 45.720 -7.313 4.972 173 HB2 ASN 20 HB1 ASN 20 45.509 -4.688 3.340 174 HB3 ASN 20 HB2 ASN 20 44.484 -6.118 3.002 175 HD21 ASN 20 HD21 ASN 20 42.575 -5.674 6.130 176 HD22 ASN 20 HD22 ASN 20 43.294 -6.950 5.180 177 HA PRO 21 HA PRO 21 49.180 -8.163 2.118 178 HB2 PRO 21 HB2 PRO 21 49.048 -10.892 2.030 179 HB3 PRO 21 HB1 PRO 21 49.631 -10.003 3.492 180 HG2 PRO 21 HG2 PRO 21 46.802 -11.057 3.068 181 HG3 PRO 21 HG1 PRO 21 47.895 -11.316 4.492 182 HD2 PRO 21 HD2 PRO 21 46.037 -9.264 4.433 183 HD3 PRO 21 HD1 PRO 21 47.645 -9.114 5.295 184 H ARG 22 HN ARG 22 45.864 -8.671 1.772 185 HA ARG 22 HA ARG 22 45.542 -9.569 -0.860 186 HB2 ARG 22 HB1 ARG 22 43.783 -9.467 0.883 187 HB3 ARG 22 HB2 ARG 22 43.855 -7.689 0.915 188 HG2 ARG 22 HG1 ARG 22 43.050 -7.685 -1.518 189 HG3 ARG 22 HG2 ARG 22 42.951 -9.455 -1.472 190 HD2 ARG 22 HD1 ARG 22 41.341 -9.395 0.470 191 HD3 ARG 22 HD2 ARG 22 41.306 -7.586 0.400 192 HE ARG 22 HE ARG 22 40.832 -8.621 -2.209 193 HH11 ARG 22 HH11 ARG 22 37.697 -8.289 0.474 194 HH12 ARG 22 HH12 ARG 22 39.365 -8.407 0.980 195 HH21 ARG 22 HH21 ARG 22 37.237 -8.355 -1.869 196 HH22 ARG 22 HH22 ARG 22 38.571 -8.473 -2.965 197 H THR 23 HN THR 23 46.330 -6.302 0.379 198 HA THR 23 HA THR 23 45.408 -4.871 -1.805 199 HB THR 23 HB THR 23 47.596 -4.269 0.233 200 HG1 THR 23 HG1 THR 23 45.908 -3.050 1.194 201 HG21 THR 23 HG21 THR 23 47.237 -1.807 -0.274 202 HG22 THR 23 HG22 THR 23 47.636 -2.639 -1.814 203 HG23 THR 23 HG23 THR 23 45.929 -2.199 -1.447 204 H THR 24 HN THR 24 46.215 -4.186 -3.757 205 HA THR 24 HA THR 24 48.930 -5.005 -4.405 206 HB THR 24 HB THR 24 47.371 -6.758 -5.169 207 HG1 THR 24 HG1 THR 24 47.960 -6.717 -7.367 208 HG21 THR 24 HG21 THR 24 45.683 -6.272 -6.977 209 HG22 THR 24 HG22 THR 24 45.341 -5.235 -5.551 210 HG23 THR 24 HG23 THR 24 46.154 -4.534 -6.997 211 H ALA 25 HN ALA 25 49.330 -4.112 -6.824 212 HA ALA 25 HA ALA 25 49.832 -1.390 -6.425 213 HB1 ALA 25 HB1 ALA 25 51.242 -2.921 -7.788 214 HB2 ALA 25 HB2 ALA 25 49.932 -3.051 -9.010 215 HB3 ALA 25 HB3 ALA 25 50.762 -1.472 -8.737 216 H LYS 26 HN LYS 26 47.240 -2.969 -8.278 217 HA LYS 26 HA LYS 26 46.261 -0.731 -9.602 218 HB2 LYS 26 HB1 LYS 26 44.913 -3.297 -8.605 219 HB3 LYS 26 HB2 LYS 26 44.085 -2.140 -9.679 220 HG2 LYS 26 HG1 LYS 26 45.992 -2.467 -11.391 221 HG3 LYS 26 HG2 LYS 26 46.717 -3.688 -10.295 222 HD2 LYS 26 HD1 LYS 26 44.470 -4.972 -10.465 223 HD3 LYS 26 HD2 LYS 26 43.998 -3.806 -11.746 224 HE2 LYS 26 HE1 LYS 26 46.181 -4.471 -13.006 225 HE3 LYS 26 HE2 LYS 26 46.360 -5.812 -11.811 226 HZ1 LYS 26 HZ1 LYS 26 45.189 -6.516 -13.792 227 HZ2 LYS 26 HZ2 LYS 26 44.163 -6.590 -12.441 228 HZ3 LYS 26 HZ3 LYS 26 43.998 -5.330 -13.562 229 H ASP 27 HN ASP 27 45.437 -2.012 -6.267 230 HA ASP 27 HA ASP 27 43.469 -0.100 -5.764 231 HB2 ASP 27 HB1 ASP 27 45.471 -1.625 -3.934 232 HB3 ASP 27 HB2 ASP 27 44.088 -0.682 -3.280 233 H LEU 28 HN LEU 28 47.009 -0.109 -5.292 234 HA LEU 28 HA LEU 28 47.133 2.189 -3.738 235 HB2 LEU 28 HB1 LEU 28 49.138 0.658 -5.465 236 HB3 LEU 28 HB2 LEU 28 49.644 2.034 -4.458 237 HG LEU 28 HG LEU 28 48.099 -0.394 -3.337 238 HD11 LEU 28 HD11 LEU 28 50.365 -1.264 -2.493 239 HD12 LEU 28 HD12 LEU 28 50.255 -1.269 -4.291 240 HD13 LEU 28 HD13 LEU 28 51.187 0.022 -3.447 241 HD21 LEU 28 HD21 LEU 28 49.089 0.301 -1.135 242 HD22 LEU 28 HD22 LEU 28 49.896 1.696 -1.918 243 HD23 LEU 28 HD23 LEU 28 48.099 1.610 -1.874 244 H VAL 29 HN VAL 29 47.611 1.794 -7.372 245 HA VAL 29 HA VAL 29 48.242 4.474 -7.786 246 HB VAL 29 HB VAL 29 48.748 2.733 -9.388 247 HG11 VAL 29 HG11 VAL 29 46.957 1.955 -10.995 248 HG12 VAL 29 HG12 VAL 29 46.671 1.342 -9.339 249 HG13 VAL 29 HG13 VAL 29 45.701 2.727 -9.967 250 HG21 VAL 29 HG21 VAL 29 48.113 4.098 -11.429 251 HG22 VAL 29 HG22 VAL 29 47.009 5.080 -10.399 252 HG23 VAL 29 HG23 VAL 29 48.785 5.093 -10.100 253 H LYS 30 HN LYS 30 45.042 2.827 -7.631 254 HA LYS 30 HA LYS 30 43.531 4.991 -8.512 255 HB2 LYS 30 HB1 LYS 30 42.795 2.635 -8.463 256 HB3 LYS 30 HB2 LYS 30 42.818 2.639 -6.680 257 HG2 LYS 30 HG1 LYS 30 40.961 4.279 -6.600 258 HG3 LYS 30 HG2 LYS 30 41.084 4.583 -8.365 259 HD2 LYS 30 HD1 LYS 30 40.597 1.970 -8.573 260 HD3 LYS 30 HD2 LYS 30 40.045 2.106 -6.869 261 HE2 LYS 30 HE1 LYS 30 38.935 3.949 -9.092 262 HE3 LYS 30 HE2 LYS 30 38.201 2.345 -8.711 263 HZ1 LYS 30 HZ1 LYS 30 37.141 4.131 -7.510 264 HZ2 LYS 30 HZ2 LYS 30 37.921 3.077 -6.433 265 HZ3 LYS 30 HZ3 LYS 30 38.611 4.583 -6.792 266 H MET 31 HN MET 31 44.475 4.046 -5.087 267 HA MET 31 HA MET 31 43.189 6.204 -3.907 268 HB2 MET 31 HB1 MET 31 45.624 4.576 -3.086 269 HB3 MET 31 HB2 MET 31 44.959 5.852 -2.036 270 HG2 MET 31 HG1 MET 31 42.660 4.578 -2.151 271 HG3 MET 31 HG2 MET 31 43.522 3.267 -3.018 272 HE1 MET 31 HE1 MET 31 46.001 1.872 -0.346 273 HE2 MET 31 HE2 MET 31 45.331 1.712 -2.007 274 HE3 MET 31 HE3 MET 31 46.337 3.138 -1.575 275 H LEU 32 HN LEU 32 46.569 6.028 -5.320 276 HA LEU 32 HA LEU 32 47.387 8.461 -4.284 277 HB2 LEU 32 HB1 LEU 32 48.135 6.889 -6.816 278 HB3 LEU 32 HB2 LEU 32 49.018 8.364 -6.357 279 HG LEU 32 HG LEU 32 48.715 5.902 -4.530 280 HD11 LEU 32 HD11 LEU 32 51.102 5.303 -5.267 281 HD12 LEU 32 HD12 LEU 32 49.900 5.183 -6.603 282 HD13 LEU 32 HD13 LEU 32 51.010 6.600 -6.511 283 HD21 LEU 32 HD21 LEU 32 50.722 6.834 -3.338 284 HD22 LEU 32 HD22 LEU 32 50.731 8.257 -4.428 285 HD23 LEU 32 HD23 LEU 32 49.336 7.982 -3.324 286 H GLU 33 HN GLU 33 45.801 7.785 -7.546 287 HA GLU 33 HA GLU 33 45.813 10.498 -8.266 288 HB2 GLU 33 HB1 GLU 33 44.291 9.898 -10.053 289 HB3 GLU 33 HB2 GLU 33 45.663 8.768 -9.988 290 HG2 GLU 33 HG1 GLU 33 44.193 7.059 -8.849 291 HG3 GLU 33 HG2 GLU 33 42.793 8.193 -8.948 292 H GLU 34 HN GLU 34 43.467 8.551 -6.320 293 HA GLU 34 HA GLU 34 41.393 10.423 -6.336 294 HB2 GLU 34 HB1 GLU 34 41.149 8.037 -5.663 295 HB3 GLU 34 HB2 GLU 34 42.184 8.310 -4.243 296 HG2 GLU 34 HG1 GLU 34 40.488 9.851 -3.251 297 HG3 GLU 34 HG2 GLU 34 39.451 9.727 -4.722 298 H THR 35 HN THR 35 44.185 10.027 -3.998 299 HA THR 35 HA THR 35 43.561 12.307 -2.515 300 HB THR 35 HB THR 35 46.243 11.012 -3.132 301 HG1 THR 35 HG1 THR 35 45.971 10.177 -1.023 302 HG21 THR 35 HG21 THR 35 47.106 12.221 -1.051 303 HG22 THR 35 HG22 THR 35 46.412 13.450 -2.161 304 HG23 THR 35 HG23 THR 35 45.470 12.901 -0.728 305 H GLY 36 HN GLY 36 45.537 11.913 -5.510 306 HA2 GLY 36 HA2 GLY 36 45.542 13.547 -7.144 307 HA3 GLY 36 HA1 GLY 36 45.285 14.801 -5.856 308 H THR 37 HN THR 37 47.686 12.286 -5.298 309 HA THR 37 HA THR 37 49.744 14.344 -5.581 310 HB THR 37 HB THR 37 49.715 11.669 -4.087 311 HG1 THR 37 HG1 THR 37 49.796 12.987 -2.222 312 HG21 THR 37 HG21 THR 37 51.921 12.448 -3.045 313 HG22 THR 37 HG22 THR 37 52.084 12.549 -4.830 314 HG23 THR 37 HG23 THR 37 51.783 14.043 -3.871 315 H LYS 38 HN LYS 38 51.317 14.126 -7.209 316 HA LYS 38 HA LYS 38 51.051 11.779 -8.843 317 HB2 LYS 38 HB1 LYS 38 52.963 14.180 -8.924 318 HB3 LYS 38 HB2 LYS 38 52.972 12.891 -10.156 319 HG2 LYS 38 HG1 LYS 38 50.555 13.478 -10.741 320 HG3 LYS 38 HG2 LYS 38 50.582 14.768 -9.493 321 HD2 LYS 38 HD1 LYS 38 52.482 15.886 -10.743 322 HD3 LYS 38 HD2 LYS 38 52.417 14.585 -11.979 323 HE2 LYS 38 HE1 LYS 38 50.101 15.253 -12.634 324 HE3 LYS 38 HE2 LYS 38 50.062 16.497 -11.325 325 HZ1 LYS 38 HZ1 LYS 38 50.663 17.449 -13.460 326 HZ2 LYS 38 HZ2 LYS 38 51.958 17.574 -12.369 327 HZ3 LYS 38 HZ3 LYS 38 51.994 16.404 -13.596 328 H VAL 39 HN VAL 39 52.014 9.909 -8.422 329 HA VAL 39 HA VAL 39 54.706 9.877 -7.253 330 HB VAL 39 HB VAL 39 52.375 8.045 -6.524 331 HG11 VAL 39 HG11 VAL 39 54.003 7.078 -4.832 332 HG12 VAL 39 HG12 VAL 39 54.554 6.806 -6.512 333 HG13 VAL 39 HG13 VAL 39 55.314 8.103 -5.514 334 HG21 VAL 39 HG21 VAL 39 52.645 9.062 -4.194 335 HG22 VAL 39 HG22 VAL 39 53.834 10.235 -4.870 336 HG23 VAL 39 HG23 VAL 39 52.117 10.266 -5.411 337 H SER 40 HN SER 40 56.107 8.543 -8.466 338 HA SER 40 HA SER 40 55.110 7.432 -10.835 339 HB2 SER 40 HB1 SER 40 57.443 8.276 -10.653 340 HB3 SER 40 HB2 SER 40 57.826 7.076 -9.379 341 HG SER 40 HG SER 40 58.495 6.597 -11.617 342 H ILE 41 HN ILE 41 54.876 5.233 -11.529 343 HA ILE 41 HA ILE 41 53.902 3.431 -9.644 344 HB ILE 41 HB ILE 41 54.751 3.144 -12.507 345 HG12 ILE 41 HG11 ILE 41 52.860 4.631 -12.312 346 HG13 ILE 41 HG12 ILE 41 52.259 3.071 -12.957 347 HG21 ILE 41 HG21 ILE 41 53.533 0.904 -12.526 348 HG22 ILE 41 HG22 ILE 41 54.769 0.853 -11.230 349 HG23 ILE 41 HG23 ILE 41 53.038 1.117 -10.811 350 HD11 ILE 41 HD11 ILE 41 50.662 3.968 -11.320 351 HD12 ILE 41 HD12 ILE 41 51.393 2.458 -10.668 352 HD13 ILE 41 HD13 ILE 41 51.932 4.064 -10.051 353 H SER 42 HN SER 42 57.215 3.779 -11.074 354 HA SER 42 HA SER 42 58.080 1.253 -10.412 355 HB2 SER 42 HB1 SER 42 59.638 3.902 -10.630 356 HB3 SER 42 HB2 SER 42 60.452 2.308 -10.550 357 HG SER 42 HG SER 42 60.001 3.240 -12.724 358 H THR 43 HN THR 43 58.243 4.290 -8.333 359 HA THR 43 HA THR 43 59.623 2.973 -6.289 360 HB THR 43 HB THR 43 59.673 5.351 -6.478 361 HG1 THR 43 HG1 THR 43 59.243 5.826 -4.294 362 HG21 THR 43 HG21 THR 43 57.743 6.791 -5.778 363 HG22 THR 43 HG22 THR 43 57.230 5.744 -7.145 364 HG23 THR 43 HG23 THR 43 56.723 5.342 -5.464 365 H VAL 44 HN VAL 44 56.066 3.232 -6.932 366 HA VAL 44 HA VAL 44 55.216 1.971 -4.582 367 HB VAL 44 HB VAL 44 54.047 2.026 -7.399 368 HG11 VAL 44 HG11 VAL 44 51.850 1.367 -6.307 369 HG12 VAL 44 HG12 VAL 44 53.067 0.061 -6.184 370 HG13 VAL 44 HG13 VAL 44 52.709 1.096 -4.751 371 HG21 VAL 44 HG21 VAL 44 52.502 3.774 -6.359 372 HG22 VAL 44 HG22 VAL 44 53.460 3.677 -4.836 373 HG23 VAL 44 HG23 VAL 44 54.222 4.279 -6.352 374 H LYS 45 HN LYS 45 56.197 0.617 -7.792 375 HA LYS 45 HA LYS 45 55.618 -2.037 -7.155 376 HB2 LYS 45 HB1 LYS 45 55.917 -1.001 -9.444 377 HB3 LYS 45 HB2 LYS 45 57.665 -0.847 -9.130 378 HG2 LYS 45 HG1 LYS 45 57.682 -2.823 -10.361 379 HG3 LYS 45 HG2 LYS 45 57.451 -3.535 -8.729 380 HD2 LYS 45 HD1 LYS 45 55.096 -2.802 -10.585 381 HD3 LYS 45 HD2 LYS 45 55.952 -4.379 -10.693 382 HE2 LYS 45 HE1 LYS 45 55.336 -4.816 -8.250 383 HE3 LYS 45 HE2 LYS 45 54.344 -3.309 -8.283 384 HZ1 LYS 45 HZ1 LYS 45 53.032 -5.267 -8.812 385 HZ2 LYS 45 HZ2 LYS 45 53.113 -4.228 -10.153 386 HZ3 LYS 45 HZ3 LYS 45 54.047 -5.643 -10.119 387 H ARG 46 HN ARG 46 58.755 -0.191 -6.862 388 HA ARG 46 HA ARG 46 60.196 -2.357 -5.814 389 HB2 ARG 46 HB1 ARG 46 60.592 0.625 -5.592 390 HB3 ARG 46 HB2 ARG 46 61.710 -0.510 -4.799 391 HG2 ARG 46 HG1 ARG 46 61.866 -1.647 -7.226 392 HG3 ARG 46 HG2 ARG 46 61.099 -0.166 -7.825 393 HD2 ARG 46 HD1 ARG 46 62.908 1.275 -6.878 394 HD3 ARG 46 HD2 ARG 46 63.794 -0.188 -6.281 395 HE ARG 46 HE ARG 46 63.496 0.703 -9.065 396 HH11 ARG 46 HH11 ARG 46 65.408 -2.787 -7.957 397 HH12 ARG 46 HH12 ARG 46 64.471 -1.842 -6.826 398 HH21 ARG 46 HH21 ARG 46 65.582 -1.992 -10.198 399 HH22 ARG 46 HH22 ARG 46 64.743 -0.540 -10.625 400 H VAL 47 HN VAL 47 58.234 0.169 -3.913 401 HA VAL 47 HA VAL 47 59.164 -0.816 -1.463 402 HB VAL 47 HB VAL 47 58.199 1.408 -1.791 403 HG11 VAL 47 HG11 VAL 47 55.710 1.663 -1.503 404 HG12 VAL 47 HG12 VAL 47 56.121 0.912 -3.073 405 HG13 VAL 47 HG13 VAL 47 55.502 -0.109 -1.720 406 HG21 VAL 47 HG21 VAL 47 57.125 1.404 0.494 407 HG22 VAL 47 HG22 VAL 47 57.137 -0.398 0.468 408 HG23 VAL 47 HG23 VAL 47 58.684 0.523 0.439 409 H LEU 48 HN LEU 48 56.423 -1.965 -3.578 410 HA LEU 48 HA LEU 48 55.380 -3.763 -1.750 411 HB2 LEU 48 HB1 LEU 48 55.589 -3.802 -4.800 412 HB3 LEU 48 HB2 LEU 48 54.738 -5.091 -3.918 413 HG LEU 48 HG LEU 48 54.062 -2.086 -3.719 414 HD11 LEU 48 HD11 LEU 48 52.059 -2.660 -5.218 415 HD12 LEU 48 HD12 LEU 48 53.639 -2.869 -6.057 416 HD13 LEU 48 HD13 LEU 48 52.740 -4.309 -5.451 417 HD21 LEU 48 HD21 LEU 48 51.879 -2.871 -2.752 418 HD22 LEU 48 HD22 LEU 48 52.438 -4.573 -2.827 419 HD23 LEU 48 HD23 LEU 48 53.285 -3.398 -1.758 420 H TYR 49 HN TYR 49 58.193 -4.262 -4.096 421 HA TYR 49 HA TYR 49 58.647 -6.876 -3.261 422 HB2 TYR 49 HB1 TYR 49 60.534 -4.735 -4.410 423 HB3 TYR 49 HB2 TYR 49 61.118 -6.383 -4.027 424 HD1 TYR 49 HD1 TYR 49 60.126 -4.361 -6.636 425 HD2 TYR 49 HD2 TYR 49 59.152 -8.225 -5.013 426 HE1 TYR 49 HE1 TYR 49 59.430 -5.143 -8.886 427 HE2 TYR 49 HE2 TYR 49 58.424 -8.977 -7.248 428 HH TYR 49 HH TYR 49 58.259 -8.464 -9.433 429 H ARG 50 HN ARG 50 59.893 -3.760 -1.856 430 HA ARG 50 HA ARG 50 61.610 -4.959 0.010 431 HB2 ARG 50 HB1 ARG 50 59.981 -2.376 0.093 432 HB3 ARG 50 HB2 ARG 50 61.089 -2.802 1.419 433 HG2 ARG 50 HG1 ARG 50 62.999 -2.879 -0.302 434 HG3 ARG 50 HG2 ARG 50 61.854 -2.411 -1.572 435 HD2 ARG 50 HD1 ARG 50 63.020 -0.379 -0.914 436 HD3 ARG 50 HD2 ARG 50 61.317 -0.228 -0.314 437 HE ARG 50 HE ARG 50 62.922 -1.515 1.671 438 HH11 ARG 50 HH11 ARG 50 62.781 2.615 1.489 439 HH12 ARG 50 HH12 ARG 50 62.430 1.598 0.113 440 HH21 ARG 50 HH21 ARG 50 63.388 1.537 3.542 441 HH22 ARG 50 HH22 ARG 50 63.411 -0.192 3.582 442 H HIS 51 HN HIS 51 58.053 -4.177 0.351 443 HA HIS 51 HA HIS 51 58.073 -5.149 3.010 444 HB2 HIS 51 HB1 HIS 51 55.794 -4.440 1.131 445 HB3 HIS 51 HB2 HIS 51 55.548 -5.006 2.806 446 HD1 HIS 51 HD1 HIS 51 57.958 -3.385 4.156 447 HD2 HIS 51 HD2 HIS 51 55.191 -1.702 1.487 448 HE1 HIS 51 HE1 HIS 51 57.786 -0.874 4.655 449 H ASN 52 HN ASN 52 57.589 -6.844 -0.171 450 HA ASN 52 HA ASN 52 56.671 -9.179 1.044 451 HB2 ASN 52 HB1 ASN 52 58.354 -8.644 -1.474 452 HB3 ASN 52 HB2 ASN 52 57.892 -10.314 -1.025 453 HD21 ASN 52 HD21 ASN 52 54.305 -8.625 -1.564 454 HD22 ASN 52 HD22 ASN 52 55.176 -8.628 -0.051 455 H LEU 53 HN LEU 53 60.139 -8.022 0.476 456 HA LEU 53 HA LEU 53 61.240 -10.261 1.682 457 HB2 LEU 53 HB1 LEU 53 62.263 -7.504 1.048 458 HB3 LEU 53 HB2 LEU 53 63.234 -8.522 2.139 459 HG LEU 53 HG LEU 53 63.990 -8.594 -0.150 460 HD11 LEU 53 HD11 LEU 53 64.019 -11.185 -0.428 461 HD12 LEU 53 HD12 LEU 53 64.413 -10.590 1.225 462 HD13 LEU 53 HD13 LEU 53 62.780 -11.265 0.875 463 HD21 LEU 53 HD21 LEU 53 62.782 -9.802 -2.017 464 HD22 LEU 53 HD22 LEU 53 61.303 -9.882 -1.008 465 HD23 LEU 53 HD23 LEU 53 61.957 -8.283 -1.513 466 H LYS 54 HN LYS 54 60.488 -6.977 3.288 467 HA LYS 54 HA LYS 54 60.245 -8.656 5.643 468 HB2 LYS 54 HB1 LYS 54 61.187 -6.941 7.132 469 HB3 LYS 54 HB2 LYS 54 62.414 -7.655 6.056 470 HG2 LYS 54 HG1 LYS 54 62.478 -5.619 4.673 471 HG3 LYS 54 HG2 LYS 54 61.037 -4.945 5.503 472 HD2 LYS 54 HD1 LYS 54 62.258 -4.535 7.532 473 HD3 LYS 54 HD2 LYS 54 63.560 -5.691 7.089 474 HE2 LYS 54 HE1 LYS 54 64.370 -4.129 5.291 475 HE3 LYS 54 HE2 LYS 54 63.044 -2.970 5.688 476 HZ1 LYS 54 HZ1 LYS 54 65.112 -2.387 6.782 477 HZ2 LYS 54 HZ2 LYS 54 63.934 -2.808 7.930 478 HZ3 LYS 54 HZ3 LYS 54 65.178 -3.897 7.554 479 H GLY 55 HN GLY 55 58.324 -8.498 6.542 480 HA2 GLY 55 HA2 GLY 55 56.870 -5.943 6.345 481 HA3 GLY 55 HA1 GLY 55 56.188 -7.567 6.789 482 H ARG 56 HN ARG 56 56.862 -4.626 8.080 483 HA ARG 56 HA ARG 56 58.069 -5.693 10.567 484 HB2 ARG 56 HB1 ARG 56 59.184 -3.812 9.176 485 HB3 ARG 56 HB2 ARG 56 57.775 -2.788 9.538 486 HG2 ARG 56 HG1 ARG 56 59.610 -4.041 11.688 487 HG3 ARG 56 HG2 ARG 56 59.921 -2.452 10.967 488 HD2 ARG 56 HD1 ARG 56 57.444 -3.130 12.640 489 HD3 ARG 56 HD2 ARG 56 58.863 -2.138 13.170 490 HE ARG 56 HE ARG 56 56.730 -1.352 11.314 491 HH11 ARG 56 HH11 ARG 56 59.955 1.043 12.272 492 HH12 ARG 56 HH12 ARG 56 59.876 -0.638 12.739 493 HH21 ARG 56 HH21 ARG 56 58.115 1.950 11.060 494 HH22 ARG 56 HH22 ARG 56 56.798 0.905 10.656 495 H SER 57 HN SER 57 56.711 -5.854 12.447 496 HA SER 57 HA SER 57 54.147 -4.619 12.141 497 HB2 SER 57 HB1 SER 57 53.972 -6.664 10.696 498 HB3 SER 57 HB2 SER 57 54.585 -7.696 12.027 499 HG SER 57 HG SER 57 52.243 -7.627 11.641 500 H ALA 58 HN ALA 58 52.972 -4.480 14.008 501 HA ALA 58 HA ALA 58 54.099 -5.624 16.505 502 HB1 ALA 58 HB1 ALA 58 54.607 -3.168 16.373 503 HB2 ALA 58 HB2 ALA 58 52.883 -2.823 16.006 504 HB3 ALA 58 HB3 ALA 58 53.352 -3.477 17.621 505 H ARG 59 HN ARG 59 52.233 -7.007 14.939 506 HA ARG 59 HA ARG 59 49.748 -6.613 16.465 507 HB2 ARG 59 HB1 ARG 59 49.524 -5.512 14.251 508 HB3 ARG 59 HB2 ARG 59 49.993 -7.014 13.419 509 HG2 ARG 59 HG1 ARG 59 47.577 -6.782 13.265 510 HG3 ARG 59 HG2 ARG 59 47.893 -8.127 14.375 511 HD2 ARG 59 HD1 ARG 59 46.200 -7.005 15.535 512 HD3 ARG 59 HD2 ARG 59 47.673 -6.330 16.347 513 HE ARG 59 HE ARG 59 45.990 -4.964 14.314 514 HH11 ARG 59 HH11 ARG 59 48.808 -3.119 16.697 515 HH12 ARG 59 HH12 ARG 59 48.603 -4.853 16.703 516 HH21 ARG 59 HH21 ARG 59 47.401 -1.835 15.286 517 HH22 ARG 59 HH22 ARG 59 46.253 -2.658 14.286 518 H LYS 60 HN LYS 60 48.510 -8.425 16.734 519 HA LYS 60 HA LYS 60 48.091 -10.459 17.422 520 HB2 LYS 60 HB1 LYS 60 49.820 -11.361 15.082 521 HB3 LYS 60 HB2 LYS 60 48.717 -12.421 16.000 522 HG2 LYS 60 HG1 LYS 60 46.811 -10.713 15.312 523 HG3 LYS 60 HG2 LYS 60 48.008 -10.022 14.167 524 HD2 LYS 60 HD1 LYS 60 48.270 -12.420 13.212 525 HD3 LYS 60 HD2 LYS 60 46.875 -12.892 14.240 526 HE2 LYS 60 HE1 LYS 60 45.419 -11.190 13.081 527 HE3 LYS 60 HE2 LYS 60 46.816 -10.685 12.056 528 HZ1 LYS 60 HZ1 LYS 60 45.403 -12.278 10.935 529 HZ2 LYS 60 HZ2 LYS 60 46.941 -12.944 11.211 530 HZ3 LYS 60 HZ3 LYS 60 45.628 -13.416 12.175 531 H LEU 61 HN LEU 61 50.627 -12.501 16.575 532 HA LEU 61 HA LEU 61 51.211 -12.904 19.237 533 HB2 LEU 61 HB1 LEU 61 52.610 -14.736 18.513 534 HB3 LEU 61 HB2 LEU 61 51.077 -14.735 17.609 535 HG LEU 61 HG LEU 61 53.689 -13.582 16.501 536 HD11 LEU 61 HD11 LEU 61 53.915 -15.862 15.301 537 HD12 LEU 61 HD12 LEU 61 54.075 -15.989 17.091 538 HD13 LEU 61 HD13 LEU 61 52.538 -16.475 16.286 539 HD21 LEU 61 HD21 LEU 61 52.679 -14.038 14.243 540 HD22 LEU 61 HD22 LEU 61 51.168 -14.621 15.012 541 HD23 LEU 61 HD23 LEU 61 51.666 -12.903 15.208 542 H GLU 62 HN GLU 62 53.114 -10.911 16.855 543 HA GLU 62 HA GLU 62 55.427 -11.181 18.555 544 HB2 GLU 62 HB1 GLU 62 56.663 -10.018 16.831 545 HB3 GLU 62 HB2 GLU 62 55.784 -11.400 16.142 546 HG2 GLU 62 HG1 GLU 62 54.039 -9.810 15.231 547 HG3 GLU 62 HG2 GLU 62 54.983 -8.415 15.877 Start of MODEL 2 1 H1 ALA 1 HT1 ALA 1 58.488 0.110 10.964 2 H2 ALA 1 HT2 ALA 1 59.437 1.463 11.353 3 H3 ALA 1 HT3 ALA 1 58.730 1.337 9.815 4 HA ALA 1 HA ALA 1 56.528 1.494 10.762 5 HB1 ALA 1 HB1 ALA 1 57.151 0.324 12.873 6 HB2 ALA 1 HB2 ALA 1 58.052 1.777 13.423 7 HB3 ALA 1 HB3 ALA 1 56.260 1.843 13.230 8 H SER 2 HN SER 2 59.358 3.522 11.720 9 HA SER 2 HA SER 2 57.751 5.815 12.082 10 HB2 SER 2 HB1 SER 2 60.813 5.454 11.909 11 HB3 SER 2 HB2 SER 2 60.046 6.998 12.394 12 HG SER 2 HG SER 2 60.724 5.478 14.131 13 H MET 3 HN MET 3 58.716 4.428 9.190 14 HA MET 3 HA MET 3 59.855 6.649 7.903 15 HB2 MET 3 HB1 MET 3 58.601 4.012 6.954 16 HB3 MET 3 HB2 MET 3 59.347 5.147 5.799 17 HG2 MET 3 HG1 MET 3 61.589 4.842 6.897 18 HG3 MET 3 HG2 MET 3 60.844 3.896 8.226 19 HE1 MET 3 HE1 MET 3 61.374 2.473 3.788 20 HE2 MET 3 HE2 MET 3 60.231 3.778 4.253 21 HE3 MET 3 HE3 MET 3 62.001 4.026 4.440 22 H VAL 4 HN VAL 4 58.743 8.539 7.433 23 HA VAL 4 HA VAL 4 56.549 8.158 5.561 24 HB VAL 4 HB VAL 4 55.435 8.664 7.676 25 HG11 VAL 4 HG11 VAL 4 55.770 10.936 8.751 26 HG12 VAL 4 HG12 VAL 4 57.231 9.914 8.896 27 HG13 VAL 4 HG13 VAL 4 57.176 11.237 7.671 28 HG21 VAL 4 HG21 VAL 4 54.150 10.666 6.884 29 HG22 VAL 4 HG22 VAL 4 55.368 10.902 5.578 30 HG23 VAL 4 HG23 VAL 4 54.367 9.406 5.629 31 H LEU 5 HN LEU 5 56.885 9.399 3.686 32 HA LEU 5 HA LEU 5 58.802 11.584 3.950 33 HB2 LEU 5 HB1 LEU 5 58.335 9.675 1.586 34 HB3 LEU 5 HB2 LEU 5 59.305 11.159 1.439 35 HG LEU 5 HG LEU 5 59.881 8.821 3.367 36 HD11 LEU 5 HD11 LEU 5 61.819 8.287 1.766 37 HD12 LEU 5 HD12 LEU 5 60.199 8.072 1.007 38 HD13 LEU 5 HD13 LEU 5 61.186 9.534 0.633 39 HD21 LEU 5 HD21 LEU 5 62.154 9.872 3.647 40 HD22 LEU 5 HD22 LEU 5 61.657 11.254 2.620 41 HD23 LEU 5 HD23 LEU 5 60.829 10.964 4.192 42 H SER 6 HN SER 6 55.953 10.332 2.051 43 HA SER 6 HA SER 6 55.284 13.120 1.473 44 HB2 SER 6 HB1 SER 6 54.394 10.464 0.155 45 HB3 SER 6 HB2 SER 6 53.683 12.047 -0.291 46 HG SER 6 HG SER 6 55.488 11.204 -1.627 47 HA PRO 7 HA PRO 7 52.886 12.794 4.809 48 HB2 PRO 7 HB2 PRO 7 50.950 14.725 4.645 49 HB3 PRO 7 HB1 PRO 7 52.722 15.088 4.650 50 HG2 PRO 7 HG2 PRO 7 51.079 14.885 2.120 51 HG3 PRO 7 HG1 PRO 7 52.186 16.217 2.656 52 HD2 PRO 7 HD2 PRO 7 53.076 14.136 1.060 53 HD3 PRO 7 HD1 PRO 7 54.147 14.959 2.295 54 H ARG 8 HN ARG 8 50.609 12.493 1.957 55 HA ARG 8 HA ARG 8 48.893 10.842 3.727 56 HB2 ARG 8 HB2 ARG 8 48.463 12.020 0.891 57 HB3 ARG 8 HB1 ARG 8 47.324 10.920 1.640 58 HG2 ARG 8 HG2 ARG 8 46.952 12.617 3.532 59 HG3 ARG 8 HG1 ARG 8 48.144 13.689 2.789 60 HD2 ARG 8 HD2 ARG 8 46.692 13.803 0.688 61 HD3 ARG 8 HD1 ARG 8 45.505 12.729 1.470 62 HE ARG 8 HE ARG 8 45.951 14.957 3.305 63 HH11 ARG 8 HH11 ARG 8 44.584 14.505 0.151 64 HH12 ARG 8 HH12 ARG 8 43.482 15.953 0.339 65 HH21 ARG 8 HH21 ARG 8 44.699 16.581 3.489 66 HH22 ARG 8 HH22 ARG 8 43.564 17.058 2.150 67 H ASP 9 HN ASP 9 50.843 10.543 0.545 68 HA ASP 9 HA ASP 9 49.714 8.059 0.039 69 HB2 ASP 9 HB1 ASP 9 50.781 9.550 -1.699 70 HB3 ASP 9 HB2 ASP 9 52.387 9.273 -0.944 71 H GLU 10 HN GLU 10 52.925 8.885 1.688 72 HA GLU 10 HA GLU 10 53.570 6.175 2.013 73 HB2 GLU 10 HB1 GLU 10 54.554 8.688 3.392 74 HB3 GLU 10 HB2 GLU 10 55.165 7.072 3.813 75 HG2 GLU 10 HG1 GLU 10 55.237 8.250 0.937 76 HG3 GLU 10 HG2 GLU 10 56.630 8.323 2.081 77 H ARG 11 HN ARG 11 51.712 8.482 4.100 78 HA ARG 11 HA ARG 11 51.606 6.804 6.352 79 HB2 ARG 11 HB1 ARG 11 50.996 9.223 6.335 80 HB3 ARG 11 HB2 ARG 11 49.584 8.893 5.302 81 HG2 ARG 11 HG1 ARG 11 48.635 7.426 7.188 82 HG3 ARG 11 HG2 ARG 11 50.046 7.822 8.187 83 HD2 ARG 11 HD1 ARG 11 49.529 10.273 8.115 84 HD3 ARG 11 HD2 ARG 11 48.025 9.949 7.158 85 HE ARG 11 HE ARG 11 47.960 8.219 9.372 86 HH11 ARG 11 HH11 ARG 11 46.987 12.183 10.046 87 HH12 ARG 11 HH12 ARG 11 48.014 11.676 8.728 88 HH21 ARG 11 HH21 ARG 11 46.147 10.494 11.516 89 HH22 ARG 11 HH22 ARG 11 46.556 8.845 11.190 90 H THR 12 HN THR 12 49.232 7.039 3.539 91 HA THR 12 HA THR 12 47.713 4.899 4.510 92 HB THR 12 HB THR 12 48.063 5.965 1.695 93 HG1 THR 12 HG1 THR 12 46.040 6.926 2.165 94 HG21 THR 12 HG21 THR 12 45.825 4.800 1.215 95 HG22 THR 12 HG22 THR 12 46.953 3.568 1.873 96 HG23 THR 12 HG23 THR 12 45.689 4.287 2.935 97 H LEU 13 HN LEU 13 50.509 4.934 2.136 98 HA LEU 13 HA LEU 13 50.289 2.274 1.458 99 HB2 LEU 13 HB1 LEU 13 51.654 3.864 0.173 100 HB3 LEU 13 HB2 LEU 13 52.679 4.225 1.583 101 HG LEU 13 HG LEU 13 53.601 1.934 1.494 102 HD11 LEU 13 HD11 LEU 13 53.341 0.552 -0.657 103 HD12 LEU 13 HD12 LEU 13 51.822 0.639 0.307 104 HD13 LEU 13 HD13 LEU 13 52.015 1.654 -1.170 105 HD21 LEU 13 HD21 LEU 13 55.018 2.309 -0.580 106 HD22 LEU 13 HD22 LEU 13 53.875 3.579 -1.122 107 HD23 LEU 13 HD23 LEU 13 54.796 3.797 0.410 108 H VAL 14 HN VAL 14 52.277 3.726 4.177 109 HA VAL 14 HA VAL 14 53.497 1.303 4.838 110 HB VAL 14 HB VAL 14 53.031 3.865 6.365 111 HG11 VAL 14 HG11 VAL 14 54.807 3.042 7.972 112 HG12 VAL 14 HG12 VAL 14 53.316 2.057 8.072 113 HG13 VAL 14 HG13 VAL 14 54.758 1.422 7.192 114 HG21 VAL 14 HG21 VAL 14 55.562 4.076 5.850 115 HG22 VAL 14 HG22 VAL 14 55.476 2.525 4.936 116 HG23 VAL 14 HG23 VAL 14 54.582 3.975 4.353 117 H ARG 15 HN ARG 15 50.477 2.867 6.248 118 HA ARG 15 HA ARG 15 49.992 0.663 7.921 119 HB2 ARG 15 HB1 ARG 15 48.259 2.874 6.766 120 HB3 ARG 15 HB2 ARG 15 47.516 1.614 7.781 121 HG2 ARG 15 HG1 ARG 15 49.914 3.402 8.632 122 HG3 ARG 15 HG2 ARG 15 48.228 3.817 8.990 123 HD2 ARG 15 HD1 ARG 15 49.369 1.094 9.880 124 HD3 ARG 15 HD2 ARG 15 49.472 2.560 10.939 125 HE ARG 15 HE ARG 15 46.838 2.505 10.072 126 HH11 ARG 15 HH11 ARG 15 47.835 -0.436 12.808 127 HH12 ARG 15 HH12 ARG 15 49.009 0.294 11.739 128 HH21 ARG 15 HH21 ARG 15 45.568 0.301 12.640 129 HH22 ARG 15 HH22 ARG 15 45.193 1.549 11.501 130 H LYS 16 HN LYS 16 48.758 1.258 4.522 131 HA LYS 16 HA LYS 16 46.755 -0.688 4.808 132 HB2 LYS 16 HB1 LYS 16 46.745 1.260 3.196 133 HB3 LYS 16 HB2 LYS 16 48.028 0.465 2.250 134 HG2 LYS 16 HG1 LYS 16 45.962 -0.024 1.094 135 HG3 LYS 16 HG2 LYS 16 46.384 -1.541 1.954 136 HD2 LYS 16 HD1 LYS 16 44.090 -1.310 2.487 137 HD3 LYS 16 HD2 LYS 16 44.872 -0.546 3.913 138 HE2 LYS 16 HE1 LYS 16 44.487 1.739 2.937 139 HE3 LYS 16 HE2 LYS 16 43.745 0.998 1.468 140 HZ1 LYS 16 HZ1 LYS 16 42.083 1.686 3.071 141 HZ2 LYS 16 HZ2 LYS 16 42.066 -0.003 2.889 142 HZ3 LYS 16 HZ3 LYS 16 42.765 0.693 4.268 143 H VAL 17 HN VAL 17 50.007 -0.791 3.299 144 HA VAL 17 HA VAL 17 49.901 -3.432 2.388 145 HB VAL 17 HB VAL 17 52.214 -1.607 3.044 146 HG11 VAL 17 HG11 VAL 17 53.587 -3.152 1.580 147 HG12 VAL 17 HG12 VAL 17 53.051 -3.966 3.080 148 HG13 VAL 17 HG13 VAL 17 52.214 -4.311 1.519 149 HG21 VAL 17 HG21 VAL 17 52.167 -1.416 0.455 150 HG22 VAL 17 HG22 VAL 17 50.705 -2.470 0.439 151 HG23 VAL 17 HG23 VAL 17 50.643 -0.839 1.199 152 H GLN 18 HN GLN 18 50.929 -2.032 5.588 153 HA GLN 18 HA GLN 18 52.094 -4.377 6.541 154 HB2 GLN 18 HB1 GLN 18 52.170 -1.932 7.469 155 HB3 GLN 18 HB2 GLN 18 50.560 -2.234 8.174 156 HG2 GLN 18 HG1 GLN 18 52.266 -2.571 9.946 157 HG3 GLN 18 HG2 GLN 18 51.616 -4.192 9.530 158 HE21 GLN 18 HE21 GLN 18 55.307 -3.183 7.861 159 HE22 GLN 18 HE22 GLN 18 53.991 -2.028 7.819 160 H ILE 19 HN ILE 19 48.694 -3.135 6.822 161 HA ILE 19 HA ILE 19 47.729 -5.390 8.164 162 HB ILE 19 HB ILE 19 46.467 -3.262 6.430 163 HG12 ILE 19 HG11 ILE 19 47.398 -2.308 8.449 164 HG13 ILE 19 HG12 ILE 19 45.612 -2.309 8.596 165 HG21 ILE 19 HG21 ILE 19 44.195 -3.991 7.300 166 HG22 ILE 19 HG22 ILE 19 44.985 -5.409 6.539 167 HG23 ILE 19 HG23 ILE 19 44.952 -5.253 8.334 168 HD11 ILE 19 HD11 ILE 19 46.628 -2.939 10.744 169 HD12 ILE 19 HD12 ILE 19 45.734 -4.351 10.072 170 HD13 ILE 19 HD13 ILE 19 47.534 -4.290 9.979 171 H ASN 20 HN ASN 20 47.917 -4.640 4.575 172 HA ASN 20 HA ASN 20 47.017 -7.381 4.195 173 HB2 ASN 20 HB1 ASN 20 45.182 -5.584 3.844 174 HB3 ASN 20 HB2 ASN 20 46.172 -4.896 2.520 175 HD21 ASN 20 HD21 ASN 20 44.047 -8.441 2.122 176 HD22 ASN 20 HD22 ASN 20 44.322 -7.714 3.686 177 HA PRO 21 HA PRO 21 50.956 -6.477 2.019 178 HB2 PRO 21 HB2 PRO 21 52.307 -8.818 2.417 179 HB3 PRO 21 HB1 PRO 21 52.065 -7.593 3.725 180 HG2 PRO 21 HG2 PRO 21 50.346 -10.073 3.271 181 HG3 PRO 21 HG1 PRO 21 51.139 -9.523 4.807 182 HD2 PRO 21 HD2 PRO 21 48.525 -8.840 4.209 183 HD3 PRO 21 HD1 PRO 21 49.642 -7.746 5.160 184 H ARG 22 HN ARG 22 48.467 -8.692 1.291 185 HA ARG 22 HA ARG 22 49.436 -9.970 -1.022 186 HB2 ARG 22 HB1 ARG 22 47.408 -10.644 0.275 187 HB3 ARG 22 HB2 ARG 22 46.551 -9.186 -0.281 188 HG2 ARG 22 HG1 ARG 22 46.906 -10.032 -2.712 189 HG3 ARG 22 HG2 ARG 22 47.641 -11.505 -2.055 190 HD2 ARG 22 HD1 ARG 22 45.455 -12.256 -2.421 191 HD3 ARG 22 HD2 ARG 22 45.369 -11.814 -0.667 192 HE ARG 22 HE ARG 22 44.086 -9.967 -1.128 193 HH11 ARG 22 HH11 ARG 22 42.589 -9.022 -4.266 194 HH12 ARG 22 HH12 ARG 22 42.587 -8.824 -2.530 195 HH21 ARG 22 HH21 ARG 22 44.125 -10.577 -5.208 196 HH22 ARG 22 HH22 ARG 22 45.205 -11.419 -4.150 197 H THR 23 HN THR 23 48.119 -6.671 -0.555 198 HA THR 23 HA THR 23 47.098 -6.432 -3.132 199 HB THR 23 HB THR 23 46.301 -5.199 -1.144 200 HG1 THR 23 HG1 THR 23 46.025 -3.213 -2.222 201 HG21 THR 23 HG21 THR 23 47.525 -3.094 -0.426 202 HG22 THR 23 HG22 THR 23 48.643 -4.491 -0.274 203 HG23 THR 23 HG23 THR 23 48.795 -3.366 -1.671 204 H THR 24 HN THR 24 47.656 -4.587 -4.729 205 HA THR 24 HA THR 24 50.516 -4.611 -5.183 206 HB THR 24 HB THR 24 49.592 -6.675 -6.180 207 HG1 THR 24 HG1 THR 24 50.381 -6.304 -8.283 208 HG21 THR 24 HG21 THR 24 48.043 -6.539 -8.165 209 HG22 THR 24 HG22 THR 24 47.268 -5.741 -6.755 210 HG23 THR 24 HG23 THR 24 48.007 -4.742 -8.058 211 H ALA 25 HN ALA 25 50.767 -3.491 -7.557 212 HA ALA 25 HA ALA 25 50.604 -0.799 -6.832 213 HB1 ALA 25 HB1 ALA 25 52.420 -1.812 -8.194 214 HB2 ALA 25 HB2 ALA 25 51.272 -2.057 -9.554 215 HB3 ALA 25 HB3 ALA 25 51.704 -0.386 -9.024 216 H LYS 26 HN LYS 26 48.427 -2.672 -8.936 217 HA LYS 26 HA LYS 26 47.140 -0.543 -10.180 218 HB2 LYS 26 HB1 LYS 26 46.177 -3.331 -9.348 219 HB3 LYS 26 HB2 LYS 26 45.180 -2.244 -10.350 220 HG2 LYS 26 HG1 LYS 26 47.072 -2.204 -12.092 221 HG3 LYS 26 HG2 LYS 26 48.000 -3.348 -11.067 222 HD2 LYS 26 HD1 LYS 26 46.027 -4.983 -11.266 223 HD3 LYS 26 HD2 LYS 26 45.256 -3.831 -12.408 224 HE2 LYS 26 HE1 LYS 26 47.234 -4.041 -13.972 225 HE3 LYS 26 HE2 LYS 26 48.007 -5.208 -12.832 226 HZ1 LYS 26 HZ1 LYS 26 46.803 -6.327 -14.592 227 HZ2 LYS 26 HZ2 LYS 26 46.083 -6.646 -13.088 228 HZ3 LYS 26 HZ3 LYS 26 45.359 -5.549 -14.158 229 H ASP 27 HN ASP 27 46.435 -2.128 -6.957 230 HA ASP 27 HA ASP 27 44.223 -0.516 -6.402 231 HB2 ASP 27 HB1 ASP 27 44.789 -2.744 -5.317 232 HB3 ASP 27 HB2 ASP 27 46.212 -1.981 -4.528 233 H LEU 28 HN LEU 28 47.784 -0.091 -5.686 234 HA LEU 28 HA LEU 28 47.467 2.199 -4.176 235 HB2 LEU 28 HB1 LEU 28 49.758 1.013 -5.770 236 HB3 LEU 28 HB2 LEU 28 49.946 2.662 -5.129 237 HG LEU 28 HG LEU 28 50.973 0.844 -3.817 238 HD11 LEU 28 HD11 LEU 28 50.119 1.738 -1.524 239 HD12 LEU 28 HD12 LEU 28 50.508 3.010 -2.738 240 HD13 LEU 28 HD13 LEU 28 48.792 2.562 -2.419 241 HD21 LEU 28 HD21 LEU 28 49.626 -0.564 -2.199 242 HD22 LEU 28 HD22 LEU 28 48.112 -0.046 -3.007 243 HD23 LEU 28 HD23 LEU 28 49.332 -1.003 -3.921 244 H VAL 29 HN VAL 29 47.982 1.985 -7.850 245 HA VAL 29 HA VAL 29 48.189 4.745 -8.114 246 HB VAL 29 HB VAL 29 48.989 3.234 -9.791 247 HG11 VAL 29 HG11 VAL 29 47.396 2.288 -11.499 248 HG12 VAL 29 HG12 VAL 29 47.186 1.515 -9.899 249 HG13 VAL 29 HG13 VAL 29 46.004 2.757 -10.462 250 HG21 VAL 29 HG21 VAL 29 48.158 4.613 -11.755 251 HG22 VAL 29 HG22 VAL 29 46.887 5.319 -10.689 252 HG23 VAL 29 HG23 VAL 29 48.630 5.613 -10.345 253 H LYS 30 HN LYS 30 45.202 2.637 -8.210 254 HA LYS 30 HA LYS 30 43.475 4.743 -8.821 255 HB2 LYS 30 HB1 LYS 30 42.979 2.300 -9.037 256 HB3 LYS 30 HB2 LYS 30 43.067 2.106 -7.267 257 HG2 LYS 30 HG1 LYS 30 41.045 3.611 -7.018 258 HG3 LYS 30 HG2 LYS 30 40.995 3.832 -8.799 259 HD2 LYS 30 HD1 LYS 30 40.872 1.184 -8.892 260 HD3 LYS 30 HD2 LYS 30 40.499 1.280 -7.138 261 HE2 LYS 30 HE1 LYS 30 38.850 2.686 -9.354 262 HE3 LYS 30 HE2 LYS 30 38.414 1.116 -8.577 263 HZ1 LYS 30 HZ1 LYS 30 37.293 2.974 -7.552 264 HZ2 LYS 30 HZ2 LYS 30 38.361 2.248 -6.449 265 HZ3 LYS 30 HZ3 LYS 30 38.772 3.722 -7.182 266 H MET 31 HN MET 31 44.554 3.429 -5.625 267 HA MET 31 HA MET 31 42.936 5.061 -4.075 268 HB2 MET 31 HB1 MET 31 43.928 2.937 -3.354 269 HB3 MET 31 HB2 MET 31 45.573 3.612 -3.468 270 HG2 MET 31 HG1 MET 31 45.154 5.108 -1.533 271 HG3 MET 31 HG2 MET 31 43.401 4.733 -1.563 272 HE1 MET 31 HE1 MET 31 46.771 1.664 -0.437 273 HE2 MET 31 HE2 MET 31 46.446 2.209 -2.119 274 HE3 MET 31 HE3 MET 31 47.086 3.369 -0.905 275 H LEU 32 HN LEU 32 46.426 5.646 -5.168 276 HA LEU 32 HA LEU 32 46.618 7.972 -3.634 277 HB2 LEU 32 HB1 LEU 32 48.680 8.414 -4.748 278 HB3 LEU 32 HB2 LEU 32 48.594 6.682 -4.349 279 HG LEU 32 HG LEU 32 47.695 6.552 -6.883 280 HD11 LEU 32 HD11 LEU 32 49.149 8.085 -8.356 281 HD12 LEU 32 HD12 LEU 32 47.902 8.993 -7.426 282 HD13 LEU 32 HD13 LEU 32 49.621 9.005 -6.883 283 HD21 LEU 32 HD21 LEU 32 50.067 5.972 -7.558 284 HD22 LEU 32 HD22 LEU 32 50.679 6.712 -6.044 285 HD23 LEU 32 HD23 LEU 32 49.601 5.272 -5.965 286 H GLU 33 HN GLU 33 45.458 7.472 -7.065 287 HA GLU 33 HA GLU 33 45.208 10.193 -7.654 288 HB2 GLU 33 HB1 GLU 33 43.752 7.722 -8.699 289 HB3 GLU 33 HB2 GLU 33 43.435 9.348 -9.342 290 HG2 GLU 33 HG1 GLU 33 45.875 9.560 -10.015 291 HG3 GLU 33 HG2 GLU 33 46.209 7.909 -9.365 292 H GLU 34 HN GLU 34 42.821 7.875 -6.133 293 HA GLU 34 HA GLU 34 40.758 9.729 -5.870 294 HB2 GLU 34 HB1 GLU 34 40.512 7.249 -5.642 295 HB3 GLU 34 HB2 GLU 34 41.511 7.266 -4.170 296 HG2 GLU 34 HG1 GLU 34 39.134 7.067 -3.559 297 HG3 GLU 34 HG2 GLU 34 39.693 8.696 -3.019 298 H THR 35 HN THR 35 43.497 8.936 -3.638 299 HA THR 35 HA THR 35 42.716 10.656 -1.594 300 HB THR 35 HB THR 35 45.465 9.662 -2.435 301 HG1 THR 35 HG1 THR 35 45.124 8.213 -0.700 302 HG21 THR 35 HG21 THR 35 46.189 10.173 -0.036 303 HG22 THR 35 HG22 THR 35 45.507 11.679 -0.738 304 HG23 THR 35 HG23 THR 35 44.518 10.686 0.394 305 H GLY 36 HN GLY 36 44.874 11.269 -4.445 306 HA2 GLY 36 HA2 GLY 36 44.810 13.338 -5.482 307 HA3 GLY 36 HA1 GLY 36 44.496 14.101 -3.864 308 H THR 37 HN THR 37 47.023 11.668 -3.954 309 HA THR 37 HA THR 37 49.027 13.808 -4.073 310 HB THR 37 HB THR 37 49.052 11.122 -2.602 311 HG1 THR 37 HG1 THR 37 49.221 12.444 -0.743 312 HG21 THR 37 HG21 THR 37 51.298 11.841 -1.641 313 HG22 THR 37 HG22 THR 37 51.398 11.934 -3.432 314 HG23 THR 37 HG23 THR 37 51.179 13.437 -2.465 315 H LYS 38 HN LYS 38 50.522 13.647 -5.763 316 HA LYS 38 HA LYS 38 50.376 11.143 -7.238 317 HB2 LYS 38 HB1 LYS 38 51.645 13.853 -7.896 318 HB3 LYS 38 HB2 LYS 38 51.771 12.436 -8.969 319 HG2 LYS 38 HG1 LYS 38 49.200 12.401 -9.120 320 HG3 LYS 38 HG2 LYS 38 49.156 13.880 -8.105 321 HD2 LYS 38 HD1 LYS 38 50.472 15.115 -9.848 322 HD3 LYS 38 HD2 LYS 38 50.601 13.616 -10.829 323 HE2 LYS 38 HE1 LYS 38 48.068 13.575 -11.071 324 HE3 LYS 38 HE2 LYS 38 47.974 15.124 -10.150 325 HZ1 LYS 38 HZ1 LYS 38 47.995 15.489 -12.533 326 HZ2 LYS 38 HZ2 LYS 38 49.394 16.139 -11.824 327 HZ3 LYS 38 HZ3 LYS 38 49.479 14.682 -12.686 328 H VAL 39 HN VAL 39 51.924 9.625 -7.156 329 HA VAL 39 HA VAL 39 54.691 10.418 -6.648 330 HB VAL 39 HB VAL 39 55.135 8.334 -5.447 331 HG11 VAL 39 HG11 VAL 39 54.028 9.020 -3.244 332 HG12 VAL 39 HG12 VAL 39 54.737 10.423 -4.099 333 HG13 VAL 39 HG13 VAL 39 52.955 10.144 -4.149 334 HG21 VAL 39 HG21 VAL 39 53.161 7.023 -4.487 335 HG22 VAL 39 HG22 VAL 39 52.038 8.039 -5.463 336 HG23 VAL 39 HG23 VAL 39 53.217 6.948 -6.276 337 H SER 40 HN SER 40 56.247 8.802 -7.636 338 HA SER 40 HA SER 40 55.318 7.853 -10.096 339 HB2 SER 40 HB1 SER 40 57.870 7.194 -8.490 340 HB3 SER 40 HB2 SER 40 57.644 6.705 -10.200 341 HG SER 40 HG SER 40 58.807 8.763 -9.757 342 H ILE 41 HN ILE 41 55.032 5.723 -10.921 343 HA ILE 41 HA ILE 41 53.832 3.906 -9.185 344 HB ILE 41 HB ILE 41 54.837 3.752 -12.023 345 HG12 ILE 41 HG11 ILE 41 53.037 5.367 -11.775 346 HG13 ILE 41 HG12 ILE 41 52.426 3.939 -12.671 347 HG21 ILE 41 HG21 ILE 41 53.474 1.621 -12.300 348 HG22 ILE 41 HG22 ILE 41 54.616 1.381 -10.940 349 HG23 ILE 41 HG23 ILE 41 52.882 1.736 -10.605 350 HD11 ILE 41 HD11 ILE 41 50.720 4.727 -11.091 351 HD12 ILE 41 HD12 ILE 41 51.302 3.103 -10.574 352 HD13 ILE 41 HD13 ILE 41 51.857 4.584 -9.706 353 H SER 42 HN SER 42 57.184 3.987 -10.554 354 HA SER 42 HA SER 42 57.762 1.354 -9.963 355 HB2 SER 42 HB1 SER 42 59.616 3.799 -10.211 356 HB3 SER 42 HB2 SER 42 60.233 2.117 -10.160 357 HG SER 42 HG SER 42 59.825 3.109 -12.319 358 H THR 43 HN THR 43 58.269 4.320 -7.870 359 HA THR 43 HA THR 43 59.761 2.890 -5.984 360 HB THR 43 HB THR 43 59.912 5.296 -6.242 361 HG1 THR 43 HG1 THR 43 59.878 5.757 -4.009 362 HG21 THR 43 HG21 THR 43 58.195 6.821 -5.225 363 HG22 THR 43 HG22 THR 43 57.408 5.810 -6.483 364 HG23 THR 43 HG23 THR 43 57.177 5.418 -4.741 365 H VAL 44 HN VAL 44 56.125 3.428 -6.194 366 HA VAL 44 HA VAL 44 55.708 2.297 -3.640 367 HB VAL 44 HB VAL 44 53.374 2.111 -4.206 368 HG11 VAL 44 HG11 VAL 44 53.055 4.636 -4.570 369 HG12 VAL 44 HG12 VAL 44 54.313 4.292 -3.346 370 HG13 VAL 44 HG13 VAL 44 54.790 4.772 -5.018 371 HG21 VAL 44 HG21 VAL 44 52.481 3.035 -6.355 372 HG22 VAL 44 HG22 VAL 44 54.156 3.085 -7.019 373 HG23 VAL 44 HG23 VAL 44 53.396 1.511 -6.585 374 H LYS 45 HN LYS 45 55.832 0.892 -6.976 375 HA LYS 45 HA LYS 45 55.206 -1.725 -6.249 376 HB2 LYS 45 HB1 LYS 45 55.255 -0.887 -8.588 377 HB3 LYS 45 HB2 LYS 45 57.018 -0.642 -8.491 378 HG2 LYS 45 HG1 LYS 45 57.308 -3.161 -8.120 379 HG3 LYS 45 HG2 LYS 45 55.529 -3.365 -8.245 380 HD2 LYS 45 HD1 LYS 45 57.240 -2.147 -10.497 381 HD3 LYS 45 HD2 LYS 45 57.007 -3.919 -10.312 382 HE2 LYS 45 HE1 LYS 45 54.492 -3.584 -10.495 383 HE3 LYS 45 HE2 LYS 45 54.771 -1.823 -10.776 384 HZ1 LYS 45 HZ1 LYS 45 54.566 -3.047 -12.845 385 HZ2 LYS 45 HZ2 LYS 45 56.129 -2.403 -12.692 386 HZ3 LYS 45 HZ3 LYS 45 55.865 -4.057 -12.425 387 H ARG 46 HN ARG 46 58.355 -0.028 -6.289 388 HA ARG 46 HA ARG 46 60.023 -2.189 -5.650 389 HB2 ARG 46 HB1 ARG 46 60.744 0.086 -6.464 390 HB3 ARG 46 HB2 ARG 46 60.191 0.832 -4.945 391 HG2 ARG 46 HG1 ARG 46 62.020 -0.852 -3.877 392 HG3 ARG 46 HG2 ARG 46 62.670 -0.859 -5.527 393 HD2 ARG 46 HD1 ARG 46 62.354 1.791 -5.505 394 HD3 ARG 46 HD2 ARG 46 62.338 1.631 -3.701 395 HE ARG 46 HE ARG 46 64.526 0.150 -4.633 396 HH11 ARG 46 HH11 ARG 46 66.819 2.988 -4.508 397 HH12 ARG 46 HH12 ARG 46 66.668 1.249 -4.566 398 HH21 ARG 46 HH21 ARG 46 64.820 4.280 -4.447 399 HH22 ARG 46 HH22 ARG 46 63.301 3.453 -4.503 400 H VAL 47 HN VAL 47 58.345 0.137 -3.426 401 HA VAL 47 HA VAL 47 59.324 -0.951 -1.055 402 HB VAL 47 HB VAL 47 56.843 0.643 -1.731 403 HG11 VAL 47 HG11 VAL 47 56.678 1.130 0.753 404 HG12 VAL 47 HG12 VAL 47 56.356 -0.593 0.395 405 HG13 VAL 47 HG13 VAL 47 57.953 -0.095 1.075 406 HG21 VAL 47 HG21 VAL 47 58.274 2.484 -0.611 407 HG22 VAL 47 HG22 VAL 47 59.609 1.289 -0.424 408 HG23 VAL 47 HG23 VAL 47 59.071 1.802 -2.064 409 H LEU 48 HN LEU 48 56.249 -1.747 -2.901 410 HA LEU 48 HA LEU 48 55.413 -3.711 -1.138 411 HB2 LEU 48 HB1 LEU 48 55.106 -3.306 -4.171 412 HB3 LEU 48 HB2 LEU 48 54.286 -4.655 -3.351 413 HG LEU 48 HG LEU 48 53.880 -1.705 -2.514 414 HD11 LEU 48 HD11 LEU 48 51.760 -1.800 -3.939 415 HD12 LEU 48 HD12 LEU 48 53.250 -1.934 -4.941 416 HD13 LEU 48 HD13 LEU 48 52.275 -3.403 -4.575 417 HD21 LEU 48 HD21 LEU 48 51.743 -2.585 -1.560 418 HD22 LEU 48 HD22 LEU 48 52.145 -4.244 -2.108 419 HD23 LEU 48 HD23 LEU 48 53.167 -3.438 -0.864 420 H TYR 49 HN TYR 49 57.584 -3.990 -4.034 421 HA TYR 49 HA TYR 49 57.794 -6.765 -3.957 422 HB2 TYR 49 HB1 TYR 49 58.366 -5.310 -5.947 423 HB3 TYR 49 HB2 TYR 49 59.751 -4.615 -5.051 424 HD1 TYR 49 HD1 TYR 49 58.282 -7.759 -6.438 425 HD2 TYR 49 HD2 TYR 49 61.864 -5.860 -5.001 426 HE1 TYR 49 HE1 TYR 49 59.639 -9.648 -7.311 427 HE2 TYR 49 HE2 TYR 49 63.206 -7.756 -5.859 428 HH TYR 49 HH TYR 49 63.203 -9.676 -6.990 429 H ARG 50 HN ARG 50 59.929 -4.209 -2.448 430 HA ARG 50 HA ARG 50 61.661 -6.064 -1.264 431 HB2 ARG 50 HB1 ARG 50 60.897 -3.235 -0.518 432 HB3 ARG 50 HB2 ARG 50 62.050 -4.156 0.476 433 HG2 ARG 50 HG1 ARG 50 63.292 -4.572 -1.887 434 HG3 ARG 50 HG2 ARG 50 62.298 -3.225 -2.470 435 HD2 ARG 50 HD1 ARG 50 63.321 -1.583 -1.152 436 HD3 ARG 50 HD2 ARG 50 63.832 -2.736 0.148 437 HE ARG 50 HE ARG 50 65.254 -2.104 -2.317 438 HH11 ARG 50 HH11 ARG 50 66.290 -5.243 0.175 439 HH12 ARG 50 HH12 ARG 50 64.790 -4.364 0.346 440 HH21 ARG 50 HH21 ARG 50 67.774 -4.589 -1.564 441 HH22 ARG 50 HH22 ARG 50 67.298 -3.300 -2.616 442 H HIS 51 HN HIS 51 58.587 -4.626 0.126 443 HA HIS 51 HA HIS 51 58.901 -5.889 2.608 444 HB2 HIS 51 HB1 HIS 51 57.312 -3.946 2.017 445 HB3 HIS 51 HB2 HIS 51 56.245 -5.157 1.253 446 HD1 HIS 51 HD1 HIS 51 55.682 -7.285 3.230 447 HD2 HIS 51 HD2 HIS 51 56.591 -3.421 4.585 448 HE1 HIS 51 HE1 HIS 51 54.752 -7.029 5.605 449 H ASN 52 HN ASN 52 57.330 -7.119 -0.484 450 HA ASN 52 HA ASN 52 56.549 -9.516 0.682 451 HB2 ASN 52 HB1 ASN 52 57.410 -8.732 -2.180 452 HB3 ASN 52 HB2 ASN 52 56.816 -10.384 -1.827 453 HD21 ASN 52 HD21 ASN 52 53.540 -8.375 -0.918 454 HD22 ASN 52 HD22 ASN 52 54.771 -8.916 0.196 455 H LEU 53 HN LEU 53 59.737 -8.606 -0.873 456 HA LEU 53 HA LEU 53 60.757 -11.212 -0.792 457 HB2 LEU 53 HB1 LEU 53 61.508 -9.355 -2.319 458 HB3 LEU 53 HB2 LEU 53 62.162 -8.464 -0.925 459 HG LEU 53 HG LEU 53 63.737 -9.502 -2.416 460 HD11 LEU 53 HD11 LEU 53 65.321 -10.647 -0.694 461 HD12 LEU 53 HD12 LEU 53 64.656 -9.056 -0.172 462 HD13 LEU 53 HD13 LEU 53 63.967 -10.584 0.489 463 HD21 LEU 53 HD21 LEU 53 64.221 -12.032 -2.316 464 HD22 LEU 53 HD22 LEU 53 62.694 -12.240 -1.401 465 HD23 LEU 53 HD23 LEU 53 62.651 -11.580 -3.075 466 H LYS 54 HN LYS 54 61.201 -8.399 1.482 467 HA LYS 54 HA LYS 54 62.298 -10.323 3.394 468 HB2 LYS 54 HB1 LYS 54 63.397 -8.414 4.540 469 HB3 LYS 54 HB2 LYS 54 64.038 -8.682 2.899 470 HG2 LYS 54 HG1 LYS 54 62.793 -6.715 2.041 471 HG3 LYS 54 HG2 LYS 54 61.918 -6.536 3.598 472 HD2 LYS 54 HD1 LYS 54 64.007 -5.928 4.754 473 HD3 LYS 54 HD2 LYS 54 64.980 -6.325 3.297 474 HE2 LYS 54 HE1 LYS 54 64.790 -3.875 3.482 475 HE3 LYS 54 HE2 LYS 54 63.826 -4.412 2.055 476 HZ1 LYS 54 HZ1 LYS 54 62.636 -2.825 3.403 477 HZ2 LYS 54 HZ2 LYS 54 61.848 -4.328 3.429 478 HZ3 LYS 54 HZ3 LYS 54 62.756 -3.824 4.769 479 H GLY 55 HN GLY 55 61.159 -10.752 5.203 480 HA2 GLY 55 HA2 GLY 55 58.764 -9.220 5.732 481 HA3 GLY 55 HA1 GLY 55 59.377 -10.702 6.586 482 H ARG 56 HN ARG 56 59.241 -7.287 6.470 483 HA ARG 56 HA ARG 56 61.604 -6.507 7.733 484 HB2 ARG 56 HB1 ARG 56 60.186 -5.078 6.295 485 HB3 ARG 56 HB2 ARG 56 58.850 -5.130 7.469 486 HG2 ARG 56 HG1 ARG 56 59.893 -2.969 7.686 487 HG3 ARG 56 HG2 ARG 56 60.380 -3.880 9.127 488 HD2 ARG 56 HD1 ARG 56 62.610 -4.341 8.309 489 HD3 ARG 56 HD2 ARG 56 62.239 -3.698 6.656 490 HE ARG 56 HE ARG 56 61.548 -1.723 8.598 491 HH11 ARG 56 HH11 ARG 56 65.495 -1.993 7.401 492 HH12 ARG 56 HH12 ARG 56 64.411 -3.363 7.384 493 HH21 ARG 56 HH21 ARG 56 64.619 0.109 8.139 494 HH22 ARG 56 HH22 ARG 56 62.947 0.191 8.580 495 H SER 57 HN SER 57 58.375 -7.148 9.180 496 HA SER 57 HA SER 57 59.077 -6.457 11.760 497 HB2 SER 57 HB1 SER 57 57.026 -7.815 12.395 498 HB3 SER 57 HB2 SER 57 56.696 -6.636 11.087 499 HG SER 57 HG SER 57 55.926 -8.890 10.796 500 H ALA 58 HN ALA 58 60.007 -9.338 9.986 501 HA ALA 58 HA ALA 58 60.594 -10.794 12.481 502 HB1 ALA 58 HB1 ALA 58 59.221 -12.000 10.781 503 HB2 ALA 58 HB2 ALA 58 60.501 -11.733 9.548 504 HB3 ALA 58 HB3 ALA 58 60.826 -12.785 10.978 505 H ARG 59 HN ARG 59 62.237 -10.307 9.236 506 HA ARG 59 HA ARG 59 64.671 -9.587 10.569 507 HB2 ARG 59 HB1 ARG 59 66.056 -11.426 9.806 508 HB3 ARG 59 HB2 ARG 59 64.828 -12.064 10.924 509 HG2 ARG 59 HG1 ARG 59 63.466 -12.792 8.853 510 HG3 ARG 59 HG2 ARG 59 64.799 -12.235 7.824 511 HD2 ARG 59 HD1 ARG 59 66.430 -13.765 9.070 512 HD3 ARG 59 HD2 ARG 59 65.021 -14.520 9.920 513 HE ARG 59 HE ARG 59 65.760 -14.801 7.100 514 HH11 ARG 59 HH11 ARG 59 62.290 -16.357 8.712 515 HH12 ARG 59 HH12 ARG 59 63.248 -15.158 9.547 516 HH21 ARG 59 HH21 ARG 59 63.079 -17.143 6.606 517 HH22 ARG 59 HH22 ARG 59 64.540 -16.470 5.969 518 H LYS 60 HN LYS 60 66.438 -9.076 9.029 519 HA LYS 60 HA LYS 60 65.563 -7.949 6.634 520 HB2 LYS 60 HB1 LYS 60 67.551 -7.172 7.879 521 HB3 LYS 60 HB2 LYS 60 68.375 -8.731 7.618 522 HG2 LYS 60 HG1 LYS 60 69.278 -6.984 6.086 523 HG3 LYS 60 HG2 LYS 60 68.463 -8.271 5.137 524 HD2 LYS 60 HD1 LYS 60 66.462 -6.829 4.853 525 HD3 LYS 60 HD2 LYS 60 67.166 -5.586 5.941 526 HE2 LYS 60 HE1 LYS 60 67.418 -4.862 3.584 527 HE3 LYS 60 HE2 LYS 60 69.050 -5.221 4.269 528 HZ1 LYS 60 HZ1 LYS 60 68.754 -6.188 2.085 529 HZ2 LYS 60 HZ2 LYS 60 68.933 -7.408 3.253 530 HZ3 LYS 60 HZ3 LYS 60 67.401 -7.069 2.610 531 H LEU 61 HN LEU 61 67.009 -11.074 7.346 532 HA LEU 61 HA LEU 61 67.385 -12.957 6.279 533 HB2 LEU 61 HB1 LEU 61 65.133 -12.686 5.276 534 HB3 LEU 61 HB2 LEU 61 65.845 -11.810 3.901 535 HG LEU 61 HG LEU 61 66.788 -14.622 4.602 536 HD11 LEU 61 HD11 LEU 61 64.931 -15.506 3.034 537 HD12 LEU 61 HD12 LEU 61 64.287 -14.779 4.551 538 HD13 LEU 61 HD13 LEU 61 64.219 -13.853 3.006 539 HD21 LEU 61 HD21 LEU 61 67.104 -14.863 2.121 540 HD22 LEU 61 HD22 LEU 61 66.499 -13.196 1.860 541 HD23 LEU 61 HD23 LEU 61 68.025 -13.461 2.777 542 H GLU 62 HN GLU 62 69.443 -13.585 5.619 543 HA GLU 62 HA GLU 62 71.168 -11.531 4.870 544 HB2 GLU 62 HB1 GLU 62 71.770 -13.441 6.336 545 HB3 GLU 62 HB2 GLU 62 71.587 -14.573 4.977 546 HG2 GLU 62 HG1 GLU 62 73.491 -13.446 3.762 547 HG3 GLU 62 HG2 GLU 62 73.673 -12.256 5.107 Start of MODEL 3 1 H1 ALA 1 HT1 ALA 1 43.095 14.409 10.693 2 H2 ALA 1 HT2 ALA 1 42.762 13.660 12.120 3 H3 ALA 1 HT3 ALA 1 43.166 12.768 10.789 4 HA ALA 1 HA ALA 1 44.909 14.656 12.210 5 HB1 ALA 1 HB1 ALA 1 44.567 12.628 13.527 6 HB2 ALA 1 HB2 ALA 1 46.233 12.733 12.925 7 HB3 ALA 1 HB3 ALA 1 45.071 11.616 12.156 8 H SER 2 HN SER 2 45.424 11.861 9.895 9 HA SER 2 HA SER 2 46.730 13.768 8.029 10 HB2 SER 2 HB2 SER 2 48.558 12.079 7.711 11 HB3 SER 2 HB1 SER 2 48.565 12.877 9.287 12 HG SER 2 HG SER 2 47.536 10.277 8.735 13 H MET 3 HN MET 3 46.958 12.873 5.830 14 HA MET 3 HA MET 3 45.169 10.599 5.146 15 HB2 MET 3 HB2 MET 3 44.967 13.449 4.060 16 HB3 MET 3 HB1 MET 3 44.113 12.049 3.396 17 HG2 MET 3 HG2 MET 3 42.918 11.730 5.523 18 HG3 MET 3 HG1 MET 3 43.752 13.129 6.217 19 HE1 MET 3 HE1 MET 3 40.559 12.679 6.139 20 HE2 MET 3 HE2 MET 3 40.005 14.315 5.736 21 HE3 MET 3 HE3 MET 3 41.323 14.088 6.914 22 H VAL 4 HG21 VAL 4 45.337 10.187 2.672 23 HA VAL 4 HG22 VAL 4 48.119 9.846 1.977 24 HB VAL 4 HG23 VAL 4 45.662 9.354 0.243 25 HG11 VAL 4 HA VAL 4 48.535 8.298 0.142 26 HG12 VAL 4 HB VAL 4 47.651 9.193 -1.115 27 HG13 VAL 4 HN VAL 4 47.174 7.552 -0.723 28 HG21 VAL 4 HG11 VAL 4 47.097 7.500 2.187 29 HG22 VAL 4 HG12 VAL 4 45.825 7.017 1.043 30 HG23 VAL 4 HG13 VAL 4 45.442 8.109 2.365 31 H LEU 5 HD12 LEU 5 45.990 12.483 1.404 32 HA LEU 5 HD13 LEU 5 47.530 13.681 -0.769 33 HB2 LEU 5 HD22 LEU 5 45.126 14.061 -0.247 34 HB3 LEU 5 HD21 LEU 5 45.573 14.907 1.226 35 HG LEU 5 HD23 LEU 5 46.738 15.880 -1.395 36 HD11 LEU 5 HA LEU 5 43.878 16.430 -0.468 37 HD12 LEU 5 HB1 LEU 5 44.361 15.509 -1.920 38 HD13 LEU 5 HN LEU 5 44.712 17.226 -1.819 39 HD21 LEU 5 HB2 LEU 5 45.606 17.358 1.035 40 HD22 LEU 5 HD11 LEU 5 47.331 17.071 0.729 41 HD23 LEU 5 HG LEU 5 46.409 18.095 -0.366 42 H SER 6 HN SER 6 48.055 13.321 2.645 43 HA SER 6 HA SER 6 49.751 15.709 2.970 44 HB2 SER 6 HB2 SER 6 49.562 13.276 4.792 45 HB3 SER 6 HB1 SER 6 50.144 14.889 5.200 46 HG SER 6 HG SER 6 47.781 15.369 4.423 47 HA PRO 7 HA PRO 7 53.591 13.313 2.131 48 HB2 PRO 7 HB2 PRO 7 55.450 14.731 3.517 49 HB3 PRO 7 HB1 PRO 7 54.692 15.347 2.028 50 HG2 PRO 7 HG2 PRO 7 53.878 15.960 4.889 51 HG3 PRO 7 HG1 PRO 7 54.195 17.118 3.555 52 HD2 PRO 7 HD2 PRO 7 51.675 16.288 4.189 53 HD3 PRO 7 HD1 PRO 7 52.153 16.588 2.497 54 H ARG 8 HN ARG 8 51.945 11.984 3.519 55 HA ARG 8 HA ARG 8 53.545 10.353 5.355 56 HB2 ARG 8 HB2 ARG 8 50.777 11.553 6.072 57 HB3 ARG 8 HB1 ARG 8 51.434 10.146 6.883 58 HG2 ARG 8 HG2 ARG 8 53.430 11.567 7.678 59 HG3 ARG 8 HG1 ARG 8 52.750 12.960 6.830 60 HD2 ARG 8 HD2 ARG 8 50.634 12.739 8.278 61 HD3 ARG 8 HD1 ARG 8 51.412 11.395 9.149 62 HE ARG 8 HE ARG 8 52.125 14.317 9.421 63 HH11 ARG 8 HH11 ARG 8 53.245 11.086 9.989 64 HH12 ARG 8 HH12 ARG 8 54.431 11.641 11.265 65 HH21 ARG 8 HH21 ARG 8 53.470 14.914 10.861 66 HH22 ARG 8 HH22 ARG 8 54.534 13.712 11.719 67 H ASP 9 HN ASP 9 52.547 10.315 2.576 68 HA ASP 9 HA ASP 9 50.363 8.521 2.169 69 HB2 ASP 9 HB2 ASP 9 51.294 8.393 -0.090 70 HB3 ASP 9 HB1 ASP 9 51.239 10.069 0.464 71 H GLU 10 HN GLU 10 53.949 7.980 2.096 72 HA GLU 10 HA GLU 10 54.203 5.269 2.053 73 HB2 GLU 10 HB2 GLU 10 56.073 6.787 2.210 74 HB3 GLU 10 HB1 GLU 10 55.679 7.237 3.857 75 HG2 GLU 10 HG2 GLU 10 56.346 4.358 3.099 76 HG3 GLU 10 HG1 GLU 10 57.615 5.549 3.339 77 H ARG 11 HN ARG 11 53.427 7.132 4.954 78 HA ARG 11 HA ARG 11 53.498 4.917 6.716 79 HB2 ARG 11 HB2 ARG 11 53.657 7.534 7.116 80 HB3 ARG 11 HB1 ARG 11 51.897 7.463 7.249 81 HG2 ARG 11 HG2 ARG 11 52.834 7.330 9.461 82 HG3 ARG 11 HG1 ARG 11 52.192 5.727 9.083 83 HD2 ARG 11 HD2 ARG 11 54.483 4.948 8.489 84 HD3 ARG 11 HD1 ARG 11 55.104 6.582 8.767 85 HE ARG 11 HE ARG 11 53.706 5.473 11.069 86 HH11 ARG 11 HH11 ARG 11 54.888 4.992 12.896 87 HH12 ARG 11 HH12 ARG 11 56.606 4.782 12.801 88 HH21 ARG 11 HH21 ARG 11 56.762 5.327 9.404 89 HH22 ARG 11 HH22 ARG 11 57.671 4.941 10.834 90 H THR 12 HG1 THR 12 50.959 6.118 4.726 91 HA THR 12 HG21 THR 12 48.859 4.431 5.969 92 HB THR 12 HG22 THR 12 48.689 6.071 3.423 93 HG1 THR 12 HG23 THR 12 49.140 7.476 5.051 94 HG21 THR 12 HA THR 12 46.597 4.929 5.331 95 HG22 THR 12 HB THR 12 46.881 4.440 3.635 96 HG23 THR 12 HN THR 12 46.243 6.051 4.003 97 H LEU 13 HD12 LEU 13 50.767 4.682 2.986 98 HA LEU 13 HD13 LEU 13 49.763 2.580 1.458 99 HB2 LEU 13 HD22 LEU 13 51.370 4.525 0.940 100 HB3 LEU 13 HD21 LEU 13 52.650 3.581 1.653 101 HG LEU 13 HD23 LEU 13 52.791 3.539 -0.709 102 HD11 LEU 13 HA LEU 13 51.711 0.799 0.028 103 HD12 LEU 13 HB1 LEU 13 53.347 1.387 0.410 104 HD13 LEU 13 HN LEU 13 52.833 1.213 -1.277 105 HD21 LEU 13 HB2 LEU 13 50.022 2.317 -0.897 106 HD22 LEU 13 HD11 LEU 13 50.361 4.046 -1.106 107 HD23 LEU 13 HG LEU 13 51.095 2.890 -2.201 108 H VAL 14 HG21 VAL 14 52.689 2.507 3.544 109 HA VAL 14 HG22 VAL 14 53.210 -0.274 3.228 110 HB VAL 14 HG23 VAL 14 54.059 1.714 5.377 111 HG11 VAL 14 HA VAL 14 54.333 -0.555 6.307 112 HG12 VAL 14 HB VAL 14 55.894 0.159 5.911 113 HG13 VAL 14 HN VAL 14 55.188 -1.058 4.827 114 HG21 VAL 14 HG11 VAL 14 54.863 2.197 3.054 115 HG22 VAL 14 HG12 VAL 14 55.543 0.564 2.956 116 HG23 VAL 14 HG13 VAL 14 56.179 1.741 4.130 117 H ARG 15 HN ARG 15 51.401 1.446 5.836 118 HA ARG 15 HA ARG 15 50.967 -1.052 7.240 119 HB2 ARG 15 HB2 ARG 15 51.089 1.118 8.406 120 HB3 ARG 15 HB1 ARG 15 49.586 1.623 7.642 121 HG2 ARG 15 HG2 ARG 15 49.230 0.878 9.949 122 HG3 ARG 15 HG1 ARG 15 48.335 -0.118 8.808 123 HD2 ARG 15 HD2 ARG 15 50.036 -1.920 9.011 124 HD3 ARG 15 HD1 ARG 15 50.981 -0.904 10.122 125 HE ARG 15 HE ARG 15 48.256 -1.255 11.020 126 HH11 ARG 15 HH11 ARG 15 47.793 -2.496 12.805 127 HH12 ARG 15 HH12 ARG 15 48.931 -3.677 13.346 128 HH21 ARG 15 HH21 ARG 15 51.285 -3.072 10.932 129 HH22 ARG 15 HH22 ARG 15 50.841 -3.991 12.339 130 H LYS 16 HN LYS 16 48.969 0.698 4.850 131 HA LYS 16 HA LYS 16 46.641 -0.980 5.095 132 HB2 LYS 16 HB2 LYS 16 46.613 1.160 3.892 133 HB3 LYS 16 HB1 LYS 16 47.740 0.532 2.688 134 HG2 LYS 16 HG2 LYS 16 46.055 -1.162 1.988 135 HG3 LYS 16 HG1 LYS 16 44.928 -0.545 3.222 136 HD2 LYS 16 HD2 LYS 16 44.872 1.644 2.079 137 HD3 LYS 16 HD1 LYS 16 46.069 1.066 0.895 138 HE2 LYS 16 HE2 LYS 16 44.493 -0.689 0.134 139 HE3 LYS 16 HE1 LYS 16 43.295 -0.151 1.318 140 HZ1 LYS 16 HZ1 LYS 16 42.873 0.779 -0.912 141 HZ2 LYS 16 HZ2 LYS 16 44.337 1.540 -0.908 142 HZ3 LYS 16 HZ3 LYS 16 43.188 1.989 0.165 143 H VAL 17 HG21 VAL 17 49.522 -1.271 2.980 144 HA VAL 17 HG22 VAL 17 48.798 -3.787 1.796 145 HB VAL 17 HG23 VAL 17 51.480 -2.467 2.315 146 HG11 VAL 17 HA VAL 17 52.438 -3.980 0.636 147 HG12 VAL 17 HB VAL 17 50.901 -4.880 0.531 148 HG13 VAL 17 HN VAL 17 51.873 -4.897 2.023 149 HG21 VAL 17 HG11 VAL 17 49.814 -1.335 0.727 150 HG22 VAL 17 HG12 VAL 17 49.947 -2.778 -0.305 151 HG23 VAL 17 HG13 VAL 17 51.366 -1.759 0.031 152 H GLN 18 HB1 GLN 18 50.596 -3.041 4.788 153 HA GLN 18 HB2 GLN 18 51.306 -5.700 5.421 154 HB2 GLN 18 HG2 GLN 18 52.324 -3.612 6.240 155 HB3 GLN 18 HG1 GLN 18 50.884 -3.281 7.214 156 HG2 GLN 18 HE22 GLN 18 51.364 -5.245 8.615 157 HG3 GLN 18 HE21 GLN 18 52.743 -5.675 7.570 158 HE21 GLN 18 HA GLN 18 54.819 -3.057 8.884 159 HE22 GLN 18 HN GLN 18 54.572 -4.095 7.478 160 H ILE 19 HD11 ILE 19 48.168 -4.185 5.828 161 HA ILE 19 HD12 ILE 19 47.266 -6.591 7.377 162 HB ILE 19 HD13 ILE 19 45.196 -5.423 7.832 163 HG12 ILE 19 HG12 ILE 19 46.461 -2.931 6.641 164 HG13 ILE 19 HG11 ILE 19 45.190 -3.857 5.864 165 HG21 ILE 19 HG21 ILE 19 46.088 -4.021 9.586 166 HG22 ILE 19 HG22 ILE 19 47.623 -3.804 8.706 167 HG23 ILE 19 HG23 ILE 19 47.169 -5.396 9.367 168 HD11 ILE 19 HA ILE 19 44.950 -2.346 8.498 169 HD12 ILE 19 HB ILE 19 43.688 -3.403 7.800 170 HD13 ILE 19 HN ILE 19 44.209 -1.940 6.937 171 H ASN 20 HB1 ASN 20 46.801 -4.885 4.323 172 HA ASN 20 HB2 ASN 20 45.200 -7.208 3.328 173 HB2 ASN 20 HD22 ASN 20 45.171 -4.272 2.541 174 HB3 ASN 20 HD21 ASN 20 44.465 -5.550 1.557 175 HD21 ASN 20 HA ASN 20 42.300 -4.988 1.688 176 HD22 ASN 20 HN ASN 20 41.472 -4.995 3.245 177 HA PRO 21 HA PRO 21 49.403 -7.267 1.284 178 HB2 PRO 21 HB2 PRO 21 49.838 -9.980 1.320 179 HB3 PRO 21 HB1 PRO 21 50.195 -8.893 2.695 180 HG2 PRO 21 HG2 PRO 21 47.682 -10.554 2.232 181 HG3 PRO 21 HG1 PRO 21 48.704 -10.482 3.705 182 HD2 PRO 21 HD2 PRO 21 46.471 -8.997 3.524 183 HD3 PRO 21 HD1 PRO 21 47.951 -8.291 4.238 184 H ARG 22 HN ARG 22 46.331 -8.313 0.450 185 HA ARG 22 HA ARG 22 46.953 -9.245 -2.292 186 HB2 ARG 22 HB2 ARG 22 44.298 -8.630 -0.916 187 HB3 ARG 22 HB1 ARG 22 44.481 -9.319 -2.533 188 HG2 ARG 22 HG2 ARG 22 45.637 -11.293 -1.587 189 HG3 ARG 22 HG1 ARG 22 45.434 -10.634 0.049 190 HD2 ARG 22 HD2 ARG 22 42.951 -10.667 -0.271 191 HD3 ARG 22 HD1 ARG 22 43.184 -11.396 -1.859 192 HE ARG 22 HE ARG 22 44.050 -13.389 -0.851 193 HH11 ARG 22 HH11 ARG 22 43.934 -14.951 0.728 194 HH12 ARG 22 HH12 ARG 22 43.268 -14.559 2.276 195 HH21 ARG 22 HH21 ARG 22 42.602 -11.289 1.557 196 HH22 ARG 22 HH22 ARG 22 42.554 -12.548 2.748 197 H THR 23 HG1 THR 23 46.853 -6.216 -0.798 198 HA THR 23 HG21 THR 23 45.486 -4.642 -2.785 199 HB THR 23 HG22 THR 23 47.736 -3.700 -0.965 200 HG1 THR 23 HG23 THR 23 46.302 -4.562 0.380 201 HG21 THR 23 HA THR 23 46.942 -2.092 -2.686 202 HG22 THR 23 HB THR 23 46.598 -1.552 -1.039 203 HG23 THR 23 HN THR 23 45.296 -2.247 -2.045 204 H THR 24 HG1 THR 24 46.091 -4.360 -4.877 205 HA THR 24 HG21 THR 24 48.902 -4.921 -5.624 206 HB THR 24 HG22 THR 24 48.213 -5.310 -7.782 207 HG1 THR 24 HG23 THR 24 45.785 -4.000 -7.192 208 HG21 THR 24 HA THR 24 46.394 -6.860 -7.759 209 HG22 THR 24 HB THR 24 45.739 -6.177 -6.259 210 HG23 THR 24 HN THR 24 47.295 -7.037 -6.238 211 H ALA 25 HN ALA 25 49.633 -3.649 -7.690 212 HA ALA 25 HA ALA 25 50.005 -0.887 -6.992 213 HB1 ALA 25 HB1 ALA 25 50.545 -2.350 -9.607 214 HB2 ALA 25 HB2 ALA 25 51.667 -2.187 -8.235 215 HB3 ALA 25 HB3 ALA 25 51.169 -0.747 -9.140 216 H LYS 26 HN LYS 26 47.264 -2.399 -8.522 217 HA LYS 26 HA LYS 26 46.477 0.117 -9.926 218 HB2 LYS 26 HB2 LYS 26 45.401 -2.717 -9.880 219 HB3 LYS 26 HB1 LYS 26 44.404 -1.397 -10.471 220 HG2 LYS 26 HG2 LYS 26 47.202 -1.895 -11.558 221 HG3 LYS 26 HG1 LYS 26 45.772 -2.691 -12.222 222 HD2 LYS 26 HD2 LYS 26 44.750 -0.610 -12.848 223 HD3 LYS 26 HD1 LYS 26 45.982 0.346 -12.001 224 HE2 LYS 26 HE2 LYS 26 47.725 -0.523 -13.531 225 HE3 LYS 26 HE1 LYS 26 46.502 -1.449 -14.409 226 HZ1 LYS 26 HZ1 LYS 26 45.410 0.642 -14.984 227 HZ2 LYS 26 HZ2 LYS 26 46.966 0.707 -15.476 228 HZ3 LYS 26 HZ3 LYS 26 46.492 1.519 -14.126 229 H ASP 27 HN ASP 27 45.408 -1.818 -7.112 230 HA ASP 27 HA ASP 27 43.456 -0.085 -6.083 231 HB2 ASP 27 HB2 ASP 27 45.709 -1.625 -4.720 232 HB3 ASP 27 HB1 ASP 27 44.443 -0.797 -3.836 233 H LEU 28 HD12 LEU 28 46.968 0.155 -6.129 234 HA LEU 28 HD13 LEU 28 47.125 2.602 -4.532 235 HB2 LEU 28 HD22 LEU 28 49.023 0.711 -5.891 236 HB3 LEU 28 HD21 LEU 28 49.575 2.356 -5.633 237 HG LEU 28 HD23 LEU 28 49.223 2.230 -3.271 238 HD11 LEU 28 HA LEU 28 48.323 -0.642 -3.636 239 HD12 LEU 28 HB1 LEU 28 47.295 0.699 -3.078 240 HD13 LEU 28 HN LEU 28 48.650 0.154 -2.083 241 HD21 LEU 28 HB2 LEU 28 50.927 0.465 -2.758 242 HD22 LEU 28 HD11 LEU 28 50.670 -0.231 -4.372 243 HD23 LEU 28 HG LEU 28 51.341 1.404 -4.204 244 H VAL 29 HG21 VAL 29 46.983 1.990 -8.055 245 HA VAL 29 HG22 VAL 29 47.563 4.722 -8.839 246 HB VAL 29 HG23 VAL 29 45.750 2.613 -10.081 247 HG11 VAL 29 HA VAL 29 44.758 4.744 -10.727 248 HG12 VAL 29 HB VAL 29 45.643 4.109 -12.099 249 HG13 VAL 29 HN VAL 29 46.349 5.417 -11.124 250 HG21 VAL 29 HG11 VAL 29 48.300 3.876 -11.131 251 HG22 VAL 29 HG12 VAL 29 47.426 2.486 -11.815 252 HG23 VAL 29 HG13 VAL 29 48.268 2.329 -10.253 253 H LYS 30 HN LYS 30 44.469 3.075 -8.137 254 HA LYS 30 HA LYS 30 42.772 5.295 -8.056 255 HB2 LYS 30 HB2 LYS 30 42.798 2.633 -6.567 256 HB3 LYS 30 HB1 LYS 30 41.527 3.819 -6.318 257 HG2 LYS 30 HG2 LYS 30 41.238 3.910 -8.825 258 HG3 LYS 30 HG1 LYS 30 42.299 2.504 -8.954 259 HD2 LYS 30 HD2 LYS 30 40.758 1.056 -7.993 260 HD3 LYS 30 HD1 LYS 30 40.003 2.303 -6.998 261 HE2 LYS 30 HE2 LYS 30 39.698 2.098 -10.017 262 HE3 LYS 30 HE1 LYS 30 38.514 1.526 -8.832 263 HZ1 LYS 30 HZ1 LYS 30 38.525 3.919 -7.953 264 HZ2 LYS 30 HZ2 LYS 30 37.902 3.785 -9.490 265 HZ3 LYS 30 HZ3 LYS 30 39.418 4.353 -9.147 266 H MET 31 HN MET 31 44.327 3.913 -5.139 267 HA MET 31 HA MET 31 43.463 6.035 -3.466 268 HB2 MET 31 HB2 MET 31 44.203 3.617 -2.941 269 HB3 MET 31 HB1 MET 31 45.847 4.237 -2.969 270 HG2 MET 31 HG2 MET 31 45.021 5.898 -1.129 271 HG3 MET 31 HG1 MET 31 43.566 4.926 -1.085 272 HE1 MET 31 HE1 MET 31 47.829 3.661 0.231 273 HE2 MET 31 HE2 MET 31 47.343 5.249 -0.393 274 HE3 MET 31 HE3 MET 31 47.446 3.866 -1.494 275 H LEU 32 HD12 LEU 32 45.458 6.712 -5.877 276 HA LEU 32 HD13 LEU 32 46.843 8.903 -4.391 277 HB2 LEU 32 HD22 LEU 32 47.884 7.254 -6.732 278 HB3 LEU 32 HD21 LEU 32 48.648 8.735 -6.146 279 HG LEU 32 HD23 LEU 32 48.297 6.234 -4.413 280 HD11 LEU 32 HA LEU 32 50.742 5.913 -4.865 281 HD12 LEU 32 HB1 LEU 32 50.619 7.154 -6.144 282 HD13 LEU 32 HN LEU 32 49.719 5.660 -6.279 283 HD21 LEU 32 HB2 LEU 32 48.579 8.272 -3.119 284 HD22 LEU 32 HD11 LEU 32 50.054 7.293 -3.038 285 HD23 LEU 32 HG LEU 32 49.994 8.732 -4.087 286 H GLU 33 HN GLU 33 45.501 7.734 -7.449 287 HA GLU 33 HA GLU 33 45.164 10.157 -8.888 288 HB2 GLU 33 HB2 GLU 33 45.184 7.793 -9.646 289 HB3 GLU 33 HB1 GLU 33 43.639 7.516 -8.856 290 HG2 GLU 33 HG2 GLU 33 42.524 8.935 -10.496 291 HG3 GLU 33 HG1 GLU 33 44.091 9.411 -11.185 292 H GLU 34 HN GLU 34 42.961 8.373 -6.704 293 HA GLU 34 HA GLU 34 40.802 10.256 -6.732 294 HB2 GLU 34 HB2 GLU 34 41.544 7.987 -4.846 295 HB3 GLU 34 HB1 GLU 34 40.019 8.846 -4.777 296 HG2 GLU 34 HG2 GLU 34 39.228 8.036 -6.817 297 HG3 GLU 34 HG1 GLU 34 40.821 7.601 -7.413 298 H THR 35 HG1 THR 35 43.845 10.728 -5.383 299 HA THR 35 HG21 THR 35 42.741 13.033 -3.866 300 HB THR 35 HG22 THR 35 44.454 12.879 -2.121 301 HG1 THR 35 HG23 THR 35 46.020 11.597 -2.963 302 HG21 THR 35 HA THR 35 42.192 11.950 -1.710 303 HG22 THR 35 HB THR 35 43.464 11.125 -0.786 304 HG23 THR 35 HN THR 35 42.778 10.360 -2.237 305 H GLY 36 HN GLY 36 44.366 12.414 -6.544 306 HA2 GLY 36 HA2 GLY 36 45.803 13.616 -7.856 307 HA3 GLY 36 HA1 GLY 36 45.569 14.979 -6.763 308 H THR 37 HG1 THR 37 46.984 12.099 -5.357 309 HA THR 37 HG21 THR 37 49.220 13.699 -4.482 310 HB THR 37 HG22 THR 37 48.826 10.718 -4.062 311 HG1 THR 37 HG23 THR 37 48.139 11.696 -1.949 312 HG21 THR 37 HA THR 37 51.097 11.720 -3.442 313 HG22 THR 37 HB THR 37 50.204 11.035 -2.091 314 HG23 THR 37 HN THR 37 50.242 12.797 -2.327 315 H LYS 38 HN LYS 38 51.124 13.986 -5.455 316 HA LYS 38 HA LYS 38 51.847 12.590 -7.892 317 HB2 LYS 38 HB2 LYS 38 53.222 14.760 -6.266 318 HB3 LYS 38 HB1 LYS 38 53.917 14.067 -7.737 319 HG2 LYS 38 HG2 LYS 38 51.900 14.709 -9.026 320 HG3 LYS 38 HG1 LYS 38 51.236 15.501 -7.574 321 HD2 LYS 38 HD2 LYS 38 53.116 17.080 -7.537 322 HD3 LYS 38 HD1 LYS 38 53.941 16.195 -8.821 323 HE2 LYS 38 HE2 LYS 38 52.944 18.168 -9.777 324 HE3 LYS 38 HE1 LYS 38 52.151 16.728 -10.412 325 HZ1 LYS 38 HZ1 LYS 38 50.535 18.423 -9.816 326 HZ2 LYS 38 HZ2 LYS 38 51.068 18.478 -8.270 327 HZ3 LYS 38 HZ3 LYS 38 50.336 17.126 -8.825 328 H VAL 39 HG21 VAL 39 51.842 10.442 -6.848 329 HA VAL 39 HG22 VAL 39 54.625 9.679 -5.986 330 HB VAL 39 HG23 VAL 39 51.934 8.569 -5.224 331 HG11 VAL 39 HA VAL 39 53.114 6.812 -3.936 332 HG12 VAL 39 HB VAL 39 54.641 7.269 -4.715 333 HG13 VAL 39 HN VAL 39 53.289 6.584 -5.680 334 HG21 VAL 39 HG11 VAL 39 52.675 8.977 -2.946 335 HG22 VAL 39 HG12 VAL 39 52.876 10.463 -3.886 336 HG23 VAL 39 HG13 VAL 39 54.283 9.452 -3.505 337 H SER 40 HN SER 40 55.717 8.242 -7.216 338 HA SER 40 HA SER 40 54.542 7.529 -9.793 339 HB2 SER 40 HB2 SER 40 56.938 8.193 -9.576 340 HB3 SER 40 HB1 SER 40 57.236 6.684 -8.690 341 HG SER 40 HG SER 40 56.667 7.118 -11.383 342 H ILE 41 HD11 ILE 41 53.329 5.809 -10.176 343 HA ILE 41 HD12 ILE 41 52.958 3.509 -8.651 344 HB ILE 41 HD13 ILE 41 52.924 3.583 -11.680 345 HG12 ILE 41 HG12 ILE 41 51.640 5.505 -11.035 346 HG13 ILE 41 HG11 ILE 41 50.539 4.235 -11.516 347 HG21 ILE 41 HG21 ILE 41 51.360 1.906 -9.661 348 HG22 ILE 41 HG22 ILE 41 52.608 1.327 -10.775 349 HG23 ILE 41 HG23 ILE 41 51.066 1.931 -11.409 350 HD11 ILE 41 HA ILE 41 51.157 5.080 -8.635 351 HD12 ILE 41 HB ILE 41 50.055 3.760 -9.096 352 HD13 ILE 41 HN ILE 41 49.691 5.435 -9.560 353 H SER 42 HN SER 42 55.645 4.270 -10.797 354 HA SER 42 HA SER 42 56.769 1.593 -10.866 355 HB2 SER 42 HB2 SER 42 58.504 2.473 -12.113 356 HB3 SER 42 HB1 SER 42 57.126 3.475 -12.585 357 HG SER 42 HG SER 42 57.907 5.109 -11.198 358 H THR 43 HG1 THR 43 56.863 4.034 -8.378 359 HA THR 43 HG21 THR 43 59.335 2.820 -7.237 360 HB THR 43 HG22 THR 43 59.099 5.353 -7.395 361 HG1 THR 43 HG23 THR 43 60.185 5.411 -5.343 362 HG21 THR 43 HA THR 43 57.597 4.972 -4.756 363 HG22 THR 43 HB THR 43 56.910 5.697 -6.225 364 HG23 THR 43 HN THR 43 58.251 6.483 -5.410 365 H VAL 44 HG21 VAL 44 55.875 3.364 -6.385 366 HA VAL 44 HG22 VAL 44 56.007 2.004 -3.907 367 HB VAL 44 HG23 VAL 44 53.603 1.600 -4.091 368 HG11 VAL 44 HA VAL 44 52.916 3.945 -4.177 369 HG12 VAL 44 HB VAL 44 54.412 4.392 -5.006 370 HG13 VAL 44 HN VAL 44 54.462 3.799 -3.340 371 HG21 VAL 44 HG11 VAL 44 52.342 2.523 -6.054 372 HG22 VAL 44 HG12 VAL 44 53.321 1.110 -6.482 373 HG23 VAL 44 HG13 VAL 44 53.877 2.750 -6.894 374 H LYS 45 HN LYS 45 55.632 0.582 -7.175 375 HA LYS 45 HA LYS 45 55.283 -2.103 -6.333 376 HB2 LYS 45 HB2 LYS 45 55.622 -0.746 -8.785 377 HB3 LYS 45 HB1 LYS 45 56.955 -1.884 -8.745 378 HG2 LYS 45 HG2 LYS 45 54.014 -2.580 -8.357 379 HG3 LYS 45 HG1 LYS 45 54.911 -2.744 -9.865 380 HD2 LYS 45 HD2 LYS 45 56.420 -4.411 -8.770 381 HD3 LYS 45 HD1 LYS 45 55.433 -4.307 -7.291 382 HE2 LYS 45 HE2 LYS 45 53.428 -5.025 -8.551 383 HE3 LYS 45 HE1 LYS 45 54.376 -5.099 -10.039 384 HZ1 LYS 45 HZ1 LYS 45 55.714 -6.855 -9.043 385 HZ2 LYS 45 HZ2 LYS 45 54.131 -7.286 -9.024 386 HZ3 LYS 45 HZ3 LYS 45 54.855 -6.791 -7.646 387 H ARG 46 HN ARG 46 58.156 -0.182 -6.111 388 HA ARG 46 HA ARG 46 59.947 -2.516 -5.633 389 HB2 ARG 46 HB2 ARG 46 60.626 0.438 -5.406 390 HB3 ARG 46 HB1 ARG 46 61.737 -0.927 -5.505 391 HG2 ARG 46 HG2 ARG 46 60.966 -1.375 -7.852 392 HG3 ARG 46 HG1 ARG 46 59.855 0.001 -7.713 393 HD2 ARG 46 HD2 ARG 46 62.058 1.353 -7.100 394 HD3 ARG 46 HD1 ARG 46 62.863 0.015 -7.937 395 HE ARG 46 HE ARG 46 60.571 1.448 -9.217 396 HH11 ARG 46 HH11 ARG 46 60.833 2.521 -11.081 397 HH12 ARG 46 HH12 ARG 46 62.356 2.479 -11.924 398 HH21 ARG 46 HH21 ARG 46 64.005 0.710 -9.480 399 HH22 ARG 46 HH22 ARG 46 64.117 1.491 -11.025 400 H VAL 47 HG21 VAL 47 58.397 0.149 -3.830 401 HA VAL 47 HG22 VAL 47 59.464 -0.467 -1.243 402 HB VAL 47 HG23 VAL 47 56.754 0.705 -1.983 403 HG11 VAL 47 HA VAL 47 56.668 -0.092 0.342 404 HG12 VAL 47 HB VAL 47 56.778 1.667 0.315 405 HG13 VAL 47 HN VAL 47 58.216 0.706 0.686 406 HG21 VAL 47 HG11 VAL 47 59.359 2.053 -1.163 407 HG22 VAL 47 HG12 VAL 47 57.821 2.875 -1.464 408 HG23 VAL 47 HG13 VAL 47 58.666 2.070 -2.787 409 H LEU 48 HD12 LEU 48 56.474 -1.677 -2.839 410 HA LEU 48 HD13 LEU 48 55.588 -3.536 -0.926 411 HB2 LEU 48 HD22 LEU 48 55.663 -3.733 -3.968 412 HB3 LEU 48 HD21 LEU 48 54.764 -4.836 -2.940 413 HG LEU 48 HD23 LEU 48 54.220 -1.851 -3.122 414 HD11 LEU 48 HA LEU 48 52.236 -2.470 -4.391 415 HD12 LEU 48 HB1 LEU 48 52.657 -4.193 -4.288 416 HD13 LEU 48 HN LEU 48 53.676 -3.072 -5.228 417 HD21 LEU 48 HB2 LEU 48 52.085 -2.437 -2.030 418 HD22 LEU 48 HD11 LEU 48 52.688 -4.083 -1.767 419 HD23 LEU 48 HG LEU 48 53.492 -2.704 -0.983 420 H TYR 49 HN TYR 49 58.044 -4.091 -3.480 421 HA TYR 49 HA TYR 49 58.595 -6.791 -2.725 422 HB2 TYR 49 HB2 TYR 49 58.993 -5.756 -4.961 423 HB3 TYR 49 HB1 TYR 49 60.314 -4.819 -4.284 424 HD1 TYR 49 HD1 TYR 49 59.099 -8.327 -4.841 425 HD2 TYR 49 HD2 TYR 49 62.509 -5.772 -4.179 426 HE1 TYR 49 HE1 TYR 49 60.624 -10.212 -5.388 427 HE2 TYR 49 HE2 TYR 49 64.034 -7.667 -4.725 428 HH TYR 49 HH TYR 49 64.166 -9.883 -5.384 429 H ARG 50 HN ARG 50 60.270 -3.717 -1.795 430 HA ARG 50 HA ARG 50 62.315 -5.092 -0.251 431 HB2 ARG 50 HB2 ARG 50 61.324 -2.228 0.059 432 HB3 ARG 50 HB1 ARG 50 62.736 -2.932 0.852 433 HG2 ARG 50 HG2 ARG 50 63.352 -3.526 -1.738 434 HG3 ARG 50 HG1 ARG 50 62.408 -2.059 -1.989 435 HD2 ARG 50 HD2 ARG 50 64.920 -2.396 -0.311 436 HD3 ARG 50 HD1 ARG 50 64.763 -1.534 -1.843 437 HE ARG 50 HE ARG 50 63.278 -0.594 0.596 438 HH11 ARG 50 HH11 ARG 50 63.887 1.366 1.546 439 HH12 ARG 50 HH12 ARG 50 65.107 2.304 0.834 440 HH21 ARG 50 HH21 ARG 50 65.763 0.160 -1.768 441 HH22 ARG 50 HH22 ARG 50 66.078 1.713 -1.039 442 H HIS 51 HN HIS 51 59.048 -3.979 0.683 443 HA HIS 51 HA HIS 51 59.386 -4.753 3.445 444 HB2 HIS 51 HB2 HIS 51 57.548 -3.286 2.638 445 HB3 HIS 51 HB1 HIS 51 56.812 -4.677 1.827 446 HD1 HIS 51 HD1 HIS 51 55.714 -6.579 3.545 447 HD2 HIS 51 HD2 HIS 51 57.114 -3.001 5.234 448 HE1 HIS 51 HE1 HIS 51 54.788 -6.491 5.925 449 H ASN 52 HB1 ASN 52 58.063 -6.523 0.591 450 HA ASN 52 HB2 ASN 52 57.390 -8.900 1.958 451 HB2 ASN 52 HD22 ASN 52 56.617 -8.205 -0.297 452 HB3 ASN 52 HD21 ASN 52 58.245 -8.452 -0.946 453 HD21 ASN 52 HA ASN 52 55.673 -10.423 0.862 454 HD22 ASN 52 HN ASN 52 55.999 -11.795 -0.186 455 H LEU 53 HD12 LEU 53 60.491 -8.135 0.269 456 HA LEU 53 HD13 LEU 53 61.541 -10.777 1.001 457 HB2 LEU 53 HD22 LEU 53 61.809 -9.821 -1.254 458 HB3 LEU 53 HD21 LEU 53 62.702 -8.461 -0.591 459 HG LEU 53 HD23 LEU 53 64.539 -9.968 0.103 460 HD11 LEU 53 HA LEU 53 64.589 -12.312 -0.725 461 HD12 LEU 53 HB1 LEU 53 62.895 -12.158 -1.241 462 HD13 LEU 53 HN LEU 53 63.330 -12.084 0.486 463 HD21 LEU 53 HB2 LEU 53 64.537 -8.920 -2.139 464 HD22 LEU 53 HD11 LEU 53 65.368 -10.496 -2.118 465 HD23 LEU 53 HG LEU 53 63.724 -10.371 -2.784 466 H LYS 54 HN LYS 54 62.000 -7.479 2.223 467 HA LYS 54 HA LYS 54 64.109 -8.525 4.038 468 HB2 LYS 54 HB2 LYS 54 65.037 -7.644 1.887 469 HB3 LYS 54 HB1 LYS 54 64.419 -6.044 2.295 470 HG2 LYS 54 HG2 LYS 54 66.880 -6.451 2.662 471 HG3 LYS 54 HG1 LYS 54 66.025 -5.797 4.054 472 HD2 LYS 54 HD2 LYS 54 66.031 -7.995 5.147 473 HD3 LYS 54 HD1 LYS 54 66.645 -8.768 3.686 474 HE2 LYS 54 HE2 LYS 54 68.400 -8.491 5.384 475 HE3 LYS 54 HE1 LYS 54 68.773 -7.622 3.898 476 HZ1 LYS 54 HZ1 LYS 54 67.620 -6.374 6.327 477 HZ2 LYS 54 HZ2 LYS 54 68.063 -5.586 4.959 478 HZ3 LYS 54 HZ3 LYS 54 69.207 -6.290 5.895 479 H GLY 55 HN GLY 55 61.248 -7.120 4.242 480 HA2 GLY 55 HA2 GLY 55 60.168 -6.188 6.057 481 HA3 GLY 55 HA1 GLY 55 61.431 -7.042 6.951 482 H ARG 56 HN ARG 56 61.642 -4.038 4.942 483 HA ARG 56 HA ARG 56 62.101 -2.449 7.381 484 HB2 ARG 56 HB2 ARG 56 64.268 -3.616 6.565 485 HB3 ARG 56 HB1 ARG 56 64.223 -2.515 5.204 486 HG2 ARG 56 HG2 ARG 56 65.742 -1.777 6.988 487 HG3 ARG 56 HG1 ARG 56 64.476 -0.598 6.707 488 HD2 ARG 56 HD2 ARG 56 65.014 -0.939 9.110 489 HD3 ARG 56 HD1 ARG 56 63.329 -1.207 8.731 490 HE ARG 56 HE ARG 56 63.686 -3.620 8.900 491 HH11 ARG 56 HH11 ARG 56 66.338 -1.716 10.233 492 HH12 ARG 56 HH12 ARG 56 66.770 -2.947 11.371 493 HH21 ARG 56 HH21 ARG 56 64.279 -5.125 10.403 494 HH22 ARG 56 HH22 ARG 56 65.640 -4.841 11.455 495 H SER 57 HN SER 57 61.111 -0.652 7.293 496 HA SER 57 HA SER 57 61.544 1.232 5.084 497 HB2 SER 57 HB2 SER 57 59.127 0.358 4.856 498 HB3 SER 57 HB1 SER 57 58.804 1.108 6.435 499 HG SER 57 HG SER 57 58.484 2.860 5.191 500 H ALA 58 HN ALA 58 63.240 1.931 6.536 501 HA ALA 58 HA ALA 58 62.820 1.532 9.326 502 HB1 ALA 58 HB1 ALA 58 64.950 1.067 8.376 503 HB2 ALA 58 HB2 ALA 58 65.216 2.518 9.365 504 HB3 ALA 58 HB3 ALA 58 64.983 2.622 7.608 505 H ARG 59 HN ARG 59 63.826 4.658 7.813 506 HA ARG 59 HA ARG 59 62.130 6.092 9.827 507 HB2 ARG 59 HB2 ARG 59 65.080 6.699 9.339 508 HB3 ARG 59 HB1 ARG 59 63.984 7.557 10.424 509 HG2 ARG 59 HG2 ARG 59 63.640 5.260 11.599 510 HG3 ARG 59 HG1 ARG 59 65.110 4.768 10.733 511 HD2 ARG 59 HD2 ARG 59 66.250 6.813 11.740 512 HD3 ARG 59 HD1 ARG 59 64.809 7.074 12.714 513 HE ARG 59 HE ARG 59 66.890 5.069 13.032 514 HH11 ARG 59 HH11 ARG 59 66.910 4.024 15.044 515 HH12 ARG 59 HH12 ARG 59 65.425 3.746 15.913 516 HH21 ARG 59 HH21 ARG 59 63.497 5.405 13.611 517 HH22 ARG 59 HH22 ARG 59 63.503 4.503 15.124 518 H LYS 60 HN LYS 60 61.567 5.736 7.139 519 HA LYS 60 HA LYS 60 60.788 6.796 5.253 520 HB2 LYS 60 HB2 LYS 60 61.989 9.454 5.894 521 HB3 LYS 60 HB1 LYS 60 60.579 9.099 4.943 522 HG2 LYS 60 HG2 LYS 60 59.144 9.254 6.745 523 HG3 LYS 60 HG1 LYS 60 60.290 8.588 7.901 524 HD2 LYS 60 HD2 LYS 60 61.680 10.672 7.676 525 HD3 LYS 60 HD1 LYS 60 60.386 11.387 6.692 526 HE2 LYS 60 HE2 LYS 60 58.851 11.282 8.593 527 HE3 LYS 60 HE1 LYS 60 60.023 10.327 9.527 528 HZ1 LYS 60 HZ1 LYS 60 60.492 13.112 8.615 529 HZ2 LYS 60 HZ2 LYS 60 61.533 12.209 9.479 530 HZ3 LYS 60 HZ3 LYS 60 60.122 12.682 10.164 531 H LEU 61 HD12 LEU 61 63.884 8.019 6.368 532 HA LEU 61 HD13 LEU 61 65.300 7.209 3.890 533 HB2 LEU 61 HD22 LEU 61 66.387 8.303 6.521 534 HB3 LEU 61 HD21 LEU 61 67.254 8.149 4.992 535 HG LEU 61 HD23 LEU 61 64.960 10.079 5.576 536 HD11 LEU 61 HA LEU 61 66.648 11.821 5.326 537 HD12 LEU 61 HB1 LEU 61 67.909 10.605 5.026 538 HD13 LEU 61 HN LEU 61 67.112 10.698 6.613 539 HD21 LEU 61 HB2 LEU 61 66.608 9.759 3.020 540 HD22 LEU 61 HD11 LEU 61 64.877 9.397 3.201 541 HD23 LEU 61 HG LEU 61 65.448 11.063 3.359 542 H GLU 62 HN GLU 62 67.439 5.940 4.764 543 HA GLU 62 HA GLU 62 68.271 3.891 5.251 544 HB2 GLU 62 HB2 GLU 62 66.381 4.044 7.578 545 HB3 GLU 62 HB1 GLU 62 67.642 2.828 7.418 546 HG2 GLU 62 HG2 GLU 62 69.306 4.465 7.918 547 HG3 GLU 62 HG1 GLU 62 68.211 5.804 7.557 Start of MODEL 4 1 H1 ALA 1 HT1 ALA 1 43.493 12.677 12.930 2 H2 ALA 1 HT2 ALA 1 43.857 11.217 12.142 3 H3 ALA 1 HT3 ALA 1 43.570 12.623 11.234 4 HA ALA 1 HA ALA 1 45.546 13.663 12.134 5 HB1 ALA 1 HB1 ALA 1 45.364 12.528 14.349 6 HB2 ALA 1 HB2 ALA 1 45.880 10.976 13.606 7 HB3 ALA 1 HB3 ALA 1 47.028 12.365 13.692 8 H SER 2 HN SER 2 44.730 11.042 10.174 9 HA SER 2 HA SER 2 47.304 11.220 8.838 10 HB2 SER 2 HB1 SER 2 47.056 8.780 8.184 11 HB3 SER 2 HB2 SER 2 47.314 8.960 9.948 12 HG SER 2 HG SER 2 45.571 7.508 9.205 13 H MET 3 HN MET 3 47.174 11.435 6.600 14 HA MET 3 HA MET 3 44.528 11.334 5.401 15 HB2 MET 3 HB1 MET 3 46.474 13.710 5.371 16 HB3 MET 3 HB2 MET 3 45.127 13.567 4.213 17 HG2 MET 3 HG1 MET 3 43.466 13.664 6.147 18 HG3 MET 3 HG2 MET 3 44.829 13.710 7.312 19 HE1 MET 3 HE1 MET 3 43.500 17.040 4.342 20 HE2 MET 3 HE2 MET 3 44.187 15.468 3.805 21 HE3 MET 3 HE3 MET 3 42.615 15.513 4.678 22 H VAL 4 HN VAL 4 44.554 10.757 3.225 23 HA VAL 4 HA VAL 4 46.952 9.624 2.237 24 HB VAL 4 HB VAL 4 45.621 8.991 0.280 25 HG11 VAL 4 HG11 VAL 4 44.086 7.442 1.639 26 HG12 VAL 4 HG12 VAL 4 45.739 7.505 2.320 27 HG13 VAL 4 HG13 VAL 4 44.407 8.436 3.102 28 HG21 VAL 4 HG21 VAL 4 43.104 9.354 0.377 29 HG22 VAL 4 HG22 VAL 4 43.332 10.458 1.782 30 HG23 VAL 4 HG23 VAL 4 43.998 10.893 0.168 31 H LEU 5 HN LEU 5 45.328 12.722 1.760 32 HA LEU 5 HA LEU 5 46.490 13.469 -0.650 33 HB2 LEU 5 HB1 LEU 5 44.477 14.519 0.372 34 HB3 LEU 5 HB2 LEU 5 45.432 15.077 1.766 35 HG LEU 5 HG LEU 5 46.772 16.546 0.204 36 HD11 LEU 5 HD11 LEU 5 45.774 17.040 -2.106 37 HD12 LEU 5 HD12 LEU 5 46.416 15.363 -1.967 38 HD13 LEU 5 HD13 LEU 5 44.640 15.660 -1.882 39 HD21 LEU 5 HD21 LEU 5 44.958 18.274 -0.095 40 HD22 LEU 5 HD22 LEU 5 43.707 17.031 0.230 41 HD23 LEU 5 HD23 LEU 5 44.884 17.474 1.517 42 H SER 6 HN SER 6 47.593 13.896 2.723 43 HA SER 6 HA SER 6 49.678 15.668 2.126 44 HB2 SER 6 HB1 SER 6 49.132 13.831 4.556 45 HB3 SER 6 HB2 SER 6 50.377 15.120 4.582 46 HG SER 6 HG SER 6 48.194 15.639 5.446 47 HA PRO 7 HA PRO 7 52.932 12.905 0.962 48 HB2 PRO 7 HB2 PRO 7 55.245 14.043 1.867 49 HB3 PRO 7 HB1 PRO 7 54.196 14.848 0.633 50 HG2 PRO 7 HG2 PRO 7 54.170 15.395 3.636 51 HG3 PRO 7 HG1 PRO 7 54.304 16.593 2.281 52 HD2 PRO 7 HD2 PRO 7 51.865 15.954 3.422 53 HD3 PRO 7 HD1 PRO 7 52.042 16.393 1.654 54 H ARG 8 HN ARG 8 52.149 13.322 4.212 55 HA ARG 8 HA ARG 8 53.731 11.404 5.539 56 HB2 ARG 8 HB1 ARG 8 52.182 13.202 6.519 57 HB3 ARG 8 HB2 ARG 8 50.795 12.170 6.098 58 HG2 ARG 8 HG1 ARG 8 51.205 11.723 8.414 59 HG3 ARG 8 HG2 ARG 8 51.919 10.324 7.590 60 HD2 ARG 8 HD1 ARG 8 54.212 11.360 7.633 61 HD3 ARG 8 HD2 ARG 8 53.572 12.774 8.567 62 HE ARG 8 HE ARG 8 52.697 10.489 9.921 63 HH11 ARG 8 HH11 ARG 8 55.682 10.071 11.949 64 HH12 ARG 8 HH12 ARG 8 54.004 9.636 11.727 65 HH21 ARG 8 HH21 ARG 8 56.659 11.579 10.377 66 HH22 ARG 8 HH22 ARG 8 55.683 12.143 9.063 67 H ASP 9 HN ASP 9 51.492 10.893 2.954 68 HA ASP 9 HA ASP 9 49.925 8.842 3.897 69 HB2 ASP 9 HB1 ASP 9 49.323 8.500 1.468 70 HB3 ASP 9 HB2 ASP 9 49.322 10.249 1.882 71 H GLU 10 HN GLU 10 53.241 8.661 2.790 72 HA GLU 10 HA GLU 10 53.446 5.975 2.136 73 HB2 GLU 10 HB1 GLU 10 55.229 7.710 1.802 74 HB3 GLU 10 HB2 GLU 10 55.428 7.862 3.562 75 HG2 GLU 10 HG1 GLU 10 56.240 5.482 3.692 76 HG3 GLU 10 HG2 GLU 10 56.004 5.280 1.915 77 H ARG 11 HN ARG 11 53.373 7.573 5.337 78 HA ARG 11 HA ARG 11 54.066 5.349 6.928 79 HB2 ARG 11 HB1 ARG 11 54.031 7.797 7.587 80 HB3 ARG 11 HB2 ARG 11 52.254 7.810 7.492 81 HG2 ARG 11 HG1 ARG 11 53.867 6.073 9.466 82 HG3 ARG 11 HG2 ARG 11 53.356 7.732 9.833 83 HD2 ARG 11 HD1 ARG 11 50.903 6.863 9.143 84 HD3 ARG 11 HD2 ARG 11 51.578 5.255 9.633 85 HE ARG 11 HE ARG 11 51.827 5.950 11.807 86 HH11 ARG 11 HH11 ARG 11 50.456 8.937 13.298 87 HH12 ARG 11 HH12 ARG 11 51.019 7.305 13.563 88 HH21 ARG 11 HH21 ARG 11 50.377 9.742 11.061 89 HH22 ARG 11 HH22 ARG 11 50.916 8.701 9.788 90 H THR 12 HN THR 12 50.850 6.567 5.855 91 HA THR 12 HA THR 12 49.333 4.541 7.016 92 HB THR 12 HB THR 12 48.867 6.238 4.524 93 HG1 THR 12 HG1 THR 12 47.556 7.443 5.966 94 HG21 THR 12 HG21 THR 12 46.388 5.747 4.828 95 HG22 THR 12 HG22 THR 12 47.262 4.181 4.716 96 HG23 THR 12 HG23 THR 12 46.724 4.798 6.320 97 H LEU 13 HN LEU 13 50.877 4.747 3.758 98 HA LEU 13 HA LEU 13 49.630 2.498 2.690 99 HB2 LEU 13 HB1 LEU 13 50.879 4.432 1.518 100 HB3 LEU 13 HB2 LEU 13 52.411 3.709 2.061 101 HG LEU 13 HG LEU 13 50.362 2.356 0.283 102 HD11 LEU 13 HD11 LEU 13 51.991 3.021 -1.657 103 HD12 LEU 13 HD12 LEU 13 51.163 4.408 -0.859 104 HD13 LEU 13 HD13 LEU 13 52.881 4.034 -0.465 105 HD21 LEU 13 HD21 LEU 13 52.222 0.888 -0.593 106 HD22 LEU 13 HD22 LEU 13 53.353 1.594 0.605 107 HD23 LEU 13 HD23 LEU 13 51.927 0.651 1.167 108 H VAL 14 HN VAL 14 52.777 2.861 4.441 109 HA VAL 14 HA VAL 14 53.594 0.212 4.215 110 HB VAL 14 HB VAL 14 54.262 2.388 6.199 111 HG11 VAL 14 HG11 VAL 14 56.300 0.979 6.759 112 HG12 VAL 14 HG12 VAL 14 54.783 0.186 7.279 113 HG13 VAL 14 HG13 VAL 14 55.626 -0.374 5.785 114 HG21 VAL 14 HG21 VAL 14 56.398 2.430 4.734 115 HG22 VAL 14 HG22 VAL 14 55.664 1.165 3.680 116 HG23 VAL 14 HG23 VAL 14 54.927 2.805 3.782 117 H ARG 15 HN ARG 15 51.663 1.821 6.873 118 HA ARG 15 HA ARG 15 51.347 -0.527 8.382 119 HB2 ARG 15 HB1 ARG 15 50.889 1.706 9.261 120 HB3 ARG 15 HB2 ARG 15 49.539 1.940 8.123 121 HG2 ARG 15 HG1 ARG 15 48.293 0.027 9.228 122 HG3 ARG 15 HG2 ARG 15 49.681 -0.304 10.281 123 HD2 ARG 15 HD1 ARG 15 48.057 0.896 11.620 124 HD3 ARG 15 HD2 ARG 15 49.455 2.015 11.354 125 HE ARG 15 HE ARG 15 46.855 2.134 9.889 126 HH11 ARG 15 HH11 ARG 15 47.327 5.684 9.584 127 HH12 ARG 15 HH12 ARG 15 46.284 4.317 9.276 128 HH21 ARG 15 HH21 ARG 15 49.440 5.261 10.612 129 HH22 ARG 15 HH22 ARG 15 49.833 3.632 11.047 130 H LYS 16 HN LYS 16 49.290 0.738 5.648 131 HA LYS 16 HA LYS 16 47.293 -1.162 5.917 132 HB2 LYS 16 HB1 LYS 16 48.375 0.436 3.533 133 HB3 LYS 16 HB2 LYS 16 46.996 -0.672 3.317 134 HG2 LYS 16 HG1 LYS 16 46.987 1.636 5.375 135 HG3 LYS 16 HG2 LYS 16 46.487 1.865 3.667 136 HD2 LYS 16 HD1 LYS 16 44.770 -0.010 4.010 137 HD3 LYS 16 HD2 LYS 16 45.243 -0.059 5.742 138 HE2 LYS 16 HE1 LYS 16 44.527 2.342 6.027 139 HE3 LYS 16 HE2 LYS 16 44.071 2.419 4.283 140 HZ1 LYS 16 HZ1 LYS 16 42.175 1.947 5.692 141 HZ2 LYS 16 HZ2 LYS 16 42.498 0.628 4.672 142 HZ3 LYS 16 HZ3 LYS 16 42.928 0.557 6.311 143 H VAL 17 HN VAL 17 50.375 -1.419 3.900 144 HA VAL 17 HA VAL 17 49.429 -3.713 2.604 145 HB VAL 17 HB VAL 17 51.689 -4.071 1.807 146 HG11 VAL 17 HG11 VAL 17 51.713 -1.848 0.510 147 HG12 VAL 17 HG12 VAL 17 50.070 -2.551 0.602 148 HG13 VAL 17 HG13 VAL 17 50.524 -1.176 1.680 149 HG21 VAL 17 HG21 VAL 17 53.449 -2.327 2.276 150 HG22 VAL 17 HG22 VAL 17 52.401 -1.637 3.568 151 HG23 VAL 17 HG23 VAL 17 53.047 -3.310 3.719 152 H GLN 18 HN GLN 18 51.226 -3.355 5.729 153 HA GLN 18 HA GLN 18 51.723 -6.090 6.007 154 HB2 GLN 18 HB1 GLN 18 51.286 -3.802 7.986 155 HB3 GLN 18 HB2 GLN 18 51.735 -5.434 8.544 156 HG2 GLN 18 HG1 GLN 18 53.901 -5.312 7.212 157 HG3 GLN 18 HG2 GLN 18 53.417 -3.722 6.532 158 HE21 GLN 18 HE21 GLN 18 54.700 -1.951 9.272 159 HE22 GLN 18 HE22 GLN 18 54.089 -1.937 7.632 160 H ILE 19 HN ILE 19 48.858 -4.081 7.001 161 HA ILE 19 HA ILE 19 47.523 -6.197 8.257 162 HB ILE 19 HB ILE 19 46.691 -3.536 7.109 163 HG12 ILE 19 HG11 ILE 19 47.009 -4.444 10.049 164 HG13 ILE 19 HG12 ILE 19 48.225 -3.547 9.085 165 HG21 ILE 19 HG21 ILE 19 44.446 -3.796 8.283 166 HG22 ILE 19 HG22 ILE 19 44.665 -5.198 7.189 167 HG23 ILE 19 HG23 ILE 19 44.940 -5.386 8.960 168 HD11 ILE 19 HD11 ILE 19 46.994 -1.984 10.544 169 HD12 ILE 19 HD12 ILE 19 46.600 -1.628 8.824 170 HD13 ILE 19 HD13 ILE 19 45.417 -2.509 9.861 171 H ASN 20 HN ASN 20 47.332 -4.928 4.864 172 HA ASN 20 HA ASN 20 45.708 -7.249 4.261 173 HB2 ASN 20 HB1 ASN 20 44.439 -5.751 2.602 174 HB3 ASN 20 HB2 ASN 20 44.050 -5.581 4.342 175 HD21 ASN 20 HD21 ASN 20 45.978 -2.454 2.410 176 HD22 ASN 20 HD22 ASN 20 46.324 -4.082 1.878 177 HA PRO 21 HA PRO 21 49.547 -7.000 1.793 178 HB2 PRO 21 HB2 PRO 21 50.378 -9.610 1.863 179 HB3 PRO 21 HB1 PRO 21 50.463 -8.513 3.299 180 HG2 PRO 21 HG2 PRO 21 48.234 -10.511 2.685 181 HG3 PRO 21 HG1 PRO 21 49.173 -10.321 4.225 182 HD2 PRO 21 HD2 PRO 21 46.754 -9.035 3.852 183 HD3 PRO 21 HD1 PRO 21 48.113 -8.324 4.850 184 H ARG 22 HN ARG 22 46.623 -8.643 0.890 185 HA ARG 22 HA ARG 22 47.433 -9.683 -1.607 186 HB2 ARG 22 HB1 ARG 22 45.087 -9.734 -2.217 187 HB3 ARG 22 HB2 ARG 22 45.319 -10.428 -0.594 188 HG2 ARG 22 HG1 ARG 22 44.407 -7.514 -1.047 189 HG3 ARG 22 HG2 ARG 22 43.253 -8.861 -1.069 190 HD2 ARG 22 HD1 ARG 22 43.833 -9.538 1.249 191 HD3 ARG 22 HD2 ARG 22 45.012 -8.170 1.386 192 HE ARG 22 HE ARG 22 42.861 -6.828 0.521 193 HH11 ARG 22 HH11 ARG 22 40.770 -6.658 3.437 194 HH12 ARG 22 HH12 ARG 22 41.373 -5.823 2.025 195 HH21 ARG 22 HH21 ARG 22 41.690 -8.801 3.940 196 HH22 ARG 22 HH22 ARG 22 42.881 -9.460 2.871 197 H THR 23 HN THR 23 47.143 -6.433 -0.577 198 HA THR 23 HA THR 23 46.159 -5.203 -2.856 199 HB THR 23 HB THR 23 48.015 -4.249 -0.639 200 HG1 THR 23 HG1 THR 23 46.054 -3.347 0.143 201 HG21 THR 23 HG21 THR 23 47.287 -1.885 -1.193 202 HG22 THR 23 HG22 THR 23 47.961 -2.621 -2.685 203 HG23 THR 23 HG23 THR 23 46.177 -2.485 -2.477 204 H THR 24 HN THR 24 46.970 -4.506 -4.754 205 HA THR 24 HA THR 24 49.832 -4.945 -5.249 206 HB THR 24 HB THR 24 47.415 -5.421 -7.066 207 HG1 THR 24 HG1 THR 24 48.128 -7.597 -6.970 208 HG21 THR 24 HG21 THR 24 49.061 -6.430 -8.732 209 HG22 THR 24 HG22 THR 24 49.647 -4.783 -8.322 210 HG23 THR 24 HG23 THR 24 50.421 -6.225 -7.571 211 H ALA 25 HN ALA 25 50.564 -3.547 -7.224 212 HA ALA 25 HA ALA 25 50.231 -0.867 -6.509 213 HB1 ALA 25 HB1 ALA 25 52.258 -1.829 -7.586 214 HB2 ALA 25 HB2 ALA 25 51.339 -2.071 -9.112 215 HB3 ALA 25 HB3 ALA 25 51.655 -0.402 -8.498 216 H LYS 26 HN LYS 26 48.320 -2.752 -8.767 217 HA LYS 26 HA LYS 26 47.044 -0.732 -10.170 218 HB2 LYS 26 HB1 LYS 26 46.874 -3.182 -10.645 219 HB3 LYS 26 HB2 LYS 26 46.015 -3.444 -9.104 220 HG2 LYS 26 HG1 LYS 26 44.093 -2.020 -9.943 221 HG3 LYS 26 HG2 LYS 26 44.989 -1.702 -11.464 222 HD2 LYS 26 HD1 LYS 26 44.890 -4.098 -12.068 223 HD3 LYS 26 HD2 LYS 26 44.189 -4.512 -10.468 224 HE2 LYS 26 HE1 LYS 26 42.100 -3.264 -10.988 225 HE3 LYS 26 HE2 LYS 26 42.803 -2.655 -12.534 226 HZ1 LYS 26 HZ1 LYS 26 41.390 -4.577 -12.881 227 HZ2 LYS 26 HZ2 LYS 26 42.998 -4.945 -13.283 228 HZ3 LYS 26 HZ3 LYS 26 42.337 -5.515 -11.829 229 H ASP 27 HN ASP 27 46.289 -2.032 -6.825 230 HA ASP 27 HA ASP 27 44.029 -0.438 -6.467 231 HB2 ASP 27 HB1 ASP 27 46.096 -1.657 -4.509 232 HB3 ASP 27 HB2 ASP 27 44.546 -0.931 -3.962 233 H LEU 28 HN LEU 28 47.531 0.146 -5.841 234 HA LEU 28 HA LEU 28 47.195 2.499 -4.409 235 HB2 LEU 28 HB1 LEU 28 49.501 1.346 -6.043 236 HB3 LEU 28 HB2 LEU 28 49.653 2.959 -5.306 237 HG LEU 28 HG LEU 28 50.742 1.225 -4.055 238 HD11 LEU 28 HD11 LEU 28 49.677 1.696 -1.728 239 HD12 LEU 28 HD12 LEU 28 49.938 3.153 -2.754 240 HD13 LEU 28 HD13 LEU 28 48.290 2.445 -2.595 241 HD21 LEU 28 HD21 LEU 28 49.524 -0.518 -2.668 242 HD22 LEU 28 HD22 LEU 28 48.001 -0.125 -3.527 243 HD23 LEU 28 HD23 LEU 28 49.396 -0.801 -4.442 244 H VAL 29 HN VAL 29 47.706 2.036 -8.049 245 HA VAL 29 HA VAL 29 47.814 4.776 -8.535 246 HB VAL 29 HB VAL 29 48.632 3.155 -10.111 247 HG11 VAL 29 HG11 VAL 29 47.035 2.044 -11.710 248 HG12 VAL 29 HG12 VAL 29 46.876 1.387 -10.054 249 HG13 VAL 29 HG13 VAL 29 45.650 2.552 -10.683 250 HG21 VAL 29 HG21 VAL 29 47.733 4.361 -12.152 251 HG22 VAL 29 HG22 VAL 29 46.468 5.118 -11.117 252 HG23 VAL 29 HG23 VAL 29 48.210 5.473 -10.830 253 H LYS 30 HN LYS 30 44.919 2.561 -8.303 254 HA LYS 30 HA LYS 30 43.080 4.482 -9.107 255 HB2 LYS 30 HB1 LYS 30 42.931 2.064 -7.229 256 HB3 LYS 30 HB2 LYS 30 41.473 3.015 -7.614 257 HG2 LYS 30 HG1 LYS 30 41.706 2.438 -10.044 258 HG3 LYS 30 HG2 LYS 30 43.278 1.629 -9.729 259 HD2 LYS 30 HD1 LYS 30 41.415 -0.008 -10.023 260 HD3 LYS 30 HD2 LYS 30 42.151 -0.120 -8.388 261 HE2 LYS 30 HE1 LYS 30 40.228 1.122 -7.393 262 HE3 LYS 30 HE2 LYS 30 39.496 1.340 -9.029 263 HZ1 LYS 30 HZ1 LYS 30 38.555 -0.547 -7.862 264 HZ2 LYS 30 HZ2 LYS 30 39.396 -1.065 -9.244 265 HZ3 LYS 30 HZ3 LYS 30 40.084 -1.267 -7.708 266 H MET 31 HN MET 31 44.274 3.755 -5.677 267 HA MET 31 HA MET 31 42.585 5.690 -4.573 268 HB2 MET 31 HB1 MET 31 45.228 4.464 -3.626 269 HB3 MET 31 HB2 MET 31 44.274 5.561 -2.594 270 HG2 MET 31 HG1 MET 31 42.282 3.871 -2.835 271 HG3 MET 31 HG2 MET 31 43.413 2.777 -3.698 272 HE1 MET 31 HE1 MET 31 46.102 2.092 -0.795 273 HE2 MET 31 HE2 MET 31 45.730 1.870 -2.538 274 HE3 MET 31 HE3 MET 31 46.138 3.502 -1.907 275 H LEU 32 HN LEU 32 46.043 5.887 -5.662 276 HA LEU 32 HA LEU 32 46.452 8.449 -4.642 277 HB2 LEU 32 HB1 LEU 32 47.848 6.758 -6.779 278 HB3 LEU 32 HB2 LEU 32 48.483 8.351 -6.303 279 HG LEU 32 HG LEU 32 47.933 6.072 -4.299 280 HD11 LEU 32 HD11 LEU 32 50.457 5.588 -4.402 281 HD12 LEU 32 HD12 LEU 32 49.603 5.215 -5.945 282 HD13 LEU 32 HD13 LEU 32 50.585 6.720 -5.795 283 HD21 LEU 32 HD21 LEU 32 49.573 7.289 -2.823 284 HD22 LEU 32 HD22 LEU 32 49.749 8.577 -4.057 285 HD23 LEU 32 HD23 LEU 32 48.158 8.316 -3.257 286 H GLU 33 HN GLU 33 45.527 7.356 -8.012 287 HA GLU 33 HA GLU 33 45.752 9.916 -9.127 288 HB2 GLU 33 HB1 GLU 33 45.859 7.786 -10.414 289 HB3 GLU 33 HB2 GLU 33 44.144 7.476 -10.060 290 HG2 GLU 33 HG1 GLU 33 43.475 9.529 -11.338 291 HG3 GLU 33 HG2 GLU 33 45.205 9.946 -11.640 292 H GLU 34 HN GLU 34 42.866 8.143 -7.750 293 HA GLU 34 HA GLU 34 41.024 10.162 -8.290 294 HB2 GLU 34 HB1 GLU 34 41.147 7.960 -6.171 295 HB3 GLU 34 HB2 GLU 34 39.747 9.047 -6.307 296 HG2 GLU 34 HG1 GLU 34 40.772 7.292 -8.648 297 HG3 GLU 34 HG2 GLU 34 39.467 6.772 -7.516 298 H THR 35 HN THR 35 43.142 9.644 -5.362 299 HA THR 35 HA THR 35 42.133 11.841 -3.972 300 HB THR 35 HB THR 35 44.895 10.564 -3.934 301 HG1 THR 35 HG1 THR 35 44.078 9.568 -2.047 302 HG21 THR 35 HG21 THR 35 45.131 11.616 -1.610 303 HG22 THR 35 HG22 THR 35 44.739 12.926 -2.774 304 HG23 THR 35 HG23 THR 35 43.455 12.263 -1.700 305 H GLY 36 HN GLY 36 44.800 11.605 -6.380 306 HA2 GLY 36 HA2 GLY 36 45.493 13.329 -7.714 307 HA3 GLY 36 HA1 GLY 36 44.800 14.510 -6.521 308 H THR 37 HN THR 37 46.897 11.803 -5.477 309 HA THR 37 HA THR 37 48.747 13.854 -4.535 310 HB THR 37 HB THR 37 48.501 10.887 -3.838 311 HG1 THR 37 HG1 THR 37 47.711 11.668 -1.846 312 HG21 THR 37 HG21 THR 37 50.020 11.497 -1.843 313 HG22 THR 37 HG22 THR 37 50.822 12.100 -3.333 314 HG23 THR 37 HG23 THR 37 49.925 13.243 -2.270 315 H LYS 38 HN LYS 38 50.870 13.986 -5.292 316 HA LYS 38 HA LYS 38 51.258 12.541 -7.741 317 HB2 LYS 38 HB1 LYS 38 52.854 14.748 -6.338 318 HB3 LYS 38 HB2 LYS 38 53.310 14.088 -7.930 319 HG2 LYS 38 HG1 LYS 38 50.601 15.475 -7.294 320 HG3 LYS 38 HG2 LYS 38 52.022 16.314 -8.001 321 HD2 LYS 38 HD1 LYS 38 51.913 14.680 -9.962 322 HD3 LYS 38 HD2 LYS 38 50.426 13.978 -9.240 323 HE2 LYS 38 HE1 LYS 38 49.250 16.192 -9.434 324 HE3 LYS 38 HE2 LYS 38 50.747 16.943 -10.107 325 HZ1 LYS 38 HZ1 LYS 38 49.215 16.275 -11.840 326 HZ2 LYS 38 HZ2 LYS 38 50.648 15.369 -11.936 327 HZ3 LYS 38 HZ3 LYS 38 49.242 14.665 -11.303 328 H VAL 39 HN VAL 39 51.554 10.416 -6.812 329 HA VAL 39 HA VAL 39 54.263 9.916 -5.787 330 HB VAL 39 HB VAL 39 51.685 8.334 -5.390 331 HG11 VAL 39 HG11 VAL 39 53.081 6.895 -3.834 332 HG12 VAL 39 HG12 VAL 39 53.644 6.779 -5.529 333 HG13 VAL 39 HG13 VAL 39 54.557 7.787 -4.342 334 HG21 VAL 39 HG21 VAL 39 52.064 8.951 -2.924 335 HG22 VAL 39 HG22 VAL 39 53.456 9.981 -3.421 336 HG23 VAL 39 HG23 VAL 39 51.784 10.397 -3.943 337 H SER 40 HN SER 40 55.573 8.524 -7.004 338 HA SER 40 HA SER 40 54.617 7.969 -9.614 339 HB2 SER 40 HB1 SER 40 56.936 8.790 -9.266 340 HB3 SER 40 HB2 SER 40 57.325 7.394 -8.213 341 HG SER 40 HG SER 40 58.033 7.323 -10.486 342 H ILE 41 HN ILE 41 54.426 5.994 -10.698 343 HA ILE 41 HA ILE 41 53.449 3.799 -9.274 344 HB ILE 41 HB ILE 41 54.412 4.164 -12.117 345 HG12 ILE 41 HG11 ILE 41 52.526 5.617 -11.682 346 HG13 ILE 41 HG12 ILE 41 51.971 4.269 -12.725 347 HG21 ILE 41 HG21 ILE 41 53.164 2.007 -12.681 348 HG22 ILE 41 HG22 ILE 41 54.321 1.648 -11.361 349 HG23 ILE 41 HG23 ILE 41 52.572 1.866 -10.988 350 HD11 ILE 41 HD11 ILE 41 50.262 4.781 -11.040 351 HD12 ILE 41 HD12 ILE 41 50.939 3.143 -10.719 352 HD13 ILE 41 HD13 ILE 41 51.434 4.544 -9.698 353 H SER 42 HN SER 42 56.672 4.477 -10.733 354 HA SER 42 HA SER 42 57.698 1.920 -10.413 355 HB2 SER 42 HB1 SER 42 58.651 3.657 -11.942 356 HB3 SER 42 HB2 SER 42 59.087 4.695 -10.548 357 HG SER 42 HG SER 42 60.785 3.336 -11.518 358 H THR 43 HN THR 43 57.807 4.781 -8.148 359 HA THR 43 HA THR 43 59.416 3.450 -6.295 360 HB THR 43 HB THR 43 58.679 5.172 -4.663 361 HG1 THR 43 HG1 THR 43 57.595 6.960 -5.540 362 HG21 THR 43 HG21 THR 43 59.925 7.032 -5.919 363 HG22 THR 43 HG22 THR 43 60.674 5.452 -6.331 364 HG23 THR 43 HG23 THR 43 59.553 6.246 -7.495 365 H VAL 44 HN VAL 44 55.723 3.649 -6.481 366 HA VAL 44 HA VAL 44 55.451 2.322 -4.023 367 HB VAL 44 HB VAL 44 53.204 1.725 -4.612 368 HG11 VAL 44 HG11 VAL 44 52.423 4.165 -4.792 369 HG12 VAL 44 HG12 VAL 44 53.734 3.971 -3.590 370 HG13 VAL 44 HG13 VAL 44 54.101 4.651 -5.220 371 HG21 VAL 44 HG21 VAL 44 52.150 2.606 -6.703 372 HG22 VAL 44 HG22 VAL 44 53.785 3.005 -7.346 373 HG23 VAL 44 HG23 VAL 44 53.331 1.295 -7.017 374 H LYS 45 HN LYS 45 55.918 1.051 -7.398 375 HA LYS 45 HA LYS 45 55.310 -1.581 -6.768 376 HB2 LYS 45 HB1 LYS 45 55.423 -0.658 -9.054 377 HB3 LYS 45 HB2 LYS 45 57.170 -0.348 -8.886 378 HG2 LYS 45 HG1 LYS 45 57.605 -2.824 -8.732 379 HG3 LYS 45 HG2 LYS 45 55.841 -3.152 -8.772 380 HD2 LYS 45 HD1 LYS 45 55.702 -2.201 -11.075 381 HD3 LYS 45 HD2 LYS 45 57.439 -1.744 -11.012 382 HE2 LYS 45 HE1 LYS 45 56.533 -4.683 -10.690 383 HE3 LYS 45 HE2 LYS 45 56.841 -3.946 -12.309 384 HZ1 LYS 45 HZ1 LYS 45 58.799 -5.033 -11.423 385 HZ2 LYS 45 HZ2 LYS 45 59.061 -3.360 -11.558 386 HZ3 LYS 45 HZ3 LYS 45 58.770 -4.052 -10.038 387 H ARG 46 HN ARG 46 58.586 0.059 -6.718 388 HA ARG 46 HA ARG 46 59.914 -2.239 -5.821 389 HB2 ARG 46 HB1 ARG 46 60.546 0.696 -5.726 390 HB3 ARG 46 HB2 ARG 46 61.628 -0.464 -4.918 391 HG2 ARG 46 HG1 ARG 46 61.816 -1.740 -7.156 392 HG3 ARG 46 HG2 ARG 46 60.757 -0.537 -7.917 393 HD2 ARG 46 HD1 ARG 46 63.252 0.516 -6.517 394 HD3 ARG 46 HD2 ARG 46 63.426 -0.227 -8.159 395 HE ARG 46 HE ARG 46 61.304 1.295 -8.633 396 HH11 ARG 46 HH11 ARG 46 62.468 4.657 -8.672 397 HH12 ARG 46 HH12 ARG 46 61.343 3.482 -9.309 398 HH21 ARG 46 HH21 ARG 46 64.143 3.872 -7.145 399 HH22 ARG 46 HH22 ARG 46 64.134 2.196 -6.713 400 H VAL 47 HN VAL 47 58.396 0.441 -3.719 401 HA VAL 47 HA VAL 47 59.446 -0.706 -1.389 402 HB VAL 47 HB VAL 47 58.715 1.617 -1.573 403 HG11 VAL 47 HG11 VAL 47 56.293 2.133 -1.093 404 HG12 VAL 47 HG12 VAL 47 56.504 1.384 -2.704 405 HG13 VAL 47 HG13 VAL 47 55.877 0.399 -1.328 406 HG21 VAL 47 HG21 VAL 47 57.818 1.674 0.785 407 HG22 VAL 47 HG22 VAL 47 57.617 -0.116 0.725 408 HG23 VAL 47 HG23 VAL 47 59.255 0.620 0.597 409 H LEU 48 HN LEU 48 56.297 -1.362 -3.146 410 HA LEU 48 HA LEU 48 55.308 -3.139 -1.267 411 HB2 LEU 48 HB1 LEU 48 55.012 -2.899 -4.304 412 HB3 LEU 48 HB2 LEU 48 54.135 -4.159 -3.406 413 HG LEU 48 HG LEU 48 53.950 -1.155 -2.703 414 HD11 LEU 48 HD11 LEU 48 51.724 -1.160 -3.974 415 HD12 LEU 48 HD12 LEU 48 53.126 -1.436 -5.070 416 HD13 LEU 48 HD13 LEU 48 52.085 -2.820 -4.568 417 HD21 LEU 48 HD21 LEU 48 51.794 -1.828 -1.609 418 HD22 LEU 48 HD22 LEU 48 52.072 -3.538 -2.068 419 HD23 LEU 48 HD23 LEU 48 53.200 -2.723 -0.927 420 H TYR 49 HN TYR 49 57.515 -3.798 -4.109 421 HA TYR 49 HA TYR 49 57.654 -6.534 -3.676 422 HB2 TYR 49 HB1 TYR 49 58.338 -5.428 -5.795 423 HB3 TYR 49 HB2 TYR 49 59.628 -4.515 -4.955 424 HD1 TYR 49 HD1 TYR 49 58.495 -8.120 -5.381 425 HD2 TYR 49 HD2 TYR 49 61.779 -5.343 -5.245 426 HE1 TYR 49 HE1 TYR 49 60.075 -9.941 -5.992 427 HE2 TYR 49 HE2 TYR 49 63.328 -7.142 -5.930 428 HH TYR 49 HH TYR 49 63.543 -9.291 -6.540 429 H ARG 50 HN ARG 50 59.791 -3.892 -2.343 430 HA ARG 50 HA ARG 50 61.476 -5.644 -0.935 431 HB2 ARG 50 HB1 ARG 50 60.673 -2.738 -0.487 432 HB3 ARG 50 HB2 ARG 50 61.863 -3.529 0.572 433 HG2 ARG 50 HG1 ARG 50 63.293 -4.002 -1.522 434 HG3 ARG 50 HG2 ARG 50 62.095 -3.146 -2.510 435 HD2 ARG 50 HD1 ARG 50 63.978 -1.615 -2.022 436 HD3 ARG 50 HD2 ARG 50 62.470 -0.983 -1.243 437 HE ARG 50 HE ARG 50 63.751 -2.714 0.598 438 HH11 ARG 50 HH11 ARG 50 65.210 1.136 0.232 439 HH12 ARG 50 HH12 ARG 50 64.420 0.300 -1.083 440 HH21 ARG 50 HH21 ARG 50 65.425 -0.012 2.313 441 HH22 ARG 50 HH22 ARG 50 64.756 -1.602 2.448 442 H HIS 51 HN HIS 51 58.451 -3.965 0.224 443 HA HIS 51 HA HIS 51 58.656 -5.041 2.811 444 HB2 HIS 51 HB1 HIS 51 56.344 -3.777 1.298 445 HB3 HIS 51 HB2 HIS 51 56.178 -4.373 2.973 446 HD1 HIS 51 HD1 HIS 51 55.800 -1.425 2.846 447 HD2 HIS 51 HD2 HIS 51 59.675 -3.015 3.099 448 HE1 HIS 51 HE1 HIS 51 57.379 0.417 3.689 449 H ASN 52 HN ASN 52 56.996 -6.366 -0.171 450 HA ASN 52 HA ASN 52 55.805 -8.476 1.195 451 HB2 ASN 52 HB1 ASN 52 55.300 -7.743 -1.185 452 HB3 ASN 52 HB2 ASN 52 56.909 -8.326 -1.712 453 HD21 ASN 52 HD21 ASN 52 54.950 -11.697 -0.703 454 HD22 ASN 52 HD22 ASN 52 55.726 -10.681 0.487 455 H LEU 53 HN LEU 53 59.165 -8.209 -0.267 456 HA LEU 53 HA LEU 53 59.837 -10.834 0.426 457 HB2 LEU 53 HB1 LEU 53 60.879 -9.567 -1.399 458 HB3 LEU 53 HB2 LEU 53 61.515 -8.357 -0.260 459 HG LEU 53 HG LEU 53 62.291 -11.269 0.105 460 HD11 LEU 53 HD11 LEU 53 64.209 -10.918 -1.595 461 HD12 LEU 53 HD12 LEU 53 62.578 -10.922 -2.360 462 HD13 LEU 53 HD13 LEU 53 63.442 -9.365 -2.082 463 HD21 LEU 53 HD21 LEU 53 64.527 -10.321 0.751 464 HD22 LEU 53 HD22 LEU 53 63.945 -8.660 0.412 465 HD23 LEU 53 HD23 LEU 53 63.194 -9.620 1.737 466 H LYS 54 HN LYS 54 60.391 -7.679 2.188 467 HA LYS 54 HA LYS 54 61.229 -9.289 4.496 468 HB2 LYS 54 HB1 LYS 54 63.142 -8.008 3.345 469 HB3 LYS 54 HB2 LYS 54 62.218 -6.497 3.546 470 HG2 LYS 54 HG1 LYS 54 62.322 -7.094 6.154 471 HG3 LYS 54 HG2 LYS 54 63.635 -8.216 5.666 472 HD2 LYS 54 HD1 LYS 54 63.517 -5.158 5.215 473 HD3 LYS 54 HD2 LYS 54 64.533 -6.026 6.415 474 HE2 LYS 54 HE1 LYS 54 65.976 -6.940 4.696 475 HE3 LYS 54 HE2 LYS 54 64.835 -6.468 3.378 476 HZ1 LYS 54 HZ1 LYS 54 66.657 -4.894 3.604 477 HZ2 LYS 54 HZ2 LYS 54 65.180 -4.150 3.988 478 HZ3 LYS 54 HZ3 LYS 54 66.250 -4.597 5.225 479 H GLY 55 HN GLY 55 59.749 -9.067 6.187 480 HA2 GLY 55 HA2 GLY 55 57.769 -7.004 5.825 481 HA3 GLY 55 HA1 GLY 55 57.741 -8.432 6.948 482 H ARG 56 HN ARG 56 59.701 -5.470 6.487 483 HA ARG 56 HA ARG 56 59.199 -4.712 9.301 484 HB2 ARG 56 HB1 ARG 56 61.810 -4.595 7.726 485 HB3 ARG 56 HB2 ARG 56 61.518 -3.439 9.047 486 HG2 ARG 56 HG1 ARG 56 62.884 -5.169 9.980 487 HG3 ARG 56 HG2 ARG 56 61.263 -5.490 10.623 488 HD2 ARG 56 HD1 ARG 56 60.862 -7.378 9.236 489 HD3 ARG 56 HD2 ARG 56 62.271 -7.030 8.152 490 HE ARG 56 HE ARG 56 62.335 -8.217 10.834 491 HH11 ARG 56 HH11 ARG 56 65.892 -8.773 10.434 492 HH12 ARG 56 HH12 ARG 56 64.460 -9.135 11.367 493 HH21 ARG 56 HH21 ARG 56 65.686 -7.290 8.606 494 HH22 ARG 56 HH22 ARG 56 64.126 -6.645 8.229 495 H SER 57 HN SER 57 58.839 -2.481 9.693 496 HA SER 57 HA SER 57 58.255 -0.909 7.372 497 HB2 SER 57 HB1 SER 57 56.819 -0.754 9.438 498 HB3 SER 57 HB2 SER 57 58.237 -0.259 10.415 499 HG SER 57 HG SER 57 56.760 1.436 9.632 500 H ALA 58 HN ALA 58 59.382 0.992 6.669 501 HA ALA 58 HA ALA 58 62.193 1.125 7.565 502 HB1 ALA 58 HB1 ALA 58 61.794 0.829 5.108 503 HB2 ALA 58 HB2 ALA 58 60.740 2.284 5.098 504 HB3 ALA 58 HB3 ALA 58 62.504 2.446 5.441 505 H ARG 59 HN ARG 59 62.975 2.828 8.686 506 HA ARG 59 HA ARG 59 61.238 5.188 8.939 507 HB2 ARG 59 HB1 ARG 59 62.747 3.661 11.134 508 HB3 ARG 59 HB2 ARG 59 62.073 5.286 11.402 509 HG2 ARG 59 HG1 ARG 59 59.753 4.384 11.001 510 HG3 ARG 59 HG2 ARG 59 60.411 2.792 10.580 511 HD2 ARG 59 HD1 ARG 59 61.386 2.478 12.853 512 HD3 ARG 59 HD2 ARG 59 60.715 4.073 13.392 513 HE ARG 59 HE ARG 59 58.627 2.577 12.173 514 HH11 ARG 59 HH11 ARG 59 57.462 1.210 15.335 515 HH12 ARG 59 HH12 ARG 59 57.064 1.565 13.671 516 HH21 ARG 59 HH21 ARG 59 59.638 1.854 16.117 517 HH22 ARG 59 HH22 ARG 59 60.723 2.599 14.993 518 H LYS 60 HN LYS 60 62.261 7.036 8.468 519 HA LYS 60 HA LYS 60 65.055 7.307 8.399 520 HB2 LYS 60 HB1 LYS 60 64.657 9.723 8.208 521 HB3 LYS 60 HB2 LYS 60 63.676 8.793 7.045 522 HG2 LYS 60 HG1 LYS 60 62.516 9.830 9.704 523 HG3 LYS 60 HG2 LYS 60 62.622 10.862 8.240 524 HD2 LYS 60 HD1 LYS 60 61.287 8.947 7.044 525 HD3 LYS 60 HD2 LYS 60 60.984 8.306 8.694 526 HE2 LYS 60 HE1 LYS 60 59.825 10.388 9.373 527 HE3 LYS 60 HE2 LYS 60 60.282 11.203 7.830 528 HZ1 LYS 60 HZ1 LYS 60 58.029 10.347 7.767 529 HZ2 LYS 60 HZ2 LYS 60 59.002 9.536 6.636 530 HZ3 LYS 60 HZ3 LYS 60 58.575 8.772 8.088 531 H LEU 61 HN LEU 61 62.703 7.598 10.968 532 HA LEU 61 HA LEU 61 64.140 9.032 12.847 533 HB2 LEU 61 HB1 LEU 61 61.701 8.695 12.865 534 HB3 LEU 61 HB2 LEU 61 61.896 6.939 13.070 535 HG LEU 61 HG LEU 61 63.061 8.816 15.159 536 HD11 LEU 61 HD11 LEU 61 60.763 8.809 16.343 537 HD12 LEU 61 HD12 LEU 61 60.747 9.718 14.789 538 HD13 LEU 61 HD13 LEU 61 60.046 8.059 14.872 539 HD21 LEU 61 HD21 LEU 61 62.367 7.013 16.768 540 HD22 LEU 61 HD22 LEU 61 61.660 6.057 15.427 541 HD23 LEU 61 HD23 LEU 61 63.431 6.369 15.466 542 H GLU 62 HN GLU 62 64.250 5.496 12.065 543 HA GLU 62 HA GLU 62 65.116 4.658 14.552 544 HB2 GLU 62 HB1 GLU 62 64.059 3.192 12.855 545 HB3 GLU 62 HB2 GLU 62 65.449 3.392 11.764 546 HG2 GLU 62 HG1 GLU 62 65.573 1.191 12.819 547 HG3 GLU 62 HG2 GLU 62 66.910 2.175 13.524 Start of MODEL 5 1 H1 ALA 1 HT1 ALA 1 40.016 12.636 7.450 2 H2 ALA 1 HT2 ALA 1 40.711 11.826 6.130 3 H3 ALA 1 HT3 ALA 1 41.666 12.242 7.472 4 HA ALA 1 HA ALA 1 40.428 10.737 8.881 5 HB1 ALA 1 HB1 ALA 1 38.272 11.079 7.681 6 HB2 ALA 1 HB2 ALA 1 38.881 10.114 6.292 7 HB3 ALA 1 HB3 ALA 1 38.608 9.325 7.892 8 H SER 2 HN SER 2 41.196 9.728 5.434 9 HA SER 2 HA SER 2 42.255 7.269 6.436 10 HB2 SER 2 HB1 SER 2 40.922 7.410 4.275 11 HB3 SER 2 HB2 SER 2 42.209 8.424 3.552 12 HG SER 2 HG SER 2 42.238 6.078 3.108 13 H MET 3 HN MET 3 43.511 10.356 6.153 14 HA MET 3 HA MET 3 45.419 11.201 6.738 15 HB2 MET 3 HB1 MET 3 46.390 8.342 7.046 16 HB3 MET 3 HB2 MET 3 47.404 9.749 7.455 17 HG2 MET 3 HG1 MET 3 45.631 10.478 9.168 18 HG3 MET 3 HG2 MET 3 44.648 9.045 8.724 19 HE1 MET 3 HE1 MET 3 45.577 8.094 12.245 20 HE2 MET 3 HE2 MET 3 45.100 9.684 11.558 21 HE3 MET 3 HE3 MET 3 44.326 8.177 10.958 22 H VAL 4 HN VAL 4 45.044 9.695 3.813 23 HA VAL 4 HA VAL 4 47.628 9.571 2.743 24 HB VAL 4 HB VAL 4 44.905 9.831 1.436 25 HG11 VAL 4 HG11 VAL 4 46.066 8.944 -0.646 26 HG12 VAL 4 HG12 VAL 4 46.662 10.571 -0.197 27 HG13 VAL 4 HG13 VAL 4 47.656 9.113 0.177 28 HG21 VAL 4 HG21 VAL 4 45.261 7.317 1.073 29 HG22 VAL 4 HG22 VAL 4 46.783 7.420 2.031 30 HG23 VAL 4 HG23 VAL 4 45.193 7.752 2.809 31 H LEU 5 HN LEU 5 45.211 12.167 2.847 32 HA LEU 5 HA LEU 5 46.363 13.905 1.013 33 HB2 LEU 5 HB1 LEU 5 44.471 14.346 3.388 34 HB3 LEU 5 HB2 LEU 5 44.844 15.635 2.221 35 HG LEU 5 HG LEU 5 44.036 13.844 0.422 36 HD11 LEU 5 HD11 LEU 5 42.068 12.428 1.294 37 HD12 LEU 5 HD12 LEU 5 43.653 11.889 1.961 38 HD13 LEU 5 HD13 LEU 5 42.530 12.867 2.976 39 HD21 LEU 5 HD21 LEU 5 41.679 14.748 0.617 40 HD22 LEU 5 HD22 LEU 5 42.054 15.380 2.252 41 HD23 LEU 5 HD23 LEU 5 42.934 16.023 0.819 42 H SER 6 HN SER 6 46.736 13.625 4.547 43 HA SER 6 HA SER 6 48.458 15.793 4.926 44 HB2 SER 6 HB1 SER 6 48.089 13.122 6.443 45 HB3 SER 6 HB2 SER 6 49.058 14.474 7.108 46 HG SER 6 HG SER 6 46.751 14.306 7.765 47 HA PRO 7 HA PRO 7 52.187 14.516 3.220 48 HB2 PRO 7 HB2 PRO 7 54.271 15.153 4.859 49 HB3 PRO 7 HB1 PRO 7 53.163 16.385 4.134 50 HG2 PRO 7 HG2 PRO 7 52.863 15.258 6.933 51 HG3 PRO 7 HG1 PRO 7 52.910 16.993 6.410 52 HD2 PRO 7 HD2 PRO 7 50.512 15.635 6.669 53 HD3 PRO 7 HD1 PRO 7 50.777 16.951 5.426 54 H ARG 8 HN ARG 8 51.387 12.726 6.135 55 HA ARG 8 HA ARG 8 53.494 10.778 5.782 56 HB2 ARG 8 HB1 ARG 8 50.933 10.835 7.464 57 HB3 ARG 8 HB2 ARG 8 52.098 9.492 7.550 58 HG2 ARG 8 HG1 ARG 8 53.879 11.249 8.269 59 HG3 ARG 8 HG2 ARG 8 52.590 12.466 8.312 60 HD2 ARG 8 HD1 ARG 8 52.325 9.868 9.949 61 HD3 ARG 8 HD2 ARG 8 53.097 11.357 10.634 62 HE ARG 8 HE ARG 8 50.999 12.577 10.048 63 HH11 ARG 8 HH11 ARG 8 49.216 8.984 11.020 64 HH12 ARG 8 HH12 ARG 8 50.852 9.066 10.416 65 HH21 ARG 8 HH21 ARG 8 48.014 11.012 11.270 66 HH22 ARG 8 HH22 ARG 8 48.809 12.500 10.888 67 H ASP 9 HN ASP 9 52.172 11.017 3.267 68 HA ASP 9 HA ASP 9 50.091 9.190 2.995 69 HB2 ASP 9 HB1 ASP 9 50.494 9.471 0.530 70 HB3 ASP 9 HB2 ASP 9 50.320 11.035 1.398 71 H GLU 10 HN GLU 10 53.629 8.827 2.658 72 HA GLU 10 HA GLU 10 53.731 6.258 1.619 73 HB2 GLU 10 HB1 GLU 10 55.644 7.863 1.705 74 HB3 GLU 10 HB2 GLU 10 55.672 7.765 3.480 75 HG2 GLU 10 HG1 GLU 10 56.307 5.333 3.357 76 HG3 GLU 10 HG2 GLU 10 56.227 5.376 1.556 77 H ARG 11 HN ARG 11 53.437 7.381 5.007 78 HA ARG 11 HA ARG 11 53.856 4.908 6.269 79 HB2 ARG 11 HB1 ARG 11 53.852 7.135 7.424 80 HB3 ARG 11 HB2 ARG 11 52.118 7.345 7.082 81 HG2 ARG 11 HG1 ARG 11 51.908 5.026 8.467 82 HG3 ARG 11 HG2 ARG 11 53.522 5.452 9.066 83 HD2 ARG 11 HD1 ARG 11 52.826 7.534 10.064 84 HD3 ARG 11 HD2 ARG 11 51.210 7.512 9.246 85 HE ARG 11 HE ARG 11 51.990 6.075 11.645 86 HH11 ARG 11 HH11 ARG 11 48.867 4.263 11.732 87 HH12 ARG 11 HH12 ARG 11 50.404 4.547 12.510 88 HH21 ARG 11 HH21 ARG 11 48.473 5.289 9.629 89 HH22 ARG 11 HH22 ARG 11 49.699 6.311 8.961 90 H THR 12 HN THR 12 50.700 6.444 5.212 91 HA THR 12 HA THR 12 49.161 4.271 6.049 92 HB THR 12 HB THR 12 48.686 6.327 3.865 93 HG1 THR 12 HG1 THR 12 47.333 7.228 5.480 94 HG21 THR 12 HG21 THR 12 46.211 5.721 4.075 95 HG22 THR 12 HG22 THR 12 47.122 4.214 3.718 96 HG23 THR 12 HG23 THR 12 46.574 4.556 5.398 97 H LEU 13 HN LEU 13 50.738 4.968 2.865 98 HA LEU 13 HA LEU 13 49.537 2.867 1.531 99 HB2 LEU 13 HB1 LEU 13 50.560 4.833 0.474 100 HB3 LEU 13 HB2 LEU 13 52.165 4.410 1.117 101 HG LEU 13 HG LEU 13 50.748 2.413 -0.681 102 HD11 LEU 13 HD11 LEU 13 51.667 3.679 -2.727 103 HD12 LEU 13 HD12 LEU 13 50.375 4.588 -1.862 104 HD13 LEU 13 HD13 LEU 13 52.104 5.048 -1.644 105 HD21 LEU 13 HD21 LEU 13 53.065 2.003 -1.562 106 HD22 LEU 13 HD22 LEU 13 53.722 3.292 -0.504 107 HD23 LEU 13 HD23 LEU 13 52.995 1.817 0.228 108 H VAL 14 HN VAL 14 52.798 2.908 3.270 109 HA VAL 14 HA VAL 14 53.294 0.214 2.639 110 HB VAL 14 HB VAL 14 55.026 1.867 3.143 111 HG11 VAL 14 HG11 VAL 14 55.670 2.202 5.560 112 HG12 VAL 14 HG12 VAL 14 54.110 2.990 5.175 113 HG13 VAL 14 HG13 VAL 14 54.133 1.428 6.077 114 HG21 VAL 14 HG21 VAL 14 56.463 0.186 4.353 115 HG22 VAL 14 HG22 VAL 14 54.990 -0.800 4.678 116 HG23 VAL 14 HG23 VAL 14 55.538 -0.513 2.987 117 H ARG 15 HN ARG 15 51.620 1.756 5.448 118 HA ARG 15 HA ARG 15 51.374 -0.581 6.990 119 HB2 ARG 15 HB1 ARG 15 50.930 1.732 7.810 120 HB3 ARG 15 HB2 ARG 15 49.525 1.884 6.728 121 HG2 ARG 15 HG1 ARG 15 48.465 -0.098 8.022 122 HG3 ARG 15 HG2 ARG 15 49.844 -0.049 9.134 123 HD2 ARG 15 HD1 ARG 15 49.356 2.488 9.523 124 HD3 ARG 15 HD2 ARG 15 47.737 2.195 8.766 125 HE ARG 15 HE ARG 15 47.053 0.996 10.567 126 HH11 ARG 15 HH11 ARG 15 50.760 0.889 12.397 127 HH12 ARG 15 HH12 ARG 15 50.556 1.386 10.736 128 HH21 ARG 15 HH21 ARG 15 48.817 0.222 13.608 129 HH22 ARG 15 HH22 ARG 15 47.283 0.295 12.811 130 H LYS 16 HN LYS 16 49.248 0.706 4.368 131 HA LYS 16 HA LYS 16 47.097 -0.960 4.949 132 HB2 LYS 16 HB1 LYS 16 47.022 1.181 3.634 133 HB3 LYS 16 HB2 LYS 16 47.929 0.408 2.309 134 HG2 LYS 16 HG1 LYS 16 45.570 0.468 1.673 135 HG3 LYS 16 HG2 LYS 16 45.979 -1.243 2.030 136 HD2 LYS 16 HD1 LYS 16 44.991 -1.016 4.323 137 HD3 LYS 16 HD2 LYS 16 44.696 0.735 4.044 138 HE2 LYS 16 HE1 LYS 16 43.320 -1.535 2.465 139 HE3 LYS 16 HE2 LYS 16 42.604 -0.661 3.873 140 HZ1 LYS 16 HZ1 LYS 16 41.892 0.261 1.778 141 HZ2 LYS 16 HZ2 LYS 16 42.822 1.394 2.635 142 HZ3 LYS 16 HZ3 LYS 16 43.495 0.571 1.315 143 H VAL 17 HN VAL 17 49.803 -1.383 2.582 144 HA VAL 17 HA VAL 17 48.811 -3.767 1.498 145 HB VAL 17 HB VAL 17 51.014 -4.078 0.510 146 HG11 VAL 17 HG11 VAL 17 50.889 -1.900 -0.852 147 HG12 VAL 17 HG12 VAL 17 49.273 -2.631 -0.612 148 HG13 VAL 17 HG13 VAL 17 49.779 -1.213 0.384 149 HG21 VAL 17 HG21 VAL 17 52.756 -2.271 0.766 150 HG22 VAL 17 HG22 VAL 17 51.798 -1.555 2.113 151 HG23 VAL 17 HG23 VAL 17 52.508 -3.202 2.277 152 H GLN 18 HN GLN 18 51.037 -3.172 4.324 153 HA GLN 18 HA GLN 18 51.602 -5.881 4.701 154 HB2 GLN 18 HB1 GLN 18 51.586 -3.458 6.548 155 HB3 GLN 18 HB2 GLN 18 52.123 -5.057 7.121 156 HG2 GLN 18 HG1 GLN 18 53.946 -5.087 5.313 157 HG3 GLN 18 HG2 GLN 18 53.371 -3.500 4.703 158 HE21 GLN 18 HE21 GLN 18 54.616 -1.784 7.710 159 HE22 GLN 18 HE22 GLN 18 53.139 -1.853 6.772 160 H ILE 19 HN ILE 19 48.933 -3.789 6.116 161 HA ILE 19 HA ILE 19 47.875 -5.876 7.650 162 HB ILE 19 HB ILE 19 46.726 -3.330 6.517 163 HG12 ILE 19 HG11 ILE 19 48.464 -2.887 8.160 164 HG13 ILE 19 HG12 ILE 19 46.870 -2.455 8.857 165 HG21 ILE 19 HG21 ILE 19 44.735 -3.636 8.074 166 HG22 ILE 19 HG22 ILE 19 44.860 -5.091 7.036 167 HG23 ILE 19 HG23 ILE 19 45.441 -5.151 8.740 168 HD11 ILE 19 HD11 ILE 19 48.268 -3.529 10.563 169 HD12 ILE 19 HD12 ILE 19 46.870 -4.599 10.182 170 HD13 ILE 19 HD13 ILE 19 48.508 -4.982 9.532 171 H ASN 20 HN ASN 20 47.041 -4.766 4.258 172 HA ASN 20 HA ASN 20 45.549 -7.264 4.047 173 HB2 ASN 20 HB1 ASN 20 45.154 -4.544 2.645 174 HB3 ASN 20 HB2 ASN 20 44.327 -6.023 2.064 175 HD21 ASN 20 HD21 ASN 20 42.336 -3.894 4.671 176 HD22 ASN 20 HD22 ASN 20 43.326 -3.376 3.328 177 HA PRO 21 HA PRO 21 49.154 -7.616 1.177 178 HB2 PRO 21 HB2 PRO 21 49.596 -10.310 1.406 179 HB3 PRO 21 HB1 PRO 21 50.087 -9.146 2.701 180 HG2 PRO 21 HG2 PRO 21 47.512 -10.765 2.702 181 HG3 PRO 21 HG1 PRO 21 48.755 -10.621 4.016 182 HD2 PRO 21 HD2 PRO 21 46.509 -8.997 3.917 183 HD3 PRO 21 HD1 PRO 21 48.113 -8.411 4.575 184 H ARG 22 HN ARG 22 46.009 -8.817 1.224 185 HA ARG 22 HA ARG 22 45.879 -10.406 -1.148 186 HB2 ARG 22 HB2 ARG 22 43.767 -8.838 0.496 187 HB3 ARG 22 HB1 ARG 22 43.340 -9.868 -0.855 188 HG2 ARG 22 HG2 ARG 22 44.328 -11.886 0.388 189 HG3 ARG 22 HG1 ARG 22 44.800 -10.821 1.717 190 HD2 ARG 22 HD2 ARG 22 42.343 -10.207 2.061 191 HD3 ARG 22 HD1 ARG 22 41.900 -11.297 0.725 192 HE ARG 22 HE ARG 22 43.497 -12.875 2.593 193 HH11 ARG 22 HH11 ARG 22 40.409 -11.299 2.600 194 HH12 ARG 22 HH12 ARG 22 39.736 -12.460 3.843 195 HH21 ARG 22 HH21 ARG 22 42.713 -14.167 3.990 196 HH22 ARG 22 HH22 ARG 22 41.000 -13.999 4.579 197 H THR 23 HN THR 23 45.987 -6.900 -0.607 198 HA THR 23 HA THR 23 44.611 -6.259 -3.002 199 HB THR 23 HB THR 23 45.335 -3.925 -2.560 200 HG1 THR 23 HG1 THR 23 46.269 -3.491 -0.542 201 HG21 THR 23 HG21 THR 23 43.923 -3.656 -0.457 202 HG22 THR 23 HG22 THR 23 43.211 -4.946 -1.483 203 HG23 THR 23 HG23 THR 23 44.180 -5.387 -0.032 204 H THR 24 HN THR 24 45.558 -4.764 -4.740 205 HA THR 24 HA THR 24 48.301 -5.579 -5.325 206 HB THR 24 HB THR 24 47.783 -5.624 -7.717 207 HG1 THR 24 HG1 THR 24 45.612 -5.682 -8.378 208 HG21 THR 24 HG21 THR 24 46.434 -7.797 -7.743 209 HG22 THR 24 HG22 THR 24 47.501 -7.794 -6.298 210 HG23 THR 24 HG23 THR 24 45.748 -7.419 -6.122 211 H ALA 25 HN ALA 25 49.210 -4.106 -7.192 212 HA ALA 25 HA ALA 25 49.395 -1.497 -6.215 213 HB1 ALA 25 HB1 ALA 25 51.139 -2.641 -7.579 214 HB2 ALA 25 HB2 ALA 25 50.057 -2.592 -9.013 215 HB3 ALA 25 HB3 ALA 25 50.688 -1.058 -8.303 216 H LYS 26 HN LYS 26 47.144 -2.807 -8.690 217 HA LYS 26 HA LYS 26 46.311 -0.358 -9.691 218 HB2 LYS 26 HB1 LYS 26 44.947 -3.066 -9.489 219 HB3 LYS 26 HB2 LYS 26 44.168 -1.686 -10.306 220 HG2 LYS 26 HG1 LYS 26 46.269 -1.498 -11.815 221 HG3 LYS 26 HG2 LYS 26 46.916 -2.971 -11.020 222 HD2 LYS 26 HD1 LYS 26 44.925 -4.271 -11.830 223 HD3 LYS 26 HD2 LYS 26 44.251 -2.782 -12.576 224 HE2 LYS 26 HE1 LYS 26 46.942 -4.086 -13.392 225 HE3 LYS 26 HE2 LYS 26 45.379 -4.290 -14.272 226 HZ1 LYS 26 HZ1 LYS 26 46.746 -2.575 -15.243 227 HZ2 LYS 26 HZ2 LYS 26 45.321 -1.905 -14.607 228 HZ3 LYS 26 HZ3 LYS 26 46.790 -1.716 -13.780 229 H ASP 27 HN ASP 27 45.267 -2.005 -6.597 230 HA ASP 27 HA ASP 27 43.101 -0.304 -6.177 231 HB2 ASP 27 HB1 ASP 27 45.081 -1.752 -4.283 232 HB3 ASP 27 HB2 ASP 27 43.607 -0.920 -3.679 233 H LEU 28 HN LEU 28 46.591 0.032 -5.441 234 HA LEU 28 HA LEU 28 46.391 2.401 -3.994 235 HB2 LEU 28 HB1 LEU 28 48.676 0.989 -5.417 236 HB3 LEU 28 HB2 LEU 28 48.940 2.566 -4.639 237 HG LEU 28 HG LEU 28 48.145 1.594 -2.468 238 HD11 LEU 28 HD11 LEU 28 48.193 -0.961 -2.166 239 HD12 LEU 28 HD12 LEU 28 46.823 -0.418 -3.204 240 HD13 LEU 28 HD13 LEU 28 48.292 -1.145 -3.954 241 HD21 LEU 28 HD21 LEU 28 50.255 0.264 -2.016 242 HD22 LEU 28 HD22 LEU 28 50.569 0.177 -3.779 243 HD23 LEU 28 HD23 LEU 28 50.552 1.775 -2.950 244 H VAL 29 HN VAL 29 46.888 1.862 -7.613 245 HA VAL 29 HA VAL 29 47.745 4.490 -8.050 246 HB VAL 29 HB VAL 29 47.316 4.207 -10.399 247 HG11 VAL 29 HG11 VAL 29 48.801 2.145 -10.722 248 HG12 VAL 29 HG12 VAL 29 49.423 3.219 -9.434 249 HG13 VAL 29 HG13 VAL 29 48.541 1.706 -8.998 250 HG21 VAL 29 HG21 VAL 29 46.430 2.107 -11.373 251 HG22 VAL 29 HG22 VAL 29 45.881 1.592 -9.737 252 HG23 VAL 29 HG23 VAL 29 45.194 3.068 -10.504 253 H LYS 30 HN LYS 30 44.406 3.044 -8.079 254 HA LYS 30 HA LYS 30 43.108 5.369 -8.920 255 HB2 LYS 30 HB1 LYS 30 42.057 3.106 -8.879 256 HB3 LYS 30 HB2 LYS 30 42.131 3.084 -7.098 257 HG2 LYS 30 HG1 LYS 30 40.591 5.128 -7.041 258 HG3 LYS 30 HG2 LYS 30 40.536 5.117 -8.835 259 HD2 LYS 30 HD1 LYS 30 39.521 2.777 -8.706 260 HD3 LYS 30 HD2 LYS 30 39.493 2.940 -6.917 261 HE2 LYS 30 HE1 LYS 30 38.060 5.070 -7.192 262 HE3 LYS 30 HE2 LYS 30 37.975 4.723 -8.961 263 HZ1 LYS 30 HZ1 LYS 30 36.077 3.845 -7.775 264 HZ2 LYS 30 HZ2 LYS 30 36.998 2.580 -8.436 265 HZ3 LYS 30 HZ3 LYS 30 37.080 2.909 -6.775 266 H MET 31 HN MET 31 43.971 4.220 -5.599 267 HA MET 31 HA MET 31 42.681 6.219 -4.199 268 HB2 MET 31 HB1 MET 31 43.418 4.082 -3.253 269 HB3 MET 31 HB2 MET 31 45.127 4.424 -3.630 270 HG2 MET 31 HG1 MET 31 43.633 6.296 -1.703 271 HG3 MET 31 HG2 MET 31 44.130 4.670 -1.133 272 HE1 MET 31 HE1 MET 31 48.007 4.738 -1.265 273 HE2 MET 31 HE2 MET 31 46.533 3.857 -0.740 274 HE3 MET 31 HE3 MET 31 46.878 4.067 -2.490 275 H LEU 32 HN LEU 32 46.111 6.110 -5.341 276 HA LEU 32 HA LEU 32 46.829 8.585 -4.289 277 HB2 LEU 32 HB1 LEU 32 47.873 6.768 -6.504 278 HB3 LEU 32 HB2 LEU 32 48.732 8.265 -6.069 279 HG LEU 32 HG LEU 32 47.904 6.213 -3.947 280 HD11 LEU 32 HD11 LEU 32 50.241 5.138 -4.153 281 HD12 LEU 32 HD12 LEU 32 49.198 4.871 -5.597 282 HD13 LEU 32 HD13 LEU 32 50.508 6.107 -5.646 283 HD21 LEU 32 HD21 LEU 32 49.918 7.041 -2.673 284 HD22 LEU 32 HD22 LEU 32 50.286 8.197 -3.992 285 HD23 LEU 32 HD23 LEU 32 48.755 8.359 -3.061 286 H GLU 33 HN GLU 33 45.574 7.709 -7.633 287 HA GLU 33 HA GLU 33 45.650 10.322 -8.594 288 HB2 GLU 33 HB1 GLU 33 45.441 8.299 -10.019 289 HB3 GLU 33 HB2 GLU 33 43.845 7.938 -9.325 290 HG2 GLU 33 HG1 GLU 33 42.901 10.037 -10.331 291 HG3 GLU 33 HG2 GLU 33 44.522 10.492 -10.981 292 H GLU 34 HN GLU 34 42.975 8.574 -6.851 293 HA GLU 34 HA GLU 34 41.019 10.527 -7.183 294 HB2 GLU 34 HB1 GLU 34 40.592 8.139 -6.552 295 HB3 GLU 34 HB2 GLU 34 41.390 8.393 -4.984 296 HG2 GLU 34 HG1 GLU 34 39.580 10.022 -4.321 297 HG3 GLU 34 HG2 GLU 34 38.763 9.783 -5.913 298 H THR 35 HN THR 35 43.429 10.058 -4.515 299 HA THR 35 HA THR 35 42.430 12.307 -3.111 300 HB THR 35 HB THR 35 44.474 12.071 -1.702 301 HG1 THR 35 HG1 THR 35 45.619 10.124 -1.948 302 HG21 THR 35 HG21 THR 35 43.673 9.908 -0.624 303 HG22 THR 35 HG22 THR 35 42.249 10.830 -1.216 304 HG23 THR 35 HG23 THR 35 42.857 9.417 -2.152 305 H GLY 36 HN GLY 36 44.511 12.070 -5.854 306 HA2 GLY 36 HA2 GLY 36 45.246 13.757 -7.079 307 HA3 GLY 36 HA1 GLY 36 44.748 14.900 -5.758 308 H THR 37 HN THR 37 47.135 12.177 -5.449 309 HA THR 37 HA THR 37 49.089 14.266 -4.846 310 HB THR 37 HB THR 37 48.485 12.939 -2.881 311 HG1 THR 37 HG1 THR 37 50.581 12.184 -2.389 312 HG21 THR 37 HG21 THR 37 48.998 10.473 -2.769 313 HG22 THR 37 HG22 THR 37 47.868 10.778 -4.131 314 HG23 THR 37 HG23 THR 37 49.614 10.489 -4.460 315 H LYS 38 HN LYS 38 51.265 14.067 -5.633 316 HA LYS 38 HA LYS 38 51.404 12.384 -8.015 317 HB2 LYS 38 HB1 LYS 38 51.817 14.872 -8.202 318 HB3 LYS 38 HB2 LYS 38 53.135 14.743 -7.010 319 HG2 LYS 38 HG1 LYS 38 54.393 13.218 -8.634 320 HG3 LYS 38 HG2 LYS 38 53.055 13.414 -9.815 321 HD2 LYS 38 HD1 LYS 38 54.746 15.745 -8.702 322 HD3 LYS 38 HD2 LYS 38 55.162 14.829 -10.191 323 HE2 LYS 38 HE1 LYS 38 54.095 16.731 -11.075 324 HE3 LYS 38 HE2 LYS 38 52.720 15.563 -11.003 325 HZ1 LYS 38 HZ1 LYS 38 52.129 17.708 -10.130 326 HZ2 LYS 38 HZ2 LYS 38 52.074 16.537 -8.901 327 HZ3 LYS 38 HZ3 LYS 38 53.366 17.633 -8.971 328 H VAL 39 HN VAL 39 52.082 10.346 -7.486 329 HA VAL 39 HA VAL 39 54.547 10.107 -5.917 330 HB VAL 39 HB VAL 39 52.052 8.375 -5.677 331 HG11 VAL 39 HG11 VAL 39 53.385 7.169 -3.879 332 HG12 VAL 39 HG12 VAL 39 54.130 6.983 -5.495 333 HG13 VAL 39 HG13 VAL 39 54.833 8.147 -4.307 334 HG21 VAL 39 HG21 VAL 39 52.128 9.212 -3.235 335 HG22 VAL 39 HG22 VAL 39 53.504 10.290 -3.674 336 HG23 VAL 39 HG23 VAL 39 51.873 10.557 -4.391 337 H SER 40 HN SER 40 56.118 8.779 -6.952 338 HA SER 40 HA SER 40 55.489 7.841 -9.522 339 HB2 SER 40 HB1 SER 40 57.798 8.574 -8.927 340 HB3 SER 40 HB2 SER 40 57.927 7.293 -7.681 341 HG SER 40 HG SER 40 58.924 6.897 -9.813 342 H ILE 41 HN ILE 41 54.820 5.913 -10.289 343 HA ILE 41 HA ILE 41 53.681 4.039 -8.564 344 HB ILE 41 HB ILE 41 54.278 4.038 -11.514 345 HG12 ILE 41 HG11 ILE 41 52.745 5.813 -11.009 346 HG13 ILE 41 HG12 ILE 41 51.777 4.491 -11.735 347 HG21 ILE 41 HG21 ILE 41 52.633 2.101 -11.722 348 HG22 ILE 41 HG22 ILE 41 53.902 1.627 -10.549 349 HG23 ILE 41 HG23 ILE 41 52.285 2.159 -9.958 350 HD11 ILE 41 HD11 ILE 41 50.549 5.490 -9.853 351 HD12 ILE 41 HD12 ILE 41 51.001 3.797 -9.435 352 HD13 ILE 41 HD13 ILE 41 51.915 5.180 -8.727 353 H SER 42 HN SER 42 56.781 4.013 -10.404 354 HA SER 42 HA SER 42 57.423 1.356 -9.934 355 HB2 SER 42 HB1 SER 42 58.552 2.796 -11.648 356 HB3 SER 42 HB2 SER 42 59.229 3.849 -10.366 357 HG SER 42 HG SER 42 60.631 2.154 -11.291 358 H THR 43 HN THR 43 58.149 4.312 -7.962 359 HA THR 43 HA THR 43 59.613 3.002 -5.990 360 HB THR 43 HB THR 43 57.794 5.444 -5.829 361 HG1 THR 43 HG1 THR 43 59.779 6.566 -5.998 362 HG21 THR 43 HG21 THR 43 59.152 6.125 -3.787 363 HG22 THR 43 HG22 THR 43 58.503 4.474 -3.503 364 HG23 THR 43 HG23 THR 43 60.226 4.693 -3.979 365 H VAL 44 HN VAL 44 56.048 3.610 -6.229 366 HA VAL 44 HA VAL 44 55.378 2.505 -3.770 367 HB VAL 44 HB VAL 44 53.889 2.833 -6.391 368 HG11 VAL 44 HG11 VAL 44 51.758 2.419 -5.091 369 HG12 VAL 44 HG12 VAL 44 52.765 0.944 -5.200 370 HG13 VAL 44 HG13 VAL 44 52.728 1.900 -3.669 371 HG21 VAL 44 HG21 VAL 44 52.771 4.692 -4.987 372 HG22 VAL 44 HG22 VAL 44 53.860 4.268 -3.615 373 HG23 VAL 44 HG23 VAL 44 54.540 4.934 -5.143 374 H LYS 45 HN LYS 45 55.606 0.891 -7.026 375 HA LYS 45 HA LYS 45 54.809 -1.616 -6.127 376 HB2 LYS 45 HB1 LYS 45 54.802 -0.918 -8.473 377 HB3 LYS 45 HB2 LYS 45 56.577 -0.760 -8.478 378 HG2 LYS 45 HG1 LYS 45 56.844 -3.218 -8.199 379 HG3 LYS 45 HG2 LYS 45 55.083 -3.421 -7.920 380 HD2 LYS 45 HD1 LYS 45 56.175 -2.204 -10.528 381 HD3 LYS 45 HD2 LYS 45 56.136 -3.983 -10.284 382 HE2 LYS 45 HE1 LYS 45 53.638 -3.887 -9.903 383 HE3 LYS 45 HE2 LYS 45 53.671 -2.099 -10.152 384 HZ1 LYS 45 HZ1 LYS 45 53.080 -3.282 -12.168 385 HZ2 LYS 45 HZ2 LYS 45 54.563 -2.481 -12.367 386 HZ3 LYS 45 HZ3 LYS 45 54.532 -4.159 -12.130 387 H ARG 46 HN ARG 46 58.088 -0.149 -6.259 388 HA ARG 46 HA ARG 46 59.549 -2.420 -5.517 389 HB2 ARG 46 HB1 ARG 46 60.523 -0.349 -6.465 390 HB3 ARG 46 HB2 ARG 46 60.149 0.546 -4.973 391 HG2 ARG 46 HG1 ARG 46 61.666 -1.122 -3.703 392 HG3 ARG 46 HG2 ARG 46 62.056 -1.902 -5.246 393 HD2 ARG 46 HD1 ARG 46 62.889 0.377 -6.147 394 HD3 ARG 46 HD2 ARG 46 62.844 0.982 -4.440 395 HE ARG 46 HE ARG 46 64.707 -0.948 -5.588 396 HH11 ARG 46 HH11 ARG 46 66.363 -1.409 -2.437 397 HH12 ARG 46 HH12 ARG 46 66.357 -1.757 -4.148 398 HH21 ARG 46 HH21 ARG 46 64.532 -0.168 -1.546 399 HH22 ARG 46 HH22 ARG 46 63.296 0.372 -2.629 400 H VAL 47 HN VAL 47 57.846 -0.018 -3.385 401 HA VAL 47 HA VAL 47 59.015 -0.793 -0.997 402 HB VAL 47 HB VAL 47 56.338 0.459 -1.644 403 HG11 VAL 47 HG11 VAL 47 56.201 1.109 0.802 404 HG12 VAL 47 HG12 VAL 47 56.054 -0.660 0.579 405 HG13 VAL 47 HG13 VAL 47 57.608 0.048 1.162 406 HG21 VAL 47 HG21 VAL 47 57.578 2.510 -0.675 407 HG22 VAL 47 HG22 VAL 47 59.048 1.489 -0.464 408 HG23 VAL 47 HG23 VAL 47 58.415 1.844 -2.112 409 H LEU 48 HN LEU 48 55.981 -2.189 -2.587 410 HA LEU 48 HA LEU 48 55.411 -3.888 -0.465 411 HB2 LEU 48 HB1 LEU 48 54.855 -4.086 -3.467 412 HB3 LEU 48 HB2 LEU 48 54.343 -5.385 -2.367 413 HG LEU 48 HG LEU 48 53.053 -3.595 -1.065 414 HD11 LEU 48 HD11 LEU 48 52.269 -1.564 -2.425 415 HD12 LEU 48 HD12 LEU 48 54.017 -1.489 -1.996 416 HD13 LEU 48 HD13 LEU 48 53.516 -1.949 -3.665 417 HD21 LEU 48 HD21 LEU 48 51.099 -3.718 -2.681 418 HD22 LEU 48 HD22 LEU 48 52.206 -4.295 -3.967 419 HD23 LEU 48 HD23 LEU 48 51.959 -5.288 -2.486 420 H TYR 49 HN TYR 49 57.495 -4.490 -3.427 421 HA TYR 49 HA TYR 49 58.187 -7.060 -2.647 422 HB2 TYR 49 HB1 TYR 49 59.448 -4.993 -4.490 423 HB3 TYR 49 HB2 TYR 49 60.375 -6.472 -4.096 424 HD1 TYR 49 HD1 TYR 49 57.370 -5.097 -5.856 425 HD2 TYR 49 HD2 TYR 49 59.435 -8.686 -4.696 426 HE1 TYR 49 HE1 TYR 49 56.028 -6.413 -7.488 427 HE2 TYR 49 HE2 TYR 49 58.113 -9.979 -6.323 428 HH TYR 49 HH TYR 49 56.572 -9.927 -7.926 429 H ARG 50 HN ARG 50 59.741 -3.899 -1.758 430 HA ARG 50 HA ARG 50 62.011 -5.069 -0.582 431 HB2 ARG 50 HB1 ARG 50 61.735 -2.643 -1.215 432 HB3 ARG 50 HB2 ARG 50 60.617 -2.418 0.150 433 HG2 ARG 50 HG1 ARG 50 62.575 -3.268 1.686 434 HG3 ARG 50 HG2 ARG 50 63.627 -3.206 0.260 435 HD2 ARG 50 HD1 ARG 50 64.132 -1.106 1.045 436 HD3 ARG 50 HD2 ARG 50 62.677 -0.631 0.074 437 HE ARG 50 HE ARG 50 61.763 -1.527 2.592 438 HH11 ARG 50 HH11 ARG 50 61.841 1.700 4.198 439 HH12 ARG 50 HH12 ARG 50 61.238 0.062 4.244 440 HH21 ARG 50 HH21 ARG 50 63.230 2.323 2.358 441 HH22 ARG 50 HH22 ARG 50 63.614 1.120 1.175 442 H HIS 51 HN HIS 51 58.861 -4.056 1.043 443 HA HIS 51 HA HIS 51 59.599 -5.139 3.502 444 HB2 HIS 51 HB1 HIS 51 56.954 -4.331 2.339 445 HB3 HIS 51 HB2 HIS 51 57.003 -5.255 3.865 446 HD1 HIS 51 HD1 HIS 51 57.144 -3.780 5.884 447 HD2 HIS 51 HD2 HIS 51 59.123 -1.967 2.660 448 HE1 HIS 51 HE1 HIS 51 58.165 -1.579 6.707 449 H ASN 52 HN ASN 52 57.867 -6.868 0.707 450 HA ASN 52 HA ASN 52 57.512 -9.154 2.246 451 HB2 ASN 52 HB1 ASN 52 57.854 -8.654 -0.765 452 HB3 ASN 52 HB2 ASN 52 57.599 -10.318 -0.155 453 HD21 ASN 52 HD21 ASN 52 54.292 -8.727 -1.114 454 HD22 ASN 52 HD22 ASN 52 55.792 -9.051 -1.948 455 H LEU 53 HN LEU 53 60.353 -8.143 0.203 456 HA LEU 53 HA LEU 53 61.787 -10.500 0.615 457 HB2 LEU 53 HB1 LEU 53 62.139 -8.922 -1.274 458 HB3 LEU 53 HB2 LEU 53 62.614 -7.626 -0.152 459 HG LEU 53 HG LEU 53 64.642 -8.994 0.498 460 HD11 LEU 53 HD11 LEU 53 65.322 -10.897 -1.075 461 HD12 LEU 53 HD12 LEU 53 63.849 -11.287 -0.115 462 HD13 LEU 53 HD13 LEU 53 63.697 -10.811 -1.846 463 HD21 LEU 53 HD21 LEU 53 65.901 -8.532 -1.634 464 HD22 LEU 53 HD22 LEU 53 64.357 -8.315 -2.517 465 HD23 LEU 53 HD23 LEU 53 64.798 -7.180 -1.191 466 H LYS 54 HN LYS 54 61.878 -7.343 2.374 467 HA LYS 54 HA LYS 54 63.666 -8.561 4.362 468 HB2 LYS 54 HB1 LYS 54 64.753 -6.735 2.939 469 HB3 LYS 54 HB2 LYS 54 63.420 -5.626 3.355 470 HG2 LYS 54 HG1 LYS 54 64.224 -5.991 5.868 471 HG3 LYS 54 HG2 LYS 54 65.716 -6.659 5.126 472 HD2 LYS 54 HD1 LYS 54 64.510 -3.853 4.586 473 HD3 LYS 54 HD2 LYS 54 65.875 -4.197 5.703 474 HE2 LYS 54 HE1 LYS 54 66.042 -4.835 2.696 475 HE3 LYS 54 HE2 LYS 54 66.474 -3.221 3.381 476 HZ1 LYS 54 HZ1 LYS 54 68.380 -4.671 3.211 477 HZ2 LYS 54 HZ2 LYS 54 68.045 -4.322 4.839 478 HZ3 LYS 54 HZ3 LYS 54 67.637 -5.836 4.195 479 H GLY 55 HN GLY 55 62.665 -8.811 6.359 480 HA2 GLY 55 HA2 GLY 55 60.114 -7.523 6.678 481 HA3 GLY 55 HA1 GLY 55 60.922 -8.741 7.757 482 H ARG 56 HN ARG 56 60.980 -5.231 6.798 483 HA ARG 56 HA ARG 56 62.548 -4.537 9.076 484 HB2 ARG 56 HB1 ARG 56 60.704 -2.834 7.320 485 HB3 ARG 56 HB2 ARG 56 61.775 -2.141 8.560 486 HG2 ARG 56 HG1 ARG 56 63.719 -3.341 7.172 487 HG3 ARG 56 HG2 ARG 56 62.508 -3.505 5.887 488 HD2 ARG 56 HD1 ARG 56 63.501 -1.437 5.290 489 HD3 ARG 56 HD2 ARG 56 62.040 -0.882 6.207 490 HE ARG 56 HE ARG 56 63.376 -0.516 8.156 491 HH11 ARG 56 HH11 ARG 56 66.832 0.406 8.008 492 HH12 ARG 56 HH12 ARG 56 65.363 0.374 8.952 493 HH21 ARG 56 HH21 ARG 56 66.749 -0.476 5.792 494 HH22 ARG 56 HH22 ARG 56 65.258 -1.147 5.227 495 H SER 57 HN SER 57 61.946 -4.423 11.209 496 HA SER 57 HA SER 57 59.580 -2.910 11.783 497 HB2 SER 57 HB1 SER 57 58.693 -5.297 11.847 498 HB3 SER 57 HB2 SER 57 60.027 -5.767 12.947 499 HG SER 57 HG SER 57 57.906 -5.217 13.912 500 H ALA 58 HN ALA 58 59.916 -1.729 13.680 501 HA ALA 58 HA ALA 58 61.069 -0.655 15.287 502 HB1 ALA 58 HB1 ALA 58 61.029 -2.802 16.453 503 HB2 ALA 58 HB2 ALA 58 62.598 -3.250 15.700 504 HB3 ALA 58 HB3 ALA 58 62.506 -1.850 16.837 505 H ARG 59 HN ARG 59 63.756 -2.632 14.031 506 HA ARG 59 HA ARG 59 65.008 -0.258 12.793 507 HB2 ARG 59 HB1 ARG 59 65.923 -0.633 15.091 508 HB3 ARG 59 HB2 ARG 59 66.299 -2.326 14.690 509 HG2 ARG 59 HG1 ARG 59 68.002 -1.523 13.028 510 HG3 ARG 59 HG2 ARG 59 67.584 0.160 13.392 511 HD2 ARG 59 HD1 ARG 59 68.407 -1.736 15.682 512 HD3 ARG 59 HD2 ARG 59 69.646 -0.786 14.763 513 HE ARG 59 HE ARG 59 67.590 0.260 16.590 514 HH11 ARG 59 HH11 ARG 59 70.333 2.596 14.572 515 HH12 ARG 59 HH12 ARG 59 70.130 0.897 14.229 516 HH21 ARG 59 HH21 ARG 59 68.979 3.558 16.282 517 HH22 ARG 59 HH22 ARG 59 67.824 2.550 17.084 518 H LYS 60 HN LYS 60 66.614 -3.514 12.888 519 HA LYS 60 HA LYS 60 64.776 -4.322 10.785 520 HB2 LYS 60 HB1 LYS 60 67.809 -4.598 10.710 521 HB3 LYS 60 HB2 LYS 60 66.749 -5.598 9.682 522 HG2 LYS 60 HG1 LYS 60 65.807 -3.471 8.634 523 HG3 LYS 60 HG2 LYS 60 66.882 -2.491 9.687 524 HD2 LYS 60 HD1 LYS 60 67.686 -4.423 7.427 525 HD3 LYS 60 HD2 LYS 60 67.795 -2.630 7.426 526 HE2 LYS 60 HE1 LYS 60 69.483 -4.530 9.186 527 HE3 LYS 60 HE2 LYS 60 70.038 -3.662 7.704 528 HZ1 LYS 60 HZ1 LYS 60 70.658 -2.506 9.714 529 HZ2 LYS 60 HZ2 LYS 60 69.559 -1.576 8.814 530 HZ3 LYS 60 HZ3 LYS 60 69.038 -2.394 10.205 531 H LEU 61 HN LEU 61 67.367 -5.646 13.048 532 HA LEU 61 HA LEU 61 67.532 -7.484 14.152 533 HB2 LEU 61 HB1 LEU 61 64.568 -7.061 14.475 534 HB3 LEU 61 HB2 LEU 61 65.432 -8.341 15.357 535 HG LEU 61 HG LEU 61 66.356 -5.413 15.315 536 HD11 LEU 61 HD11 LEU 61 65.226 -5.142 17.612 537 HD12 LEU 61 HD12 LEU 61 64.051 -5.385 16.267 538 HD13 LEU 61 HD13 LEU 61 64.448 -6.748 17.377 539 HD21 LEU 61 HD21 LEU 61 67.518 -5.981 17.488 540 HD22 LEU 61 HD22 LEU 61 66.949 -7.676 17.358 541 HD23 LEU 61 HD23 LEU 61 68.075 -7.012 16.120 542 H GLU 62 HN GLU 62 67.712 -8.316 11.512 543 HA GLU 62 HA GLU 62 65.993 -10.475 10.963 544 HB2 GLU 62 HB1 GLU 62 68.715 -9.598 9.884 545 HB3 GLU 62 HB2 GLU 62 67.841 -10.994 9.218 546 HG2 GLU 62 HG1 GLU 62 65.890 -9.500 8.605 547 HG3 GLU 62 HG2 GLU 62 66.732 -8.071 9.316 Start of MODEL 6 1 H1 ALA 1 HT1 ALA 1 60.016 5.275 17.129 2 H2 ALA 1 HT2 ALA 1 61.529 5.441 16.376 3 H3 ALA 1 HT3 ALA 1 60.362 4.399 15.716 4 HA ALA 1 HA ALA 1 58.916 6.257 15.212 5 HB1 ALA 1 HB1 ALA 1 59.626 7.605 17.187 6 HB2 ALA 1 HB2 ALA 1 61.215 7.925 16.410 7 HB3 ALA 1 HB3 ALA 1 59.703 8.596 15.688 8 H SER 2 HN SER 2 59.207 5.378 13.075 9 HA SER 2 HA SER 2 61.529 6.143 11.636 10 HB2 SER 2 HB1 SER 2 60.332 5.084 9.676 11 HB3 SER 2 HB2 SER 2 60.441 3.969 11.075 12 HG SER 2 HG SER 2 58.332 4.194 9.971 13 H MET 3 HN MET 3 61.558 7.477 9.615 14 HA MET 3 HA MET 3 59.735 9.702 9.825 15 HB2 MET 3 HB1 MET 3 62.053 9.070 7.914 16 HB3 MET 3 HB2 MET 3 61.114 10.584 7.834 17 HG2 MET 3 HG1 MET 3 62.872 9.638 10.231 18 HG3 MET 3 HG2 MET 3 63.312 10.907 9.042 19 HE1 MET 3 HE1 MET 3 61.043 13.900 9.880 20 HE2 MET 3 HE2 MET 3 62.460 13.282 8.966 21 HE3 MET 3 HE3 MET 3 60.816 12.655 8.606 22 H VAL 4 HN VAL 4 58.028 10.134 8.457 23 HA VAL 4 HA VAL 4 57.779 8.478 6.046 24 HB VAL 4 HB VAL 4 55.343 8.687 6.199 25 HG11 VAL 4 HG11 VAL 4 55.060 6.978 8.089 26 HG12 VAL 4 HG12 VAL 4 56.447 6.579 7.032 27 HG13 VAL 4 HG13 VAL 4 56.732 7.338 8.644 28 HG21 VAL 4 HG21 VAL 4 54.270 9.314 8.406 29 HG22 VAL 4 HG22 VAL 4 55.880 9.844 9.021 30 HG23 VAL 4 HG23 VAL 4 55.108 10.698 7.636 31 H LEU 5 HN LEU 5 57.071 9.604 4.180 32 HA LEU 5 HA LEU 5 57.984 12.227 3.997 33 HB2 LEU 5 HB1 LEU 5 56.350 10.433 2.137 34 HB3 LEU 5 HB2 LEU 5 56.784 12.089 1.653 35 HG LEU 5 HG LEU 5 59.221 11.451 2.039 36 HD11 LEU 5 HD11 LEU 5 59.823 8.960 1.780 37 HD12 LEU 5 HD12 LEU 5 59.022 9.320 3.352 38 HD13 LEU 5 HD13 LEU 5 58.089 8.545 2.020 39 HD21 LEU 5 HD21 LEU 5 59.405 10.287 -0.214 40 HD22 LEU 5 HD22 LEU 5 57.639 9.985 -0.193 41 HD23 LEU 5 HD23 LEU 5 58.259 11.674 -0.218 42 H SER 6 HN SER 6 54.597 10.897 4.124 43 HA SER 6 HA SER 6 53.832 13.480 5.183 44 HB2 SER 6 HB1 SER 6 51.643 13.374 3.934 45 HB3 SER 6 HB2 SER 6 53.002 13.553 2.781 46 HG SER 6 HG SER 6 51.335 11.911 2.314 47 HA PRO 7 HA PRO 7 51.961 10.584 8.020 48 HB2 PRO 7 HB2 PRO 7 50.201 12.143 9.422 49 HB3 PRO 7 HB1 PRO 7 51.990 12.379 9.542 50 HG2 PRO 7 HG2 PRO 7 50.088 13.956 7.742 51 HG3 PRO 7 HG1 PRO 7 51.321 14.602 8.906 52 HD2 PRO 7 HD2 PRO 7 51.872 14.235 6.212 53 HD3 PRO 7 HD1 PRO 7 53.146 14.022 7.510 54 H ARG 8 HN ARG 8 50.149 12.203 5.455 55 HA ARG 8 HA ARG 8 47.745 10.713 6.132 56 HB2 ARG 8 HB1 ARG 8 48.382 12.730 3.934 57 HB3 ARG 8 HB2 ARG 8 46.794 11.938 4.070 58 HG2 ARG 8 HG1 ARG 8 48.156 13.874 6.083 59 HG3 ARG 8 HG2 ARG 8 46.723 14.223 5.098 60 HD2 ARG 8 HD1 ARG 8 46.805 12.209 7.428 61 HD3 ARG 8 HD2 ARG 8 45.934 13.797 7.400 62 HE ARG 8 HE ARG 8 44.840 12.694 5.250 63 HH11 ARG 8 HH11 ARG 8 42.798 10.001 6.509 64 HH12 ARG 8 HH12 ARG 8 43.097 11.114 5.196 65 HH21 ARG 8 HH21 ARG 8 44.214 10.129 8.422 66 HH22 ARG 8 HH22 ARG 8 45.501 11.286 8.419 67 H ASP 9 HN ASP 9 50.222 10.748 3.323 68 HA ASP 9 HA ASP 9 48.611 8.577 2.293 69 HB2 ASP 9 HB1 ASP 9 50.919 10.256 1.097 70 HB3 ASP 9 HB2 ASP 9 50.125 8.909 0.212 71 H GLU 10 HN GLU 10 52.101 9.279 3.278 72 HA GLU 10 HA GLU 10 52.922 6.717 2.452 73 HB2 GLU 10 HB1 GLU 10 54.430 8.700 2.585 74 HB3 GLU 10 HB2 GLU 10 54.272 8.710 4.356 75 HG2 GLU 10 HG1 GLU 10 56.400 7.623 3.755 76 HG3 GLU 10 HG2 GLU 10 55.318 6.322 4.384 77 H ARG 11 HN ARG 11 52.016 8.050 5.684 78 HA ARG 11 HA ARG 11 52.658 5.737 7.159 79 HB2 ARG 11 HB1 ARG 11 52.263 8.009 8.114 80 HB3 ARG 11 HB2 ARG 11 50.542 7.928 7.666 81 HG2 ARG 11 HG1 ARG 11 50.384 5.831 9.211 82 HG3 ARG 11 HG2 ARG 11 52.051 6.152 9.721 83 HD2 ARG 11 HD1 ARG 11 49.731 8.149 10.110 84 HD3 ARG 11 HD2 ARG 11 50.471 7.129 11.412 85 HE ARG 11 HE ARG 11 51.610 9.512 10.148 86 HH11 ARG 11 HH11 ARG 11 54.342 9.439 12.491 87 HH12 ARG 11 HH12 ARG 11 53.478 10.361 11.286 88 HH21 ARG 11 HH21 ARG 11 53.584 7.229 12.958 89 HH22 ARG 11 HH22 ARG 11 52.190 6.640 12.120 90 H THR 12 HN THR 12 49.553 6.744 5.610 91 HA THR 12 HA THR 12 48.093 4.485 6.333 92 HB THR 12 HB THR 12 47.877 6.293 3.891 93 HG1 THR 12 HG1 THR 12 46.185 7.225 5.119 94 HG21 THR 12 HG21 THR 12 45.458 5.477 3.728 95 HG22 THR 12 HG22 THR 12 46.532 4.038 3.713 96 HG23 THR 12 HG23 THR 12 45.657 4.490 5.220 97 H LEU 13 HN LEU 13 50.139 5.099 3.378 98 HA LEU 13 HA LEU 13 49.543 2.706 2.151 99 HB2 LEU 13 HB1 LEU 13 50.637 4.596 1.015 100 HB3 LEU 13 HB2 LEU 13 52.027 4.534 2.124 101 HG LEU 13 HG LEU 13 52.664 2.318 1.194 102 HD11 LEU 13 HD11 LEU 13 51.621 1.551 -1.021 103 HD12 LEU 13 HD12 LEU 13 50.477 1.457 0.368 104 HD13 LEU 13 HD13 LEU 13 50.346 2.806 -0.819 105 HD21 LEU 13 HD21 LEU 13 53.484 3.166 -1.047 106 HD22 LEU 13 HD22 LEU 13 52.373 4.567 -0.925 107 HD23 LEU 13 HD23 LEU 13 53.699 4.370 0.276 108 H VAL 14 HN VAL 14 52.248 3.412 4.538 109 HA VAL 14 HA VAL 14 53.369 0.868 4.322 110 HB VAL 14 HB VAL 14 53.461 2.953 6.516 111 HG11 VAL 14 HG11 VAL 14 55.476 1.675 7.393 112 HG12 VAL 14 HG12 VAL 14 53.967 0.731 7.567 113 HG13 VAL 14 HG13 VAL 14 55.126 0.341 6.240 114 HG21 VAL 14 HG21 VAL 14 55.820 3.274 5.518 115 HG22 VAL 14 HG22 VAL 14 55.426 2.041 4.264 116 HG23 VAL 14 HG23 VAL 14 54.532 3.602 4.316 117 H ARG 15 HN ARG 15 50.855 2.109 6.750 118 HA ARG 15 HA ARG 15 50.793 -0.426 8.013 119 HB2 ARG 15 HB1 ARG 15 48.858 0.278 9.199 120 HB3 ARG 15 HB2 ARG 15 50.117 1.534 9.267 121 HG2 ARG 15 HG1 ARG 15 48.425 2.973 8.826 122 HG3 ARG 15 HG2 ARG 15 48.559 2.444 7.140 123 HD2 ARG 15 HD1 ARG 15 46.800 0.748 7.372 124 HD3 ARG 15 HD2 ARG 15 46.621 1.083 9.144 125 HE ARG 15 HE ARG 15 46.432 3.504 7.567 126 HH11 ARG 15 HH11 ARG 15 43.069 1.310 8.554 127 HH12 ARG 15 HH12 ARG 15 44.666 0.604 8.485 128 HH21 ARG 15 HH21 ARG 15 42.859 3.640 8.057 129 HH22 ARG 15 HH22 ARG 15 44.295 4.534 7.693 130 H LYS 16 HN LYS 16 48.842 0.896 5.229 131 HA LYS 16 HA LYS 16 46.939 -1.142 5.295 132 HB2 LYS 16 HB1 LYS 16 46.709 1.045 4.080 133 HB3 LYS 16 HB2 LYS 16 48.012 0.576 2.957 134 HG2 LYS 16 HG1 LYS 16 45.943 0.279 1.760 135 HG3 LYS 16 HG2 LYS 16 46.488 -1.376 2.188 136 HD2 LYS 16 HD1 LYS 16 44.137 -1.333 2.615 137 HD3 LYS 16 HD2 LYS 16 44.916 -1.233 4.230 138 HE2 LYS 16 HE1 LYS 16 44.511 1.236 4.316 139 HE3 LYS 16 HE2 LYS 16 43.801 1.199 2.657 140 HZ1 LYS 16 HZ1 LYS 16 42.104 1.127 4.367 141 HZ2 LYS 16 HZ2 LYS 16 42.107 -0.319 3.477 142 HZ3 LYS 16 HZ3 LYS 16 42.775 -0.282 5.035 143 H VAL 17 HN VAL 17 50.068 -0.936 3.370 144 HA VAL 17 HA VAL 17 49.621 -3.403 2.107 145 HB VAL 17 HB VAL 17 51.039 -1.602 1.215 146 HG11 VAL 17 HG11 VAL 17 53.467 -1.565 1.901 147 HG12 VAL 17 HG12 VAL 17 52.403 -0.964 3.207 148 HG13 VAL 17 HG13 VAL 17 53.090 -2.630 3.300 149 HG21 VAL 17 HG21 VAL 17 52.706 -3.226 0.234 150 HG22 VAL 17 HG22 VAL 17 52.180 -4.455 1.442 151 HG23 VAL 17 HG23 VAL 17 51.020 -3.833 0.213 152 H GLN 18 HN GLN 18 51.335 -2.553 5.216 153 HA GLN 18 HA GLN 18 52.320 -5.119 5.630 154 HB2 GLN 18 HB1 GLN 18 53.152 -3.081 6.722 155 HB3 GLN 18 HB2 GLN 18 51.603 -2.846 7.571 156 HG2 GLN 18 HG1 GLN 18 51.994 -4.887 8.962 157 HG3 GLN 18 HG2 GLN 18 53.426 -5.341 7.980 158 HE21 GLN 18 HE21 GLN 18 53.634 -2.122 10.623 159 HE22 GLN 18 HE22 GLN 18 52.088 -2.550 9.921 160 H ILE 19 HN ILE 19 49.128 -3.646 6.726 161 HA ILE 19 HA ILE 19 48.345 -5.951 8.095 162 HB ILE 19 HB ILE 19 46.899 -3.593 6.924 163 HG12 ILE 19 HG11 ILE 19 47.433 -4.354 9.873 164 HG13 ILE 19 HG12 ILE 19 48.449 -3.263 8.880 165 HG21 ILE 19 HG21 ILE 19 44.796 -4.331 8.161 166 HG22 ILE 19 HG22 ILE 19 45.298 -5.672 7.083 167 HG23 ILE 19 HG23 ILE 19 45.653 -5.756 8.847 168 HD11 ILE 19 HD11 ILE 19 46.937 -1.929 10.304 169 HD12 ILE 19 HD12 ILE 19 46.481 -1.704 8.577 170 HD13 ILE 19 HD13 ILE 19 45.492 -2.770 9.643 171 H ASN 20 HN ASN 20 47.611 -4.923 4.625 172 HA ASN 20 HA ASN 20 46.995 -7.734 4.231 173 HB2 ASN 20 HB1 ASN 20 45.214 -7.141 2.571 174 HB3 ASN 20 HB2 ASN 20 44.779 -6.773 4.268 175 HD21 ASN 20 HD21 ASN 20 44.637 -3.227 3.715 176 HD22 ASN 20 HD22 ASN 20 45.045 -4.412 4.932 177 HA PRO 21 HA PRO 21 50.237 -6.474 1.294 178 HB2 PRO 21 HB2 PRO 21 51.617 -8.821 1.089 179 HB3 PRO 21 HB1 PRO 21 51.721 -7.751 2.543 180 HG2 PRO 21 HG2 PRO 21 49.916 -10.189 2.276 181 HG3 PRO 21 HG1 PRO 21 51.079 -9.791 3.609 182 HD2 PRO 21 HD2 PRO 21 48.405 -9.087 3.758 183 HD3 PRO 21 HD1 PRO 21 49.735 -8.077 4.505 184 H ARG 22 HN ARG 22 47.617 -8.773 0.939 185 HA ARG 22 HA ARG 22 48.300 -9.478 -1.786 186 HB2 ARG 22 HB1 ARG 22 45.802 -9.920 -0.083 187 HB3 ARG 22 HB2 ARG 22 45.972 -10.569 -1.732 188 HG2 ARG 22 HG1 ARG 22 48.109 -11.809 -0.870 189 HG3 ARG 22 HG2 ARG 22 47.702 -11.254 0.764 190 HD2 ARG 22 HD1 ARG 22 45.443 -12.362 0.664 191 HD3 ARG 22 HD2 ARG 22 45.848 -13.062 -0.957 192 HE ARG 22 HE ARG 22 46.977 -13.826 1.649 193 HH11 ARG 22 HH11 ARG 22 48.123 -15.491 -1.954 194 HH12 ARG 22 HH12 ARG 22 47.100 -14.078 -1.867 195 HH21 ARG 22 HH21 ARG 22 48.841 -16.475 0.096 196 HH22 ARG 22 HH22 ARG 22 48.358 -15.730 1.582 197 H THR 23 HN THR 23 48.495 -7.002 -2.109 198 HA THR 23 HA THR 23 46.106 -6.223 -3.582 199 HB THR 23 HB THR 23 46.669 -3.840 -3.229 200 HG1 THR 23 HG1 THR 23 47.963 -3.306 -1.448 201 HG21 THR 23 HG21 THR 23 45.718 -3.650 -0.882 202 HG22 THR 23 HG22 THR 23 44.918 -5.017 -1.729 203 HG23 THR 23 HG23 THR 23 46.207 -5.343 -0.515 204 H THR 24 HN THR 24 46.691 -4.759 -5.507 205 HA THR 24 HA THR 24 49.445 -5.317 -6.323 206 HB THR 24 HB THR 24 48.718 -5.191 -8.662 207 HG1 THR 24 HG1 THR 24 46.500 -5.329 -9.126 208 HG21 THR 24 HG21 THR 24 47.507 -7.443 -8.745 209 HG22 THR 24 HG22 THR 24 48.708 -7.476 -7.409 210 HG23 THR 24 HG23 THR 24 46.961 -7.239 -7.042 211 H ALA 25 HN ALA 25 50.205 -3.643 -8.047 212 HA ALA 25 HA ALA 25 50.248 -1.115 -6.843 213 HB1 ALA 25 HB1 ALA 25 52.050 -2.022 -8.294 214 HB2 ALA 25 HB2 ALA 25 50.959 -1.931 -9.719 215 HB3 ALA 25 HB3 ALA 25 51.489 -0.420 -8.886 216 H LYS 26 HN LYS 26 48.032 -2.403 -9.302 217 HA LYS 26 HA LYS 26 46.976 -0.020 -10.241 218 HB2 LYS 26 HB1 LYS 26 45.828 -2.834 -9.858 219 HB3 LYS 26 HB2 LYS 26 44.867 -1.554 -10.642 220 HG2 LYS 26 HG1 LYS 26 47.662 -2.456 -11.638 221 HG3 LYS 26 HG2 LYS 26 46.133 -3.204 -12.206 222 HD2 LYS 26 HD1 LYS 26 45.370 -0.825 -12.894 223 HD3 LYS 26 HD2 LYS 26 47.031 -0.261 -12.500 224 HE2 LYS 26 HE1 LYS 26 48.013 -1.722 -14.249 225 HE3 LYS 26 HE2 LYS 26 46.408 -2.479 -14.575 226 HZ1 LYS 26 HZ1 LYS 26 46.916 -0.723 -16.153 227 HZ2 LYS 26 HZ2 LYS 26 45.570 -0.300 -15.208 228 HZ3 LYS 26 HZ3 LYS 26 47.079 0.410 -14.901 229 H ASP 27 HN ASP 27 46.072 -1.891 -7.228 230 HA ASP 27 HA ASP 27 43.826 -0.362 -6.630 231 HB2 ASP 27 HB1 ASP 27 45.893 -1.871 -4.863 232 HB3 ASP 27 HB2 ASP 27 44.333 -1.253 -4.219 233 H LEU 28 HN LEU 28 47.264 0.012 -5.752 234 HA LEU 28 HA LEU 28 47.014 2.303 -4.194 235 HB2 LEU 28 HB1 LEU 28 49.294 0.962 -5.679 236 HB3 LEU 28 HB2 LEU 28 49.566 2.521 -4.865 237 HG LEU 28 HG LEU 28 48.849 1.543 -2.717 238 HD11 LEU 28 HD11 LEU 28 48.763 -1.012 -2.396 239 HD12 LEU 28 HD12 LEU 28 47.379 -0.395 -3.371 240 HD13 LEU 28 HD13 LEU 28 48.763 -1.211 -4.184 241 HD21 LEU 28 HD21 LEU 28 50.897 0.079 -2.370 242 HD22 LEU 28 HD22 LEU 28 51.123 0.002 -4.146 243 HD23 LEU 28 HD23 LEU 28 51.230 1.587 -3.298 244 H VAL 29 HN VAL 29 47.570 1.920 -7.767 245 HA VAL 29 HA VAL 29 48.004 4.607 -8.348 246 HB VAL 29 HB VAL 29 46.757 2.339 -9.956 247 HG11 VAL 29 HG11 VAL 29 47.209 3.746 -12.016 248 HG12 VAL 29 HG12 VAL 29 45.957 4.484 -10.973 249 HG13 VAL 29 HG13 VAL 29 47.636 5.141 -10.966 250 HG21 VAL 29 HG21 VAL 29 49.043 2.397 -11.119 251 HG22 VAL 29 HG22 VAL 29 49.573 3.673 -9.962 252 HG23 VAL 29 HG23 VAL 29 49.183 2.015 -9.374 253 H LYS 30 HN LYS 30 44.825 2.753 -8.179 254 HA LYS 30 HA LYS 30 43.277 4.993 -8.763 255 HB2 LYS 30 HB1 LYS 30 42.678 2.485 -7.144 256 HB3 LYS 30 HB2 LYS 30 41.438 3.730 -7.442 257 HG2 LYS 30 HG1 LYS 30 41.952 3.418 -10.001 258 HG3 LYS 30 HG2 LYS 30 42.952 2.002 -9.534 259 HD2 LYS 30 HD1 LYS 30 39.925 2.394 -9.050 260 HD3 LYS 30 HD2 LYS 30 40.683 1.328 -10.280 261 HE2 LYS 30 HE1 LYS 30 41.763 0.009 -8.332 262 HE3 LYS 30 HE2 LYS 30 40.725 0.970 -7.211 263 HZ1 LYS 30 HZ1 LYS 30 39.675 -1.104 -7.861 264 HZ2 LYS 30 HZ2 LYS 30 38.788 0.219 -8.451 265 HZ3 LYS 30 HZ3 LYS 30 39.766 -0.682 -9.502 266 H MET 31 HN MET 31 44.483 3.803 -5.528 267 HA MET 31 HA MET 31 43.141 5.680 -4.005 268 HB2 MET 31 HB1 MET 31 44.205 3.654 -3.112 269 HB3 MET 31 HB2 MET 31 45.820 4.195 -3.636 270 HG2 MET 31 HG1 MET 31 44.253 5.864 -1.578 271 HG3 MET 31 HG2 MET 31 45.066 4.347 -1.074 272 HE1 MET 31 HE1 MET 31 47.600 6.628 0.522 273 HE2 MET 31 HE2 MET 31 45.804 6.595 0.580 274 HE3 MET 31 HE3 MET 31 46.731 5.056 0.560 275 H LEU 32 HN LEU 32 46.457 5.962 -5.538 276 HA LEU 32 HA LEU 32 46.955 8.497 -4.508 277 HB2 LEU 32 HB1 LEU 32 47.959 7.018 -6.997 278 HB3 LEU 32 HB2 LEU 32 48.631 8.591 -6.505 279 HG LEU 32 HG LEU 32 48.579 6.052 -4.760 280 HD11 LEU 32 HD11 LEU 32 51.096 5.901 -5.300 281 HD12 LEU 32 HD12 LEU 32 50.040 5.654 -6.738 282 HD13 LEU 32 HD13 LEU 32 50.880 7.229 -6.494 283 HD21 LEU 32 HD21 LEU 32 50.320 7.203 -3.346 284 HD22 LEU 32 HD22 LEU 32 50.174 8.682 -4.348 285 HD23 LEU 32 HD23 LEU 32 48.764 8.110 -3.385 286 H GLU 33 HN GLU 33 45.467 7.520 -7.710 287 HA GLU 33 HA GLU 33 45.159 10.130 -8.647 288 HB2 GLU 33 HB1 GLU 33 43.708 7.518 -9.277 289 HB3 GLU 33 HB2 GLU 33 43.342 9.029 -10.139 290 HG2 GLU 33 HG1 GLU 33 45.734 9.171 -10.946 291 HG3 GLU 33 HG2 GLU 33 46.157 7.672 -10.034 292 H GLU 34 HN GLU 34 42.864 8.051 -6.721 293 HA GLU 34 HA GLU 34 40.732 9.845 -6.748 294 HB2 GLU 34 HB1 GLU 34 40.574 7.419 -6.129 295 HB3 GLU 34 HB2 GLU 34 41.563 7.706 -4.679 296 HG2 GLU 34 HG1 GLU 34 39.751 9.195 -3.737 297 HG3 GLU 34 HG2 GLU 34 38.738 8.910 -5.202 298 H THR 35 HN THR 35 43.470 9.483 -4.392 299 HA THR 35 HA THR 35 42.600 11.514 -2.681 300 HB THR 35 HB THR 35 45.399 10.487 -3.288 301 HG1 THR 35 HG1 THR 35 45.059 9.317 -1.351 302 HG21 THR 35 HG21 THR 35 46.020 11.431 -0.985 303 HG22 THR 35 HG22 THR 35 45.293 12.760 -1.951 304 HG23 THR 35 HG23 THR 35 44.313 11.923 -0.694 305 H GLY 36 HN GLY 36 44.774 11.584 -5.546 306 HA2 GLY 36 HA2 GLY 36 44.794 13.348 -7.026 307 HA3 GLY 36 HA1 GLY 36 44.287 14.457 -5.680 308 H THR 37 HN THR 37 47.011 12.047 -5.935 309 HA THR 37 HA THR 37 48.861 14.277 -5.814 310 HB THR 37 HB THR 37 48.496 13.584 -3.469 311 HG1 THR 37 HG1 THR 37 50.672 13.091 -3.004 312 HG21 THR 37 HG21 THR 37 49.196 11.279 -2.701 313 HG22 THR 37 HG22 THR 37 47.928 11.116 -3.963 314 HG23 THR 37 HG23 THR 37 49.655 10.820 -4.380 315 H LYS 38 HN LYS 38 51.056 13.705 -6.571 316 HA LYS 38 HA LYS 38 51.023 11.242 -8.167 317 HB2 LYS 38 HB1 LYS 38 52.684 13.816 -8.422 318 HB3 LYS 38 HB2 LYS 38 52.963 12.370 -9.425 319 HG2 LYS 38 HG1 LYS 38 50.601 12.602 -10.367 320 HG3 LYS 38 HG2 LYS 38 50.346 14.051 -9.338 321 HD2 LYS 38 HD1 LYS 38 50.858 14.803 -11.587 322 HD3 LYS 38 HD2 LYS 38 52.276 15.177 -10.551 323 HE2 LYS 38 HE1 LYS 38 53.494 13.173 -11.455 324 HE3 LYS 38 HE2 LYS 38 52.067 12.760 -12.480 325 HZ1 LYS 38 HZ1 LYS 38 53.720 14.020 -13.698 326 HZ2 LYS 38 HZ2 LYS 38 52.284 14.913 -13.553 327 HZ3 LYS 38 HZ3 LYS 38 53.624 15.300 -12.589 328 H VAL 39 HN VAL 39 52.153 9.599 -7.337 329 HA VAL 39 HA VAL 39 54.723 10.140 -6.005 330 HB VAL 39 HB VAL 39 52.697 7.953 -5.325 331 HG11 VAL 39 HG11 VAL 39 54.349 7.404 -3.463 332 HG12 VAL 39 HG12 VAL 39 55.071 7.165 -5.082 333 HG13 VAL 39 HG13 VAL 39 55.484 8.634 -4.119 334 HG21 VAL 39 HG21 VAL 39 52.573 9.128 -3.052 335 HG22 VAL 39 HG22 VAL 39 53.588 10.462 -3.712 336 HG23 VAL 39 HG23 VAL 39 51.947 10.151 -4.383 337 H SER 40 HN SER 40 56.439 8.866 -6.967 338 HA SER 40 HA SER 40 55.810 8.013 -9.534 339 HB2 SER 40 HB1 SER 40 58.302 7.484 -7.787 340 HB3 SER 40 HB2 SER 40 58.259 7.138 -9.544 341 HG SER 40 HG SER 40 59.151 9.250 -8.828 342 H ILE 41 HN ILE 41 55.385 6.076 -10.491 343 HA ILE 41 HA ILE 41 54.234 4.157 -8.839 344 HB ILE 41 HB ILE 41 54.841 4.243 -11.783 345 HG12 ILE 41 HG11 ILE 41 53.298 5.998 -11.197 346 HG13 ILE 41 HG12 ILE 41 52.360 4.712 -12.019 347 HG21 ILE 41 HG21 ILE 41 53.199 2.306 -12.053 348 HG22 ILE 41 HG22 ILE 41 54.468 1.799 -10.893 349 HG23 ILE 41 HG23 ILE 41 52.850 2.309 -10.289 350 HD11 ILE 41 HD11 ILE 41 51.075 5.602 -10.125 351 HD12 ILE 41 HD12 ILE 41 51.526 3.892 -9.784 352 HD13 ILE 41 HD13 ILE 41 52.411 5.240 -8.977 353 H SER 42 HN SER 42 57.367 4.098 -10.675 354 HA SER 42 HA SER 42 57.845 1.402 -10.305 355 HB2 SER 42 HB1 SER 42 59.818 3.765 -10.533 356 HB3 SER 42 HB2 SER 42 60.329 2.055 -10.690 357 HG SER 42 HG SER 42 59.812 3.271 -12.704 358 H THR 43 HN THR 43 58.720 4.197 -8.185 359 HA THR 43 HA THR 43 60.209 2.724 -6.343 360 HB THR 43 HB THR 43 58.501 5.227 -5.998 361 HG1 THR 43 HG1 THR 43 60.531 6.268 -6.199 362 HG21 THR 43 HG21 THR 43 59.980 5.737 -3.975 363 HG22 THR 43 HG22 THR 43 59.280 4.098 -3.750 364 HG23 THR 43 HG23 THR 43 60.985 4.279 -4.301 365 H VAL 44 HN VAL 44 56.693 3.510 -6.433 366 HA VAL 44 HA VAL 44 55.996 2.259 -4.043 367 HB VAL 44 HB VAL 44 54.486 2.812 -6.635 368 HG11 VAL 44 HG11 VAL 44 52.357 2.472 -5.310 369 HG12 VAL 44 HG12 VAL 44 53.280 0.949 -5.482 370 HG13 VAL 44 HG13 VAL 44 53.321 1.856 -3.922 371 HG21 VAL 44 HG21 VAL 44 53.465 4.680 -5.200 372 HG22 VAL 44 HG22 VAL 44 54.555 4.201 -3.847 373 HG23 VAL 44 HG23 VAL 44 55.239 4.853 -5.379 374 H LYS 45 HN LYS 45 56.105 0.938 -7.430 375 HA LYS 45 HA LYS 45 55.117 -1.566 -6.717 376 HB2 LYS 45 HB1 LYS 45 55.043 -0.600 -8.969 377 HB3 LYS 45 HB2 LYS 45 56.822 -0.636 -9.084 378 HG2 LYS 45 HG1 LYS 45 56.843 -3.100 -9.114 379 HG3 LYS 45 HG2 LYS 45 55.118 -3.181 -8.623 380 HD2 LYS 45 HD1 LYS 45 54.478 -2.070 -10.808 381 HD3 LYS 45 HD2 LYS 45 56.213 -2.008 -11.271 382 HE2 LYS 45 HE1 LYS 45 55.177 -3.922 -12.422 383 HE3 LYS 45 HE2 LYS 45 56.276 -4.572 -11.148 384 HZ1 LYS 45 HZ1 LYS 45 54.132 -5.668 -11.137 385 HZ2 LYS 45 HZ2 LYS 45 54.362 -4.804 -9.694 386 HZ3 LYS 45 HZ3 LYS 45 53.331 -4.192 -10.893 387 H ARG 46 HN ARG 46 58.544 -0.415 -7.024 388 HA ARG 46 HA ARG 46 59.728 -2.885 -6.427 389 HB2 ARG 46 HB1 ARG 46 60.606 0.010 -6.000 390 HB3 ARG 46 HB2 ARG 46 61.684 -1.332 -5.554 391 HG2 ARG 46 HG1 ARG 46 60.560 -0.926 -8.406 392 HG3 ARG 46 HG2 ARG 46 62.045 -0.129 -7.857 393 HD2 ARG 46 HD1 ARG 46 62.827 -2.049 -9.026 394 HD3 ARG 46 HD2 ARG 46 63.030 -2.483 -7.280 395 HE ARG 46 HE ARG 46 60.450 -3.277 -8.278 396 HH11 ARG 46 HH11 ARG 46 63.744 -5.775 -8.491 397 HH12 ARG 46 HH12 ARG 46 63.875 -4.034 -8.485 398 HH21 ARG 46 HH21 ARG 46 61.563 -6.729 -8.334 399 HH22 ARG 46 HH22 ARG 46 60.208 -5.664 -8.180 400 H VAL 47 HN VAL 47 58.738 -0.208 -4.042 401 HA VAL 47 HA VAL 47 59.880 -1.623 -1.905 402 HB VAL 47 HB VAL 47 59.454 0.807 -1.924 403 HG11 VAL 47 HG11 VAL 47 57.215 1.613 -1.091 404 HG12 VAL 47 HG12 VAL 47 57.100 0.932 -2.742 405 HG13 VAL 47 HG13 VAL 47 56.533 -0.033 -1.326 406 HG21 VAL 47 HG21 VAL 47 58.903 0.840 0.542 407 HG22 VAL 47 HG22 VAL 47 58.466 -0.904 0.440 408 HG23 VAL 47 HG23 VAL 47 60.152 -0.368 0.105 409 H LEU 48 HN LEU 48 56.560 -1.710 -3.356 410 HA LEU 48 HA LEU 48 55.367 -3.120 -1.280 411 HB2 LEU 48 HB1 LEU 48 54.183 -1.799 -3.052 412 HB3 LEU 48 HB2 LEU 48 54.740 -2.936 -4.302 413 HG LEU 48 HG LEU 48 53.082 -3.944 -1.965 414 HD11 LEU 48 HD11 LEU 48 50.967 -3.346 -3.335 415 HD12 LEU 48 HD12 LEU 48 51.866 -1.907 -2.728 416 HD13 LEU 48 HD13 LEU 48 52.015 -2.405 -4.454 417 HD21 LEU 48 HD21 LEU 48 52.069 -5.510 -3.651 418 HD22 LEU 48 HD22 LEU 48 53.076 -4.795 -4.951 419 HD23 LEU 48 HD23 LEU 48 53.862 -5.669 -3.587 420 H TYR 49 HN TYR 49 56.846 -4.384 -4.423 421 HA TYR 49 HA TYR 49 56.437 -7.009 -3.558 422 HB2 TYR 49 HB1 TYR 49 57.919 -5.679 -5.833 423 HB3 TYR 49 HB2 TYR 49 58.372 -7.368 -5.454 424 HD1 TYR 49 HD1 TYR 49 56.773 -9.139 -5.688 425 HD2 TYR 49 HD2 TYR 49 55.567 -5.118 -6.637 426 HE1 TYR 49 HE1 TYR 49 54.709 -10.011 -6.745 427 HE2 TYR 49 HE2 TYR 49 53.477 -5.997 -7.638 428 HH TYR 49 HH TYR 49 52.241 -7.796 -8.088 429 H ARG 50 HN ARG 50 59.413 -4.867 -3.231 430 HA ARG 50 HA ARG 50 61.057 -7.143 -3.027 431 HB2 ARG 50 HB1 ARG 50 61.817 -4.932 -3.789 432 HB3 ARG 50 HB2 ARG 50 61.609 -4.263 -2.154 433 HG2 ARG 50 HG1 ARG 50 63.343 -5.934 -1.299 434 HG3 ARG 50 HG2 ARG 50 63.509 -6.604 -2.931 435 HD2 ARG 50 HD1 ARG 50 65.356 -5.111 -2.817 436 HD3 ARG 50 HD2 ARG 50 64.133 -4.159 -3.754 437 HE ARG 50 HE ARG 50 63.963 -3.840 -0.847 438 HH11 ARG 50 HH11 ARG 50 65.148 -0.452 -1.082 439 HH12 ARG 50 HH12 ARG 50 64.395 -1.671 -0.083 440 HH21 ARG 50 HH21 ARG 50 65.681 -1.038 -3.339 441 HH22 ARG 50 HH22 ARG 50 65.340 -2.648 -3.872 442 H HIS 51 HN HIS 51 59.682 -5.037 -0.375 443 HA HIS 51 HA HIS 51 61.070 -6.364 1.662 444 HB2 HIS 51 HB1 HIS 51 58.525 -4.672 1.702 445 HB3 HIS 51 HB2 HIS 51 59.214 -5.383 3.188 446 HD1 HIS 51 HD1 HIS 51 59.421 -2.713 3.820 447 HD2 HIS 51 HD2 HIS 51 62.105 -4.109 0.908 448 HE1 HIS 51 HE1 HIS 51 61.307 -0.987 3.563 449 H ASN 52 HN ASN 52 57.719 -7.013 0.324 450 HA ASN 52 HA ASN 52 57.232 -9.061 2.146 451 HB2 ASN 52 HB1 ASN 52 56.188 -8.401 -0.662 452 HB3 ASN 52 HB2 ASN 52 55.593 -9.859 0.189 453 HD21 ASN 52 HD21 ASN 52 54.022 -6.204 1.051 454 HD22 ASN 52 HD22 ASN 52 55.010 -6.525 -0.352 455 H LEU 53 HN LEU 53 58.854 -9.116 -1.102 456 HA LEU 53 HA LEU 53 58.800 -11.944 -1.220 457 HB2 LEU 53 HB1 LEU 53 58.617 -10.367 -3.162 458 HB3 LEU 53 HB2 LEU 53 60.273 -9.790 -2.864 459 HG LEU 53 HG LEU 53 59.904 -11.230 -4.774 460 HD11 LEU 53 HD11 LEU 53 61.942 -12.802 -4.467 461 HD12 LEU 53 HD12 LEU 53 62.225 -11.085 -4.001 462 HD13 LEU 53 HD13 LEU 53 61.955 -12.334 -2.730 463 HD21 LEU 53 HD21 LEU 53 59.697 -13.773 -4.486 464 HD22 LEU 53 HD22 LEU 53 59.383 -13.512 -2.741 465 HD23 LEU 53 HD23 LEU 53 58.251 -12.836 -3.964 466 H LYS 54 HN LYS 54 61.401 -9.498 -0.429 467 HA LYS 54 HA LYS 54 62.904 -11.728 0.754 468 HB2 LYS 54 HB1 LYS 54 64.028 -10.821 -1.361 469 HB3 LYS 54 HB2 LYS 54 64.023 -9.192 -0.636 470 HG2 LYS 54 HG1 LYS 54 65.471 -10.145 1.295 471 HG3 LYS 54 HG2 LYS 54 65.539 -11.701 0.402 472 HD2 LYS 54 HD1 LYS 54 66.711 -8.975 -0.415 473 HD3 LYS 54 HD2 LYS 54 67.600 -10.463 0.056 474 HE2 LYS 54 HE1 LYS 54 66.714 -11.598 -2.049 475 HE3 LYS 54 HE2 LYS 54 65.994 -10.017 -2.541 476 HZ1 LYS 54 HZ1 LYS 54 68.215 -10.322 -3.456 477 HZ2 LYS 54 HZ2 LYS 54 68.198 -9.022 -2.364 478 HZ3 LYS 54 HZ3 LYS 54 68.871 -10.507 -1.902 479 H GLY 55 HN GLY 55 63.456 -11.405 2.963 480 HA2 GLY 55 HA2 GLY 55 62.368 -9.012 4.121 481 HA3 GLY 55 HA1 GLY 55 63.182 -10.411 4.947 482 H ARG 56 HN ARG 56 63.524 -7.241 3.535 483 HA ARG 56 HA ARG 56 66.414 -7.170 3.704 484 HB2 ARG 56 HB1 ARG 56 64.302 -5.014 3.180 485 HB3 ARG 56 HB2 ARG 56 66.050 -4.695 3.090 486 HG2 ARG 56 HG1 ARG 56 64.439 -6.681 1.323 487 HG3 ARG 56 HG2 ARG 56 64.941 -5.060 0.814 488 HD2 ARG 56 HD1 ARG 56 67.019 -7.179 1.612 489 HD3 ARG 56 HD2 ARG 56 66.456 -6.942 -0.093 490 HE ARG 56 HE ARG 56 67.162 -4.571 0.109 491 HH11 ARG 56 HH11 ARG 56 70.076 -6.028 2.630 492 HH12 ARG 56 HH12 ARG 56 68.488 -6.750 2.542 493 HH21 ARG 56 HH21 ARG 56 70.547 -4.190 1.190 494 HH22 ARG 56 HH22 ARG 56 69.318 -3.672 0.087 495 H SER 57 HN SER 57 66.543 -7.807 5.934 496 HA SER 57 HA SER 57 66.701 -7.626 8.087 497 HB2 SER 57 HB1 SER 57 68.037 -5.550 7.469 498 HB3 SER 57 HB2 SER 57 66.580 -4.562 7.800 499 HG SER 57 HG SER 57 68.171 -4.849 9.556 500 H ALA 58 HN ALA 58 65.509 -5.782 10.041 501 HA ALA 58 HA ALA 58 62.634 -6.254 9.606 502 HB1 ALA 58 HB1 ALA 58 63.532 -8.222 10.836 503 HB2 ALA 58 HB2 ALA 58 64.244 -7.133 12.075 504 HB3 ALA 58 HB3 ALA 58 62.452 -7.244 11.889 505 H ARG 59 HN ARG 59 64.858 -5.025 12.142 506 HA ARG 59 HA ARG 59 64.697 -3.341 13.616 507 HB2 ARG 59 HB1 ARG 59 63.638 -1.946 11.180 508 HB3 ARG 59 HB2 ARG 59 63.746 -1.089 12.736 509 HG2 ARG 59 HG1 ARG 59 65.777 -0.530 11.571 510 HG3 ARG 59 HG2 ARG 59 66.289 -1.747 12.755 511 HD2 ARG 59 HD1 ARG 59 67.408 -2.092 10.587 512 HD3 ARG 59 HD2 ARG 59 66.414 -3.537 11.043 513 HE ARG 59 HE ARG 59 64.865 -3.073 9.395 514 HH11 ARG 59 HH11 ARG 59 65.292 -0.876 6.592 515 HH12 ARG 59 HH12 ARG 59 64.491 -2.291 7.232 516 HH21 ARG 59 HH21 ARG 59 66.935 0.185 7.958 517 HH22 ARG 59 HH22 ARG 59 67.236 -0.458 9.535 518 H LYS 60 HN LYS 60 61.883 -1.543 12.741 519 HA LYS 60 HA LYS 60 60.545 -2.831 15.000 520 HB2 LYS 60 HB1 LYS 60 60.293 -0.010 13.818 521 HB3 LYS 60 HB2 LYS 60 59.288 -0.605 15.165 522 HG2 LYS 60 HG1 LYS 60 61.459 -0.993 16.517 523 HG3 LYS 60 HG2 LYS 60 62.384 -0.280 15.154 524 HD2 LYS 60 HD1 LYS 60 60.969 1.852 15.453 525 HD3 LYS 60 HD2 LYS 60 60.261 1.097 16.921 526 HE2 LYS 60 HE1 LYS 60 62.630 0.867 17.890 527 HE3 LYS 60 HE2 LYS 60 63.255 1.780 16.464 528 HZ1 LYS 60 HZ1 LYS 60 62.845 3.217 18.349 529 HZ2 LYS 60 HZ2 LYS 60 61.801 3.609 17.069 530 HZ3 LYS 60 HZ3 LYS 60 61.215 2.750 18.407 531 H LEU 61 HN LEU 61 58.529 -3.581 14.857 532 HA LEU 61 HA LEU 61 56.580 -4.227 14.198 533 HB2 LEU 61 HB1 LEU 61 56.780 -1.902 12.256 534 HB3 LEU 61 HB2 LEU 61 55.391 -3.011 12.175 535 HG LEU 61 HG LEU 61 54.888 -0.995 13.303 536 HD11 LEU 61 HD11 LEU 61 53.937 -1.961 15.525 537 HD12 LEU 61 HD12 LEU 61 53.613 -2.945 14.051 538 HD13 LEU 61 HD13 LEU 61 54.905 -3.443 15.204 539 HD21 LEU 61 HD21 LEU 61 55.771 -0.344 15.603 540 HD22 LEU 61 HD22 LEU 61 57.024 -1.617 15.465 541 HD23 LEU 61 HD23 LEU 61 57.007 -0.248 14.298 542 H GLU 62 HN GLU 62 58.672 -3.739 11.227 543 HA GLU 62 HA GLU 62 57.076 -5.412 9.659 544 HB2 GLU 62 HB1 GLU 62 58.467 -3.567 8.783 545 HB3 GLU 62 HB2 GLU 62 59.949 -4.422 9.262 546 HG2 GLU 62 HG1 GLU 62 59.471 -6.266 7.647 547 HG3 GLU 62 HG2 GLU 62 57.861 -5.562 7.240 Start of MODEL 7 1 H1 ALA 1 HT1 ALA 1 41.278 5.933 8.597 2 H2 ALA 1 HT2 ALA 1 42.942 5.894 8.932 3 H3 ALA 1 HT3 ALA 1 42.397 6.329 7.383 4 HA ALA 1 HA ALA 1 41.367 8.326 8.254 5 HB1 ALA 1 HB1 ALA 1 40.799 7.299 10.459 6 HB2 ALA 1 HB2 ALA 1 42.532 7.332 10.932 7 HB3 ALA 1 HB3 ALA 1 41.628 8.877 10.698 8 H SER 2 HN SER 2 44.556 6.923 8.591 9 HA SER 2 HA SER 2 46.005 9.247 9.034 10 HB2 SER 2 HB1 SER 2 46.753 6.579 7.679 11 HB3 SER 2 HB2 SER 2 47.979 7.802 8.136 12 HG SER 2 HG SER 2 47.509 6.031 9.699 13 H MET 3 HN MET 3 47.260 10.616 7.684 14 HA MET 3 HA MET 3 46.007 11.034 5.153 15 HB2 MET 3 HB1 MET 3 48.184 12.521 6.709 16 HB3 MET 3 HB2 MET 3 47.558 13.109 5.147 17 HG2 MET 3 HG1 MET 3 45.223 13.313 6.181 18 HG3 MET 3 HG2 MET 3 45.857 12.654 7.724 19 HE1 MET 3 HE1 MET 3 46.777 16.828 5.841 20 HE2 MET 3 HE2 MET 3 47.322 15.286 5.096 21 HE3 MET 3 HE3 MET 3 45.567 15.650 5.226 22 H VAL 4 HN VAL 4 46.996 11.105 3.066 23 HA VAL 4 HA VAL 4 49.548 9.710 2.879 24 HB VAL 4 HB VAL 4 47.585 8.793 1.691 25 HG11 VAL 4 HG11 VAL 4 46.872 9.921 -0.459 26 HG12 VAL 4 HG12 VAL 4 46.417 10.886 0.978 27 HG13 VAL 4 HG13 VAL 4 47.841 11.369 -0.018 28 HG21 VAL 4 HG21 VAL 4 48.829 8.396 -0.457 29 HG22 VAL 4 HG22 VAL 4 50.018 9.660 0.025 30 HG23 VAL 4 HG23 VAL 4 49.835 8.163 1.007 31 H LEU 5 HN LEU 5 48.126 12.905 2.545 32 HA LEU 5 HA LEU 5 49.965 14.062 0.817 33 HB2 LEU 5 HB1 LEU 5 48.202 15.201 3.049 34 HB3 LEU 5 HB2 LEU 5 49.223 16.266 2.054 35 HG LEU 5 HG LEU 5 47.023 16.393 1.347 36 HD11 LEU 5 HD11 LEU 5 47.137 15.610 -1.138 37 HD12 LEU 5 HD12 LEU 5 48.585 16.505 -0.548 38 HD13 LEU 5 HD13 LEU 5 48.635 14.710 -0.706 39 HD21 LEU 5 HD21 LEU 5 45.615 14.500 0.368 40 HD22 LEU 5 HD22 LEU 5 46.849 13.323 0.925 41 HD23 LEU 5 HD23 LEU 5 45.958 14.323 2.128 42 H SER 6 HN SER 6 50.093 13.549 4.330 43 HA SER 6 HA SER 6 52.222 15.346 4.799 44 HB2 SER 6 HB1 SER 6 52.021 14.462 7.156 45 HB3 SER 6 HB2 SER 6 50.418 14.929 6.505 46 HG SER 6 HG SER 6 50.622 12.807 7.592 47 HA PRO 7 HA PRO 7 55.697 12.687 4.197 48 HB2 PRO 7 HB2 PRO 7 57.507 13.119 6.193 49 HB3 PRO 7 HB1 PRO 7 57.001 14.423 5.046 50 HG2 PRO 7 HG2 PRO 7 55.866 13.942 7.839 51 HG3 PRO 7 HG1 PRO 7 56.502 15.491 7.141 52 HD2 PRO 7 HD2 PRO 7 53.808 14.852 7.067 53 HD3 PRO 7 HD1 PRO 7 54.627 15.823 5.749 54 H ARG 8 HN ARG 8 53.617 11.974 6.672 55 HA ARG 8 HA ARG 8 54.745 9.479 7.588 56 HB2 ARG 8 HB1 ARG 8 51.978 10.780 7.785 57 HB3 ARG 8 HB2 ARG 8 52.357 9.233 8.581 58 HG2 ARG 8 HG1 ARG 8 54.155 10.407 9.952 59 HG3 ARG 8 HG2 ARG 8 53.850 11.926 9.089 60 HD2 ARG 8 HD1 ARG 8 52.752 12.015 11.298 61 HD3 ARG 8 HD2 ARG 8 51.497 12.069 9.995 62 HE ARG 8 HE ARG 8 51.881 9.366 10.551 63 HH11 ARG 8 HH11 ARG 8 49.381 9.146 13.144 64 HH12 ARG 8 HH12 ARG 8 50.183 8.331 11.824 65 HH21 ARG 8 HH21 ARG 8 49.898 11.455 13.505 66 HH22 ARG 8 HH22 ARG 8 51.071 12.203 12.475 67 H ASP 9 HN ASP 9 53.887 10.215 4.545 68 HA ASP 9 HA ASP 9 51.714 8.669 3.905 69 HB2 ASP 9 HB1 ASP 9 52.493 9.006 1.522 70 HB3 ASP 9 HB2 ASP 9 52.513 10.542 2.454 71 H GLU 10 HN GLU 10 55.210 7.716 3.985 72 HA GLU 10 HA GLU 10 54.909 5.243 2.751 73 HB2 GLU 10 HB1 GLU 10 57.092 6.374 3.179 74 HB3 GLU 10 HB2 GLU 10 56.868 6.189 4.933 75 HG2 GLU 10 HG1 GLU 10 56.987 3.689 4.715 76 HG3 GLU 10 HG2 GLU 10 57.128 3.820 2.921 77 H ARG 11 HN ARG 11 54.560 6.160 6.220 78 HA ARG 11 HA ARG 11 54.007 3.580 7.202 79 HB2 ARG 11 HB1 ARG 11 54.644 5.503 8.612 80 HB3 ARG 11 HB2 ARG 11 53.150 6.371 8.190 81 HG2 ARG 11 HG1 ARG 11 51.836 4.458 9.321 82 HG3 ARG 11 HG2 ARG 11 53.380 3.728 9.799 83 HD2 ARG 11 HD1 ARG 11 54.076 5.735 11.091 84 HD3 ARG 11 HD2 ARG 11 52.555 6.610 10.645 85 HE ARG 11 HE ARG 11 51.830 4.086 11.697 86 HH11 ARG 11 HH11 ARG 11 51.402 5.312 15.079 87 HH12 ARG 11 HH12 ARG 11 50.962 4.093 13.908 88 HH21 ARG 11 HH21 ARG 11 52.837 7.081 14.359 89 HH22 ARG 11 HH22 ARG 11 53.413 7.060 12.728 90 H THR 12 HN THR 12 51.756 6.136 5.940 91 HA THR 12 HA THR 12 49.425 4.692 6.393 92 HB THR 12 HB THR 12 50.133 6.751 4.257 93 HG1 THR 12 HG1 THR 12 49.039 8.152 5.704 94 HG21 THR 12 HG21 THR 12 47.629 7.201 4.082 95 HG22 THR 12 HG22 THR 12 47.900 5.451 3.791 96 HG23 THR 12 HG23 THR 12 47.288 6.011 5.388 97 H LEU 13 HN LEU 13 51.555 4.759 3.443 98 HA LEU 13 HA LEU 13 49.964 3.034 1.951 99 HB2 LEU 13 HB1 LEU 13 51.686 4.563 1.042 100 HB3 LEU 13 HB2 LEU 13 52.975 3.672 1.884 101 HG LEU 13 HG LEU 13 51.187 2.236 -0.109 102 HD11 LEU 13 HD11 LEU 13 52.836 2.953 -1.973 103 HD12 LEU 13 HD12 LEU 13 51.867 4.321 -1.316 104 HD13 LEU 13 HD13 LEU 13 53.584 4.106 -0.812 105 HD21 LEU 13 HD21 LEU 13 53.269 0.939 -0.665 106 HD22 LEU 13 HD22 LEU 13 54.207 1.900 0.522 107 HD23 LEU 13 HD23 LEU 13 52.865 0.843 1.087 108 H VAL 14 HN VAL 14 52.764 2.305 4.166 109 HA VAL 14 HA VAL 14 52.794 -0.451 3.756 110 HB VAL 14 HB VAL 14 53.712 1.270 6.057 111 HG11 VAL 14 HG11 VAL 14 55.042 -0.751 6.819 112 HG12 VAL 14 HG12 VAL 14 53.280 -1.013 6.994 113 HG13 VAL 14 HG13 VAL 14 54.173 -1.771 5.620 114 HG21 VAL 14 HG21 VAL 14 55.991 0.620 4.998 115 HG22 VAL 14 HG22 VAL 14 55.106 -0.287 3.718 116 HG23 VAL 14 HG23 VAL 14 54.950 1.502 3.837 117 H ARG 15 HN ARG 15 50.898 1.521 6.131 118 HA ARG 15 HA ARG 15 49.775 -0.619 7.539 119 HB2 ARG 15 HB1 ARG 15 49.709 1.733 8.276 120 HB3 ARG 15 HB2 ARG 15 48.688 2.195 6.893 121 HG2 ARG 15 HG1 ARG 15 47.261 2.080 8.847 122 HG3 ARG 15 HG2 ARG 15 46.843 0.676 7.848 123 HD2 ARG 15 HD1 ARG 15 48.106 -0.890 9.228 124 HD3 ARG 15 HD2 ARG 15 48.779 0.441 10.257 125 HE ARG 15 HE ARG 15 45.944 0.706 10.160 126 HH11 ARG 15 HH11 ARG 15 45.429 -1.034 13.288 127 HH12 ARG 15 HH12 ARG 15 44.822 0.169 12.176 128 HH21 ARG 15 HH21 ARG 15 47.548 -2.026 12.805 129 HH22 ARG 15 HH22 ARG 15 48.372 -1.546 11.362 130 H LYS 16 HN LYS 16 48.503 0.991 4.498 131 HA LYS 16 HA LYS 16 46.219 -0.592 4.352 132 HB2 LYS 16 HB1 LYS 16 47.943 0.771 2.213 133 HB3 LYS 16 HB2 LYS 16 46.418 -0.053 1.792 134 HG2 LYS 16 HG1 LYS 16 46.638 2.285 3.825 135 HG3 LYS 16 HG2 LYS 16 46.279 2.515 2.081 136 HD2 LYS 16 HD1 LYS 16 44.230 1.015 2.391 137 HD3 LYS 16 HD2 LYS 16 44.595 0.959 4.149 138 HE2 LYS 16 HE1 LYS 16 44.344 3.467 4.298 139 HE3 LYS 16 HE2 LYS 16 43.993 3.541 2.530 140 HZ1 LYS 16 HZ1 LYS 16 41.977 3.509 3.850 141 HZ2 LYS 16 HZ2 LYS 16 42.086 2.102 2.905 142 HZ3 LYS 16 HZ3 LYS 16 42.418 2.034 4.565 143 H VAL 17 HN VAL 17 49.514 -1.168 2.983 144 HA VAL 17 HA VAL 17 48.934 -3.559 1.669 145 HB VAL 17 HB VAL 17 51.504 -2.405 2.785 146 HG11 VAL 17 HG11 VAL 17 52.693 -4.037 1.247 147 HG12 VAL 17 HG12 VAL 17 51.824 -4.882 2.565 148 HG13 VAL 17 HG13 VAL 17 51.126 -4.847 0.900 149 HG21 VAL 17 HG21 VAL 17 51.862 -1.896 0.282 150 HG22 VAL 17 HG22 VAL 17 50.222 -2.559 -0.058 151 HG23 VAL 17 HG23 VAL 17 50.411 -1.073 0.939 152 H GLN 18 HN GLN 18 50.140 -3.023 5.119 153 HA GLN 18 HA GLN 18 50.275 -5.743 5.672 154 HB2 GLN 18 HB1 GLN 18 49.802 -3.309 7.456 155 HB3 GLN 18 HB2 GLN 18 49.983 -4.944 8.142 156 HG2 GLN 18 HG1 GLN 18 52.326 -5.095 7.070 157 HG3 GLN 18 HG2 GLN 18 52.122 -3.429 6.433 158 HE21 GLN 18 HE21 GLN 18 52.280 -2.016 9.840 159 HE22 GLN 18 HE22 GLN 18 51.249 -1.884 8.430 160 H ILE 19 HN ILE 19 47.446 -3.435 6.117 161 HA ILE 19 HA ILE 19 45.856 -5.360 7.359 162 HB ILE 19 HB ILE 19 45.282 -2.817 5.876 163 HG12 ILE 19 HG11 ILE 19 46.467 -2.470 7.979 164 HG13 ILE 19 HG12 ILE 19 44.782 -1.879 8.138 165 HG21 ILE 19 HG21 ILE 19 42.896 -2.917 6.737 166 HG22 ILE 19 HG22 ILE 19 43.214 -4.409 5.796 167 HG23 ILE 19 HG23 ILE 19 43.228 -4.461 7.598 168 HD11 ILE 19 HD11 ILE 19 45.471 -3.008 10.204 169 HD12 ILE 19 HD12 ILE 19 44.171 -3.967 9.408 170 HD13 ILE 19 HD13 ILE 19 45.886 -4.512 9.310 171 H ASN 20 HN ASN 20 46.035 -4.462 3.758 172 HA ASN 20 HA ASN 20 44.676 -7.025 3.412 173 HB2 ASN 20 HB1 ASN 20 43.308 -5.043 2.609 174 HB3 ASN 20 HB2 ASN 20 44.649 -4.555 1.527 175 HD21 ASN 20 HD21 ASN 20 42.658 -6.434 -0.844 176 HD22 ASN 20 HD22 ASN 20 42.972 -4.832 -0.222 177 HA PRO 21 HA PRO 21 48.848 -7.624 1.697 178 HB2 PRO 21 HB2 PRO 21 49.003 -10.351 1.879 179 HB3 PRO 21 HB1 PRO 21 49.125 -9.275 3.328 180 HG2 PRO 21 HG2 PRO 21 46.596 -10.686 2.376 181 HG3 PRO 21 HG1 PRO 21 47.328 -10.690 4.036 182 HD2 PRO 21 HD2 PRO 21 45.356 -8.887 3.309 183 HD3 PRO 21 HD1 PRO 21 46.682 -8.468 4.499 184 H ARG 22 HN ARG 22 45.738 -8.551 0.455 185 HA ARG 22 HA ARG 22 46.781 -9.882 -1.899 186 HB2 ARG 22 HB1 ARG 22 43.971 -8.981 -1.075 187 HB3 ARG 22 HB2 ARG 22 44.286 -9.875 -2.581 188 HG2 ARG 22 HG1 ARG 22 44.805 -10.888 0.309 189 HG3 ARG 22 HG2 ARG 22 43.394 -11.320 -0.673 190 HD2 ARG 22 HD1 ARG 22 44.892 -12.350 -2.443 191 HD3 ARG 22 HD2 ARG 22 46.313 -12.121 -1.343 192 HE ARG 22 HE ARG 22 44.300 -13.300 0.213 193 HH11 ARG 22 HH11 ARG 22 45.182 -16.730 -0.527 194 HH12 ARG 22 HH12 ARG 22 44.403 -15.634 0.589 195 HH21 ARG 22 HH21 ARG 22 46.250 -15.787 -2.447 196 HH22 ARG 22 HH22 ARG 22 46.172 -14.073 -2.672 197 H THR 23 HN THR 23 46.757 -6.629 -1.060 198 HA THR 23 HA THR 23 45.431 -5.577 -3.302 199 HB THR 23 HB THR 23 45.633 -4.436 -1.118 200 HG1 THR 23 HG1 THR 23 46.104 -2.390 -2.003 201 HG21 THR 23 HG21 THR 23 47.764 -3.193 -0.554 202 HG22 THR 23 HG22 THR 23 48.141 -4.940 -0.728 203 HG23 THR 23 HG23 THR 23 48.555 -3.794 -2.054 204 H THR 24 HN THR 24 46.283 -4.253 -5.039 205 HA THR 24 HA THR 24 48.989 -4.971 -5.860 206 HB THR 24 HB THR 24 48.231 -5.054 -8.204 207 HG1 THR 24 HG1 THR 24 46.008 -5.259 -8.619 208 HG21 THR 24 HG21 THR 24 47.048 -7.306 -8.104 209 HG22 THR 24 HG22 THR 24 48.269 -7.229 -6.790 210 HG23 THR 24 HG23 THR 24 46.525 -6.987 -6.412 211 H ALA 25 HN ALA 25 49.694 -3.436 -7.763 212 HA ALA 25 HA ALA 25 49.847 -0.835 -6.757 213 HB1 ALA 25 HB1 ALA 25 51.513 -1.894 -8.291 214 HB2 ALA 25 HB2 ALA 25 50.309 -1.868 -9.625 215 HB3 ALA 25 HB3 ALA 25 50.946 -0.320 -8.950 216 H LYS 26 HN LYS 26 47.626 -2.183 -9.162 217 HA LYS 26 HA LYS 26 46.398 0.142 -10.000 218 HB2 LYS 26 HB1 LYS 26 45.578 -2.776 -9.750 219 HB3 LYS 26 HB2 LYS 26 44.426 -1.587 -10.411 220 HG2 LYS 26 HG1 LYS 26 46.039 -0.985 -12.243 221 HG3 LYS 26 HG2 LYS 26 47.325 -1.983 -11.487 222 HD2 LYS 26 HD1 LYS 26 46.165 -4.043 -12.036 223 HD3 LYS 26 HD2 LYS 26 44.646 -3.169 -12.425 224 HE2 LYS 26 HE1 LYS 26 45.700 -3.902 -14.532 225 HE3 LYS 26 HE2 LYS 26 45.825 -2.104 -14.433 226 HZ1 LYS 26 HZ1 LYS 26 47.888 -3.118 -15.120 227 HZ2 LYS 26 HZ2 LYS 26 48.076 -2.364 -13.611 228 HZ3 LYS 26 HZ3 LYS 26 47.955 -4.051 -13.705 229 H ASP 27 HN ASP 27 45.588 -1.906 -7.055 230 HA ASP 27 HA ASP 27 43.334 -0.388 -6.417 231 HB2 ASP 27 HB1 ASP 27 45.322 -2.056 -4.732 232 HB3 ASP 27 HB2 ASP 27 43.775 -1.424 -4.071 233 H LEU 28 HN LEU 28 46.843 -0.036 -5.466 234 HA LEU 28 HA LEU 28 46.392 2.094 -3.736 235 HB2 LEU 28 HB1 LEU 28 48.844 1.169 -5.299 236 HB3 LEU 28 HB2 LEU 28 48.914 2.662 -4.335 237 HG LEU 28 HG LEU 28 48.231 1.288 -2.320 238 HD11 LEU 28 HD11 LEU 28 48.799 -1.221 -2.369 239 HD12 LEU 28 HD12 LEU 28 47.356 -0.814 -3.367 240 HD13 LEU 28 HD13 LEU 28 48.945 -1.123 -4.160 241 HD21 LEU 28 HD21 LEU 28 50.575 0.373 -1.961 242 HD22 LEU 28 HD22 LEU 28 50.923 0.606 -3.704 243 HD23 LEU 28 HD23 LEU 28 50.556 2.030 -2.666 244 H VAL 29 HN VAL 29 47.109 2.125 -7.352 245 HA VAL 29 HA VAL 29 47.703 4.846 -7.375 246 HB VAL 29 HB VAL 29 48.430 3.262 -9.098 247 HG11 VAL 29 HG11 VAL 29 46.914 2.853 -11.065 248 HG12 VAL 29 HG12 VAL 29 46.337 2.006 -9.598 249 HG13 VAL 29 HG13 VAL 29 45.526 3.525 -10.138 250 HG21 VAL 29 HG21 VAL 29 48.179 4.950 -10.968 251 HG22 VAL 29 HG22 VAL 29 46.970 5.839 -9.970 252 HG23 VAL 29 HG23 VAL 29 48.675 5.688 -9.412 253 H LYS 30 HN LYS 30 44.499 3.159 -7.853 254 HA LYS 30 HA LYS 30 43.176 5.433 -8.781 255 HB2 LYS 30 HB1 LYS 30 42.346 3.110 -9.038 256 HB3 LYS 30 HB2 LYS 30 42.134 2.961 -7.274 257 HG2 LYS 30 HG1 LYS 30 40.365 4.770 -7.331 258 HG3 LYS 30 HG2 LYS 30 40.644 5.003 -9.088 259 HD2 LYS 30 HD1 LYS 30 38.670 3.669 -8.932 260 HD3 LYS 30 HD2 LYS 30 39.974 2.518 -9.382 261 HE2 LYS 30 HE1 LYS 30 40.157 1.774 -6.975 262 HE3 LYS 30 HE2 LYS 30 38.834 2.918 -6.527 263 HZ1 LYS 30 HZ1 LYS 30 38.004 0.688 -6.922 264 HZ2 LYS 30 HZ2 LYS 30 37.385 1.764 -8.081 265 HZ3 LYS 30 HZ3 LYS 30 38.628 0.691 -8.501 266 H MET 31 HN MET 31 43.511 4.143 -5.405 267 HA MET 31 HA MET 31 42.043 6.142 -4.157 268 HB2 MET 31 HB1 MET 31 42.652 3.956 -3.153 269 HB3 MET 31 HB2 MET 31 44.391 4.337 -3.251 270 HG2 MET 31 HG1 MET 31 42.507 6.074 -1.524 271 HG3 MET 31 HG2 MET 31 43.110 4.496 -0.923 272 HE1 MET 31 HE1 MET 31 47.008 5.086 -0.730 273 HE2 MET 31 HE2 MET 31 45.663 3.923 -0.471 274 HE3 MET 31 HE3 MET 31 46.112 4.424 -2.137 275 H LEU 32 HN LEU 32 45.560 5.947 -4.902 276 HA LEU 32 HA LEU 32 46.274 8.229 -3.465 277 HB2 LEU 32 HB1 LEU 32 47.713 6.252 -4.093 278 HB3 LEU 32 HB2 LEU 32 47.579 6.692 -5.812 279 HG LEU 32 HG LEU 32 48.735 8.916 -5.177 280 HD11 LEU 32 HD11 LEU 32 50.213 8.777 -3.087 281 HD12 LEU 32 HD12 LEU 32 48.456 8.823 -2.693 282 HD13 LEU 32 HD13 LEU 32 49.359 7.266 -2.613 283 HD21 LEU 32 HD21 LEU 32 51.014 7.852 -5.258 284 HD22 LEU 32 HD22 LEU 32 50.296 6.251 -4.892 285 HD23 LEU 32 HD23 LEU 32 49.868 7.094 -6.424 286 H GLU 33 HN GLU 33 45.591 7.724 -6.988 287 HA GLU 33 HA GLU 33 46.030 10.359 -7.805 288 HB2 GLU 33 HB1 GLU 33 46.047 8.382 -9.325 289 HB3 GLU 33 HB2 GLU 33 44.316 8.108 -9.027 290 HG2 GLU 33 HG1 GLU 33 44.618 9.164 -11.222 291 HG3 GLU 33 HG2 GLU 33 43.824 10.380 -10.150 292 H GLU 34 HN GLU 34 42.933 8.690 -6.776 293 HA GLU 34 HA GLU 34 41.263 10.859 -7.327 294 HB2 GLU 34 HB1 GLU 34 40.538 8.476 -6.991 295 HB3 GLU 34 HB2 GLU 34 40.946 8.598 -5.265 296 HG2 GLU 34 HG1 GLU 34 38.892 10.523 -6.493 297 HG3 GLU 34 HG2 GLU 34 38.413 8.849 -6.017 298 H THR 35 HN THR 35 43.080 9.966 -4.313 299 HA THR 35 HA THR 35 42.147 12.105 -2.791 300 HB THR 35 HB THR 35 44.811 10.640 -2.715 301 HG1 THR 35 HG1 THR 35 43.810 9.530 -0.984 302 HG21 THR 35 HG21 THR 35 44.933 11.473 -0.282 303 HG22 THR 35 HG22 THR 35 44.692 12.902 -1.343 304 HG23 THR 35 HG23 THR 35 43.301 12.218 -0.428 305 H GLY 36 HN GLY 36 45.047 11.863 -4.958 306 HA2 GLY 36 HA2 GLY 36 45.209 13.715 -6.458 307 HA3 GLY 36 HA1 GLY 36 44.962 14.790 -5.016 308 H THR 37 HN THR 37 47.105 11.891 -5.121 309 HA THR 37 HA THR 37 49.365 13.737 -4.856 310 HB THR 37 HB THR 37 48.892 10.976 -3.636 311 HG1 THR 37 HG1 THR 37 49.021 12.139 -1.668 312 HG21 THR 37 HG21 THR 37 51.091 11.323 -2.400 313 HG22 THR 37 HG22 THR 37 51.399 11.532 -4.157 314 HG23 THR 37 HG23 THR 37 51.259 12.977 -3.092 315 H LYS 38 HN LYS 38 51.073 13.459 -6.336 316 HA LYS 38 HA LYS 38 50.727 11.187 -8.138 317 HB2 LYS 38 HB1 LYS 38 52.527 13.683 -8.282 318 HB3 LYS 38 HB2 LYS 38 52.451 12.442 -9.559 319 HG2 LYS 38 HG1 LYS 38 50.110 14.279 -8.664 320 HG3 LYS 38 HG2 LYS 38 51.131 14.534 -10.118 321 HD2 LYS 38 HD1 LYS 38 49.232 12.160 -9.605 322 HD3 LYS 38 HD2 LYS 38 48.880 13.598 -10.624 323 HE2 LYS 38 HE1 LYS 38 50.893 12.941 -12.103 324 HE3 LYS 38 HE2 LYS 38 50.996 11.404 -11.162 325 HZ1 LYS 38 HZ1 LYS 38 49.653 11.159 -13.148 326 HZ2 LYS 38 HZ2 LYS 38 48.699 10.949 -11.760 327 HZ3 LYS 38 HZ3 LYS 38 48.605 12.394 -12.642 328 H VAL 39 HN VAL 39 51.855 9.328 -7.569 329 HA VAL 39 HA VAL 39 54.730 9.692 -7.061 330 HB VAL 39 HB VAL 39 52.968 7.534 -5.809 331 HG11 VAL 39 HG11 VAL 39 55.114 6.919 -4.581 332 HG12 VAL 39 HG12 VAL 39 55.281 6.717 -6.351 333 HG13 VAL 39 HG13 VAL 39 56.006 8.155 -5.536 334 HG21 VAL 39 HG21 VAL 39 53.592 8.624 -3.588 335 HG22 VAL 39 HG22 VAL 39 54.358 9.979 -4.494 336 HG23 VAL 39 HG23 VAL 39 52.585 9.691 -4.617 337 H SER 40 HN SER 40 55.955 8.474 -8.595 338 HA SER 40 HA SER 40 54.553 7.173 -10.623 339 HB2 SER 40 HB1 SER 40 57.513 6.980 -9.765 340 HB3 SER 40 HB2 SER 40 56.905 6.325 -11.318 341 HG SER 40 HG SER 40 57.854 8.531 -11.315 342 H ILE 41 HN ILE 41 54.298 4.951 -11.186 343 HA ILE 41 HA ILE 41 53.755 3.297 -9.010 344 HB ILE 41 HB ILE 41 53.875 2.805 -11.968 345 HG12 ILE 41 HG11 ILE 41 52.184 4.445 -11.429 346 HG13 ILE 41 HG12 ILE 41 51.353 2.907 -11.821 347 HG21 ILE 41 HG21 ILE 41 52.536 0.667 -11.520 348 HG22 ILE 41 HG22 ILE 41 54.030 0.591 -10.533 349 HG23 ILE 41 HG23 ILE 41 52.465 1.038 -9.762 350 HD11 ILE 41 HD11 ILE 41 50.245 3.994 -9.920 351 HD12 ILE 41 HD12 ILE 41 51.013 2.464 -9.363 352 HD13 ILE 41 HD13 ILE 41 51.780 4.052 -8.987 353 H SER 42 HN SER 42 56.589 3.465 -11.167 354 HA SER 42 HA SER 42 57.530 0.910 -10.823 355 HB2 SER 42 HB1 SER 42 59.087 3.562 -11.237 356 HB3 SER 42 HB2 SER 42 59.816 1.952 -11.537 357 HG SER 42 HG SER 42 58.880 3.138 -13.406 358 H THR 43 HN THR 43 58.335 3.868 -8.816 359 HA THR 43 HA THR 43 60.095 2.361 -7.205 360 HB THR 43 HB THR 43 60.401 4.715 -7.526 361 HG1 THR 43 HG1 THR 43 60.615 5.314 -5.345 362 HG21 THR 43 HG21 THR 43 58.880 6.412 -6.463 363 HG22 THR 43 HG22 THR 43 57.933 5.391 -7.597 364 HG23 THR 43 HG23 THR 43 57.816 5.109 -5.823 365 H VAL 44 HN VAL 44 56.551 3.012 -7.001 366 HA VAL 44 HA VAL 44 56.218 2.215 -4.346 367 HB VAL 44 HB VAL 44 54.328 2.181 -6.722 368 HG11 VAL 44 HG11 VAL 44 52.464 2.046 -5.005 369 HG12 VAL 44 HG12 VAL 44 53.455 0.556 -5.024 370 HG13 VAL 44 HG13 VAL 44 53.682 1.772 -3.710 371 HG21 VAL 44 HG21 VAL 44 53.429 4.276 -5.532 372 HG22 VAL 44 HG22 VAL 44 54.748 4.116 -4.315 373 HG23 VAL 44 HG23 VAL 44 55.138 4.463 -6.037 374 H LYS 45 HN LYS 45 56.062 0.194 -7.438 375 HA LYS 45 HA LYS 45 55.354 -2.132 -6.078 376 HB2 LYS 45 HB1 LYS 45 56.098 -3.386 -8.040 377 HB3 LYS 45 HB2 LYS 45 55.093 -1.994 -8.518 378 HG2 LYS 45 HG1 LYS 45 57.105 -0.734 -9.249 379 HG3 LYS 45 HG2 LYS 45 58.191 -1.985 -8.559 380 HD2 LYS 45 HD1 LYS 45 58.271 -2.433 -10.840 381 HD3 LYS 45 HD2 LYS 45 57.037 -3.607 -10.268 382 HE2 LYS 45 HE1 LYS 45 55.215 -2.306 -11.199 383 HE3 LYS 45 HE2 LYS 45 56.282 -0.881 -11.491 384 HZ1 LYS 45 HZ1 LYS 45 55.973 -2.205 -13.503 385 HZ2 LYS 45 HZ2 LYS 45 57.597 -2.246 -13.008 386 HZ3 LYS 45 HZ3 LYS 45 56.594 -3.584 -12.731 387 H ARG 46 HN ARG 46 58.569 -0.734 -6.708 388 HA ARG 46 HA ARG 46 60.122 -2.893 -5.775 389 HB2 ARG 46 HB1 ARG 46 60.641 0.081 -6.038 390 HB3 ARG 46 HB2 ARG 46 61.907 -1.038 -5.478 391 HG2 ARG 46 HG1 ARG 46 61.564 -2.404 -7.648 392 HG3 ARG 46 HG2 ARG 46 60.320 -1.253 -8.167 393 HD2 ARG 46 HD1 ARG 46 62.033 0.635 -8.121 394 HD3 ARG 46 HD2 ARG 46 63.330 -0.609 -7.890 395 HE ARG 46 HE ARG 46 61.635 -0.217 -10.283 396 HH11 ARG 46 HH11 ARG 46 64.579 -3.096 -9.967 397 HH12 ARG 46 HH12 ARG 46 64.095 -2.109 -8.608 398 HH21 ARG 46 HH21 ARG 46 63.481 -2.742 -12.049 399 HH22 ARG 46 HH22 ARG 46 62.222 -1.558 -12.128 400 H VAL 47 HN VAL 47 58.744 -0.025 -3.965 401 HA VAL 47 HA VAL 47 59.909 -0.673 -1.521 402 HB VAL 47 HB VAL 47 57.317 0.740 -2.251 403 HG11 VAL 47 HG11 VAL 47 57.308 1.649 0.119 404 HG12 VAL 47 HG12 VAL 47 57.028 -0.118 0.087 405 HG13 VAL 47 HG13 VAL 47 58.647 0.530 0.550 406 HG21 VAL 47 HG21 VAL 47 58.725 2.787 -1.561 407 HG22 VAL 47 HG22 VAL 47 60.130 1.693 -1.287 408 HG23 VAL 47 HG23 VAL 47 59.449 1.903 -2.941 409 H LEU 48 HN LEU 48 56.633 -1.795 -2.883 410 HA LEU 48 HA LEU 48 56.110 -3.337 -0.631 411 HB2 LEU 48 HB1 LEU 48 55.122 -3.479 -3.496 412 HB3 LEU 48 HB2 LEU 48 54.650 -4.735 -2.326 413 HG LEU 48 HG LEU 48 53.848 -2.792 -0.823 414 HD11 LEU 48 HD11 LEU 48 52.982 -0.725 -2.081 415 HD12 LEU 48 HD12 LEU 48 54.780 -0.804 -2.020 416 HD13 LEU 48 HD13 LEU 48 53.908 -1.256 -3.530 417 HD21 LEU 48 HD21 LEU 48 51.602 -2.724 -2.014 418 HD22 LEU 48 HD22 LEU 48 52.363 -3.448 -3.467 419 HD23 LEU 48 HD23 LEU 48 52.316 -4.374 -1.924 420 H TYR 49 HN TYR 49 57.845 -4.255 -3.723 421 HA TYR 49 HA TYR 49 58.104 -6.942 -3.065 422 HB2 TYR 49 HB1 TYR 49 58.427 -6.007 -5.373 423 HB3 TYR 49 HB2 TYR 49 59.847 -5.065 -4.827 424 HD1 TYR 49 HD1 TYR 49 58.500 -8.565 -5.163 425 HD2 TYR 49 HD2 TYR 49 62.013 -6.091 -4.936 426 HE1 TYR 49 HE1 TYR 49 59.919 -10.504 -5.798 427 HE2 TYR 49 HE2 TYR 49 63.414 -8.023 -5.581 428 HH TYR 49 HH TYR 49 63.444 -10.182 -6.214 429 H ARG 50 HN ARG 50 60.356 -4.192 -2.411 430 HA ARG 50 HA ARG 50 62.339 -5.703 -1.120 431 HB2 ARG 50 HB1 ARG 50 62.664 -3.421 -1.999 432 HB3 ARG 50 HB2 ARG 50 61.495 -2.751 -0.835 433 HG2 ARG 50 HG1 ARG 50 63.076 -3.474 1.051 434 HG3 ARG 50 HG2 ARG 50 64.223 -4.070 -0.163 435 HD2 ARG 50 HD1 ARG 50 63.271 -1.132 -0.133 436 HD3 ARG 50 HD2 ARG 50 64.812 -1.688 0.639 437 HE ARG 50 HE ARG 50 65.072 -2.784 -1.803 438 HH11 ARG 50 HH11 ARG 50 65.889 0.047 -3.873 439 HH12 ARG 50 HH12 ARG 50 66.060 -1.673 -3.619 440 HH21 ARG 50 HH21 ARG 50 64.700 1.301 -2.229 441 HH22 ARG 50 HH22 ARG 50 64.023 0.456 -0.879 442 H HIS 51 HN HIS 51 59.455 -3.995 0.300 443 HA HIS 51 HA HIS 51 60.102 -4.702 2.948 444 HB2 HIS 51 HB1 HIS 51 58.568 -2.795 2.160 445 HB3 HIS 51 HB2 HIS 51 57.320 -4.036 1.858 446 HD1 HIS 51 HD1 HIS 51 56.700 -5.515 4.246 447 HD2 HIS 51 HD2 HIS 51 58.685 -1.847 4.716 448 HE1 HIS 51 HE1 HIS 51 56.411 -4.746 6.680 449 H ASN 52 HN ASN 52 58.113 -6.435 0.412 450 HA ASN 52 HA ASN 52 57.270 -8.438 2.144 451 HB2 ASN 52 HB1 ASN 52 56.338 -7.973 -0.152 452 HB3 ASN 52 HB2 ASN 52 57.875 -8.500 -0.905 453 HD21 ASN 52 HD21 ASN 52 55.199 -11.282 0.663 454 HD22 ASN 52 HD22 ASN 52 55.178 -9.639 1.256 455 H LEU 53 HN LEU 53 60.316 -8.220 0.124 456 HA LEU 53 HA LEU 53 61.280 -10.720 0.894 457 HB2 LEU 53 HB1 LEU 53 61.946 -9.472 -1.145 458 HB3 LEU 53 HB2 LEU 53 62.650 -8.167 -0.163 459 HG LEU 53 HG LEU 53 64.150 -9.657 -1.360 460 HD11 LEU 53 HD11 LEU 53 65.896 -10.010 0.536 461 HD12 LEU 53 HD12 LEU 53 65.167 -8.364 0.469 462 HD13 LEU 53 HD13 LEU 53 64.612 -9.548 1.709 463 HD21 LEU 53 HD21 LEU 53 64.787 -11.946 -0.384 464 HD22 LEU 53 HD22 LEU 53 63.355 -11.845 0.689 465 HD23 LEU 53 HD23 LEU 53 63.136 -11.864 -1.097 466 H LYS 54 HN LYS 54 61.900 -7.425 2.295 467 HA LYS 54 HA LYS 54 63.248 -8.745 4.551 468 HB2 LYS 54 HB1 LYS 54 64.716 -7.199 3.140 469 HB3 LYS 54 HB2 LYS 54 63.539 -5.881 3.380 470 HG2 LYS 54 HG1 LYS 54 64.026 -6.224 5.973 471 HG3 LYS 54 HG2 LYS 54 65.445 -7.180 5.430 472 HD2 LYS 54 HD1 LYS 54 64.834 -4.262 4.593 473 HD3 LYS 54 HD2 LYS 54 65.916 -4.724 5.951 474 HE2 LYS 54 HE1 LYS 54 67.561 -5.691 4.453 475 HE3 LYS 54 HE2 LYS 54 66.425 -5.636 3.051 476 HZ1 LYS 54 HZ1 LYS 54 67.976 -3.777 3.034 477 HZ2 LYS 54 HZ2 LYS 54 66.385 -3.222 3.251 478 HZ3 LYS 54 HZ3 LYS 54 67.450 -3.277 4.569 479 H GLY 55 HN GLY 55 62.101 -8.669 6.464 480 HA2 GLY 55 HA2 GLY 55 59.647 -7.199 6.449 481 HA3 GLY 55 HA1 GLY 55 60.311 -8.300 7.732 482 H ARG 56 HN ARG 56 60.497 -5.090 6.330 483 HA ARG 56 HA ARG 56 61.286 -3.069 6.966 484 HB2 ARG 56 HB1 ARG 56 59.287 -3.466 8.506 485 HB3 ARG 56 HB2 ARG 56 60.434 -3.899 9.796 486 HG2 ARG 56 HG1 ARG 56 61.494 -1.488 9.249 487 HG3 ARG 56 HG2 ARG 56 59.953 -1.178 8.429 488 HD2 ARG 56 HD1 ARG 56 58.644 -1.827 10.493 489 HD3 ARG 56 HD2 ARG 56 60.190 -2.013 11.419 490 HE ARG 56 HE ARG 56 59.045 0.508 10.356 491 HH11 ARG 56 HH11 ARG 56 61.270 2.363 12.478 492 HH12 ARG 56 HH12 ARG 56 59.931 2.419 11.356 493 HH21 ARG 56 HH21 ARG 56 62.258 0.251 12.931 494 HH22 ARG 56 HH22 ARG 56 61.597 -1.155 12.171 495 H SER 57 HN SER 57 62.458 -2.832 10.020 496 HA SER 57 HA SER 57 64.349 -4.957 10.097 497 HB2 SER 57 HB1 SER 57 65.649 -3.219 8.721 498 HB3 SER 57 HB2 SER 57 65.358 -2.015 10.015 499 HG SER 57 HG SER 57 67.422 -3.230 10.047 500 H ALA 58 HN ALA 58 64.885 -5.266 12.320 501 HA ALA 58 HA ALA 58 64.601 -5.171 14.531 502 HB1 ALA 58 HB1 ALA 58 66.146 -3.287 14.187 503 HB2 ALA 58 HB2 ALA 58 64.755 -2.152 14.104 504 HB3 ALA 58 HB3 ALA 58 65.106 -3.043 15.634 505 H ARG 59 HN ARG 59 62.183 -5.876 13.745 506 HA ARG 59 HA ARG 59 60.094 -4.102 14.275 507 HB2 ARG 59 HB1 ARG 59 60.285 -7.138 14.214 508 HB3 ARG 59 HB2 ARG 59 58.734 -6.354 14.594 509 HG2 ARG 59 HG1 ARG 59 60.370 -5.920 11.999 510 HG3 ARG 59 HG2 ARG 59 59.063 -7.108 12.151 511 HD2 ARG 59 HD1 ARG 59 57.589 -5.052 13.069 512 HD3 ARG 59 HD2 ARG 59 58.768 -4.042 12.137 513 HE ARG 59 HE ARG 59 58.215 -5.959 10.328 514 HH11 ARG 59 HH11 ARG 59 54.824 -3.783 11.290 515 HH12 ARG 59 HH12 ARG 59 56.220 -3.854 12.338 516 HH21 ARG 59 HH21 ARG 59 54.849 -5.058 9.310 517 HH22 ARG 59 HH22 ARG 59 56.255 -5.992 8.932 518 H LYS 60 HN LYS 60 58.983 -3.429 16.008 519 HA LYS 60 HA LYS 60 58.750 -5.311 18.274 520 HB2 LYS 60 HB1 LYS 60 58.222 -2.275 18.108 521 HB3 LYS 60 HB2 LYS 60 57.784 -3.276 19.516 522 HG2 LYS 60 HG1 LYS 60 60.257 -3.787 19.884 523 HG3 LYS 60 HG2 LYS 60 60.663 -2.772 18.461 524 HD2 LYS 60 HD1 LYS 60 59.747 -0.758 19.583 525 HD3 LYS 60 HD2 LYS 60 59.108 -1.754 20.934 526 HE2 LYS 60 HE1 LYS 60 62.125 -1.493 20.299 527 HE3 LYS 60 HE2 LYS 60 61.249 -0.458 21.492 528 HZ1 LYS 60 HZ1 LYS 60 62.285 -2.365 22.537 529 HZ2 LYS 60 HZ2 LYS 60 60.595 -2.465 22.666 530 HZ3 LYS 60 HZ3 LYS 60 61.418 -3.434 21.544 531 H LEU 61 HN LEU 61 56.630 -6.171 18.512 532 HA LEU 61 HA LEU 61 55.059 -5.965 16.214 533 HB2 LEU 61 HB1 LEU 61 55.274 -7.998 17.650 534 HB3 LEU 61 HB2 LEU 61 54.485 -7.150 19.001 535 HG LEU 61 HG LEU 61 52.419 -6.899 17.491 536 HD11 LEU 61 HD11 LEU 61 52.210 -8.591 15.581 537 HD12 LEU 61 HD12 LEU 61 53.438 -7.313 15.257 538 HD13 LEU 61 HD13 LEU 61 53.963 -8.963 15.755 539 HD21 LEU 61 HD21 LEU 61 51.654 -9.261 17.937 540 HD22 LEU 61 HD22 LEU 61 53.346 -9.754 18.268 541 HD23 LEU 61 HD23 LEU 61 52.541 -8.546 19.333 542 H GLU 62 HN GLU 62 54.643 -4.566 19.539 543 HA GLU 62 HA GLU 62 52.118 -3.461 19.034 544 HB2 GLU 62 HB1 GLU 62 54.284 -2.850 21.108 545 HB3 GLU 62 HB2 GLU 62 52.689 -2.064 21.136 546 HG2 GLU 62 HG1 GLU 62 51.568 -4.321 21.390 547 HG3 GLU 62 HG2 GLU 62 53.174 -5.144 21.335 Start of MODEL 8 1 H1 ALA 1 HT1 ALA 1 61.947 7.666 12.969 2 H2 ALA 1 HT2 ALA 1 62.782 6.767 11.797 3 H3 ALA 1 HT3 ALA 1 61.150 7.171 11.555 4 HA ALA 1 HA ALA 1 61.698 9.507 11.434 5 HB1 ALA 1 HB1 ALA 1 63.572 9.346 13.062 6 HB2 ALA 1 HB2 ALA 1 64.583 8.510 11.833 7 HB3 ALA 1 HB3 ALA 1 64.092 10.230 11.584 8 H SER 2 HN SER 2 64.070 7.177 9.911 9 HA SER 2 HA SER 2 64.377 8.718 7.632 10 HB2 SER 2 HB1 SER 2 66.054 7.034 8.423 11 HB3 SER 2 HB2 SER 2 64.896 5.695 8.151 12 HG SER 2 HG SER 2 66.557 6.103 6.493 13 H MET 3 HN MET 3 62.219 5.892 8.218 14 HA MET 3 HA MET 3 61.321 5.683 5.601 15 HB2 MET 3 HB1 MET 3 59.574 4.221 6.499 16 HB3 MET 3 HB2 MET 3 61.168 3.796 7.176 17 HG2 MET 3 HG1 MET 3 60.532 5.081 9.320 18 HG3 MET 3 HG2 MET 3 58.923 5.408 8.597 19 HE1 MET 3 HE1 MET 3 57.150 2.012 8.454 20 HE2 MET 3 HE2 MET 3 57.023 3.800 8.327 21 HE3 MET 3 HE3 MET 3 58.015 2.883 7.142 22 H VAL 4 HN VAL 4 60.431 8.120 7.967 23 HA VAL 4 HA VAL 4 57.659 8.083 7.588 24 HB VAL 4 HB VAL 4 59.523 10.162 8.766 25 HG11 VAL 4 HG11 VAL 4 57.440 11.128 9.857 26 HG12 VAL 4 HG12 VAL 4 57.407 11.323 8.080 27 HG13 VAL 4 HG13 VAL 4 56.418 10.034 8.863 28 HG21 VAL 4 HG21 VAL 4 58.573 9.184 10.947 29 HG22 VAL 4 HG22 VAL 4 57.665 7.969 9.975 30 HG23 VAL 4 HG23 VAL 4 59.466 7.962 9.986 31 H LEU 5 HN LEU 5 60.166 10.407 6.261 32 HA LEU 5 HA LEU 5 60.172 11.662 4.498 33 HB2 LEU 5 HB1 LEU 5 58.468 9.380 3.461 34 HB3 LEU 5 HB2 LEU 5 59.140 10.632 2.390 35 HG LEU 5 HG LEU 5 60.874 9.014 4.365 36 HD11 LEU 5 HD11 LEU 5 61.494 7.506 2.384 37 HD12 LEU 5 HD12 LEU 5 59.768 7.348 2.874 38 HD13 LEU 5 HD13 LEU 5 60.207 8.305 1.411 39 HD21 LEU 5 HD21 LEU 5 62.762 9.603 2.802 40 HD22 LEU 5 HD22 LEU 5 61.634 10.534 1.766 41 HD23 LEU 5 HD23 LEU 5 61.943 11.067 3.458 42 H SER 6 HN SER 6 57.319 11.272 2.656 43 HA SER 6 HA SER 6 56.100 13.574 3.957 44 HB2 SER 6 HB1 SER 6 55.550 12.134 1.272 45 HB3 SER 6 HB2 SER 6 54.558 13.511 1.844 46 HG SER 6 HG SER 6 56.375 13.973 0.343 47 HA PRO 7 HA PRO 7 53.931 10.262 5.882 48 HB2 PRO 7 HB2 PRO 7 52.424 11.538 7.769 49 HB3 PRO 7 HB1 PRO 7 54.231 11.488 7.829 50 HG2 PRO 7 HG2 PRO 7 52.596 13.787 6.699 51 HG3 PRO 7 HG1 PRO 7 53.927 13.848 7.929 52 HD2 PRO 7 HD2 PRO 7 54.416 14.208 5.224 53 HD3 PRO 7 HD1 PRO 7 55.626 13.418 6.348 54 H ARG 8 HN ARG 8 52.228 12.769 4.145 55 HA ARG 8 HA ARG 8 49.578 11.947 4.506 56 HB2 ARG 8 HB1 ARG 8 49.079 13.369 2.571 57 HB3 ARG 8 HB2 ARG 8 50.116 14.208 3.749 58 HG2 ARG 8 HG1 ARG 8 52.131 13.508 2.214 59 HG3 ARG 8 HG2 ARG 8 50.931 12.964 1.026 60 HD2 ARG 8 HD1 ARG 8 49.914 15.212 0.833 61 HD3 ARG 8 HD2 ARG 8 51.058 15.888 2.064 62 HE ARG 8 HE ARG 8 51.686 15.073 -0.696 63 HH11 ARG 8 HH11 ARG 8 55.146 15.995 -0.234 64 HH12 ARG 8 HH12 ARG 8 53.984 15.212 -1.276 65 HH21 ARG 8 HH21 ARG 8 54.433 16.657 1.933 66 HH22 ARG 8 HH22 ARG 8 52.786 16.378 2.386 67 H ASP 9 HN ASP 9 51.937 10.942 1.861 68 HA ASP 9 HA ASP 9 49.975 8.990 1.062 69 HB2 ASP 9 HB1 ASP 9 51.631 8.476 -0.773 70 HB3 ASP 9 HB2 ASP 9 51.107 10.195 -0.792 71 H GLU 10 HN GLU 10 53.117 9.205 2.865 72 HA GLU 10 HA GLU 10 53.799 6.529 2.521 73 HB2 GLU 10 HB1 GLU 10 55.375 8.379 3.104 74 HB3 GLU 10 HB2 GLU 10 54.617 8.535 4.704 75 HG2 GLU 10 HG1 GLU 10 56.693 7.301 4.971 76 HG3 GLU 10 HG2 GLU 10 55.375 6.089 5.191 77 H ARG 11 HN ARG 11 52.007 8.120 5.290 78 HA ARG 11 HA ARG 11 51.929 5.794 6.876 79 HB2 ARG 11 HB1 ARG 11 51.470 8.034 7.768 80 HB3 ARG 11 HB2 ARG 11 50.028 8.212 6.741 81 HG2 ARG 11 HG1 ARG 11 48.992 6.208 7.990 82 HG3 ARG 11 HG2 ARG 11 50.433 6.131 9.020 83 HD2 ARG 11 HD1 ARG 11 48.775 8.716 8.864 84 HD3 ARG 11 HD2 ARG 11 48.425 7.417 10.077 85 HE ARG 11 HE ARG 11 50.762 9.195 9.990 86 HH11 ARG 11 HH11 ARG 11 51.889 7.841 13.139 87 HH12 ARG 11 HH12 ARG 11 52.120 9.060 11.908 88 HH21 ARG 11 HH21 ARG 11 50.183 6.212 12.787 89 HH22 ARG 11 HH22 ARG 11 49.219 6.325 11.355 90 H THR 12 HN THR 12 49.611 7.025 4.419 91 HA THR 12 HA THR 12 47.701 5.033 4.774 92 HB THR 12 HB THR 12 48.475 6.699 2.338 93 HG1 THR 12 HG1 THR 12 46.710 7.983 3.039 94 HG21 THR 12 HG21 THR 12 46.085 6.305 1.524 95 HG22 THR 12 HG22 THR 12 46.835 4.703 1.833 96 HG23 THR 12 HG23 THR 12 45.687 5.402 3.030 97 H LEU 13 HN LEU 13 50.528 5.194 2.474 98 HA LEU 13 HA LEU 13 49.978 2.755 1.261 99 HB2 LEU 13 HB1 LEU 13 51.454 4.506 0.319 100 HB3 LEU 13 HB2 LEU 13 52.601 4.319 1.667 101 HG LEU 13 HG LEU 13 51.939 1.930 -0.086 102 HD11 LEU 13 HD11 LEU 13 53.827 2.673 -1.700 103 HD12 LEU 13 HD12 LEU 13 52.383 3.749 -1.748 104 HD13 LEU 13 HD13 LEU 13 53.863 4.263 -0.858 105 HD21 LEU 13 HD21 LEU 13 54.362 1.324 0.249 106 HD22 LEU 13 HD22 LEU 13 54.615 2.806 1.225 107 HD23 LEU 13 HD23 LEU 13 53.494 1.526 1.814 108 H VAL 14 HN VAL 14 52.077 3.504 4.164 109 HA VAL 14 HA VAL 14 52.987 0.892 4.510 110 HB VAL 14 HB VAL 14 52.711 3.217 6.415 111 HG11 VAL 14 HG11 VAL 14 54.268 1.933 7.951 112 HG12 VAL 14 HG12 VAL 14 52.672 1.137 7.811 113 HG13 VAL 14 HG13 VAL 14 54.090 0.477 6.909 114 HG21 VAL 14 HG21 VAL 14 55.284 3.176 6.068 115 HG22 VAL 14 HG22 VAL 14 55.078 1.803 4.920 116 HG23 VAL 14 HG23 VAL 14 54.411 3.428 4.523 117 H ARG 15 HN ARG 15 50.052 2.547 5.941 118 HA ARG 15 HA ARG 15 49.343 0.357 7.551 119 HB2 ARG 15 HB1 ARG 15 48.440 2.637 7.834 120 HB3 ARG 15 HB2 ARG 15 47.571 2.527 6.285 121 HG2 ARG 15 HG1 ARG 15 46.248 0.540 7.222 122 HG3 ARG 15 HG2 ARG 15 47.149 0.655 8.744 123 HD2 ARG 15 HD1 ARG 15 45.063 1.689 9.219 124 HD3 ARG 15 HD2 ARG 15 46.225 3.069 9.057 125 HE ARG 15 HE ARG 15 45.407 2.914 6.534 126 HH11 ARG 15 HH11 ARG 15 42.039 3.335 8.892 127 HH12 ARG 15 HH12 ARG 15 43.479 2.521 9.453 128 HH21 ARG 15 HH21 ARG 15 42.051 4.223 6.680 129 HH22 ARG 15 HH22 ARG 15 43.493 4.064 5.737 130 H LYS 16 HN LYS 16 48.353 1.106 4.109 131 HA LYS 16 HA LYS 16 46.625 -1.050 3.905 132 HB2 LYS 16 HB1 LYS 16 48.292 0.524 1.888 133 HB3 LYS 16 HB2 LYS 16 47.222 -0.792 1.340 134 HG2 LYS 16 HG1 LYS 16 45.841 1.136 3.191 135 HG3 LYS 16 HG2 LYS 16 46.521 1.953 1.745 136 HD2 LYS 16 HD1 LYS 16 44.200 1.295 1.296 137 HD3 LYS 16 HD2 LYS 16 45.299 0.309 0.272 138 HE2 LYS 16 HE1 LYS 16 45.060 -1.610 1.937 139 HE3 LYS 16 HE2 LYS 16 43.841 -0.624 2.834 140 HZ1 LYS 16 HZ1 LYS 16 42.805 -2.098 1.227 141 HZ2 LYS 16 HZ2 LYS 16 42.545 -0.476 0.796 142 HZ3 LYS 16 HZ3 LYS 16 43.690 -1.402 -0.043 143 H VAL 17 HN VAL 17 50.243 -0.972 3.118 144 HA VAL 17 HA VAL 17 50.101 -3.654 2.197 145 HB VAL 17 HB VAL 17 52.508 -3.658 2.109 146 HG11 VAL 17 HG11 VAL 17 52.672 -1.750 0.396 147 HG12 VAL 17 HG12 VAL 17 51.178 -2.711 0.183 148 HG13 VAL 17 HG13 VAL 17 51.106 -1.101 0.996 149 HG21 VAL 17 HG21 VAL 17 53.837 -1.601 2.602 150 HG22 VAL 17 HG22 VAL 17 52.394 -0.878 3.403 151 HG23 VAL 17 HG23 VAL 17 53.154 -2.369 4.069 152 H GLN 18 HN GLN 18 50.776 -2.147 5.437 153 HA GLN 18 HA GLN 18 51.632 -4.521 6.615 154 HB2 GLN 18 HB1 GLN 18 51.965 -2.270 7.580 155 HB3 GLN 18 HB2 GLN 18 50.208 -2.048 7.782 156 HG2 GLN 18 HG1 GLN 18 50.166 -3.932 9.491 157 HG3 GLN 18 HG2 GLN 18 51.923 -4.204 9.246 158 HE21 GLN 18 HE21 GLN 18 52.770 -1.719 11.595 159 HE22 GLN 18 HE22 GLN 18 53.242 -3.135 10.678 160 H ILE 19 HN ILE 19 48.227 -3.130 6.366 161 HA ILE 19 HA ILE 19 47.102 -5.266 7.781 162 HB ILE 19 HB ILE 19 46.027 -3.199 5.889 163 HG12 ILE 19 HG11 ILE 19 45.729 -3.531 8.951 164 HG13 ILE 19 HG12 ILE 19 46.866 -2.435 8.102 165 HG21 ILE 19 HG21 ILE 19 43.670 -3.915 6.523 166 HG22 ILE 19 HG22 ILE 19 44.521 -5.342 5.854 167 HG23 ILE 19 HG23 ILE 19 44.309 -5.175 7.635 168 HD11 ILE 19 HD11 ILE 19 44.900 -1.161 8.880 169 HD12 ILE 19 HD12 ILE 19 44.911 -1.199 7.079 170 HD13 ILE 19 HD13 ILE 19 43.779 -2.257 8.001 171 H ASN 20 HN ASN 20 47.512 -4.764 4.155 172 HA ASN 20 HA ASN 20 46.970 -7.625 3.976 173 HB2 ASN 20 HB1 ASN 20 45.038 -6.226 3.073 174 HB3 ASN 20 HB2 ASN 20 46.165 -5.402 1.951 175 HD21 ASN 20 HD21 ASN 20 44.569 -8.012 -0.098 176 HD22 ASN 20 HD22 ASN 20 44.207 -6.447 0.587 177 HA PRO 21 HA PRO 21 51.160 -6.771 2.355 178 HB2 PRO 21 HB2 PRO 21 52.334 -9.194 2.820 179 HB3 PRO 21 HB1 PRO 21 51.985 -8.014 4.145 180 HG2 PRO 21 HG2 PRO 21 50.216 -10.371 3.375 181 HG3 PRO 21 HG1 PRO 21 50.841 -9.925 5.018 182 HD2 PRO 21 HD2 PRO 21 48.355 -9.092 4.122 183 HD3 PRO 21 HD1 PRO 21 49.385 -8.081 5.247 184 H ARG 22 HN ARG 22 48.668 -8.907 1.285 185 HA ARG 22 HA ARG 22 50.154 -9.830 -1.052 186 HB2 ARG 22 HB1 ARG 22 47.318 -10.380 -0.040 187 HB3 ARG 22 HB2 ARG 22 47.985 -11.134 -1.508 188 HG2 ARG 22 HG1 ARG 22 49.004 -11.470 1.412 189 HG3 ARG 22 HG2 ARG 22 48.079 -12.680 0.503 190 HD2 ARG 22 HD1 ARG 22 50.887 -11.742 -0.354 191 HD3 ARG 22 HD2 ARG 22 50.543 -13.274 0.549 192 HE ARG 22 HE ARG 22 48.951 -13.810 -1.374 193 HH11 ARG 22 HH11 ARG 22 50.664 -13.838 -4.523 194 HH12 ARG 22 HH12 ARG 22 49.366 -14.499 -3.559 195 HH21 ARG 22 HH21 ARG 22 52.120 -12.259 -3.499 196 HH22 ARG 22 HH22 ARG 22 51.816 -11.797 -1.859 197 H THR 23 HN THR 23 48.640 -6.933 -0.335 198 HA THR 23 HA THR 23 46.909 -6.705 -2.513 199 HB THR 23 HB THR 23 46.754 -5.275 -0.536 200 HG1 THR 23 HG1 THR 23 46.501 -3.300 -1.634 201 HG21 THR 23 HG21 THR 23 48.344 -3.351 -0.199 202 HG22 THR 23 HG22 THR 23 49.271 -4.890 -0.196 203 HG23 THR 23 HG23 THR 23 49.290 -3.832 -1.652 204 H THR 24 HN THR 24 47.059 -5.821 -4.557 205 HA THR 24 HA THR 24 49.710 -5.757 -5.651 206 HB THR 24 HB THR 24 48.542 -5.476 -7.825 207 HG1 THR 24 HG1 THR 24 46.287 -5.796 -7.825 208 HG21 THR 24 HG21 THR 24 47.521 -7.826 -7.847 209 HG22 THR 24 HG22 THR 24 48.964 -7.836 -6.778 210 HG23 THR 24 HG23 THR 24 47.314 -7.780 -6.060 211 H ALA 25 HN ALA 25 50.256 -4.016 -7.293 212 HA ALA 25 HA ALA 25 50.377 -1.521 -6.009 213 HB1 ALA 25 HB1 ALA 25 52.090 -2.387 -7.593 214 HB2 ALA 25 HB2 ALA 25 50.910 -2.267 -8.944 215 HB3 ALA 25 HB3 ALA 25 51.487 -0.774 -8.110 216 H LYS 26 HN LYS 26 47.988 -2.771 -8.324 217 HA LYS 26 HA LYS 26 47.073 -0.347 -9.306 218 HB2 LYS 26 HB1 LYS 26 45.769 -3.083 -8.947 219 HB3 LYS 26 HB2 LYS 26 44.922 -1.750 -9.776 220 HG2 LYS 26 HG1 LYS 26 46.867 -1.593 -11.440 221 HG3 LYS 26 HG2 LYS 26 47.692 -2.935 -10.580 222 HD2 LYS 26 HD1 LYS 26 45.843 -4.483 -11.188 223 HD3 LYS 26 HD2 LYS 26 44.922 -3.131 -11.930 224 HE2 LYS 26 HE1 LYS 26 46.725 -2.802 -13.653 225 HE3 LYS 26 HE2 LYS 26 47.714 -4.105 -12.891 226 HZ1 LYS 26 HZ1 LYS 26 46.456 -4.910 -14.777 227 HZ2 LYS 26 HZ2 LYS 26 45.921 -5.655 -13.348 228 HZ3 LYS 26 HZ3 LYS 26 44.995 -4.429 -14.062 229 H ASP 27 HN ASP 27 45.979 -2.150 -6.294 230 HA ASP 27 HA ASP 27 43.861 -0.433 -5.751 231 HB2 ASP 27 HB1 ASP 27 44.291 -2.748 -4.730 232 HB3 ASP 27 HB2 ASP 27 45.653 -2.044 -3.794 233 H LEU 28 HN LEU 28 47.361 -0.260 -4.830 234 HA LEU 28 HA LEU 28 47.167 2.064 -3.318 235 HB2 LEU 28 HB1 LEU 28 49.441 0.737 -4.843 236 HB3 LEU 28 HB2 LEU 28 49.701 2.302 -4.038 237 HG LEU 28 HG LEU 28 49.010 1.280 -1.876 238 HD11 LEU 28 HD11 LEU 28 49.112 -1.280 -1.601 239 HD12 LEU 28 HD12 LEU 28 47.686 -0.736 -2.559 240 HD13 LEU 28 HD13 LEU 28 49.119 -1.441 -3.394 241 HD21 LEU 28 HD21 LEU 28 51.168 -0.024 -1.525 242 HD22 LEU 28 HD22 LEU 28 51.415 -0.063 -3.300 243 HD23 LEU 28 HD23 LEU 28 51.393 1.515 -2.433 244 H VAL 29 HN VAL 29 47.755 1.637 -6.895 245 HA VAL 29 HA VAL 29 48.120 4.334 -7.473 246 HB VAL 29 HB VAL 29 47.113 2.015 -9.137 247 HG11 VAL 29 HG11 VAL 29 47.628 3.459 -11.158 248 HG12 VAL 29 HG12 VAL 29 46.258 4.112 -10.211 249 HG13 VAL 29 HG13 VAL 29 47.889 4.873 -10.078 250 HG21 VAL 29 HG21 VAL 29 49.501 2.241 -10.095 251 HG22 VAL 29 HG22 VAL 29 49.824 3.556 -8.907 252 HG23 VAL 29 HG23 VAL 29 49.515 1.875 -8.341 253 H LYS 30 HN LYS 30 44.983 2.406 -7.352 254 HA LYS 30 HA LYS 30 43.421 4.502 -8.284 255 HB2 LYS 30 HB1 LYS 30 42.860 2.124 -6.443 256 HB3 LYS 30 HB2 LYS 30 41.551 3.236 -6.919 257 HG2 LYS 30 HG1 LYS 30 41.954 2.668 -9.351 258 HG3 LYS 30 HG2 LYS 30 43.332 1.615 -8.884 259 HD2 LYS 30 HD1 LYS 30 41.822 0.081 -7.678 260 HD3 LYS 30 HD2 LYS 30 40.444 1.220 -7.850 261 HE2 LYS 30 HE1 LYS 30 41.826 -0.173 -10.243 262 HE3 LYS 30 HE2 LYS 30 40.333 -0.780 -9.431 263 HZ1 LYS 30 HZ1 LYS 30 39.828 0.583 -11.353 264 HZ2 LYS 30 HZ2 LYS 30 39.271 1.332 -9.933 265 HZ3 LYS 30 HZ3 LYS 30 40.676 1.898 -10.694 266 H MET 31 HN MET 31 44.240 3.695 -4.754 267 HA MET 31 HA MET 31 42.715 5.868 -3.844 268 HB2 MET 31 HB1 MET 31 43.758 5.562 -1.697 269 HB3 MET 31 HB2 MET 31 43.265 3.978 -2.349 270 HG2 MET 31 HG1 MET 31 45.699 3.560 -3.038 271 HG3 MET 31 HG2 MET 31 46.139 5.149 -2.334 272 HE1 MET 31 HE1 MET 31 47.961 3.248 0.195 273 HE2 MET 31 HE2 MET 31 47.916 3.171 -1.600 274 HE3 MET 31 HE3 MET 31 47.780 4.757 -0.764 275 H LEU 32 HN LEU 32 46.104 5.633 -4.996 276 HA LEU 32 HA LEU 32 47.012 8.073 -4.013 277 HB2 LEU 32 HB1 LEU 32 48.435 6.196 -4.921 278 HB3 LEU 32 HB2 LEU 32 47.759 6.460 -6.546 279 HG LEU 32 HG LEU 32 48.770 8.853 -6.405 280 HD11 LEU 32 HD11 LEU 32 50.747 9.064 -4.802 281 HD12 LEU 32 HD12 LEU 32 49.163 8.956 -3.951 282 HD13 LEU 32 HD13 LEU 32 50.250 7.520 -4.022 283 HD21 LEU 32 HD21 LEU 32 51.033 8.009 -7.110 284 HD22 LEU 32 HD22 LEU 32 50.652 6.385 -6.452 285 HD23 LEU 32 HD23 LEU 32 49.697 7.039 -7.831 286 H GLU 33 HN GLU 33 45.417 7.233 -7.172 287 HA GLU 33 HA GLU 33 45.445 9.798 -8.254 288 HB2 GLU 33 HB1 GLU 33 43.586 7.403 -8.659 289 HB3 GLU 33 HB2 GLU 33 43.428 8.891 -9.619 290 HG2 GLU 33 HG1 GLU 33 45.759 8.589 -10.523 291 HG3 GLU 33 HG2 GLU 33 46.005 7.127 -9.496 292 H GLU 34 HN GLU 34 42.922 8.185 -6.154 293 HA GLU 34 HA GLU 34 41.173 10.346 -6.114 294 HB2 GLU 34 HB1 GLU 34 40.597 8.036 -5.403 295 HB3 GLU 34 HB2 GLU 34 41.734 8.140 -4.040 296 HG2 GLU 34 HG1 GLU 34 40.343 9.940 -2.979 297 HG3 GLU 34 HG2 GLU 34 39.210 9.937 -4.383 298 H THR 35 HN THR 35 43.988 9.595 -3.970 299 HA THR 35 HA THR 35 43.633 11.742 -2.228 300 HB THR 35 HB THR 35 46.141 10.234 -3.072 301 HG1 THR 35 HG1 THR 35 45.776 9.152 -1.086 302 HG21 THR 35 HG21 THR 35 47.158 11.029 -0.866 303 HG22 THR 35 HG22 THR 35 46.611 12.476 -1.778 304 HG23 THR 35 HG23 THR 35 45.620 11.846 -0.413 305 H GLY 36 HN GLY 36 45.616 11.518 -5.266 306 HA2 GLY 36 HA2 GLY 36 45.796 13.228 -6.739 307 HA3 GLY 36 HA1 GLY 36 45.337 14.395 -5.424 308 H THR 37 HN THR 37 47.850 12.122 -4.604 309 HA THR 37 HA THR 37 49.793 14.291 -4.820 310 HB THR 37 HB THR 37 49.827 11.645 -3.273 311 HG1 THR 37 HG1 THR 37 49.712 13.002 -1.441 312 HG21 THR 37 HG21 THR 37 51.898 12.532 -2.097 313 HG22 THR 37 HG22 THR 37 52.186 12.591 -3.869 314 HG23 THR 37 HG23 THR 37 51.770 14.097 -2.975 315 H LYS 38 HN LYS 38 51.495 14.164 -6.331 316 HA LYS 38 HA LYS 38 51.610 11.714 -7.827 317 HB2 LYS 38 HB1 LYS 38 53.113 14.367 -8.018 318 HB3 LYS 38 HB2 LYS 38 53.514 12.983 -9.068 319 HG2 LYS 38 HG1 LYS 38 50.704 14.299 -8.907 320 HG3 LYS 38 HG2 LYS 38 51.958 14.772 -10.101 321 HD2 LYS 38 HD1 LYS 38 50.946 13.195 -11.437 322 HD3 LYS 38 HD2 LYS 38 51.912 12.024 -10.478 323 HE2 LYS 38 HE1 LYS 38 49.732 12.131 -8.834 324 HE3 LYS 38 HE2 LYS 38 48.919 12.601 -10.377 325 HZ1 LYS 38 HZ1 LYS 38 48.930 10.217 -10.049 326 HZ2 LYS 38 HZ2 LYS 38 49.861 10.632 -11.407 327 HZ3 LYS 38 HZ3 LYS 38 50.625 10.194 -9.958 328 H VAL 39 HN VAL 39 52.836 10.032 -7.383 329 HA VAL 39 HA VAL 39 55.593 10.433 -6.481 330 HB VAL 39 HB VAL 39 55.567 8.360 -5.221 331 HG11 VAL 39 HG11 VAL 39 54.177 9.191 -3.233 332 HG12 VAL 39 HG12 VAL 39 55.167 10.499 -3.948 333 HG13 VAL 39 HG13 VAL 39 53.401 10.407 -4.306 334 HG21 VAL 39 HG21 VAL 39 53.369 7.251 -4.607 335 HG22 VAL 39 HG22 VAL 39 52.517 8.342 -5.761 336 HG23 VAL 39 HG23 VAL 39 53.723 7.148 -6.360 337 H SER 40 HN SER 40 56.987 8.502 -7.296 338 HA SER 40 HA SER 40 56.118 7.903 -9.922 339 HB2 SER 40 HB1 SER 40 58.550 6.964 -8.270 340 HB3 SER 40 HB2 SER 40 58.352 6.569 -10.006 341 HG SER 40 HG SER 40 59.646 8.516 -9.429 342 H ILE 41 HN ILE 41 55.560 5.905 -10.876 343 HA ILE 41 HA ILE 41 54.238 4.054 -9.255 344 HB ILE 41 HB ILE 41 55.168 4.024 -12.126 345 HG12 ILE 41 HG11 ILE 41 53.524 5.773 -11.741 346 HG13 ILE 41 HG12 ILE 41 52.772 4.465 -12.710 347 HG21 ILE 41 HG21 ILE 41 53.607 2.045 -12.508 348 HG22 ILE 41 HG22 ILE 41 54.744 1.612 -11.193 349 HG23 ILE 41 HG23 ILE 41 53.056 2.101 -10.796 350 HD11 ILE 41 HD11 ILE 41 51.169 5.303 -11.050 351 HD12 ILE 41 HD12 ILE 41 51.610 3.605 -10.645 352 HD13 ILE 41 HD13 ILE 41 52.308 4.972 -9.700 353 H SER 42 HN SER 42 57.500 3.985 -10.770 354 HA SER 42 HA SER 42 58.028 1.305 -10.324 355 HB2 SER 42 HB1 SER 42 59.320 2.751 -11.917 356 HB3 SER 42 HB2 SER 42 59.968 3.720 -10.556 357 HG SER 42 HG SER 42 61.337 1.996 -11.465 358 H THR 43 HN THR 43 58.698 4.174 -8.150 359 HA THR 43 HA THR 43 60.026 2.613 -6.256 360 HB THR 43 HB THR 43 59.566 4.468 -4.666 361 HG1 THR 43 HG1 THR 43 58.816 6.393 -5.606 362 HG21 THR 43 HG21 THR 43 61.135 6.060 -5.931 363 HG22 THR 43 HG22 THR 43 61.610 4.367 -6.300 364 HG23 THR 43 HG23 THR 43 60.660 5.316 -7.499 365 H VAL 44 HN VAL 44 56.480 3.357 -6.595 366 HA VAL 44 HA VAL 44 55.725 2.198 -4.164 367 HB VAL 44 HB VAL 44 54.281 2.481 -6.820 368 HG11 VAL 44 HG11 VAL 44 52.152 2.085 -5.492 369 HG12 VAL 44 HG12 VAL 44 53.184 0.624 -5.540 370 HG13 VAL 44 HG13 VAL 44 53.137 1.647 -4.053 371 HG21 VAL 44 HG21 VAL 44 53.120 4.383 -5.535 372 HG22 VAL 44 HG22 VAL 44 54.207 4.063 -4.134 373 HG23 VAL 44 HG23 VAL 44 54.883 4.652 -5.695 374 H LYS 45 HN LYS 45 56.133 0.703 -7.466 375 HA LYS 45 HA LYS 45 55.519 -1.894 -6.657 376 HB2 LYS 45 HB1 LYS 45 57.286 -0.789 -8.892 377 HB3 LYS 45 HB2 LYS 45 56.978 -2.536 -8.718 378 HG2 LYS 45 HG1 LYS 45 54.468 -2.079 -8.947 379 HG3 LYS 45 HG2 LYS 45 54.821 -0.329 -9.131 380 HD2 LYS 45 HD1 LYS 45 54.433 -1.231 -11.340 381 HD3 LYS 45 HD2 LYS 45 56.193 -0.899 -11.206 382 HE2 LYS 45 HE1 LYS 45 56.661 -3.327 -10.824 383 HE3 LYS 45 HE2 LYS 45 54.895 -3.694 -10.865 384 HZ1 LYS 45 HZ1 LYS 45 55.949 -4.097 -12.991 385 HZ2 LYS 45 HZ2 LYS 45 54.823 -2.833 -13.120 386 HZ3 LYS 45 HZ3 LYS 45 56.483 -2.488 -13.081 387 H ARG 46 HN ARG 46 58.681 -0.166 -6.679 388 HA ARG 46 HA ARG 46 60.279 -2.336 -5.908 389 HB2 ARG 46 HB1 ARG 46 61.160 -0.236 -6.834 390 HB3 ARG 46 HB2 ARG 46 60.638 0.673 -5.394 391 HG2 ARG 46 HG1 ARG 46 62.217 -0.772 -3.983 392 HG3 ARG 46 HG2 ARG 46 62.711 -1.651 -5.441 393 HD2 ARG 46 HD1 ARG 46 63.569 0.462 -6.507 394 HD3 ARG 46 HD2 ARG 46 63.219 1.375 -4.982 395 HE ARG 46 HE ARG 46 64.594 -0.933 -4.192 396 HH11 ARG 46 HH11 ARG 46 66.900 2.026 -5.926 397 HH12 ARG 46 HH12 ARG 46 65.186 1.874 -6.228 398 HH21 ARG 46 HH21 ARG 46 67.920 0.412 -4.478 399 HH22 ARG 46 HH22 ARG 46 66.914 -0.803 -3.766 400 H VAL 47 HN VAL 47 58.504 0.058 -3.761 401 HA VAL 47 HA VAL 47 59.438 -1.013 -1.367 402 HB VAL 47 HB VAL 47 56.891 0.459 -2.084 403 HG11 VAL 47 HG11 VAL 47 56.625 0.875 0.405 404 HG12 VAL 47 HG12 VAL 47 56.413 -0.854 -0.002 405 HG13 VAL 47 HG13 VAL 47 57.957 -0.286 0.739 406 HG21 VAL 47 HG21 VAL 47 58.178 2.342 -0.855 407 HG22 VAL 47 HG22 VAL 47 59.569 1.217 -0.648 408 HG23 VAL 47 HG23 VAL 47 59.070 1.753 -2.292 409 H LEU 48 HN LEU 48 56.421 -1.967 -3.308 410 HA LEU 48 HA LEU 48 55.729 -3.977 -1.544 411 HB2 LEU 48 HB1 LEU 48 55.265 -3.549 -4.518 412 HB3 LEU 48 HB2 LEU 48 54.685 -5.040 -3.739 413 HG LEU 48 HG LEU 48 53.984 -2.209 -2.687 414 HD11 LEU 48 HD11 LEU 48 51.733 -2.513 -3.860 415 HD12 LEU 48 HD12 LEU 48 53.090 -2.408 -5.040 416 HD13 LEU 48 HD13 LEU 48 52.355 -4.007 -4.648 417 HD21 LEU 48 HD21 LEU 48 52.086 -3.421 -1.574 418 HD22 LEU 48 HD22 LEU 48 52.652 -4.981 -2.251 419 HD23 LEU 48 HD23 LEU 48 53.682 -4.088 -1.075 420 H TYR 49 HN TYR 49 57.942 -4.269 -4.526 421 HA TYR 49 HA TYR 49 58.375 -6.949 -4.055 422 HB2 TYR 49 HB1 TYR 49 59.787 -4.797 -5.606 423 HB3 TYR 49 HB2 TYR 49 60.780 -6.228 -5.197 424 HD1 TYR 49 HD1 TYR 49 60.099 -8.433 -5.945 425 HD2 TYR 49 HD2 TYR 49 57.839 -4.992 -7.189 426 HE1 TYR 49 HE1 TYR 49 58.968 -9.805 -7.670 427 HE2 TYR 49 HE2 TYR 49 56.683 -6.376 -8.885 428 HH TYR 49 HH TYR 49 56.431 -8.428 -9.773 429 H ARG 50 HN ARG 50 60.281 -4.135 -2.643 430 HA ARG 50 HA ARG 50 62.204 -5.856 -1.508 431 HB2 ARG 50 HB1 ARG 50 62.502 -3.432 -1.899 432 HB3 ARG 50 HB2 ARG 50 61.271 -3.045 -0.673 433 HG2 ARG 50 HG1 ARG 50 63.723 -4.741 0.088 434 HG3 ARG 50 HG2 ARG 50 63.938 -2.996 -0.145 435 HD2 ARG 50 HD1 ARG 50 61.816 -4.043 1.803 436 HD3 ARG 50 HD2 ARG 50 63.525 -3.721 2.309 437 HE ARG 50 HE ARG 50 62.539 -1.494 0.826 438 HH11 ARG 50 HH11 ARG 50 61.725 -1.813 4.874 439 HH12 ARG 50 HH12 ARG 50 62.024 -3.201 3.856 440 HH21 ARG 50 HH21 ARG 50 61.803 0.348 3.861 441 HH22 ARG 50 HH22 ARG 50 62.189 0.455 2.178 442 H HIS 51 HN HIS 51 59.147 -4.493 -0.066 443 HA HIS 51 HA HIS 51 59.471 -5.780 2.384 444 HB2 HIS 51 HB1 HIS 51 58.018 -3.821 2.111 445 HB3 HIS 51 HB2 HIS 51 56.966 -4.713 0.977 446 HD1 HIS 51 HD1 HIS 51 58.129 -5.286 4.646 447 HD2 HIS 51 HD2 HIS 51 54.671 -5.465 2.273 448 HE1 HIS 51 HE1 HIS 51 56.165 -6.005 6.136 449 H ASN 52 HN ASN 52 57.551 -6.929 -0.561 450 HA ASN 52 HA ASN 52 56.638 -9.183 0.806 451 HB2 ASN 52 HB1 ASN 52 57.008 -8.542 -2.186 452 HB3 ASN 52 HB2 ASN 52 56.329 -10.118 -1.672 453 HD21 ASN 52 HD21 ASN 52 53.542 -7.694 -0.227 454 HD22 ASN 52 HD22 ASN 52 54.928 -8.287 0.654 455 H LEU 53 HN LEU 53 59.619 -8.671 -1.223 456 HA LEU 53 HA LEU 53 60.136 -11.423 -1.442 457 HB2 LEU 53 HB1 LEU 53 60.904 -9.563 -3.020 458 HB3 LEU 53 HB2 LEU 53 62.023 -8.997 -1.757 459 HG LEU 53 HG LEU 53 63.106 -11.388 -1.883 460 HD11 LEU 53 HD11 LEU 53 62.674 -12.568 -4.107 461 HD12 LEU 53 HD12 LEU 53 61.209 -12.514 -3.062 462 HD13 LEU 53 HD13 LEU 53 61.362 -11.387 -4.459 463 HD21 LEU 53 HD21 LEU 53 64.470 -10.762 -3.883 464 HD22 LEU 53 HD22 LEU 53 63.263 -9.527 -4.362 465 HD23 LEU 53 HD23 LEU 53 64.180 -9.334 -2.825 466 H LYS 54 HN LYS 54 61.370 -8.843 0.804 467 HA LYS 54 HA LYS 54 62.533 -10.990 2.395 468 HB2 LYS 54 HB1 LYS 54 64.342 -9.926 1.038 469 HB3 LYS 54 HB2 LYS 54 63.843 -8.308 1.593 470 HG2 LYS 54 HG1 LYS 54 65.886 -9.022 2.781 471 HG3 LYS 54 HG2 LYS 54 64.528 -8.922 3.949 472 HD2 LYS 54 HD1 LYS 54 64.297 -11.351 3.998 473 HD3 LYS 54 HD2 LYS 54 65.388 -11.546 2.584 474 HE2 LYS 54 HE1 LYS 54 66.347 -10.336 5.266 475 HE3 LYS 54 HE2 LYS 54 66.439 -12.099 4.890 476 HZ1 LYS 54 HZ1 LYS 54 68.476 -10.948 4.326 477 HZ2 LYS 54 HZ2 LYS 54 67.733 -11.555 2.926 478 HZ3 LYS 54 HZ3 LYS 54 67.645 -9.900 3.280 479 H GLY 55 HN GLY 55 61.809 -10.960 4.478 480 HA2 GLY 55 HA2 GLY 55 60.478 -8.550 5.396 481 HA3 GLY 55 HA1 GLY 55 60.523 -10.191 6.176 482 H ARG 56 HN ARG 56 62.085 -7.066 5.830 483 HA ARG 56 HA ARG 56 64.440 -7.785 7.339 484 HB2 ARG 56 HB1 ARG 56 63.269 -5.105 6.402 485 HB3 ARG 56 HB2 ARG 56 64.862 -5.228 7.185 486 HG2 ARG 56 HG1 ARG 56 65.662 -6.683 5.257 487 HG3 ARG 56 HG2 ARG 56 64.050 -6.616 4.520 488 HD2 ARG 56 HD1 ARG 56 65.334 -4.972 3.315 489 HD3 ARG 56 HD2 ARG 56 64.246 -4.015 4.403 490 HE ARG 56 HE ARG 56 66.724 -4.583 5.715 491 HH11 ARG 56 HH11 ARG 56 68.100 -1.338 4.812 492 HH12 ARG 56 HH12 ARG 56 68.297 -2.780 5.780 493 HH21 ARG 56 HH21 ARG 56 66.206 -1.201 3.385 494 HH22 ARG 56 HH22 ARG 56 65.115 -2.543 3.322 495 H SER 57 HN SER 57 62.740 -8.640 9.072 496 HA SER 57 HA SER 57 61.378 -6.750 10.610 497 HB2 SER 57 HB1 SER 57 60.652 -9.130 10.365 498 HB3 SER 57 HB2 SER 57 62.155 -9.711 11.148 499 HG SER 57 HG SER 57 60.178 -9.566 12.470 500 H ALA 58 HN ALA 58 64.473 -8.504 11.201 501 HA ALA 58 HA ALA 58 64.912 -7.268 13.756 502 HB1 ALA 58 HB1 ALA 58 65.749 -9.551 13.194 503 HB2 ALA 58 HB2 ALA 58 66.785 -8.858 11.899 504 HB3 ALA 58 HB3 ALA 58 67.108 -8.457 13.628 505 H ARG 59 HN ARG 59 65.746 -6.539 10.486 506 HA ARG 59 HA ARG 59 67.115 -5.142 9.374 507 HB2 ARG 59 HB1 ARG 59 66.158 -3.335 10.685 508 HB3 ARG 59 HB2 ARG 59 67.341 -3.588 11.991 509 HG2 ARG 59 HG1 ARG 59 69.206 -3.019 10.328 510 HG3 ARG 59 HG2 ARG 59 67.990 -2.760 9.064 511 HD2 ARG 59 HD1 ARG 59 67.932 -1.148 11.692 512 HD3 ARG 59 HD2 ARG 59 68.754 -0.558 10.189 513 HE ARG 59 HE ARG 59 66.135 -1.484 9.531 514 HH11 ARG 59 HH11 ARG 59 66.648 2.395 10.869 515 HH12 ARG 59 HH12 ARG 59 67.797 1.125 11.210 516 HH21 ARG 59 HH21 ARG 59 64.694 1.817 9.606 517 HH22 ARG 59 HH22 ARG 59 64.529 0.185 9.054 518 H LYS 60 HN LYS 60 69.034 -5.847 8.581 519 HA LYS 60 HA LYS 60 70.970 -6.809 10.548 520 HB2 LYS 60 HB1 LYS 60 70.613 -7.330 7.542 521 HB3 LYS 60 HB2 LYS 60 72.033 -7.916 8.446 522 HG2 LYS 60 HG1 LYS 60 70.363 -9.205 9.983 523 HG3 LYS 60 HG2 LYS 60 69.066 -8.731 8.836 524 HD2 LYS 60 HD1 LYS 60 71.623 -10.330 8.121 525 HD3 LYS 60 HD2 LYS 60 70.011 -11.054 8.441 526 HE2 LYS 60 HE1 LYS 60 69.065 -9.941 6.424 527 HE3 LYS 60 HE2 LYS 60 70.638 -9.111 6.117 528 HZ1 LYS 60 HZ1 LYS 60 70.424 -11.151 4.829 529 HZ2 LYS 60 HZ2 LYS 60 71.690 -11.289 5.952 530 HZ3 LYS 60 HZ3 LYS 60 70.212 -12.066 6.242 531 H LEU 61 HN LEU 61 70.702 -4.825 7.533 532 HA LEU 61 HA LEU 61 72.763 -3.092 8.558 533 HB2 LEU 61 HB1 LEU 61 74.025 -3.019 6.463 534 HB3 LEU 61 HB2 LEU 61 74.135 -4.651 7.160 535 HG LEU 61 HG LEU 61 72.056 -4.008 5.022 536 HD11 LEU 61 HD11 LEU 61 73.814 -4.713 3.270 537 HD12 LEU 61 HD12 LEU 61 74.224 -3.162 4.089 538 HD13 LEU 61 HD13 LEU 61 75.066 -4.683 4.562 539 HD21 LEU 61 HD21 LEU 61 72.404 -6.407 4.354 540 HD22 LEU 61 HD22 LEU 61 73.626 -6.613 5.649 541 HD23 LEU 61 HD23 LEU 61 71.914 -6.259 6.080 542 H GLU 62 HN GLU 62 72.669 -0.942 7.231 543 HA GLU 62 HA GLU 62 69.832 -0.586 6.682 544 HB2 GLU 62 HB1 GLU 62 70.827 0.640 8.615 545 HB3 GLU 62 HB2 GLU 62 72.003 1.418 7.533 546 HG2 GLU 62 HG1 GLU 62 70.159 2.602 6.318 547 HG3 GLU 62 HG2 GLU 62 68.910 1.748 7.303 Start of MODEL 9 1 H1 ALA 1 HT1 ALA 1 63.128 12.149 -4.804 2 H2 ALA 1 HT2 ALA 1 62.383 11.568 -3.394 3 H3 ALA 1 HT3 ALA 1 63.463 10.578 -4.253 4 HA ALA 1 HA ALA 1 65.305 12.049 -3.725 5 HB1 ALA 1 HB1 ALA 1 63.912 14.125 -3.747 6 HB2 ALA 1 HB2 ALA 1 63.111 13.618 -2.219 7 HB3 ALA 1 HB3 ALA 1 64.866 14.037 -2.226 8 H SER 2 HN SER 2 62.846 11.800 -1.107 9 HA SER 2 HA SER 2 64.377 9.640 0.112 10 HB2 SER 2 HB1 SER 2 62.968 11.985 1.553 11 HB3 SER 2 HB2 SER 2 63.584 10.536 2.407 12 HG SER 2 HG SER 2 64.987 12.482 2.323 13 H MET 3 HN MET 3 62.925 8.324 1.535 14 HA MET 3 HA MET 3 60.830 7.390 -0.010 15 HB2 MET 3 HB1 MET 3 62.313 6.061 1.491 16 HB3 MET 3 HB2 MET 3 61.627 6.863 2.928 17 HG2 MET 3 HG1 MET 3 59.375 5.779 2.421 18 HG3 MET 3 HG2 MET 3 60.094 5.005 0.972 19 HE1 MET 3 HE1 MET 3 59.823 1.789 2.841 20 HE2 MET 3 HE2 MET 3 58.650 3.105 2.495 21 HE3 MET 3 HE3 MET 3 59.864 2.635 1.257 22 H VAL 4 HN VAL 4 60.819 9.637 2.693 23 HA VAL 4 HA VAL 4 58.071 9.198 3.372 24 HB VAL 4 HB VAL 4 58.510 10.759 5.237 25 HG11 VAL 4 HG11 VAL 4 60.166 9.187 6.405 26 HG12 VAL 4 HG12 VAL 4 58.898 8.282 5.526 27 HG13 VAL 4 HG13 VAL 4 60.550 8.435 4.818 28 HG21 VAL 4 HG21 VAL 4 60.910 11.478 5.665 29 HG22 VAL 4 HG22 VAL 4 61.363 10.873 4.029 30 HG23 VAL 4 HG23 VAL 4 60.213 12.247 4.204 31 H LEU 5 HN LEU 5 58.670 10.624 0.725 32 HA LEU 5 HA LEU 5 58.791 13.359 1.061 33 HB2 LEU 5 HB1 LEU 5 59.574 12.004 -0.912 34 HB3 LEU 5 HB2 LEU 5 57.890 11.609 -1.330 35 HG LEU 5 HG LEU 5 59.035 13.118 -2.758 36 HD11 LEU 5 HD11 LEU 5 57.243 14.990 -3.011 37 HD12 LEU 5 HD12 LEU 5 56.602 13.310 -2.903 38 HD13 LEU 5 HD13 LEU 5 56.524 14.399 -1.470 39 HD21 LEU 5 HD21 LEU 5 59.409 15.595 -2.139 40 HD22 LEU 5 HD22 LEU 5 59.073 15.163 -0.432 41 HD23 LEU 5 HD23 LEU 5 60.469 14.414 -1.286 42 H SER 6 HN SER 6 55.845 11.304 0.308 43 HA SER 6 HA SER 6 54.267 13.655 1.040 44 HB2 SER 6 HB1 SER 6 53.572 11.331 -0.882 45 HB3 SER 6 HB2 SER 6 52.365 12.547 -0.358 46 HG SER 6 HG SER 6 53.496 12.903 -2.444 47 HA PRO 7 HA PRO 7 53.899 10.400 4.155 48 HB2 PRO 7 HB2 PRO 7 53.113 11.820 6.345 49 HB3 PRO 7 HB1 PRO 7 54.784 11.907 5.661 50 HG2 PRO 7 HG2 PRO 7 52.586 13.908 5.056 51 HG3 PRO 7 HG1 PRO 7 54.279 14.222 5.626 52 HD2 PRO 7 HD2 PRO 7 53.609 14.220 2.934 53 HD3 PRO 7 HD1 PRO 7 55.246 13.670 3.539 54 H ARG 8 HN ARG 8 51.217 12.561 3.184 55 HA ARG 8 HA ARG 8 49.105 11.155 4.393 56 HB2 ARG 8 HB1 ARG 8 49.375 12.749 1.792 57 HB3 ARG 8 HB2 ARG 8 47.804 12.051 2.252 58 HG2 ARG 8 HG1 ARG 8 49.233 13.790 4.313 59 HG3 ARG 8 HG2 ARG 8 48.644 14.625 2.864 60 HD2 ARG 8 HD1 ARG 8 46.847 14.742 4.542 61 HD3 ARG 8 HD2 ARG 8 46.286 13.651 3.210 62 HE ARG 8 HE ARG 8 47.636 12.422 5.544 63 HH11 ARG 8 HH11 ARG 8 44.708 10.403 6.085 64 HH12 ARG 8 HH12 ARG 8 46.406 10.630 6.426 65 HH21 ARG 8 HH21 ARG 8 43.671 11.888 4.541 66 HH22 ARG 8 HH22 ARG 8 44.622 13.158 3.849 67 H ASP 9 HN ASP 9 50.729 10.605 1.154 68 HA ASP 9 HA ASP 9 49.069 8.310 0.782 69 HB2 ASP 9 HB1 ASP 9 51.464 9.529 -0.750 70 HB3 ASP 9 HB2 ASP 9 50.556 8.093 -1.335 71 H GLU 10 HN GLU 10 52.553 9.009 1.679 72 HA GLU 10 HA GLU 10 53.359 6.390 1.203 73 HB2 GLU 10 HB1 GLU 10 54.888 8.332 1.183 74 HB3 GLU 10 HB2 GLU 10 54.627 8.597 2.921 75 HG2 GLU 10 HG1 GLU 10 56.795 7.458 2.561 76 HG3 GLU 10 HG2 GLU 10 55.693 6.288 3.383 77 H ARG 11 HN ARG 11 52.374 7.972 4.350 78 HA ARG 11 HA ARG 11 53.046 5.664 5.861 79 HB2 ARG 11 HB1 ARG 11 51.164 7.963 6.454 80 HB3 ARG 11 HB2 ARG 11 51.582 6.713 7.649 81 HG2 ARG 11 HG1 ARG 11 54.137 7.483 6.775 82 HG3 ARG 11 HG2 ARG 11 53.267 9.001 6.484 83 HD2 ARG 11 HD1 ARG 11 53.464 7.581 9.210 84 HD3 ARG 11 HD2 ARG 11 54.242 9.151 8.749 85 HE ARG 11 HE ARG 11 52.066 10.164 8.542 86 HH11 ARG 11 HH11 ARG 11 50.646 7.214 11.060 87 HH12 ARG 11 HH12 ARG 11 52.099 7.001 10.114 88 HH21 ARG 11 HH21 ARG 11 49.455 9.263 10.830 89 HH22 ARG 11 HH22 ARG 11 50.093 10.475 9.771 90 H THR 12 HN THR 12 49.995 6.773 4.330 91 HA THR 12 HA THR 12 48.377 4.691 5.223 92 HB THR 12 HB THR 12 48.332 6.277 2.617 93 HG1 THR 12 HG1 THR 12 46.720 7.474 3.715 94 HG21 THR 12 HG21 THR 12 45.851 5.662 2.501 95 HG22 THR 12 HG22 THR 12 46.795 4.141 2.645 96 HG23 THR 12 HG23 THR 12 45.955 4.816 4.087 97 H LEU 13 HN LEU 13 50.535 4.928 2.359 98 HA LEU 13 HA LEU 13 49.768 2.554 1.140 99 HB2 LEU 13 HB1 LEU 13 51.050 4.490 0.113 100 HB3 LEU 13 HB2 LEU 13 52.448 4.122 1.150 101 HG LEU 13 HG LEU 13 52.710 3.639 -1.129 102 HD11 LEU 13 HD11 LEU 13 53.595 1.193 -1.049 103 HD12 LEU 13 HD12 LEU 13 54.147 2.253 0.300 104 HD13 LEU 13 HD13 LEU 13 52.834 1.049 0.575 105 HD21 LEU 13 HD21 LEU 13 51.593 1.634 -2.279 106 HD22 LEU 13 HD22 LEU 13 50.474 1.518 -0.883 107 HD23 LEU 13 HD23 LEU 13 50.496 3.009 -1.892 108 H VAL 14 HN VAL 14 52.553 3.157 3.520 109 HA VAL 14 HA VAL 14 53.283 0.444 3.461 110 HB VAL 14 HB VAL 14 54.621 0.828 5.423 111 HG11 VAL 14 HG11 VAL 14 56.150 2.531 4.252 112 HG12 VAL 14 HG12 VAL 14 55.527 1.301 3.112 113 HG13 VAL 14 HG13 VAL 14 54.800 2.952 3.141 114 HG21 VAL 14 HG21 VAL 14 54.922 3.154 6.318 115 HG22 VAL 14 HG22 VAL 14 53.482 3.690 5.375 116 HG23 VAL 14 HG23 VAL 14 53.307 2.473 6.691 117 H ARG 15 HN ARG 15 51.021 2.294 5.658 118 HA ARG 15 HA ARG 15 50.554 0.132 7.383 119 HB2 ARG 15 HB1 ARG 15 49.896 2.420 7.934 120 HB3 ARG 15 HB2 ARG 15 48.794 2.517 6.539 121 HG2 ARG 15 HG1 ARG 15 47.452 2.213 8.558 122 HG3 ARG 15 HG2 ARG 15 47.343 0.706 7.632 123 HD2 ARG 15 HD1 ARG 15 47.613 -0.069 9.837 124 HD3 ARG 15 HD2 ARG 15 49.277 -0.248 9.146 125 HE ARG 15 HE ARG 15 48.953 2.360 10.276 126 HH11 ARG 15 HH11 ARG 15 50.421 1.384 13.440 127 HH12 ARG 15 HH12 ARG 15 49.816 2.696 12.458 128 HH21 ARG 15 HH21 ARG 15 50.308 -0.826 12.534 129 HH22 ARG 15 HH22 ARG 15 49.595 -1.036 10.972 130 H LYS 16 HN LYS 16 48.725 1.040 4.330 131 HA LYS 16 HA LYS 16 46.925 -1.067 4.600 132 HB2 LYS 16 HB1 LYS 16 46.482 0.879 3.209 133 HB3 LYS 16 HB2 LYS 16 47.848 0.487 2.134 134 HG2 LYS 16 HG1 LYS 16 46.699 -1.543 1.301 135 HG3 LYS 16 HG2 LYS 16 45.453 -1.436 2.589 136 HD2 LYS 16 HD1 LYS 16 45.845 0.808 0.518 137 HD3 LYS 16 HD2 LYS 16 44.884 -0.658 0.130 138 HE2 LYS 16 HE1 LYS 16 44.279 1.095 2.610 139 HE3 LYS 16 HE2 LYS 16 43.529 1.393 0.996 140 HZ1 LYS 16 HZ1 LYS 16 42.151 0.002 2.390 141 HZ2 LYS 16 HZ2 LYS 16 42.685 -0.868 1.033 142 HZ3 LYS 16 HZ3 LYS 16 43.391 -1.145 2.549 143 H VAL 17 HN VAL 17 50.104 -0.970 2.751 144 HA VAL 17 HA VAL 17 49.848 -3.571 1.784 145 HB VAL 17 HB VAL 17 52.244 -1.807 2.320 146 HG11 VAL 17 HG11 VAL 17 53.532 -3.380 0.803 147 HG12 VAL 17 HG12 VAL 17 53.064 -4.175 2.336 148 HG13 VAL 17 HG13 VAL 17 52.147 -4.527 0.823 149 HG21 VAL 17 HG21 VAL 17 52.108 -1.628 -0.259 150 HG22 VAL 17 HG22 VAL 17 50.628 -2.656 -0.222 151 HG23 VAL 17 HG23 VAL 17 50.621 -1.023 0.536 152 H GLN 18 HN GLN 18 51.301 -2.374 4.921 153 HA GLN 18 HA GLN 18 52.377 -4.845 5.639 154 HB2 GLN 18 HB1 GLN 18 52.825 -2.449 6.577 155 HB3 GLN 18 HB2 GLN 18 51.310 -2.602 7.502 156 HG2 GLN 18 HG1 GLN 18 53.014 -3.173 9.102 157 HG3 GLN 18 HG2 GLN 18 52.449 -4.787 8.558 158 HE21 GLN 18 HE21 GLN 18 56.049 -3.208 7.125 159 HE22 GLN 18 HE22 GLN 18 54.728 -2.144 7.557 160 H ILE 19 HN ILE 19 49.175 -3.344 6.405 161 HA ILE 19 HA ILE 19 48.395 -5.546 8.030 162 HB ILE 19 HB ILE 19 47.047 -3.050 7.038 163 HG12 ILE 19 HG11 ILE 19 48.792 -2.577 8.670 164 HG13 ILE 19 HG12 ILE 19 47.192 -2.294 9.426 165 HG21 ILE 19 HG21 ILE 19 45.118 -3.556 8.604 166 HG22 ILE 19 HG22 ILE 19 45.314 -4.946 7.490 167 HG23 ILE 19 HG23 ILE 19 45.927 -5.054 9.181 168 HD11 ILE 19 HD11 ILE 19 48.703 -3.362 11.036 169 HD12 ILE 19 HD12 ILE 19 47.369 -4.502 10.626 170 HD13 ILE 19 HD13 ILE 19 49.012 -4.737 9.919 171 H ASN 20 HN ASN 20 47.581 -4.452 4.642 172 HA ASN 20 HA ASN 20 46.084 -6.950 4.393 173 HB2 ASN 20 HB1 ASN 20 45.783 -4.248 2.883 174 HB3 ASN 20 HB2 ASN 20 44.804 -5.696 2.493 175 HD21 ASN 20 HD21 ASN 20 42.928 -5.363 5.698 176 HD22 ASN 20 HD22 ASN 20 43.784 -6.620 4.839 177 HA PRO 21 HA PRO 21 49.807 -6.978 1.702 178 HB2 PRO 21 HB2 PRO 21 50.535 -9.615 1.855 179 HB3 PRO 21 HB1 PRO 21 50.771 -8.464 3.230 180 HG2 PRO 21 HG2 PRO 21 48.420 -10.384 2.879 181 HG3 PRO 21 HG1 PRO 21 49.483 -10.169 4.334 182 HD2 PRO 21 HD2 PRO 21 47.096 -8.796 4.086 183 HD3 PRO 21 HD1 PRO 21 48.555 -8.102 4.944 184 H ARG 22 HN ARG 22 46.736 -8.264 1.196 185 HA ARG 22 HA ARG 22 47.314 -9.804 -1.182 186 HB2 ARG 22 HB1 ARG 22 44.722 -9.033 0.253 187 HB3 ARG 22 HB2 ARG 22 44.736 -10.080 -1.186 188 HG2 ARG 22 HG1 ARG 22 46.279 -11.694 0.155 189 HG3 ARG 22 HG2 ARG 22 46.064 -10.650 1.573 190 HD2 ARG 22 HD1 ARG 22 43.579 -10.955 1.543 191 HD3 ARG 22 HD2 ARG 22 43.708 -12.079 0.128 192 HE ARG 22 HE ARG 22 45.537 -12.944 2.117 193 HH11 ARG 22 HH11 ARG 22 43.229 -15.315 3.586 194 HH12 ARG 22 HH12 ARG 22 44.901 -14.875 3.338 195 HH21 ARG 22 HH21 ARG 22 41.557 -13.968 2.535 196 HH22 ARG 22 HH22 ARG 22 42.067 -12.596 1.613 197 H THR 23 HN THR 23 47.195 -6.457 -0.831 198 HA THR 23 HA THR 23 45.261 -5.944 -2.832 199 HB THR 23 HB THR 23 46.059 -3.600 -2.745 200 HG1 THR 23 HG1 THR 23 47.491 -3.076 -1.060 201 HG21 THR 23 HG21 THR 23 45.244 -3.200 -0.350 202 HG22 THR 23 HG22 THR 23 44.303 -4.556 -1.059 203 HG23 THR 23 HG23 THR 23 45.643 -4.897 0.095 204 H THR 24 HN THR 24 45.679 -4.588 -4.791 205 HA THR 24 HA THR 24 48.166 -5.337 -6.147 206 HB THR 24 HB THR 24 45.325 -5.245 -7.267 207 HG1 THR 24 HG1 THR 24 45.719 -7.458 -7.696 208 HG21 THR 24 HG21 THR 24 46.359 -6.066 -9.454 209 HG22 THR 24 HG22 THR 24 47.234 -4.580 -8.955 210 HG23 THR 24 HG23 THR 24 47.978 -6.195 -8.679 211 H ALA 25 HN ALA 25 48.899 -3.730 -7.656 212 HA ALA 25 HA ALA 25 48.873 -1.205 -6.474 213 HB1 ALA 25 HB1 ALA 25 50.784 -2.199 -7.708 214 HB2 ALA 25 HB2 ALA 25 49.876 -2.045 -9.251 215 HB3 ALA 25 HB3 ALA 25 50.376 -0.567 -8.343 216 H LYS 26 HN LYS 26 46.702 -2.405 -8.970 217 HA LYS 26 HA LYS 26 45.819 -0.006 -10.016 218 HB2 LYS 26 HB1 LYS 26 44.486 -2.694 -9.431 219 HB3 LYS 26 HB2 LYS 26 43.543 -1.379 -10.177 220 HG2 LYS 26 HG1 LYS 26 46.218 -2.417 -11.360 221 HG3 LYS 26 HG2 LYS 26 44.637 -3.160 -11.775 222 HD2 LYS 26 HD1 LYS 26 44.727 -0.147 -11.994 223 HD3 LYS 26 HD2 LYS 26 45.859 -1.000 -13.098 224 HE2 LYS 26 HE1 LYS 26 43.649 -0.528 -14.208 225 HE3 LYS 26 HE2 LYS 26 43.958 -2.302 -14.089 226 HZ1 LYS 26 HZ1 LYS 26 41.715 -1.732 -13.466 227 HZ2 LYS 26 HZ2 LYS 26 42.557 -2.359 -12.131 228 HZ3 LYS 26 HZ3 LYS 26 42.269 -0.692 -12.243 229 H ASP 27 HN ASP 27 44.780 -1.621 -6.885 230 HA ASP 27 HA ASP 27 42.814 0.266 -6.304 231 HB2 ASP 27 HB1 ASP 27 43.046 -2.045 -5.273 232 HB3 ASP 27 HB2 ASP 27 44.545 -1.510 -4.439 233 H LEU 28 HN LEU 28 46.342 0.173 -5.603 234 HA LEU 28 HA LEU 28 46.396 2.393 -3.946 235 HB2 LEU 28 HB1 LEU 28 48.423 0.930 -5.701 236 HB3 LEU 28 HB2 LEU 28 48.927 2.403 -4.840 237 HG LEU 28 HG LEU 28 48.572 1.411 -2.716 238 HD11 LEU 28 HD11 LEU 28 47.967 -1.064 -2.358 239 HD12 LEU 28 HD12 LEU 28 46.582 -0.111 -3.002 240 HD13 LEU 28 HD13 LEU 28 47.528 -1.186 -4.098 241 HD21 LEU 28 HD21 LEU 28 50.238 -0.512 -2.833 242 HD22 LEU 28 HD22 LEU 28 50.043 -0.543 -4.615 243 HD23 LEU 28 HD23 LEU 28 50.708 0.925 -3.813 244 H VAL 29 HN VAL 29 46.945 2.233 -7.621 245 HA VAL 29 HA VAL 29 47.495 4.984 -7.736 246 HB VAL 29 HB VAL 29 47.120 4.894 -10.118 247 HG11 VAL 29 HG11 VAL 29 49.022 3.216 -10.526 248 HG12 VAL 29 HG12 VAL 29 49.359 4.282 -9.129 249 HG13 VAL 29 HG13 VAL 29 48.800 2.588 -8.857 250 HG21 VAL 29 HG21 VAL 29 46.695 2.690 -11.245 251 HG22 VAL 29 HG22 VAL 29 46.300 1.962 -9.646 252 HG23 VAL 29 HG23 VAL 29 45.278 3.280 -10.323 253 H LYS 30 HN LYS 30 44.419 3.145 -7.902 254 HA LYS 30 HA LYS 30 42.763 5.254 -8.639 255 HB2 LYS 30 HB1 LYS 30 42.209 2.840 -8.721 256 HB3 LYS 30 HB2 LYS 30 42.299 2.725 -6.945 257 HG2 LYS 30 HG1 LYS 30 40.279 4.185 -6.730 258 HG3 LYS 30 HG2 LYS 30 40.247 4.433 -8.508 259 HD2 LYS 30 HD1 LYS 30 38.577 2.726 -7.864 260 HD3 LYS 30 HD2 LYS 30 39.880 1.962 -8.834 261 HE2 LYS 30 HE1 LYS 30 39.215 0.470 -6.974 262 HE3 LYS 30 HE2 LYS 30 40.906 1.043 -6.711 263 HZ1 LYS 30 HZ1 LYS 30 39.592 1.152 -4.710 264 HZ2 LYS 30 HZ2 LYS 30 40.044 2.711 -5.204 265 HZ3 LYS 30 HZ3 LYS 30 38.457 2.172 -5.453 266 H MET 31 HN MET 31 43.769 4.167 -5.292 267 HA MET 31 HA MET 31 42.398 6.143 -3.915 268 HB2 MET 31 HB1 MET 31 43.387 4.132 -2.870 269 HB3 MET 31 HB2 MET 31 45.035 4.657 -3.303 270 HG2 MET 31 HG1 MET 31 44.823 6.620 -1.701 271 HG3 MET 31 HG2 MET 31 43.133 6.142 -1.339 272 HE1 MET 31 HE1 MET 31 47.050 3.897 -0.131 273 HE2 MET 31 HE2 MET 31 46.522 4.078 -1.839 274 HE3 MET 31 HE3 MET 31 46.964 5.529 -0.877 275 H LEU 32 HN LEU 32 45.774 6.221 -5.264 276 HA LEU 32 HA LEU 32 46.416 8.743 -4.298 277 HB2 LEU 32 HB1 LEU 32 47.404 6.950 -6.540 278 HB3 LEU 32 HB2 LEU 32 48.054 8.602 -6.428 279 HG LEU 32 HG LEU 32 49.279 8.182 -4.613 280 HD11 LEU 32 HD11 LEU 32 49.011 6.290 -2.869 281 HD12 LEU 32 HD12 LEU 32 47.619 7.433 -2.896 282 HD13 LEU 32 HD13 LEU 32 47.475 5.816 -3.678 283 HD21 LEU 32 HD21 LEU 32 50.376 5.876 -4.797 284 HD22 LEU 32 HD22 LEU 32 49.032 5.356 -5.862 285 HD23 LEU 32 HD23 LEU 32 50.110 6.702 -6.374 286 H GLU 33 HN GLU 33 44.934 7.813 -7.533 287 HA GLU 33 HA GLU 33 44.714 10.424 -8.465 288 HB2 GLU 33 HB1 GLU 33 43.111 7.892 -9.033 289 HB3 GLU 33 HB2 GLU 33 42.784 9.421 -9.879 290 HG2 GLU 33 HG1 GLU 33 45.144 9.452 -10.780 291 HG3 GLU 33 HG2 GLU 33 45.536 7.939 -9.882 292 H GLU 34 HN GLU 34 42.404 8.506 -6.384 293 HA GLU 34 HA GLU 34 40.354 10.370 -6.426 294 HB2 GLU 34 HB1 GLU 34 40.121 8.005 -5.699 295 HB3 GLU 34 HB2 GLU 34 41.173 8.300 -4.296 296 HG2 GLU 34 HG1 GLU 34 39.469 9.871 -3.322 297 HG3 GLU 34 HG2 GLU 34 38.400 9.640 -4.757 298 H THR 35 HN THR 35 43.177 10.133 -4.041 299 HA THR 35 HA THR 35 42.207 12.438 -2.687 300 HB THR 35 HB THR 35 43.474 10.662 -1.561 301 HG1 THR 35 HG1 THR 35 44.818 12.090 -0.402 302 HG21 THR 35 HG21 THR 35 45.983 10.597 -1.750 303 HG22 THR 35 HG22 THR 35 45.270 10.316 -3.374 304 HG23 THR 35 HG23 THR 35 45.963 11.927 -2.964 305 H GLY 36 HN GLY 36 44.446 11.916 -5.428 306 HA2 GLY 36 HA2 GLY 36 44.582 13.486 -7.077 307 HA3 GLY 36 HA1 GLY 36 44.250 14.781 -5.848 308 H THR 37 HN THR 37 46.662 12.468 -4.907 309 HA THR 37 HA THR 37 48.765 14.328 -5.734 310 HB THR 37 HB THR 37 48.507 12.650 -3.203 311 HG1 THR 37 HG1 THR 37 48.639 14.705 -2.202 312 HG21 THR 37 HG21 THR 37 50.729 13.650 -2.485 313 HG22 THR 37 HG22 THR 37 50.954 12.855 -4.079 314 HG23 THR 37 HG23 THR 37 50.804 14.646 -3.982 315 H LYS 38 HN LYS 38 50.445 13.479 -6.911 316 HA LYS 38 HA LYS 38 50.136 10.731 -7.649 317 HB2 LYS 38 HB1 LYS 38 52.079 12.933 -8.528 318 HB3 LYS 38 HB2 LYS 38 52.123 11.289 -9.217 319 HG2 LYS 38 HG1 LYS 38 49.722 11.597 -10.033 320 HG3 LYS 38 HG2 LYS 38 49.700 13.241 -9.314 321 HD2 LYS 38 HD1 LYS 38 50.077 13.502 -11.679 322 HD3 LYS 38 HD2 LYS 38 51.639 13.852 -10.864 323 HE2 LYS 38 HE1 LYS 38 52.512 11.591 -11.466 324 HE3 LYS 38 HE2 LYS 38 50.926 11.149 -12.205 325 HZ1 LYS 38 HZ1 LYS 38 52.511 11.905 -13.854 326 HZ2 LYS 38 HZ2 LYS 38 51.201 12.982 -13.755 327 HZ3 LYS 38 HZ3 LYS 38 52.690 13.395 -13.059 328 H VAL 39 HN VAL 39 51.349 8.994 -7.085 329 HA VAL 39 HA VAL 39 54.039 9.444 -5.973 330 HB VAL 39 HB VAL 39 52.086 7.177 -5.361 331 HG11 VAL 39 HG11 VAL 39 53.892 6.402 -3.747 332 HG12 VAL 39 HG12 VAL 39 54.452 6.341 -5.445 333 HG13 VAL 39 HG13 VAL 39 54.989 7.684 -4.367 334 HG21 VAL 39 HG21 VAL 39 52.227 8.089 -2.970 335 HG22 VAL 39 HG22 VAL 39 53.196 9.478 -3.584 336 HG23 VAL 39 HG23 VAL 39 51.486 9.262 -4.104 337 H SER 40 HN SER 40 55.649 8.521 -7.246 338 HA SER 40 HA SER 40 54.897 7.413 -9.691 339 HB2 SER 40 HB1 SER 40 57.595 7.469 -8.214 340 HB3 SER 40 HB2 SER 40 57.437 6.932 -9.916 341 HG SER 40 HG SER 40 57.964 9.253 -9.506 342 H ILE 41 HN ILE 41 55.253 5.295 -10.603 343 HA ILE 41 HA ILE 41 54.216 3.351 -8.897 344 HB ILE 41 HB ILE 41 55.329 3.234 -11.686 345 HG12 ILE 41 HG11 ILE 41 53.425 4.701 -11.645 346 HG13 ILE 41 HG12 ILE 41 52.891 3.158 -12.383 347 HG21 ILE 41 HG21 ILE 41 54.091 0.987 -11.884 348 HG22 ILE 41 HG22 ILE 41 55.176 0.884 -10.462 349 HG23 ILE 41 HG23 ILE 41 53.415 1.177 -10.229 350 HD11 ILE 41 HD11 ILE 41 51.146 4.019 -10.888 351 HD12 ILE 41 HD12 ILE 41 51.812 2.491 -10.206 352 HD13 ILE 41 HD13 ILE 41 52.288 4.081 -9.501 353 H SER 42 HN SER 42 57.577 3.899 -10.085 354 HA SER 42 HA SER 42 58.542 1.411 -9.457 355 HB2 SER 42 HB1 SER 42 60.820 2.517 -9.546 356 HB3 SER 42 HB2 SER 42 59.800 2.891 -10.970 357 HG SER 42 HG SER 42 60.931 4.700 -9.884 358 H THR 43 HN THR 43 58.325 4.307 -7.210 359 HA THR 43 HA THR 43 59.776 3.018 -5.192 360 HB THR 43 HB THR 43 58.685 4.589 -3.615 361 HG1 THR 43 HG1 THR 43 57.510 6.293 -4.542 362 HG21 THR 43 HG21 THR 43 59.831 6.650 -4.623 363 HG22 THR 43 HG22 THR 43 60.809 5.198 -5.019 364 HG23 THR 43 HG23 THR 43 59.736 5.927 -6.269 365 H VAL 44 HN VAL 44 56.261 2.963 -5.993 366 HA VAL 44 HA VAL 44 55.428 1.470 -3.780 367 HB VAL 44 HB VAL 44 54.352 1.694 -6.611 368 HG11 VAL 44 HG11 VAL 44 52.186 0.770 -5.656 369 HG12 VAL 44 HG12 VAL 44 53.496 -0.447 -5.621 370 HG13 VAL 44 HG13 VAL 44 53.026 0.415 -4.107 371 HG21 VAL 44 HG21 VAL 44 52.658 3.222 -5.438 372 HG22 VAL 44 HG22 VAL 44 53.579 3.019 -3.903 373 HG23 VAL 44 HG23 VAL 44 54.337 3.838 -5.316 374 H LYS 45 HN LYS 45 56.662 0.426 -7.026 375 HA LYS 45 HA LYS 45 56.380 -2.314 -6.618 376 HB2 LYS 45 HB1 LYS 45 58.362 -0.666 -8.283 377 HB3 LYS 45 HB2 LYS 45 58.318 -2.447 -8.370 378 HG2 LYS 45 HG1 LYS 45 55.891 -0.618 -9.006 379 HG3 LYS 45 HG2 LYS 45 57.065 -1.172 -10.246 380 HD2 LYS 45 HD1 LYS 45 56.443 -3.543 -9.780 381 HD3 LYS 45 HD2 LYS 45 55.341 -3.010 -8.465 382 HE2 LYS 45 HE1 LYS 45 53.979 -3.532 -10.431 383 HE3 LYS 45 HE2 LYS 45 53.965 -1.739 -10.223 384 HZ1 LYS 45 HZ1 LYS 45 54.317 -2.382 -12.502 385 HZ2 LYS 45 HZ2 LYS 45 55.690 -1.588 -11.895 386 HZ3 LYS 45 HZ3 LYS 45 55.701 -3.272 -12.088 387 H ARG 46 HN ARG 46 59.215 -0.150 -5.835 388 HA ARG 46 HA ARG 46 60.795 -2.192 -4.762 389 HB2 ARG 46 HB1 ARG 46 60.633 0.776 -4.167 390 HB3 ARG 46 HB2 ARG 46 61.784 -0.260 -3.290 391 HG2 ARG 46 HG1 ARG 46 62.708 -0.963 -5.637 392 HG3 ARG 46 HG2 ARG 46 61.655 0.273 -6.351 393 HD2 ARG 46 HD1 ARG 46 64.023 1.112 -6.010 394 HD3 ARG 46 HD2 ARG 46 62.789 2.138 -5.170 395 HE ARG 46 HE ARG 46 63.283 0.960 -3.085 396 HH11 ARG 46 HH11 ARG 46 67.068 0.343 -4.572 397 HH12 ARG 46 HH12 ARG 46 65.714 0.657 -5.629 398 HH21 ARG 46 HH21 ARG 46 66.647 0.227 -2.225 399 HH22 ARG 46 HH22 ARG 46 65.033 0.499 -1.666 400 H VAL 47 HN VAL 47 58.262 -0.176 -3.041 401 HA VAL 47 HA VAL 47 58.816 -1.182 -0.500 402 HB VAL 47 HB VAL 47 56.274 -0.091 -1.749 403 HG11 VAL 47 HG11 VAL 47 55.425 0.187 0.628 404 HG12 VAL 47 HG12 VAL 47 55.590 -1.538 0.182 405 HG13 VAL 47 HG13 VAL 47 56.831 -0.756 1.235 406 HG21 VAL 47 HG21 VAL 47 56.915 1.926 -0.271 407 HG22 VAL 47 HG22 VAL 47 58.404 1.048 0.237 408 HG23 VAL 47 HG23 VAL 47 58.187 1.555 -1.476 409 H LEU 48 HN LEU 48 56.476 -2.442 -3.049 410 HA LEU 48 HA LEU 48 55.707 -4.632 -1.537 411 HB2 LEU 48 HB1 LEU 48 55.922 -4.114 -4.548 412 HB3 LEU 48 HB2 LEU 48 55.258 -5.645 -3.930 413 HG LEU 48 HG LEU 48 54.126 -2.867 -3.170 414 HD11 LEU 48 HD11 LEU 48 52.301 -3.365 -4.894 415 HD12 LEU 48 HD12 LEU 48 53.921 -3.171 -5.660 416 HD13 LEU 48 HD13 LEU 48 53.222 -4.817 -5.427 417 HD21 LEU 48 HD21 LEU 48 52.082 -4.180 -2.544 418 HD22 LEU 48 HD22 LEU 48 52.900 -5.712 -2.985 419 HD23 LEU 48 HD23 LEU 48 53.527 -4.725 -1.617 420 H TYR 49 HN TYR 49 58.516 -4.291 -3.838 421 HA TYR 49 HA TYR 49 59.186 -6.986 -3.837 422 HB2 TYR 49 HB1 TYR 49 59.983 -5.291 -5.532 423 HB3 TYR 49 HB2 TYR 49 60.906 -4.427 -4.265 424 HD1 TYR 49 HD1 TYR 49 60.583 -7.725 -6.046 425 HD2 TYR 49 HD2 TYR 49 63.167 -5.093 -3.830 426 HE1 TYR 49 HE1 TYR 49 62.549 -9.097 -6.694 427 HE2 TYR 49 HE2 TYR 49 65.118 -6.463 -4.487 428 HH TYR 49 HH TYR 49 65.859 -8.197 -5.671 429 H ARG 50 HN ARG 50 60.352 -4.316 -1.695 430 HA ARG 50 HA ARG 50 62.272 -5.966 -0.337 431 HB2 ARG 50 HB2 ARG 50 62.307 -3.418 -0.429 432 HB3 ARG 50 HB1 ARG 50 60.825 -3.355 0.503 433 HG2 ARG 50 HG2 ARG 50 62.029 -4.373 2.507 434 HG3 ARG 50 HG1 ARG 50 63.494 -4.564 1.537 435 HD2 ARG 50 HD2 ARG 50 63.612 -2.045 1.229 436 HD3 ARG 50 HD1 ARG 50 62.108 -1.861 2.165 437 HE ARG 50 HE ARG 50 64.002 -3.407 3.799 438 HH11 ARG 50 HH11 ARG 50 63.627 -0.162 2.639 439 HH12 ARG 50 HH12 ARG 50 64.584 0.528 4.038 440 HH21 ARG 50 HH21 ARG 50 65.074 -2.604 5.361 441 HH22 ARG 50 HH22 ARG 50 65.355 -0.811 5.494 442 H HIS 51 HN HIS 51 58.738 -5.184 0.518 443 HA HIS 51 HA HIS 51 58.792 -6.673 2.873 444 HB2 HIS 51 HB1 HIS 51 56.509 -5.969 0.988 445 HB3 HIS 51 HB2 HIS 51 56.251 -6.952 2.457 446 HD1 HIS 51 HD1 HIS 51 57.176 -3.397 1.376 447 HD2 HIS 51 HD2 HIS 51 56.413 -5.506 4.918 448 HE1 HIS 51 HE1 HIS 51 57.047 -1.708 3.299 449 H ASN 52 HN ASN 52 58.058 -7.883 -0.561 450 HA ASN 52 HA ASN 52 57.537 -10.447 0.330 451 HB2 ASN 52 HB1 ASN 52 58.497 -9.276 -2.305 452 HB3 ASN 52 HB2 ASN 52 58.403 -11.055 -2.134 453 HD21 ASN 52 HD21 ASN 52 54.990 -8.794 -2.626 454 HD22 ASN 52 HD22 ASN 52 56.579 -8.067 -2.640 455 H LEU 53 HN LEU 53 60.831 -8.989 -0.540 456 HA LEU 53 HA LEU 53 62.152 -11.380 -0.170 457 HB2 LEU 53 HB1 LEU 53 62.937 -8.462 -0.097 458 HB3 LEU 53 HB2 LEU 53 64.122 -9.636 0.518 459 HG LEU 53 HG LEU 53 64.188 -10.779 -1.594 460 HD11 LEU 53 HD11 LEU 53 63.165 -9.804 -3.745 461 HD12 LEU 53 HD12 LEU 53 61.929 -10.466 -2.614 462 HD13 LEU 53 HD13 LEU 53 62.184 -8.686 -2.731 463 HD21 LEU 53 HD21 LEU 53 65.276 -8.922 -2.973 464 HD22 LEU 53 HD22 LEU 53 64.558 -7.712 -1.861 465 HD23 LEU 53 HD23 LEU 53 65.738 -8.918 -1.232 466 H LYS 54 HN LYS 54 61.338 -8.870 2.434 467 HA LYS 54 HA LYS 54 62.892 -10.621 4.169 468 HB2 LYS 54 HB1 LYS 54 63.450 -8.698 5.574 469 HB3 LYS 54 HB2 LYS 54 63.985 -8.397 3.900 470 HG2 LYS 54 HG1 LYS 54 62.667 -6.515 3.739 471 HG3 LYS 54 HG2 LYS 54 61.219 -7.392 4.334 472 HD2 LYS 54 HD1 LYS 54 62.380 -7.185 6.716 473 HD3 LYS 54 HD2 LYS 54 63.421 -5.950 5.928 474 HE2 LYS 54 HE1 LYS 54 61.350 -4.649 5.241 475 HE3 LYS 54 HE2 LYS 54 60.320 -5.870 6.083 476 HZ1 LYS 54 HZ1 LYS 54 60.776 -3.960 7.475 477 HZ2 LYS 54 HZ2 LYS 54 61.484 -5.355 8.134 478 HZ3 LYS 54 HZ3 LYS 54 62.450 -4.209 7.342 479 H GLY 55 HN GLY 55 59.611 -9.898 3.677 480 HA2 GLY 55 HA2 GLY 55 59.024 -8.392 5.904 481 HA3 GLY 55 HA1 GLY 55 57.877 -9.339 4.860 482 H ARG 56 HN ARG 56 58.403 -8.638 7.809 483 HA ARG 56 HA ARG 56 58.320 -9.439 9.888 484 HB2 ARG 56 HB1 ARG 56 56.473 -10.828 10.491 485 HB3 ARG 56 HB2 ARG 56 56.034 -9.414 9.502 486 HG2 ARG 56 HG1 ARG 56 55.946 -11.053 7.482 487 HG3 ARG 56 HG2 ARG 56 56.143 -12.378 8.644 488 HD2 ARG 56 HD1 ARG 56 53.866 -10.300 8.873 489 HD3 ARG 56 HD2 ARG 56 53.662 -11.950 8.154 490 HE ARG 56 HE ARG 56 54.288 -11.334 10.995 491 HH11 ARG 56 HH11 ARG 56 53.056 -14.990 9.537 492 HH12 ARG 56 HH12 ARG 56 53.597 -13.708 8.481 493 HH21 ARG 56 HH21 ARG 56 52.949 -14.546 11.865 494 HH22 ARG 56 HH22 ARG 56 53.447 -12.991 12.436 495 H SER 57 HN SER 57 60.601 -10.411 9.141 496 HA SER 57 HA SER 57 60.883 -13.173 9.128 497 HB2 SER 57 HB1 SER 57 63.342 -12.688 9.379 498 HB3 SER 57 HB2 SER 57 62.591 -11.719 8.071 499 HG SER 57 HG SER 57 64.014 -10.594 9.635 500 H ALA 58 HN ALA 58 60.060 -11.299 11.755 501 HA ALA 58 HA ALA 58 61.727 -12.377 13.821 502 HB1 ALA 58 HB1 ALA 58 60.742 -10.076 13.880 503 HB2 ALA 58 HB2 ALA 58 59.086 -10.774 13.867 504 HB3 ALA 58 HB3 ALA 58 60.169 -11.038 15.286 505 H ARG 59 HN ARG 59 61.395 -14.590 13.228 506 HA ARG 59 HA ARG 59 60.881 -16.661 13.880 507 HB2 ARG 59 HB1 ARG 59 58.843 -15.430 15.738 508 HB3 ARG 59 HB2 ARG 59 59.154 -17.180 15.650 509 HG2 ARG 59 HG1 ARG 59 61.673 -16.553 16.163 510 HG3 ARG 59 HG2 ARG 59 61.091 -14.917 16.522 511 HD2 ARG 59 HD1 ARG 59 61.122 -15.976 18.678 512 HD3 ARG 59 HD2 ARG 59 59.370 -15.975 18.218 513 HE ARG 59 HE ARG 59 59.400 -18.251 17.848 514 HH11 ARG 59 HH11 ARG 59 63.355 -18.656 18.965 515 HH12 ARG 59 HH12 ARG 59 62.670 -17.114 18.509 516 HH21 ARG 59 HH21 ARG 59 61.931 -20.564 18.929 517 HH22 ARG 59 HH22 ARG 59 60.270 -20.345 18.495 518 H LYS 60 HN LYS 60 59.322 -18.457 13.649 519 HA LYS 60 HA LYS 60 57.614 -17.902 11.418 520 HB2 LYS 60 HB1 LYS 60 58.237 -20.459 12.996 521 HB3 LYS 60 HB2 LYS 60 57.175 -20.445 11.565 522 HG2 LYS 60 HG1 LYS 60 59.169 -19.554 10.195 523 HG3 LYS 60 HG2 LYS 60 60.191 -19.737 11.660 524 HD2 LYS 60 HD1 LYS 60 59.744 -22.176 11.724 525 HD3 LYS 60 HD2 LYS 60 58.515 -22.027 10.421 526 HE2 LYS 60 HE1 LYS 60 60.389 -21.249 8.838 527 HE3 LYS 60 HE2 LYS 60 61.573 -21.640 10.143 528 HZ1 LYS 60 HZ1 LYS 60 61.239 -23.505 8.638 529 HZ2 LYS 60 HZ2 LYS 60 60.686 -23.893 10.195 530 HZ3 LYS 60 HZ3 LYS 60 59.574 -23.524 8.970 531 H LEU 61 HN LEU 61 56.211 -16.415 12.823 532 HA LEU 61 HA LEU 61 54.367 -17.801 14.536 533 HB2 LEU 61 HB1 LEU 61 54.580 -14.901 13.550 534 HB3 LEU 61 HB2 LEU 61 53.362 -15.441 14.731 535 HG LEU 61 HG LEU 61 56.420 -15.616 15.096 536 HD11 LEU 61 HD11 LEU 61 56.086 -13.666 16.742 537 HD12 LEU 61 HD12 LEU 61 55.703 -13.229 15.037 538 HD13 LEU 61 HD13 LEU 61 54.371 -13.554 16.208 539 HD21 LEU 61 HD21 LEU 61 55.931 -16.008 17.537 540 HD22 LEU 61 HD22 LEU 61 54.171 -16.033 17.196 541 HD23 LEU 61 HD23 LEU 61 55.237 -17.301 16.491 542 H GLU 62 HN GLU 62 53.778 -19.281 12.652 543 HA GLU 62 HA GLU 62 52.421 -18.324 10.428 544 HB2 GLU 62 HB1 GLU 62 53.534 -20.532 10.569 545 HB3 GLU 62 HB2 GLU 62 52.375 -21.073 11.804 546 HG2 GLU 62 HG1 GLU 62 50.497 -20.941 10.142 547 HG3 GLU 62 HG2 GLU 62 51.617 -20.305 8.879 Start of MODEL 10 1 H1 ALA 1 HT1 ALA 1 65.014 4.627 1.258 2 H2 ALA 1 HT2 ALA 1 63.946 5.935 1.434 3 H3 ALA 1 HT3 ALA 1 63.907 4.991 0.023 4 HA ALA 1 HA ALA 1 63.172 3.072 1.272 5 HB1 ALA 1 HB1 ALA 1 64.445 3.679 3.321 6 HB2 ALA 1 HB2 ALA 1 63.280 5.003 3.668 7 HB3 ALA 1 HB3 ALA 1 62.741 3.282 3.731 8 H SER 2 HN SER 2 61.725 6.158 2.619 9 HA SER 2 HA SER 2 59.283 5.460 1.177 10 HB2 SER 2 HB1 SER 2 59.573 6.688 3.996 11 HB3 SER 2 HB2 SER 2 58.009 6.605 3.127 12 HG SER 2 HG SER 2 58.539 4.845 4.675 13 H MET 3 HN MET 3 58.008 7.266 0.463 14 HA MET 3 HA MET 3 59.658 9.148 -0.703 15 HB2 MET 3 HB1 MET 3 57.591 9.939 -1.792 16 HB3 MET 3 HB2 MET 3 57.767 8.167 -1.879 17 HG2 MET 3 HG1 MET 3 56.119 8.019 0.145 18 HG3 MET 3 HG2 MET 3 55.887 9.790 -0.015 19 HE1 MET 3 HE1 MET 3 54.555 6.397 -2.889 20 HE2 MET 3 HE2 MET 3 56.281 6.728 -2.517 21 HE3 MET 3 HE3 MET 3 55.163 6.209 -1.210 22 H VAL 4 HN VAL 4 57.443 9.531 2.063 23 HA VAL 4 HA VAL 4 56.855 11.176 3.391 24 HB VAL 4 HB VAL 4 59.642 12.245 3.159 25 HG11 VAL 4 HG11 VAL 4 59.247 12.651 5.649 26 HG12 VAL 4 HG12 VAL 4 58.086 13.559 4.636 27 HG13 VAL 4 HG13 VAL 4 57.563 12.046 5.469 28 HG21 VAL 4 HG21 VAL 4 60.174 10.471 4.959 29 HG22 VAL 4 HG22 VAL 4 58.530 9.774 4.727 30 HG23 VAL 4 HG23 VAL 4 59.741 9.710 3.396 31 H LEU 5 HN LEU 5 55.751 11.850 0.975 32 HA LEU 5 HA LEU 5 56.499 14.617 0.493 33 HB2 LEU 5 HB1 LEU 5 56.747 13.078 -1.410 34 HB3 LEU 5 HB2 LEU 5 55.076 12.496 -1.221 35 HG LEU 5 HG LEU 5 54.200 14.724 -1.901 36 HD11 LEU 5 HD11 LEU 5 55.804 16.457 -2.890 37 HD12 LEU 5 HD12 LEU 5 56.068 16.232 -1.123 38 HD13 LEU 5 HD13 LEU 5 57.199 15.480 -2.308 39 HD21 LEU 5 HD21 LEU 5 54.946 14.625 -4.306 40 HD22 LEU 5 HD22 LEU 5 56.314 13.559 -3.853 41 HD23 LEU 5 HD23 LEU 5 54.621 12.989 -3.627 42 H SER 6 HN SER 6 53.560 12.494 1.026 43 HA SER 6 HA SER 6 52.261 14.860 2.121 44 HB2 SER 6 HB1 SER 6 51.255 14.497 -0.171 45 HB3 SER 6 HB2 SER 6 51.029 12.754 0.173 46 HG SER 6 HG SER 6 49.150 14.199 0.395 47 HA PRO 7 HA PRO 7 52.084 11.951 5.396 48 HB2 PRO 7 HB2 PRO 7 50.249 13.002 7.133 49 HB3 PRO 7 HB1 PRO 7 51.822 13.817 6.773 50 HG2 PRO 7 HG2 PRO 7 49.177 14.498 5.438 51 HG3 PRO 7 HG1 PRO 7 50.356 15.616 6.246 52 HD2 PRO 7 HD2 PRO 7 50.389 15.116 3.514 53 HD3 PRO 7 HD1 PRO 7 51.920 15.445 4.461 54 H ARG 8 HN ARG 8 49.045 12.697 3.675 55 HA ARG 8 HA ARG 8 47.434 10.751 4.936 56 HB2 ARG 8 HB1 ARG 8 46.571 12.731 3.698 57 HB3 ARG 8 HB2 ARG 8 47.245 12.121 2.169 58 HG2 ARG 8 HG1 ARG 8 44.903 11.646 2.059 59 HG3 ARG 8 HG2 ARG 8 45.638 10.078 2.438 60 HD2 ARG 8 HD1 ARG 8 44.726 11.773 4.803 61 HD3 ARG 8 HD2 ARG 8 43.481 10.862 3.852 62 HE ARG 8 HE ARG 8 45.044 8.854 4.174 63 HH11 ARG 8 HH11 ARG 8 45.116 10.490 7.957 64 HH12 ARG 8 HH12 ARG 8 44.921 11.476 6.527 65 HH21 ARG 8 HH21 ARG 8 45.335 8.135 7.666 66 HH22 ARG 8 HH22 ARG 8 45.253 7.492 6.062 67 H ASP 9 HN ASP 9 49.320 10.598 1.775 68 HA ASP 9 HA ASP 9 48.380 7.959 1.410 69 HB2 ASP 9 HB1 ASP 9 49.830 7.970 -0.628 70 HB3 ASP 9 HB2 ASP 9 48.599 9.278 -0.589 71 H GLU 10 HN GLU 10 51.552 9.371 2.737 72 HA GLU 10 HA GLU 10 52.894 6.961 2.318 73 HB2 GLU 10 HB1 GLU 10 54.643 7.810 3.754 74 HB3 GLU 10 HB2 GLU 10 54.107 9.106 2.660 75 HG2 GLU 10 HG1 GLU 10 52.775 10.134 4.543 76 HG3 GLU 10 HG2 GLU 10 53.344 8.836 5.660 77 H ARG 11 HN ARG 11 51.083 8.151 5.236 78 HA ARG 11 HA ARG 11 51.854 5.964 6.863 79 HB2 ARG 11 HB1 ARG 11 49.480 7.885 6.955 80 HB3 ARG 11 HB2 ARG 11 49.770 6.691 8.242 81 HG2 ARG 11 HG1 ARG 11 51.659 9.005 7.384 82 HG3 ARG 11 HG2 ARG 11 50.617 9.022 8.818 83 HD2 ARG 11 HD1 ARG 11 51.825 7.036 9.796 84 HD3 ARG 11 HD2 ARG 11 53.014 7.092 8.430 85 HE ARG 11 HE ARG 11 53.876 9.108 9.180 86 HH11 ARG 11 HH11 ARG 11 51.478 9.157 12.543 87 HH12 ARG 11 HH12 ARG 11 51.117 8.156 11.158 88 HH21 ARG 11 HH21 ARG 11 53.420 10.535 12.447 89 HH22 ARG 11 HH22 ARG 11 54.415 10.459 11.033 90 H THR 12 HN THR 12 48.981 6.528 4.757 91 HA THR 12 HA THR 12 47.666 4.188 5.567 92 HB THR 12 HB THR 12 47.464 5.814 2.995 93 HG1 THR 12 HG1 THR 12 45.661 6.743 4.051 94 HG21 THR 12 HG21 THR 12 45.093 4.819 2.843 95 HG22 THR 12 HG22 THR 12 46.248 3.455 3.018 96 HG23 THR 12 HG23 THR 12 45.300 4.016 4.442 97 H LEU 13 HN LEU 13 49.844 4.897 2.750 98 HA LEU 13 HA LEU 13 49.477 2.416 1.543 99 HB2 LEU 13 HB1 LEU 13 50.267 4.452 0.379 100 HB3 LEU 13 HB2 LEU 13 51.745 4.490 1.368 101 HG LEU 13 HG LEU 13 51.155 2.063 -0.364 102 HD11 LEU 13 HD11 LEU 13 52.339 3.289 -2.310 103 HD12 LEU 13 HD12 LEU 13 50.745 4.013 -1.888 104 HD13 LEU 13 HD13 LEU 13 52.270 4.808 -1.348 105 HD21 LEU 13 HD21 LEU 13 53.649 2.014 -0.676 106 HD22 LEU 13 HD22 LEU 13 53.826 3.488 0.327 107 HD23 LEU 13 HD23 LEU 13 53.196 1.973 1.067 108 H VAL 14 HN VAL 14 52.100 3.508 3.951 109 HA VAL 14 HA VAL 14 53.486 1.095 3.583 110 HB VAL 14 HB VAL 14 54.762 1.576 5.563 111 HG11 VAL 14 HG11 VAL 14 55.745 3.761 4.637 112 HG12 VAL 14 HG12 VAL 14 55.424 2.573 3.338 113 HG13 VAL 14 HG13 VAL 14 54.292 3.955 3.596 114 HG21 VAL 14 HG21 VAL 14 54.479 3.712 6.809 115 HG22 VAL 14 HG22 VAL 14 52.888 3.956 5.999 116 HG23 VAL 14 HG23 VAL 14 53.150 2.541 7.081 117 H ARG 15 HN ARG 15 50.820 2.000 5.847 118 HA ARG 15 HA ARG 15 51.028 -0.302 7.459 119 HB2 ARG 15 HB1 ARG 15 49.615 1.743 7.953 120 HB3 ARG 15 HB2 ARG 15 48.523 1.317 6.614 121 HG2 ARG 15 HG1 ARG 15 48.439 -1.055 8.038 122 HG3 ARG 15 HG2 ARG 15 48.886 0.022 9.375 123 HD2 ARG 15 HD1 ARG 15 46.363 0.318 7.636 124 HD3 ARG 15 HD2 ARG 15 46.428 -0.126 9.390 125 HE ARG 15 HE ARG 15 46.821 2.531 8.207 126 HH11 ARG 15 HH11 ARG 15 46.956 3.983 11.496 127 HH12 ARG 15 HH12 ARG 15 46.949 4.270 9.773 128 HH21 ARG 15 HH21 ARG 15 46.962 1.720 12.247 129 HH22 ARG 15 HH22 ARG 15 46.917 0.459 11.064 130 H LYS 16 HN LYS 16 49.031 0.256 4.431 131 HA LYS 16 HA LYS 16 47.981 -2.339 4.463 132 HB2 LYS 16 HB1 LYS 16 48.363 -0.335 2.198 133 HB3 LYS 16 HB2 LYS 16 47.575 -1.914 1.942 134 HG2 LYS 16 HG1 LYS 16 45.922 -1.228 3.871 135 HG3 LYS 16 HG2 LYS 16 46.649 0.410 3.780 136 HD2 LYS 16 HD1 LYS 16 45.223 -1.103 1.489 137 HD3 LYS 16 HD2 LYS 16 44.510 0.209 2.488 138 HE2 LYS 16 HE1 LYS 16 46.351 1.779 1.600 139 HE3 LYS 16 HE2 LYS 16 46.832 0.462 0.463 140 HZ1 LYS 16 HZ1 LYS 16 45.245 1.982 -0.534 141 HZ2 LYS 16 HZ2 LYS 16 44.564 0.434 -0.377 142 HZ3 LYS 16 HZ3 LYS 16 44.114 1.671 0.693 143 H VAL 17 HN VAL 17 50.917 -0.990 2.798 144 HA VAL 17 HA VAL 17 51.525 -3.322 1.419 145 HB VAL 17 HB VAL 17 53.159 -0.960 2.350 146 HG11 VAL 17 HG11 VAL 17 54.922 -1.739 0.702 147 HG12 VAL 17 HG12 VAL 17 54.751 -2.871 2.078 148 HG13 VAL 17 HG13 VAL 17 54.022 -3.280 0.479 149 HG21 VAL 17 HG21 VAL 17 52.982 -0.432 -0.173 150 HG22 VAL 17 HG22 VAL 17 51.963 -1.904 -0.379 151 HG23 VAL 17 HG23 VAL 17 51.374 -0.520 0.610 152 H GLN 18 HN GLN 18 52.634 -2.261 4.781 153 HA GLN 18 HA GLN 18 54.206 -4.531 5.120 154 HB2 GLN 18 HB1 GLN 18 54.396 -2.415 6.421 155 HB3 GLN 18 HB2 GLN 18 52.798 -2.688 7.161 156 HG2 GLN 18 HG1 GLN 18 53.719 -4.804 8.296 157 HG3 GLN 18 HG2 GLN 18 55.323 -4.482 7.560 158 HE21 GLN 18 HE21 GLN 18 55.451 -1.337 9.702 159 HE22 GLN 18 HE22 GLN 18 55.329 -1.568 7.970 160 H ILE 19 HN ILE 19 50.696 -3.972 6.073 161 HA ILE 19 HA ILE 19 50.643 -6.482 7.412 162 HB ILE 19 HB ILE 19 48.562 -4.428 6.722 163 HG12 ILE 19 HG11 ILE 19 49.876 -5.202 9.413 164 HG13 ILE 19 HG12 ILE 19 50.243 -3.764 8.409 165 HG21 ILE 19 HG21 ILE 19 46.933 -5.726 8.196 166 HG22 ILE 19 HG22 ILE 19 47.533 -6.840 6.927 167 HG23 ILE 19 HG23 ILE 19 48.202 -6.936 8.596 168 HD11 ILE 19 HD11 ILE 19 48.783 -3.121 10.289 169 HD12 ILE 19 HD12 ILE 19 47.881 -2.929 8.741 170 HD13 ILE 19 HD13 ILE 19 47.550 -4.340 9.815 171 H ASN 20 HN ASN 20 49.536 -5.292 4.187 172 HA ASN 20 HA ASN 20 48.607 -7.996 3.644 173 HB2 ASN 20 HB1 ASN 20 47.457 -5.241 2.808 174 HB3 ASN 20 HB2 ASN 20 46.854 -6.767 2.092 175 HD21 ASN 20 HD21 ASN 20 45.307 -7.810 5.285 176 HD22 ASN 20 HD22 ASN 20 46.268 -8.494 3.997 177 HA PRO 21 HA PRO 21 51.802 -6.601 0.482 178 HB2 PRO 21 HB2 PRO 21 53.407 -8.816 0.419 179 HB3 PRO 21 HB1 PRO 21 53.507 -7.594 1.747 180 HG2 PRO 21 HG2 PRO 21 51.943 -10.207 1.865 181 HG3 PRO 21 HG1 PRO 21 53.151 -9.565 3.056 182 HD2 PRO 21 HD2 PRO 21 50.434 -9.116 3.348 183 HD3 PRO 21 HD1 PRO 21 51.697 -7.907 3.889 184 H ARG 22 HN ARG 22 49.592 -9.188 0.759 185 HA ARG 22 HA ARG 22 49.678 -10.335 -1.800 186 HB2 ARG 22 HB1 ARG 22 47.452 -10.007 0.268 187 HB3 ARG 22 HB2 ARG 22 47.219 -10.979 -1.205 188 HG2 ARG 22 HG1 ARG 22 49.252 -12.413 -0.459 189 HG3 ARG 22 HG2 ARG 22 49.338 -11.458 1.033 190 HD2 ARG 22 HD1 ARG 22 48.146 -13.529 1.557 191 HD3 ARG 22 HD2 ARG 22 46.963 -12.162 1.676 192 HE ARG 22 HE ARG 22 46.919 -13.070 -0.991 193 HH11 ARG 22 HH11 ARG 22 44.876 -15.319 1.814 194 HH12 ARG 22 HH12 ARG 22 46.252 -14.324 2.226 195 HH21 ARG 22 HH21 ARG 22 44.180 -15.364 -0.474 196 HH22 ARG 22 HH22 ARG 22 45.036 -14.381 -1.611 197 H THR 23 HN THR 23 48.443 -7.120 -0.862 198 HA THR 23 HA THR 23 46.283 -7.132 -2.615 199 HB THR 23 HB THR 23 46.433 -5.624 -0.693 200 HG1 THR 23 HG1 THR 23 45.730 -3.745 -1.770 201 HG21 THR 23 HG21 THR 23 47.831 -3.525 -0.802 202 HG22 THR 23 HG22 THR 23 48.911 -4.950 -0.973 203 HG23 THR 23 HG23 THR 23 48.462 -3.984 -2.425 204 H THR 24 HN THR 24 45.882 -6.388 -4.667 205 HA THR 24 HA THR 24 48.020 -6.194 -6.479 206 HB THR 24 HB THR 24 45.086 -5.412 -6.719 207 HG1 THR 24 HG1 THR 24 44.960 -7.429 -7.798 208 HG21 THR 24 HG21 THR 24 45.430 -5.652 -9.244 209 HG22 THR 24 HG22 THR 24 46.659 -4.493 -8.631 210 HG23 THR 24 HG23 THR 24 47.129 -6.192 -8.994 211 H ALA 25 HN ALA 25 49.009 -4.463 -7.468 212 HA ALA 25 HA ALA 25 49.355 -2.141 -5.929 213 HB1 ALA 25 HB1 ALA 25 51.106 -3.174 -7.363 214 HB2 ALA 25 HB2 ALA 25 50.178 -2.717 -8.834 215 HB3 ALA 25 HB3 ALA 25 50.875 -1.437 -7.768 216 H LYS 26 HN LYS 26 47.047 -2.778 -8.436 217 HA LYS 26 HA LYS 26 46.493 -0.244 -9.392 218 HB2 LYS 26 HB1 LYS 26 45.689 -2.377 -10.384 219 HB3 LYS 26 HB2 LYS 26 44.677 -2.697 -8.952 220 HG2 LYS 26 HG1 LYS 26 43.258 -1.893 -10.800 221 HG3 LYS 26 HG2 LYS 26 43.287 -0.641 -9.513 222 HD2 LYS 26 HD1 LYS 26 45.024 0.631 -10.825 223 HD3 LYS 26 HD2 LYS 26 44.989 -0.642 -12.093 224 HE2 LYS 26 HE1 LYS 26 42.602 -0.133 -12.612 225 HE3 LYS 26 HE2 LYS 26 42.533 1.063 -11.262 226 HZ1 LYS 26 HZ1 LYS 26 42.919 2.123 -13.388 227 HZ2 LYS 26 HZ2 LYS 26 44.262 2.331 -12.371 228 HZ3 LYS 26 HZ3 LYS 26 44.326 1.207 -13.637 229 H ASP 27 HN ASP 27 45.312 -1.836 -6.322 230 HA ASP 27 HA ASP 27 43.456 0.111 -5.660 231 HB2 ASP 27 HB1 ASP 27 43.702 -2.222 -4.626 232 HB3 ASP 27 HB2 ASP 27 45.220 -1.683 -3.830 233 H LEU 28 HN LEU 28 47.026 -0.060 -4.942 234 HA LEU 28 HA LEU 28 47.126 2.307 -3.474 235 HB2 LEU 28 HB1 LEU 28 49.188 0.805 -5.169 236 HB3 LEU 28 HB2 LEU 28 49.621 2.329 -4.361 237 HG LEU 28 HG LEU 28 49.100 1.299 -2.161 238 HD11 LEU 28 HD11 LEU 28 48.997 -1.260 -1.961 239 HD12 LEU 28 HD12 LEU 28 47.533 -0.573 -2.755 240 HD13 LEU 28 HD13 LEU 28 48.810 -1.369 -3.747 241 HD21 LEU 28 HD21 LEU 28 51.174 -0.169 -2.107 242 HD22 LEU 28 HD22 LEU 28 51.197 -0.189 -3.899 243 HD23 LEU 28 HD23 LEU 28 51.412 1.365 -3.019 244 H VAL 29 HN VAL 29 47.464 1.700 -7.037 245 HA VAL 29 HA VAL 29 48.177 4.300 -7.742 246 HB VAL 29 HB VAL 29 46.814 2.075 -9.282 247 HG11 VAL 29 HG11 VAL 29 47.514 3.338 -11.371 248 HG12 VAL 29 HG12 VAL 29 46.279 4.235 -10.439 249 HG13 VAL 29 HG13 VAL 29 48.010 4.736 -10.354 250 HG21 VAL 29 HG21 VAL 29 49.196 1.873 -10.254 251 HG22 VAL 29 HG22 VAL 29 49.734 3.173 -9.127 252 HG23 VAL 29 HG23 VAL 29 49.162 1.591 -8.485 253 H LYS 30 HN LYS 30 44.860 2.771 -7.539 254 HA LYS 30 HA LYS 30 43.472 5.037 -8.347 255 HB2 LYS 30 HB1 LYS 30 42.490 2.766 -8.198 256 HB3 LYS 30 HB2 LYS 30 42.704 2.750 -6.429 257 HG2 LYS 30 HG1 LYS 30 41.047 4.667 -6.227 258 HG3 LYS 30 HG2 LYS 30 40.875 4.701 -8.013 259 HD2 LYS 30 HD1 LYS 30 38.972 3.561 -6.865 260 HD3 LYS 30 HD2 LYS 30 39.837 2.479 -8.008 261 HE2 LYS 30 HE1 LYS 30 40.937 1.269 -6.183 262 HE3 LYS 30 HE2 LYS 30 40.395 2.485 -4.963 263 HZ1 LYS 30 HZ1 LYS 30 39.012 0.516 -4.953 264 HZ2 LYS 30 HZ2 LYS 30 38.111 1.868 -5.446 265 HZ3 LYS 30 HZ3 LYS 30 38.622 0.726 -6.591 266 H MET 31 HN MET 31 44.501 4.066 -4.981 267 HA MET 31 HA MET 31 43.312 6.217 -3.687 268 HB2 MET 31 HB1 MET 31 44.156 4.143 -2.593 269 HB3 MET 31 HB2 MET 31 45.835 4.572 -3.007 270 HG2 MET 31 HG1 MET 31 45.623 6.647 -1.504 271 HG3 MET 31 HG2 MET 31 43.948 6.145 -1.102 272 HE1 MET 31 HE1 MET 31 47.908 3.977 0.111 273 HE2 MET 31 HE2 MET 31 47.345 4.082 -1.593 274 HE3 MET 31 HE3 MET 31 47.809 5.575 -0.704 275 H LEU 32 HN LEU 32 46.650 5.907 -5.082 276 HA LEU 32 HA LEU 32 47.527 8.433 -4.347 277 HB2 LEU 32 HB1 LEU 32 48.226 6.527 -6.643 278 HB3 LEU 32 HB2 LEU 32 49.134 8.035 -6.392 279 HG LEU 32 HG LEU 32 48.786 5.877 -4.208 280 HD11 LEU 32 HD11 LEU 32 51.141 5.101 -4.860 281 HD12 LEU 32 HD12 LEU 32 49.930 4.816 -6.163 282 HD13 LEU 32 HD13 LEU 32 51.081 6.198 -6.286 283 HD21 LEU 32 HD21 LEU 32 50.826 6.932 -3.194 284 HD22 LEU 32 HD22 LEU 32 50.871 8.155 -4.504 285 HD23 LEU 32 HD23 LEU 32 49.477 8.113 -3.364 286 H GLU 33 HN GLU 33 45.848 7.361 -7.410 287 HA GLU 33 HA GLU 33 45.917 9.842 -8.668 288 HB2 GLU 33 HB1 GLU 33 45.428 7.679 -9.804 289 HB3 GLU 33 HB2 GLU 33 43.907 7.520 -8.897 290 HG2 GLU 33 HG1 GLU 33 42.983 9.560 -10.037 291 HG3 GLU 33 HG2 GLU 33 44.538 9.811 -10.917 292 H GLU 34 HN GLU 34 43.403 8.436 -6.426 293 HA GLU 34 HA GLU 34 41.671 10.613 -6.537 294 HB2 GLU 34 HB1 GLU 34 41.057 8.359 -5.681 295 HB3 GLU 34 HB2 GLU 34 42.176 8.546 -4.312 296 HG2 GLU 34 HG1 GLU 34 40.800 10.440 -3.406 297 HG3 GLU 34 HG2 GLU 34 39.691 10.361 -4.826 298 H THR 35 HN THR 35 44.472 9.963 -4.313 299 HA THR 35 HA THR 35 44.133 12.259 -2.762 300 HB THR 35 HB THR 35 46.658 10.710 -3.491 301 HG1 THR 35 HG1 THR 35 46.345 9.790 -1.425 302 HG21 THR 35 HG21 THR 35 47.657 11.711 -1.354 303 HG22 THR 35 HG22 THR 35 47.069 13.067 -2.374 304 HG23 THR 35 HG23 THR 35 46.096 12.516 -0.963 305 H GLY 36 HN GLY 36 46.051 11.712 -5.757 306 HA2 GLY 36 HA2 GLY 36 46.123 13.336 -7.418 307 HA3 GLY 36 HA1 GLY 36 46.054 14.613 -6.128 308 H THR 37 HN THR 37 48.097 12.677 -4.721 309 HA THR 37 HA THR 37 50.434 14.061 -5.407 310 HB THR 37 HB THR 37 50.040 11.366 -4.009 311 HG1 THR 37 HG1 THR 37 50.275 12.603 -2.106 312 HG21 THR 37 HG21 THR 37 52.307 11.816 -2.911 313 HG22 THR 37 HG22 THR 37 52.518 11.951 -4.690 314 HG23 THR 37 HG23 THR 37 52.394 13.439 -3.685 315 H LYS 38 HN LYS 38 52.136 13.644 -6.913 316 HA LYS 38 HA LYS 38 51.451 11.481 -8.719 317 HB2 LYS 38 HB1 LYS 38 53.618 13.656 -8.848 318 HB3 LYS 38 HB2 LYS 38 53.251 12.526 -10.177 319 HG2 LYS 38 HG1 LYS 38 51.373 14.720 -9.013 320 HG3 LYS 38 HG2 LYS 38 52.220 14.781 -10.595 321 HD2 LYS 38 HD1 LYS 38 50.853 12.774 -11.335 322 HD3 LYS 38 HD2 LYS 38 49.989 12.822 -9.762 323 HE2 LYS 38 HE1 LYS 38 49.973 15.069 -11.900 324 HE3 LYS 38 HE2 LYS 38 48.623 13.926 -11.539 325 HZ1 LYS 38 HZ1 LYS 38 48.328 16.045 -10.448 326 HZ2 LYS 38 HZ2 LYS 38 48.543 14.815 -9.298 327 HZ3 LYS 38 HZ3 LYS 38 49.811 15.887 -9.638 328 H VAL 39 HN VAL 39 52.272 9.510 -8.420 329 HA VAL 39 HA VAL 39 54.987 9.184 -7.354 330 HB VAL 39 HB VAL 39 52.506 7.577 -6.583 331 HG11 VAL 39 HG11 VAL 39 54.092 6.412 -4.972 332 HG12 VAL 39 HG12 VAL 39 54.557 6.135 -6.677 333 HG13 VAL 39 HG13 VAL 39 55.469 7.328 -5.677 334 HG21 VAL 39 HG21 VAL 39 52.947 8.507 -4.244 335 HG22 VAL 39 HG22 VAL 39 54.228 9.568 -4.935 336 HG23 VAL 39 HG23 VAL 39 52.507 9.786 -5.420 337 H SER 40 HN SER 40 56.204 7.560 -8.566 338 HA SER 40 HA SER 40 54.868 6.798 -10.942 339 HB2 SER 40 HB1 SER 40 56.987 5.822 -11.670 340 HB3 SER 40 HB2 SER 40 57.362 7.404 -10.917 341 HG SER 40 HG SER 40 58.710 5.537 -10.346 342 H ILE 41 HN ILE 41 54.788 4.562 -11.828 343 HA ILE 41 HA ILE 41 53.674 2.711 -10.045 344 HB ILE 41 HB ILE 41 54.749 2.480 -12.857 345 HG12 ILE 41 HG11 ILE 41 52.919 4.056 -12.825 346 HG13 ILE 41 HG12 ILE 41 52.334 2.539 -13.579 347 HG21 ILE 41 HG21 ILE 41 53.406 0.293 -12.998 348 HG22 ILE 41 HG22 ILE 41 54.495 0.179 -11.580 349 HG23 ILE 41 HG23 ILE 41 52.749 0.555 -11.345 350 HD11 ILE 41 HD11 ILE 41 50.598 3.472 -12.119 351 HD12 ILE 41 HD12 ILE 41 51.182 1.916 -11.427 352 HD13 ILE 41 HD13 ILE 41 51.711 3.482 -10.707 353 H SER 42 HN SER 42 56.969 3.069 -11.439 354 HA SER 42 HA SER 42 57.951 0.613 -10.611 355 HB2 SER 42 HB1 SER 42 59.041 2.046 -12.355 356 HB3 SER 42 HB2 SER 42 59.396 3.314 -11.140 357 HG SER 42 HG SER 42 61.136 1.789 -11.719 358 H THR 43 HN THR 43 58.026 3.851 -8.849 359 HA THR 43 HA THR 43 59.526 2.801 -6.759 360 HB THR 43 HB THR 43 58.693 4.725 -5.405 361 HG1 THR 43 HG1 THR 43 57.743 6.392 -6.615 362 HG21 THR 43 HG21 THR 43 60.112 6.353 -6.771 363 HG22 THR 43 HG22 THR 43 60.835 4.713 -6.878 364 HG23 THR 43 HG23 THR 43 59.869 5.360 -8.252 365 H VAL 44 HN VAL 44 55.835 2.880 -7.104 366 HA VAL 44 HA VAL 44 55.501 1.942 -4.476 367 HB VAL 44 HB VAL 44 53.284 1.215 -5.062 368 HG11 VAL 44 HG11 VAL 44 52.466 3.561 -5.705 369 HG12 VAL 44 HG12 VAL 44 53.715 3.616 -4.425 370 HG13 VAL 44 HG13 VAL 44 54.155 4.012 -6.129 371 HG21 VAL 44 HG21 VAL 44 52.311 1.719 -7.315 372 HG22 VAL 44 HG22 VAL 44 53.966 2.050 -7.946 373 HG23 VAL 44 HG23 VAL 44 53.525 0.403 -7.369 374 H LYS 45 HN LYS 45 56.074 0.190 -7.601 375 HA LYS 45 HA LYS 45 55.735 -2.377 -6.577 376 HB2 LYS 45 HB1 LYS 45 57.390 -1.231 -8.871 377 HB3 LYS 45 HB2 LYS 45 57.375 -2.983 -8.540 378 HG2 LYS 45 HG1 LYS 45 54.722 -1.467 -8.949 379 HG3 LYS 45 HG2 LYS 45 55.734 -1.891 -10.372 380 HD2 LYS 45 HD1 LYS 45 53.996 -3.558 -10.096 381 HD3 LYS 45 HD2 LYS 45 55.580 -4.314 -9.720 382 HE2 LYS 45 HE1 LYS 45 55.075 -4.226 -7.284 383 HE3 LYS 45 HE2 LYS 45 53.496 -3.422 -7.629 384 HZ1 LYS 45 HZ1 LYS 45 53.258 -5.813 -7.384 385 HZ2 LYS 45 HZ2 LYS 45 52.876 -5.340 -8.970 386 HZ3 LYS 45 HZ3 LYS 45 54.360 -6.093 -8.644 387 H ARG 46 HN ARG 46 58.739 -0.320 -6.678 388 HA ARG 46 HA ARG 46 60.410 -2.267 -5.527 389 HB2 ARG 46 HB1 ARG 46 60.475 0.777 -5.483 390 HB3 ARG 46 HB2 ARG 46 61.787 -0.192 -4.772 391 HG2 ARG 46 HG1 ARG 46 60.821 -0.331 -7.729 392 HG3 ARG 46 HG2 ARG 46 62.211 0.630 -7.192 393 HD2 ARG 46 HD1 ARG 46 63.542 -1.285 -6.579 394 HD3 ARG 46 HD2 ARG 46 62.156 -2.436 -6.769 395 HE ARG 46 HE ARG 46 63.719 -1.156 -8.910 396 HH11 ARG 46 HH11 ARG 46 61.746 -2.857 -11.412 397 HH12 ARG 46 HH12 ARG 46 63.016 -1.696 -11.106 398 HH21 ARG 46 HH21 ARG 46 60.550 -3.719 -9.545 399 HH22 ARG 46 HH22 ARG 46 61.006 -3.198 -7.959 400 H VAL 47 HN VAL 47 58.359 0.269 -3.873 401 HA VAL 47 HA VAL 47 59.164 -0.378 -1.282 402 HB VAL 47 HB VAL 47 56.629 0.845 -2.405 403 HG11 VAL 47 HG11 VAL 47 56.166 1.661 -0.052 404 HG12 VAL 47 HG12 VAL 47 56.039 -0.119 -0.171 405 HG13 VAL 47 HG13 VAL 47 57.505 0.632 0.567 406 HG21 VAL 47 HG21 VAL 47 57.752 2.963 -1.431 407 HG22 VAL 47 HG22 VAL 47 59.167 1.957 -0.950 408 HG23 VAL 47 HG23 VAL 47 58.765 2.188 -2.690 409 H LEU 48 HN LEU 48 56.360 -1.703 -3.246 410 HA LEU 48 HA LEU 48 55.522 -3.510 -1.327 411 HB2 LEU 48 HB1 LEU 48 55.433 -3.452 -4.392 412 HB3 LEU 48 HB2 LEU 48 54.719 -4.823 -3.512 413 HG LEU 48 HG LEU 48 53.881 -1.912 -2.905 414 HD11 LEU 48 HD11 LEU 48 51.937 -2.300 -4.526 415 HD12 LEU 48 HD12 LEU 48 53.519 -2.295 -5.388 416 HD13 LEU 48 HD13 LEU 48 52.684 -3.854 -5.039 417 HD21 LEU 48 HD21 LEU 48 51.757 -3.016 -2.177 418 HD22 LEU 48 HD22 LEU 48 52.406 -4.628 -2.618 419 HD23 LEU 48 HD23 LEU 48 53.175 -3.684 -1.292 420 H TYR 49 HN TYR 49 58.032 -3.938 -3.936 421 HA TYR 49 HA TYR 49 58.333 -6.686 -3.511 422 HB2 TYR 49 HB1 TYR 49 59.056 -5.326 -5.591 423 HB3 TYR 49 HB2 TYR 49 60.435 -4.706 -4.634 424 HD1 TYR 49 HD1 TYR 49 58.782 -7.676 -6.086 425 HD2 TYR 49 HD2 TYR 49 62.382 -6.285 -4.188 426 HE1 TYR 49 HE1 TYR 49 59.954 -9.752 -6.775 427 HE2 TYR 49 HE2 TYR 49 63.540 -8.357 -4.877 428 HH TYR 49 HH TYR 49 63.399 -10.287 -6.028 429 H ARG 50 HN ARG 50 60.208 -3.842 -2.140 430 HA ARG 50 HA ARG 50 61.875 -5.420 -0.569 431 HB2 ARG 50 HB1 ARG 50 60.878 -2.581 -0.319 432 HB3 ARG 50 HB2 ARG 50 61.799 -3.276 1.036 433 HG2 ARG 50 HG1 ARG 50 62.783 -3.194 -1.904 434 HG3 ARG 50 HG2 ARG 50 63.136 -1.906 -0.737 435 HD2 ARG 50 HD1 ARG 50 64.326 -3.387 0.823 436 HD3 ARG 50 HD2 ARG 50 63.835 -4.881 -0.078 437 HE ARG 50 HE ARG 50 65.414 -4.524 -1.660 438 HH11 ARG 50 HH11 ARG 50 66.699 -0.944 -0.045 439 HH12 ARG 50 HH12 ARG 50 65.168 -1.665 0.385 440 HH21 ARG 50 HH21 ARG 50 68.069 -2.100 -1.627 441 HH22 ARG 50 HH22 ARG 50 67.509 -3.616 -2.245 442 H HIS 51 HN HIS 51 58.591 -4.081 0.422 443 HA HIS 51 HA HIS 51 58.877 -5.070 3.028 444 HB2 HIS 51 HB1 HIS 51 56.478 -4.224 1.360 445 HB3 HIS 51 HB2 HIS 51 56.264 -4.904 2.996 446 HD1 HIS 51 HD1 HIS 51 58.525 -2.086 1.492 447 HD2 HIS 51 HD2 HIS 51 56.085 -2.865 4.811 448 HE1 HIS 51 HE1 HIS 51 58.593 -0.038 3.038 449 H ASN 52 HN ASN 52 57.392 -6.602 0.068 450 HA ASN 52 HA ASN 52 56.571 -8.868 1.464 451 HB2 ASN 52 HB1 ASN 52 55.759 -8.005 -0.801 452 HB3 ASN 52 HB2 ASN 52 57.310 -8.523 -1.532 453 HD21 ASN 52 HD21 ASN 52 55.783 -11.623 -2.289 454 HD22 ASN 52 HD22 ASN 52 56.679 -10.234 -2.853 455 H LEU 53 HN LEU 53 59.695 -8.193 -0.356 456 HA LEU 53 HA LEU 53 60.730 -10.737 0.066 457 HB2 LEU 53 HB1 LEU 53 61.565 -9.163 -1.670 458 HB3 LEU 53 HB2 LEU 53 62.054 -7.987 -0.427 459 HG LEU 53 HG LEU 53 63.712 -9.690 0.429 460 HD11 LEU 53 HD11 LEU 53 64.437 -11.550 -1.187 461 HD12 LEU 53 HD12 LEU 53 62.796 -11.804 -0.488 462 HD13 LEU 53 HD13 LEU 53 62.975 -11.207 -2.179 463 HD21 LEU 53 HD21 LEU 53 65.389 -9.260 -1.421 464 HD22 LEU 53 HD22 LEU 53 64.060 -8.720 -2.496 465 HD23 LEU 53 HD23 LEU 53 64.424 -7.802 -0.990 466 H LYS 54 HN LYS 54 61.246 -7.675 2.006 467 HA LYS 54 HA LYS 54 62.329 -9.385 4.122 468 HB2 LYS 54 HB1 LYS 54 64.190 -8.180 2.813 469 HB3 LYS 54 HB2 LYS 54 63.391 -6.626 3.163 470 HG2 LYS 54 HG1 LYS 54 63.717 -7.189 5.695 471 HG3 LYS 54 HG2 LYS 54 64.730 -8.572 5.164 472 HD2 LYS 54 HD1 LYS 54 65.239 -5.601 4.481 473 HD3 LYS 54 HD2 LYS 54 66.017 -6.497 5.829 474 HE2 LYS 54 HE1 LYS 54 67.073 -8.077 4.155 475 HE3 LYS 54 HE2 LYS 54 66.339 -7.118 2.814 476 HZ1 LYS 54 HZ1 LYS 54 68.596 -6.403 3.307 477 HZ2 LYS 54 HZ2 LYS 54 67.491 -5.163 3.659 478 HZ3 LYS 54 HZ3 LYS 54 68.179 -6.066 4.918 479 H GLY 55 HN GLY 55 61.025 -9.138 5.953 480 HA2 GLY 55 HA2 GLY 55 59.257 -6.831 5.908 481 HA3 GLY 55 HA1 GLY 55 59.177 -8.299 6.974 482 H ARG 56 HN ARG 56 60.372 -5.007 6.590 483 HA ARG 56 HA ARG 56 62.157 -5.129 8.796 484 HB2 ARG 56 HB1 ARG 56 62.243 -2.707 8.729 485 HB3 ARG 56 HB2 ARG 56 62.495 -3.372 7.099 486 HG2 ARG 56 HG1 ARG 56 60.256 -2.676 6.389 487 HG3 ARG 56 HG2 ARG 56 59.719 -2.399 8.056 488 HD2 ARG 56 HD1 ARG 56 62.034 -0.740 6.886 489 HD3 ARG 56 HD2 ARG 56 60.307 -0.216 6.728 490 HE ARG 56 HE ARG 56 60.081 -0.163 9.116 491 HH11 ARG 56 HH11 ARG 56 64.176 0.130 9.450 492 HH12 ARG 56 HH12 ARG 56 63.409 -0.350 7.955 493 HH21 ARG 56 HH21 ARG 56 62.806 0.482 11.347 494 HH22 ARG 56 HH22 ARG 56 61.094 0.292 11.182 495 H SER 57 HN SER 57 62.013 -4.227 10.943 496 HA SER 57 HA SER 57 59.413 -3.207 11.680 497 HB2 SER 57 HB1 SER 57 59.396 -5.652 12.340 498 HB3 SER 57 HB2 SER 57 60.951 -5.448 13.206 499 HG SER 57 HG SER 57 58.933 -5.382 14.481 500 H ALA 58 HN ALA 58 62.844 -3.838 12.661 501 HA ALA 58 HA ALA 58 62.805 -1.282 14.156 502 HB1 ALA 58 HB1 ALA 58 62.931 -3.275 15.646 503 HB2 ALA 58 HB2 ALA 58 64.346 -3.890 14.725 504 HB3 ALA 58 HB3 ALA 58 64.481 -2.364 15.681 505 H ARG 59 HN ARG 59 65.660 -3.245 13.534 506 HA ARG 59 HA ARG 59 66.678 -1.193 11.671 507 HB2 ARG 59 HB1 ARG 59 68.137 -2.543 14.011 508 HB3 ARG 59 HB2 ARG 59 68.969 -1.550 12.790 509 HG2 ARG 59 HG1 ARG 59 67.412 0.417 13.554 510 HG3 ARG 59 HG2 ARG 59 66.849 -0.630 14.869 511 HD2 ARG 59 HD1 ARG 59 69.830 0.082 14.482 512 HD3 ARG 59 HD2 ARG 59 68.732 0.907 15.664 513 HE ARG 59 HE ARG 59 68.267 -1.550 16.444 514 HH11 ARG 59 HH11 ARG 59 71.322 -2.816 17.849 515 HH12 ARG 59 HH12 ARG 59 69.576 -2.849 17.881 516 HH21 ARG 59 HH21 ARG 59 72.379 -1.289 16.354 517 HH22 ARG 59 HH22 ARG 59 71.382 -0.309 15.335 518 H LYS 60 HN LYS 60 68.060 -1.913 10.065 519 HA LYS 60 HA LYS 60 68.861 -3.267 8.557 520 HB2 LYS 60 HB1 LYS 60 69.658 -4.865 11.001 521 HB3 LYS 60 HB2 LYS 60 70.243 -5.250 9.361 522 HG2 LYS 60 HG1 LYS 60 71.234 -2.897 9.207 523 HG3 LYS 60 HG2 LYS 60 70.644 -2.560 10.868 524 HD2 LYS 60 HD1 LYS 60 72.291 -3.885 11.865 525 HD3 LYS 60 HD2 LYS 60 72.283 -5.086 10.529 526 HE2 LYS 60 HE1 LYS 60 73.597 -2.292 10.316 527 HE3 LYS 60 HE2 LYS 60 74.478 -3.805 10.749 528 HZ1 LYS 60 HZ1 LYS 60 74.614 -3.325 8.392 529 HZ2 LYS 60 HZ2 LYS 60 73.751 -4.763 8.654 530 HZ3 LYS 60 HZ3 LYS 60 72.923 -3.341 8.248 531 H LEU 61 HN LEU 61 68.813 -6.431 9.712 532 HA LEU 61 HA LEU 61 67.106 -7.247 7.679 533 HB2 LEU 61 HB1 LEU 61 69.089 -8.510 8.539 534 HB3 LEU 61 HB2 LEU 61 68.301 -8.718 10.120 535 HG LEU 61 HG LEU 61 66.466 -10.057 8.927 536 HD11 LEU 61 HD11 LEU 61 67.078 -11.005 6.629 537 HD12 LEU 61 HD12 LEU 61 66.792 -9.228 6.598 538 HD13 LEU 61 HD13 LEU 61 68.475 -9.872 6.562 539 HD21 LEU 61 HD21 LEU 61 67.865 -12.139 8.737 540 HD22 LEU 61 HD22 LEU 61 69.362 -11.155 8.752 541 HD23 LEU 61 HD23 LEU 61 68.287 -11.172 10.196 542 H GLU 62 HN GLU 62 66.597 -7.068 11.257 543 HA GLU 62 HA GLU 62 63.748 -7.587 10.811 544 HB2 GLU 62 HB1 GLU 62 65.574 -8.615 13.062 545 HB3 GLU 62 HB2 GLU 62 63.801 -8.698 13.149 546 HG2 GLU 62 HG1 GLU 62 65.453 -10.051 10.906 547 HG3 GLU 62 HG2 GLU 62 64.950 -10.897 12.417
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