NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
620659 | 5gwm | 36021 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 HT1 MET 1 30.357 -1.553 9.148 2 H2 MET 1 HT2 MET 1 29.940 -1.317 7.527 3 H3 MET 1 HT3 MET 1 31.235 -0.465 8.199 4 HA MET 1 HA MET 1 32.438 -2.530 8.547 5 HB2 MET 1 HB2 MET 1 30.082 -3.705 7.062 6 HB3 MET 1 HB1 MET 1 31.592 -4.556 7.353 7 HG2 MET 1 HG2 MET 1 29.686 -3.550 9.451 8 HG3 MET 1 HG1 MET 1 29.898 -5.225 8.947 9 HE1 MET 1 HE1 MET 1 30.022 -4.292 11.982 10 HE2 MET 1 HE2 MET 1 31.421 -5.199 12.556 11 HE3 MET 1 HE3 MET 1 30.258 -5.964 11.474 12 H ASP 2 HN ASP 2 30.645 -1.252 5.817 13 HA ASP 2 HA ASP 2 32.678 -1.944 3.891 14 HB2 ASP 2 HB2 ASP 2 30.180 -1.678 3.421 15 HB3 ASP 2 HB1 ASP 2 30.442 0.057 3.549 16 H SER 3 HN SER 3 34.101 -0.495 2.885 17 HA SER 3 HA SER 3 35.012 1.606 4.645 18 HB2 SER 3 HB2 SER 3 36.574 -0.021 3.562 19 HB3 SER 3 HB1 SER 3 36.182 0.700 2.002 20 HG SER 3 HG SER 3 37.219 2.523 2.552 21 H ALA 4 HN ALA 4 33.220 1.334 1.703 22 HA ALA 4 HA ALA 4 33.557 4.189 1.121 23 HB1 ALA 4 HB1 ALA 4 32.456 3.711 -1.000 24 HB2 ALA 4 HB2 ALA 4 32.180 2.043 -0.495 25 HB3 ALA 4 HB3 ALA 4 33.825 2.625 -0.754 26 H ILE 5 HN ILE 5 30.997 1.756 1.532 27 HA ILE 5 HA ILE 5 28.939 3.727 1.892 28 HB ILE 5 HB ILE 5 28.899 0.798 2.647 29 HG12 ILE 5 HG12 ILE 5 27.938 2.130 0.109 30 HG13 ILE 5 HG11 ILE 5 29.414 1.184 0.249 31 HG21 ILE 5 HG21 ILE 5 26.486 1.009 2.571 32 HG22 ILE 5 HG22 ILE 5 26.627 2.709 2.132 33 HG23 ILE 5 HG23 ILE 5 27.159 2.163 3.722 34 HD11 ILE 5 HD11 ILE 5 28.106 -0.790 0.798 35 HD12 ILE 5 HD12 ILE 5 27.614 -0.105 -0.751 36 HD13 ILE 5 HD13 ILE 5 26.620 0.155 0.683 37 H SER 6 HN SER 6 29.282 5.069 3.582 38 HA SER 6 HA SER 6 30.212 3.936 6.110 39 HB2 SER 6 HB2 SER 6 31.376 5.922 5.130 40 HB3 SER 6 HB1 SER 6 29.882 6.840 5.303 41 HG SER 6 HG SER 6 31.725 6.044 7.214 42 H LYS 7 HN LYS 7 29.196 5.562 7.971 43 HA LYS 7 HA LYS 7 26.580 4.740 8.441 44 HB2 LYS 7 HB2 LYS 7 28.169 5.660 10.138 45 HB3 LYS 7 HB1 LYS 7 27.914 7.260 9.455 46 HG2 LYS 7 HG2 LYS 7 25.494 7.019 9.996 47 HG3 LYS 7 HG1 LYS 7 25.896 5.525 10.842 48 HD2 LYS 7 HD2 LYS 7 26.976 8.268 11.477 49 HD3 LYS 7 HD1 LYS 7 25.738 7.407 12.392 50 HE2 LYS 7 HE2 LYS 7 27.360 5.632 12.890 51 HE3 LYS 7 HE1 LYS 7 28.591 6.516 11.991 52 HZ1 LYS 7 HZ1 LYS 7 27.214 7.468 14.441 53 HZ2 LYS 7 HZ2 LYS 7 28.364 8.344 13.566 54 HZ3 LYS 7 HZ3 LYS 7 28.808 6.913 14.346 55 H GLU 8 HN GLU 8 27.881 7.463 6.737 56 HA GLU 8 HA GLU 8 25.756 9.189 6.507 57 HB2 GLU 8 HB2 GLU 8 27.752 8.471 4.353 58 HB3 GLU 8 HB1 GLU 8 26.822 9.963 4.453 59 HG2 GLU 8 HG2 GLU 8 28.951 9.035 6.368 60 HG3 GLU 8 HG1 GLU 8 29.078 10.348 5.199 61 H ASP 9 HN ASP 9 26.624 6.737 4.053 62 HA ASP 9 HA ASP 9 24.280 7.047 2.536 63 HB2 ASP 9 HB2 ASP 9 26.319 6.011 1.641 64 HB3 ASP 9 HB1 ASP 9 26.107 4.642 2.727 65 H GLU 10 HN GLU 10 25.034 5.047 5.282 66 HA GLU 10 HA GLU 10 22.844 3.271 5.079 67 HB2 GLU 10 HB2 GLU 10 24.770 2.694 6.427 68 HB3 GLU 10 HB1 GLU 10 24.518 4.096 7.458 69 HG2 GLU 10 HG2 GLU 10 22.468 3.167 8.299 70 HG3 GLU 10 HG1 GLU 10 22.593 1.803 7.191 71 H GLU 11 HN GLU 11 23.350 5.990 7.330 72 HA GLU 11 HA GLU 11 20.850 6.113 8.441 73 HB2 GLU 11 HB2 GLU 11 22.799 8.315 7.793 74 HB3 GLU 11 HB1 GLU 11 21.340 8.577 8.742 75 HG2 GLU 11 HG2 GLU 11 23.481 6.592 9.452 76 HG3 GLU 11 HG1 GLU 11 23.393 8.232 10.088 77 H ARG 12 HN ARG 12 21.944 7.605 5.418 78 HA ARG 12 HA ARG 12 19.600 9.085 4.905 79 HB2 ARG 12 HB2 ARG 12 21.584 7.920 2.943 80 HB3 ARG 12 HB1 ARG 12 20.368 9.128 2.551 81 HG2 ARG 12 HG2 ARG 12 21.416 10.710 4.062 82 HG3 ARG 12 HG1 ARG 12 22.608 9.495 4.529 83 HD2 ARG 12 HD2 ARG 12 23.273 9.375 2.109 84 HD3 ARG 12 HD1 ARG 12 22.239 10.775 1.830 85 HE ARG 12 HE ARG 12 23.920 11.490 3.888 86 HH11 ARG 12 HH11 ARG 12 24.272 10.488 0.554 87 HH12 ARG 12 HH12 ARG 12 25.774 11.329 0.328 88 HH21 ARG 12 HH21 ARG 12 25.884 12.603 3.595 89 HH22 ARG 12 HH22 ARG 12 26.688 12.545 2.057 90 H TYR 13 HN TYR 13 20.507 5.767 4.145 91 HA TYR 13 HA TYR 13 18.177 5.249 2.571 92 HB2 TYR 13 HB2 TYR 13 20.081 3.911 2.102 93 HB3 TYR 13 HB1 TYR 13 20.296 3.487 3.795 94 HD1 TYR 13 HD1 TYR 13 19.859 1.281 4.231 95 HD2 TYR 13 HD2 TYR 13 17.483 3.297 1.340 96 HE1 TYR 13 HE1 TYR 13 18.525 -0.763 3.913 97 HE2 TYR 13 HE2 TYR 13 16.133 1.270 1.017 98 HH TYR 13 HH TYR 13 16.467 -1.232 1.329 99 H GLN 14 HN GLN 14 19.186 4.428 5.874 100 HA GLN 14 HA GLN 14 17.016 2.878 6.653 101 HB2 GLN 14 HB2 GLN 14 18.650 4.819 8.292 102 HB3 GLN 14 HB1 GLN 14 17.572 3.609 8.967 103 HG2 GLN 14 HG2 GLN 14 19.999 3.056 7.277 104 HG3 GLN 14 HG1 GLN 14 19.905 2.916 9.030 105 HE21 GLN 14 HE21 GLN 14 20.511 0.908 6.987 106 HE22 GLN 14 HE22 GLN 14 19.368 -0.368 7.221 107 H LYS 15 HN LYS 15 17.465 6.347 7.222 108 HA LYS 15 HA LYS 15 14.948 6.876 8.253 109 HB2 LYS 15 HB2 LYS 15 16.761 8.667 6.641 110 HB3 LYS 15 HB1 LYS 15 15.346 9.231 7.517 111 HG2 LYS 15 HG2 LYS 15 17.765 7.916 8.738 112 HG3 LYS 15 HG1 LYS 15 17.405 9.640 8.757 113 HD2 LYS 15 HD2 LYS 15 15.730 7.470 10.021 114 HD3 LYS 15 HD1 LYS 15 16.811 8.567 10.878 115 HE2 LYS 15 HE2 LYS 15 15.478 10.468 10.134 116 HE3 LYS 15 HE1 LYS 15 14.406 9.380 9.259 117 HZ1 LYS 15 HZ1 LYS 15 13.438 9.982 11.356 118 HZ2 LYS 15 HZ2 LYS 15 14.808 9.457 12.197 119 HZ3 LYS 15 HZ3 LYS 15 13.836 8.338 11.385 120 H LEU 16 HN LEU 16 15.984 6.552 4.939 121 HA LEU 16 HA LEU 16 13.728 7.740 3.720 122 HB2 LEU 16 HB2 LEU 16 15.981 7.299 2.687 123 HB3 LEU 16 HB1 LEU 16 15.518 5.615 2.566 124 HG LEU 16 HG LEU 16 13.836 6.088 0.952 125 HD11 LEU 16 HD11 LEU 16 13.511 8.529 0.256 126 HD12 LEU 16 HD12 LEU 16 14.233 8.935 1.810 127 HD13 LEU 16 HD13 LEU 16 12.743 7.988 1.747 128 HD21 LEU 16 HD21 LEU 16 15.123 7.130 -0.818 129 HD22 LEU 16 HD22 LEU 16 16.140 6.055 0.147 130 HD23 LEU 16 HD23 LEU 16 16.241 7.801 0.371 131 H VAL 17 HN VAL 17 14.559 4.363 4.411 132 HA VAL 17 HA VAL 17 12.181 3.236 3.391 133 HB VAL 17 HB VAL 17 12.827 1.220 4.311 134 HG11 VAL 17 HG11 VAL 17 15.261 1.081 4.199 135 HG12 VAL 17 HG12 VAL 17 15.348 2.843 4.290 136 HG13 VAL 17 HG13 VAL 17 14.589 2.068 2.897 137 HG21 VAL 17 HG21 VAL 17 14.154 0.938 6.363 138 HG22 VAL 17 HG22 VAL 17 12.641 1.800 6.657 139 HG23 VAL 17 HG23 VAL 17 14.163 2.690 6.581 140 H THR 18 HN THR 18 13.031 4.607 6.489 141 HA THR 18 HA THR 18 10.747 3.893 7.939 142 HB THR 18 HB THR 18 13.027 5.565 8.318 143 HG1 THR 18 HG1 THR 18 11.413 3.947 9.708 144 HG21 THR 18 HG21 THR 18 11.563 7.483 7.942 145 HG22 THR 18 HG22 THR 18 12.078 7.391 9.634 146 HG23 THR 18 HG23 THR 18 10.449 6.875 9.180 147 H GLU 19 HN GLU 19 11.427 6.676 5.869 148 HA GLU 19 HA GLU 19 9.014 8.040 6.192 149 HB2 GLU 19 HB2 GLU 19 10.813 7.836 3.765 150 HB3 GLU 19 HB1 GLU 19 9.555 9.048 3.989 151 HG2 GLU 19 HG2 GLU 19 11.841 8.683 5.906 152 HG3 GLU 19 HG1 GLU 19 11.909 9.772 4.537 153 H ASN 20 HN ASN 20 9.974 5.513 3.938 154 HA ASN 20 HA ASN 20 7.641 5.375 2.407 155 HB2 ASN 20 HB2 ASN 20 9.875 3.501 3.016 156 HB3 ASN 20 HB1 ASN 20 8.434 2.841 2.246 157 HD21 ASN 20 HD21 ASN 20 9.739 6.065 1.765 158 HD22 ASN 20 HD22 ASN 20 10.190 5.830 0.112 159 H GLU 21 HN GLU 21 8.540 3.567 5.350 160 HA GLU 21 HA GLU 21 6.291 1.935 5.461 161 HB2 GLU 21 HB2 GLU 21 7.935 3.026 7.737 162 HB3 GLU 21 HB1 GLU 21 6.883 1.614 7.806 163 HG2 GLU 21 HG2 GLU 21 9.127 1.834 5.856 164 HG3 GLU 21 HG1 GLU 21 9.365 1.211 7.478 165 H GLN 22 HN GLN 22 6.811 5.177 6.770 166 HA GLN 22 HA GLN 22 4.586 5.356 8.443 167 HB2 GLN 22 HB2 GLN 22 5.592 7.674 6.801 168 HB3 GLN 22 HB1 GLN 22 4.844 7.717 8.388 169 HG2 GLN 22 HG2 GLN 22 6.845 6.652 9.348 170 HG3 GLN 22 HG1 GLN 22 7.590 6.655 7.752 171 HE21 GLN 22 HE21 GLN 22 9.254 7.988 8.309 172 HE22 GLN 22 HE22 GLN 22 9.056 9.664 8.667 173 H LEU 23 HN LEU 23 4.902 6.645 5.140 174 HA LEU 23 HA LEU 23 2.176 7.511 5.300 175 HB2 LEU 23 HB2 LEU 23 2.609 8.907 3.521 176 HB3 LEU 23 HB1 LEU 23 4.130 8.829 4.368 177 HG LEU 23 HG LEU 23 3.435 7.501 1.776 178 HD11 LEU 23 HD11 LEU 23 5.431 9.623 2.504 179 HD12 LEU 23 HD12 LEU 23 3.911 9.875 1.645 180 HD13 LEU 23 HD13 LEU 23 5.201 8.931 0.900 181 HD21 LEU 23 HD21 LEU 23 5.992 7.300 3.345 182 HD22 LEU 23 HD22 LEU 23 5.741 6.707 1.704 183 HD23 LEU 23 HD23 LEU 23 4.852 5.989 3.046 184 H GLN 24 HN GLN 24 3.774 4.790 3.843 185 HA GLN 24 HA GLN 24 1.763 4.241 1.908 186 HB2 GLN 24 HB2 GLN 24 2.668 2.019 1.757 187 HB3 GLN 24 HB1 GLN 24 4.007 3.146 1.907 188 HG2 GLN 24 HG2 GLN 24 4.280 2.568 4.235 189 HG3 GLN 24 HG1 GLN 24 2.867 1.516 4.166 190 HE21 GLN 24 HE21 GLN 24 6.183 1.925 3.221 191 HE22 GLN 24 HE22 GLN 24 6.465 0.280 2.765 192 H ARG 25 HN ARG 25 2.071 3.720 5.309 193 HA ARG 25 HA ARG 25 -0.166 1.982 5.619 194 HB2 ARG 25 HB2 ARG 25 1.181 1.788 7.448 195 HB3 ARG 25 HB1 ARG 25 1.780 3.432 7.306 196 HG2 ARG 25 HG2 ARG 25 -0.642 4.022 8.090 197 HG3 ARG 25 HG1 ARG 25 -0.581 2.391 8.763 198 HD2 ARG 25 HD2 ARG 25 1.261 4.711 9.325 199 HD3 ARG 25 HD1 ARG 25 0.170 3.903 10.452 200 HE ARG 25 HE ARG 25 1.766 1.883 9.793 201 HH11 ARG 25 HH11 ARG 25 2.554 5.197 10.599 202 HH12 ARG 25 HH12 ARG 25 4.084 4.799 11.308 203 HH21 ARG 25 HH21 ARG 25 3.792 1.350 10.716 204 HH22 ARG 25 HH22 ARG 25 4.782 2.604 11.391 205 H LEU 26 HN LEU 26 0.444 5.445 5.911 206 HA LEU 26 HA LEU 26 -2.074 6.225 6.865 207 HB2 LEU 26 HB2 LEU 26 -0.135 7.760 5.130 208 HB3 LEU 26 HB1 LEU 26 -1.441 8.467 6.069 209 HG LEU 26 HG LEU 26 0.896 6.956 7.253 210 HD11 LEU 26 HD11 LEU 26 1.782 9.061 7.942 211 HD12 LEU 26 HD12 LEU 26 0.406 9.924 7.252 212 HD13 LEU 26 HD13 LEU 26 1.550 9.099 6.195 213 HD21 LEU 26 HD21 LEU 26 -1.294 8.585 8.531 214 HD22 LEU 26 HD22 LEU 26 0.098 7.904 9.371 215 HD23 LEU 26 HD23 LEU 26 -1.092 6.835 8.630 216 H ILE 27 HN ILE 27 -0.838 5.701 3.626 217 HA ILE 27 HA ILE 27 -3.059 6.543 2.146 218 HB ILE 27 HB ILE 27 -1.125 4.294 1.574 219 HG12 ILE 27 HG12 ILE 27 -1.177 7.131 0.537 220 HG13 ILE 27 HG11 ILE 27 -0.116 6.547 1.825 221 HG21 ILE 27 HG21 ILE 27 -1.818 4.506 -0.760 222 HG22 ILE 27 HG22 ILE 27 -3.036 5.691 -0.293 223 HG23 ILE 27 HG23 ILE 27 -3.163 4.026 0.273 224 HD11 ILE 27 HD11 ILE 27 0.881 4.962 0.263 225 HD12 ILE 27 HD12 ILE 27 1.050 6.628 -0.291 226 HD13 ILE 27 HD13 ILE 27 -0.161 5.574 -1.019 227 H THR 28 HN THR 28 -2.204 3.293 3.317 228 HA THR 28 HA THR 28 -4.368 1.947 2.239 229 HB THR 28 HB THR 28 -2.219 1.033 3.466 230 HG1 THR 28 HG1 THR 28 -3.168 -0.929 3.258 231 HG21 THR 28 HG21 THR 28 -2.792 0.011 5.646 232 HG22 THR 28 HG22 THR 28 -4.312 0.912 5.645 233 HG23 THR 28 HG23 THR 28 -2.773 1.775 5.715 234 H GLN 29 HN GLN 29 -4.197 3.750 5.260 235 HA GLN 29 HA GLN 29 -6.538 2.789 6.485 236 HB2 GLN 29 HB2 GLN 29 -5.494 5.620 6.630 237 HB3 GLN 29 HB1 GLN 29 -6.491 4.793 7.818 238 HG2 GLN 29 HG2 GLN 29 -3.673 4.051 7.096 239 HG3 GLN 29 HG1 GLN 29 -4.161 4.992 8.497 240 HE21 GLN 29 HE21 GLN 29 -2.782 2.409 8.278 241 HE22 GLN 29 HE22 GLN 29 -3.720 1.297 9.207 242 H LYS 30 HN LYS 30 -5.981 5.608 4.465 243 HA LYS 30 HA LYS 30 -8.707 6.378 4.320 244 HB2 LYS 30 HB2 LYS 30 -6.665 7.078 2.225 245 HB3 LYS 30 HB1 LYS 30 -8.024 8.036 2.793 246 HG2 LYS 30 HG2 LYS 30 -5.425 7.497 4.205 247 HG3 LYS 30 HG1 LYS 30 -6.056 9.042 3.639 248 HD2 LYS 30 HD2 LYS 30 -7.848 8.928 5.295 249 HD3 LYS 30 HD1 LYS 30 -7.260 7.355 5.835 250 HE2 LYS 30 HE2 LYS 30 -6.460 8.992 7.374 251 HE3 LYS 30 HE1 LYS 30 -5.090 8.446 6.409 252 HZ1 LYS 30 HZ1 LYS 30 -5.413 10.442 5.006 253 HZ2 LYS 30 HZ2 LYS 30 -4.995 10.802 6.604 254 HZ3 LYS 30 HZ3 LYS 30 -6.596 10.981 6.091 255 H GLU 31 HN GLU 31 -6.568 4.654 2.075 256 HA GLU 31 HA GLU 31 -8.212 4.280 -0.074 257 HB2 GLU 31 HB2 GLU 31 -6.089 2.548 1.130 258 HB3 GLU 31 HB1 GLU 31 -6.962 2.027 -0.304 259 HG2 GLU 31 HG2 GLU 31 -5.585 4.678 -0.145 260 HG3 GLU 31 HG1 GLU 31 -4.757 3.209 -0.655 261 H GLU 32 HN GLU 32 -8.025 2.055 2.739 262 HA GLU 32 HA GLU 32 -9.883 0.229 1.693 263 HB2 GLU 32 HB2 GLU 32 -10.171 -0.513 4.096 264 HB3 GLU 32 HB1 GLU 32 -8.535 -0.553 3.462 265 HG2 GLU 32 HG2 GLU 32 -7.964 1.453 4.644 266 HG3 GLU 32 HG1 GLU 32 -9.641 1.670 5.158 267 H LYS 33 HN LYS 33 -10.353 3.158 3.565 268 HA LYS 33 HA LYS 33 -13.147 2.624 4.010 269 HB2 LYS 33 HB2 LYS 33 -11.577 4.023 5.485 270 HB3 LYS 33 HB1 LYS 33 -11.808 5.302 4.302 271 HG2 LYS 33 HG2 LYS 33 -14.220 5.238 4.707 272 HG3 LYS 33 HG1 LYS 33 -13.981 3.963 5.901 273 HD2 LYS 33 HD2 LYS 33 -12.823 6.746 6.056 274 HD3 LYS 33 HD1 LYS 33 -14.233 6.174 6.948 275 HE2 LYS 33 HE2 LYS 33 -12.841 4.501 8.068 276 HE3 LYS 33 HE1 LYS 33 -11.433 5.072 7.176 277 HZ1 LYS 33 HZ1 LYS 33 -11.489 6.011 9.386 278 HZ2 LYS 33 HZ2 LYS 33 -13.024 6.658 9.113 279 HZ3 LYS 33 HZ3 LYS 33 -11.696 7.233 8.237 280 H ILE 34 HN ILE 34 -11.237 4.729 1.891 281 HA ILE 34 HA ILE 34 -13.397 5.901 0.507 282 HB ILE 34 HB ILE 34 -10.538 5.399 -0.351 283 HG12 ILE 34 HG12 ILE 34 -11.820 8.052 0.190 284 HG13 ILE 34 HG11 ILE 34 -11.254 7.058 1.527 285 HG21 ILE 34 HG21 ILE 34 -10.923 6.915 -2.207 286 HG22 ILE 34 HG22 ILE 34 -12.625 7.047 -1.764 287 HG23 ILE 34 HG23 ILE 34 -11.976 5.506 -2.328 288 HD11 ILE 34 HD11 ILE 34 -9.572 8.682 0.891 289 HD12 ILE 34 HD12 ILE 34 -9.565 8.048 -0.753 290 HD13 ILE 34 HD13 ILE 34 -9.002 7.042 0.582 291 H ARG 35 HN ARG 35 -11.752 2.826 0.203 292 HA ARG 35 HA ARG 35 -12.511 2.001 -2.318 293 HB2 ARG 35 HB2 ARG 35 -11.133 0.971 -0.213 294 HB3 ARG 35 HB1 ARG 35 -12.587 -0.013 -0.172 295 HG2 ARG 35 HG2 ARG 35 -10.910 0.380 -2.626 296 HG3 ARG 35 HG1 ARG 35 -10.672 -0.939 -1.484 297 HD2 ARG 35 HD2 ARG 35 -12.904 -1.761 -1.915 298 HD3 ARG 35 HD1 ARG 35 -13.238 -0.387 -2.968 299 HE ARG 35 HE ARG 35 -11.126 -1.455 -4.178 300 HH11 ARG 35 HH11 ARG 35 -13.999 -2.991 -2.903 301 HH12 ARG 35 HH12 ARG 35 -13.984 -4.271 -4.074 302 HH21 ARG 35 HH21 ARG 35 -11.109 -3.131 -5.720 303 HH22 ARG 35 HH22 ARG 35 -12.344 -4.349 -5.680 304 H VAL 36 HN VAL 36 -14.223 1.814 0.757 305 HA VAL 36 HA VAL 36 -16.492 0.437 -0.246 306 HB VAL 36 HB VAL 36 -16.438 2.311 2.113 307 HG11 VAL 36 HG11 VAL 36 -18.656 1.637 1.534 308 HG12 VAL 36 HG12 VAL 36 -18.169 0.718 2.962 309 HG13 VAL 36 HG13 VAL 36 -18.157 -0.048 1.370 310 HG21 VAL 36 HG21 VAL 36 -14.553 0.701 2.177 311 HG22 VAL 36 HG22 VAL 36 -15.723 -0.619 2.081 312 HG23 VAL 36 HG23 VAL 36 -15.722 0.456 3.479 313 H LEU 37 HN LEU 37 -15.700 3.839 0.234 314 HA LEU 37 HA LEU 37 -18.087 4.991 -0.653 315 HB2 LEU 37 HB2 LEU 37 -15.245 5.870 -0.551 316 HB3 LEU 37 HB1 LEU 37 -16.342 6.797 -1.552 317 HG LEU 37 HG LEU 37 -15.943 7.598 0.847 318 HD11 LEU 37 HD11 LEU 37 -18.254 8.349 1.085 319 HD12 LEU 37 HD12 LEU 37 -18.768 7.153 -0.108 320 HD13 LEU 37 HD13 LEU 37 -17.705 8.480 -0.590 321 HD21 LEU 37 HD21 LEU 37 -17.348 6.581 2.557 322 HD22 LEU 37 HD22 LEU 37 -16.163 5.428 1.939 323 HD23 LEU 37 HD23 LEU 37 -17.844 5.331 1.415 324 H ARG 38 HN ARG 38 -15.267 3.843 -2.439 325 HA ARG 38 HA ARG 38 -15.869 4.655 -5.012 326 HB2 ARG 38 HB2 ARG 38 -14.721 1.984 -4.172 327 HB3 ARG 38 HB1 ARG 38 -14.650 2.648 -5.795 328 HG2 ARG 38 HG2 ARG 38 -13.369 3.872 -3.365 329 HG3 ARG 38 HG1 ARG 38 -12.544 2.886 -4.571 330 HD2 ARG 38 HD2 ARG 38 -13.188 4.547 -6.293 331 HD3 ARG 38 HD1 ARG 38 -13.878 5.550 -5.016 332 HE ARG 38 HE ARG 38 -11.214 4.925 -4.365 333 HH11 ARG 38 HH11 ARG 38 -13.029 6.861 -6.654 334 HH12 ARG 38 HH12 ARG 38 -11.757 8.025 -6.860 335 HH21 ARG 38 HH21 ARG 38 -9.539 6.456 -4.650 336 HH22 ARG 38 HH22 ARG 38 -9.784 7.797 -5.728 337 H GLN 39 HN GLN 39 -16.949 1.726 -3.360 338 HA GLN 39 HA GLN 39 -18.455 0.675 -5.508 339 HB2 GLN 39 HB2 GLN 39 -18.959 0.173 -2.570 340 HB3 GLN 39 HB1 GLN 39 -19.332 -0.895 -3.913 341 HG2 GLN 39 HG2 GLN 39 -16.498 -0.139 -3.461 342 HG3 GLN 39 HG1 GLN 39 -17.253 -1.281 -2.359 343 HE21 GLN 39 HE21 GLN 39 -18.188 -1.134 -5.703 344 HE22 GLN 39 HE22 GLN 39 -17.474 -2.626 -6.157 345 H ARG 40 HN ARG 40 -19.258 2.701 -2.773 346 HA ARG 40 HA ARG 40 -22.039 2.805 -3.225 347 HB2 ARG 40 HB2 ARG 40 -20.050 4.379 -1.656 348 HB3 ARG 40 HB1 ARG 40 -21.658 5.042 -1.885 349 HG2 ARG 40 HG2 ARG 40 -22.661 3.118 -0.854 350 HG3 ARG 40 HG1 ARG 40 -21.101 2.305 -0.775 351 HD2 ARG 40 HD2 ARG 40 -20.402 3.528 1.016 352 HD3 ARG 40 HD1 ARG 40 -21.344 4.945 0.558 353 HE ARG 40 HE ARG 40 -23.304 3.333 1.209 354 HH11 ARG 40 HH11 ARG 40 -20.245 3.710 2.891 355 HH12 ARG 40 HH12 ARG 40 -20.928 3.341 4.448 356 HH21 ARG 40 HH21 ARG 40 -24.180 2.858 3.229 357 HH22 ARG 40 HH22 ARG 40 -23.161 2.850 4.643 358 H LEU 41 HN LEU 41 -19.334 4.746 -4.349 359 HA LEU 41 HA LEU 41 -20.870 6.652 -5.778 360 HB2 LEU 41 HB2 LEU 41 -18.060 5.744 -6.326 361 HB3 LEU 41 HB1 LEU 41 -18.792 7.215 -6.894 362 HG LEU 41 HG LEU 41 -18.291 6.554 -4.003 363 HD11 LEU 41 HD11 LEU 41 -16.747 8.306 -5.907 364 HD12 LEU 41 HD12 LEU 41 -16.193 6.794 -5.190 365 HD13 LEU 41 HD13 LEU 41 -16.481 8.201 -4.167 366 HD21 LEU 41 HD21 LEU 41 -18.768 8.932 -3.698 367 HD22 LEU 41 HD22 LEU 41 -20.138 8.047 -4.370 368 HD23 LEU 41 HD23 LEU 41 -19.143 9.053 -5.416 369 H VAL 42 HN VAL 42 -19.736 3.428 -6.522 370 HA VAL 42 HA VAL 42 -20.050 3.379 -9.289 371 HB VAL 42 HB VAL 42 -20.597 1.217 -7.245 372 HG11 VAL 42 HG11 VAL 42 -21.842 0.693 -9.248 373 HG12 VAL 42 HG12 VAL 42 -20.447 -0.378 -9.109 374 HG13 VAL 42 HG13 VAL 42 -20.411 0.972 -10.243 375 HG21 VAL 42 HG21 VAL 42 -18.240 1.740 -9.051 376 HG22 VAL 42 HG22 VAL 42 -18.424 0.343 -7.991 377 HG23 VAL 42 HG23 VAL 42 -18.292 1.961 -7.302 378 H GLU 43 HN GLU 43 -22.458 2.840 -6.752 379 HA GLU 43 HA GLU 43 -24.631 2.362 -8.490 380 HB2 GLU 43 HB2 GLU 43 -24.680 3.455 -5.678 381 HB3 GLU 43 HB1 GLU 43 -26.022 2.697 -6.522 382 HG2 GLU 43 HG2 GLU 43 -24.830 0.590 -6.576 383 HG3 GLU 43 HG1 GLU 43 -23.438 1.338 -5.789 384 H ARG 44 HN ARG 44 -23.164 5.258 -7.241 385 HA ARG 44 HA ARG 44 -25.318 7.001 -8.024 386 HB2 ARG 44 HB2 ARG 44 -22.462 7.630 -7.250 387 HB3 ARG 44 HB1 ARG 44 -23.750 8.809 -7.448 388 HG2 ARG 44 HG2 ARG 44 -24.984 7.706 -5.608 389 HG3 ARG 44 HG1 ARG 44 -23.595 6.640 -5.375 390 HD2 ARG 44 HD2 ARG 44 -23.497 8.480 -3.800 391 HD3 ARG 44 HD1 ARG 44 -22.179 8.608 -4.962 392 HE ARG 44 HE ARG 44 -24.660 10.160 -5.292 393 HH11 ARG 44 HH11 ARG 44 -21.172 10.031 -4.947 394 HH12 ARG 44 HH12 ARG 44 -20.943 11.704 -5.341 395 HH21 ARG 44 HH21 ARG 44 -24.356 12.359 -5.804 396 HH22 ARG 44 HH22 ARG 44 -22.756 13.031 -5.817 397 H GLY 45 HN GLY 45 -22.560 5.613 -9.474 398 HA2 GLY 45 HA2 GLY 45 -21.899 5.675 -11.704 399 HA3 GLY 45 HA1 GLY 45 -23.038 6.991 -11.986 400 H ASP 46 HN ASP 46 -21.104 7.373 -9.249 401 HA ASP 46 HA ASP 46 -19.617 9.544 -10.511 402 HB2 ASP 46 HB2 ASP 46 -20.826 9.882 -8.346 403 HB3 ASP 46 HB1 ASP 46 -19.739 8.725 -7.595 404 H ALA 47 HN ALA 47 -19.223 6.387 -10.283 405 HA ALA 47 HA ALA 47 -16.906 5.717 -9.009 406 HB1 ALA 47 HB1 ALA 47 -17.870 4.623 -11.643 407 HB2 ALA 47 HB2 ALA 47 -18.407 4.106 -10.046 408 HB3 ALA 47 HB3 ALA 47 -16.739 3.834 -10.543 409 H LYS 48 HN LYS 48 -17.155 7.281 -12.184 410 HA LYS 48 HA LYS 48 -14.256 7.075 -12.460 411 HB2 LYS 48 HB2 LYS 48 -16.391 7.906 -14.405 412 HB3 LYS 48 HB1 LYS 48 -14.687 8.178 -14.720 413 HG2 LYS 48 HG2 LYS 48 -15.234 6.192 -15.841 414 HG3 LYS 48 HG1 LYS 48 -14.356 5.693 -14.398 415 HD2 LYS 48 HD2 LYS 48 -16.359 4.303 -14.889 416 HD3 LYS 48 HD1 LYS 48 -16.404 5.073 -13.300 417 HE2 LYS 48 HE2 LYS 48 -17.915 6.723 -14.049 418 HE3 LYS 48 HE1 LYS 48 -17.713 6.247 -15.732 419 HZ1 LYS 48 HZ1 LYS 48 -19.799 5.441 -14.808 420 HZ2 LYS 48 HZ2 LYS 48 -18.964 4.579 -13.617 421 HZ3 LYS 48 HZ3 LYS 48 -18.791 4.155 -15.241 422 H GLY 49 HN GLY 49 -16.793 9.390 -11.908 423 HA2 GLY 49 HA2 GLY 49 -16.645 11.536 -11.061 424 HA3 GLY 49 HA1 GLY 49 -14.891 11.385 -11.076 425 H THR 50 HN THR 50 -14.044 12.932 -12.282 426 HA THR 50 HA THR 50 -14.999 13.222 -15.026 427 HB THR 50 HB THR 50 -14.556 15.582 -13.180 428 HG1 THR 50 HG1 THR 50 -16.760 14.121 -13.829 429 HG21 THR 50 HG21 THR 50 -13.779 16.046 -15.453 430 HG22 THR 50 HG22 THR 50 -15.254 16.947 -15.100 431 HG23 THR 50 HG23 THR 50 -15.324 15.497 -16.102 432 H GLU 51 HN GLU 51 -13.172 12.247 -15.808 433 HA GLU 51 HA GLU 51 -10.622 13.599 -15.231 434 HB2 GLU 51 HB2 GLU 51 -11.022 10.787 -16.257 435 HB3 GLU 51 HB1 GLU 51 -9.497 11.531 -15.809 436 HG2 GLU 51 HG2 GLU 51 -10.383 11.749 -13.494 437 HG3 GLU 51 HG1 GLU 51 -11.760 10.776 -14.001 438 H LEU 52 HN LEU 52 -10.942 15.185 -16.816 439 HA LEU 52 HA LEU 52 -11.281 14.319 -19.553 440 HB2 LEU 52 HB2 LEU 52 -11.623 16.640 -20.052 441 HB3 LEU 52 HB1 LEU 52 -12.612 16.154 -18.698 442 HG LEU 52 HG LEU 52 -11.947 18.188 -18.000 443 HD11 LEU 52 HD11 LEU 52 -11.256 16.788 -16.225 444 HD12 LEU 52 HD12 LEU 52 -10.123 18.130 -16.380 445 HD13 LEU 52 HD13 LEU 52 -9.686 16.532 -16.985 446 HD21 LEU 52 HD21 LEU 52 -10.619 18.775 -19.919 447 HD22 LEU 52 HD22 LEU 52 -9.272 17.815 -19.305 448 HD23 LEU 52 HD23 LEU 52 -9.790 19.263 -18.440 449 H ASN 53 HN ASN 53 -8.681 14.532 -17.592 450 HA ASN 53 HA ASN 53 -6.918 15.695 -19.612 451 HB2 ASN 53 HB2 ASN 53 -6.312 14.771 -16.795 452 HB3 ASN 53 HB1 ASN 53 -5.127 15.453 -17.902 453 HD21 ASN 53 HD21 ASN 53 -7.634 16.096 -15.678 454 HD22 ASN 53 HD22 ASN 53 -7.589 17.825 -15.778 455 H GLY 84 HN GLY 84 13.500 -0.924 -19.798 456 HA2 GLY 84 HA2 GLY 84 15.197 -0.492 -17.445 457 HA3 GLY 84 HA1 GLY 84 13.450 -0.344 -17.271 458 HA PRO 85 HA PRO 85 14.329 -4.922 -18.218 459 HB2 PRO 85 HB2 PRO 85 16.802 -5.836 -18.417 460 HB3 PRO 85 HB1 PRO 85 16.117 -4.848 -19.717 461 HG2 PRO 85 HG2 PRO 85 18.013 -4.076 -17.539 462 HG3 PRO 85 HG1 PRO 85 18.028 -3.611 -19.253 463 HD2 PRO 85 HD2 PRO 85 16.988 -2.063 -17.173 464 HD3 PRO 85 HD1 PRO 85 16.611 -1.854 -18.894 465 H LEU 86 HN LEU 86 15.589 -6.904 -17.154 466 HA LEU 86 HA LEU 86 14.875 -7.056 -14.519 467 HB2 LEU 86 HB2 LEU 86 16.715 -8.965 -14.545 468 HB3 LEU 86 HB1 LEU 86 15.170 -9.127 -15.353 469 HG LEU 86 HG LEU 86 16.237 -8.506 -17.496 470 HD11 LEU 86 HD11 LEU 86 18.070 -7.136 -16.737 471 HD12 LEU 86 HD12 LEU 86 18.705 -8.514 -17.643 472 HD13 LEU 86 HD13 LEU 86 18.782 -8.508 -15.882 473 HD21 LEU 86 HD21 LEU 86 15.995 -10.848 -16.847 474 HD22 LEU 86 HD22 LEU 86 17.576 -10.796 -16.069 475 HD23 LEU 86 HD23 LEU 86 17.446 -10.589 -17.814 476 H GLY 87 HN GLY 87 15.754 -6.740 -12.582 477 HA2 GLY 87 HA2 GLY 87 18.471 -5.611 -12.459 478 HA3 GLY 87 HA1 GLY 87 17.213 -5.354 -11.257 479 H SER 88 HN SER 88 16.882 -8.458 -12.080 480 HA SER 88 HA SER 88 18.087 -9.354 -9.639 481 HB2 SER 88 HB2 SER 88 17.134 -11.599 -10.452 482 HB3 SER 88 HB1 SER 88 15.986 -10.308 -10.098 483 HG SER 88 HG SER 88 15.313 -10.613 -12.062 484 H ARG 89 HN ARG 89 19.186 -9.029 -12.811 485 HA ARG 89 HA ARG 89 20.947 -11.282 -12.898 486 HB2 ARG 89 HB2 ARG 89 20.214 -10.130 -14.952 487 HB3 ARG 89 HB1 ARG 89 21.054 -8.676 -14.437 488 HG2 ARG 89 HG2 ARG 89 22.351 -9.854 -16.103 489 HG3 ARG 89 HG1 ARG 89 23.189 -9.878 -14.551 490 HD2 ARG 89 HD2 ARG 89 22.396 -12.141 -14.144 491 HD3 ARG 89 HD1 ARG 89 21.507 -12.116 -15.664 492 HE ARG 89 HE ARG 89 24.210 -11.578 -16.193 493 HH11 ARG 89 HH11 ARG 89 22.161 -14.189 -15.092 494 HH12 ARG 89 HH12 ARG 89 23.183 -15.439 -15.723 495 HH21 ARG 89 HH21 ARG 89 25.576 -13.216 -17.031 496 HH22 ARG 89 HH22 ARG 89 25.124 -14.882 -16.845 497 H ARG 90 HN ARG 90 21.414 -7.817 -12.283 498 HA ARG 90 HA ARG 90 23.888 -8.491 -10.838 499 HB2 ARG 90 HB2 ARG 90 22.998 -5.844 -12.007 500 HB3 ARG 90 HB1 ARG 90 24.481 -6.102 -11.101 501 HG2 ARG 90 HG2 ARG 90 25.265 -7.653 -12.810 502 HG3 ARG 90 HG1 ARG 90 23.779 -7.393 -13.725 503 HD2 ARG 90 HD2 ARG 90 24.334 -5.027 -13.950 504 HD3 ARG 90 HD1 ARG 90 25.811 -5.280 -13.025 505 HE ARG 90 HE ARG 90 26.175 -7.010 -14.999 506 HH11 ARG 90 HH11 ARG 90 24.991 -3.722 -15.119 507 HH12 ARG 90 HH12 ARG 90 25.656 -3.403 -16.686 508 HH21 ARG 90 HH21 ARG 90 27.057 -6.595 -17.062 509 HH22 ARG 90 HH22 ARG 90 26.843 -5.037 -17.791 510 H PHE 91 HN PHE 91 22.342 -9.212 -9.175 511 HA PHE 91 HA PHE 91 20.443 -7.625 -7.931 512 HB2 PHE 91 HB2 PHE 91 20.631 -10.047 -7.596 513 HB3 PHE 91 HB1 PHE 91 22.142 -9.819 -6.725 514 HD1 PHE 91 HD1 PHE 91 22.157 -9.304 -4.429 515 HD2 PHE 91 HD2 PHE 91 18.507 -9.173 -6.615 516 HE1 PHE 91 HE1 PHE 91 20.906 -9.096 -2.321 517 HE2 PHE 91 HE2 PHE 91 17.253 -8.966 -4.512 518 HZ PHE 91 HZ PHE 91 18.450 -8.925 -2.362 519 H VAL 92 HN VAL 92 23.820 -8.161 -6.931 520 HA VAL 92 HA VAL 92 23.673 -6.477 -4.665 521 HB VAL 92 HB VAL 92 26.129 -7.282 -6.233 522 HG11 VAL 92 HG11 VAL 92 27.339 -6.878 -4.147 523 HG12 VAL 92 HG12 VAL 92 25.845 -6.332 -3.385 524 HG13 VAL 92 HG13 VAL 92 26.540 -5.413 -4.720 525 HG21 VAL 92 HG21 VAL 92 24.860 -9.235 -5.533 526 HG22 VAL 92 HG22 VAL 92 24.799 -8.623 -3.881 527 HG23 VAL 92 HG23 VAL 92 26.344 -9.093 -4.589 528 H VAL 93 HN VAL 93 24.682 -5.946 -7.991 529 HA VAL 93 HA VAL 93 25.832 -3.390 -7.564 530 HB VAL 93 HB VAL 93 24.769 -4.484 -10.154 531 HG11 VAL 93 HG11 VAL 93 26.422 -3.001 -11.182 532 HG12 VAL 93 HG12 VAL 93 26.870 -2.402 -9.586 533 HG13 VAL 93 HG13 VAL 93 25.251 -2.102 -10.218 534 HG21 VAL 93 HG21 VAL 93 27.510 -4.802 -8.942 535 HG22 VAL 93 HG22 VAL 93 27.039 -5.311 -10.563 536 HG23 VAL 93 HG23 VAL 93 26.312 -6.079 -9.151 537 H ASP 94 HN ASP 94 22.747 -4.334 -9.134 538 HA ASP 94 HA ASP 94 21.902 -1.656 -9.449 539 HB2 ASP 94 HB2 ASP 94 20.142 -4.109 -9.336 540 HB3 ASP 94 HB1 ASP 94 19.657 -2.528 -9.891 541 H ASP 95 HN ASP 95 20.931 -4.133 -7.048 542 HA ASP 95 HA ASP 95 19.080 -2.480 -5.755 543 HB2 ASP 95 HB2 ASP 95 20.438 -5.012 -5.040 544 HB3 ASP 95 HB1 ASP 95 19.715 -4.091 -3.725 545 H ARG 96 HN ARG 96 22.460 -2.208 -5.701 546 HA ARG 96 HA ARG 96 22.638 -0.977 -3.121 547 HB2 ARG 96 HB2 ARG 96 24.638 -1.833 -4.306 548 HB3 ARG 96 HB1 ARG 96 24.419 -0.596 -5.538 549 HG2 ARG 96 HG2 ARG 96 24.740 1.141 -3.833 550 HG3 ARG 96 HG1 ARG 96 25.006 -0.116 -2.625 551 HD2 ARG 96 HD2 ARG 96 26.941 -0.915 -3.900 552 HD3 ARG 96 HD1 ARG 96 26.674 0.357 -5.092 553 HE ARG 96 HE ARG 96 26.898 1.550 -2.571 554 HH11 ARG 96 HH11 ARG 96 28.877 -0.206 -4.857 555 HH12 ARG 96 HH12 ARG 96 30.358 0.547 -4.358 556 HH21 ARG 96 HH21 ARG 96 28.850 2.558 -1.913 557 HH22 ARG 96 HH22 ARG 96 30.343 2.114 -2.684 558 H ARG 97 HN ARG 97 22.748 0.380 -6.402 559 HA ARG 97 HA ARG 97 22.116 3.024 -5.397 560 HB2 ARG 97 HB2 ARG 97 23.725 3.097 -7.066 561 HB3 ARG 97 HB1 ARG 97 22.935 1.860 -8.027 562 HG2 ARG 97 HG2 ARG 97 21.337 4.278 -7.751 563 HG3 ARG 97 HG1 ARG 97 22.902 4.553 -8.521 564 HD2 ARG 97 HD2 ARG 97 20.819 2.528 -9.348 565 HD3 ARG 97 HD1 ARG 97 21.237 4.017 -10.202 566 HE ARG 97 HE ARG 97 23.589 2.608 -9.982 567 HH11 ARG 97 HH11 ARG 97 20.448 2.067 -11.432 568 HH12 ARG 97 HH12 ARG 97 21.069 1.003 -12.659 569 HH21 ARG 97 HH21 ARG 97 24.398 1.210 -11.587 570 HH22 ARG 97 HH22 ARG 97 23.311 0.528 -12.756 571 H GLU 98 HN GLU 98 20.604 0.586 -7.433 572 HA GLU 98 HA GLU 98 18.376 2.063 -8.257 573 HB2 GLU 98 HB2 GLU 98 18.941 -0.883 -8.044 574 HB3 GLU 98 HB1 GLU 98 17.367 -0.282 -8.576 575 HG2 GLU 98 HG2 GLU 98 19.993 0.402 -9.849 576 HG3 GLU 98 HG1 GLU 98 18.879 -0.837 -10.431 577 H LEU 99 HN LEU 99 18.825 -0.112 -5.467 578 HA LEU 99 HA LEU 99 16.100 -0.087 -4.719 579 HB2 LEU 99 HB2 LEU 99 17.753 -1.808 -4.030 580 HB3 LEU 99 HB1 LEU 99 18.503 -0.631 -2.978 581 HG LEU 99 HG LEU 99 16.978 -2.340 -1.890 582 HD11 LEU 99 HD11 LEU 99 17.681 -0.375 -0.693 583 HD12 LEU 99 HD12 LEU 99 15.985 -0.708 -0.342 584 HD13 LEU 99 HD13 LEU 99 16.417 0.585 -1.462 585 HD21 LEU 99 HD21 LEU 99 14.858 -0.629 -3.173 586 HD22 LEU 99 HD22 LEU 99 14.578 -1.839 -1.922 587 HD23 LEU 99 HD23 LEU 99 15.180 -2.331 -3.504 588 H GLN 100 HN GLN 100 18.906 1.714 -3.359 589 HA GLN 100 HA GLN 100 17.382 3.139 -1.475 590 HB2 GLN 100 HB2 GLN 100 19.253 4.744 -1.409 591 HB3 GLN 100 HB1 GLN 100 19.799 3.078 -1.310 592 HG2 GLN 100 HG2 GLN 100 20.451 3.141 -3.650 593 HG3 GLN 100 HG1 GLN 100 19.857 4.797 -3.780 594 HE21 GLN 100 HE21 GLN 100 22.314 2.728 -2.449 595 HE22 GLN 100 HE22 GLN 100 23.434 3.982 -2.039 596 H TYR 101 HN TYR 101 17.939 3.679 -4.866 597 HA TYR 101 HA TYR 101 16.941 6.329 -4.997 598 HB2 TYR 101 HB2 TYR 101 18.350 5.367 -6.762 599 HB3 TYR 101 HB1 TYR 101 17.094 4.194 -7.140 600 HD1 TYR 101 HD1 TYR 101 18.020 7.753 -7.296 601 HD2 TYR 101 HD2 TYR 101 15.207 4.794 -8.491 602 HE1 TYR 101 HE1 TYR 101 17.051 9.332 -8.904 603 HE2 TYR 101 HE2 TYR 101 14.228 6.369 -10.105 604 HH TYR 101 HH TYR 101 15.740 9.326 -10.935 605 H ARG 102 HN ARG 102 15.411 3.143 -5.451 606 HA ARG 102 HA ARG 102 12.955 4.273 -6.325 607 HB2 ARG 102 HB2 ARG 102 12.013 2.032 -6.145 608 HB3 ARG 102 HB1 ARG 102 13.560 2.008 -6.970 609 HG2 ARG 102 HG2 ARG 102 13.707 0.159 -5.622 610 HG3 ARG 102 HG1 ARG 102 14.504 1.383 -4.635 611 HD2 ARG 102 HD2 ARG 102 12.984 0.047 -3.285 612 HD3 ARG 102 HD1 ARG 102 12.426 1.717 -3.379 613 HE ARG 102 HE ARG 102 11.212 0.166 -5.406 614 HH11 ARG 102 HH11 ARG 102 11.127 0.661 -1.934 615 HH12 ARG 102 HH12 ARG 102 9.450 0.239 -1.795 616 HH21 ARG 102 HH21 ARG 102 9.010 -0.422 -5.207 617 HH22 ARG 102 HH22 ARG 102 8.256 -0.386 -3.644 618 H VAL 103 HN VAL 103 14.297 3.795 -3.200 619 HA VAL 103 HA VAL 103 11.839 3.628 -1.763 620 HB VAL 103 HB VAL 103 14.410 4.710 -0.616 621 HG11 VAL 103 HG11 VAL 103 12.167 3.090 0.574 622 HG12 VAL 103 HG12 VAL 103 12.452 4.810 0.833 623 HG13 VAL 103 HG13 VAL 103 13.619 3.616 1.425 624 HG21 VAL 103 HG21 VAL 103 13.675 1.816 -1.016 625 HG22 VAL 103 HG22 VAL 103 15.050 2.412 -0.089 626 HG23 VAL 103 HG23 VAL 103 14.978 2.682 -1.828 627 H GLU 104 HN GLU 104 14.049 6.345 -2.479 628 HA GLU 104 HA GLU 104 12.467 8.277 -1.180 629 HB2 GLU 104 HB2 GLU 104 13.743 9.893 -2.780 630 HB3 GLU 104 HB1 GLU 104 14.594 9.059 -1.491 631 HG2 GLU 104 HG2 GLU 104 15.444 7.444 -3.022 632 HG3 GLU 104 HG1 GLU 104 14.484 8.116 -4.334 633 H VAL 105 HN VAL 105 12.424 7.208 -4.588 634 HA VAL 105 HA VAL 105 10.451 9.088 -5.345 635 HB VAL 105 HB VAL 105 11.218 8.175 -7.269 636 HG11 VAL 105 HG11 VAL 105 12.664 6.522 -6.254 637 HG12 VAL 105 HG12 VAL 105 11.801 5.824 -7.624 638 HG13 VAL 105 HG13 VAL 105 11.282 5.462 -5.979 639 HG21 VAL 105 HG21 VAL 105 8.839 7.903 -7.430 640 HG22 VAL 105 HG22 VAL 105 8.939 6.318 -6.664 641 HG23 VAL 105 HG23 VAL 105 9.644 6.570 -8.259 642 H GLN 106 HN GLN 106 10.186 5.824 -3.966 643 HA GLN 106 HA GLN 106 7.389 5.668 -3.977 644 HB2 GLN 106 HB2 GLN 106 9.453 4.482 -2.129 645 HB3 GLN 106 HB1 GLN 106 7.740 4.138 -1.967 646 HG2 GLN 106 HG2 GLN 106 9.398 3.595 -4.411 647 HG3 GLN 106 HG1 GLN 106 8.933 2.400 -3.203 648 HE21 GLN 106 HE21 GLN 106 7.842 4.403 -5.821 649 HE22 GLN 106 HE22 GLN 106 6.322 3.614 -6.056 650 H ASN 107 HN ASN 107 9.615 7.181 -1.705 651 HA ASN 107 HA ASN 107 7.788 7.878 0.318 652 HB2 ASN 107 HB2 ASN 107 10.257 8.021 0.525 653 HB3 ASN 107 HB1 ASN 107 10.247 9.408 -0.563 654 HD21 ASN 107 HD21 ASN 107 11.151 10.728 1.007 655 HD22 ASN 107 HD22 ASN 107 10.243 11.303 2.365 656 H ARG 108 HN ARG 108 8.572 9.403 -2.750 657 HA ARG 108 HA ARG 108 6.987 11.756 -2.209 658 HB2 ARG 108 HB2 ARG 108 8.369 10.748 -4.694 659 HB3 ARG 108 HB1 ARG 108 7.511 12.274 -4.600 660 HG2 ARG 108 HG2 ARG 108 9.046 13.073 -2.910 661 HG3 ARG 108 HG1 ARG 108 9.873 11.515 -2.899 662 HD2 ARG 108 HD2 ARG 108 10.467 11.848 -5.265 663 HD3 ARG 108 HD1 ARG 108 9.695 13.433 -5.218 664 HE ARG 108 HE ARG 108 11.387 13.863 -3.339 665 HH11 ARG 108 HH11 ARG 108 11.984 11.852 -6.146 666 HH12 ARG 108 HH12 ARG 108 13.697 12.130 -6.137 667 HH21 ARG 108 HH21 ARG 108 13.647 14.226 -3.331 668 HH22 ARG 108 HH22 ARG 108 14.641 13.465 -4.532 669 H VAL 109 HN VAL 109 6.806 8.965 -4.347 670 HA VAL 109 HA VAL 109 4.401 9.468 -5.624 671 HB VAL 109 HB VAL 109 5.639 6.827 -4.844 672 HG11 VAL 109 HG11 VAL 109 3.543 7.265 -6.962 673 HG12 VAL 109 HG12 VAL 109 3.183 6.669 -5.343 674 HG13 VAL 109 HG13 VAL 109 4.223 5.733 -6.416 675 HG21 VAL 109 HG21 VAL 109 6.323 6.837 -7.249 676 HG22 VAL 109 HG22 VAL 109 7.087 8.082 -6.259 677 HG23 VAL 109 HG23 VAL 109 5.751 8.506 -7.337 678 H TYR 110 HN TYR 110 4.941 7.549 -2.672 679 HA TYR 110 HA TYR 110 2.221 6.998 -2.215 680 HB2 TYR 110 HB2 TYR 110 4.586 7.061 -0.348 681 HB3 TYR 110 HB1 TYR 110 2.975 6.605 0.184 682 HD1 TYR 110 HD1 TYR 110 5.600 4.957 0.184 683 HD2 TYR 110 HD2 TYR 110 2.278 5.117 -2.471 684 HE1 TYR 110 HE1 TYR 110 6.025 2.630 -0.483 685 HE2 TYR 110 HE2 TYR 110 2.699 2.793 -3.144 686 HH TYR 110 HH TYR 110 4.647 1.206 -3.186 687 H LYS 111 HN LYS 111 4.210 9.748 -1.347 688 HA LYS 111 HA LYS 111 2.398 10.898 0.498 689 HB2 LYS 111 HB2 LYS 111 4.800 11.508 0.324 690 HB3 LYS 111 HB1 LYS 111 4.463 12.287 -1.214 691 HG2 LYS 111 HG2 LYS 111 3.027 13.899 -0.126 692 HG3 LYS 111 HG1 LYS 111 3.248 13.080 1.423 693 HD2 LYS 111 HD2 LYS 111 5.659 13.562 1.309 694 HD3 LYS 111 HD1 LYS 111 5.401 14.426 -0.207 695 HE2 LYS 111 HE2 LYS 111 5.554 15.958 1.699 696 HE3 LYS 111 HE1 LYS 111 3.973 16.031 0.926 697 HZ1 LYS 111 HZ1 LYS 111 4.582 14.483 3.386 698 HZ2 LYS 111 HZ2 LYS 111 3.061 14.674 2.668 699 HZ3 LYS 111 HZ3 LYS 111 3.840 16.003 3.356 700 H LYS 112 HN LYS 112 2.784 11.131 -2.985 701 HA LYS 112 HA LYS 112 0.931 13.252 -3.359 702 HB2 LYS 112 HB2 LYS 112 1.545 13.119 -5.531 703 HB3 LYS 112 HB1 LYS 112 2.832 12.131 -4.859 704 HG2 LYS 112 HG2 LYS 112 1.339 10.161 -5.244 705 HG3 LYS 112 HG1 LYS 112 0.367 11.243 -6.236 706 HD2 LYS 112 HD2 LYS 112 2.109 11.592 -7.769 707 HD3 LYS 112 HD1 LYS 112 3.325 10.976 -6.642 708 HE2 LYS 112 HE2 LYS 112 2.886 9.368 -8.416 709 HE3 LYS 112 HE1 LYS 112 2.397 8.755 -6.838 710 HZ1 LYS 112 HZ1 LYS 112 0.134 9.135 -7.336 711 HZ2 LYS 112 HZ2 LYS 112 0.796 8.332 -8.673 712 HZ3 LYS 112 HZ3 LYS 112 0.511 9.996 -8.749 713 H GLU 113 HN GLU 113 0.729 9.798 -3.188 714 HA GLU 113 HA GLU 113 -1.905 9.417 -4.076 715 HB2 GLU 113 HB2 GLU 113 -0.462 7.899 -1.903 716 HB3 GLU 113 HB1 GLU 113 -1.896 7.359 -2.764 717 HG2 GLU 113 HG2 GLU 113 0.845 7.791 -3.919 718 HG3 GLU 113 HG1 GLU 113 0.027 6.260 -3.645 719 H ILE 114 HN ILE 114 -0.618 10.134 -0.851 720 HA ILE 114 HA ILE 114 -3.028 10.062 0.557 721 HB ILE 114 HB ILE 114 -0.541 11.682 1.084 722 HG12 ILE 114 HG12 ILE 114 -1.469 8.995 2.112 723 HG13 ILE 114 HG11 ILE 114 -0.209 9.254 0.914 724 HG21 ILE 114 HG21 ILE 114 -1.303 11.812 3.401 725 HG22 ILE 114 HG22 ILE 114 -2.796 10.982 2.966 726 HG23 ILE 114 HG23 ILE 114 -2.459 12.589 2.311 727 HD11 ILE 114 HD11 ILE 114 1.177 10.339 2.532 728 HD12 ILE 114 HD12 ILE 114 0.664 8.766 3.146 729 HD13 ILE 114 HD13 ILE 114 -0.098 10.239 3.746 730 H GLN 115 HN GLN 115 -1.571 12.608 -1.361 731 HA GLN 115 HA GLN 115 -3.334 14.674 -0.513 732 HB2 GLN 115 HB2 GLN 115 -1.864 14.491 -3.137 733 HB3 GLN 115 HB1 GLN 115 -2.429 15.947 -2.326 734 HG2 GLN 115 HG2 GLN 115 -0.869 15.414 -0.454 735 HG3 GLN 115 HG1 GLN 115 -0.227 14.110 -1.456 736 HE21 GLN 115 HE21 GLN 115 -0.511 17.549 -1.080 737 HE22 GLN 115 HE22 GLN 115 0.727 17.976 -2.210 738 H ALA 116 HN ALA 116 -3.277 12.420 -3.226 739 HA ALA 116 HA ALA 116 -5.670 13.219 -4.472 740 HB1 ALA 116 HB1 ALA 116 -4.085 11.640 -5.490 741 HB2 ALA 116 HB2 ALA 116 -5.715 10.968 -5.428 742 HB3 ALA 116 HB3 ALA 116 -4.498 10.441 -4.263 743 H LEU 117 HN LEU 117 -4.996 10.821 -1.991 744 HA LEU 117 HA LEU 117 -7.587 9.949 -1.442 745 HB2 LEU 117 HB2 LEU 117 -4.987 9.987 -0.027 746 HB3 LEU 117 HB1 LEU 117 -6.405 9.747 0.969 747 HG LEU 117 HG LEU 117 -6.886 7.674 0.018 748 HD11 LEU 117 HD11 LEU 117 -6.804 8.300 -2.333 749 HD12 LEU 117 HD12 LEU 117 -5.884 6.823 -2.041 750 HD13 LEU 117 HD13 LEU 117 -5.042 8.358 -2.267 751 HD21 LEU 117 HD21 LEU 117 -4.836 7.685 1.374 752 HD22 LEU 117 HD22 LEU 117 -3.887 7.890 -0.101 753 HD23 LEU 117 HD23 LEU 117 -4.831 6.422 0.144 754 H ASP 118 HN ASP 118 -5.878 12.819 -0.410 755 HA ASP 118 HA ASP 118 -7.437 13.477 1.823 756 HB2 ASP 118 HB2 ASP 118 -5.293 14.531 1.423 757 HB3 ASP 118 HB1 ASP 118 -5.897 15.273 -0.059 758 H ALA 119 HN ALA 119 -7.926 14.133 -1.608 759 HA ALA 119 HA ALA 119 -10.201 15.810 -1.286 760 HB1 ALA 119 HB1 ALA 119 -9.478 14.010 -3.598 761 HB2 ALA 119 HB2 ALA 119 -8.955 15.682 -3.393 762 HB3 ALA 119 HB3 ALA 119 -10.664 15.314 -3.632 763 H GLU 120 HN GLU 120 -9.748 12.340 -1.657 764 HA GLU 120 HA GLU 120 -12.468 11.617 -1.568 765 HB2 GLU 120 HB2 GLU 120 -9.858 10.245 -1.248 766 HB3 GLU 120 HB1 GLU 120 -11.271 9.448 -0.615 767 HG2 GLU 120 HG2 GLU 120 -10.606 8.781 -2.919 768 HG3 GLU 120 HG1 GLU 120 -12.277 9.288 -2.723 769 H ILE 121 HN ILE 121 -10.094 12.333 0.923 770 HA ILE 121 HA ILE 121 -11.398 11.352 3.163 771 HB ILE 121 HB ILE 121 -9.405 13.437 2.660 772 HG12 ILE 121 HG12 ILE 121 -8.408 12.442 4.710 773 HG13 ILE 121 HG11 ILE 121 -9.848 11.443 4.888 774 HG21 ILE 121 HG21 ILE 121 -10.958 14.882 3.795 775 HG22 ILE 121 HG22 ILE 121 -9.608 14.513 4.868 776 HG23 ILE 121 HG23 ILE 121 -11.160 13.707 5.094 777 HD11 ILE 121 HD11 ILE 121 -7.982 10.229 3.886 778 HD12 ILE 121 HD12 ILE 121 -7.961 11.374 2.546 779 HD13 ILE 121 HD13 ILE 121 -9.362 10.332 2.795 780 H ARG 122 HN ARG 122 -12.050 14.225 1.263 781 HA ARG 122 HA ARG 122 -13.938 15.429 2.954 782 HB2 ARG 122 HB2 ARG 122 -12.910 16.535 1.003 783 HB3 ARG 122 HB1 ARG 122 -13.812 15.475 -0.065 784 HG2 ARG 122 HG2 ARG 122 -15.903 16.427 0.728 785 HG3 ARG 122 HG1 ARG 122 -15.012 17.467 1.842 786 HD2 ARG 122 HD2 ARG 122 -13.895 18.540 -0.040 787 HD3 ARG 122 HD1 ARG 122 -14.756 17.487 -1.160 788 HE ARG 122 HE ARG 122 -16.502 18.994 0.547 789 HH11 ARG 122 HH11 ARG 122 -14.654 19.043 -2.422 790 HH12 ARG 122 HH12 ARG 122 -15.621 20.279 -3.158 791 HH21 ARG 122 HH21 ARG 122 -17.779 20.629 -0.407 792 HH22 ARG 122 HH22 ARG 122 -17.407 21.186 -2.008 793 H LYS 123 HN LYS 123 -14.295 12.961 0.413 794 HA LYS 123 HA LYS 123 -17.144 12.803 0.659 795 HB2 LYS 123 HB2 LYS 123 -17.058 11.064 -0.882 796 HB3 LYS 123 HB1 LYS 123 -15.613 11.985 -1.268 797 HG2 LYS 123 HG2 LYS 123 -14.366 10.347 0.233 798 HG3 LYS 123 HG1 LYS 123 -15.819 9.377 0.170 799 HD2 LYS 123 HD2 LYS 123 -13.750 9.201 -1.558 800 HD3 LYS 123 HD1 LYS 123 -15.394 8.665 -1.891 801 HE2 LYS 123 HE2 LYS 123 -15.901 10.854 -2.813 802 HE3 LYS 123 HE1 LYS 123 -14.240 11.358 -2.517 803 HZ1 LYS 123 HZ1 LYS 123 -13.438 10.037 -4.198 804 HZ2 LYS 123 HZ2 LYS 123 -14.905 10.567 -4.855 805 HZ3 LYS 123 HZ3 LYS 123 -14.786 9.013 -4.207 806 H LEU 124 HN LEU 124 -14.439 11.253 2.212 807 HA LEU 124 HA LEU 124 -15.914 9.333 3.666 808 HB2 LEU 124 HB2 LEU 124 -13.266 10.662 4.198 809 HB3 LEU 124 HB1 LEU 124 -13.924 9.401 5.221 810 HG LEU 124 HG LEU 124 -13.180 9.108 2.302 811 HD11 LEU 124 HD11 LEU 124 -11.519 7.490 3.309 812 HD12 LEU 124 HD12 LEU 124 -11.904 8.197 4.875 813 HD13 LEU 124 HD13 LEU 124 -11.202 9.196 3.603 814 HD21 LEU 124 HD21 LEU 124 -15.076 7.731 2.773 815 HD22 LEU 124 HD22 LEU 124 -14.345 7.149 4.266 816 HD23 LEU 124 HD23 LEU 124 -13.640 6.709 2.709 817 H GLU 125 HN GLU 125 -15.130 12.717 4.248 818 HA GLU 125 HA GLU 125 -15.971 12.805 6.933 819 HB2 GLU 125 HB2 GLU 125 -15.950 15.017 4.884 820 HB3 GLU 125 HB1 GLU 125 -16.170 15.238 6.614 821 HG2 GLU 125 HG2 GLU 125 -13.925 14.279 6.981 822 HG3 GLU 125 HG1 GLU 125 -13.714 14.185 5.237 823 H ARG 126 HN ARG 126 -17.756 13.318 3.894 824 HA ARG 126 HA ARG 126 -20.157 14.078 5.188 825 HB2 ARG 126 HB2 ARG 126 -21.275 13.781 3.095 826 HB3 ARG 126 HB1 ARG 126 -19.697 14.473 2.764 827 HG2 ARG 126 HG2 ARG 126 -18.887 12.224 2.145 828 HG3 ARG 126 HG1 ARG 126 -20.522 11.605 2.381 829 HD2 ARG 126 HD2 ARG 126 -21.339 13.167 0.668 830 HD3 ARG 126 HD1 ARG 126 -19.693 13.744 0.425 831 HE ARG 126 HE ARG 126 -20.378 10.920 -0.027 832 HH11 ARG 126 HH11 ARG 126 -19.135 13.975 -1.200 833 HH12 ARG 126 HH12 ARG 126 -18.605 13.324 -2.718 834 HH21 ARG 126 HH21 ARG 126 -19.669 10.051 -2.017 835 HH22 ARG 126 HH22 ARG 126 -18.894 11.087 -3.179 836 H LEU 127 HN LEU 127 -18.785 10.963 4.296 837 HA LEU 127 HA LEU 127 -20.888 9.309 5.142 838 HB2 LEU 127 HB2 LEU 127 -19.029 8.344 4.010 839 HB3 LEU 127 HB1 LEU 127 -17.891 8.990 5.171 840 HG LEU 127 HG LEU 127 -19.008 7.445 6.878 841 HD11 LEU 127 HD11 LEU 127 -21.009 6.923 5.636 842 HD12 LEU 127 HD12 LEU 127 -20.083 5.454 5.929 843 HD13 LEU 127 HD13 LEU 127 -20.054 6.214 4.338 844 HD21 LEU 127 HD21 LEU 127 -16.781 7.064 5.975 845 HD22 LEU 127 HD22 LEU 127 -17.477 6.256 4.571 846 HD23 LEU 127 HD23 LEU 127 -17.650 5.542 6.173 847 H LEU 128 HN LEU 128 -18.033 10.385 6.921 848 HA LEU 128 HA LEU 128 -18.579 9.446 9.437 849 HB2 LEU 128 HB2 LEU 128 -17.285 12.072 8.707 850 HB3 LEU 128 HB1 LEU 128 -17.124 11.259 10.250 851 HG LEU 128 HG LEU 128 -16.142 10.208 7.600 852 HD11 LEU 128 HD11 LEU 128 -14.792 12.067 8.329 853 HD12 LEU 128 HD12 LEU 128 -13.902 10.565 8.579 854 HD13 LEU 128 HD13 LEU 128 -14.659 11.377 9.949 855 HD21 LEU 128 HD21 LEU 128 -15.877 9.085 10.380 856 HD22 LEU 128 HD22 LEU 128 -15.050 8.471 8.947 857 HD23 LEU 128 HD23 LEU 128 -16.809 8.403 9.049 858 H GLU 129 HN GLU 129 -19.235 12.769 8.366 859 HA GLU 129 HA GLU 129 -20.461 13.530 10.782 860 HB2 GLU 129 HB2 GLU 129 -20.477 14.803 8.052 861 HB3 GLU 129 HB1 GLU 129 -21.052 15.588 9.520 862 HG2 GLU 129 HG2 GLU 129 -18.862 15.466 10.491 863 HG3 GLU 129 HG1 GLU 129 -18.261 14.546 9.120 864 H SER 130 HN SER 130 -21.822 12.387 7.730 865 HA SER 130 HA SER 130 -24.511 13.068 8.521 866 HB2 SER 130 HB2 SER 130 -23.872 13.061 6.143 867 HB3 SER 130 HB1 SER 130 -23.546 11.333 6.234 868 HG SER 130 HG SER 130 -25.878 12.592 5.817 869 H GLY 131 HN GLY 131 -22.376 10.534 9.158 870 HA2 GLY 131 HA2 GLY 131 -22.608 8.589 10.349 871 HA3 GLY 131 HA1 GLY 131 -24.228 9.125 10.769 872 H LEU 132 HN LEU 132 -23.175 8.746 7.471 873 HA LEU 132 HA LEU 132 -25.406 7.267 6.700 874 HB2 LEU 132 HB2 LEU 132 -24.153 8.539 5.113 875 HB3 LEU 132 HB1 LEU 132 -22.696 7.626 5.438 876 HG LEU 132 HG LEU 132 -23.871 5.608 4.484 877 HD11 LEU 132 HD11 LEU 132 -26.167 6.393 4.699 878 HD12 LEU 132 HD12 LEU 132 -25.782 6.025 3.018 879 HD13 LEU 132 HD13 LEU 132 -25.837 7.701 3.562 880 HD21 LEU 132 HD21 LEU 132 -23.453 6.298 2.182 881 HD22 LEU 132 HD22 LEU 132 -22.195 6.885 3.272 882 HD23 LEU 132 HD23 LEU 132 -23.442 7.989 2.691 883 H THR 133 HN THR 133 -22.149 6.215 7.567 884 HA THR 133 HA THR 133 -21.365 4.245 8.377 885 HB THR 133 HB THR 133 -24.193 3.188 8.352 886 HG1 THR 133 HG1 THR 133 -23.740 5.287 9.535 887 HG21 THR 133 HG21 THR 133 -21.778 2.493 10.034 888 HG22 THR 133 HG22 THR 133 -22.450 1.514 8.730 889 HG23 THR 133 HG23 THR 133 -23.386 1.785 10.200 Start of MODEL 2 1 H1 MET 1 HT1 MET 1 26.264 -1.852 9.528 2 H2 MET 1 HT2 MET 1 24.599 -1.809 9.791 3 H3 MET 1 HT3 MET 1 25.223 -1.373 8.279 4 HA MET 1 HA MET 1 25.335 -4.062 9.512 5 HB2 MET 1 HB2 MET 1 23.652 -2.899 7.305 6 HB3 MET 1 HB1 MET 1 23.902 -4.629 7.475 7 HG2 MET 1 HG2 MET 1 21.808 -3.997 8.468 8 HG3 MET 1 HG1 MET 1 22.925 -4.536 9.719 9 HE1 MET 1 HE1 MET 1 20.228 -2.943 10.271 10 HE2 MET 1 HE2 MET 1 20.758 -1.801 11.504 11 HE3 MET 1 HE3 MET 1 21.316 -3.472 11.554 12 H ASP 2 HN ASP 2 26.419 -1.911 6.951 13 HA ASP 2 HA ASP 2 27.885 -4.164 5.752 14 HB2 ASP 2 HB2 ASP 2 26.351 -2.828 4.280 15 HB3 ASP 2 HB1 ASP 2 27.402 -1.440 4.543 16 H SER 3 HN SER 3 30.066 -3.820 5.050 17 HA SER 3 HA SER 3 31.591 -2.500 7.108 18 HB2 SER 3 HB2 SER 3 32.185 -4.767 6.359 19 HB3 SER 3 HB1 SER 3 32.491 -4.153 4.736 20 HG SER 3 HG SER 3 33.851 -2.818 6.718 21 H ALA 4 HN ALA 4 30.832 -1.960 3.732 22 HA ALA 4 HA ALA 4 32.835 0.190 3.615 23 HB1 ALA 4 HB1 ALA 4 31.197 -0.979 1.371 24 HB2 ALA 4 HB2 ALA 4 32.843 -1.457 1.781 25 HB3 ALA 4 HB3 ALA 4 32.516 0.181 1.218 26 H ILE 5 HN ILE 5 29.414 -0.458 2.948 27 HA ILE 5 HA ILE 5 28.711 2.260 2.501 28 HB ILE 5 HB ILE 5 26.894 0.036 3.453 29 HG12 ILE 5 HG12 ILE 5 27.505 0.875 0.610 30 HG13 ILE 5 HG11 ILE 5 28.185 -0.550 1.388 31 HG21 ILE 5 HG21 ILE 5 25.119 1.336 2.442 32 HG22 ILE 5 HG22 ILE 5 26.282 2.547 1.906 33 HG23 ILE 5 HG23 ILE 5 25.981 2.317 3.628 34 HD11 ILE 5 HD11 ILE 5 25.258 -0.057 0.888 35 HD12 ILE 5 HD12 ILE 5 25.961 -1.498 1.623 36 HD13 ILE 5 HD13 ILE 5 26.308 -1.109 -0.062 37 H SER 6 HN SER 6 28.859 3.803 3.983 38 HA SER 6 HA SER 6 28.985 3.065 6.790 39 HB2 SER 6 HB2 SER 6 29.412 5.768 5.494 40 HB3 SER 6 HB1 SER 6 29.877 5.293 7.127 41 HG SER 6 HG SER 6 30.869 3.609 5.221 42 H LYS 7 HN LYS 7 27.960 4.998 8.250 43 HA LYS 7 HA LYS 7 25.183 4.682 8.018 44 HB2 LYS 7 HB2 LYS 7 26.842 6.601 9.642 45 HB3 LYS 7 HB1 LYS 7 25.092 6.525 9.754 46 HG2 LYS 7 HG2 LYS 7 25.381 4.057 10.279 47 HG3 LYS 7 HG1 LYS 7 27.094 4.419 10.496 48 HD2 LYS 7 HD2 LYS 7 26.539 6.055 12.220 49 HD3 LYS 7 HD1 LYS 7 24.822 5.736 11.983 50 HE2 LYS 7 HE2 LYS 7 25.584 4.540 13.927 51 HE3 LYS 7 HE1 LYS 7 25.204 3.387 12.652 52 HZ1 LYS 7 HZ1 LYS 7 27.271 2.845 13.792 53 HZ2 LYS 7 HZ2 LYS 7 27.934 4.336 13.341 54 HZ3 LYS 7 HZ3 LYS 7 27.546 3.188 12.159 55 H GLU 8 HN GLU 8 27.305 6.831 6.458 56 HA GLU 8 HA GLU 8 25.714 8.986 5.791 57 HB2 GLU 8 HB2 GLU 8 27.780 7.457 4.213 58 HB3 GLU 8 HB1 GLU 8 27.011 8.915 3.593 59 HG2 GLU 8 HG2 GLU 8 28.639 8.712 6.116 60 HG3 GLU 8 HG1 GLU 8 29.168 9.414 4.587 61 H ASP 9 HN ASP 9 26.153 6.114 3.719 62 HA ASP 9 HA ASP 9 23.750 6.723 2.253 63 HB2 ASP 9 HB2 ASP 9 25.725 5.754 1.134 64 HB3 ASP 9 HB1 ASP 9 25.570 4.312 2.124 65 H GLU 10 HN GLU 10 24.788 4.335 4.607 66 HA GLU 10 HA GLU 10 22.632 2.564 4.324 67 HB2 GLU 10 HB2 GLU 10 24.724 1.910 5.348 68 HB3 GLU 10 HB1 GLU 10 24.483 3.059 6.654 69 HG2 GLU 10 HG2 GLU 10 22.631 1.803 7.496 70 HG3 GLU 10 HG1 GLU 10 22.690 0.712 6.109 71 H GLU 11 HN GLU 11 23.202 4.818 7.051 72 HA GLU 11 HA GLU 11 20.666 4.505 8.138 73 HB2 GLU 11 HB2 GLU 11 22.686 6.709 8.390 74 HB3 GLU 11 HB1 GLU 11 21.173 6.707 9.285 75 HG2 GLU 11 HG2 GLU 11 23.157 4.459 9.390 76 HG3 GLU 11 HG1 GLU 11 23.160 5.815 10.510 77 H ARG 12 HN ARG 12 21.795 6.616 5.571 78 HA ARG 12 HA ARG 12 19.515 8.290 5.484 79 HB2 ARG 12 HB2 ARG 12 21.863 8.327 4.182 80 HB3 ARG 12 HB1 ARG 12 20.878 7.575 2.937 81 HG2 ARG 12 HG2 ARG 12 20.177 10.180 4.270 82 HG3 ARG 12 HG1 ARG 12 21.094 10.057 2.770 83 HD2 ARG 12 HD2 ARG 12 18.335 8.911 3.163 84 HD3 ARG 12 HD1 ARG 12 18.655 10.499 2.467 85 HE ARG 12 HE ARG 12 20.111 8.471 1.112 86 HH11 ARG 12 HH11 ARG 12 16.899 9.835 1.418 87 HH12 ARG 12 HH12 ARG 12 16.433 9.410 -0.198 88 HH21 ARG 12 HH21 ARG 12 19.502 7.900 -0.995 89 HH22 ARG 12 HH22 ARG 12 17.912 8.308 -1.584 90 H TYR 13 HN TYR 13 20.317 5.207 3.917 91 HA TYR 13 HA TYR 13 17.864 4.889 2.557 92 HB2 TYR 13 HB2 TYR 13 19.582 3.451 1.846 93 HB3 TYR 13 HB1 TYR 13 19.995 2.975 3.488 94 HD1 TYR 13 HD1 TYR 13 19.476 0.811 4.022 95 HD2 TYR 13 HD2 TYR 13 16.976 2.887 1.281 96 HE1 TYR 13 HE1 TYR 13 18.060 -1.188 3.813 97 HE2 TYR 13 HE2 TYR 13 15.547 0.902 1.067 98 HH TYR 13 HH TYR 13 15.810 -1.785 3.185 99 H GLN 14 HN GLN 14 18.978 3.842 5.745 100 HA GLN 14 HA GLN 14 16.747 2.431 6.586 101 HB2 GLN 14 HB2 GLN 14 18.619 4.183 8.175 102 HB3 GLN 14 HB1 GLN 14 17.445 3.098 8.900 103 HG2 GLN 14 HG2 GLN 14 19.474 2.087 6.952 104 HG3 GLN 14 HG1 GLN 14 19.883 2.330 8.645 105 HE21 GLN 14 HE21 GLN 14 16.669 1.336 7.751 106 HE22 GLN 14 HE22 GLN 14 16.804 -0.293 8.297 107 H LYS 15 HN LYS 15 17.415 5.871 7.215 108 HA LYS 15 HA LYS 15 14.911 6.491 8.253 109 HB2 LYS 15 HB2 LYS 15 16.821 8.256 6.724 110 HB3 LYS 15 HB1 LYS 15 15.418 8.842 7.605 111 HG2 LYS 15 HG2 LYS 15 17.743 7.375 8.828 112 HG3 LYS 15 HG1 LYS 15 17.506 9.120 8.861 113 HD2 LYS 15 HD2 LYS 15 15.641 7.070 10.055 114 HD3 LYS 15 HD1 LYS 15 16.804 8.042 10.956 115 HE2 LYS 15 HE2 LYS 15 15.648 10.080 10.211 116 HE3 LYS 15 HE1 LYS 15 14.472 9.085 9.356 117 HZ1 LYS 15 HZ1 LYS 15 13.834 8.102 11.477 118 HZ2 LYS 15 HZ2 LYS 15 13.616 9.777 11.494 119 HZ3 LYS 15 HZ3 LYS 15 14.940 9.089 12.286 120 H LEU 16 HN LEU 16 15.988 6.208 4.940 121 HA LEU 16 HA LEU 16 13.789 7.440 3.691 122 HB2 LEU 16 HB2 LEU 16 16.020 6.785 2.665 123 HB3 LEU 16 HB1 LEU 16 15.382 5.153 2.556 124 HG LEU 16 HG LEU 16 13.666 5.852 1.017 125 HD11 LEU 16 HD11 LEU 16 13.625 8.229 0.230 126 HD12 LEU 16 HD12 LEU 16 14.688 8.634 1.574 127 HD13 LEU 16 HD13 LEU 16 13.069 8.001 1.886 128 HD21 LEU 16 HD21 LEU 16 16.314 7.075 0.265 129 HD22 LEU 16 HD22 LEU 16 15.048 6.539 -0.842 130 HD23 LEU 16 HD23 LEU 16 15.910 5.363 0.151 131 H VAL 17 HN VAL 17 14.431 4.021 4.471 132 HA VAL 17 HA VAL 17 11.963 3.047 3.518 133 HB VAL 17 HB VAL 17 12.418 1.021 4.519 134 HG11 VAL 17 HG11 VAL 17 14.250 1.617 3.070 135 HG12 VAL 17 HG12 VAL 17 14.833 0.642 4.422 136 HG13 VAL 17 HG13 VAL 17 15.086 2.389 4.419 137 HG21 VAL 17 HG21 VAL 17 12.321 1.756 6.851 138 HG22 VAL 17 HG22 VAL 17 13.953 2.409 6.718 139 HG23 VAL 17 HG23 VAL 17 13.687 0.670 6.581 140 H THR 18 HN THR 18 12.957 4.487 6.540 141 HA THR 18 HA THR 18 10.678 3.989 8.047 142 HB THR 18 HB THR 18 12.880 5.996 8.086 143 HG1 THR 18 HG1 THR 18 13.547 4.497 9.404 144 HG21 THR 18 HG21 THR 18 11.881 6.957 10.164 145 HG22 THR 18 HG22 THR 18 10.360 6.188 9.698 146 HG23 THR 18 HG23 THR 18 11.094 7.404 8.654 147 H GLU 19 HN GLU 19 11.524 6.774 5.980 148 HA GLU 19 HA GLU 19 9.119 8.177 6.202 149 HB2 GLU 19 HB2 GLU 19 10.961 7.959 3.801 150 HB3 GLU 19 HB1 GLU 19 9.714 9.184 4.016 151 HG2 GLU 19 HG2 GLU 19 10.896 9.910 6.095 152 HG3 GLU 19 HG1 GLU 19 12.194 8.789 5.681 153 H ASN 20 HN ASN 20 10.073 5.560 4.098 154 HA ASN 20 HA ASN 20 7.840 5.614 2.368 155 HB2 ASN 20 HB2 ASN 20 10.165 4.605 2.032 156 HB3 ASN 20 HB1 ASN 20 9.586 3.234 2.965 157 HD21 ASN 20 HD21 ASN 20 10.005 1.946 1.158 158 HD22 ASN 20 HD22 ASN 20 8.934 1.913 -0.196 159 H GLU 21 HN GLU 21 8.572 3.706 5.288 160 HA GLU 21 HA GLU 21 6.318 2.021 5.146 161 HB2 GLU 21 HB2 GLU 21 7.895 2.909 7.557 162 HB3 GLU 21 HB1 GLU 21 6.815 1.521 7.489 163 HG2 GLU 21 HG2 GLU 21 9.061 1.745 5.563 164 HG3 GLU 21 HG1 GLU 21 9.375 1.212 7.206 165 H GLN 22 HN GLN 22 6.814 5.167 6.669 166 HA GLN 22 HA GLN 22 4.598 5.236 8.358 167 HB2 GLN 22 HB2 GLN 22 5.568 7.643 6.821 168 HB3 GLN 22 HB1 GLN 22 4.785 7.612 8.392 169 HG2 GLN 22 HG2 GLN 22 6.746 6.608 9.396 170 HG3 GLN 22 HG1 GLN 22 7.531 6.529 7.820 171 HE21 GLN 22 HE21 GLN 22 9.233 7.818 8.410 172 HE22 GLN 22 HE22 GLN 22 9.075 9.516 8.695 173 H LEU 23 HN LEU 23 4.843 6.636 5.096 174 HA LEU 23 HA LEU 23 2.101 7.444 5.292 175 HB2 LEU 23 HB2 LEU 23 2.468 8.839 3.485 176 HB3 LEU 23 HB1 LEU 23 3.979 8.838 4.353 177 HG LEU 23 HG LEU 23 3.375 7.478 1.757 178 HD11 LEU 23 HD11 LEU 23 5.295 9.651 2.530 179 HD12 LEU 23 HD12 LEU 23 3.787 9.860 1.639 180 HD13 LEU 23 HD13 LEU 23 5.120 8.956 0.919 181 HD21 LEU 23 HD21 LEU 23 5.888 7.319 3.400 182 HD22 LEU 23 HD22 LEU 23 5.721 6.762 1.736 183 HD23 LEU 23 HD23 LEU 23 4.796 5.986 3.022 184 H GLN 24 HN GLN 24 3.729 4.757 3.854 185 HA GLN 24 HA GLN 24 1.686 4.143 1.978 186 HB2 GLN 24 HB2 GLN 24 2.610 1.911 1.877 187 HB3 GLN 24 HB1 GLN 24 3.919 3.081 1.886 188 HG2 GLN 24 HG2 GLN 24 4.331 2.635 4.231 189 HG3 GLN 24 HG1 GLN 24 2.978 1.504 4.267 190 HE21 GLN 24 HE21 GLN 24 6.199 2.081 3.105 191 HE22 GLN 24 HE22 GLN 24 6.562 0.438 2.705 192 H ARG 25 HN ARG 25 2.105 3.668 5.383 193 HA ARG 25 HA ARG 25 -0.108 1.948 5.813 194 HB2 ARG 25 HB2 ARG 25 1.301 1.912 7.620 195 HB3 ARG 25 HB1 ARG 25 1.755 3.601 7.428 196 HG2 ARG 25 HG2 ARG 25 -0.684 4.045 8.158 197 HG3 ARG 25 HG1 ARG 25 -0.583 2.417 8.839 198 HD2 ARG 25 HD2 ARG 25 1.179 4.793 9.460 199 HD3 ARG 25 HD1 ARG 25 0.028 4.000 10.542 200 HE ARG 25 HE ARG 25 2.079 2.233 9.571 201 HH11 ARG 25 HH11 ARG 25 1.250 4.587 12.019 202 HH12 ARG 25 HH12 ARG 25 2.398 3.986 13.172 203 HH21 ARG 25 HH21 ARG 25 3.597 1.433 11.088 204 HH22 ARG 25 HH22 ARG 25 3.737 2.194 12.640 205 H LEU 26 HN LEU 26 0.455 5.419 5.893 206 HA LEU 26 HA LEU 26 -2.093 6.231 6.738 207 HB2 LEU 26 HB2 LEU 26 -0.085 7.664 4.992 208 HB3 LEU 26 HB1 LEU 26 -1.444 8.430 5.807 209 HG LEU 26 HG LEU 26 0.803 6.990 7.230 210 HD11 LEU 26 HD11 LEU 26 0.367 9.958 7.023 211 HD12 LEU 26 HD12 LEU 26 1.558 9.056 6.088 212 HD13 LEU 26 HD13 LEU 26 1.681 9.115 7.845 213 HD21 LEU 26 HD21 LEU 26 -1.445 8.712 8.257 214 HD22 LEU 26 HD22 LEU 26 -0.115 8.082 9.228 215 HD23 LEU 26 HD23 LEU 26 -1.264 6.972 8.482 216 H ILE 27 HN ILE 27 -0.738 5.690 3.519 217 HA ILE 27 HA ILE 27 -2.995 6.198 1.968 218 HB ILE 27 HB ILE 27 -0.884 4.063 1.649 219 HG12 ILE 27 HG12 ILE 27 -1.186 6.737 0.280 220 HG13 ILE 27 HG11 ILE 27 -0.114 6.428 1.654 221 HG21 ILE 27 HG21 ILE 27 -2.852 5.047 -0.408 222 HG22 ILE 27 HG22 ILE 27 -2.909 3.481 0.393 223 HG23 ILE 27 HG23 ILE 27 -1.562 3.877 -0.674 224 HD11 ILE 27 HD11 ILE 27 1.126 6.370 -0.407 225 HD12 ILE 27 HD12 ILE 27 0.035 5.150 -1.064 226 HD13 ILE 27 HD13 ILE 27 1.070 4.759 0.306 227 H THR 28 HN THR 28 -1.935 3.183 3.497 228 HA THR 28 HA THR 28 -3.976 1.497 2.800 229 HB THR 28 HB THR 28 -1.868 1.609 4.779 230 HG1 THR 28 HG1 THR 28 -2.947 -0.129 2.955 231 HG21 THR 28 HG21 THR 28 -4.413 0.231 5.596 232 HG22 THR 28 HG22 THR 28 -3.495 1.457 6.479 233 HG23 THR 28 HG23 THR 28 -2.827 -0.161 6.268 234 H GLN 29 HN GLN 29 -3.861 3.724 5.573 235 HA GLN 29 HA GLN 29 -6.243 2.950 6.818 236 HB2 GLN 29 HB2 GLN 29 -5.007 5.708 6.724 237 HB3 GLN 29 HB1 GLN 29 -6.179 5.144 7.905 238 HG2 GLN 29 HG2 GLN 29 -3.642 3.640 7.612 239 HG3 GLN 29 HG1 GLN 29 -3.603 5.207 8.411 240 HE21 GLN 29 HE21 GLN 29 -6.387 3.108 8.594 241 HE22 GLN 29 HE22 GLN 29 -6.202 2.696 10.259 242 H LYS 30 HN LYS 30 -5.669 5.655 4.600 243 HA LYS 30 HA LYS 30 -8.390 6.415 4.421 244 HB2 LYS 30 HB2 LYS 30 -5.943 7.057 2.809 245 HB3 LYS 30 HB1 LYS 30 -7.526 7.619 2.294 246 HG2 LYS 30 HG2 LYS 30 -6.524 9.378 3.519 247 HG3 LYS 30 HG1 LYS 30 -7.783 8.685 4.539 248 HD2 LYS 30 HD2 LYS 30 -6.037 7.369 5.710 249 HD3 LYS 30 HD1 LYS 30 -4.815 8.212 4.755 250 HE2 LYS 30 HE2 LYS 30 -6.788 9.500 6.635 251 HE3 LYS 30 HE1 LYS 30 -5.082 9.218 6.970 252 HZ1 LYS 30 HZ1 LYS 30 -6.099 10.918 4.758 253 HZ2 LYS 30 HZ2 LYS 30 -4.486 10.724 5.225 254 HZ3 LYS 30 HZ3 LYS 30 -5.577 11.502 6.256 255 H GLU 31 HN GLU 31 -6.336 4.380 2.407 256 HA GLU 31 HA GLU 31 -7.883 3.935 0.202 257 HB2 GLU 31 HB2 GLU 31 -5.905 2.341 1.716 258 HB3 GLU 31 HB1 GLU 31 -6.913 1.451 0.584 259 HG2 GLU 31 HG2 GLU 31 -5.433 3.925 -0.224 260 HG3 GLU 31 HG1 GLU 31 -4.680 2.333 -0.258 261 H GLU 32 HN GLU 32 -8.011 1.996 3.186 262 HA GLU 32 HA GLU 32 -10.013 0.231 2.501 263 HB2 GLU 32 HB2 GLU 32 -9.761 1.499 5.230 264 HB3 GLU 32 HB1 GLU 32 -10.377 -0.105 4.850 265 HG2 GLU 32 HG2 GLU 32 -8.158 -0.793 4.145 266 HG3 GLU 32 HG1 GLU 32 -7.557 0.834 4.479 267 H LYS 33 HN LYS 33 -10.380 3.297 4.206 268 HA LYS 33 HA LYS 33 -13.157 3.253 4.482 269 HB2 LYS 33 HB2 LYS 33 -11.432 5.717 4.186 270 HB3 LYS 33 HB1 LYS 33 -13.001 5.621 4.972 271 HG2 LYS 33 HG2 LYS 33 -12.067 4.188 6.704 272 HG3 LYS 33 HG1 LYS 33 -10.496 4.230 5.903 273 HD2 LYS 33 HD2 LYS 33 -10.318 5.829 7.604 274 HD3 LYS 33 HD1 LYS 33 -10.642 6.774 6.153 275 HE2 LYS 33 HE2 LYS 33 -11.993 7.636 7.935 276 HE3 LYS 33 HE1 LYS 33 -13.046 6.814 6.787 277 HZ1 LYS 33 HZ1 LYS 33 -13.203 4.944 8.239 278 HZ2 LYS 33 HZ2 LYS 33 -13.539 6.327 9.152 279 HZ3 LYS 33 HZ3 LYS 33 -12.031 5.572 9.284 280 H ILE 34 HN ILE 34 -11.170 4.548 1.857 281 HA ILE 34 HA ILE 34 -13.315 5.783 0.459 282 HB ILE 34 HB ILE 34 -10.586 4.925 -0.520 283 HG12 ILE 34 HG12 ILE 34 -11.562 7.704 0.100 284 HG13 ILE 34 HG11 ILE 34 -10.841 6.676 1.342 285 HG21 ILE 34 HG21 ILE 34 -11.035 6.604 -2.342 286 HG22 ILE 34 HG22 ILE 34 -12.729 6.565 -1.842 287 HG23 ILE 34 HG23 ILE 34 -11.954 5.099 -2.442 288 HD11 ILE 34 HD11 ILE 34 -9.198 8.200 0.405 289 HD12 ILE 34 HD12 ILE 34 -9.505 7.565 -1.210 290 HD13 ILE 34 HD13 ILE 34 -8.786 6.528 0.022 291 H ARG 35 HN ARG 35 -11.867 2.573 0.351 292 HA ARG 35 HA ARG 35 -13.209 1.689 -1.998 293 HB2 ARG 35 HB2 ARG 35 -12.184 0.035 0.312 294 HB3 ARG 35 HB1 ARG 35 -12.562 -0.557 -1.302 295 HG2 ARG 35 HG2 ARG 35 -10.370 1.393 -0.608 296 HG3 ARG 35 HG1 ARG 35 -10.159 -0.317 -0.984 297 HD2 ARG 35 HD2 ARG 35 -10.698 -0.015 -3.230 298 HD3 ARG 35 HD1 ARG 35 -11.506 1.521 -2.929 299 HE ARG 35 HE ARG 35 -8.710 1.625 -2.307 300 HH11 ARG 35 HH11 ARG 35 -10.958 1.658 -4.984 301 HH12 ARG 35 HH12 ARG 35 -10.005 2.736 -5.950 302 HH21 ARG 35 HH21 ARG 35 -7.435 3.062 -3.578 303 HH22 ARG 35 HH22 ARG 35 -8.006 3.525 -5.158 304 H VAL 36 HN VAL 36 -13.915 1.542 1.438 305 HA VAL 36 HA VAL 36 -16.325 0.073 1.289 306 HB VAL 36 HB VAL 36 -15.624 2.193 3.323 307 HG11 VAL 36 HG11 VAL 36 -17.923 1.412 3.459 308 HG12 VAL 36 HG12 VAL 36 -16.990 0.838 4.841 309 HG13 VAL 36 HG13 VAL 36 -17.366 -0.261 3.513 310 HG21 VAL 36 HG21 VAL 36 -14.480 0.507 4.585 311 HG22 VAL 36 HG22 VAL 36 -13.789 0.565 2.956 312 HG23 VAL 36 HG23 VAL 36 -14.908 -0.727 3.401 313 H LEU 37 HN LEU 37 -15.507 3.416 0.830 314 HA LEU 37 HA LEU 37 -18.079 4.545 0.843 315 HB2 LEU 37 HB2 LEU 37 -15.537 5.498 0.476 316 HB3 LEU 37 HB1 LEU 37 -16.216 5.653 -1.137 317 HG LEU 37 HG LEU 37 -16.412 7.708 0.205 318 HD11 LEU 37 HD11 LEU 37 -19.023 6.419 -0.519 319 HD12 LEU 37 HD12 LEU 37 -17.967 7.332 -1.593 320 HD13 LEU 37 HD13 LEU 37 -18.770 8.143 -0.251 321 HD21 LEU 37 HD21 LEU 37 -16.753 6.530 2.375 322 HD22 LEU 37 HD22 LEU 37 -18.415 6.230 1.868 323 HD23 LEU 37 HD23 LEU 37 -17.835 7.885 2.064 324 H ARG 38 HN ARG 38 -16.303 2.776 -1.615 325 HA ARG 38 HA ARG 38 -17.932 3.363 -3.817 326 HB2 ARG 38 HB2 ARG 38 -16.388 0.843 -3.201 327 HB3 ARG 38 HB1 ARG 38 -17.129 1.200 -4.757 328 HG2 ARG 38 HG2 ARG 38 -15.718 3.238 -4.896 329 HG3 ARG 38 HG1 ARG 38 -14.911 2.725 -3.413 330 HD2 ARG 38 HD2 ARG 38 -13.602 2.073 -5.342 331 HD3 ARG 38 HD1 ARG 38 -14.230 0.644 -4.523 332 HE ARG 38 HE ARG 38 -16.076 0.872 -6.354 333 HH11 ARG 38 HH11 ARG 38 -12.653 1.484 -6.753 334 HH12 ARG 38 HH12 ARG 38 -12.630 1.021 -8.420 335 HH21 ARG 38 HH21 ARG 38 -16.048 0.263 -8.565 336 HH22 ARG 38 HH22 ARG 38 -14.553 0.327 -9.447 337 H GLN 39 HN GLN 39 -18.206 0.858 -1.329 338 HA GLN 39 HA GLN 39 -20.567 -0.332 -2.309 339 HB2 GLN 39 HB2 GLN 39 -19.673 -0.075 0.563 340 HB3 GLN 39 HB1 GLN 39 -20.799 -1.265 -0.082 341 HG2 GLN 39 HG2 GLN 39 -17.913 -1.024 -0.884 342 HG3 GLN 39 HG1 GLN 39 -18.528 -2.136 0.325 343 HE21 GLN 39 HE21 GLN 39 -20.997 -2.627 -1.227 344 HE22 GLN 39 HE22 GLN 39 -20.526 -3.666 -2.526 345 H ARG 40 HN ARG 40 -19.978 2.457 -0.261 346 HA ARG 40 HA ARG 40 -22.664 3.072 0.353 347 HB2 ARG 40 HB2 ARG 40 -20.086 4.544 0.334 348 HB3 ARG 40 HB1 ARG 40 -21.544 5.512 0.297 349 HG2 ARG 40 HG2 ARG 40 -20.634 5.179 2.558 350 HG3 ARG 40 HG1 ARG 40 -22.285 4.592 2.383 351 HD2 ARG 40 HD2 ARG 40 -19.965 2.732 2.035 352 HD3 ARG 40 HD1 ARG 40 -20.529 3.158 3.650 353 HE ARG 40 HE ARG 40 -22.789 2.398 2.272 354 HH11 ARG 40 HH11 ARG 40 -19.727 0.889 3.084 355 HH12 ARG 40 HH12 ARG 40 -20.396 -0.709 3.166 356 HH21 ARG 40 HH21 ARG 40 -23.664 0.306 2.409 357 HH22 ARG 40 HH22 ARG 40 -22.633 -1.041 2.781 358 H LEU 41 HN LEU 41 -20.586 3.897 -2.395 359 HA LEU 41 HA LEU 41 -22.436 5.603 -3.700 360 HB2 LEU 41 HB2 LEU 41 -20.488 3.879 -5.199 361 HB3 LEU 41 HB1 LEU 41 -21.080 5.478 -5.601 362 HG LEU 41 HG LEU 41 -19.159 4.864 -3.354 363 HD11 LEU 41 HD11 LEU 41 -18.180 4.467 -5.561 364 HD12 LEU 41 HD12 LEU 41 -17.468 5.875 -4.772 365 HD13 LEU 41 HD13 LEU 41 -18.656 6.091 -6.059 366 HD21 LEU 41 HD21 LEU 41 -18.827 7.272 -3.267 367 HD22 LEU 41 HD22 LEU 41 -20.508 6.848 -2.929 368 HD23 LEU 41 HD23 LEU 41 -20.064 7.496 -4.509 369 H VAL 42 HN VAL 42 -21.894 2.143 -3.703 370 HA VAL 42 HA VAL 42 -23.611 1.309 -5.716 371 HB VAL 42 HB VAL 42 -23.008 0.043 -3.038 372 HG11 VAL 42 HG11 VAL 42 -25.110 -0.851 -3.787 373 HG12 VAL 42 HG12 VAL 42 -23.848 -2.064 -4.016 374 HG13 VAL 42 HG13 VAL 42 -24.452 -1.149 -5.397 375 HG21 VAL 42 HG21 VAL 42 -21.551 -1.427 -4.368 376 HG22 VAL 42 HG22 VAL 42 -21.074 0.268 -4.474 377 HG23 VAL 42 HG23 VAL 42 -21.945 -0.488 -5.808 378 H GLU 43 HN GLU 43 -24.321 2.044 -2.332 379 HA GLU 43 HA GLU 43 -27.078 1.499 -2.413 380 HB2 GLU 43 HB2 GLU 43 -25.614 3.476 -0.659 381 HB3 GLU 43 HB1 GLU 43 -27.197 2.780 -0.340 382 HG2 GLU 43 HG2 GLU 43 -26.242 0.596 -0.076 383 HG3 GLU 43 HG1 GLU 43 -24.652 1.190 -0.552 384 H ARG 44 HN ARG 44 -25.198 4.322 -3.262 385 HA ARG 44 HA ARG 44 -27.445 6.071 -3.597 386 HB2 ARG 44 HB2 ARG 44 -24.652 6.321 -4.750 387 HB3 ARG 44 HB1 ARG 44 -25.865 7.592 -4.674 388 HG2 ARG 44 HG2 ARG 44 -25.787 7.290 -2.154 389 HG3 ARG 44 HG1 ARG 44 -24.313 6.359 -2.433 390 HD2 ARG 44 HD2 ARG 44 -24.847 9.265 -2.932 391 HD3 ARG 44 HD1 ARG 44 -23.529 8.518 -2.034 392 HE ARG 44 HE ARG 44 -23.584 7.955 -4.877 393 HH11 ARG 44 HH11 ARG 44 -22.342 10.012 -2.330 394 HH12 ARG 44 HH12 ARG 44 -21.023 10.610 -3.287 395 HH21 ARG 44 HH21 ARG 44 -21.857 8.767 -6.148 396 HH22 ARG 44 HH22 ARG 44 -20.745 9.900 -5.446 397 H GLY 45 HN GLY 45 -25.860 3.693 -5.473 398 HA2 GLY 45 HA2 GLY 45 -26.581 2.744 -7.479 399 HA3 GLY 45 HA1 GLY 45 -27.697 4.090 -7.690 400 H ASP 46 HN ASP 46 -24.328 4.508 -6.920 401 HA ASP 46 HA ASP 46 -23.989 6.383 -9.035 402 HB2 ASP 46 HB2 ASP 46 -22.817 6.336 -6.754 403 HB3 ASP 46 HB1 ASP 46 -21.759 5.119 -7.455 404 H ALA 47 HN ALA 47 -23.557 2.995 -8.782 405 HA ALA 47 HA ALA 47 -21.814 2.916 -11.135 406 HB1 ALA 47 HB1 ALA 47 -21.060 1.629 -9.226 407 HB2 ALA 47 HB2 ALA 47 -21.475 0.557 -10.564 408 HB3 ALA 47 HB3 ALA 47 -22.580 0.739 -9.205 409 H LYS 48 HN LYS 48 -24.942 3.233 -10.760 410 HA LYS 48 HA LYS 48 -26.013 1.019 -12.212 411 HB2 LYS 48 HB2 LYS 48 -27.122 3.717 -11.474 412 HB3 LYS 48 HB1 LYS 48 -28.025 2.578 -12.463 413 HG2 LYS 48 HG2 LYS 48 -27.012 2.049 -9.677 414 HG3 LYS 48 HG1 LYS 48 -28.670 2.469 -10.110 415 HD2 LYS 48 HD2 LYS 48 -28.814 0.439 -11.485 416 HD3 LYS 48 HD1 LYS 48 -27.166 0.016 -11.018 417 HE2 LYS 48 HE2 LYS 48 -28.735 -1.226 -9.675 418 HE3 LYS 48 HE1 LYS 48 -27.876 -0.063 -8.669 419 HZ1 LYS 48 HZ1 LYS 48 -30.244 -0.111 -8.169 420 HZ2 LYS 48 HZ2 LYS 48 -30.611 0.303 -9.768 421 HZ3 LYS 48 HZ3 LYS 48 -29.790 1.399 -8.778 422 H GLY 49 HN GLY 49 -24.146 3.619 -13.172 423 HA2 GLY 49 HA2 GLY 49 -25.269 4.127 -15.748 424 HA3 GLY 49 HA1 GLY 49 -23.634 4.519 -15.231 425 H THR 50 HN THR 50 -22.811 1.955 -14.493 426 HA THR 50 HA THR 50 -23.318 0.136 -16.681 427 HB THR 50 HB THR 50 -20.507 1.138 -16.163 428 HG1 THR 50 HG1 THR 50 -22.405 2.115 -17.730 429 HG21 THR 50 HG21 THR 50 -21.541 -0.920 -18.120 430 HG22 THR 50 HG22 THR 50 -20.534 -1.238 -16.708 431 HG23 THR 50 HG23 THR 50 -19.888 -0.309 -18.061 432 H GLU 51 HN GLU 51 -24.177 -1.149 -15.016 433 HA GLU 51 HA GLU 51 -22.125 -2.351 -13.287 434 HB2 GLU 51 HB2 GLU 51 -23.925 -1.251 -12.012 435 HB3 GLU 51 HB1 GLU 51 -25.112 -2.260 -12.826 436 HG2 GLU 51 HG2 GLU 51 -24.525 -3.015 -10.539 437 HG3 GLU 51 HG1 GLU 51 -24.254 -4.228 -11.789 438 H LEU 52 HN LEU 52 -21.736 -4.436 -13.485 439 HA LEU 52 HA LEU 52 -23.190 -5.831 -15.616 440 HB2 LEU 52 HB2 LEU 52 -20.412 -6.361 -14.576 441 HB3 LEU 52 HB1 LEU 52 -21.154 -7.096 -15.983 442 HG LEU 52 HG LEU 52 -20.428 -4.177 -15.703 443 HD11 LEU 52 HD11 LEU 52 -18.481 -5.623 -15.911 444 HD12 LEU 52 HD12 LEU 52 -18.722 -4.659 -17.366 445 HD13 LEU 52 HD13 LEU 52 -19.176 -6.362 -17.352 446 HD21 LEU 52 HD21 LEU 52 -21.536 -5.699 -18.059 447 HD22 LEU 52 HD22 LEU 52 -20.992 -4.022 -18.080 448 HD23 LEU 52 HD23 LEU 52 -22.392 -4.483 -17.111 449 H ASN 53 HN ASN 53 -22.196 -5.921 -12.350 450 HA ASN 53 HA ASN 53 -24.043 -7.832 -11.531 451 HB2 ASN 53 HB2 ASN 53 -22.682 -9.492 -12.690 452 HB3 ASN 53 HB1 ASN 53 -21.243 -8.947 -11.834 453 HD21 ASN 53 HD21 ASN 53 -24.294 -10.620 -11.537 454 HD22 ASN 53 HD22 ASN 53 -23.941 -11.390 -10.027 455 H GLY 84 HN GLY 84 10.996 -19.562 -7.027 456 HA2 GLY 84 HA2 GLY 84 13.552 -21.002 -6.770 457 HA3 GLY 84 HA1 GLY 84 13.340 -19.447 -7.562 458 HA PRO 85 HA PRO 85 14.458 -18.720 -3.081 459 HB2 PRO 85 HB2 PRO 85 17.110 -18.658 -3.054 460 HB3 PRO 85 HB1 PRO 85 16.258 -20.209 -3.029 461 HG2 PRO 85 HG2 PRO 85 17.591 -18.812 -5.310 462 HG3 PRO 85 HG1 PRO 85 17.602 -20.536 -4.893 463 HD2 PRO 85 HD2 PRO 85 15.940 -19.364 -6.795 464 HD3 PRO 85 HD1 PRO 85 15.650 -20.928 -6.011 465 H LEU 86 HN LEU 86 16.125 -16.880 -2.340 466 HA LEU 86 HA LEU 86 15.420 -14.468 -3.391 467 HB2 LEU 86 HB2 LEU 86 17.621 -13.594 -2.419 468 HB3 LEU 86 HB1 LEU 86 16.456 -14.308 -1.335 469 HG LEU 86 HG LEU 86 18.891 -14.825 -0.890 470 HD11 LEU 86 HD11 LEU 86 18.483 -17.007 -0.109 471 HD12 LEU 86 HD12 LEU 86 17.239 -17.293 -1.318 472 HD13 LEU 86 HD13 LEU 86 16.949 -16.144 -0.013 473 HD21 LEU 86 HD21 LEU 86 18.590 -16.641 -3.279 474 HD22 LEU 86 HD22 LEU 86 19.948 -16.614 -2.151 475 HD23 LEU 86 HD23 LEU 86 19.630 -15.218 -3.179 476 H GLY 87 HN GLY 87 16.458 -12.891 -4.686 477 HA2 GLY 87 HA2 GLY 87 17.834 -14.085 -6.972 478 HA3 GLY 87 HA1 GLY 87 17.107 -12.484 -6.914 479 H SER 88 HN SER 88 18.972 -13.297 -4.207 480 HA SER 88 HA SER 88 20.689 -11.103 -4.516 481 HB2 SER 88 HB2 SER 88 21.043 -13.480 -2.683 482 HB3 SER 88 HB1 SER 88 21.733 -11.869 -2.470 483 HG SER 88 HG SER 88 19.461 -11.136 -2.479 484 H ARG 89 HN ARG 89 20.854 -14.006 -6.115 485 HA ARG 89 HA ARG 89 23.630 -14.462 -6.241 486 HB2 ARG 89 HB2 ARG 89 23.094 -15.570 -8.440 487 HB3 ARG 89 HB1 ARG 89 22.180 -16.166 -7.062 488 HG2 ARG 89 HG2 ARG 89 20.254 -14.856 -7.745 489 HG3 ARG 89 HG1 ARG 89 21.169 -14.190 -9.097 490 HD2 ARG 89 HD2 ARG 89 19.665 -16.029 -9.769 491 HD3 ARG 89 HD1 ARG 89 21.358 -16.376 -10.102 492 HE ARG 89 HE ARG 89 21.339 -17.789 -8.095 493 HH11 ARG 89 HH11 ARG 89 18.253 -16.944 -9.517 494 HH12 ARG 89 HH12 ARG 89 17.450 -18.362 -8.929 495 HH21 ARG 89 HH21 ARG 89 20.299 -19.658 -7.330 496 HH22 ARG 89 HH22 ARG 89 18.622 -19.919 -7.693 497 H ARG 90 HN ARG 90 21.607 -12.039 -7.642 498 HA ARG 90 HA ARG 90 23.949 -10.669 -8.658 499 HB2 ARG 90 HB2 ARG 90 23.007 -10.300 -10.901 500 HB3 ARG 90 HB1 ARG 90 23.323 -12.001 -10.600 501 HG2 ARG 90 HG2 ARG 90 20.982 -12.418 -10.231 502 HG3 ARG 90 HG1 ARG 90 20.620 -10.697 -10.364 503 HD2 ARG 90 HD2 ARG 90 20.074 -11.854 -12.432 504 HD3 ARG 90 HD1 ARG 90 21.396 -10.717 -12.683 505 HE ARG 90 HE ARG 90 22.256 -13.400 -12.108 506 HH11 ARG 90 HH11 ARG 90 21.327 -11.143 -14.610 507 HH12 ARG 90 HH12 ARG 90 22.133 -12.016 -15.874 508 HH21 ARG 90 HH21 ARG 90 23.321 -14.556 -13.763 509 HH22 ARG 90 HH22 ARG 90 23.260 -13.964 -15.392 510 H PHE 91 HN PHE 91 20.525 -10.758 -7.984 511 HA PHE 91 HA PHE 91 19.975 -8.048 -8.569 512 HB2 PHE 91 HB2 PHE 91 18.261 -9.845 -8.485 513 HB3 PHE 91 HB1 PHE 91 18.467 -9.928 -6.740 514 HD1 PHE 91 HD1 PHE 91 17.162 -8.609 -5.359 515 HD2 PHE 91 HD2 PHE 91 17.552 -7.576 -9.467 516 HE1 PHE 91 HE1 PHE 91 15.454 -6.861 -5.078 517 HE2 PHE 91 HE2 PHE 91 15.848 -5.826 -9.193 518 HZ PHE 91 HZ PHE 91 14.797 -5.468 -6.998 519 H VAL 92 HN VAL 92 21.696 -9.448 -6.022 520 HA VAL 92 HA VAL 92 21.021 -7.636 -3.944 521 HB VAL 92 HB VAL 92 22.222 -9.773 -3.535 522 HG11 VAL 92 HG11 VAL 92 24.654 -9.867 -3.877 523 HG12 VAL 92 HG12 VAL 92 24.578 -8.334 -4.746 524 HG13 VAL 92 HG13 VAL 92 23.768 -9.759 -5.398 525 HG21 VAL 92 HG21 VAL 92 22.206 -8.073 -1.824 526 HG22 VAL 92 HG22 VAL 92 23.594 -7.272 -2.560 527 HG23 VAL 92 HG23 VAL 92 23.777 -8.874 -1.841 528 H VAL 93 HN VAL 93 23.186 -7.510 -6.679 529 HA VAL 93 HA VAL 93 24.592 -5.161 -5.902 530 HB VAL 93 HB VAL 93 24.120 -6.273 -8.665 531 HG11 VAL 93 HG11 VAL 93 24.779 -3.937 -8.750 532 HG12 VAL 93 HG12 VAL 93 26.097 -4.967 -9.310 533 HG13 VAL 93 HG13 VAL 93 26.149 -4.269 -7.691 534 HG21 VAL 93 HG21 VAL 93 25.241 -7.884 -7.247 535 HG22 VAL 93 HG22 VAL 93 26.421 -6.666 -6.762 536 HG23 VAL 93 HG23 VAL 93 26.371 -7.229 -8.432 537 H ASP 94 HN ASP 94 21.795 -5.813 -7.981 538 HA ASP 94 HA ASP 94 21.230 -3.116 -8.605 539 HB2 ASP 94 HB2 ASP 94 19.143 -5.271 -8.306 540 HB3 ASP 94 HB1 ASP 94 19.067 -3.839 -9.309 541 H ASP 95 HN ASP 95 19.949 -5.258 -6.091 542 HA ASP 95 HA ASP 95 18.192 -3.566 -4.812 543 HB2 ASP 95 HB2 ASP 95 18.227 -5.835 -4.178 544 HB3 ASP 95 HB1 ASP 95 19.937 -5.792 -3.776 545 H ARG 96 HN ARG 96 21.602 -3.296 -4.904 546 HA ARG 96 HA ARG 96 21.882 -1.813 -2.471 547 HB2 ARG 96 HB2 ARG 96 23.764 -3.032 -3.558 548 HB3 ARG 96 HB1 ARG 96 23.717 -1.865 -4.874 549 HG2 ARG 96 HG2 ARG 96 24.328 -0.080 -3.375 550 HG3 ARG 96 HG1 ARG 96 24.249 -1.173 -1.992 551 HD2 ARG 96 HD2 ARG 96 26.551 -0.849 -2.656 552 HD3 ARG 96 HD1 ARG 96 26.062 -2.511 -2.973 553 HE ARG 96 HE ARG 96 26.244 -0.433 -5.063 554 HH11 ARG 96 HH11 ARG 96 26.566 -3.765 -4.015 555 HH12 ARG 96 HH12 ARG 96 27.275 -4.293 -5.508 556 HH21 ARG 96 HH21 ARG 96 27.165 -1.133 -7.028 557 HH22 ARG 96 HH22 ARG 96 27.607 -2.801 -7.222 558 H ARG 97 HN ARG 97 22.251 -0.785 -5.872 559 HA ARG 97 HA ARG 97 21.780 1.973 -5.166 560 HB2 ARG 97 HB2 ARG 97 23.362 1.359 -6.953 561 HB3 ARG 97 HB1 ARG 97 22.048 0.654 -7.882 562 HG2 ARG 97 HG2 ARG 97 21.889 3.520 -7.075 563 HG3 ARG 97 HG1 ARG 97 22.935 3.053 -8.414 564 HD2 ARG 97 HD2 ARG 97 21.103 2.210 -9.668 565 HD3 ARG 97 HD1 ARG 97 20.015 2.284 -8.275 566 HE ARG 97 HE ARG 97 20.934 4.865 -8.711 567 HH11 ARG 97 HH11 ARG 97 19.035 2.509 -10.505 568 HH12 ARG 97 HH12 ARG 97 18.153 3.734 -11.368 569 HH21 ARG 97 HH21 ARG 97 19.772 6.435 -9.862 570 HH22 ARG 97 HH22 ARG 97 18.567 5.943 -11.014 571 H GLU 98 HN GLU 98 20.077 -0.502 -6.997 572 HA GLU 98 HA GLU 98 18.016 1.107 -7.987 573 HB2 GLU 98 HB2 GLU 98 18.258 -1.854 -7.540 574 HB3 GLU 98 HB1 GLU 98 16.868 -1.107 -8.336 575 HG2 GLU 98 HG2 GLU 98 19.694 -0.761 -9.253 576 HG3 GLU 98 HG1 GLU 98 18.623 -2.027 -9.857 577 H LEU 99 HN LEU 99 18.134 -1.030 -5.147 578 HA LEU 99 HA LEU 99 15.369 -0.760 -4.590 579 HB2 LEU 99 HB2 LEU 99 16.600 -2.716 -3.907 580 HB3 LEU 99 HB1 LEU 99 17.660 -1.753 -2.909 581 HG LEU 99 HG LEU 99 15.850 -3.180 -1.786 582 HD11 LEU 99 HD11 LEU 99 16.171 -0.272 -1.089 583 HD12 LEU 99 HD12 LEU 99 17.222 -1.602 -0.598 584 HD13 LEU 99 HD13 LEU 99 15.561 -1.527 -0.009 585 HD21 LEU 99 HD21 LEU 99 13.962 -2.524 -3.157 586 HD22 LEU 99 HD22 LEU 99 14.159 -0.843 -2.660 587 HD23 LEU 99 HD23 LEU 99 13.689 -2.063 -1.477 588 H GLN 100 HN GLN 100 18.273 0.764 -3.105 589 HA GLN 100 HA GLN 100 16.797 2.293 -1.248 590 HB2 GLN 100 HB2 GLN 100 18.764 3.716 -1.060 591 HB3 GLN 100 HB1 GLN 100 19.239 2.025 -1.097 592 HG2 GLN 100 HG2 GLN 100 19.912 2.233 -3.406 593 HG3 GLN 100 HG1 GLN 100 19.335 3.897 -3.448 594 HE21 GLN 100 HE21 GLN 100 21.014 2.504 -0.721 595 HE22 GLN 100 HE22 GLN 100 22.461 3.442 -0.884 596 H TYR 101 HN TYR 101 17.573 2.796 -4.614 597 HA TYR 101 HA TYR 101 16.801 5.510 -4.793 598 HB2 TYR 101 HB2 TYR 101 18.247 4.454 -6.460 599 HB3 TYR 101 HB1 TYR 101 16.935 3.380 -6.942 600 HD1 TYR 101 HD1 TYR 101 18.066 6.902 -6.917 601 HD2 TYR 101 HD2 TYR 101 15.274 4.098 -8.478 602 HE1 TYR 101 HE1 TYR 101 17.331 8.563 -8.574 603 HE2 TYR 101 HE2 TYR 101 14.532 5.751 -10.134 604 HH TYR 101 HH TYR 101 14.515 8.094 -10.517 605 H ARG 102 HN ARG 102 15.000 2.489 -5.195 606 HA ARG 102 HA ARG 102 12.699 3.834 -6.255 607 HB2 ARG 102 HB2 ARG 102 11.557 1.682 -6.072 608 HB3 ARG 102 HB1 ARG 102 13.126 1.508 -6.845 609 HG2 ARG 102 HG2 ARG 102 14.057 0.715 -4.716 610 HG3 ARG 102 HG1 ARG 102 12.452 0.830 -3.995 611 HD2 ARG 102 HD2 ARG 102 13.077 -0.845 -6.416 612 HD3 ARG 102 HD1 ARG 102 13.129 -1.459 -4.766 613 HE ARG 102 HE ARG 102 10.644 -0.210 -5.613 614 HH11 ARG 102 HH11 ARG 102 12.459 -3.165 -5.122 615 HH12 ARG 102 HH12 ARG 102 11.045 -4.166 -5.029 616 HH21 ARG 102 HH21 ARG 102 8.790 -1.515 -5.500 617 HH22 ARG 102 HH22 ARG 102 8.950 -3.225 -5.261 618 H VAL 103 HN VAL 103 13.874 3.195 -3.075 619 HA VAL 103 HA VAL 103 11.356 3.291 -1.737 620 HB VAL 103 HB VAL 103 14.051 3.987 -0.576 621 HG11 VAL 103 HG11 VAL 103 13.075 3.242 1.533 622 HG12 VAL 103 HG12 VAL 103 11.527 3.002 0.718 623 HG13 VAL 103 HG13 VAL 103 12.206 4.623 0.854 624 HG21 VAL 103 HG21 VAL 103 14.139 1.644 0.165 625 HG22 VAL 103 HG22 VAL 103 14.227 1.815 -1.587 626 HG23 VAL 103 HG23 VAL 103 12.720 1.305 -0.822 627 H GLU 104 HN GLU 104 13.854 5.759 -2.400 628 HA GLU 104 HA GLU 104 12.486 7.858 -1.137 629 HB2 GLU 104 HB2 GLU 104 13.871 9.314 -2.804 630 HB3 GLU 104 HB1 GLU 104 14.665 8.445 -1.502 631 HG2 GLU 104 HG2 GLU 104 15.368 6.728 -2.993 632 HG3 GLU 104 HG1 GLU 104 14.430 7.421 -4.313 633 H VAL 105 HN VAL 105 12.353 6.793 -4.547 634 HA VAL 105 HA VAL 105 10.528 8.811 -5.298 635 HB VAL 105 HB VAL 105 11.222 7.844 -7.224 636 HG11 VAL 105 HG11 VAL 105 11.093 5.134 -5.930 637 HG12 VAL 105 HG12 VAL 105 12.547 6.093 -6.214 638 HG13 VAL 105 HG13 VAL 105 11.629 5.454 -7.578 639 HG21 VAL 105 HG21 VAL 105 9.538 6.361 -8.214 640 HG22 VAL 105 HG22 VAL 105 8.826 7.739 -7.375 641 HG23 VAL 105 HG23 VAL 105 8.822 6.145 -6.619 642 H GLN 106 HN GLN 106 10.018 5.577 -3.925 643 HA GLN 106 HA GLN 106 7.209 5.652 -3.998 644 HB2 GLN 106 HB2 GLN 106 9.133 4.190 -2.198 645 HB3 GLN 106 HB1 GLN 106 7.395 4.003 -2.053 646 HG2 GLN 106 HG2 GLN 106 9.118 3.306 -4.407 647 HG3 GLN 106 HG1 GLN 106 8.225 2.204 -3.364 648 HE21 GLN 106 HE21 GLN 106 8.023 4.483 -5.969 649 HE22 GLN 106 HE22 GLN 106 6.414 4.095 -6.462 650 H ASN 107 HN ASN 107 9.490 6.708 -1.494 651 HA ASN 107 HA ASN 107 7.793 7.626 0.480 652 HB2 ASN 107 HB2 ASN 107 10.227 7.672 0.667 653 HB3 ASN 107 HB1 ASN 107 10.318 8.937 -0.555 654 HD21 ASN 107 HD21 ASN 107 11.318 10.382 0.793 655 HD22 ASN 107 HD22 ASN 107 10.527 11.133 2.135 656 H ARG 108 HN ARG 108 8.675 9.207 -2.557 657 HA ARG 108 HA ARG 108 7.197 11.599 -1.947 658 HB2 ARG 108 HB2 ARG 108 8.590 10.642 -4.447 659 HB3 ARG 108 HB1 ARG 108 7.841 12.219 -4.282 660 HG2 ARG 108 HG2 ARG 108 9.370 12.786 -2.483 661 HG3 ARG 108 HG1 ARG 108 10.083 11.175 -2.567 662 HD2 ARG 108 HD2 ARG 108 10.798 11.641 -4.877 663 HD3 ARG 108 HD1 ARG 108 10.138 13.270 -4.735 664 HE ARG 108 HE ARG 108 11.966 12.747 -2.633 665 HH11 ARG 108 HH11 ARG 108 11.866 13.444 -6.068 666 HH12 ARG 108 HH12 ARG 108 13.439 14.180 -6.091 667 HH21 ARG 108 HH21 ARG 108 14.035 13.715 -2.668 668 HH22 ARG 108 HH22 ARG 108 14.666 14.337 -4.161 669 H VAL 109 HN VAL 109 6.865 8.934 -4.249 670 HA VAL 109 HA VAL 109 4.493 9.749 -5.480 671 HB VAL 109 HB VAL 109 5.526 6.946 -5.060 672 HG11 VAL 109 HG11 VAL 109 4.104 6.342 -6.974 673 HG12 VAL 109 HG12 VAL 109 3.421 7.967 -6.962 674 HG13 VAL 109 HG13 VAL 109 3.157 6.891 -5.590 675 HG21 VAL 109 HG21 VAL 109 5.839 8.906 -7.324 676 HG22 VAL 109 HG22 VAL 109 6.320 7.210 -7.394 677 HG23 VAL 109 HG23 VAL 109 7.108 8.300 -6.253 678 H TYR 110 HN TYR 110 4.987 7.632 -2.679 679 HA TYR 110 HA TYR 110 2.287 6.965 -2.298 680 HB2 TYR 110 HB2 TYR 110 4.646 7.041 -0.441 681 HB3 TYR 110 HB1 TYR 110 3.043 6.639 0.151 682 HD1 TYR 110 HD1 TYR 110 5.083 4.729 0.594 683 HD2 TYR 110 HD2 TYR 110 2.767 5.305 -2.930 684 HE1 TYR 110 HE1 TYR 110 5.417 2.370 -0.006 685 HE2 TYR 110 HE2 TYR 110 3.097 2.950 -3.537 686 HH TYR 110 HH TYR 110 4.723 1.134 -3.068 687 H LYS 111 HN LYS 111 4.148 9.760 -1.234 688 HA LYS 111 HA LYS 111 2.120 10.841 0.429 689 HB2 LYS 111 HB2 LYS 111 4.539 11.548 0.421 690 HB3 LYS 111 HB1 LYS 111 4.228 12.381 -1.096 691 HG2 LYS 111 HG2 LYS 111 2.630 13.834 -0.016 692 HG3 LYS 111 HG1 LYS 111 2.825 12.960 1.505 693 HD2 LYS 111 HD2 LYS 111 5.225 13.600 1.499 694 HD3 LYS 111 HD1 LYS 111 4.923 14.574 0.059 695 HE2 LYS 111 HE2 LYS 111 3.592 14.939 2.741 696 HE3 LYS 111 HE1 LYS 111 4.908 15.925 2.107 697 HZ1 LYS 111 HZ1 LYS 111 2.238 15.655 0.838 698 HZ2 LYS 111 HZ2 LYS 111 3.489 16.674 0.335 699 HZ3 LYS 111 HZ3 LYS 111 2.717 16.950 1.811 700 H LYS 112 HN LYS 112 2.838 11.027 -2.988 701 HA LYS 112 HA LYS 112 0.896 12.989 -3.657 702 HB2 LYS 112 HB2 LYS 112 2.272 10.858 -5.297 703 HB3 LYS 112 HB1 LYS 112 1.214 12.083 -5.983 704 HG2 LYS 112 HG2 LYS 112 2.687 13.823 -5.435 705 HG3 LYS 112 HG1 LYS 112 3.609 12.803 -4.332 706 HD2 LYS 112 HD2 LYS 112 4.826 13.189 -6.414 707 HD3 LYS 112 HD1 LYS 112 4.417 11.486 -6.215 708 HE2 LYS 112 HE2 LYS 112 2.617 11.670 -7.775 709 HE3 LYS 112 HE1 LYS 112 2.810 13.420 -7.870 710 HZ1 LYS 112 HZ1 LYS 112 3.790 12.339 -9.779 711 HZ2 LYS 112 HZ2 LYS 112 4.775 11.389 -8.786 712 HZ3 LYS 112 HZ3 LYS 112 5.003 13.063 -8.851 713 H GLU 113 HN GLU 113 0.823 9.510 -3.271 714 HA GLU 113 HA GLU 113 -1.739 9.001 -4.315 715 HB2 GLU 113 HB2 GLU 113 -0.407 7.654 -1.968 716 HB3 GLU 113 HB1 GLU 113 -1.759 7.017 -2.904 717 HG2 GLU 113 HG2 GLU 113 1.028 7.534 -3.921 718 HG3 GLU 113 HG1 GLU 113 0.315 5.969 -3.557 719 H ILE 114 HN ILE 114 -0.661 9.805 -1.049 720 HA ILE 114 HA ILE 114 -3.106 9.801 0.261 721 HB ILE 114 HB ILE 114 -0.620 11.435 0.753 722 HG12 ILE 114 HG12 ILE 114 -1.634 8.856 1.953 723 HG13 ILE 114 HG11 ILE 114 -0.343 8.998 0.769 724 HG21 ILE 114 HG21 ILE 114 -2.385 12.548 1.907 725 HG22 ILE 114 HG22 ILE 114 -1.465 11.613 3.097 726 HG23 ILE 114 HG23 ILE 114 -3.020 11.016 2.520 727 HD11 ILE 114 HD11 ILE 114 1.024 10.189 2.343 728 HD12 ILE 114 HD12 ILE 114 0.485 8.661 3.041 729 HD13 ILE 114 HD13 ILE 114 -0.278 10.173 3.531 730 H GLN 115 HN GLN 115 -1.662 12.272 -1.767 731 HA GLN 115 HA GLN 115 -3.396 14.396 -1.071 732 HB2 GLN 115 HB2 GLN 115 -2.031 13.921 -3.722 733 HB3 GLN 115 HB1 GLN 115 -2.604 15.458 -3.089 734 HG2 GLN 115 HG2 GLN 115 -0.988 15.196 -1.206 735 HG3 GLN 115 HG1 GLN 115 -0.355 13.780 -2.046 736 HE21 GLN 115 HE21 GLN 115 -0.731 17.247 -2.199 737 HE22 GLN 115 HE22 GLN 115 0.506 17.521 -3.375 738 H ALA 116 HN ALA 116 -3.465 11.992 -3.658 739 HA ALA 116 HA ALA 116 -5.926 12.731 -4.813 740 HB1 ALA 116 HB1 ALA 116 -5.934 10.508 -5.797 741 HB2 ALA 116 HB2 ALA 116 -4.691 9.980 -4.662 742 HB3 ALA 116 HB3 ALA 116 -4.314 11.202 -5.880 743 H LEU 117 HN LEU 117 -5.083 10.487 -2.242 744 HA LEU 117 HA LEU 117 -7.682 9.505 -1.744 745 HB2 LEU 117 HB2 LEU 117 -5.381 9.738 0.199 746 HB3 LEU 117 HB1 LEU 117 -6.755 8.662 0.340 747 HG LEU 117 HG LEU 117 -4.538 8.511 -1.698 748 HD11 LEU 117 HD11 LEU 117 -5.352 6.726 0.581 749 HD12 LEU 117 HD12 LEU 117 -3.867 7.667 0.433 750 HD13 LEU 117 HD13 LEU 117 -4.163 6.307 -0.647 751 HD21 LEU 117 HD21 LEU 117 -6.972 6.749 -1.452 752 HD22 LEU 117 HD22 LEU 117 -5.612 6.512 -2.553 753 HD23 LEU 117 HD23 LEU 117 -6.667 7.913 -2.743 754 H ASP 118 HN ASP 118 -6.007 12.381 -0.801 755 HA ASP 118 HA ASP 118 -7.623 13.119 1.408 756 HB2 ASP 118 HB2 ASP 118 -5.429 14.102 1.085 757 HB3 ASP 118 HB1 ASP 118 -5.925 14.789 -0.457 758 H ALA 119 HN ALA 119 -7.923 13.575 -2.057 759 HA ALA 119 HA ALA 119 -10.124 15.360 -1.982 760 HB1 ALA 119 HB1 ALA 119 -9.359 13.330 -4.083 761 HB2 ALA 119 HB2 ALA 119 -8.836 15.014 -4.021 762 HB3 ALA 119 HB3 ALA 119 -10.535 14.627 -4.295 763 H GLU 120 HN GLU 120 -9.787 11.874 -1.849 764 HA GLU 120 HA GLU 120 -12.600 11.346 -1.774 765 HB2 GLU 120 HB2 GLU 120 -10.300 9.599 -0.901 766 HB3 GLU 120 HB1 GLU 120 -11.967 9.086 -1.093 767 HG2 GLU 120 HG2 GLU 120 -10.167 10.054 -3.270 768 HG3 GLU 120 HG1 GLU 120 -10.604 8.388 -2.970 769 H ILE 121 HN ILE 121 -10.145 12.140 0.626 770 HA ILE 121 HA ILE 121 -11.519 11.489 2.929 771 HB ILE 121 HB ILE 121 -9.503 13.492 2.242 772 HG12 ILE 121 HG12 ILE 121 -8.543 12.728 4.360 773 HG13 ILE 121 HG11 ILE 121 -10.034 11.872 4.736 774 HG21 ILE 121 HG21 ILE 121 -11.105 15.057 3.131 775 HG22 ILE 121 HG22 ILE 121 -9.792 14.835 4.285 776 HG23 ILE 121 HG23 ILE 121 -11.351 14.051 4.559 777 HD11 ILE 121 HD11 ILE 121 -8.183 11.268 2.446 778 HD12 ILE 121 HD12 ILE 121 -9.676 10.410 2.820 779 HD13 ILE 121 HD13 ILE 121 -8.325 10.356 3.947 780 H ARG 122 HN ARG 122 -12.142 14.061 0.632 781 HA ARG 122 HA ARG 122 -14.161 15.374 2.112 782 HB2 ARG 122 HB2 ARG 122 -13.012 16.346 0.140 783 HB3 ARG 122 HB1 ARG 122 -13.857 15.199 -0.889 784 HG2 ARG 122 HG2 ARG 122 -15.975 16.188 -0.352 785 HG3 ARG 122 HG1 ARG 122 -15.222 17.245 0.846 786 HD2 ARG 122 HD2 ARG 122 -15.673 18.434 -1.245 787 HD3 ARG 122 HD1 ARG 122 -13.946 18.348 -0.906 788 HE ARG 122 HE ARG 122 -15.322 16.607 -2.850 789 HH11 ARG 122 HH11 ARG 122 -12.550 18.503 -1.858 790 HH12 ARG 122 HH12 ARG 122 -11.642 18.158 -3.294 791 HH21 ARG 122 HH21 ARG 122 -14.131 16.152 -4.739 792 HH22 ARG 122 HH22 ARG 122 -12.541 16.823 -4.934 793 H LYS 123 HN LYS 123 -14.365 12.794 -0.399 794 HA LYS 123 HA LYS 123 -17.122 12.452 -0.346 795 HB2 LYS 123 HB2 LYS 123 -16.757 10.402 -1.408 796 HB3 LYS 123 HB1 LYS 123 -15.393 11.363 -1.913 797 HG2 LYS 123 HG2 LYS 123 -14.094 10.246 -0.085 798 HG3 LYS 123 HG1 LYS 123 -15.456 9.171 0.136 799 HD2 LYS 123 HD2 LYS 123 -13.729 9.461 -2.334 800 HD3 LYS 123 HD1 LYS 123 -13.794 8.096 -1.211 801 HE2 LYS 123 HE2 LYS 123 -16.057 7.607 -1.822 802 HE3 LYS 123 HE1 LYS 123 -16.113 9.022 -2.876 803 HZ1 LYS 123 HZ1 LYS 123 -14.172 7.931 -4.080 804 HZ2 LYS 123 HZ2 LYS 123 -15.704 7.247 -4.304 805 HZ3 LYS 123 HZ3 LYS 123 -14.597 6.512 -3.257 806 H LEU 124 HN LEU 124 -14.592 11.080 1.651 807 HA LEU 124 HA LEU 124 -16.166 9.393 3.223 808 HB2 LEU 124 HB2 LEU 124 -13.565 10.796 3.812 809 HB3 LEU 124 HB1 LEU 124 -14.286 9.608 4.882 810 HG LEU 124 HG LEU 124 -13.447 9.057 2.025 811 HD11 LEU 124 HD11 LEU 124 -11.523 9.499 3.477 812 HD12 LEU 124 HD12 LEU 124 -11.608 7.801 3.014 813 HD13 LEU 124 HD13 LEU 124 -12.115 8.302 4.627 814 HD21 LEU 124 HD21 LEU 124 -15.260 7.650 2.719 815 HD22 LEU 124 HD22 LEU 124 -14.440 7.264 4.231 816 HD23 LEU 124 HD23 LEU 124 -13.770 6.710 2.695 817 H GLU 125 HN GLU 125 -15.069 12.742 3.884 818 HA GLU 125 HA GLU 125 -16.279 13.002 6.381 819 HB2 GLU 125 HB2 GLU 125 -15.885 15.176 4.323 820 HB3 GLU 125 HB1 GLU 125 -16.230 15.427 6.027 821 HG2 GLU 125 HG2 GLU 125 -14.090 14.290 6.571 822 HG3 GLU 125 HG1 GLU 125 -13.748 14.214 4.846 823 H ARG 126 HN ARG 126 -17.632 13.442 3.163 824 HA ARG 126 HA ARG 126 -20.087 14.572 3.799 825 HB2 ARG 126 HB2 ARG 126 -19.450 12.495 1.695 826 HB3 ARG 126 HB1 ARG 126 -20.951 13.406 1.769 827 HG2 ARG 126 HG2 ARG 126 -18.220 14.628 1.442 828 HG3 ARG 126 HG1 ARG 126 -19.341 14.290 0.122 829 HD2 ARG 126 HD2 ARG 126 -19.924 16.091 2.468 830 HD3 ARG 126 HD1 ARG 126 -19.401 16.645 0.881 831 HE ARG 126 HE ARG 126 -21.721 15.005 0.698 832 HH11 ARG 126 HH11 ARG 126 -20.651 18.228 1.533 833 HH12 ARG 126 HH12 ARG 126 -22.161 18.978 1.129 834 HH21 ARG 126 HH21 ARG 126 -23.717 15.983 0.158 835 HH22 ARG 126 HH22 ARG 126 -23.909 17.697 0.350 836 H LEU 127 HN LEU 127 -19.186 11.150 3.683 837 HA LEU 127 HA LEU 127 -21.746 10.276 4.628 838 HB2 LEU 127 HB2 LEU 127 -19.138 8.923 4.052 839 HB3 LEU 127 HB1 LEU 127 -20.395 8.069 4.922 840 HG LEU 127 HG LEU 127 -20.460 7.478 2.577 841 HD11 LEU 127 HD11 LEU 127 -22.788 9.261 3.260 842 HD12 LEU 127 HD12 LEU 127 -22.574 7.602 3.817 843 HD13 LEU 127 HD13 LEU 127 -22.779 7.934 2.098 844 HD21 LEU 127 HD21 LEU 127 -20.981 9.112 0.843 845 HD22 LEU 127 HD22 LEU 127 -19.449 9.485 1.635 846 HD23 LEU 127 HD23 LEU 127 -20.897 10.410 2.034 847 H LEU 128 HN LEU 128 -18.556 10.760 6.056 848 HA LEU 128 HA LEU 128 -18.917 9.687 8.572 849 HB2 LEU 128 HB2 LEU 128 -17.492 12.237 7.832 850 HB3 LEU 128 HB1 LEU 128 -17.306 11.403 9.359 851 HG LEU 128 HG LEU 128 -16.487 10.411 6.641 852 HD11 LEU 128 HD11 LEU 128 -15.018 12.085 7.644 853 HD12 LEU 128 HD12 LEU 128 -14.242 10.504 7.553 854 HD13 LEU 128 HD13 LEU 128 -14.876 11.089 9.091 855 HD21 LEU 128 HD21 LEU 128 -15.573 8.460 7.839 856 HD22 LEU 128 HD22 LEU 128 -17.334 8.542 7.879 857 HD23 LEU 128 HD23 LEU 128 -16.396 9.007 9.299 858 H GLU 129 HN GLU 129 -19.494 13.051 7.608 859 HA GLU 129 HA GLU 129 -20.789 13.810 9.996 860 HB2 GLU 129 HB2 GLU 129 -20.894 14.986 7.223 861 HB3 GLU 129 HB1 GLU 129 -21.593 15.756 8.641 862 HG2 GLU 129 HG2 GLU 129 -19.338 15.766 9.669 863 HG3 GLU 129 HG1 GLU 129 -18.689 15.144 8.152 864 H SER 130 HN SER 130 -21.973 12.366 7.038 865 HA SER 130 HA SER 130 -24.726 12.834 7.481 866 HB2 SER 130 HB2 SER 130 -23.771 12.180 5.283 867 HB3 SER 130 HB1 SER 130 -23.436 10.575 5.929 868 HG SER 130 HG SER 130 -25.485 10.063 5.769 869 H GLY 131 HN GLY 131 -22.480 10.525 8.757 870 HA2 GLY 131 HA2 GLY 131 -23.106 9.679 10.967 871 HA3 GLY 131 HA1 GLY 131 -24.702 9.362 10.314 872 H LEU 132 HN LEU 132 -22.142 8.621 8.182 873 HA LEU 132 HA LEU 132 -22.660 5.829 8.276 874 HB2 LEU 132 HB2 LEU 132 -21.890 6.895 6.239 875 HB3 LEU 132 HB1 LEU 132 -20.406 7.397 7.026 876 HG LEU 132 HG LEU 132 -19.877 4.938 7.329 877 HD11 LEU 132 HD11 LEU 132 -22.103 4.643 5.319 878 HD12 LEU 132 HD12 LEU 132 -22.135 4.073 6.987 879 HD13 LEU 132 HD13 LEU 132 -20.996 3.373 5.838 880 HD21 LEU 132 HD21 LEU 132 -19.035 4.721 5.060 881 HD22 LEU 132 HD22 LEU 132 -18.816 6.365 5.664 882 HD23 LEU 132 HD23 LEU 132 -20.116 6.009 4.528 883 H THR 133 HN THR 133 -20.045 7.880 9.466 884 HA THR 133 HA THR 133 -19.381 5.847 11.442 885 HB THR 133 HB THR 133 -17.233 7.152 9.758 886 HG1 THR 133 HG1 THR 133 -18.629 4.727 9.469 887 HG21 THR 133 HG21 THR 133 -16.524 6.551 12.014 888 HG22 THR 133 HG22 THR 133 -15.769 5.490 10.825 889 HG23 THR 133 HG23 THR 133 -17.132 4.912 11.783 Start of MODEL 3 1 H1 MET 1 HT1 MET 1 30.645 -2.556 3.287 2 H2 MET 1 HT2 MET 1 30.169 -0.972 3.638 3 H3 MET 1 HT3 MET 1 29.394 -2.272 4.392 4 HA MET 1 HA MET 1 31.398 -2.864 5.547 5 HB2 MET 1 HB2 MET 1 32.541 -0.442 4.138 6 HB3 MET 1 HB1 MET 1 33.320 -1.261 5.483 7 HG2 MET 1 HG2 MET 1 34.365 -2.067 3.548 8 HG3 MET 1 HG1 MET 1 33.281 -3.351 4.074 9 HE1 MET 1 HE1 MET 1 32.739 0.013 2.062 10 HE2 MET 1 HE2 MET 1 32.652 -0.612 0.417 11 HE3 MET 1 HE3 MET 1 34.155 -0.738 1.330 12 H ASP 2 HN ASP 2 30.314 -2.525 7.361 13 HA ASP 2 HA ASP 2 28.956 -0.194 8.110 14 HB2 ASP 2 HB2 ASP 2 28.449 -2.362 9.085 15 HB3 ASP 2 HB1 ASP 2 30.053 -2.448 9.803 16 H SER 3 HN SER 3 32.277 -1.154 8.563 17 HA SER 3 HA SER 3 32.866 0.788 10.579 18 HB2 SER 3 HB2 SER 3 34.104 -1.354 10.342 19 HB3 SER 3 HB1 SER 3 34.761 -0.780 8.812 20 HG SER 3 HG SER 3 35.253 0.171 11.425 21 H ALA 4 HN ALA 4 32.736 0.819 7.134 22 HA ALA 4 HA ALA 4 34.422 3.172 6.885 23 HB1 ALA 4 HB1 ALA 4 34.518 1.449 5.148 24 HB2 ALA 4 HB2 ALA 4 33.987 2.996 4.491 25 HB3 ALA 4 HB3 ALA 4 32.811 1.715 4.791 26 H ILE 5 HN ILE 5 31.035 2.271 6.623 27 HA ILE 5 HA ILE 5 30.078 4.878 5.955 28 HB ILE 5 HB ILE 5 28.535 2.639 7.283 29 HG12 ILE 5 HG12 ILE 5 28.896 3.137 4.320 30 HG13 ILE 5 HG11 ILE 5 29.713 1.866 5.224 31 HG21 ILE 5 HG21 ILE 5 27.651 4.918 5.523 32 HG22 ILE 5 HG22 ILE 5 27.401 4.794 7.263 33 HG23 ILE 5 HG23 ILE 5 26.604 3.657 6.174 34 HD11 ILE 5 HD11 ILE 5 27.523 0.899 5.782 35 HD12 ILE 5 HD12 ILE 5 27.825 0.956 4.049 36 HD13 ILE 5 HD13 ILE 5 26.749 2.137 4.793 37 H SER 6 HN SER 6 29.410 6.531 7.320 38 HA SER 6 HA SER 6 29.949 6.164 10.159 39 HB2 SER 6 HB2 SER 6 29.022 8.679 8.744 40 HB3 SER 6 HB1 SER 6 29.784 8.553 10.331 41 HG SER 6 HG SER 6 31.705 7.984 9.360 42 H LYS 7 HN LYS 7 28.206 7.160 11.689 43 HA LYS 7 HA LYS 7 25.781 5.785 11.320 44 HB2 LYS 7 HB2 LYS 7 26.814 6.762 13.495 45 HB3 LYS 7 HB1 LYS 7 25.979 8.244 13.042 46 HG2 LYS 7 HG2 LYS 7 23.866 6.945 12.956 47 HG3 LYS 7 HG1 LYS 7 24.744 5.557 13.586 48 HD2 LYS 7 HD2 LYS 7 24.398 8.220 14.948 49 HD3 LYS 7 HD1 LYS 7 23.553 6.729 15.355 50 HE2 LYS 7 HE2 LYS 7 25.804 5.702 15.807 51 HE3 LYS 7 HE1 LYS 7 26.499 7.310 15.621 52 HZ1 LYS 7 HZ1 LYS 7 24.462 6.522 17.630 53 HZ2 LYS 7 HZ2 LYS 7 25.095 8.077 17.443 54 HZ3 LYS 7 HZ3 LYS 7 26.098 6.812 17.939 55 H GLU 8 HN GLU 8 26.916 8.831 10.271 56 HA GLU 8 HA GLU 8 24.795 10.355 9.602 57 HB2 GLU 8 HB2 GLU 8 27.045 11.033 9.240 58 HB3 GLU 8 HB1 GLU 8 27.352 9.676 8.162 59 HG2 GLU 8 HG2 GLU 8 27.182 11.705 6.930 60 HG3 GLU 8 HG1 GLU 8 25.837 10.644 6.533 61 H ASP 9 HN ASP 9 26.271 8.042 7.313 62 HA ASP 9 HA ASP 9 24.091 8.297 5.492 63 HB2 ASP 9 HB2 ASP 9 26.514 7.775 4.911 64 HB3 ASP 9 HB1 ASP 9 26.195 6.138 5.457 65 H GLU 10 HN GLU 10 24.869 6.152 8.104 66 HA GLU 10 HA GLU 10 23.179 4.010 7.390 67 HB2 GLU 10 HB2 GLU 10 24.866 3.688 9.086 68 HB3 GLU 10 HB1 GLU 10 24.135 4.922 10.106 69 HG2 GLU 10 HG2 GLU 10 22.204 3.568 10.472 70 HG3 GLU 10 HG1 GLU 10 22.759 2.373 9.301 71 H GLU 11 HN GLU 11 22.610 6.581 9.820 72 HA GLU 11 HA GLU 11 19.909 6.009 10.185 73 HB2 GLU 11 HB2 GLU 11 21.253 8.694 10.488 74 HB3 GLU 11 HB1 GLU 11 19.712 8.224 11.190 75 HG2 GLU 11 HG2 GLU 11 20.917 6.457 12.472 76 HG3 GLU 11 HG1 GLU 11 22.423 7.122 11.855 77 H ARG 12 HN ARG 12 21.551 7.976 7.793 78 HA ARG 12 HA ARG 12 19.384 9.240 6.589 79 HB2 ARG 12 HB2 ARG 12 21.617 9.762 5.874 80 HB3 ARG 12 HB1 ARG 12 21.915 8.101 5.397 81 HG2 ARG 12 HG2 ARG 12 21.620 9.486 3.446 82 HG3 ARG 12 HG1 ARG 12 20.290 8.338 3.573 83 HD2 ARG 12 HD2 ARG 12 20.064 11.146 4.621 84 HD3 ARG 12 HD1 ARG 12 19.736 10.757 2.934 85 HE ARG 12 HE ARG 12 18.296 9.103 4.789 86 HH11 ARG 12 HH11 ARG 12 18.244 12.149 3.054 87 HH12 ARG 12 HH12 ARG 12 16.515 12.290 3.122 88 HH21 ARG 12 HH21 ARG 12 16.047 9.296 4.882 89 HH22 ARG 12 HH22 ARG 12 15.258 10.665 4.166 90 H TYR 13 HN TYR 13 20.757 6.029 5.834 91 HA TYR 13 HA TYR 13 18.782 5.325 3.966 92 HB2 TYR 13 HB2 TYR 13 20.842 4.098 4.007 93 HB3 TYR 13 HB1 TYR 13 20.594 3.627 5.685 94 HD1 TYR 13 HD1 TYR 13 20.192 1.372 5.867 95 HD2 TYR 13 HD2 TYR 13 18.475 3.497 2.613 96 HE1 TYR 13 HE1 TYR 13 19.040 -0.682 5.144 97 HE2 TYR 13 HE2 TYR 13 17.313 1.457 1.879 98 HH TYR 13 HH TYR 13 17.608 -1.008 2.109 99 H GLN 14 HN GLN 14 19.108 4.435 7.404 100 HA GLN 14 HA GLN 14 16.861 2.891 7.717 101 HB2 GLN 14 HB2 GLN 14 17.949 4.905 9.688 102 HB3 GLN 14 HB1 GLN 14 16.917 3.543 10.078 103 HG2 GLN 14 HG2 GLN 14 18.736 2.066 9.130 104 HG3 GLN 14 HG1 GLN 14 19.752 3.501 9.105 105 HE21 GLN 14 HE21 GLN 14 20.406 4.430 11.046 106 HE22 GLN 14 HE22 GLN 14 20.325 3.578 12.545 107 H LYS 15 HN LYS 15 16.999 6.384 8.430 108 HA LYS 15 HA LYS 15 14.297 6.724 8.879 109 HB2 LYS 15 HB2 LYS 15 16.385 8.654 7.902 110 HB3 LYS 15 HB1 LYS 15 14.729 9.151 8.238 111 HG2 LYS 15 HG2 LYS 15 16.560 7.829 10.230 112 HG3 LYS 15 HG1 LYS 15 16.276 9.568 10.113 113 HD2 LYS 15 HD2 LYS 15 14.032 9.359 10.772 114 HD3 LYS 15 HD1 LYS 15 14.014 7.623 10.463 115 HE2 LYS 15 HE2 LYS 15 15.564 7.282 12.315 116 HE3 LYS 15 HE1 LYS 15 15.564 9.015 12.637 117 HZ1 LYS 15 HZ1 LYS 15 14.057 7.790 14.105 118 HZ2 LYS 15 HZ2 LYS 15 13.172 7.260 12.768 119 HZ3 LYS 15 HZ3 LYS 15 13.223 8.904 13.146 120 H LEU 16 HN LEU 16 16.034 6.603 5.847 121 HA LEU 16 HA LEU 16 13.997 7.722 4.227 122 HB2 LEU 16 HB2 LEU 16 16.398 7.476 3.587 123 HB3 LEU 16 HB1 LEU 16 16.128 5.751 3.418 124 HG LEU 16 HG LEU 16 14.615 6.107 1.567 125 HD11 LEU 16 HD11 LEU 16 14.986 9.028 2.201 126 HD12 LEU 16 HD12 LEU 16 13.479 8.107 2.183 127 HD13 LEU 16 HD13 LEU 16 14.335 8.437 0.675 128 HD21 LEU 16 HD21 LEU 16 17.100 7.784 1.257 129 HD22 LEU 16 HD22 LEU 16 16.172 7.032 -0.042 130 HD23 LEU 16 HD23 LEU 16 17.026 6.027 1.129 131 H VAL 17 HN VAL 17 14.840 4.385 5.077 132 HA VAL 17 HA VAL 17 12.765 3.184 3.570 133 HB VAL 17 HB VAL 17 13.315 1.172 4.534 134 HG11 VAL 17 HG11 VAL 17 15.721 1.122 4.979 135 HG12 VAL 17 HG12 VAL 17 15.708 2.882 5.116 136 HG13 VAL 17 HG13 VAL 17 15.312 2.113 3.577 137 HG21 VAL 17 HG21 VAL 17 14.056 2.584 7.094 138 HG22 VAL 17 HG22 VAL 17 14.162 0.844 6.819 139 HG23 VAL 17 HG23 VAL 17 12.590 1.646 6.800 140 H THR 18 HN THR 18 12.957 4.547 6.770 141 HA THR 18 HA THR 18 10.464 3.674 7.724 142 HB THR 18 HB THR 18 12.564 5.579 8.506 143 HG1 THR 18 HG1 THR 18 12.566 3.660 9.551 144 HG21 THR 18 HG21 THR 18 10.709 7.098 8.564 145 HG22 THR 18 HG22 THR 18 11.183 6.674 10.210 146 HG23 THR 18 HG23 THR 18 9.746 5.946 9.489 147 H GLU 19 HN GLU 19 11.513 6.508 5.907 148 HA GLU 19 HA GLU 19 9.255 8.081 6.125 149 HB2 GLU 19 HB2 GLU 19 11.272 7.795 3.910 150 HB3 GLU 19 HB1 GLU 19 9.945 8.948 3.813 151 HG2 GLU 19 HG2 GLU 19 10.720 9.925 5.966 152 HG3 GLU 19 HG1 GLU 19 12.114 8.848 5.901 153 H ASN 20 HN ASN 20 9.845 5.395 3.869 154 HA ASN 20 HA ASN 20 7.300 5.880 2.597 155 HB2 ASN 20 HB2 ASN 20 7.759 3.929 1.207 156 HB3 ASN 20 HB1 ASN 20 9.121 5.038 1.213 157 HD21 ASN 20 HD21 ASN 20 11.060 4.369 1.988 158 HD22 ASN 20 HD22 ASN 20 11.374 2.746 2.493 159 H GLU 21 HN GLU 21 8.520 3.804 5.139 160 HA GLU 21 HA GLU 21 6.400 1.986 5.303 161 HB2 GLU 21 HB2 GLU 21 8.029 3.201 7.540 162 HB3 GLU 21 HB1 GLU 21 7.060 1.736 7.658 163 HG2 GLU 21 HG2 GLU 21 9.174 1.914 5.583 164 HG3 GLU 21 HG1 GLU 21 9.634 1.627 7.253 165 H GLN 22 HN GLN 22 6.795 5.213 6.674 166 HA GLN 22 HA GLN 22 4.568 5.229 8.369 167 HB2 GLN 22 HB2 GLN 22 5.635 7.641 6.902 168 HB3 GLN 22 HB1 GLN 22 4.788 7.612 8.439 169 HG2 GLN 22 HG2 GLN 22 6.644 6.493 9.508 170 HG3 GLN 22 HG1 GLN 22 7.506 6.405 7.975 171 HE21 GLN 22 HE21 GLN 22 6.652 9.111 7.195 172 HE22 GLN 22 HE22 GLN 22 7.609 10.191 8.144 173 H LEU 23 HN LEU 23 4.859 6.671 5.116 174 HA LEU 23 HA LEU 23 2.100 7.422 5.275 175 HB2 LEU 23 HB2 LEU 23 2.430 8.811 3.460 176 HB3 LEU 23 HB1 LEU 23 3.933 8.863 4.336 177 HG LEU 23 HG LEU 23 3.392 7.477 1.738 178 HD11 LEU 23 HD11 LEU 23 5.094 9.007 0.909 179 HD12 LEU 23 HD12 LEU 23 5.252 9.704 2.520 180 HD13 LEU 23 HD13 LEU 23 3.741 9.880 1.628 181 HD21 LEU 23 HD21 LEU 23 5.754 6.835 1.747 182 HD22 LEU 23 HD22 LEU 23 4.828 6.026 3.012 183 HD23 LEU 23 HD23 LEU 23 5.879 7.386 3.419 184 H GLN 24 HN GLN 24 3.767 4.737 3.881 185 HA GLN 24 HA GLN 24 1.802 4.031 1.988 186 HB2 GLN 24 HB2 GLN 24 2.658 1.801 2.046 187 HB3 GLN 24 HB1 GLN 24 4.024 2.896 2.188 188 HG2 GLN 24 HG2 GLN 24 4.124 2.500 4.574 189 HG3 GLN 24 HG1 GLN 24 2.713 1.455 4.481 190 HE21 GLN 24 HE21 GLN 24 3.602 0.250 1.960 191 HE22 GLN 24 HE22 GLN 24 4.880 -0.830 2.385 192 H ARG 25 HN ARG 25 2.014 3.648 5.448 193 HA ARG 25 HA ARG 25 -0.266 2.024 5.828 194 HB2 ARG 25 HB2 ARG 25 0.962 2.063 7.741 195 HB3 ARG 25 HB1 ARG 25 1.583 3.674 7.424 196 HG2 ARG 25 HG2 ARG 25 -0.728 4.497 8.071 197 HG3 ARG 25 HG1 ARG 25 -0.977 2.886 8.753 198 HD2 ARG 25 HD2 ARG 25 1.146 4.899 9.492 199 HD3 ARG 25 HD1 ARG 25 -0.179 4.320 10.504 200 HE ARG 25 HE ARG 25 0.985 2.051 10.234 201 HH11 ARG 25 HH11 ARG 25 2.655 5.128 10.422 202 HH12 ARG 25 HH12 ARG 25 4.130 4.429 11.009 203 HH21 ARG 25 HH21 ARG 25 2.927 1.136 10.993 204 HH22 ARG 25 HH22 ARG 25 4.293 2.157 11.319 205 H LEU 26 HN LEU 26 0.315 5.469 5.649 206 HA LEU 26 HA LEU 26 -2.308 6.329 6.279 207 HB2 LEU 26 HB2 LEU 26 -0.120 7.712 4.716 208 HB3 LEU 26 HB1 LEU 26 -1.525 8.499 5.427 209 HG LEU 26 HG LEU 26 0.532 6.988 7.044 210 HD11 LEU 26 HD11 LEU 26 0.336 9.976 6.910 211 HD12 LEU 26 HD12 LEU 26 1.397 9.067 5.839 212 HD13 LEU 26 HD13 LEU 26 1.624 8.972 7.584 213 HD21 LEU 26 HD21 LEU 26 -1.727 7.199 8.011 214 HD22 LEU 26 HD22 LEU 26 -1.586 8.953 7.889 215 HD23 LEU 26 HD23 LEU 26 -0.495 8.052 8.941 216 H ILE 27 HN ILE 27 -0.691 5.355 3.356 217 HA ILE 27 HA ILE 27 -2.741 6.046 1.527 218 HB ILE 27 HB ILE 27 -0.639 3.878 1.404 219 HG12 ILE 27 HG12 ILE 27 -0.750 6.576 0.050 220 HG13 ILE 27 HG11 ILE 27 0.181 6.223 1.513 221 HG21 ILE 27 HG21 ILE 27 -1.077 3.735 -0.977 222 HG22 ILE 27 HG22 ILE 27 -2.360 4.934 -0.833 223 HG23 ILE 27 HG23 ILE 27 -2.538 3.357 -0.064 224 HD11 ILE 27 HD11 ILE 27 1.490 4.585 0.270 225 HD12 ILE 27 HD12 ILE 27 1.583 6.185 -0.465 226 HD13 ILE 27 HD13 ILE 27 0.560 4.942 -1.183 227 H THR 28 HN THR 28 -1.866 2.975 3.078 228 HA THR 28 HA THR 28 -3.840 1.404 1.953 229 HB THR 28 HB THR 28 -1.772 0.778 3.463 230 HG1 THR 28 HG1 THR 28 -2.982 -0.757 2.332 231 HG21 THR 28 HG21 THR 28 -4.063 0.704 5.436 232 HG22 THR 28 HG22 THR 28 -2.596 1.683 5.563 233 HG23 THR 28 HG23 THR 28 -2.495 -0.074 5.673 234 H GLN 29 HN GLN 29 -4.094 3.429 4.863 235 HA GLN 29 HA GLN 29 -6.584 2.341 5.669 236 HB2 GLN 29 HB2 GLN 29 -6.741 4.328 7.159 237 HB3 GLN 29 HB1 GLN 29 -5.280 3.372 7.352 238 HG2 GLN 29 HG2 GLN 29 -3.950 4.953 6.332 239 HG3 GLN 29 HG1 GLN 29 -5.327 5.710 5.547 240 HE21 GLN 29 HE21 GLN 29 -5.402 4.815 8.904 241 HE22 GLN 29 HE22 GLN 29 -5.359 6.423 9.543 242 H LYS 30 HN LYS 30 -5.674 5.037 3.647 243 HA LYS 30 HA LYS 30 -8.368 5.981 3.342 244 HB2 LYS 30 HB2 LYS 30 -5.919 6.514 1.645 245 HB3 LYS 30 HB1 LYS 30 -7.438 7.400 1.561 246 HG2 LYS 30 HG2 LYS 30 -7.130 8.178 3.840 247 HG3 LYS 30 HG1 LYS 30 -5.632 7.259 3.964 248 HD2 LYS 30 HD2 LYS 30 -4.722 8.607 2.084 249 HD3 LYS 30 HD1 LYS 30 -6.191 9.586 2.128 250 HE2 LYS 30 HE2 LYS 30 -4.232 9.224 4.396 251 HE3 LYS 30 HE1 LYS 30 -4.361 10.646 3.364 252 HZ1 LYS 30 HZ1 LYS 30 -6.539 9.638 5.114 253 HZ2 LYS 30 HZ2 LYS 30 -6.552 11.066 4.207 254 HZ3 LYS 30 HZ3 LYS 30 -5.490 10.903 5.513 255 H GLU 31 HN GLU 31 -6.100 4.134 1.349 256 HA GLU 31 HA GLU 31 -7.579 3.534 -0.848 257 HB2 GLU 31 HB2 GLU 31 -5.548 2.002 0.705 258 HB3 GLU 31 HB1 GLU 31 -6.392 1.194 -0.610 259 HG2 GLU 31 HG2 GLU 31 -4.948 3.806 -0.934 260 HG3 GLU 31 HG1 GLU 31 -4.195 2.234 -1.205 261 H GLU 32 HN GLU 32 -7.670 1.623 2.198 262 HA GLU 32 HA GLU 32 -9.465 -0.274 1.181 263 HB2 GLU 32 HB2 GLU 32 -9.960 -0.808 3.597 264 HB3 GLU 32 HB1 GLU 32 -8.284 -0.927 3.095 265 HG2 GLU 32 HG2 GLU 32 -7.701 1.062 4.224 266 HG3 GLU 32 HG1 GLU 32 -9.399 1.494 4.478 267 H LYS 33 HN LYS 33 -10.093 2.795 2.823 268 HA LYS 33 HA LYS 33 -12.904 2.431 3.015 269 HB2 LYS 33 HB2 LYS 33 -11.278 4.975 2.814 270 HB3 LYS 33 HB1 LYS 33 -12.992 4.916 3.195 271 HG2 LYS 33 HG2 LYS 33 -12.458 3.585 5.209 272 HG3 LYS 33 HG1 LYS 33 -10.742 3.783 4.841 273 HD2 LYS 33 HD2 LYS 33 -10.984 6.208 4.996 274 HD3 LYS 33 HD1 LYS 33 -12.704 6.020 5.344 275 HE2 LYS 33 HE2 LYS 33 -12.104 4.731 7.371 276 HE3 LYS 33 HE1 LYS 33 -10.404 5.052 7.036 277 HZ1 LYS 33 HZ1 LYS 33 -11.274 6.611 8.644 278 HZ2 LYS 33 HZ2 LYS 33 -12.483 7.099 7.575 279 HZ3 LYS 33 HZ3 LYS 33 -10.863 7.422 7.222 280 H ILE 34 HN ILE 34 -10.827 3.952 0.592 281 HA ILE 34 HA ILE 34 -12.889 4.792 -1.147 282 HB ILE 34 HB ILE 34 -9.974 4.216 -1.708 283 HG12 ILE 34 HG12 ILE 34 -11.297 6.897 -1.497 284 HG13 ILE 34 HG11 ILE 34 -10.753 6.049 -0.052 285 HG21 ILE 34 HG21 ILE 34 -11.212 4.095 -3.776 286 HG22 ILE 34 HG22 ILE 34 -10.281 5.595 -3.722 287 HG23 ILE 34 HG23 ILE 34 -12.019 5.621 -3.414 288 HD11 ILE 34 HD11 ILE 34 -8.477 6.010 -0.908 289 HD12 ILE 34 HD12 ILE 34 -9.098 7.659 -0.822 290 HD13 ILE 34 HD13 ILE 34 -9.008 6.833 -2.376 291 H ARG 35 HN ARG 35 -11.180 1.748 -0.803 292 HA ARG 35 HA ARG 35 -11.869 0.538 -3.220 293 HB2 ARG 35 HB2 ARG 35 -11.600 -0.723 -0.497 294 HB3 ARG 35 HB1 ARG 35 -11.724 -1.627 -1.999 295 HG2 ARG 35 HG2 ARG 35 -9.650 -0.393 -2.761 296 HG3 ARG 35 HG1 ARG 35 -9.487 0.156 -1.091 297 HD2 ARG 35 HD2 ARG 35 -9.387 -2.658 -2.151 298 HD3 ARG 35 HD1 ARG 35 -8.131 -1.770 -1.290 299 HE ARG 35 HE ARG 35 -10.624 -2.315 0.127 300 HH11 ARG 35 HH11 ARG 35 -7.237 -3.062 -0.346 301 HH12 ARG 35 HH12 ARG 35 -7.105 -3.982 1.117 302 HH21 ARG 35 HH21 ARG 35 -10.462 -3.535 2.039 303 HH22 ARG 35 HH22 ARG 35 -8.947 -4.263 2.470 304 H VAL 36 HN VAL 36 -13.676 0.844 -0.223 305 HA VAL 36 HA VAL 36 -15.847 -0.802 -0.976 306 HB VAL 36 HB VAL 36 -15.988 1.544 0.912 307 HG11 VAL 36 HG11 VAL 36 -17.667 0.112 2.041 308 HG12 VAL 36 HG12 VAL 36 -17.506 -1.055 0.725 309 HG13 VAL 36 HG13 VAL 36 -18.129 0.564 0.400 310 HG21 VAL 36 HG21 VAL 36 -15.124 -1.264 1.581 311 HG22 VAL 36 HG22 VAL 36 -15.195 0.120 2.672 312 HG23 VAL 36 HG23 VAL 36 -14.010 0.087 1.359 313 H LEU 37 HN LEU 37 -15.169 2.630 -1.298 314 HA LEU 37 HA LEU 37 -17.602 3.388 -2.515 315 HB2 LEU 37 HB2 LEU 37 -14.861 4.542 -2.341 316 HB3 LEU 37 HB1 LEU 37 -15.930 5.175 -3.577 317 HG LEU 37 HG LEU 37 -15.843 6.429 -1.362 318 HD11 LEU 37 HD11 LEU 37 -18.255 6.882 -1.376 319 HD12 LEU 37 HD12 LEU 37 -18.503 5.464 -2.397 320 HD13 LEU 37 HD13 LEU 37 -17.572 6.838 -3.004 321 HD21 LEU 37 HD21 LEU 37 -17.207 5.584 0.451 322 HD22 LEU 37 HD22 LEU 37 -15.908 4.447 0.090 323 HD23 LEU 37 HD23 LEU 37 -17.550 4.114 -0.462 324 H ARG 38 HN ARG 38 -14.556 2.140 -3.767 325 HA ARG 38 HA ARG 38 -15.108 2.531 -6.496 326 HB2 ARG 38 HB2 ARG 38 -13.079 1.602 -6.846 327 HB3 ARG 38 HB1 ARG 38 -12.930 1.705 -5.099 328 HG2 ARG 38 HG2 ARG 38 -13.772 -0.622 -4.942 329 HG3 ARG 38 HG1 ARG 38 -13.747 -0.705 -6.704 330 HD2 ARG 38 HD2 ARG 38 -11.356 -0.324 -6.712 331 HD3 ARG 38 HD1 ARG 38 -11.354 -0.133 -4.962 332 HE ARG 38 HE ARG 38 -12.475 -2.630 -5.657 333 HH11 ARG 38 HH11 ARG 38 -9.383 -0.984 -5.527 334 HH12 ARG 38 HH12 ARG 38 -8.478 -2.446 -5.285 335 HH21 ARG 38 HH21 ARG 38 -11.280 -4.548 -5.338 336 HH22 ARG 38 HH22 ARG 38 -9.553 -4.464 -5.165 337 H GLN 39 HN GLN 39 -15.856 -0.145 -4.304 338 HA GLN 39 HA GLN 39 -16.851 -1.928 -6.247 339 HB2 GLN 39 HB2 GLN 39 -17.903 -1.677 -3.431 340 HB3 GLN 39 HB1 GLN 39 -17.868 -3.113 -4.443 341 HG2 GLN 39 HG2 GLN 39 -15.462 -1.700 -3.337 342 HG3 GLN 39 HG1 GLN 39 -16.183 -3.156 -2.674 343 HE21 GLN 39 HE21 GLN 39 -16.734 -4.298 -5.315 344 HE22 GLN 39 HE22 GLN 39 -15.208 -4.811 -5.938 345 H ARG 40 HN ARG 40 -18.348 0.688 -4.442 346 HA ARG 40 HA ARG 40 -20.962 0.389 -5.467 347 HB2 ARG 40 HB2 ARG 40 -19.457 2.788 -4.418 348 HB3 ARG 40 HB1 ARG 40 -21.160 2.805 -4.817 349 HG2 ARG 40 HG2 ARG 40 -21.574 1.082 -3.129 350 HG3 ARG 40 HG1 ARG 40 -19.857 1.078 -2.731 351 HD2 ARG 40 HD2 ARG 40 -21.032 2.416 -1.118 352 HD3 ARG 40 HD1 ARG 40 -20.037 3.468 -2.118 353 HE ARG 40 HE ARG 40 -22.211 3.861 -3.394 354 HH11 ARG 40 HH11 ARG 40 -22.107 3.132 0.033 355 HH12 ARG 40 HH12 ARG 40 -23.562 4.003 0.391 356 HH21 ARG 40 HH21 ARG 40 -24.128 4.998 -2.928 357 HH22 ARG 40 HH22 ARG 40 -24.716 5.068 -1.297 358 H LEU 41 HN LEU 41 -18.181 2.333 -6.414 359 HA LEU 41 HA LEU 41 -19.240 3.532 -8.699 360 HB2 LEU 41 HB2 LEU 41 -16.391 2.638 -8.324 361 HB3 LEU 41 HB1 LEU 41 -16.962 3.866 -9.424 362 HG LEU 41 HG LEU 41 -16.829 4.019 -6.422 363 HD11 LEU 41 HD11 LEU 41 -15.337 5.898 -6.892 364 HD12 LEU 41 HD12 LEU 41 -15.499 5.585 -8.622 365 HD13 LEU 41 HD13 LEU 41 -14.734 4.388 -7.574 366 HD21 LEU 41 HD21 LEU 41 -18.000 6.037 -8.334 367 HD22 LEU 41 HD22 LEU 41 -17.731 6.274 -6.604 368 HD23 LEU 41 HD23 LEU 41 -18.902 5.076 -7.160 369 H VAL 42 HN VAL 42 -18.023 0.288 -8.190 370 HA VAL 42 HA VAL 42 -17.656 -0.553 -10.822 371 HB VAL 42 HB VAL 42 -18.681 -2.085 -8.423 372 HG11 VAL 42 HG11 VAL 42 -17.848 -3.161 -11.114 373 HG12 VAL 42 HG12 VAL 42 -19.467 -3.213 -10.414 374 HG13 VAL 42 HG13 VAL 42 -18.155 -4.136 -9.676 375 HG21 VAL 42 HG21 VAL 42 -16.412 -3.037 -8.405 376 HG22 VAL 42 HG22 VAL 42 -16.400 -1.287 -8.194 377 HG23 VAL 42 HG23 VAL 42 -15.974 -1.990 -9.756 378 H GLU 43 HN GLU 43 -20.612 -0.494 -8.865 379 HA GLU 43 HA GLU 43 -22.313 -1.591 -10.835 380 HB2 GLU 43 HB2 GLU 43 -22.989 0.280 -8.558 381 HB3 GLU 43 HB1 GLU 43 -24.143 -0.690 -9.464 382 HG2 GLU 43 HG2 GLU 43 -23.150 -2.722 -8.632 383 HG3 GLU 43 HG1 GLU 43 -21.887 -1.804 -7.812 384 H ARG 44 HN ARG 44 -21.091 1.599 -10.273 385 HA ARG 44 HA ARG 44 -22.943 2.879 -12.078 386 HB2 ARG 44 HB2 ARG 44 -20.446 3.943 -10.733 387 HB3 ARG 44 HB1 ARG 44 -21.636 4.910 -11.603 388 HG2 ARG 44 HG2 ARG 44 -23.348 4.245 -9.975 389 HG3 ARG 44 HG1 ARG 44 -22.134 3.322 -9.093 390 HD2 ARG 44 HD2 ARG 44 -20.872 5.357 -8.666 391 HD3 ARG 44 HD1 ARG 44 -22.041 6.293 -9.597 392 HE ARG 44 HE ARG 44 -23.265 4.849 -7.451 393 HH11 ARG 44 HH11 ARG 44 -21.434 7.724 -8.224 394 HH12 ARG 44 HH12 ARG 44 -22.085 8.651 -6.909 395 HH21 ARG 44 HH21 ARG 44 -24.117 6.063 -5.700 396 HH22 ARG 44 HH22 ARG 44 -23.605 7.704 -5.472 397 H GLY 45 HN GLY 45 -19.698 1.609 -12.146 398 HA2 GLY 45 HA2 GLY 45 -18.708 0.848 -14.167 399 HA3 GLY 45 HA1 GLY 45 -19.629 2.061 -15.044 400 H ASP 46 HN ASP 46 -18.474 3.462 -12.304 401 HA ASP 46 HA ASP 46 -16.580 5.072 -13.726 402 HB2 ASP 46 HB2 ASP 46 -17.960 6.037 -11.965 403 HB3 ASP 46 HB1 ASP 46 -17.279 4.939 -10.789 404 H ALA 47 HN ALA 47 -16.451 2.301 -11.683 405 HA ALA 47 HA ALA 47 -13.681 2.547 -10.969 406 HB1 ALA 47 HB1 ALA 47 -15.545 0.201 -10.694 407 HB2 ALA 47 HB2 ALA 47 -15.270 1.452 -9.482 408 HB3 ALA 47 HB3 ALA 47 -13.961 0.360 -9.937 409 H LYS 48 HN LYS 48 -14.768 2.147 -13.883 410 HA LYS 48 HA LYS 48 -13.654 -0.240 -14.873 411 HB2 LYS 48 HB2 LYS 48 -15.194 1.530 -16.030 412 HB3 LYS 48 HB1 LYS 48 -13.681 2.303 -16.476 413 HG2 LYS 48 HG2 LYS 48 -14.307 -0.565 -17.106 414 HG3 LYS 48 HG1 LYS 48 -14.687 0.771 -18.190 415 HD2 LYS 48 HD2 LYS 48 -12.410 1.279 -18.520 416 HD3 LYS 48 HD1 LYS 48 -11.911 0.291 -17.145 417 HE2 LYS 48 HE2 LYS 48 -12.548 -1.714 -18.306 418 HE3 LYS 48 HE1 LYS 48 -13.189 -0.774 -19.649 419 HZ1 LYS 48 HZ1 LYS 48 -10.342 -0.855 -18.811 420 HZ2 LYS 48 HZ2 LYS 48 -10.966 0.031 -20.108 421 HZ3 LYS 48 HZ3 LYS 48 -10.998 -1.657 -20.147 422 H GLY 49 HN GLY 49 -12.326 3.012 -14.474 423 HA2 GLY 49 HA2 GLY 49 -10.063 3.143 -13.565 424 HA3 GLY 49 HA1 GLY 49 -9.637 1.807 -14.622 425 H THR 50 HN THR 50 -8.460 4.460 -14.371 426 HA THR 50 HA THR 50 -8.939 5.502 -17.076 427 HB THR 50 HB THR 50 -7.451 6.803 -14.781 428 HG1 THR 50 HG1 THR 50 -10.138 6.917 -15.665 429 HG21 THR 50 HG21 THR 50 -7.609 8.839 -16.123 430 HG22 THR 50 HG22 THR 50 -8.422 7.945 -17.405 431 HG23 THR 50 HG23 THR 50 -6.744 7.582 -17.006 432 H GLU 51 HN GLU 51 -7.746 3.995 -18.213 433 HA GLU 51 HA GLU 51 -4.942 3.637 -17.445 434 HB2 GLU 51 HB2 GLU 51 -6.750 1.968 -19.192 435 HB3 GLU 51 HB1 GLU 51 -5.038 1.647 -18.961 436 HG2 GLU 51 HG2 GLU 51 -7.187 1.582 -16.867 437 HG3 GLU 51 HG1 GLU 51 -6.290 0.219 -17.532 438 H LEU 52 HN LEU 52 -3.850 5.254 -18.355 439 HA LEU 52 HA LEU 52 -3.619 5.212 -21.247 440 HB2 LEU 52 HB2 LEU 52 -3.582 7.837 -21.085 441 HB3 LEU 52 HB1 LEU 52 -5.080 6.962 -21.317 442 HG LEU 52 HG LEU 52 -5.462 7.133 -18.831 443 HD11 LEU 52 HD11 LEU 52 -3.183 9.098 -18.991 444 HD12 LEU 52 HD12 LEU 52 -3.172 7.561 -18.125 445 HD13 LEU 52 HD13 LEU 52 -4.249 8.857 -17.606 446 HD21 LEU 52 HD21 LEU 52 -5.246 9.704 -20.390 447 HD22 LEU 52 HD22 LEU 52 -6.221 9.453 -18.941 448 HD23 LEU 52 HD23 LEU 52 -6.600 8.576 -20.424 449 H ASN 53 HN ASN 53 -1.893 4.166 -19.450 450 HA ASN 53 HA ASN 53 0.092 5.873 -18.445 451 HB2 ASN 53 HB2 ASN 53 1.484 3.868 -18.223 452 HB3 ASN 53 HB1 ASN 53 -0.158 3.556 -17.678 453 HD21 ASN 53 HD21 ASN 53 1.936 1.723 -18.586 454 HD22 ASN 53 HD22 ASN 53 1.238 0.826 -19.891 455 H GLY 84 HN GLY 84 20.946 7.606 -15.316 456 HA2 GLY 84 HA2 GLY 84 22.446 5.802 -17.067 457 HA3 GLY 84 HA1 GLY 84 23.340 7.054 -16.217 458 HA PRO 85 HA PRO 85 22.191 3.519 -13.219 459 HB2 PRO 85 HB2 PRO 85 22.680 1.108 -14.218 460 HB3 PRO 85 HB1 PRO 85 21.165 1.940 -14.590 461 HG2 PRO 85 HG2 PRO 85 23.629 1.652 -16.256 462 HG3 PRO 85 HG1 PRO 85 21.929 1.531 -16.744 463 HD2 PRO 85 HD2 PRO 85 23.509 3.791 -17.049 464 HD3 PRO 85 HD1 PRO 85 21.736 3.787 -17.023 465 H LEU 86 HN LEU 86 23.751 1.539 -12.464 466 HA LEU 86 HA LEU 86 26.150 2.542 -11.656 467 HB2 LEU 86 HB2 LEU 86 26.836 0.325 -11.101 468 HB3 LEU 86 HB1 LEU 86 25.115 0.454 -10.824 469 HG LEU 86 HG LEU 86 26.359 -0.884 -13.233 470 HD11 LEU 86 HD11 LEU 86 25.194 -2.092 -10.731 471 HD12 LEU 86 HD12 LEU 86 26.896 -2.087 -11.189 472 HD13 LEU 86 HD13 LEU 86 25.725 -2.982 -12.158 473 HD21 LEU 86 HD21 LEU 86 24.097 -1.840 -13.520 474 HD22 LEU 86 HD22 LEU 86 24.137 -0.088 -13.722 475 HD23 LEU 86 HD23 LEU 86 23.519 -0.790 -12.225 476 H GLY 87 HN GLY 87 27.539 3.544 -12.969 477 HA2 GLY 87 HA2 GLY 87 28.397 2.130 -15.412 478 HA3 GLY 87 HA1 GLY 87 28.407 3.876 -15.216 479 H SER 88 HN SER 88 29.804 4.644 -13.342 480 HA SER 88 HA SER 88 32.427 3.480 -13.801 481 HB2 SER 88 HB2 SER 88 31.660 6.048 -12.397 482 HB3 SER 88 HB1 SER 88 33.287 5.569 -12.875 483 HG SER 88 HG SER 88 31.815 5.379 -15.035 484 H ARG 89 HN ARG 89 30.156 4.024 -11.167 485 HA ARG 89 HA ARG 89 32.117 3.381 -9.144 486 HB2 ARG 89 HB2 ARG 89 29.128 3.614 -8.792 487 HB3 ARG 89 HB1 ARG 89 30.361 3.736 -7.546 488 HG2 ARG 89 HG2 ARG 89 29.835 5.692 -9.769 489 HG3 ARG 89 HG1 ARG 89 29.513 5.920 -8.052 490 HD2 ARG 89 HD2 ARG 89 31.928 5.763 -7.602 491 HD3 ARG 89 HD1 ARG 89 32.225 5.596 -9.333 492 HE ARG 89 HE ARG 89 30.764 7.957 -8.459 493 HH11 ARG 89 HH11 ARG 89 33.834 6.592 -9.471 494 HH12 ARG 89 HH12 ARG 89 34.505 8.129 -9.912 495 HH21 ARG 89 HH21 ARG 89 31.660 9.969 -9.031 496 HH22 ARG 89 HH22 ARG 89 33.274 10.040 -9.659 497 H ARG 90 HN ARG 90 28.887 1.979 -9.673 498 HA ARG 90 HA ARG 90 28.116 -0.152 -9.653 499 HB2 ARG 90 HB2 ARG 90 30.960 -0.910 -10.349 500 HB3 ARG 90 HB1 ARG 90 29.555 -1.958 -10.486 501 HG2 ARG 90 HG2 ARG 90 28.598 -0.448 -12.159 502 HG3 ARG 90 HG1 ARG 90 30.025 0.583 -12.033 503 HD2 ARG 90 HD2 ARG 90 31.425 -1.298 -12.765 504 HD3 ARG 90 HD1 ARG 90 29.984 -2.296 -12.925 505 HE ARG 90 HE ARG 90 30.436 0.148 -14.521 506 HH11 ARG 90 HH11 ARG 90 29.398 -3.194 -14.250 507 HH12 ARG 90 HH12 ARG 90 28.926 -3.311 -15.916 508 HH21 ARG 90 HH21 ARG 90 29.824 -0.019 -16.715 509 HH22 ARG 90 HH22 ARG 90 29.165 -1.510 -17.314 510 H PHE 91 HN PHE 91 28.874 -2.510 -8.705 511 HA PHE 91 HA PHE 91 29.179 -3.742 -6.825 512 HB2 PHE 91 HB2 PHE 91 31.363 -1.701 -6.368 513 HB3 PHE 91 HB1 PHE 91 31.184 -3.187 -5.443 514 HD1 PHE 91 HD1 PHE 91 32.238 -1.716 -8.594 515 HD2 PHE 91 HD2 PHE 91 31.596 -5.358 -6.486 516 HE1 PHE 91 HE1 PHE 91 33.572 -2.921 -10.274 517 HE2 PHE 91 HE2 PHE 91 32.929 -6.566 -8.162 518 HZ PHE 91 HZ PHE 91 33.919 -5.348 -10.059 519 H VAL 92 HN VAL 92 30.154 -2.689 -4.245 520 HA VAL 92 HA VAL 92 27.719 -2.336 -2.978 521 HB VAL 92 HB VAL 92 29.795 -3.088 -1.870 522 HG11 VAL 92 HG11 VAL 92 30.568 -0.178 -1.896 523 HG12 VAL 92 HG12 VAL 92 31.345 -1.463 -2.819 524 HG13 VAL 92 HG13 VAL 92 31.420 -1.473 -1.057 525 HG21 VAL 92 HG21 VAL 92 28.429 -0.745 -0.564 526 HG22 VAL 92 HG22 VAL 92 29.410 -1.948 0.273 527 HG23 VAL 92 HG23 VAL 92 27.906 -2.428 -0.514 528 H VAL 93 HN VAL 93 29.768 0.063 -4.463 529 HA VAL 93 HA VAL 93 28.801 2.328 -3.076 530 HB VAL 93 HB VAL 93 29.906 2.236 -5.876 531 HG11 VAL 93 HG11 VAL 93 28.785 4.333 -5.379 532 HG12 VAL 93 HG12 VAL 93 30.531 4.576 -5.445 533 HG13 VAL 93 HG13 VAL 93 29.712 4.494 -3.886 534 HG21 VAL 93 HG21 VAL 93 31.329 2.572 -3.242 535 HG22 VAL 93 HG22 VAL 93 32.067 2.776 -4.830 536 HG23 VAL 93 HG23 VAL 93 31.459 1.195 -4.337 537 H ASP 94 HN ASP 94 27.906 0.920 -6.230 538 HA ASP 94 HA ASP 94 25.689 2.719 -6.496 539 HB2 ASP 94 HB2 ASP 94 26.973 0.681 -8.157 540 HB3 ASP 94 HB1 ASP 94 25.229 0.763 -8.336 541 H ASP 95 HN ASP 95 26.157 -0.508 -5.189 542 HA ASP 95 HA ASP 95 23.410 -1.210 -5.054 543 HB2 ASP 95 HB2 ASP 95 25.786 -2.005 -3.399 544 HB3 ASP 95 HB1 ASP 95 24.160 -2.470 -2.902 545 H ARG 96 HN ARG 96 25.206 1.182 -3.539 546 HA ARG 96 HA ARG 96 23.381 1.467 -1.272 547 HB2 ARG 96 HB2 ARG 96 25.835 1.752 -0.930 548 HB3 ARG 96 HB1 ARG 96 25.800 3.117 -2.035 549 HG2 ARG 96 HG2 ARG 96 24.195 4.233 -0.486 550 HG3 ARG 96 HG1 ARG 96 24.470 2.913 0.652 551 HD2 ARG 96 HD2 ARG 96 26.421 4.968 -0.339 552 HD3 ARG 96 HD1 ARG 96 25.942 4.618 1.322 553 HE ARG 96 HE ARG 96 27.063 2.347 0.798 554 HH11 ARG 96 HH11 ARG 96 28.157 5.509 -0.226 555 HH12 ARG 96 HH12 ARG 96 29.804 5.004 -0.452 556 HH21 ARG 96 HH21 ARG 96 29.228 1.682 0.511 557 HH22 ARG 96 HH22 ARG 96 30.415 2.834 -0.019 558 H ARG 97 HN ARG 97 24.835 3.519 -3.719 559 HA ARG 97 HA ARG 97 23.193 5.697 -3.738 560 HB2 ARG 97 HB2 ARG 97 25.182 5.642 -5.048 561 HB3 ARG 97 HB1 ARG 97 24.622 4.257 -5.963 562 HG2 ARG 97 HG2 ARG 97 22.779 5.786 -6.829 563 HG3 ARG 97 HG1 ARG 97 23.748 7.111 -6.175 564 HD2 ARG 97 HD2 ARG 97 25.647 6.414 -7.517 565 HD3 ARG 97 HD1 ARG 97 24.733 5.033 -8.124 566 HE ARG 97 HE ARG 97 23.489 7.573 -8.653 567 HH11 ARG 97 HH11 ARG 97 25.736 5.138 -9.798 568 HH12 ARG 97 HH12 ARG 97 25.683 5.685 -11.446 569 HH21 ARG 97 HH21 ARG 97 23.392 8.268 -10.843 570 HH22 ARG 97 HH22 ARG 97 24.349 7.451 -12.039 571 H GLU 98 HN GLU 98 22.775 2.737 -5.652 572 HA GLU 98 HA GLU 98 20.375 3.632 -6.902 573 HB2 GLU 98 HB2 GLU 98 22.001 1.145 -6.848 574 HB3 GLU 98 HB1 GLU 98 20.336 1.060 -7.455 575 HG2 GLU 98 HG2 GLU 98 20.963 2.957 -9.008 576 HG3 GLU 98 HG1 GLU 98 22.632 2.668 -8.523 577 H LEU 99 HN LEU 99 21.078 1.460 -4.196 578 HA LEU 99 HA LEU 99 18.429 0.514 -3.917 579 HB2 LEU 99 HB2 LEU 99 20.209 -0.741 -2.992 580 HB3 LEU 99 HB1 LEU 99 20.805 0.624 -2.088 581 HG LEU 99 HG LEU 99 19.571 -1.380 -0.927 582 HD11 LEU 99 HD11 LEU 99 18.989 0.137 0.892 583 HD12 LEU 99 HD12 LEU 99 19.156 1.510 -0.207 584 HD13 LEU 99 HD13 LEU 99 20.563 0.511 0.182 585 HD21 LEU 99 HD21 LEU 99 17.490 -1.204 -2.197 586 HD22 LEU 99 HD22 LEU 99 17.264 0.441 -1.609 587 HD23 LEU 99 HD23 LEU 99 17.222 -0.913 -0.481 588 H GLN 100 HN GLN 100 20.207 3.066 -2.103 589 HA GLN 100 HA GLN 100 17.934 3.890 -0.638 590 HB2 GLN 100 HB2 GLN 100 19.193 5.877 -0.076 591 HB3 GLN 100 HB1 GLN 100 20.257 4.481 -0.036 592 HG2 GLN 100 HG2 GLN 100 21.108 5.090 -2.257 593 HG3 GLN 100 HG1 GLN 100 20.091 6.528 -2.225 594 HE21 GLN 100 HE21 GLN 100 20.619 8.219 -0.852 595 HE22 GLN 100 HE22 GLN 100 22.177 8.351 -0.112 596 H TYR 101 HN TYR 101 19.150 4.637 -3.793 597 HA TYR 101 HA TYR 101 17.705 6.845 -4.568 598 HB2 TYR 101 HB2 TYR 101 19.338 5.883 -6.048 599 HB3 TYR 101 HB1 TYR 101 18.445 4.368 -6.155 600 HD1 TYR 101 HD1 TYR 101 18.612 7.861 -7.283 601 HD2 TYR 101 HD2 TYR 101 16.518 4.171 -7.604 602 HE1 TYR 101 HE1 TYR 101 17.487 8.680 -9.310 603 HE2 TYR 101 HE2 TYR 101 15.389 4.981 -9.628 604 HH TYR 101 HH TYR 101 16.357 7.864 -11.244 605 H ARG 102 HN ARG 102 16.610 3.451 -4.541 606 HA ARG 102 HA ARG 102 14.049 4.216 -5.634 607 HB2 ARG 102 HB2 ARG 102 13.445 1.876 -5.507 608 HB3 ARG 102 HB1 ARG 102 15.032 2.053 -6.237 609 HG2 ARG 102 HG2 ARG 102 16.101 1.324 -4.208 610 HG3 ARG 102 HG1 ARG 102 14.548 1.284 -3.367 611 HD2 ARG 102 HD2 ARG 102 13.759 -0.456 -4.875 612 HD3 ARG 102 HD1 ARG 102 15.275 -0.390 -5.766 613 HE ARG 102 HE ARG 102 16.368 -1.417 -3.940 614 HH11 ARG 102 HH11 ARG 102 12.915 -1.105 -3.448 615 HH12 ARG 102 HH12 ARG 102 12.837 -2.384 -2.277 616 HH21 ARG 102 HH21 ARG 102 16.266 -3.115 -2.411 617 HH22 ARG 102 HH22 ARG 102 14.745 -3.519 -1.679 618 H VAL 103 HN VAL 103 15.389 3.898 -2.489 619 HA VAL 103 HA VAL 103 12.936 3.338 -1.128 620 HB VAL 103 HB VAL 103 15.355 4.651 0.105 621 HG11 VAL 103 HG11 VAL 103 13.390 4.577 1.511 622 HG12 VAL 103 HG12 VAL 103 14.604 3.439 2.108 623 HG13 VAL 103 HG13 VAL 103 13.206 2.851 1.205 624 HG21 VAL 103 HG21 VAL 103 16.110 2.681 -1.134 625 HG22 VAL 103 HG22 VAL 103 14.898 1.699 -0.310 626 HG23 VAL 103 HG23 VAL 103 16.214 2.431 0.608 627 H GLU 104 HN GLU 104 14.780 6.297 -1.809 628 HA GLU 104 HA GLU 104 13.007 8.016 -0.415 629 HB2 GLU 104 HB2 GLU 104 14.134 9.842 -1.738 630 HB3 GLU 104 HB1 GLU 104 15.223 8.817 -0.814 631 HG2 GLU 104 HG2 GLU 104 16.349 8.338 -2.629 632 HG3 GLU 104 HG1 GLU 104 14.897 7.672 -3.353 633 H VAL 105 HN VAL 105 13.191 7.099 -3.861 634 HA VAL 105 HA VAL 105 11.069 8.751 -4.664 635 HB VAL 105 HB VAL 105 12.177 7.955 -6.509 636 HG11 VAL 105 HG11 VAL 105 12.078 5.174 -5.372 637 HG12 VAL 105 HG12 VAL 105 13.482 6.244 -5.389 638 HG13 VAL 105 HG13 VAL 105 12.816 5.636 -6.906 639 HG21 VAL 105 HG21 VAL 105 9.845 6.090 -6.253 640 HG22 VAL 105 HG22 VAL 105 10.741 6.389 -7.739 641 HG23 VAL 105 HG23 VAL 105 9.846 7.700 -6.973 642 H GLN 106 HN GLN 106 11.106 5.502 -3.270 643 HA GLN 106 HA GLN 106 8.377 4.974 -3.519 644 HB2 GLN 106 HB2 GLN 106 10.455 4.104 -1.536 645 HB3 GLN 106 HB1 GLN 106 8.775 3.641 -1.319 646 HG2 GLN 106 HG2 GLN 106 10.467 3.046 -3.728 647 HG3 GLN 106 HG1 GLN 106 10.036 1.906 -2.456 648 HE21 GLN 106 HE21 GLN 106 8.896 3.685 -5.222 649 HE22 GLN 106 HE22 GLN 106 7.415 2.816 -5.416 650 H ASN 107 HN ASN 107 10.119 6.742 -0.964 651 HA ASN 107 HA ASN 107 7.883 7.382 0.615 652 HB2 ASN 107 HB2 ASN 107 9.933 7.874 1.618 653 HB3 ASN 107 HB1 ASN 107 10.549 8.720 0.199 654 HD21 ASN 107 HD21 ASN 107 8.357 8.922 2.928 655 HD22 ASN 107 HD22 ASN 107 8.244 10.646 2.950 656 H ARG 108 HN ARG 108 9.312 9.034 -2.151 657 HA ARG 108 HA ARG 108 7.662 11.323 -2.071 658 HB2 ARG 108 HB2 ARG 108 9.307 10.094 -4.280 659 HB3 ARG 108 HB1 ARG 108 8.544 11.673 -4.386 660 HG2 ARG 108 HG2 ARG 108 9.940 12.596 -2.766 661 HG3 ARG 108 HG1 ARG 108 10.404 11.017 -2.135 662 HD2 ARG 108 HD2 ARG 108 12.236 11.998 -3.376 663 HD3 ARG 108 HD1 ARG 108 11.634 10.568 -4.209 664 HE ARG 108 HE ARG 108 10.365 12.888 -5.206 665 HH11 ARG 108 HH11 ARG 108 13.417 11.143 -5.304 666 HH12 ARG 108 HH12 ARG 108 13.879 11.822 -6.838 667 HH21 ARG 108 HH21 ARG 108 10.981 13.754 -7.220 668 HH22 ARG 108 HH22 ARG 108 12.499 13.299 -7.923 669 H VAL 109 HN VAL 109 7.542 8.435 -4.122 670 HA VAL 109 HA VAL 109 5.291 9.099 -5.635 671 HB VAL 109 HB VAL 109 6.239 6.356 -4.802 672 HG11 VAL 109 HG11 VAL 109 5.058 5.548 -6.786 673 HG12 VAL 109 HG12 VAL 109 4.429 7.171 -7.072 674 HG13 VAL 109 HG13 VAL 109 3.948 6.281 -5.628 675 HG21 VAL 109 HG21 VAL 109 6.882 8.082 -7.180 676 HG22 VAL 109 HG22 VAL 109 7.294 6.370 -7.059 677 HG23 VAL 109 HG23 VAL 109 7.992 7.526 -5.921 678 H TYR 110 HN TYR 110 5.542 7.363 -2.562 679 HA TYR 110 HA TYR 110 2.824 6.681 -2.337 680 HB2 TYR 110 HB2 TYR 110 4.990 7.056 -0.278 681 HB3 TYR 110 HB1 TYR 110 3.366 6.544 0.147 682 HD1 TYR 110 HD1 TYR 110 4.877 4.666 1.144 683 HD2 TYR 110 HD2 TYR 110 4.200 5.220 -3.019 684 HE1 TYR 110 HE1 TYR 110 5.500 2.330 0.736 685 HE2 TYR 110 HE2 TYR 110 4.822 2.881 -3.434 686 HH TYR 110 HH TYR 110 6.262 1.131 -2.269 687 H LYS 111 HN LYS 111 4.616 9.557 -1.422 688 HA LYS 111 HA LYS 111 2.588 10.845 0.045 689 HB2 LYS 111 HB2 LYS 111 4.960 11.564 0.018 690 HB3 LYS 111 HB1 LYS 111 4.775 12.073 -1.654 691 HG2 LYS 111 HG2 LYS 111 4.685 13.976 -0.159 692 HG3 LYS 111 HG1 LYS 111 3.133 13.745 -0.965 693 HD2 LYS 111 HD2 LYS 111 2.217 12.701 1.017 694 HD3 LYS 111 HD1 LYS 111 3.784 12.790 1.823 695 HE2 LYS 111 HE2 LYS 111 2.226 14.564 2.548 696 HE3 LYS 111 HE1 LYS 111 3.698 15.202 1.815 697 HZ1 LYS 111 HZ1 LYS 111 1.656 16.328 1.062 698 HZ2 LYS 111 HZ2 LYS 111 1.118 14.879 0.384 699 HZ3 LYS 111 HZ3 LYS 111 2.517 15.624 -0.207 700 H LYS 112 HN LYS 112 3.369 10.722 -3.366 701 HA LYS 112 HA LYS 112 1.427 12.584 -4.251 702 HB2 LYS 112 HB2 LYS 112 2.915 10.360 -5.646 703 HB3 LYS 112 HB1 LYS 112 1.828 11.461 -6.485 704 HG2 LYS 112 HG2 LYS 112 3.232 13.263 -6.230 705 HG3 LYS 112 HG1 LYS 112 4.022 12.583 -4.808 706 HD2 LYS 112 HD2 LYS 112 5.479 12.620 -6.803 707 HD3 LYS 112 HD1 LYS 112 5.215 10.995 -6.175 708 HE2 LYS 112 HE2 LYS 112 3.537 10.600 -7.896 709 HE3 LYS 112 HE1 LYS 112 3.781 12.230 -8.520 710 HZ1 LYS 112 HZ1 LYS 112 4.990 10.541 -9.788 711 HZ2 LYS 112 HZ2 LYS 112 5.871 10.128 -8.406 712 HZ3 LYS 112 HZ3 LYS 112 6.037 11.664 -9.084 713 H GLU 113 HN GLU 113 1.355 9.126 -3.620 714 HA GLU 113 HA GLU 113 -1.138 8.564 -4.813 715 HB2 GLU 113 HB2 GLU 113 0.125 7.240 -2.402 716 HB3 GLU 113 HB1 GLU 113 -1.223 6.598 -3.332 717 HG2 GLU 113 HG2 GLU 113 0.368 6.723 -5.335 718 HG3 GLU 113 HG1 GLU 113 1.644 6.869 -4.124 719 H ILE 114 HN ILE 114 -0.252 9.564 -1.536 720 HA ILE 114 HA ILE 114 -2.803 9.463 -0.403 721 HB ILE 114 HB ILE 114 -0.493 11.282 0.265 722 HG12 ILE 114 HG12 ILE 114 -1.343 8.609 1.400 723 HG13 ILE 114 HG11 ILE 114 0.015 8.873 0.318 724 HG21 ILE 114 HG21 ILE 114 -1.562 11.402 2.509 725 HG22 ILE 114 HG22 ILE 114 -2.975 10.590 1.832 726 HG23 ILE 114 HG23 ILE 114 -2.499 12.182 1.229 727 HD11 ILE 114 HD11 ILE 114 0.665 8.624 2.669 728 HD12 ILE 114 HD12 ILE 114 -0.236 10.092 3.049 729 HD13 ILE 114 HD13 ILE 114 1.154 10.165 1.966 730 H GLN 115 HN GLN 115 -1.190 12.027 -2.203 731 HA GLN 115 HA GLN 115 -3.124 14.036 -1.787 732 HB2 GLN 115 HB2 GLN 115 -1.360 13.680 -4.205 733 HB3 GLN 115 HB1 GLN 115 -2.073 15.179 -3.620 734 HG2 GLN 115 HG2 GLN 115 -0.740 14.936 -1.542 735 HG3 GLN 115 HG1 GLN 115 0.032 13.527 -2.269 736 HE21 GLN 115 HE21 GLN 115 -0.332 16.984 -2.436 737 HE22 GLN 115 HE22 GLN 115 1.047 17.277 -3.436 738 H ALA 116 HN ALA 116 -2.730 11.571 -4.280 739 HA ALA 116 HA ALA 116 -5.026 12.212 -5.804 740 HB1 ALA 116 HB1 ALA 116 -4.842 9.941 -6.686 741 HB2 ALA 116 HB2 ALA 116 -3.724 9.519 -5.389 742 HB3 ALA 116 HB3 ALA 116 -3.254 10.708 -6.605 743 H LEU 117 HN LEU 117 -4.465 9.959 -3.162 744 HA LEU 117 HA LEU 117 -7.023 8.905 -2.846 745 HB2 LEU 117 HB2 LEU 117 -4.596 9.198 -1.202 746 HB3 LEU 117 HB1 LEU 117 -6.074 8.965 -0.299 747 HG LEU 117 HG LEU 117 -6.319 6.786 -0.993 748 HD11 LEU 117 HD11 LEU 117 -4.651 7.414 -3.426 749 HD12 LEU 117 HD12 LEU 117 -6.399 7.173 -3.383 750 HD13 LEU 117 HD13 LEU 117 -5.315 5.832 -3.018 751 HD21 LEU 117 HD21 LEU 117 -3.349 7.172 -1.305 752 HD22 LEU 117 HD22 LEU 117 -4.190 5.692 -0.841 753 HD23 LEU 117 HD23 LEU 117 -4.198 7.084 0.241 754 H ASP 118 HN ASP 118 -5.688 11.960 -1.812 755 HA ASP 118 HA ASP 118 -7.670 12.608 0.097 756 HB2 ASP 118 HB2 ASP 118 -5.449 13.701 -0.055 757 HB3 ASP 118 HB1 ASP 118 -5.965 14.495 -1.542 758 H ALA 119 HN ALA 119 -7.496 12.969 -3.383 759 HA ALA 119 HA ALA 119 -9.848 14.552 -3.657 760 HB1 ALA 119 HB1 ALA 119 -8.219 14.365 -5.468 761 HB2 ALA 119 HB2 ALA 119 -9.816 13.839 -6.003 762 HB3 ALA 119 HB3 ALA 119 -8.575 12.644 -5.620 763 H GLU 120 HN GLU 120 -9.163 11.083 -3.690 764 HA GLU 120 HA GLU 120 -11.811 10.215 -3.983 765 HB2 GLU 120 HB2 GLU 120 -9.296 9.000 -2.931 766 HB3 GLU 120 HB1 GLU 120 -10.819 8.176 -2.684 767 HG2 GLU 120 HG2 GLU 120 -9.728 7.289 -4.605 768 HG3 GLU 120 HG1 GLU 120 -11.189 8.134 -5.102 769 H ILE 121 HN ILE 121 -9.993 11.348 -1.204 770 HA ILE 121 HA ILE 121 -11.676 10.534 0.840 771 HB ILE 121 HB ILE 121 -9.697 12.648 0.519 772 HG12 ILE 121 HG12 ILE 121 -9.186 12.015 2.869 773 HG13 ILE 121 HG11 ILE 121 -10.610 10.979 2.870 774 HG21 ILE 121 HG21 ILE 121 -11.964 13.171 2.439 775 HG22 ILE 121 HG22 ILE 121 -11.510 14.152 1.045 776 HG23 ILE 121 HG23 ILE 121 -10.418 14.025 2.422 777 HD11 ILE 121 HD11 ILE 121 -9.616 9.630 1.091 778 HD12 ILE 121 HD12 ILE 121 -8.597 9.687 2.530 779 HD13 ILE 121 HD13 ILE 121 -8.187 10.662 1.117 780 H ARG 122 HN ARG 122 -12.144 13.083 -1.549 781 HA ARG 122 HA ARG 122 -14.401 14.251 -0.329 782 HB2 ARG 122 HB2 ARG 122 -13.223 15.343 -2.188 783 HB3 ARG 122 HB1 ARG 122 -13.781 14.085 -3.283 784 HG2 ARG 122 HG2 ARG 122 -15.135 16.082 -3.518 785 HG3 ARG 122 HG1 ARG 122 -16.101 14.758 -2.862 786 HD2 ARG 122 HD2 ARG 122 -15.473 15.755 -0.558 787 HD3 ARG 122 HD1 ARG 122 -15.054 17.199 -1.475 788 HE ARG 122 HE ARG 122 -17.473 16.907 -2.360 789 HH11 ARG 122 HH11 ARG 122 -16.342 16.298 0.904 790 HH12 ARG 122 HH12 ARG 122 -17.902 16.571 1.635 791 HH21 ARG 122 HH21 ARG 122 -19.516 17.290 -1.405 792 HH22 ARG 122 HH22 ARG 122 -19.701 17.154 0.315 793 H LYS 123 HN LYS 123 -14.175 11.616 -2.749 794 HA LYS 123 HA LYS 123 -16.956 11.165 -2.934 795 HB2 LYS 123 HB2 LYS 123 -16.483 9.087 -3.952 796 HB3 LYS 123 HB1 LYS 123 -15.153 10.129 -4.399 797 HG2 LYS 123 HG2 LYS 123 -14.090 9.019 -2.225 798 HG3 LYS 123 HG1 LYS 123 -15.174 7.719 -2.702 799 HD2 LYS 123 HD2 LYS 123 -13.119 9.029 -4.473 800 HD3 LYS 123 HD1 LYS 123 -12.920 7.477 -3.663 801 HE2 LYS 123 HE2 LYS 123 -14.549 6.463 -4.988 802 HE3 LYS 123 HE1 LYS 123 -15.190 8.012 -5.542 803 HZ1 LYS 123 HZ1 LYS 123 -13.062 8.375 -6.707 804 HZ2 LYS 123 HZ2 LYS 123 -13.898 7.027 -7.288 805 HZ3 LYS 123 HZ3 LYS 123 -12.567 6.817 -6.269 806 H LEU 124 HN LEU 124 -14.544 10.017 -0.684 807 HA LEU 124 HA LEU 124 -16.148 8.280 0.818 808 HB2 LEU 124 HB2 LEU 124 -13.781 9.974 1.592 809 HB3 LEU 124 HB1 LEU 124 -14.527 8.820 2.680 810 HG LEU 124 HG LEU 124 -13.211 8.151 0.042 811 HD11 LEU 124 HD11 LEU 124 -11.602 8.817 1.750 812 HD12 LEU 124 HD12 LEU 124 -11.511 7.082 1.450 813 HD13 LEU 124 HD13 LEU 124 -12.326 7.685 2.891 814 HD21 LEU 124 HD21 LEU 124 -15.030 6.637 0.529 815 HD22 LEU 124 HD22 LEU 124 -14.427 6.394 2.166 816 HD23 LEU 124 HD23 LEU 124 -13.489 5.823 0.787 817 H GLU 125 HN GLU 125 -15.444 11.749 1.270 818 HA GLU 125 HA GLU 125 -16.940 12.145 3.575 819 HB2 GLU 125 HB2 GLU 125 -16.461 14.063 1.303 820 HB3 GLU 125 HB1 GLU 125 -17.095 14.515 2.878 821 HG2 GLU 125 HG2 GLU 125 -15.006 13.712 3.912 822 HG3 GLU 125 HG1 GLU 125 -14.379 13.361 2.306 823 H ARG 126 HN ARG 126 -17.988 12.006 0.231 824 HA ARG 126 HA ARG 126 -20.604 12.990 0.603 825 HB2 ARG 126 HB2 ARG 126 -19.559 11.024 -1.444 826 HB3 ARG 126 HB1 ARG 126 -21.107 11.860 -1.537 827 HG2 ARG 126 HG2 ARG 126 -20.019 13.986 -1.726 828 HG3 ARG 126 HG1 ARG 126 -18.441 13.255 -1.434 829 HD2 ARG 126 HD2 ARG 126 -18.701 13.694 -3.787 830 HD3 ARG 126 HD1 ARG 126 -18.698 11.953 -3.513 831 HE ARG 126 HE ARG 126 -21.339 12.682 -3.493 832 HH11 ARG 126 HH11 ARG 126 -18.691 12.946 -5.765 833 HH12 ARG 126 HH12 ARG 126 -19.716 12.863 -7.164 834 HH21 ARG 126 HH21 ARG 126 -22.689 12.583 -5.325 835 HH22 ARG 126 HH22 ARG 126 -21.993 12.671 -6.912 836 H LEU 127 HN LEU 127 -19.130 9.942 1.261 837 HA LEU 127 HA LEU 127 -21.626 8.602 1.899 838 HB2 LEU 127 HB2 LEU 127 -19.804 7.330 0.966 839 HB3 LEU 127 HB1 LEU 127 -18.719 7.858 2.231 840 HG LEU 127 HG LEU 127 -20.405 6.618 3.798 841 HD11 LEU 127 HD11 LEU 127 -22.060 6.218 2.010 842 HD12 LEU 127 HD12 LEU 127 -21.494 4.729 2.765 843 HD13 LEU 127 HD13 LEU 127 -20.882 5.203 1.180 844 HD21 LEU 127 HD21 LEU 127 -18.487 5.183 1.967 845 HD22 LEU 127 HD22 LEU 127 -19.102 4.562 3.496 846 HD23 LEU 127 HD23 LEU 127 -18.078 5.997 3.476 847 H LEU 128 HN LEU 128 -18.675 9.428 3.722 848 HA LEU 128 HA LEU 128 -19.424 9.113 6.294 849 HB2 LEU 128 HB2 LEU 128 -17.704 11.160 4.949 850 HB3 LEU 128 HB1 LEU 128 -17.899 11.160 6.685 851 HG LEU 128 HG LEU 128 -16.916 8.962 6.825 852 HD11 LEU 128 HD11 LEU 128 -16.595 9.053 3.854 853 HD12 LEU 128 HD12 LEU 128 -17.656 7.973 4.759 854 HD13 LEU 128 HD13 LEU 128 -15.907 7.839 4.933 855 HD21 LEU 128 HD21 LEU 128 -15.290 10.866 5.158 856 HD22 LEU 128 HD22 LEU 128 -14.633 9.531 6.108 857 HD23 LEU 128 HD23 LEU 128 -15.436 10.875 6.916 858 H GLU 129 HN GLU 129 -19.587 12.311 4.702 859 HA GLU 129 HA GLU 129 -20.796 13.576 6.904 860 HB2 GLU 129 HB2 GLU 129 -20.836 14.470 4.016 861 HB3 GLU 129 HB1 GLU 129 -21.106 15.488 5.423 862 HG2 GLU 129 HG2 GLU 129 -18.807 15.093 6.147 863 HG3 GLU 129 HG1 GLU 129 -18.538 14.073 4.735 864 H SER 130 HN SER 130 -22.145 11.888 4.186 865 HA SER 130 HA SER 130 -24.768 12.993 4.371 866 HB2 SER 130 HB2 SER 130 -23.861 11.984 2.298 867 HB3 SER 130 HB1 SER 130 -23.865 10.408 3.082 868 HG SER 130 HG SER 130 -26.219 11.950 2.929 869 H GLY 131 HN GLY 131 -23.090 10.815 6.306 870 HA2 GLY 131 HA2 GLY 131 -23.854 9.813 8.257 871 HA3 GLY 131 HA1 GLY 131 -25.503 10.184 7.778 872 H LEU 132 HN LEU 132 -23.549 8.670 5.424 873 HA LEU 132 HA LEU 132 -25.243 6.342 5.471 874 HB2 LEU 132 HB2 LEU 132 -22.845 6.965 3.726 875 HB3 LEU 132 HB1 LEU 132 -23.982 5.651 3.482 876 HG LEU 132 HG LEU 132 -24.619 8.595 3.298 877 HD11 LEU 132 HD11 LEU 132 -24.443 6.457 1.184 878 HD12 LEU 132 HD12 LEU 132 -23.306 7.782 1.423 879 HD13 LEU 132 HD13 LEU 132 -24.962 8.122 0.925 880 HD21 LEU 132 HD21 LEU 132 -26.818 7.867 2.509 881 HD22 LEU 132 HD22 LEU 132 -26.518 7.348 4.167 882 HD23 LEU 132 HD23 LEU 132 -26.381 6.191 2.842 883 H THR 133 HN THR 133 -21.688 6.600 5.352 884 HA THR 133 HA THR 133 -21.598 4.551 7.465 885 HB THR 133 HB THR 133 -19.462 4.928 5.362 886 HG1 THR 133 HG1 THR 133 -21.715 3.194 5.429 887 HG21 THR 133 HG21 THR 133 -20.009 2.685 7.310 888 HG22 THR 133 HG22 THR 133 -18.734 3.893 7.467 889 HG23 THR 133 HG23 THR 133 -18.693 2.736 6.136 Start of MODEL 4 1 H1 MET 1 HT1 MET 1 34.745 10.117 -1.307 2 H2 MET 1 HT2 MET 1 34.619 9.321 0.174 3 H3 MET 1 HT3 MET 1 33.312 9.319 -0.896 4 HA MET 1 HA MET 1 34.579 8.052 -2.493 5 HB2 MET 1 HB2 MET 1 36.671 8.115 -0.317 6 HB3 MET 1 HB1 MET 1 36.704 6.977 -1.655 7 HG2 MET 1 HG2 MET 1 36.780 8.886 -3.221 8 HG3 MET 1 HG1 MET 1 36.872 9.973 -1.837 9 HE1 MET 1 HE1 MET 1 40.506 10.126 -3.283 10 HE2 MET 1 HE2 MET 1 39.091 11.059 -2.795 11 HE3 MET 1 HE3 MET 1 39.004 9.993 -4.197 12 H ASP 2 HN ASP 2 35.065 5.630 -2.163 13 HA ASP 2 HA ASP 2 32.793 4.467 -1.116 14 HB2 ASP 2 HB2 ASP 2 34.264 3.400 -2.775 15 HB3 ASP 2 HB1 ASP 2 35.488 3.161 -1.535 16 H SER 3 HN SER 3 36.046 4.392 0.322 17 HA SER 3 HA SER 3 35.053 3.112 2.706 18 HB2 SER 3 HB2 SER 3 37.820 4.179 2.113 19 HB3 SER 3 HB1 SER 3 37.380 3.038 3.383 20 HG SER 3 HG SER 3 36.627 1.651 1.616 21 H ALA 4 HN ALA 4 34.681 6.152 1.791 22 HA ALA 4 HA ALA 4 35.610 7.428 4.258 23 HB1 ALA 4 HB1 ALA 4 36.122 8.498 2.101 24 HB2 ALA 4 HB2 ALA 4 35.152 9.527 3.153 25 HB3 ALA 4 HB3 ALA 4 34.395 8.678 1.804 26 H ILE 5 HN ILE 5 32.816 6.112 2.893 27 HA ILE 5 HA ILE 5 30.807 7.816 3.847 28 HB ILE 5 HB ILE 5 30.625 4.826 3.442 29 HG12 ILE 5 HG12 ILE 5 30.116 7.088 1.496 30 HG13 ILE 5 HG11 ILE 5 31.506 6.009 1.462 31 HG21 ILE 5 HG21 ILE 5 28.244 5.224 3.088 32 HG22 ILE 5 HG22 ILE 5 28.474 6.944 3.394 33 HG23 ILE 5 HG23 ILE 5 28.732 5.778 4.691 34 HD11 ILE 5 HD11 ILE 5 29.876 5.356 -0.191 35 HD12 ILE 5 HD12 ILE 5 28.636 5.220 1.054 36 HD13 ILE 5 HD13 ILE 5 30.010 4.116 1.055 37 H SER 6 HN SER 6 29.894 8.097 5.765 38 HA SER 6 HA SER 6 30.724 6.353 7.981 39 HB2 SER 6 HB2 SER 6 29.772 9.230 8.085 40 HB3 SER 6 HB1 SER 6 30.328 8.270 9.456 41 HG SER 6 HG SER 6 32.338 8.045 8.108 42 H LYS 7 HN LYS 7 28.790 6.979 9.865 43 HA LYS 7 HA LYS 7 26.604 5.448 9.000 44 HB2 LYS 7 HB2 LYS 7 27.332 5.828 11.397 45 HB3 LYS 7 HB1 LYS 7 26.525 7.387 11.304 46 HG2 LYS 7 HG2 LYS 7 24.559 5.787 10.407 47 HG3 LYS 7 HG1 LYS 7 25.402 4.683 11.495 48 HD2 LYS 7 HD2 LYS 7 24.278 7.397 12.184 49 HD3 LYS 7 HD1 LYS 7 23.620 5.834 12.664 50 HE2 LYS 7 HE2 LYS 7 25.675 5.370 13.931 51 HE3 LYS 7 HE1 LYS 7 26.291 6.961 13.487 52 HZ1 LYS 7 HZ1 LYS 7 25.324 7.011 15.681 53 HZ2 LYS 7 HZ2 LYS 7 23.856 6.421 15.096 54 HZ3 LYS 7 HZ3 LYS 7 24.394 7.954 14.633 55 H GLU 8 HN GLU 8 27.282 8.802 8.686 56 HA GLU 8 HA GLU 8 24.930 10.129 8.654 57 HB2 GLU 8 HB2 GLU 8 27.233 10.325 6.725 58 HB3 GLU 8 HB1 GLU 8 25.906 11.473 6.743 59 HG2 GLU 8 HG2 GLU 8 27.692 10.891 9.089 60 HG3 GLU 8 HG1 GLU 8 27.904 12.238 7.970 61 H ASP 9 HN ASP 9 26.203 8.321 5.850 62 HA ASP 9 HA ASP 9 23.833 8.720 4.308 63 HB2 ASP 9 HB2 ASP 9 25.984 8.324 3.220 64 HB3 ASP 9 HB1 ASP 9 26.085 6.729 3.959 65 H GLU 10 HN GLU 10 25.082 6.097 6.301 66 HA GLU 10 HA GLU 10 23.205 4.132 5.669 67 HB2 GLU 10 HB2 GLU 10 25.184 3.546 6.899 68 HB3 GLU 10 HB1 GLU 10 24.733 4.610 8.226 69 HG2 GLU 10 HG2 GLU 10 22.798 3.201 8.704 70 HG3 GLU 10 HG1 GLU 10 23.249 2.135 7.376 71 H GLU 11 HN GLU 11 23.176 6.235 8.567 72 HA GLU 11 HA GLU 11 20.640 5.419 9.401 73 HB2 GLU 11 HB2 GLU 11 20.653 7.497 10.812 74 HB3 GLU 11 HB1 GLU 11 22.042 6.443 11.019 75 HG2 GLU 11 HG2 GLU 11 23.455 7.896 9.835 76 HG3 GLU 11 HG1 GLU 11 22.103 8.822 9.206 77 H ARG 12 HN ARG 12 21.637 7.872 7.121 78 HA ARG 12 HA ARG 12 19.135 9.172 6.865 79 HB2 ARG 12 HB2 ARG 12 21.204 10.112 5.911 80 HB3 ARG 12 HB1 ARG 12 21.285 8.776 4.769 81 HG2 ARG 12 HG2 ARG 12 19.099 9.508 3.843 82 HG3 ARG 12 HG1 ARG 12 19.168 10.911 4.910 83 HD2 ARG 12 HD2 ARG 12 19.934 11.487 2.680 84 HD3 ARG 12 HD1 ARG 12 21.250 11.617 3.844 85 HE ARG 12 HE ARG 12 22.211 9.650 2.936 86 HH11 ARG 12 HH11 ARG 12 19.406 10.762 1.154 87 HH12 ARG 12 HH12 ARG 12 19.807 9.863 -0.272 88 HH21 ARG 12 HH21 ARG 12 22.752 8.491 1.057 89 HH22 ARG 12 HH22 ARG 12 21.705 8.581 -0.331 90 H TYR 13 HN TYR 13 20.624 6.466 5.124 91 HA TYR 13 HA TYR 13 18.464 5.836 3.456 92 HB2 TYR 13 HB2 TYR 13 20.434 4.742 2.879 93 HB3 TYR 13 HB1 TYR 13 20.798 4.298 4.540 94 HD1 TYR 13 HD1 TYR 13 18.133 3.626 1.985 95 HD2 TYR 13 HD2 TYR 13 20.603 2.082 5.086 96 HE1 TYR 13 HE1 TYR 13 17.177 1.388 1.634 97 HE2 TYR 13 HE2 TYR 13 19.654 -0.158 4.731 98 HH TYR 13 HH TYR 13 17.740 -0.948 2.023 99 H GLN 14 HN GLN 14 19.325 4.601 6.665 100 HA GLN 14 HA GLN 14 17.258 2.809 7.098 101 HB2 GLN 14 HB2 GLN 14 18.544 4.739 9.041 102 HB3 GLN 14 HB1 GLN 14 17.506 3.408 9.520 103 HG2 GLN 14 HG2 GLN 14 20.065 3.065 7.984 104 HG3 GLN 14 HG1 GLN 14 19.949 2.988 9.740 105 HE21 GLN 14 HE21 GLN 14 19.284 1.388 6.753 106 HE22 GLN 14 HE22 GLN 14 18.810 -0.130 7.429 107 H LYS 15 HN LYS 15 17.278 6.246 8.008 108 HA LYS 15 HA LYS 15 14.589 6.310 8.755 109 HB2 LYS 15 HB2 LYS 15 16.430 8.539 7.907 110 HB3 LYS 15 HB1 LYS 15 14.823 8.798 8.575 111 HG2 LYS 15 HG2 LYS 15 17.088 7.390 9.968 112 HG3 LYS 15 HG1 LYS 15 16.564 9.048 10.266 113 HD2 LYS 15 HD2 LYS 15 14.593 8.382 11.277 114 HD3 LYS 15 HD1 LYS 15 14.596 6.808 10.485 115 HE2 LYS 15 HE2 LYS 15 16.536 6.160 11.848 116 HE3 LYS 15 HE1 LYS 15 16.439 7.709 12.686 117 HZ1 LYS 15 HZ1 LYS 15 14.231 7.112 13.453 118 HZ2 LYS 15 HZ2 LYS 15 15.355 5.945 13.934 119 HZ3 LYS 15 HZ3 LYS 15 14.317 5.633 12.636 120 H LEU 16 HN LEU 16 16.095 6.559 5.653 121 HA LEU 16 HA LEU 16 13.952 7.770 4.261 122 HB2 LEU 16 HB2 LEU 16 16.306 7.529 3.442 123 HB3 LEU 16 HB1 LEU 16 15.988 5.826 3.182 124 HG LEU 16 HG LEU 16 14.321 6.357 1.481 125 HD11 LEU 16 HD11 LEU 16 14.985 9.228 2.146 126 HD12 LEU 16 HD12 LEU 16 13.432 8.419 2.376 127 HD13 LEU 16 HD13 LEU 16 14.045 8.707 0.749 128 HD21 LEU 16 HD21 LEU 16 15.823 7.233 -0.189 129 HD22 LEU 16 HD22 LEU 16 16.698 6.143 0.890 130 HD23 LEU 16 HD23 LEU 16 16.880 7.889 1.062 131 H VAL 17 HN VAL 17 14.791 4.407 4.956 132 HA VAL 17 HA VAL 17 12.598 3.267 3.568 133 HB VAL 17 HB VAL 17 13.224 1.240 4.387 134 HG11 VAL 17 HG11 VAL 17 15.638 2.886 5.063 135 HG12 VAL 17 HG12 VAL 17 15.226 2.216 3.482 136 HG13 VAL 17 HG13 VAL 17 15.623 1.139 4.821 137 HG21 VAL 17 HG21 VAL 17 14.046 0.780 6.656 138 HG22 VAL 17 HG22 VAL 17 12.474 1.590 6.659 139 HG23 VAL 17 HG23 VAL 17 13.941 2.505 7.026 140 H THR 18 HN THR 18 13.028 4.539 6.803 141 HA THR 18 HA THR 18 10.581 3.727 7.898 142 HB THR 18 HB THR 18 12.773 5.306 8.721 143 HG1 THR 18 HG1 THR 18 11.943 4.845 10.742 144 HG21 THR 18 HG21 THR 18 10.172 6.788 9.142 145 HG22 THR 18 HG22 THR 18 11.516 7.326 8.124 146 HG23 THR 18 HG23 THR 18 11.727 7.189 9.874 147 H GLU 19 HN GLU 19 11.517 6.545 6.011 148 HA GLU 19 HA GLU 19 9.201 8.049 6.225 149 HB2 GLU 19 HB2 GLU 19 11.191 7.823 3.966 150 HB3 GLU 19 HB1 GLU 19 9.929 9.050 4.043 151 HG2 GLU 19 HG2 GLU 19 11.911 8.673 6.262 152 HG3 GLU 19 HG1 GLU 19 12.259 9.686 4.875 153 H ASN 20 HN ASN 20 9.998 5.469 3.908 154 HA ASN 20 HA ASN 20 7.571 5.964 2.464 155 HB2 ASN 20 HB2 ASN 20 8.191 4.272 0.943 156 HB3 ASN 20 HB1 ASN 20 9.681 5.092 1.383 157 HD21 ASN 20 HD21 ASN 20 11.287 3.960 2.337 158 HD22 ASN 20 HD22 ASN 20 11.205 2.263 2.671 159 H GLU 21 HN GLU 21 8.485 3.847 5.099 160 HA GLU 21 HA GLU 21 6.207 2.138 4.842 161 HB2 GLU 21 HB2 GLU 21 7.928 2.777 7.251 162 HB3 GLU 21 HB1 GLU 21 6.808 1.426 7.118 163 HG2 GLU 21 HG2 GLU 21 8.983 1.764 5.123 164 HG3 GLU 21 HG1 GLU 21 9.335 1.075 6.696 165 H GLN 22 HN GLN 22 6.853 5.137 6.600 166 HA GLN 22 HA GLN 22 4.672 5.176 8.330 167 HB2 GLN 22 HB2 GLN 22 5.735 7.591 6.857 168 HB3 GLN 22 HB1 GLN 22 4.864 7.585 8.381 169 HG2 GLN 22 HG2 GLN 22 6.712 6.498 9.490 170 HG3 GLN 22 HG1 GLN 22 7.584 6.372 7.963 171 HE21 GLN 22 HE21 GLN 22 8.342 7.696 10.442 172 HE22 GLN 22 HE22 GLN 22 8.640 9.348 10.025 173 H LEU 23 HN LEU 23 4.891 6.604 5.099 174 HA LEU 23 HA LEU 23 2.138 7.371 5.233 175 HB2 LEU 23 HB2 LEU 23 2.494 8.656 3.325 176 HB3 LEU 23 HB1 LEU 23 3.958 8.780 4.255 177 HG LEU 23 HG LEU 23 3.536 7.308 1.680 178 HD11 LEU 23 HD11 LEU 23 5.422 9.491 2.527 179 HD12 LEU 23 HD12 LEU 23 3.959 9.703 1.565 180 HD13 LEU 23 HD13 LEU 23 5.314 8.776 0.919 181 HD21 LEU 23 HD21 LEU 23 5.955 7.215 3.453 182 HD22 LEU 23 HD22 LEU 23 5.840 6.575 1.813 183 HD23 LEU 23 HD23 LEU 23 4.868 5.870 3.105 184 H GLN 24 HN GLN 24 3.849 4.668 3.923 185 HA GLN 24 HA GLN 24 2.093 3.577 2.149 186 HB2 GLN 24 HB2 GLN 24 3.746 2.429 4.331 187 HB3 GLN 24 HB1 GLN 24 2.602 1.374 3.515 188 HG2 GLN 24 HG2 GLN 24 3.666 2.033 1.382 189 HG3 GLN 24 HG1 GLN 24 4.867 2.910 2.290 190 HE21 GLN 24 HE21 GLN 24 6.558 1.861 3.070 191 HE22 GLN 24 HE22 GLN 24 6.793 0.150 3.012 192 H ARG 25 HN ARG 25 1.833 3.556 5.662 193 HA ARG 25 HA ARG 25 -0.655 2.236 5.824 194 HB2 ARG 25 HB2 ARG 25 0.182 2.182 7.900 195 HB3 ARG 25 HB1 ARG 25 1.229 3.555 7.589 196 HG2 ARG 25 HG2 ARG 25 -0.909 4.960 7.881 197 HG3 ARG 25 HG1 ARG 25 -1.559 3.513 8.664 198 HD2 ARG 25 HD2 ARG 25 0.377 3.525 10.197 199 HD3 ARG 25 HD1 ARG 25 0.957 5.004 9.427 200 HE ARG 25 HE ARG 25 -1.706 5.295 10.413 201 HH11 ARG 25 HH11 ARG 25 1.659 5.250 11.376 202 HH12 ARG 25 HH12 ARG 25 1.411 6.260 12.764 203 HH21 ARG 25 HH21 ARG 25 -2.039 6.625 12.243 204 HH22 ARG 25 HH22 ARG 25 -0.695 7.031 13.264 205 H LEU 26 HN LEU 26 0.286 5.619 5.657 206 HA LEU 26 HA LEU 26 -2.224 6.741 6.269 207 HB2 LEU 26 HB2 LEU 26 0.099 7.888 4.717 208 HB3 LEU 26 HB1 LEU 26 -1.232 8.828 5.381 209 HG LEU 26 HG LEU 26 0.661 7.156 7.048 210 HD11 LEU 26 HD11 LEU 26 1.795 9.068 5.942 211 HD12 LEU 26 HD12 LEU 26 1.759 9.163 7.701 212 HD13 LEU 26 HD13 LEU 26 0.650 10.146 6.741 213 HD21 LEU 26 HD21 LEU 26 -0.291 8.437 8.916 214 HD22 LEU 26 HD22 LEU 26 -1.500 7.459 8.087 215 HD23 LEU 26 HD23 LEU 26 -1.423 9.197 7.800 216 H ILE 27 HN ILE 27 -0.721 5.798 3.233 217 HA ILE 27 HA ILE 27 -2.737 6.690 1.481 218 HB ILE 27 HB ILE 27 -0.990 4.231 1.256 219 HG12 ILE 27 HG12 ILE 27 -0.595 6.951 0.005 220 HG13 ILE 27 HG11 ILE 27 0.197 6.434 1.500 221 HG21 ILE 27 HG21 ILE 27 -2.533 5.714 -0.870 222 HG22 ILE 27 HG22 ILE 27 -2.913 4.114 -0.236 223 HG23 ILE 27 HG23 ILE 27 -1.427 4.370 -1.148 224 HD11 ILE 27 HD11 ILE 27 1.621 6.193 -0.486 225 HD12 ILE 27 HD12 ILE 27 0.456 5.053 -1.160 226 HD13 ILE 27 HD13 ILE 27 1.318 4.657 0.327 227 H THR 28 HN THR 28 -2.228 3.570 3.066 228 HA THR 28 HA THR 28 -4.418 2.211 2.064 229 HB THR 28 HB THR 28 -2.374 1.692 3.901 230 HG1 THR 28 HG1 THR 28 -2.738 -0.277 3.178 231 HG21 THR 28 HG21 THR 28 -3.631 0.393 5.660 232 HG22 THR 28 HG22 THR 28 -5.077 1.283 5.172 233 HG23 THR 28 HG23 THR 28 -3.681 2.149 5.828 234 H GLN 29 HN GLN 29 -4.244 4.440 4.789 235 HA GLN 29 HA GLN 29 -6.775 3.944 5.926 236 HB2 GLN 29 HB2 GLN 29 -5.346 6.606 5.776 237 HB3 GLN 29 HB1 GLN 29 -6.574 6.136 6.941 238 HG2 GLN 29 HG2 GLN 29 -3.887 4.815 6.714 239 HG3 GLN 29 HG1 GLN 29 -4.243 6.156 7.797 240 HE21 GLN 29 HE21 GLN 29 -4.728 2.791 7.149 241 HE22 GLN 29 HE22 GLN 29 -5.405 2.379 8.684 242 H LYS 30 HN LYS 30 -5.722 6.453 3.685 243 HA LYS 30 HA LYS 30 -8.309 7.545 3.304 244 HB2 LYS 30 HB2 LYS 30 -5.841 7.887 1.595 245 HB3 LYS 30 HB1 LYS 30 -7.237 8.957 1.645 246 HG2 LYS 30 HG2 LYS 30 -6.746 9.603 3.895 247 HG3 LYS 30 HG1 LYS 30 -5.466 8.399 4.013 248 HD2 LYS 30 HD2 LYS 30 -4.236 9.598 2.228 249 HD3 LYS 30 HD1 LYS 30 -5.495 10.835 2.232 250 HE2 LYS 30 HE2 LYS 30 -3.784 10.080 4.602 251 HE3 LYS 30 HE1 LYS 30 -3.521 11.481 3.568 252 HZ1 LYS 30 HZ1 LYS 30 -5.611 12.394 4.257 253 HZ2 LYS 30 HZ2 LYS 30 -4.714 12.010 5.636 254 HZ3 LYS 30 HZ3 LYS 30 -5.987 11.009 5.154 255 H GLU 31 HN GLU 31 -6.280 5.405 1.317 256 HA GLU 31 HA GLU 31 -7.724 5.198 -0.976 257 HB2 GLU 31 HB2 GLU 31 -6.041 3.303 0.562 258 HB3 GLU 31 HB1 GLU 31 -7.021 2.633 -0.736 259 HG2 GLU 31 HG2 GLU 31 -5.121 4.933 -1.085 260 HG3 GLU 31 HG1 GLU 31 -4.706 3.248 -1.387 261 H GLU 32 HN GLU 32 -8.252 3.006 1.825 262 HA GLU 32 HA GLU 32 -10.379 1.665 0.587 263 HB2 GLU 32 HB2 GLU 32 -10.949 0.864 2.907 264 HB3 GLU 32 HB1 GLU 32 -9.313 0.541 2.361 265 HG2 GLU 32 HG2 GLU 32 -8.436 2.298 3.720 266 HG3 GLU 32 HG1 GLU 32 -10.063 2.848 4.138 267 H LYS 33 HN LYS 33 -10.364 4.558 2.574 268 HA LYS 33 HA LYS 33 -13.174 4.697 2.962 269 HB2 LYS 33 HB2 LYS 33 -11.126 6.926 2.880 270 HB3 LYS 33 HB1 LYS 33 -12.769 7.077 3.487 271 HG2 LYS 33 HG2 LYS 33 -12.291 5.545 5.288 272 HG3 LYS 33 HG1 LYS 33 -10.675 5.248 4.644 273 HD2 LYS 33 HD2 LYS 33 -10.502 6.807 6.467 274 HD3 LYS 33 HD1 LYS 33 -10.163 7.658 4.961 275 HE2 LYS 33 HE2 LYS 33 -11.573 9.036 6.339 276 HE3 LYS 33 HE1 LYS 33 -12.502 8.477 4.950 277 HZ1 LYS 33 HZ1 LYS 33 -13.779 8.315 6.986 278 HZ2 LYS 33 HZ2 LYS 33 -12.603 7.321 7.683 279 HZ3 LYS 33 HZ3 LYS 33 -13.492 6.774 6.354 280 H ILE 34 HN ILE 34 -10.976 6.058 0.560 281 HA ILE 34 HA ILE 34 -12.945 7.483 -0.903 282 HB ILE 34 HB ILE 34 -10.154 6.578 -1.603 283 HG12 ILE 34 HG12 ILE 34 -11.157 9.386 -1.230 284 HG13 ILE 34 HG11 ILE 34 -10.720 8.388 0.159 285 HG21 ILE 34 HG21 ILE 34 -12.024 8.282 -3.231 286 HG22 ILE 34 HG22 ILE 34 -11.352 6.718 -3.682 287 HG23 ILE 34 HG23 ILE 34 -10.296 8.121 -3.528 288 HD11 ILE 34 HD11 ILE 34 -8.464 8.124 -0.697 289 HD12 ILE 34 HD12 ILE 34 -8.876 9.830 -0.520 290 HD13 ILE 34 HD13 ILE 34 -8.880 9.084 -2.117 291 H ARG 35 HN ARG 35 -11.771 4.199 -1.012 292 HA ARG 35 HA ARG 35 -12.586 3.471 -3.585 293 HB2 ARG 35 HB2 ARG 35 -12.383 1.843 -1.056 294 HB3 ARG 35 HB1 ARG 35 -12.683 1.141 -2.643 295 HG2 ARG 35 HG2 ARG 35 -10.564 2.060 -3.453 296 HG3 ARG 35 HG1 ARG 35 -10.253 2.736 -1.855 297 HD2 ARG 35 HD2 ARG 35 -10.292 0.453 -0.921 298 HD3 ARG 35 HD1 ARG 35 -10.527 -0.185 -2.546 299 HE ARG 35 HE ARG 35 -8.234 1.461 -2.502 300 HH11 ARG 35 HH11 ARG 35 -9.356 -1.658 -1.375 301 HH12 ARG 35 HH12 ARG 35 -7.776 -2.370 -1.384 302 HH21 ARG 35 HH21 ARG 35 -6.147 0.527 -2.506 303 HH22 ARG 35 HH22 ARG 35 -5.950 -1.128 -2.024 304 H VAL 36 HN VAL 36 -14.356 3.646 -0.568 305 HA VAL 36 HA VAL 36 -16.746 2.463 -1.567 306 HB VAL 36 HB VAL 36 -16.519 4.392 0.735 307 HG11 VAL 36 HG11 VAL 36 -18.479 2.202 0.060 308 HG12 VAL 36 HG12 VAL 36 -18.795 3.940 0.095 309 HG13 VAL 36 HG13 VAL 36 -18.444 3.074 1.595 310 HG21 VAL 36 HG21 VAL 36 -15.989 2.552 2.163 311 HG22 VAL 36 HG22 VAL 36 -14.837 2.530 0.816 312 HG23 VAL 36 HG23 VAL 36 -16.195 1.398 0.845 313 H LEU 37 HN LEU 37 -15.576 5.772 -1.208 314 HA LEU 37 HA LEU 37 -17.813 7.122 -2.229 315 HB2 LEU 37 HB2 LEU 37 -14.894 7.729 -2.071 316 HB3 LEU 37 HB1 LEU 37 -15.891 8.728 -3.110 317 HG LEU 37 HG LEU 37 -15.490 9.635 -0.796 318 HD11 LEU 37 HD11 LEU 37 -18.338 9.128 -1.647 319 HD12 LEU 37 HD12 LEU 37 -17.302 10.466 -2.155 320 HD13 LEU 37 HD13 LEU 37 -17.826 10.342 -0.474 321 HD21 LEU 37 HD21 LEU 37 -15.650 7.531 0.435 322 HD22 LEU 37 HD22 LEU 37 -17.354 7.401 0.000 323 HD23 LEU 37 HD23 LEU 37 -16.807 8.719 1.039 324 H ARG 38 HN ARG 38 -15.164 5.445 -3.771 325 HA ARG 38 HA ARG 38 -15.571 6.322 -6.402 326 HB2 ARG 38 HB2 ARG 38 -13.502 5.400 -6.147 327 HB3 ARG 38 HB1 ARG 38 -14.062 4.197 -4.997 328 HG2 ARG 38 HG2 ARG 38 -15.067 2.957 -6.850 329 HG3 ARG 38 HG1 ARG 38 -14.357 4.108 -7.986 330 HD2 ARG 38 HD2 ARG 38 -12.118 3.548 -6.998 331 HD3 ARG 38 HD1 ARG 38 -12.909 2.265 -6.087 332 HE ARG 38 HE ARG 38 -13.104 2.291 -9.015 333 HH11 ARG 38 HH11 ARG 38 -12.052 0.725 -6.065 334 HH12 ARG 38 HH12 ARG 38 -11.459 -0.687 -6.877 335 HH21 ARG 38 HH21 ARG 38 -12.325 0.426 -10.081 336 HH22 ARG 38 HH22 ARG 38 -11.630 -0.866 -9.150 337 H GLN 39 HN GLN 39 -16.778 3.497 -4.609 338 HA GLN 39 HA GLN 39 -18.238 2.306 -6.693 339 HB2 GLN 39 HB2 GLN 39 -18.890 2.365 -3.739 340 HB3 GLN 39 HB1 GLN 39 -19.511 1.211 -4.910 341 HG2 GLN 39 HG2 GLN 39 -16.599 1.536 -4.263 342 HG3 GLN 39 HG1 GLN 39 -17.657 0.377 -3.470 343 HE21 GLN 39 HE21 GLN 39 -19.162 -0.158 -5.930 344 HE22 GLN 39 HE22 GLN 39 -18.130 -1.132 -6.915 345 H ARG 40 HN ARG 40 -19.104 4.788 -4.351 346 HA ARG 40 HA ARG 40 -21.768 5.129 -5.219 347 HB2 ARG 40 HB2 ARG 40 -19.854 6.573 -3.491 348 HB3 ARG 40 HB1 ARG 40 -21.141 7.549 -4.185 349 HG2 ARG 40 HG2 ARG 40 -22.791 6.445 -3.044 350 HG3 ARG 40 HG1 ARG 40 -21.851 4.960 -2.910 351 HD2 ARG 40 HD2 ARG 40 -20.621 5.751 -1.105 352 HD3 ARG 40 HD1 ARG 40 -20.990 7.436 -1.461 353 HE ARG 40 HE ARG 40 -23.416 6.476 -0.896 354 HH11 ARG 40 HH11 ARG 40 -20.377 6.090 0.813 355 HH12 ARG 40 HH12 ARG 40 -21.134 5.946 2.372 356 HH21 ARG 40 HH21 ARG 40 -24.398 6.293 1.134 357 HH22 ARG 40 HH22 ARG 40 -23.425 6.045 2.558 358 H LEU 41 HN LEU 41 -18.708 6.515 -6.233 359 HA LEU 41 HA LEU 41 -19.764 8.377 -8.082 360 HB2 LEU 41 HB2 LEU 41 -17.116 6.941 -8.243 361 HB3 LEU 41 HB1 LEU 41 -17.551 8.417 -9.074 362 HG LEU 41 HG LEU 41 -17.108 8.065 -6.120 363 HD11 LEU 41 HD11 LEU 41 -15.654 9.617 -8.251 364 HD12 LEU 41 HD12 LEU 41 -15.072 8.190 -7.394 365 HD13 LEU 41 HD13 LEU 41 -15.311 9.704 -6.524 366 HD21 LEU 41 HD21 LEU 41 -17.575 10.421 -5.873 367 HD22 LEU 41 HD22 LEU 41 -18.987 9.596 -6.537 368 HD23 LEU 41 HD23 LEU 41 -17.949 10.557 -7.592 369 H VAL 42 HN VAL 42 -19.245 4.930 -8.205 370 HA VAL 42 HA VAL 42 -19.307 4.553 -10.993 371 HB VAL 42 HB VAL 42 -20.270 2.734 -8.771 372 HG11 VAL 42 HG11 VAL 42 -19.802 2.103 -11.684 373 HG12 VAL 42 HG12 VAL 42 -21.358 2.119 -10.850 374 HG13 VAL 42 HG13 VAL 42 -20.138 0.919 -10.420 375 HG21 VAL 42 HG21 VAL 42 -17.699 2.792 -10.342 376 HG22 VAL 42 HG22 VAL 42 -18.150 1.552 -9.173 377 HG23 VAL 42 HG23 VAL 42 -17.902 3.214 -8.641 378 H GLU 43 HN GLU 43 -21.920 4.607 -8.600 379 HA GLU 43 HA GLU 43 -23.994 4.201 -10.497 380 HB2 GLU 43 HB2 GLU 43 -24.147 5.440 -7.744 381 HB3 GLU 43 HB1 GLU 43 -25.505 4.825 -8.677 382 HG2 GLU 43 HG2 GLU 43 -24.608 2.579 -8.551 383 HG3 GLU 43 HG1 GLU 43 -23.195 3.174 -7.679 384 H ARG 44 HN ARG 44 -22.314 6.981 -9.263 385 HA ARG 44 HA ARG 44 -24.009 8.977 -10.322 386 HB2 ARG 44 HB2 ARG 44 -21.124 8.967 -9.550 387 HB3 ARG 44 HB1 ARG 44 -21.973 10.409 -10.102 388 HG2 ARG 44 HG2 ARG 44 -22.932 8.727 -7.821 389 HG3 ARG 44 HG1 ARG 44 -21.840 10.078 -7.642 390 HD2 ARG 44 HD2 ARG 44 -24.601 10.202 -8.800 391 HD3 ARG 44 HD1 ARG 44 -24.116 10.793 -7.211 392 HE ARG 44 HE ARG 44 -22.472 12.123 -8.904 393 HH11 ARG 44 HH11 ARG 44 -25.942 11.761 -8.690 394 HH12 ARG 44 HH12 ARG 44 -26.274 13.282 -9.456 395 HH21 ARG 44 HH21 ARG 44 -22.892 14.108 -9.931 396 HH22 ARG 44 HH22 ARG 44 -24.535 14.612 -10.181 397 H GLY 45 HN GLY 45 -21.319 7.138 -11.549 398 HA2 GLY 45 HA2 GLY 45 -21.086 6.572 -13.839 399 HA3 GLY 45 HA1 GLY 45 -21.937 8.052 -14.268 400 H ASP 46 HN ASP 46 -19.416 8.025 -11.876 401 HA ASP 46 HA ASP 46 -18.013 10.124 -13.184 402 HB2 ASP 46 HB2 ASP 46 -18.091 9.846 -10.726 403 HB3 ASP 46 HB1 ASP 46 -17.124 8.385 -10.880 404 H ALA 47 HN ALA 47 -17.649 6.650 -13.112 405 HA ALA 47 HA ALA 47 -14.949 6.617 -14.047 406 HB1 ALA 47 HB1 ALA 47 -15.956 4.748 -12.790 407 HB2 ALA 47 HB2 ALA 47 -15.249 4.239 -14.323 408 HB3 ALA 47 HB3 ALA 47 -16.996 4.408 -14.171 409 H LYS 48 HN LYS 48 -17.943 7.191 -15.532 410 HA LYS 48 HA LYS 48 -17.177 6.329 -18.175 411 HB2 LYS 48 HB2 LYS 48 -19.430 8.162 -17.332 412 HB3 LYS 48 HB1 LYS 48 -19.249 7.403 -18.907 413 HG2 LYS 48 HG2 LYS 48 -19.681 5.953 -16.303 414 HG3 LYS 48 HG1 LYS 48 -20.909 6.266 -17.526 415 HD2 LYS 48 HD2 LYS 48 -18.392 4.698 -18.063 416 HD3 LYS 48 HD1 LYS 48 -19.916 3.958 -17.569 417 HE2 LYS 48 HE2 LYS 48 -19.559 5.694 -20.002 418 HE3 LYS 48 HE1 LYS 48 -19.545 3.933 -20.023 419 HZ1 LYS 48 HZ1 LYS 48 -21.817 5.658 -19.191 420 HZ2 LYS 48 HZ2 LYS 48 -21.815 3.972 -19.137 421 HZ3 LYS 48 HZ3 LYS 48 -21.712 4.767 -20.622 422 H GLY 49 HN GLY 49 -16.492 8.950 -16.190 423 HA2 GLY 49 HA2 GLY 49 -15.649 10.577 -18.505 424 HA3 GLY 49 HA1 GLY 49 -16.036 11.238 -16.918 425 H THR 50 HN THR 50 -13.628 9.788 -18.889 426 HA THR 50 HA THR 50 -11.636 10.249 -16.821 427 HB THR 50 HB THR 50 -11.819 7.634 -18.340 428 HG1 THR 50 HG1 THR 50 -12.913 8.453 -15.991 429 HG21 THR 50 HG21 THR 50 -9.950 6.935 -16.923 430 HG22 THR 50 HG22 THR 50 -9.900 8.535 -16.186 431 HG23 THR 50 HG23 THR 50 -9.512 8.340 -17.894 432 H GLU 51 HN GLU 51 -10.124 11.449 -17.685 433 HA GLU 51 HA GLU 51 -9.842 11.654 -20.557 434 HB2 GLU 51 HB2 GLU 51 -8.522 13.131 -18.276 435 HB3 GLU 51 HB1 GLU 51 -8.134 13.419 -19.963 436 HG2 GLU 51 HG2 GLU 51 -9.655 15.092 -19.181 437 HG3 GLU 51 HG1 GLU 51 -10.469 14.072 -20.362 438 H LEU 52 HN LEU 52 -8.653 10.202 -21.584 439 HA LEU 52 HA LEU 52 -6.657 8.630 -20.303 440 HB2 LEU 52 HB2 LEU 52 -7.325 8.888 -23.235 441 HB3 LEU 52 HB1 LEU 52 -6.363 7.621 -22.511 442 HG LEU 52 HG LEU 52 -8.444 6.662 -22.920 443 HD11 LEU 52 HD11 LEU 52 -8.496 7.493 -20.037 444 HD12 LEU 52 HD12 LEU 52 -7.578 6.145 -20.710 445 HD13 LEU 52 HD13 LEU 52 -9.341 6.113 -20.739 446 HD21 LEU 52 HD21 LEU 52 -10.585 7.586 -22.351 447 HD22 LEU 52 HD22 LEU 52 -9.687 8.736 -23.343 448 HD23 LEU 52 HD23 LEU 52 -9.816 8.982 -21.601 449 H ASN 53 HN ASN 53 -5.483 10.728 -19.678 450 HA ASN 53 HA ASN 53 -3.897 11.976 -21.710 451 HB2 ASN 53 HB2 ASN 53 -2.817 13.178 -19.904 452 HB3 ASN 53 HB1 ASN 53 -4.553 13.152 -19.623 453 HD21 ASN 53 HD21 ASN 53 -1.455 12.142 -18.498 454 HD22 ASN 53 HD22 ASN 53 -1.984 11.469 -16.995 455 H GLY 84 HN GLY 84 38.726 -2.569 -19.346 456 HA2 GLY 84 HA2 GLY 84 36.444 -3.034 -19.724 457 HA3 GLY 84 HA1 GLY 84 36.230 -3.266 -17.993 458 HA PRO 85 HA PRO 85 34.745 1.005 -19.139 459 HB2 PRO 85 HB2 PRO 85 32.161 0.746 -18.481 460 HB3 PRO 85 HB1 PRO 85 32.775 0.202 -20.048 461 HG2 PRO 85 HG2 PRO 85 32.183 -1.395 -17.588 462 HG3 PRO 85 HG1 PRO 85 31.801 -1.765 -19.282 463 HD2 PRO 85 HD2 PRO 85 33.949 -2.827 -17.954 464 HD3 PRO 85 HD1 PRO 85 33.904 -2.579 -19.711 465 H LEU 86 HN LEU 86 33.140 2.346 -17.583 466 HA LEU 86 HA LEU 86 34.353 2.942 -15.232 467 HB2 LEU 86 HB2 LEU 86 31.927 3.633 -14.495 468 HB3 LEU 86 HB1 LEU 86 32.771 4.484 -15.773 469 HG LEU 86 HG LEU 86 31.505 3.193 -17.457 470 HD11 LEU 86 HD11 LEU 86 30.008 2.070 -15.096 471 HD12 LEU 86 HD12 LEU 86 31.062 1.167 -16.188 472 HD13 LEU 86 HD13 LEU 86 29.566 1.876 -16.792 473 HD21 LEU 86 HD21 LEU 86 30.698 5.361 -16.754 474 HD22 LEU 86 HD22 LEU 86 29.817 4.624 -15.417 475 HD23 LEU 86 HD23 LEU 86 29.344 4.282 -17.081 476 H GLY 87 HN GLY 87 34.063 2.496 -13.037 477 HA2 GLY 87 HA2 GLY 87 33.350 -0.273 -12.502 478 HA3 GLY 87 HA1 GLY 87 34.152 0.833 -11.396 479 H SER 88 HN SER 88 31.491 2.275 -12.832 480 HA SER 88 HA SER 88 30.047 2.382 -10.377 481 HB2 SER 88 HB2 SER 88 29.099 3.224 -13.122 482 HB3 SER 88 HB1 SER 88 28.520 3.814 -11.564 483 HG SER 88 HG SER 88 30.924 4.395 -11.336 484 H ARG 89 HN ARG 89 30.266 -0.024 -12.599 485 HA ARG 89 HA ARG 89 27.448 -0.811 -12.480 486 HB2 ARG 89 HB2 ARG 89 28.014 -2.425 -14.231 487 HB3 ARG 89 HB1 ARG 89 28.498 -0.799 -14.695 488 HG2 ARG 89 HG2 ARG 89 30.788 -1.269 -14.243 489 HG3 ARG 89 HG1 ARG 89 30.382 -2.816 -13.498 490 HD2 ARG 89 HD2 ARG 89 29.510 -3.588 -15.674 491 HD3 ARG 89 HD1 ARG 89 30.029 -2.067 -16.397 492 HE ARG 89 HE ARG 89 32.332 -2.837 -15.474 493 HH11 ARG 89 HH11 ARG 89 29.864 -4.889 -16.869 494 HH12 ARG 89 HH12 ARG 89 30.992 -6.064 -17.460 495 HH21 ARG 89 HH21 ARG 89 33.826 -4.377 -16.254 496 HH22 ARG 89 HH22 ARG 89 33.249 -5.769 -17.120 497 H ARG 90 HN ARG 90 29.918 -1.172 -10.489 498 HA ARG 90 HA ARG 90 30.063 -4.028 -10.247 499 HB2 ARG 90 HB2 ARG 90 31.111 -1.792 -8.524 500 HB3 ARG 90 HB1 ARG 90 31.362 -3.493 -8.155 501 HG2 ARG 90 HG2 ARG 90 32.217 -2.221 -10.742 502 HG3 ARG 90 HG1 ARG 90 33.259 -2.345 -9.323 503 HD2 ARG 90 HD2 ARG 90 31.944 -4.698 -10.673 504 HD3 ARG 90 HD1 ARG 90 33.589 -4.158 -11.003 505 HE ARG 90 HE ARG 90 33.600 -4.487 -8.326 506 HH11 ARG 90 HH11 ARG 90 32.580 -6.571 -10.956 507 HH12 ARG 90 HH12 ARG 90 32.993 -8.034 -10.125 508 HH21 ARG 90 HH21 ARG 90 34.171 -6.416 -7.242 509 HH22 ARG 90 HH22 ARG 90 33.907 -7.945 -8.018 510 H PHE 91 HN PHE 91 29.159 -5.342 -8.723 511 HA PHE 91 HA PHE 91 26.518 -4.940 -8.174 512 HB2 PHE 91 HB2 PHE 91 26.631 -6.879 -6.683 513 HB3 PHE 91 HB1 PHE 91 27.564 -7.141 -8.146 514 HD1 PHE 91 HD1 PHE 91 27.582 -7.212 -4.593 515 HD2 PHE 91 HD2 PHE 91 30.109 -6.787 -7.989 516 HE1 PHE 91 HE1 PHE 91 29.526 -7.833 -3.222 517 HE2 PHE 91 HE2 PHE 91 32.057 -7.406 -6.623 518 HZ PHE 91 HZ PHE 91 31.764 -7.931 -4.232 519 H VAL 92 HN VAL 92 29.159 -4.480 -5.829 520 HA VAL 92 HA VAL 92 27.408 -3.726 -3.714 521 HB VAL 92 HB VAL 92 29.578 -4.706 -3.223 522 HG11 VAL 92 HG11 VAL 92 31.658 -3.420 -3.539 523 HG12 VAL 92 HG12 VAL 92 30.746 -2.208 -4.439 524 HG13 VAL 92 HG13 VAL 92 30.884 -3.851 -5.062 525 HG21 VAL 92 HG21 VAL 92 29.388 -1.858 -2.244 526 HG22 VAL 92 HG22 VAL 92 30.346 -3.139 -1.501 527 HG23 VAL 92 HG23 VAL 92 28.587 -3.261 -1.534 528 H VAL 93 HN VAL 93 29.072 -2.010 -6.242 529 HA VAL 93 HA VAL 93 28.913 0.574 -5.093 530 HB VAL 93 HB VAL 93 29.169 -0.219 -7.989 531 HG11 VAL 93 HG11 VAL 93 29.621 2.445 -6.654 532 HG12 VAL 93 HG12 VAL 93 28.345 2.055 -7.805 533 HG13 VAL 93 HG13 VAL 93 30.031 2.063 -8.324 534 HG21 VAL 93 HG21 VAL 93 31.253 0.594 -5.970 535 HG22 VAL 93 HG22 VAL 93 31.548 0.254 -7.676 536 HG23 VAL 93 HG23 VAL 93 31.000 -1.034 -6.599 537 H ASP 94 HN ASP 94 26.858 -1.191 -7.420 538 HA ASP 94 HA ASP 94 25.003 0.947 -7.673 539 HB2 ASP 94 HB2 ASP 94 24.519 -1.987 -8.172 540 HB3 ASP 94 HB1 ASP 94 23.420 -0.698 -8.593 541 H ASP 95 HN ASP 95 24.904 -2.059 -5.713 542 HA ASP 95 HA ASP 95 22.288 -1.697 -4.806 543 HB2 ASP 95 HB2 ASP 95 24.166 -3.632 -4.425 544 HB3 ASP 95 HB1 ASP 95 24.087 -2.892 -2.824 545 H ARG 96 HN ARG 96 25.092 0.029 -3.909 546 HA ARG 96 HA ARG 96 24.036 0.848 -1.342 547 HB2 ARG 96 HB2 ARG 96 26.452 0.580 -1.637 548 HB3 ARG 96 HB1 ARG 96 26.446 1.818 -2.884 549 HG2 ARG 96 HG2 ARG 96 25.925 3.517 -1.317 550 HG3 ARG 96 HG1 ARG 96 25.587 2.332 -0.052 551 HD2 ARG 96 HD2 ARG 96 27.783 3.405 0.224 552 HD3 ARG 96 HD1 ARG 96 27.902 1.662 -0.008 553 HE ARG 96 HE ARG 96 28.239 3.394 -2.344 554 HH11 ARG 96 HH11 ARG 96 29.654 1.273 0.058 555 HH12 ARG 96 HH12 ARG 96 31.137 1.065 -0.818 556 HH21 ARG 96 HH21 ARG 96 30.192 3.111 -3.497 557 HH22 ARG 96 HH22 ARG 96 31.449 2.111 -2.823 558 H ARG 97 HN ARG 97 24.615 2.296 -4.514 559 HA ARG 97 HA ARG 97 23.275 4.760 -3.752 560 HB2 ARG 97 HB2 ARG 97 25.164 5.172 -5.041 561 HB3 ARG 97 HB1 ARG 97 24.863 3.812 -6.106 562 HG2 ARG 97 HG2 ARG 97 22.772 5.808 -6.293 563 HG3 ARG 97 HG1 ARG 97 24.371 6.475 -6.643 564 HD2 ARG 97 HD2 ARG 97 23.062 4.088 -7.953 565 HD3 ARG 97 HD1 ARG 97 23.408 5.654 -8.695 566 HE ARG 97 HE ARG 97 25.855 4.897 -7.988 567 HH11 ARG 97 HH11 ARG 97 23.317 3.153 -9.658 568 HH12 ARG 97 HH12 ARG 97 24.416 2.009 -10.385 569 HH21 ARG 97 HH21 ARG 97 27.296 3.447 -9.021 570 HH22 ARG 97 HH22 ARG 97 26.668 2.201 -10.059 571 H GLU 98 HN GLU 98 22.874 2.195 -6.147 572 HA GLU 98 HA GLU 98 20.515 3.011 -7.346 573 HB2 GLU 98 HB2 GLU 98 21.831 0.344 -6.954 574 HB3 GLU 98 HB1 GLU 98 20.232 0.451 -7.709 575 HG2 GLU 98 HG2 GLU 98 22.773 1.732 -8.627 576 HG3 GLU 98 HG1 GLU 98 21.917 0.401 -9.401 577 H LEU 99 HN LEU 99 20.983 0.912 -4.511 578 HA LEU 99 HA LEU 99 18.220 0.272 -4.293 579 HB2 LEU 99 HB2 LEU 99 19.976 -1.214 -3.514 580 HB3 LEU 99 HB1 LEU 99 20.503 -0.022 -2.355 581 HG LEU 99 HG LEU 99 19.107 -2.092 -1.610 582 HD11 LEU 99 HD11 LEU 99 18.594 0.703 -0.618 583 HD12 LEU 99 HD12 LEU 99 19.908 -0.376 -0.134 584 HD13 LEU 99 HD13 LEU 99 18.238 -0.783 0.269 585 HD21 LEU 99 HD21 LEU 99 16.926 -0.172 -2.410 586 HD22 LEU 99 HD22 LEU 99 16.719 -1.640 -1.457 587 HD23 LEU 99 HD23 LEU 99 17.241 -1.748 -3.136 588 H GLN 100 HN GLN 100 20.336 2.542 -2.472 589 HA GLN 100 HA GLN 100 18.283 3.410 -0.739 590 HB2 GLN 100 HB2 GLN 100 19.683 5.303 -0.213 591 HB3 GLN 100 HB1 GLN 100 20.685 3.867 -0.327 592 HG2 GLN 100 HG2 GLN 100 21.517 4.540 -2.459 593 HG3 GLN 100 HG1 GLN 100 20.360 5.866 -2.549 594 HE21 GLN 100 HE21 GLN 100 22.047 5.035 0.384 595 HE22 GLN 100 HE22 GLN 100 23.056 6.443 0.442 596 H TYR 101 HN TYR 101 19.209 4.340 -3.959 597 HA TYR 101 HA TYR 101 17.758 6.711 -4.226 598 HB2 TYR 101 HB2 TYR 101 19.375 6.149 -5.892 599 HB3 TYR 101 HB1 TYR 101 18.565 4.629 -6.257 600 HD1 TYR 101 HD1 TYR 101 16.918 4.522 -7.918 601 HD2 TYR 101 HD2 TYR 101 18.170 8.325 -6.481 602 HE1 TYR 101 HE1 TYR 101 15.644 5.609 -9.711 603 HE2 TYR 101 HE2 TYR 101 16.895 9.427 -8.275 604 HH TYR 101 HH TYR 101 14.652 7.704 -10.259 605 H ARG 102 HN ARG 102 16.725 3.335 -4.690 606 HA ARG 102 HA ARG 102 14.197 4.128 -5.773 607 HB2 ARG 102 HB2 ARG 102 13.583 1.829 -5.768 608 HB3 ARG 102 HB1 ARG 102 15.267 1.921 -6.251 609 HG2 ARG 102 HG2 ARG 102 15.932 1.286 -3.972 610 HG3 ARG 102 HG1 ARG 102 14.227 1.137 -3.541 611 HD2 ARG 102 HD2 ARG 102 15.183 -1.038 -4.069 612 HD3 ARG 102 HD1 ARG 102 13.947 -0.593 -5.246 613 HE ARG 102 HE ARG 102 16.000 0.195 -6.602 614 HH11 ARG 102 HH11 ARG 102 15.868 -2.621 -4.530 615 HH12 ARG 102 HH12 ARG 102 17.091 -3.479 -5.410 616 HH21 ARG 102 HH21 ARG 102 17.596 -0.949 -7.773 617 HH22 ARG 102 HH22 ARG 102 18.073 -2.533 -7.249 618 H VAL 103 HN VAL 103 15.449 3.750 -2.601 619 HA VAL 103 HA VAL 103 12.987 3.268 -1.257 620 HB VAL 103 HB VAL 103 15.404 4.631 -0.068 621 HG11 VAL 103 HG11 VAL 103 13.290 2.856 1.140 622 HG12 VAL 103 HG12 VAL 103 13.389 4.607 1.311 623 HG13 VAL 103 HG13 VAL 103 14.650 3.579 1.996 624 HG21 VAL 103 HG21 VAL 103 16.114 2.589 -1.252 625 HG22 VAL 103 HG22 VAL 103 14.938 1.662 -0.319 626 HG23 VAL 103 HG23 VAL 103 16.282 2.453 0.496 627 H GLU 104 HN GLU 104 14.862 6.227 -1.909 628 HA GLU 104 HA GLU 104 13.027 7.956 -0.663 629 HB2 GLU 104 HB2 GLU 104 14.130 9.706 -2.248 630 HB3 GLU 104 HB1 GLU 104 15.047 8.997 -0.928 631 HG2 GLU 104 HG2 GLU 104 16.218 7.578 -2.367 632 HG3 GLU 104 HG1 GLU 104 15.121 7.896 -3.708 633 H VAL 105 HN VAL 105 13.241 6.867 -4.065 634 HA VAL 105 HA VAL 105 11.102 8.524 -4.900 635 HB VAL 105 HB VAL 105 12.098 7.772 -6.793 636 HG11 VAL 105 HG11 VAL 105 12.940 5.505 -7.186 637 HG12 VAL 105 HG12 VAL 105 12.367 5.032 -5.586 638 HG13 VAL 105 HG13 VAL 105 13.646 6.237 -5.746 639 HG21 VAL 105 HG21 VAL 105 9.771 7.259 -7.098 640 HG22 VAL 105 HG22 VAL 105 10.004 5.660 -6.392 641 HG23 VAL 105 HG23 VAL 105 10.763 6.063 -7.931 642 H GLN 106 HN GLN 106 11.190 5.258 -3.537 643 HA GLN 106 HA GLN 106 8.453 4.728 -3.669 644 HB2 GLN 106 HB2 GLN 106 10.572 3.925 -1.681 645 HB3 GLN 106 HB1 GLN 106 8.915 3.366 -1.537 646 HG2 GLN 106 HG2 GLN 106 10.621 2.962 -3.973 647 HG3 GLN 106 HG1 GLN 106 10.453 1.782 -2.677 648 HE21 GLN 106 HE21 GLN 106 8.810 3.432 -5.280 649 HE22 GLN 106 HE22 GLN 106 7.487 2.327 -5.403 650 H ASN 107 HN ASN 107 10.310 6.392 -1.125 651 HA ASN 107 HA ASN 107 8.251 7.197 0.553 652 HB2 ASN 107 HB2 ASN 107 10.561 7.628 1.117 653 HB3 ASN 107 HB1 ASN 107 10.747 8.700 -0.269 654 HD21 ASN 107 HD21 ASN 107 8.015 8.562 1.974 655 HD22 ASN 107 HD22 ASN 107 8.237 10.154 2.609 656 H ARG 108 HN ARG 108 9.516 8.871 -2.320 657 HA ARG 108 HA ARG 108 7.798 11.090 -2.171 658 HB2 ARG 108 HB2 ARG 108 9.356 9.916 -4.471 659 HB3 ARG 108 HB1 ARG 108 8.489 11.439 -4.565 660 HG2 ARG 108 HG2 ARG 108 9.861 12.281 -2.679 661 HG3 ARG 108 HG1 ARG 108 10.785 10.781 -2.735 662 HD2 ARG 108 HD2 ARG 108 10.508 12.728 -5.016 663 HD3 ARG 108 HD1 ARG 108 11.877 12.664 -3.916 664 HE ARG 108 HE ARG 108 11.176 10.664 -5.944 665 HH11 ARG 108 HH11 ARG 108 13.403 11.841 -3.514 666 HH12 ARG 108 HH12 ARG 108 14.758 10.937 -4.133 667 HH21 ARG 108 HH21 ARG 108 12.971 9.502 -6.780 668 HH22 ARG 108 HH22 ARG 108 14.507 9.613 -5.974 669 H VAL 109 HN VAL 109 7.608 8.175 -4.198 670 HA VAL 109 HA VAL 109 5.310 8.850 -5.627 671 HB VAL 109 HB VAL 109 6.250 6.095 -4.828 672 HG11 VAL 109 HG11 VAL 109 4.378 6.887 -7.059 673 HG12 VAL 109 HG12 VAL 109 3.880 6.143 -5.540 674 HG13 VAL 109 HG13 VAL 109 4.914 5.253 -6.660 675 HG21 VAL 109 HG21 VAL 109 7.955 7.255 -6.051 676 HG22 VAL 109 HG22 VAL 109 6.783 7.791 -7.261 677 HG23 VAL 109 HG23 VAL 109 7.197 6.081 -7.129 678 H TYR 110 HN TYR 110 5.608 7.015 -2.598 679 HA TYR 110 HA TYR 110 2.855 6.536 -2.276 680 HB2 TYR 110 HB2 TYR 110 5.067 6.735 -0.230 681 HB3 TYR 110 HB1 TYR 110 3.429 6.232 0.157 682 HD1 TYR 110 HD1 TYR 110 2.986 4.591 -2.409 683 HD2 TYR 110 HD2 TYR 110 6.161 4.743 0.412 684 HE1 TYR 110 HE1 TYR 110 3.560 2.266 -2.944 685 HE2 TYR 110 HE2 TYR 110 6.754 2.413 -0.124 686 HH TYR 110 HH TYR 110 5.737 0.425 -1.057 687 H LYS 111 HN LYS 111 4.873 9.271 -1.479 688 HA LYS 111 HA LYS 111 2.937 10.664 0.068 689 HB2 LYS 111 HB2 LYS 111 5.395 11.124 0.098 690 HB3 LYS 111 HB1 LYS 111 5.248 11.803 -1.516 691 HG2 LYS 111 HG2 LYS 111 3.851 13.577 -0.708 692 HG3 LYS 111 HG1 LYS 111 3.787 12.848 0.898 693 HD2 LYS 111 HD2 LYS 111 6.278 13.884 -0.457 694 HD3 LYS 111 HD1 LYS 111 5.368 14.727 0.796 695 HE2 LYS 111 HE2 LYS 111 5.789 12.800 2.312 696 HE3 LYS 111 HE1 LYS 111 6.818 12.098 1.068 697 HZ1 LYS 111 HZ1 LYS 111 8.089 13.310 2.742 698 HZ2 LYS 111 HZ2 LYS 111 7.264 14.732 2.358 699 HZ3 LYS 111 HZ3 LYS 111 8.268 14.004 1.210 700 H LYS 112 HN LYS 112 3.891 10.690 -3.315 701 HA LYS 112 HA LYS 112 2.147 12.675 -4.240 702 HB2 LYS 112 HB2 LYS 112 3.296 10.246 -5.620 703 HB3 LYS 112 HB1 LYS 112 2.409 11.512 -6.458 704 HG2 LYS 112 HG2 LYS 112 4.067 13.117 -6.015 705 HG3 LYS 112 HG1 LYS 112 4.838 12.101 -4.799 706 HD2 LYS 112 HD2 LYS 112 6.134 12.148 -6.867 707 HD3 LYS 112 HD1 LYS 112 5.519 10.530 -6.533 708 HE2 LYS 112 HE2 LYS 112 3.834 10.731 -8.185 709 HE3 LYS 112 HE1 LYS 112 4.127 12.460 -8.374 710 HZ1 LYS 112 HZ1 LYS 112 5.096 11.234 -10.189 711 HZ2 LYS 112 HZ2 LYS 112 5.985 10.270 -9.127 712 HZ3 LYS 112 HZ3 LYS 112 6.329 11.920 -9.258 713 H GLU 113 HN GLU 113 1.624 9.258 -3.572 714 HA GLU 113 HA GLU 113 -0.971 9.053 -4.647 715 HB2 GLU 113 HB2 GLU 113 0.156 7.654 -2.211 716 HB3 GLU 113 HB1 GLU 113 -1.313 7.196 -3.061 717 HG2 GLU 113 HG2 GLU 113 0.263 7.013 -5.126 718 HG3 GLU 113 HG1 GLU 113 1.529 6.901 -3.903 719 H ILE 114 HN ILE 114 0.129 9.904 -1.381 720 HA ILE 114 HA ILE 114 -2.378 10.378 -0.254 721 HB ILE 114 HB ILE 114 0.302 11.572 0.414 722 HG12 ILE 114 HG12 ILE 114 -1.221 9.216 1.536 723 HG13 ILE 114 HG11 ILE 114 0.188 9.129 0.490 724 HG21 ILE 114 HG21 ILE 114 -2.295 11.610 1.936 725 HG22 ILE 114 HG22 ILE 114 -1.322 12.991 1.412 726 HG23 ILE 114 HG23 ILE 114 -0.728 11.914 2.685 727 HD11 ILE 114 HD11 ILE 114 0.697 8.727 2.849 728 HD12 ILE 114 HD12 ILE 114 0.173 10.370 3.219 729 HD13 ILE 114 HD13 ILE 114 1.568 10.101 2.171 730 H GLN 115 HN GLN 115 -0.267 12.510 -2.104 731 HA GLN 115 HA GLN 115 -1.625 14.921 -1.612 732 HB2 GLN 115 HB2 GLN 115 -0.169 14.156 -4.128 733 HB3 GLN 115 HB1 GLN 115 -0.469 15.780 -3.522 734 HG2 GLN 115 HG2 GLN 115 0.884 15.193 -1.511 735 HG3 GLN 115 HG1 GLN 115 1.295 13.682 -2.322 736 HE21 GLN 115 HE21 GLN 115 1.328 14.921 -4.947 737 HE22 GLN 115 HE22 GLN 115 2.788 15.832 -5.027 738 H ALA 116 HN ALA 116 -1.960 12.538 -4.199 739 HA ALA 116 HA ALA 116 -4.166 13.739 -5.504 740 HB1 ALA 116 HB1 ALA 116 -4.522 11.532 -6.501 741 HB2 ALA 116 HB2 ALA 116 -3.401 10.826 -5.335 742 HB3 ALA 116 HB3 ALA 116 -2.816 11.979 -6.537 743 H LEU 117 HN LEU 117 -3.909 11.241 -3.035 744 HA LEU 117 HA LEU 117 -6.584 10.692 -2.582 745 HB2 LEU 117 HB2 LEU 117 -4.066 10.456 -1.084 746 HB3 LEU 117 HB1 LEU 117 -5.502 10.499 -0.089 747 HG LEU 117 HG LEU 117 -6.259 8.447 -0.851 748 HD11 LEU 117 HD11 LEU 117 -5.484 7.349 -2.904 749 HD12 LEU 117 HD12 LEU 117 -4.502 8.768 -3.279 750 HD13 LEU 117 HD13 LEU 117 -6.260 8.897 -3.230 751 HD21 LEU 117 HD21 LEU 117 -4.136 8.236 0.383 752 HD22 LEU 117 HD22 LEU 117 -3.271 8.219 -1.157 753 HD23 LEU 117 HD23 LEU 117 -4.394 6.918 -0.760 754 H ASP 118 HN ASP 118 -4.653 13.423 -1.527 755 HA ASP 118 HA ASP 118 -6.385 14.331 0.511 756 HB2 ASP 118 HB2 ASP 118 -4.034 15.060 0.284 757 HB3 ASP 118 HB1 ASP 118 -4.468 15.963 -1.166 758 H ALA 119 HN ALA 119 -6.323 14.849 -2.959 759 HA ALA 119 HA ALA 119 -8.414 16.787 -3.015 760 HB1 ALA 119 HB1 ALA 119 -7.569 14.814 -5.142 761 HB2 ALA 119 HB2 ALA 119 -6.926 16.442 -4.928 762 HB3 ALA 119 HB3 ALA 119 -8.613 16.214 -5.388 763 H GLU 120 HN GLU 120 -8.309 13.255 -3.345 764 HA GLU 120 HA GLU 120 -11.070 12.862 -3.487 765 HB2 GLU 120 HB2 GLU 120 -8.758 11.152 -2.682 766 HB3 GLU 120 HB1 GLU 120 -10.392 10.585 -2.426 767 HG2 GLU 120 HG2 GLU 120 -9.668 9.675 -4.445 768 HG3 GLU 120 HG1 GLU 120 -10.826 10.931 -4.852 769 H ILE 121 HN ILE 121 -8.944 13.441 -0.758 770 HA ILE 121 HA ILE 121 -10.639 12.744 1.323 771 HB ILE 121 HB ILE 121 -8.332 14.512 1.053 772 HG12 ILE 121 HG12 ILE 121 -7.833 13.566 3.307 773 HG13 ILE 121 HG11 ILE 121 -9.398 12.762 3.276 774 HG21 ILE 121 HG21 ILE 121 -8.698 15.797 3.095 775 HG22 ILE 121 HG22 ILE 121 -10.341 15.166 3.203 776 HG23 ILE 121 HG23 ILE 121 -9.880 16.203 1.854 777 HD11 ILE 121 HD11 ILE 121 -7.120 12.290 1.371 778 HD12 ILE 121 HD12 ILE 121 -8.690 11.486 1.319 779 HD13 ILE 121 HD13 ILE 121 -7.616 11.237 2.697 780 H ARG 122 HN ARG 122 -10.756 15.535 -0.817 781 HA ARG 122 HA ARG 122 -12.733 16.987 0.557 782 HB2 ARG 122 HB2 ARG 122 -11.613 18.046 -1.266 783 HB3 ARG 122 HB1 ARG 122 -12.101 16.785 -2.387 784 HG2 ARG 122 HG2 ARG 122 -13.353 18.884 -2.686 785 HG3 ARG 122 HG1 ARG 122 -14.390 17.514 -2.294 786 HD2 ARG 122 HD2 ARG 122 -15.122 19.436 -1.048 787 HD3 ARG 122 HD1 ARG 122 -14.422 18.262 0.063 788 HE ARG 122 HE ARG 122 -12.582 20.286 -0.844 789 HH11 ARG 122 HH11 ARG 122 -14.951 19.391 1.576 790 HH12 ARG 122 HH12 ARG 122 -14.365 20.523 2.750 791 HH21 ARG 122 HH21 ARG 122 -11.820 21.788 0.699 792 HH22 ARG 122 HH22 ARG 122 -12.582 21.888 2.256 793 H LYS 123 HN LYS 123 -13.035 14.364 -1.857 794 HA LYS 123 HA LYS 123 -15.887 14.337 -1.783 795 HB2 LYS 123 HB2 LYS 123 -15.819 12.462 -3.134 796 HB3 LYS 123 HB1 LYS 123 -14.267 13.192 -3.482 797 HG2 LYS 123 HG2 LYS 123 -13.608 11.529 -1.466 798 HG3 LYS 123 HG1 LYS 123 -14.889 10.626 -2.221 799 HD2 LYS 123 HD2 LYS 123 -12.454 11.714 -3.586 800 HD3 LYS 123 HD1 LYS 123 -12.736 10.029 -3.154 801 HE2 LYS 123 HE2 LYS 123 -14.348 9.753 -4.745 802 HE3 LYS 123 HE1 LYS 123 -14.730 11.472 -4.768 803 HZ1 LYS 123 HZ1 LYS 123 -12.281 10.227 -5.898 804 HZ2 LYS 123 HZ2 LYS 123 -12.637 11.879 -5.923 805 HZ3 LYS 123 HZ3 LYS 123 -13.593 10.797 -6.797 806 H LEU 124 HN LEU 124 -13.403 12.810 0.146 807 HA LEU 124 HA LEU 124 -15.087 11.151 1.684 808 HB2 LEU 124 HB2 LEU 124 -12.438 12.435 2.315 809 HB3 LEU 124 HB1 LEU 124 -13.255 11.350 3.422 810 HG LEU 124 HG LEU 124 -12.211 10.652 0.675 811 HD11 LEU 124 HD11 LEU 124 -10.471 10.866 2.356 812 HD12 LEU 124 HD12 LEU 124 -10.715 9.170 1.941 813 HD13 LEU 124 HD13 LEU 124 -11.369 9.813 3.447 814 HD21 LEU 124 HD21 LEU 124 -12.888 8.350 1.270 815 HD22 LEU 124 HD22 LEU 124 -14.254 9.445 1.064 816 HD23 LEU 124 HD23 LEU 124 -13.725 8.993 2.684 817 H GLU 125 HN GLU 125 -13.896 14.455 2.265 818 HA GLU 125 HA GLU 125 -15.136 14.833 4.732 819 HB2 GLU 125 HB2 GLU 125 -14.420 16.848 2.604 820 HB3 GLU 125 HB1 GLU 125 -14.930 17.273 4.234 821 HG2 GLU 125 HG2 GLU 125 -13.011 16.028 5.130 822 HG3 GLU 125 HG1 GLU 125 -12.488 15.681 3.493 823 H ARG 126 HN ARG 126 -16.422 15.060 1.491 824 HA ARG 126 HA ARG 126 -18.906 16.241 2.060 825 HB2 ARG 126 HB2 ARG 126 -18.178 14.088 0.065 826 HB3 ARG 126 HB1 ARG 126 -19.747 14.873 0.117 827 HG2 ARG 126 HG2 ARG 126 -17.136 16.298 -0.324 828 HG3 ARG 126 HG1 ARG 126 -18.241 15.793 -1.603 829 HD2 ARG 126 HD2 ARG 126 -20.002 17.187 -0.581 830 HD3 ARG 126 HD1 ARG 126 -18.839 17.739 0.622 831 HE ARG 126 HE ARG 126 -17.678 18.281 -1.803 832 HH11 ARG 126 HH11 ARG 126 -20.680 19.148 -0.223 833 HH12 ARG 126 HH12 ARG 126 -20.804 20.684 -1.025 834 HH21 ARG 126 HH21 ARG 126 -17.839 20.304 -2.863 835 HH22 ARG 126 HH22 ARG 126 -19.188 21.339 -2.526 836 H LEU 127 HN LEU 127 -17.844 12.880 2.211 837 HA LEU 127 HA LEU 127 -20.242 11.744 3.152 838 HB2 LEU 127 HB2 LEU 127 -18.427 10.420 2.216 839 HB3 LEU 127 HB1 LEU 127 -17.358 10.916 3.510 840 HG LEU 127 HG LEU 127 -19.085 9.749 5.058 841 HD11 LEU 127 HD11 LEU 127 -20.235 7.877 4.000 842 HD12 LEU 127 HD12 LEU 127 -19.691 8.434 2.418 843 HD13 LEU 127 HD13 LEU 127 -20.798 9.422 3.368 844 HD21 LEU 127 HD21 LEU 127 -16.792 8.999 4.716 845 HD22 LEU 127 HD22 LEU 127 -17.272 8.180 3.229 846 HD23 LEU 127 HD23 LEU 127 -17.899 7.629 4.781 847 H LEU 128 HN LEU 128 -17.254 12.400 4.978 848 HA LEU 128 HA LEU 128 -18.028 12.087 7.536 849 HB2 LEU 128 HB2 LEU 128 -16.207 14.094 6.254 850 HB3 LEU 128 HB1 LEU 128 -16.412 14.047 7.991 851 HG LEU 128 HG LEU 128 -15.575 11.747 8.020 852 HD11 LEU 128 HD11 LEU 128 -14.501 10.763 6.085 853 HD12 LEU 128 HD12 LEU 128 -15.063 12.106 5.091 854 HD13 LEU 128 HD13 LEU 128 -16.227 11.000 5.818 855 HD21 LEU 128 HD21 LEU 128 -13.237 12.285 7.521 856 HD22 LEU 128 HD22 LEU 128 -14.046 13.609 8.360 857 HD23 LEU 128 HD23 LEU 128 -13.771 13.708 6.616 858 H GLU 129 HN GLU 129 -18.056 15.303 5.981 859 HA GLU 129 HA GLU 129 -19.197 16.541 8.238 860 HB2 GLU 129 HB2 GLU 129 -19.033 17.532 5.395 861 HB3 GLU 129 HB1 GLU 129 -19.437 18.521 6.793 862 HG2 GLU 129 HG2 GLU 129 -17.217 17.906 7.758 863 HG3 GLU 129 HG1 GLU 129 -16.829 17.147 6.214 864 H SER 130 HN SER 130 -20.693 15.200 5.340 865 HA SER 130 HA SER 130 -23.221 16.462 5.941 866 HB2 SER 130 HB2 SER 130 -22.523 16.050 3.601 867 HB3 SER 130 HB1 SER 130 -22.585 14.316 3.902 868 HG SER 130 HG SER 130 -24.809 16.039 4.272 869 H GLY 131 HN GLY 131 -21.613 13.540 6.746 870 HA2 GLY 131 HA2 GLY 131 -22.237 11.862 8.200 871 HA3 GLY 131 HA1 GLY 131 -23.759 12.703 8.455 872 H LEU 132 HN LEU 132 -22.578 11.835 5.304 873 HA LEU 132 HA LEU 132 -25.010 10.672 4.526 874 HB2 LEU 132 HB2 LEU 132 -23.546 11.705 2.934 875 HB3 LEU 132 HB1 LEU 132 -22.252 10.596 3.323 876 HG LEU 132 HG LEU 132 -23.641 8.744 2.384 877 HD11 LEU 132 HD11 LEU 132 -25.836 9.750 2.614 878 HD12 LEU 132 HD12 LEU 132 -25.517 9.359 0.925 879 HD13 LEU 132 HD13 LEU 132 -25.390 11.026 1.482 880 HD21 LEU 132 HD21 LEU 132 -21.868 9.801 1.110 881 HD22 LEU 132 HD22 LEU 132 -22.990 11.041 0.550 882 HD23 LEU 132 HD23 LEU 132 -23.215 9.360 0.059 883 H THR 133 HN THR 133 -21.893 9.224 5.386 884 HA THR 133 HA THR 133 -21.291 7.168 6.099 885 HB THR 133 HB THR 133 -24.233 6.674 6.582 886 HG1 THR 133 HG1 THR 133 -22.508 8.403 7.734 887 HG21 THR 133 HG21 THR 133 -23.399 5.114 8.305 888 HG22 THR 133 HG22 THR 133 -21.747 5.431 7.774 889 HG23 THR 133 HG23 THR 133 -22.889 4.642 6.685 Start of MODEL 5 1 H1 MET 1 HT1 MET 1 27.067 -6.031 4.082 2 H2 MET 1 HT2 MET 1 26.498 -4.440 4.157 3 H3 MET 1 HT3 MET 1 27.595 -5.004 5.314 4 HA MET 1 HA MET 1 29.311 -5.223 3.693 5 HB2 MET 1 HB2 MET 1 27.171 -4.285 1.780 6 HB3 MET 1 HB1 MET 1 28.884 -4.294 1.387 7 HG2 MET 1 HG2 MET 1 28.932 -6.722 1.749 8 HG3 MET 1 HG1 MET 1 27.199 -6.689 2.071 9 HE1 MET 1 HE1 MET 1 27.581 -8.403 -1.471 10 HE2 MET 1 HE2 MET 1 26.874 -8.580 0.134 11 HE3 MET 1 HE3 MET 1 28.626 -8.544 -0.059 12 H ASP 2 HN ASP 2 29.212 -3.590 5.652 13 HA ASP 2 HA ASP 2 28.865 -0.829 4.858 14 HB2 ASP 2 HB2 ASP 2 29.746 -2.112 7.450 15 HB3 ASP 2 HB1 ASP 2 29.624 -0.370 7.222 16 H SER 3 HN SER 3 30.886 -2.363 3.482 17 HA SER 3 HA SER 3 33.401 -1.217 4.385 18 HB2 SER 3 HB2 SER 3 34.273 -2.475 2.340 19 HB3 SER 3 HB1 SER 3 33.588 -3.470 3.624 20 HG SER 3 HG SER 3 32.262 -4.203 2.182 21 H ALA 4 HN ALA 4 31.359 -1.212 1.477 22 HA ALA 4 HA ALA 4 32.668 1.164 0.457 23 HB1 ALA 4 HB1 ALA 4 30.287 -0.358 -0.605 24 HB2 ALA 4 HB2 ALA 4 31.964 -0.588 -1.098 25 HB3 ALA 4 HB3 ALA 4 31.146 0.935 -1.442 26 H ILE 5 HN ILE 5 29.696 0.238 2.035 27 HA ILE 5 HA ILE 5 28.543 2.896 1.858 28 HB ILE 5 HB ILE 5 27.570 0.556 3.509 29 HG12 ILE 5 HG12 ILE 5 26.773 1.256 0.674 30 HG13 ILE 5 HG11 ILE 5 27.852 -0.066 1.106 31 HG21 ILE 5 HG21 ILE 5 25.399 1.654 3.332 32 HG22 ILE 5 HG22 ILE 5 26.120 2.943 2.369 33 HG23 ILE 5 HG23 ILE 5 26.593 2.732 4.055 34 HD11 ILE 5 HD11 ILE 5 26.047 -1.123 2.363 35 HD12 ILE 5 HD12 ILE 5 25.610 -0.872 0.674 36 HD13 ILE 5 HD13 ILE 5 24.968 0.199 1.919 37 H SER 6 HN SER 6 28.590 4.414 3.496 38 HA SER 6 HA SER 6 29.939 3.608 5.983 39 HB2 SER 6 HB2 SER 6 31.044 5.454 4.785 40 HB3 SER 6 HB1 SER 6 29.541 6.370 4.790 41 HG SER 6 HG SER 6 31.119 5.622 7.031 42 H LYS 7 HN LYS 7 29.072 4.970 7.936 43 HA LYS 7 HA LYS 7 26.402 4.404 8.430 44 HB2 LYS 7 HB2 LYS 7 28.187 4.940 10.105 45 HB3 LYS 7 HB1 LYS 7 28.062 6.626 9.632 46 HG2 LYS 7 HG2 LYS 7 26.845 6.310 11.627 47 HG3 LYS 7 HG1 LYS 7 25.691 6.593 10.327 48 HD2 LYS 7 HD2 LYS 7 24.838 4.820 11.684 49 HD3 LYS 7 HD1 LYS 7 25.394 4.112 10.168 50 HE2 LYS 7 HE2 LYS 7 26.065 2.741 12.064 51 HE3 LYS 7 HE1 LYS 7 27.474 3.421 11.254 52 HZ1 LYS 7 HZ1 LYS 7 27.622 3.548 13.679 53 HZ2 LYS 7 HZ2 LYS 7 26.246 4.530 13.719 54 HZ3 LYS 7 HZ3 LYS 7 27.658 5.080 12.967 55 H GLU 8 HN GLU 8 27.966 7.083 6.911 56 HA GLU 8 HA GLU 8 26.143 9.108 6.824 57 HB2 GLU 8 HB2 GLU 8 27.859 8.050 4.568 58 HB3 GLU 8 HB1 GLU 8 27.096 9.638 4.594 59 HG2 GLU 8 HG2 GLU 8 29.219 8.636 6.472 60 HG3 GLU 8 HG1 GLU 8 29.422 9.821 5.185 61 H ASP 9 HN ASP 9 26.312 6.373 4.555 62 HA ASP 9 HA ASP 9 23.886 7.242 3.241 63 HB2 ASP 9 HB2 ASP 9 25.800 6.339 1.956 64 HB3 ASP 9 HB1 ASP 9 25.573 4.785 2.748 65 H GLU 10 HN GLU 10 24.876 4.832 5.549 66 HA GLU 10 HA GLU 10 22.657 3.118 5.355 67 HB2 GLU 10 HB2 GLU 10 24.584 2.367 6.557 68 HB3 GLU 10 HB1 GLU 10 24.494 3.729 7.670 69 HG2 GLU 10 HG2 GLU 10 22.526 2.888 8.679 70 HG3 GLU 10 HG1 GLU 10 22.335 1.655 7.435 71 H GLU 11 HN GLU 11 23.284 5.727 7.707 72 HA GLU 11 HA GLU 11 20.842 5.731 8.993 73 HB2 GLU 11 HB2 GLU 11 22.641 8.073 8.351 74 HB3 GLU 11 HB1 GLU 11 21.330 8.112 9.522 75 HG2 GLU 11 HG2 GLU 11 23.665 6.231 9.694 76 HG3 GLU 11 HG1 GLU 11 23.611 7.806 10.482 77 H ARG 12 HN ARG 12 21.816 7.286 6.011 78 HA ARG 12 HA ARG 12 19.494 8.798 5.550 79 HB2 ARG 12 HB2 ARG 12 21.594 9.183 4.358 80 HB3 ARG 12 HB1 ARG 12 21.455 7.614 3.581 81 HG2 ARG 12 HG2 ARG 12 20.802 9.322 2.034 82 HG3 ARG 12 HG1 ARG 12 19.379 8.381 2.486 83 HD2 ARG 12 HD2 ARG 12 18.772 10.127 4.110 84 HD3 ARG 12 HD1 ARG 12 20.171 11.068 3.597 85 HE ARG 12 HE ARG 12 18.229 10.321 1.556 86 HH11 ARG 12 HH11 ARG 12 19.511 12.780 3.685 87 HH12 ARG 12 HH12 ARG 12 18.815 14.095 2.794 88 HH21 ARG 12 HH21 ARG 12 17.301 12.036 0.385 89 HH22 ARG 12 HH22 ARG 12 17.565 13.672 0.904 90 H TYR 13 HN TYR 13 20.403 5.505 4.601 91 HA TYR 13 HA TYR 13 18.077 5.071 3.029 92 HB2 TYR 13 HB2 TYR 13 19.954 3.725 2.496 93 HB3 TYR 13 HB1 TYR 13 20.161 3.213 4.169 94 HD1 TYR 13 HD1 TYR 13 17.343 3.220 1.718 95 HD2 TYR 13 HD2 TYR 13 19.678 0.994 4.484 96 HE1 TYR 13 HE1 TYR 13 15.941 1.247 1.298 97 HE2 TYR 13 HE2 TYR 13 18.290 -0.995 4.067 98 HH TYR 13 HH TYR 13 15.886 -1.059 1.535 99 H GLN 14 HN GLN 14 19.017 4.003 6.295 100 HA GLN 14 HA GLN 14 16.797 2.489 6.922 101 HB2 GLN 14 HB2 GLN 14 18.396 4.299 8.728 102 HB3 GLN 14 HB1 GLN 14 17.288 3.061 9.285 103 HG2 GLN 14 HG2 GLN 14 18.773 1.499 7.804 104 HG3 GLN 14 HG1 GLN 14 19.956 2.786 8.001 105 HE21 GLN 14 HE21 GLN 14 20.057 0.067 8.982 106 HE22 GLN 14 HE22 GLN 14 20.205 0.176 10.702 107 H LYS 15 HN LYS 15 17.228 5.943 7.679 108 HA LYS 15 HA LYS 15 14.610 6.299 8.588 109 HB2 LYS 15 HB2 LYS 15 16.587 8.307 7.519 110 HB3 LYS 15 HB1 LYS 15 15.052 8.740 8.269 111 HG2 LYS 15 HG2 LYS 15 17.204 7.128 9.621 112 HG3 LYS 15 HG1 LYS 15 16.991 8.870 9.804 113 HD2 LYS 15 HD2 LYS 15 14.975 8.631 10.941 114 HD3 LYS 15 HD1 LYS 15 14.712 6.998 10.332 115 HE2 LYS 15 HE2 LYS 15 16.476 6.144 11.723 116 HE3 LYS 15 HE1 LYS 15 16.892 7.772 12.259 117 HZ1 LYS 15 HZ1 LYS 15 14.776 7.946 13.353 118 HZ2 LYS 15 HZ2 LYS 15 15.550 6.540 13.883 119 HZ3 LYS 15 HZ3 LYS 15 14.288 6.438 12.764 120 H LEU 16 HN LEU 16 15.921 6.211 5.389 121 HA LEU 16 HA LEU 16 13.795 7.535 4.061 122 HB2 LEU 16 HB2 LEU 16 16.090 6.996 3.127 123 HB3 LEU 16 HB1 LEU 16 15.523 5.349 2.918 124 HG LEU 16 HG LEU 16 13.866 6.058 1.307 125 HD11 LEU 16 HD11 LEU 16 13.788 8.440 0.597 126 HD12 LEU 16 HD12 LEU 16 14.806 8.844 1.975 127 HD13 LEU 16 HD13 LEU 16 13.195 8.171 2.235 128 HD21 LEU 16 HD21 LEU 16 16.159 5.639 0.557 129 HD22 LEU 16 HD22 LEU 16 16.526 7.353 0.757 130 HD23 LEU 16 HD23 LEU 16 15.338 6.840 -0.443 131 H VAL 17 HN VAL 17 14.473 4.107 4.740 132 HA VAL 17 HA VAL 17 12.105 3.093 3.591 133 HB VAL 17 HB VAL 17 12.613 1.051 4.488 134 HG11 VAL 17 HG11 VAL 17 15.023 0.774 4.688 135 HG12 VAL 17 HG12 VAL 17 15.201 2.521 4.867 136 HG13 VAL 17 HG13 VAL 17 14.596 1.847 3.353 137 HG21 VAL 17 HG21 VAL 17 12.144 1.601 6.813 138 HG22 VAL 17 HG22 VAL 17 13.725 2.370 6.963 139 HG23 VAL 17 HG23 VAL 17 13.613 0.631 6.684 140 H THR 18 HN THR 18 12.837 4.530 6.677 141 HA THR 18 HA THR 18 10.510 3.957 8.066 142 HB THR 18 HB THR 18 12.451 6.261 8.118 143 HG1 THR 18 HG1 THR 18 13.401 4.450 8.917 144 HG21 THR 18 HG21 THR 18 10.168 5.706 9.980 145 HG22 THR 18 HG22 THR 18 10.389 7.115 8.941 146 HG23 THR 18 HG23 THR 18 11.480 6.841 10.299 147 H GLU 19 HN GLU 19 11.388 6.859 6.211 148 HA GLU 19 HA GLU 19 8.940 8.162 6.249 149 HB2 GLU 19 HB2 GLU 19 11.023 8.121 4.048 150 HB3 GLU 19 HB1 GLU 19 9.738 9.317 4.213 151 HG2 GLU 19 HG2 GLU 19 10.656 9.981 6.394 152 HG3 GLU 19 HG1 GLU 19 11.956 8.802 6.193 153 H ASN 20 HN ASN 20 10.112 5.610 4.203 154 HA ASN 20 HA ASN 20 8.071 5.758 2.239 155 HB2 ASN 20 HB2 ASN 20 10.386 4.810 1.966 156 HB3 ASN 20 HB1 ASN 20 9.854 3.417 2.896 157 HD21 ASN 20 HD21 ASN 20 10.352 2.114 1.131 158 HD22 ASN 20 HD22 ASN 20 9.330 2.033 -0.256 159 H GLU 21 HN GLU 21 8.503 3.751 5.163 160 HA GLU 21 HA GLU 21 6.167 2.194 4.585 161 HB2 GLU 21 HB2 GLU 21 7.708 2.460 7.162 162 HB3 GLU 21 HB1 GLU 21 6.586 1.170 6.741 163 HG2 GLU 21 HG2 GLU 21 8.936 1.730 5.018 164 HG3 GLU 21 HG1 GLU 21 9.136 0.808 6.495 165 H GLN 22 HN GLN 22 6.855 5.028 6.571 166 HA GLN 22 HA GLN 22 4.644 5.032 8.253 167 HB2 GLN 22 HB2 GLN 22 5.903 7.448 6.944 168 HB3 GLN 22 HB1 GLN 22 4.860 7.475 8.356 169 HG2 GLN 22 HG2 GLN 22 6.499 6.263 9.654 170 HG3 GLN 22 HG1 GLN 22 7.539 6.112 8.240 171 HE21 GLN 22 HE21 GLN 22 6.308 8.256 10.680 172 HE22 GLN 22 HE22 GLN 22 7.424 9.544 10.395 173 H LEU 23 HN LEU 23 4.943 6.631 5.095 174 HA LEU 23 HA LEU 23 2.216 7.448 5.221 175 HB2 LEU 23 HB2 LEU 23 2.629 8.777 3.396 176 HB3 LEU 23 HB1 LEU 23 4.158 8.742 4.222 177 HG LEU 23 HG LEU 23 3.434 7.356 1.650 178 HD11 LEU 23 HD11 LEU 23 5.224 8.750 0.768 179 HD12 LEU 23 HD12 LEU 23 5.471 9.451 2.367 180 HD13 LEU 23 HD13 LEU 23 3.954 9.723 1.508 181 HD21 LEU 23 HD21 LEU 23 5.726 6.523 1.594 182 HD22 LEU 23 HD22 LEU 23 4.821 5.833 2.942 183 HD23 LEU 23 HD23 LEU 23 5.986 7.126 3.232 184 H GLN 24 HN GLN 24 3.880 4.719 3.897 185 HA GLN 24 HA GLN 24 1.999 3.712 2.134 186 HB2 GLN 24 HB2 GLN 24 3.707 2.351 4.179 187 HB3 GLN 24 HB1 GLN 24 2.588 1.427 3.196 188 HG2 GLN 24 HG2 GLN 24 3.802 2.652 1.240 189 HG3 GLN 24 HG1 GLN 24 5.079 2.850 2.428 190 HE21 GLN 24 HE21 GLN 24 6.256 1.081 3.069 191 HE22 GLN 24 HE22 GLN 24 6.124 -0.468 2.324 192 H ARG 25 HN ARG 25 2.064 3.541 5.645 193 HA ARG 25 HA ARG 25 -0.375 2.182 5.999 194 HB2 ARG 25 HB2 ARG 25 0.758 2.090 7.952 195 HB3 ARG 25 HB1 ARG 25 1.639 3.570 7.613 196 HG2 ARG 25 HG2 ARG 25 -0.590 4.732 8.178 197 HG3 ARG 25 HG1 ARG 25 -0.990 3.205 8.976 198 HD2 ARG 25 HD2 ARG 25 1.105 3.393 10.280 199 HD3 ARG 25 HD1 ARG 25 1.419 4.950 9.508 200 HE ARG 25 HE ARG 25 -1.117 4.741 10.894 201 HH11 ARG 25 HH11 ARG 25 2.263 5.636 11.101 202 HH12 ARG 25 HH12 ARG 25 2.021 6.731 12.424 203 HH21 ARG 25 HH21 ARG 25 -1.434 6.162 12.642 204 HH22 ARG 25 HH22 ARG 25 -0.081 7.024 13.305 205 H LEU 26 HN LEU 26 0.509 5.593 5.905 206 HA LEU 26 HA LEU 26 -1.997 6.639 6.656 207 HB2 LEU 26 HB2 LEU 26 0.154 7.922 4.967 208 HB3 LEU 26 HB1 LEU 26 -1.119 8.763 5.840 209 HG LEU 26 HG LEU 26 1.030 7.099 7.160 210 HD11 LEU 26 HD11 LEU 26 0.829 10.099 7.061 211 HD12 LEU 26 HD12 LEU 26 1.917 9.140 6.059 212 HD13 LEU 26 HD13 LEU 26 2.097 9.126 7.811 213 HD21 LEU 26 HD21 LEU 26 -1.034 8.973 8.305 214 HD22 LEU 26 HD22 LEU 26 0.246 8.173 9.216 215 HD23 LEU 26 HD23 LEU 26 -1.023 7.216 8.451 216 H ILE 27 HN ILE 27 -0.612 5.745 3.556 217 HA ILE 27 HA ILE 27 -2.732 6.639 1.915 218 HB ILE 27 HB ILE 27 -0.812 4.335 1.548 219 HG12 ILE 27 HG12 ILE 27 -0.828 7.069 0.266 220 HG13 ILE 27 HG11 ILE 27 0.167 6.630 1.662 221 HG21 ILE 27 HG21 ILE 27 -2.831 3.984 0.220 222 HG22 ILE 27 HG22 ILE 27 -1.441 4.345 -0.803 223 HG23 ILE 27 HG23 ILE 27 -2.648 5.591 -0.485 224 HD11 ILE 27 HD11 ILE 27 1.322 4.972 0.353 225 HD12 ILE 27 HD12 ILE 27 1.389 6.534 -0.468 226 HD13 ILE 27 HD13 ILE 27 0.274 5.290 -1.028 227 H THR 28 HN THR 28 -2.007 3.442 3.294 228 HA THR 28 HA THR 28 -4.181 2.095 2.245 229 HB THR 28 HB THR 28 -2.097 1.230 3.631 230 HG1 THR 28 HG1 THR 28 -3.745 -0.008 2.450 231 HG21 THR 28 HG21 THR 28 -2.820 0.340 5.827 232 HG22 THR 28 HG22 THR 28 -4.314 1.274 5.684 233 HG23 THR 28 HG23 THR 28 -2.758 2.104 5.798 234 H GLN 29 HN GLN 29 -4.048 4.082 5.157 235 HA GLN 29 HA GLN 29 -6.486 3.337 6.330 236 HB2 GLN 29 HB2 GLN 29 -5.243 6.093 6.270 237 HB3 GLN 29 HB1 GLN 29 -6.440 5.524 7.421 238 HG2 GLN 29 HG2 GLN 29 -3.685 4.368 7.128 239 HG3 GLN 29 HG1 GLN 29 -4.135 5.611 8.288 240 HE21 GLN 29 HE21 GLN 29 -4.417 2.270 7.410 241 HE22 GLN 29 HE22 GLN 29 -5.086 1.719 8.904 242 H LYS 30 HN LYS 30 -5.745 6.022 4.180 243 HA LYS 30 HA LYS 30 -8.440 6.806 3.791 244 HB2 LYS 30 HB2 LYS 30 -6.065 7.391 2.013 245 HB3 LYS 30 HB1 LYS 30 -7.562 8.308 2.107 246 HG2 LYS 30 HG2 LYS 30 -7.042 8.948 4.401 247 HG3 LYS 30 HG1 LYS 30 -5.553 8.006 4.332 248 HD2 LYS 30 HD2 LYS 30 -4.789 9.443 2.461 249 HD3 LYS 30 HD1 LYS 30 -6.241 10.424 2.664 250 HE2 LYS 30 HE2 LYS 30 -4.101 9.975 4.744 251 HE3 LYS 30 HE1 LYS 30 -4.303 11.429 3.770 252 HZ1 LYS 30 HZ1 LYS 30 -6.235 10.382 5.764 253 HZ2 LYS 30 HZ2 LYS 30 -6.482 11.747 4.797 254 HZ3 LYS 30 HZ3 LYS 30 -5.242 11.737 5.944 255 H GLU 31 HN GLU 31 -6.161 4.992 1.725 256 HA GLU 31 HA GLU 31 -7.705 4.518 -0.465 257 HB2 GLU 31 HB2 GLU 31 -5.499 3.087 0.862 258 HB3 GLU 31 HB1 GLU 31 -6.436 2.158 -0.301 259 HG2 GLU 31 HG2 GLU 31 -5.171 4.818 -0.882 260 HG3 GLU 31 HG1 GLU 31 -4.443 3.260 -1.253 261 H GLU 32 HN GLU 32 -7.722 2.466 2.500 262 HA GLU 32 HA GLU 32 -9.484 0.566 1.389 263 HB2 GLU 32 HB2 GLU 32 -9.917 -0.148 3.741 264 HB3 GLU 32 HB1 GLU 32 -8.217 -0.068 3.311 265 HG2 GLU 32 HG2 GLU 32 -7.924 1.954 4.532 266 HG3 GLU 32 HG1 GLU 32 -9.666 2.107 4.795 267 H LYS 33 HN LYS 33 -10.090 3.570 3.096 268 HA LYS 33 HA LYS 33 -12.917 3.152 3.311 269 HB2 LYS 33 HB2 LYS 33 -11.269 5.677 3.508 270 HB3 LYS 33 HB1 LYS 33 -12.978 5.560 3.902 271 HG2 LYS 33 HG2 LYS 33 -12.465 3.962 5.673 272 HG3 LYS 33 HG1 LYS 33 -10.750 4.075 5.277 273 HD2 LYS 33 HD2 LYS 33 -10.730 6.420 5.875 274 HD3 LYS 33 HD1 LYS 33 -12.471 6.385 6.169 275 HE2 LYS 33 HE2 LYS 33 -10.391 4.808 7.683 276 HE3 LYS 33 HE1 LYS 33 -11.201 6.265 8.261 277 HZ1 LYS 33 HZ1 LYS 33 -13.318 5.065 8.096 278 HZ2 LYS 33 HZ2 LYS 33 -12.252 4.321 9.174 279 HZ3 LYS 33 HZ3 LYS 33 -12.492 3.663 7.638 280 H ILE 34 HN ILE 34 -10.829 5.067 1.183 281 HA ILE 34 HA ILE 34 -12.883 6.082 -0.467 282 HB ILE 34 HB ILE 34 -9.944 5.639 -1.028 283 HG12 ILE 34 HG12 ILE 34 -11.332 8.264 -0.627 284 HG13 ILE 34 HG11 ILE 34 -10.855 7.295 0.767 285 HG21 ILE 34 HG21 ILE 34 -10.246 7.192 -2.910 286 HG22 ILE 34 HG22 ILE 34 -11.989 7.139 -2.648 287 HG23 ILE 34 HG23 ILE 34 -11.125 5.679 -3.130 288 HD11 ILE 34 HD11 ILE 34 -9.172 8.967 0.241 289 HD12 ILE 34 HD12 ILE 34 -8.994 8.286 -1.376 290 HD13 ILE 34 HD13 ILE 34 -8.538 7.334 0.039 291 H ARG 35 HN ARG 35 -11.103 3.074 -0.451 292 HA ARG 35 HA ARG 35 -11.580 2.002 -2.894 293 HB2 ARG 35 HB2 ARG 35 -10.467 1.141 -0.644 294 HB3 ARG 35 HB1 ARG 35 -12.017 0.330 -0.472 295 HG2 ARG 35 HG2 ARG 35 -11.689 -0.673 -2.675 296 HG3 ARG 35 HG1 ARG 35 -10.099 0.080 -2.749 297 HD2 ARG 35 HD2 ARG 35 -9.363 -1.159 -0.826 298 HD3 ARG 35 HD1 ARG 35 -10.978 -1.820 -0.584 299 HE ARG 35 HE ARG 35 -9.833 -2.439 -3.151 300 HH11 ARG 35 HH11 ARG 35 -10.040 -3.401 0.200 301 HH12 ARG 35 HH12 ARG 35 -9.768 -5.082 -0.123 302 HH21 ARG 35 HH21 ARG 35 -9.425 -4.651 -3.592 303 HH22 ARG 35 HH22 ARG 35 -9.416 -5.795 -2.288 304 H VAL 36 HN VAL 36 -13.723 1.927 -0.049 305 HA VAL 36 HA VAL 36 -15.818 0.547 -1.355 306 HB VAL 36 HB VAL 36 -16.256 2.460 0.922 307 HG11 VAL 36 HG11 VAL 36 -17.926 0.714 1.553 308 HG12 VAL 36 HG12 VAL 36 -17.555 -0.108 0.033 309 HG13 VAL 36 HG13 VAL 36 -18.254 1.512 0.015 310 HG21 VAL 36 HG21 VAL 36 -15.153 -0.344 1.088 311 HG22 VAL 36 HG22 VAL 36 -15.678 0.631 2.461 312 HG23 VAL 36 HG23 VAL 36 -14.291 1.140 1.494 313 H LEU 37 HN LEU 37 -15.075 3.961 -0.944 314 HA LEU 37 HA LEU 37 -17.452 5.024 -2.023 315 HB2 LEU 37 HB2 LEU 37 -14.681 6.065 -1.636 316 HB3 LEU 37 HB1 LEU 37 -15.796 6.975 -2.638 317 HG LEU 37 HG LEU 37 -15.585 7.646 -0.179 318 HD11 LEU 37 HD11 LEU 37 -17.979 8.158 -0.012 319 HD12 LEU 37 HD12 LEU 37 -18.295 7.050 -1.349 320 HD13 LEU 37 HD13 LEU 37 -17.328 8.503 -1.616 321 HD21 LEU 37 HD21 LEU 37 -16.976 6.422 1.396 322 HD22 LEU 37 HD22 LEU 37 -15.680 5.401 0.774 323 HD23 LEU 37 HD23 LEU 37 -17.322 5.210 0.163 324 H ARG 38 HN ARG 38 -14.387 4.086 -3.518 325 HA ARG 38 HA ARG 38 -15.081 5.088 -6.084 326 HB2 ARG 38 HB2 ARG 38 -13.083 4.123 -6.881 327 HB3 ARG 38 HB1 ARG 38 -12.771 4.635 -5.240 328 HG2 ARG 38 HG2 ARG 38 -13.010 2.334 -4.462 329 HG3 ARG 38 HG1 ARG 38 -13.257 1.820 -6.134 330 HD2 ARG 38 HD2 ARG 38 -10.898 1.586 -5.205 331 HD3 ARG 38 HD1 ARG 38 -11.064 2.409 -6.755 332 HE ARG 38 HE ARG 38 -11.039 4.514 -5.254 333 HH11 ARG 38 HH11 ARG 38 -9.131 1.619 -4.709 334 HH12 ARG 38 HH12 ARG 38 -7.847 2.475 -3.904 335 HH21 ARG 38 HH21 ARG 38 -9.341 5.619 -4.226 336 HH22 ARG 38 HH22 ARG 38 -7.964 4.738 -3.627 337 H GLN 39 HN GLN 39 -15.372 1.944 -4.542 338 HA GLN 39 HA GLN 39 -16.486 0.491 -6.638 339 HB2 GLN 39 HB2 GLN 39 -17.273 0.447 -3.721 340 HB3 GLN 39 HB1 GLN 39 -17.673 -0.796 -4.901 341 HG2 GLN 39 HG2 GLN 39 -14.893 0.001 -4.105 342 HG3 GLN 39 HG1 GLN 39 -15.772 -1.386 -3.481 343 HE21 GLN 39 HE21 GLN 39 -16.172 -3.146 -4.860 344 HE22 GLN 39 HE22 GLN 39 -15.293 -3.370 -6.334 345 H ARG 40 HN ARG 40 -18.054 2.707 -4.379 346 HA ARG 40 HA ARG 40 -20.653 2.509 -5.412 347 HB2 ARG 40 HB2 ARG 40 -19.191 4.713 -3.968 348 HB3 ARG 40 HB1 ARG 40 -20.886 4.815 -4.389 349 HG2 ARG 40 HG2 ARG 40 -21.402 2.907 -3.020 350 HG3 ARG 40 HG1 ARG 40 -19.689 2.633 -2.706 351 HD2 ARG 40 HD2 ARG 40 -20.611 3.693 -0.788 352 HD3 ARG 40 HD1 ARG 40 -19.613 4.879 -1.617 353 HE ARG 40 HE ARG 40 -21.865 5.630 -2.600 354 HH11 ARG 40 HH11 ARG 40 -21.452 4.291 0.611 355 HH12 ARG 40 HH12 ARG 40 -22.763 5.195 1.295 356 HH21 ARG 40 HH21 ARG 40 -23.587 6.836 -1.692 357 HH22 ARG 40 HH22 ARG 40 -23.974 6.652 -0.012 358 H LEU 41 HN LEU 41 -17.961 4.668 -6.198 359 HA LEU 41 HA LEU 41 -19.372 6.037 -8.256 360 HB2 LEU 41 HB2 LEU 41 -16.400 5.782 -8.328 361 HB3 LEU 41 HB1 LEU 41 -17.422 7.128 -8.790 362 HG LEU 41 HG LEU 41 -16.801 6.280 -5.964 363 HD11 LEU 41 HD11 LEU 41 -14.891 7.266 -7.074 364 HD12 LEU 41 HD12 LEU 41 -15.551 8.387 -5.885 365 HD13 LEU 41 HD13 LEU 41 -15.873 8.633 -7.600 366 HD21 LEU 41 HD21 LEU 41 -18.343 8.672 -6.963 367 HD22 LEU 41 HD22 LEU 41 -17.932 8.313 -5.282 368 HD23 LEU 41 HD23 LEU 41 -19.040 7.260 -6.166 369 H VAL 42 HN VAL 42 -17.769 2.974 -8.140 370 HA VAL 42 HA VAL 42 -17.358 2.534 -10.886 371 HB VAL 42 HB VAL 42 -18.104 0.658 -8.633 372 HG11 VAL 42 HG11 VAL 42 -18.977 -0.320 -10.654 373 HG12 VAL 42 HG12 VAL 42 -17.548 -1.210 -10.119 374 HG13 VAL 42 HG13 VAL 42 -17.431 -0.082 -11.472 375 HG21 VAL 42 HG21 VAL 42 -15.790 -0.125 -8.894 376 HG22 VAL 42 HG22 VAL 42 -15.876 1.589 -8.488 377 HG23 VAL 42 HG23 VAL 42 -15.533 1.090 -10.146 378 H GLU 43 HN GLU 43 -20.187 2.351 -8.853 379 HA GLU 43 HA GLU 43 -21.940 1.411 -10.905 380 HB2 GLU 43 HB2 GLU 43 -22.610 2.765 -8.289 381 HB3 GLU 43 HB1 GLU 43 -23.713 1.838 -9.295 382 HG2 GLU 43 HG2 GLU 43 -22.345 -0.164 -8.914 383 HG3 GLU 43 HG1 GLU 43 -21.301 0.774 -7.848 384 H ARG 44 HN ARG 44 -20.601 4.454 -10.126 385 HA ARG 44 HA ARG 44 -22.730 5.931 -11.453 386 HB2 ARG 44 HB2 ARG 44 -21.935 7.779 -10.426 387 HB3 ARG 44 HB1 ARG 44 -21.169 6.622 -9.350 388 HG2 ARG 44 HG2 ARG 44 -19.106 6.881 -10.355 389 HG3 ARG 44 HG1 ARG 44 -19.819 7.606 -11.790 390 HD2 ARG 44 HD2 ARG 44 -20.455 9.577 -10.450 391 HD3 ARG 44 HD1 ARG 44 -19.689 8.844 -9.043 392 HE ARG 44 HE ARG 44 -17.769 8.944 -11.029 393 HH11 ARG 44 HH11 ARG 44 -19.736 11.238 -9.280 394 HH12 ARG 44 HH12 ARG 44 -18.543 12.497 -9.335 395 HH21 ARG 44 HH21 ARG 44 -16.177 10.576 -11.090 396 HH22 ARG 44 HH22 ARG 44 -16.530 12.129 -10.392 397 H GLY 45 HN GLY 45 -19.487 4.837 -11.878 398 HA2 GLY 45 HA2 GLY 45 -18.806 4.142 -14.094 399 HA3 GLY 45 HA1 GLY 45 -19.642 5.553 -14.727 400 H ASP 46 HN ASP 46 -17.520 5.495 -11.900 401 HA ASP 46 HA ASP 46 -15.894 7.569 -13.153 402 HB2 ASP 46 HB2 ASP 46 -16.706 7.763 -10.779 403 HB3 ASP 46 HB1 ASP 46 -15.638 6.429 -10.366 404 H ALA 47 HN ALA 47 -15.676 4.235 -12.143 405 HA ALA 47 HA ALA 47 -12.824 4.059 -12.449 406 HB1 ALA 47 HB1 ALA 47 -14.886 1.859 -12.277 407 HB2 ALA 47 HB2 ALA 47 -14.017 2.569 -10.917 408 HB3 ALA 47 HB3 ALA 47 -13.141 1.656 -12.144 409 H LYS 48 HN LYS 48 -15.474 4.127 -14.510 410 HA LYS 48 HA LYS 48 -14.554 2.626 -16.715 411 HB2 LYS 48 HB2 LYS 48 -16.870 3.560 -16.374 412 HB3 LYS 48 HB1 LYS 48 -16.226 5.144 -16.778 413 HG2 LYS 48 HG2 LYS 48 -17.279 4.219 -18.710 414 HG3 LYS 48 HG1 LYS 48 -15.536 4.250 -18.979 415 HD2 LYS 48 HD2 LYS 48 -15.414 1.876 -18.358 416 HD3 LYS 48 HD1 LYS 48 -17.165 1.854 -18.134 417 HE2 LYS 48 HE2 LYS 48 -15.718 2.469 -20.702 418 HE3 LYS 48 HE1 LYS 48 -16.504 0.944 -20.308 419 HZ1 LYS 48 HZ1 LYS 48 -17.917 2.322 -21.694 420 HZ2 LYS 48 HZ2 LYS 48 -17.860 3.576 -20.564 421 HZ3 LYS 48 HZ3 LYS 48 -18.621 2.116 -20.170 422 H GLY 49 HN GLY 49 -13.735 5.752 -15.438 423 HA2 GLY 49 HA2 GLY 49 -12.360 6.716 -17.758 424 HA3 GLY 49 HA1 GLY 49 -12.243 7.368 -16.129 425 H THR 50 HN THR 50 -11.613 4.427 -15.369 426 HA THR 50 HA THR 50 -8.750 4.580 -16.017 427 HB THR 50 HB THR 50 -10.062 3.092 -13.725 428 HG1 THR 50 HG1 THR 50 -9.919 5.615 -13.872 429 HG21 THR 50 HG21 THR 50 -7.899 2.164 -14.427 430 HG22 THR 50 HG22 THR 50 -7.789 2.923 -12.839 431 HG23 THR 50 HG23 THR 50 -7.162 3.758 -14.259 432 H GLU 51 HN GLU 51 -8.790 3.457 -17.964 433 HA GLU 51 HA GLU 51 -10.150 0.941 -18.172 434 HB2 GLU 51 HB2 GLU 51 -8.621 0.984 -20.381 435 HB3 GLU 51 HB1 GLU 51 -10.180 1.769 -20.267 436 HG2 GLU 51 HG2 GLU 51 -8.558 3.207 -21.316 437 HG3 GLU 51 HG1 GLU 51 -9.074 3.883 -19.775 438 H LEU 52 HN LEU 52 -9.376 -1.026 -17.877 439 HA LEU 52 HA LEU 52 -6.514 -1.268 -17.217 440 HB2 LEU 52 HB2 LEU 52 -8.834 -2.774 -16.004 441 HB3 LEU 52 HB1 LEU 52 -7.145 -3.002 -15.598 442 HG LEU 52 HG LEU 52 -8.714 -0.467 -15.122 443 HD11 LEU 52 HD11 LEU 52 -8.594 -1.072 -12.766 444 HD12 LEU 52 HD12 LEU 52 -7.793 -2.585 -13.187 445 HD13 LEU 52 HD13 LEU 52 -9.458 -2.299 -13.692 446 HD21 LEU 52 HD21 LEU 52 -5.913 -1.261 -14.333 447 HD22 LEU 52 HD22 LEU 52 -6.754 0.186 -13.781 448 HD23 LEU 52 HD23 LEU 52 -6.365 -0.008 -15.490 449 H ASN 53 HN ASN 53 -8.680 -2.016 -19.511 450 HA ASN 53 HA ASN 53 -7.502 -4.668 -20.006 451 HB2 ASN 53 HB2 ASN 53 -10.265 -3.669 -20.713 452 HB3 ASN 53 HB1 ASN 53 -9.585 -5.181 -21.302 453 HD21 ASN 53 HD21 ASN 53 -10.873 -3.486 -18.574 454 HD22 ASN 53 HD22 ASN 53 -11.026 -4.858 -17.531 455 H GLY 84 HN GLY 84 18.599 -16.650 -17.249 456 HA2 GLY 84 HA2 GLY 84 20.036 -15.976 -14.997 457 HA3 GLY 84 HA1 GLY 84 20.589 -14.875 -16.256 458 HA PRO 85 HA PRO 85 16.308 -13.693 -14.573 459 HB2 PRO 85 HB2 PRO 85 16.722 -12.348 -12.316 460 HB3 PRO 85 HB1 PRO 85 16.711 -14.116 -12.322 461 HG2 PRO 85 HG2 PRO 85 19.042 -12.237 -12.321 462 HG3 PRO 85 HG1 PRO 85 18.799 -13.712 -11.364 463 HD2 PRO 85 HD2 PRO 85 20.284 -13.608 -13.683 464 HD3 PRO 85 HD1 PRO 85 19.504 -15.077 -13.066 465 H LEU 86 HN LEU 86 15.602 -11.334 -13.822 466 HA LEU 86 HA LEU 86 16.126 -9.481 -15.757 467 HB2 LEU 86 HB2 LEU 86 15.546 -7.794 -13.798 468 HB3 LEU 86 HB1 LEU 86 14.341 -8.835 -14.519 469 HG LEU 86 HG LEU 86 14.583 -10.413 -12.633 470 HD11 LEU 86 HD11 LEU 86 15.786 -9.688 -10.609 471 HD12 LEU 86 HD12 LEU 86 16.470 -8.344 -11.524 472 HD13 LEU 86 HD13 LEU 86 16.865 -10.007 -11.970 473 HD21 LEU 86 HD21 LEU 86 14.007 -7.572 -11.816 474 HD22 LEU 86 HD22 LEU 86 13.493 -9.020 -10.951 475 HD23 LEU 86 HD23 LEU 86 12.869 -8.690 -12.567 476 H GLY 87 HN GLY 87 17.450 -7.676 -15.995 477 HA2 GLY 87 HA2 GLY 87 20.042 -7.967 -14.666 478 HA3 GLY 87 HA1 GLY 87 19.720 -7.045 -16.128 479 H SER 88 HN SER 88 17.464 -6.541 -13.653 480 HA SER 88 HA SER 88 18.294 -3.812 -13.362 481 HB2 SER 88 HB2 SER 88 16.276 -3.771 -11.781 482 HB3 SER 88 HB1 SER 88 15.959 -4.149 -13.474 483 HG SER 88 HG SER 88 14.882 -5.624 -12.166 484 H ARG 89 HN ARG 89 18.479 -6.731 -11.454 485 HA ARG 89 HA ARG 89 19.188 -5.380 -9.019 486 HB2 ARG 89 HB2 ARG 89 19.322 -8.296 -9.795 487 HB3 ARG 89 HB1 ARG 89 19.678 -7.680 -8.187 488 HG2 ARG 89 HG2 ARG 89 17.371 -6.777 -8.079 489 HG3 ARG 89 HG1 ARG 89 17.040 -7.555 -9.628 490 HD2 ARG 89 HD2 ARG 89 16.255 -8.938 -7.794 491 HD3 ARG 89 HD1 ARG 89 17.580 -9.731 -8.645 492 HE ARG 89 HE ARG 89 18.664 -8.273 -6.511 493 HH11 ARG 89 HH11 ARG 89 16.587 -11.055 -7.028 494 HH12 ARG 89 HH12 ARG 89 17.068 -11.844 -5.562 495 HH21 ARG 89 HH21 ARG 89 19.282 -9.295 -4.590 496 HH22 ARG 89 HH22 ARG 89 18.602 -10.832 -4.159 497 H ARG 90 HN ARG 90 20.925 -7.453 -11.324 498 HA ARG 90 HA ARG 90 23.132 -7.682 -11.825 499 HB2 ARG 90 HB2 ARG 90 22.513 -5.302 -12.575 500 HB3 ARG 90 HB1 ARG 90 23.397 -4.759 -11.156 501 HG2 ARG 90 HG2 ARG 90 24.897 -4.620 -12.960 502 HG3 ARG 90 HG1 ARG 90 25.373 -6.050 -12.041 503 HD2 ARG 90 HD2 ARG 90 25.408 -6.520 -14.424 504 HD3 ARG 90 HD1 ARG 90 24.152 -7.465 -13.629 505 HE ARG 90 HE ARG 90 23.044 -5.061 -14.591 506 HH11 ARG 90 HH11 ARG 90 24.311 -8.111 -15.760 507 HH12 ARG 90 HH12 ARG 90 23.356 -8.101 -17.207 508 HH21 ARG 90 HH21 ARG 90 21.780 -5.045 -16.492 509 HH22 ARG 90 HH22 ARG 90 21.906 -6.358 -17.620 510 H PHE 91 HN PHE 91 23.038 -8.835 -9.615 511 HA PHE 91 HA PHE 91 24.068 -9.443 -7.691 512 HB2 PHE 91 HB2 PHE 91 26.199 -7.453 -8.511 513 HB3 PHE 91 HB1 PHE 91 26.377 -8.723 -7.309 514 HD1 PHE 91 HD1 PHE 91 26.717 -7.852 -10.737 515 HD2 PHE 91 HD2 PHE 91 26.112 -11.140 -8.105 516 HE1 PHE 91 HE1 PHE 91 27.495 -9.391 -12.489 517 HE2 PHE 91 HE2 PHE 91 26.891 -12.688 -9.854 518 HZ PHE 91 HZ PHE 91 27.584 -11.813 -12.050 519 H VAL 92 HN VAL 92 25.714 -7.717 -5.973 520 HA VAL 92 HA VAL 92 23.539 -6.308 -4.692 521 HB VAL 92 HB VAL 92 25.084 -5.883 -2.864 522 HG11 VAL 92 HG11 VAL 92 25.567 -8.198 -2.223 523 HG12 VAL 92 HG12 VAL 92 25.277 -8.714 -3.885 524 HG13 VAL 92 HG13 VAL 92 23.959 -8.037 -2.928 525 HG21 VAL 92 HG21 VAL 92 27.110 -5.444 -4.114 526 HG22 VAL 92 HG22 VAL 92 27.176 -7.124 -4.647 527 HG23 VAL 92 HG23 VAL 92 27.398 -6.730 -2.943 528 H VAL 93 HN VAL 93 25.510 -5.513 -7.162 529 HA VAL 93 HA VAL 93 26.501 -2.966 -6.381 530 HB VAL 93 HB VAL 93 26.011 -4.014 -9.162 531 HG11 VAL 93 HG11 VAL 93 27.743 -1.742 -8.198 532 HG12 VAL 93 HG12 VAL 93 26.247 -1.592 -9.120 533 HG13 VAL 93 HG13 VAL 93 27.664 -2.341 -9.855 534 HG21 VAL 93 HG21 VAL 93 28.392 -4.590 -9.156 535 HG22 VAL 93 HG22 VAL 93 27.507 -5.469 -7.909 536 HG23 VAL 93 HG23 VAL 93 28.505 -4.081 -7.471 537 H ASP 94 HN ASP 94 23.954 -3.758 -8.767 538 HA ASP 94 HA ASP 94 22.894 -1.127 -8.651 539 HB2 ASP 94 HB2 ASP 94 22.100 -3.683 -9.984 540 HB3 ASP 94 HB1 ASP 94 20.965 -2.353 -9.909 541 H ASP 95 HN ASP 95 21.980 -4.260 -7.234 542 HA ASP 95 HA ASP 95 19.543 -3.550 -6.099 543 HB2 ASP 95 HB2 ASP 95 21.611 -5.555 -5.447 544 HB3 ASP 95 HB1 ASP 95 20.533 -5.108 -4.124 545 H ARG 96 HN ARG 96 22.633 -2.353 -5.308 546 HA ARG 96 HA ARG 96 21.956 -1.674 -2.577 547 HB2 ARG 96 HB2 ARG 96 24.275 -2.248 -3.158 548 HB3 ARG 96 HB1 ARG 96 24.334 -0.890 -4.274 549 HG2 ARG 96 HG2 ARG 96 24.123 0.674 -2.448 550 HG3 ARG 96 HG1 ARG 96 23.927 -0.654 -1.299 551 HD2 ARG 96 HD2 ARG 96 26.368 -0.132 -2.996 552 HD3 ARG 96 HD1 ARG 96 26.213 0.235 -1.277 553 HE ARG 96 HE ARG 96 25.710 -2.343 -1.213 554 HH11 ARG 96 HH11 ARG 96 28.169 -0.650 -3.044 555 HH12 ARG 96 HH12 ARG 96 29.235 -2.018 -3.103 556 HH21 ARG 96 HH21 ARG 96 27.115 -4.127 -1.268 557 HH22 ARG 96 HH22 ARG 96 28.639 -3.993 -2.092 558 H ARG 97 HN ARG 97 22.977 0.223 -5.390 559 HA ARG 97 HA ARG 97 22.056 2.669 -4.292 560 HB2 ARG 97 HB2 ARG 97 23.861 2.863 -5.747 561 HB3 ARG 97 HB1 ARG 97 23.143 1.794 -6.940 562 HG2 ARG 97 HG2 ARG 97 21.529 4.157 -6.565 563 HG3 ARG 97 HG1 ARG 97 23.196 4.569 -6.986 564 HD2 ARG 97 HD2 ARG 97 21.367 2.693 -8.485 565 HD3 ARG 97 HD1 ARG 97 21.882 4.304 -9.003 566 HE ARG 97 HE ARG 97 24.232 3.217 -8.818 567 HH11 ARG 97 HH11 ARG 97 21.318 1.758 -10.075 568 HH12 ARG 97 HH12 ARG 97 22.171 0.549 -11.001 569 HH21 ARG 97 HH21 ARG 97 25.357 1.686 -10.060 570 HH22 ARG 97 HH22 ARG 97 24.475 0.531 -11.013 571 H GLU 98 HN GLU 98 20.710 0.404 -6.650 572 HA GLU 98 HA GLU 98 18.623 2.087 -7.536 573 HB2 GLU 98 HB2 GLU 98 19.051 -0.876 -7.600 574 HB3 GLU 98 HB1 GLU 98 17.587 -0.131 -8.253 575 HG2 GLU 98 HG2 GLU 98 20.398 0.464 -9.100 576 HG3 GLU 98 HG1 GLU 98 19.265 -0.566 -9.971 577 H LEU 99 HN LEU 99 18.748 -0.477 -5.081 578 HA LEU 99 HA LEU 99 16.023 -0.428 -4.407 579 HB2 LEU 99 HB2 LEU 99 17.420 -2.282 -3.832 580 HB3 LEU 99 HB1 LEU 99 18.476 -1.266 -2.889 581 HG LEU 99 HG LEU 99 16.807 -2.904 -1.742 582 HD11 LEU 99 HD11 LEU 99 16.781 -1.467 0.209 583 HD12 LEU 99 HD12 LEU 99 17.204 -0.078 -0.792 584 HD13 LEU 99 HD13 LEU 99 18.341 -1.416 -0.609 585 HD21 LEU 99 HD21 LEU 99 14.779 -2.123 -2.808 586 HD22 LEU 99 HD22 LEU 99 15.052 -0.495 -2.188 587 HD23 LEU 99 HD23 LEU 99 14.712 -1.818 -1.072 588 H GLN 100 HN GLN 100 18.796 1.275 -2.906 589 HA GLN 100 HA GLN 100 17.171 2.582 -0.978 590 HB2 GLN 100 HB2 GLN 100 19.105 4.066 -0.631 591 HB3 GLN 100 HB1 GLN 100 19.552 2.368 -0.609 592 HG2 GLN 100 HG2 GLN 100 20.272 2.630 -2.993 593 HG3 GLN 100 HG1 GLN 100 20.017 4.366 -2.804 594 HE21 GLN 100 HE21 GLN 100 20.876 4.332 -0.026 595 HE22 GLN 100 HE22 GLN 100 22.601 4.167 -0.043 596 H TYR 101 HN TYR 101 18.085 3.330 -4.264 597 HA TYR 101 HA TYR 101 17.170 6.004 -4.311 598 HB2 TYR 101 HB2 TYR 101 18.636 5.197 -6.061 599 HB3 TYR 101 HB1 TYR 101 17.459 3.977 -6.542 600 HD1 TYR 101 HD1 TYR 101 17.984 7.656 -6.335 601 HD2 TYR 101 HD2 TYR 101 15.837 4.467 -8.157 602 HE1 TYR 101 HE1 TYR 101 16.999 9.240 -7.935 603 HE2 TYR 101 HE2 TYR 101 14.846 6.043 -9.759 604 HH TYR 101 HH TYR 101 15.971 9.266 -10.110 605 H ARG 102 HN ARG 102 15.576 2.915 -5.058 606 HA ARG 102 HA ARG 102 13.211 4.085 -6.057 607 HB2 ARG 102 HB2 ARG 102 12.259 1.921 -6.054 608 HB3 ARG 102 HB1 ARG 102 13.964 1.689 -6.393 609 HG2 ARG 102 HG2 ARG 102 13.708 0.039 -4.878 610 HG3 ARG 102 HG1 ARG 102 14.022 1.355 -3.747 611 HD2 ARG 102 HD2 ARG 102 11.536 1.697 -3.609 612 HD3 ARG 102 HD1 ARG 102 11.350 0.213 -4.541 613 HE ARG 102 HE ARG 102 12.935 -0.002 -2.124 614 HH11 ARG 102 HH11 ARG 102 9.804 -0.411 -3.637 615 HH12 ARG 102 HH12 ARG 102 9.204 -1.471 -2.399 616 HH21 ARG 102 HH21 ARG 102 12.133 -1.388 -0.475 617 HH22 ARG 102 HH22 ARG 102 10.521 -2.017 -0.605 618 H VAL 103 HN VAL 103 14.321 3.518 -2.824 619 HA VAL 103 HA VAL 103 11.764 3.534 -1.571 620 HB VAL 103 HB VAL 103 14.392 4.276 -0.297 621 HG11 VAL 103 HG11 VAL 103 12.459 4.778 1.073 622 HG12 VAL 103 HG12 VAL 103 13.375 3.423 1.744 623 HG13 VAL 103 HG13 VAL 103 11.874 3.127 0.866 624 HG21 VAL 103 HG21 VAL 103 13.197 1.556 -0.751 625 HG22 VAL 103 HG22 VAL 103 14.511 1.887 0.371 626 HG23 VAL 103 HG23 VAL 103 14.743 2.159 -1.355 627 H GLU 104 HN GLU 104 14.204 6.091 -2.127 628 HA GLU 104 HA GLU 104 12.715 8.099 -0.824 629 HB2 GLU 104 HB2 GLU 104 14.166 9.677 -2.278 630 HB3 GLU 104 HB1 GLU 104 14.923 8.708 -1.026 631 HG2 GLU 104 HG2 GLU 104 15.700 7.134 -2.636 632 HG3 GLU 104 HG1 GLU 104 14.814 7.942 -3.923 633 H VAL 105 HN VAL 105 12.704 7.054 -4.219 634 HA VAL 105 HA VAL 105 10.909 9.111 -5.021 635 HB VAL 105 HB VAL 105 11.697 8.243 -6.950 636 HG11 VAL 105 HG11 VAL 105 11.677 5.491 -5.742 637 HG12 VAL 105 HG12 VAL 105 13.081 6.537 -5.949 638 HG13 VAL 105 HG13 VAL 105 12.249 5.891 -7.362 639 HG21 VAL 105 HG21 VAL 105 10.139 6.690 -8.053 640 HG22 VAL 105 HG22 VAL 105 9.324 8.011 -7.218 641 HG23 VAL 105 HG23 VAL 105 9.365 6.404 -6.494 642 H GLN 106 HN GLN 106 10.424 5.810 -3.810 643 HA GLN 106 HA GLN 106 7.625 5.796 -3.963 644 HB2 GLN 106 HB2 GLN 106 9.504 4.416 -2.041 645 HB3 GLN 106 HB1 GLN 106 7.780 4.100 -2.095 646 HG2 GLN 106 HG2 GLN 106 9.668 3.721 -4.399 647 HG3 GLN 106 HG1 GLN 106 9.117 2.441 -3.325 648 HE21 GLN 106 HE21 GLN 106 8.170 4.694 -5.820 649 HE22 GLN 106 HE22 GLN 106 6.704 3.889 -6.261 650 H ASN 107 HN ASN 107 9.793 6.906 -1.388 651 HA ASN 107 HA ASN 107 8.005 7.769 0.534 652 HB2 ASN 107 HB2 ASN 107 10.414 7.859 0.843 653 HB3 ASN 107 HB1 ASN 107 10.557 9.110 -0.390 654 HD21 ASN 107 HD21 ASN 107 8.020 8.943 2.046 655 HD22 ASN 107 HD22 ASN 107 8.506 10.362 2.905 656 H ARG 108 HN ARG 108 8.878 9.338 -2.511 657 HA ARG 108 HA ARG 108 7.372 11.724 -1.882 658 HB2 ARG 108 HB2 ARG 108 8.942 10.842 -4.295 659 HB3 ARG 108 HB1 ARG 108 8.039 12.347 -4.245 660 HG2 ARG 108 HG2 ARG 108 9.383 13.172 -2.449 661 HG3 ARG 108 HG1 ARG 108 10.188 11.612 -2.279 662 HD2 ARG 108 HD2 ARG 108 11.611 13.186 -3.456 663 HD3 ARG 108 HD1 ARG 108 11.139 11.860 -4.516 664 HE ARG 108 HE ARG 108 9.309 13.903 -4.925 665 HH11 ARG 108 HH11 ARG 108 12.747 13.389 -5.293 666 HH12 ARG 108 HH12 ARG 108 12.904 14.494 -6.621 667 HH21 ARG 108 HH21 ARG 108 9.505 15.378 -6.663 668 HH22 ARG 108 HH22 ARG 108 11.054 15.620 -7.409 669 H VAL 109 HN VAL 109 7.155 9.108 -4.285 670 HA VAL 109 HA VAL 109 4.839 10.022 -5.567 671 HB VAL 109 HB VAL 109 5.703 7.145 -5.273 672 HG11 VAL 109 HG11 VAL 109 4.010 8.494 -7.376 673 HG12 VAL 109 HG12 VAL 109 3.418 7.418 -6.112 674 HG13 VAL 109 HG13 VAL 109 4.495 6.799 -7.366 675 HG21 VAL 109 HG21 VAL 109 7.542 8.454 -6.121 676 HG22 VAL 109 HG22 VAL 109 6.487 9.223 -7.311 677 HG23 VAL 109 HG23 VAL 109 6.848 7.502 -7.436 678 H TYR 110 HN TYR 110 5.261 7.958 -2.750 679 HA TYR 110 HA TYR 110 2.515 7.277 -2.488 680 HB2 TYR 110 HB2 TYR 110 4.870 7.149 -0.623 681 HB3 TYR 110 HB1 TYR 110 3.254 6.701 -0.101 682 HD1 TYR 110 HD1 TYR 110 4.248 4.466 0.407 683 HD2 TYR 110 HD2 TYR 110 4.035 5.990 -3.557 684 HE1 TYR 110 HE1 TYR 110 4.566 2.197 -0.482 685 HE2 TYR 110 HE2 TYR 110 4.351 3.727 -4.450 686 HH TYR 110 HH TYR 110 5.333 1.587 -3.717 687 H LYS 111 HN LYS 111 4.506 9.921 -1.345 688 HA LYS 111 HA LYS 111 2.620 11.077 0.415 689 HB2 LYS 111 HB2 LYS 111 4.970 11.752 0.426 690 HB3 LYS 111 HB1 LYS 111 4.825 12.359 -1.216 691 HG2 LYS 111 HG2 LYS 111 4.814 14.183 0.366 692 HG3 LYS 111 HG1 LYS 111 3.251 14.065 -0.441 693 HD2 LYS 111 HD2 LYS 111 2.282 12.994 1.489 694 HD3 LYS 111 HD1 LYS 111 3.855 12.923 2.284 695 HE2 LYS 111 HE2 LYS 111 2.551 14.748 3.191 696 HE3 LYS 111 HE1 LYS 111 3.938 15.376 2.305 697 HZ1 LYS 111 HZ1 LYS 111 1.962 16.642 1.804 698 HZ2 LYS 111 HZ2 LYS 111 1.140 15.254 1.310 699 HZ3 LYS 111 HZ3 LYS 111 2.465 15.814 0.418 700 H LYS 112 HN LYS 112 3.250 11.394 -3.025 701 HA LYS 112 HA LYS 112 1.332 13.381 -3.585 702 HB2 LYS 112 HB2 LYS 112 2.461 11.204 -5.355 703 HB3 LYS 112 HB1 LYS 112 1.539 12.589 -5.926 704 HG2 LYS 112 HG2 LYS 112 3.243 14.102 -5.309 705 HG3 LYS 112 HG1 LYS 112 4.087 12.879 -4.362 706 HD2 LYS 112 HD2 LYS 112 5.245 13.254 -6.456 707 HD3 LYS 112 HD1 LYS 112 4.555 11.635 -6.428 708 HE2 LYS 112 HE2 LYS 112 4.172 12.571 -8.591 709 HE3 LYS 112 HE1 LYS 112 2.633 12.495 -7.740 710 HZ1 LYS 112 HZ1 LYS 112 4.318 14.921 -8.022 711 HZ2 LYS 112 HZ2 LYS 112 2.828 14.840 -7.231 712 HZ3 LYS 112 HZ3 LYS 112 2.909 14.593 -8.899 713 H GLU 113 HN GLU 113 1.113 9.888 -3.241 714 HA GLU 113 HA GLU 113 -1.481 9.546 -4.291 715 HB2 GLU 113 HB2 GLU 113 -0.167 7.990 -2.053 716 HB3 GLU 113 HB1 GLU 113 -1.592 7.489 -2.954 717 HG2 GLU 113 HG2 GLU 113 -0.065 7.685 -5.021 718 HG3 GLU 113 HG1 GLU 113 1.248 7.634 -3.847 719 H ILE 114 HN ILE 114 -0.332 10.226 -1.013 720 HA ILE 114 HA ILE 114 -2.807 10.209 0.277 721 HB ILE 114 HB ILE 114 -0.352 11.834 0.929 722 HG12 ILE 114 HG12 ILE 114 -1.282 9.131 1.918 723 HG13 ILE 114 HG11 ILE 114 0.014 9.398 0.759 724 HG21 ILE 114 HG21 ILE 114 -2.693 11.073 2.672 725 HG22 ILE 114 HG22 ILE 114 -2.349 12.691 2.054 726 HG23 ILE 114 HG23 ILE 114 -1.243 11.928 3.201 727 HD11 ILE 114 HD11 ILE 114 0.028 10.440 3.572 728 HD12 ILE 114 HD12 ILE 114 1.348 10.482 2.402 729 HD13 ILE 114 HD13 ILE 114 0.790 8.939 3.049 730 H GLN 115 HN GLN 115 -1.133 12.786 -1.448 731 HA GLN 115 HA GLN 115 -2.877 14.881 -0.730 732 HB2 GLN 115 HB2 GLN 115 -1.340 14.662 -3.304 733 HB3 GLN 115 HB1 GLN 115 -1.844 16.126 -2.470 734 HG2 GLN 115 HG2 GLN 115 -0.383 15.396 -0.555 735 HG3 GLN 115 HG1 GLN 115 0.249 14.151 -1.631 736 HE21 GLN 115 HE21 GLN 115 -0.049 15.960 -3.946 737 HE22 GLN 115 HE22 GLN 115 1.277 17.054 -3.836 738 H ALA 116 HN ALA 116 -2.834 12.634 -3.457 739 HA ALA 116 HA ALA 116 -5.183 13.573 -4.722 740 HB1 ALA 116 HB1 ALA 116 -3.568 12.058 -5.804 741 HB2 ALA 116 HB2 ALA 116 -5.213 11.423 -5.863 742 HB3 ALA 116 HB3 ALA 116 -4.058 10.771 -4.699 743 H LEU 117 HN LEU 117 -4.582 11.064 -2.333 744 HA LEU 117 HA LEU 117 -7.178 10.123 -1.940 745 HB2 LEU 117 HB2 LEU 117 -4.635 10.131 -0.442 746 HB3 LEU 117 HB1 LEU 117 -6.072 9.862 0.517 747 HG LEU 117 HG LEU 117 -6.473 7.789 -0.411 748 HD11 LEU 117 HD11 LEU 117 -5.576 7.008 -2.554 749 HD12 LEU 117 HD12 LEU 117 -4.834 8.589 -2.811 750 HD13 LEU 117 HD13 LEU 117 -6.590 8.437 -2.743 751 HD21 LEU 117 HD21 LEU 117 -4.398 6.581 -0.441 752 HD22 LEU 117 HD22 LEU 117 -4.312 7.841 0.789 753 HD23 LEU 117 HD23 LEU 117 -3.495 8.060 -0.762 754 H ASP 118 HN ASP 118 -5.628 13.025 -0.831 755 HA ASP 118 HA ASP 118 -7.382 13.612 1.319 756 HB2 ASP 118 HB2 ASP 118 -5.177 14.620 1.155 757 HB3 ASP 118 HB1 ASP 118 -5.625 15.426 -0.346 758 H ALA 119 HN ALA 119 -7.446 14.367 -2.124 759 HA ALA 119 HA ALA 119 -9.760 16.018 -2.055 760 HB1 ALA 119 HB1 ALA 119 -9.929 15.561 -4.445 761 HB2 ALA 119 HB2 ALA 119 -8.765 14.245 -4.290 762 HB3 ALA 119 HB3 ALA 119 -8.257 15.908 -4.005 763 H GLU 120 HN GLU 120 -9.181 12.582 -2.390 764 HA GLU 120 HA GLU 120 -11.852 11.727 -2.606 765 HB2 GLU 120 HB2 GLU 120 -9.241 10.502 -1.866 766 HB3 GLU 120 HB1 GLU 120 -10.696 9.644 -1.447 767 HG2 GLU 120 HG2 GLU 120 -9.606 8.993 -3.605 768 HG3 GLU 120 HG1 GLU 120 -11.325 9.352 -3.672 769 H ILE 121 HN ILE 121 -9.854 12.654 0.145 770 HA ILE 121 HA ILE 121 -11.366 11.641 2.232 771 HB ILE 121 HB ILE 121 -9.403 13.757 1.942 772 HG12 ILE 121 HG12 ILE 121 -8.722 12.949 4.168 773 HG13 ILE 121 HG11 ILE 121 -10.199 11.994 4.265 774 HG21 ILE 121 HG21 ILE 121 -11.534 14.198 4.033 775 HG22 ILE 121 HG22 ILE 121 -11.136 15.263 2.681 776 HG23 ILE 121 HG23 ILE 121 -9.967 15.013 3.977 777 HD11 ILE 121 HD11 ILE 121 -8.280 10.632 3.665 778 HD12 ILE 121 HD12 ILE 121 -8.004 11.636 2.240 779 HD13 ILE 121 HD13 ILE 121 -9.471 10.664 2.366 780 H ARG 122 HN ARG 122 -11.973 14.484 0.226 781 HA ARG 122 HA ARG 122 -14.144 15.524 1.634 782 HB2 ARG 122 HB2 ARG 122 -13.608 15.532 -1.337 783 HB3 ARG 122 HB1 ARG 122 -14.696 16.600 -0.484 784 HG2 ARG 122 HG2 ARG 122 -12.827 17.540 0.765 785 HG3 ARG 122 HG1 ARG 122 -11.727 16.463 -0.098 786 HD2 ARG 122 HD2 ARG 122 -13.449 18.613 -1.324 787 HD3 ARG 122 HD1 ARG 122 -11.705 18.690 -1.075 788 HE ARG 122 HE ARG 122 -12.595 16.457 -2.677 789 HH11 ARG 122 HH11 ARG 122 -11.504 19.777 -2.665 790 HH12 ARG 122 HH12 ARG 122 -11.015 19.762 -4.328 791 HH21 ARG 122 HH21 ARG 122 -11.977 16.431 -4.883 792 HH22 ARG 122 HH22 ARG 122 -11.293 17.860 -5.592 793 H LYS 123 HN LYS 123 -13.988 13.082 -0.943 794 HA LYS 123 HA LYS 123 -16.778 12.635 -1.145 795 HB2 LYS 123 HB2 LYS 123 -16.271 10.892 -2.553 796 HB3 LYS 123 HB1 LYS 123 -14.789 11.823 -2.639 797 HG2 LYS 123 HG2 LYS 123 -14.054 10.250 -0.677 798 HG3 LYS 123 HG1 LYS 123 -15.287 9.193 -1.346 799 HD2 LYS 123 HD2 LYS 123 -12.733 10.143 -2.552 800 HD3 LYS 123 HD1 LYS 123 -13.405 8.518 -2.497 801 HE2 LYS 123 HE2 LYS 123 -14.957 9.010 -4.178 802 HE3 LYS 123 HE1 LYS 123 -14.650 10.729 -4.088 803 HZ1 LYS 123 HZ1 LYS 123 -12.430 10.345 -4.967 804 HZ2 LYS 123 HZ2 LYS 123 -13.612 9.770 -6.033 805 HZ3 LYS 123 HZ3 LYS 123 -12.745 8.683 -5.073 806 H LEU 124 HN LEU 124 -14.331 11.402 1.006 807 HA LEU 124 HA LEU 124 -15.969 9.475 2.286 808 HB2 LEU 124 HB2 LEU 124 -13.454 10.904 3.093 809 HB3 LEU 124 HB1 LEU 124 -14.213 9.687 4.102 810 HG LEU 124 HG LEU 124 -13.129 9.234 1.313 811 HD11 LEU 124 HD11 LEU 124 -12.078 8.460 4.036 812 HD12 LEU 124 HD12 LEU 124 -11.337 9.587 2.899 813 HD13 LEU 124 HD13 LEU 124 -11.438 7.873 2.504 814 HD21 LEU 124 HD21 LEU 124 -15.022 7.812 1.783 815 HD22 LEU 124 HD22 LEU 124 -14.314 7.330 3.324 816 HD23 LEU 124 HD23 LEU 124 -13.532 6.871 1.812 817 H GLU 125 HN GLU 125 -15.088 12.840 3.039 818 HA GLU 125 HA GLU 125 -16.326 13.030 5.520 819 HB2 GLU 125 HB2 GLU 125 -16.055 15.224 3.466 820 HB3 GLU 125 HB1 GLU 125 -16.378 15.451 5.179 821 HG2 GLU 125 HG2 GLU 125 -14.184 14.438 5.691 822 HG3 GLU 125 HG1 GLU 125 -13.872 14.315 3.965 823 H ARG 126 HN ARG 126 -17.708 13.623 2.304 824 HA ARG 126 HA ARG 126 -20.219 14.488 3.225 825 HB2 ARG 126 HB2 ARG 126 -21.060 13.810 0.958 826 HB3 ARG 126 HB1 ARG 126 -19.683 14.902 0.944 827 HG2 ARG 126 HG2 ARG 126 -18.192 13.092 0.425 828 HG3 ARG 126 HG1 ARG 126 -19.503 11.922 0.583 829 HD2 ARG 126 HD2 ARG 126 -19.487 14.167 -1.424 830 HD3 ARG 126 HD1 ARG 126 -18.909 12.539 -1.771 831 HE ARG 126 HE ARG 126 -21.522 12.421 -0.719 832 HH11 ARG 126 HH11 ARG 126 -19.818 13.382 -3.624 833 HH12 ARG 126 HH12 ARG 126 -21.146 13.010 -4.676 834 HH21 ARG 126 HH21 ARG 126 -23.265 11.936 -2.089 835 HH22 ARG 126 HH22 ARG 126 -23.117 12.189 -3.800 836 H LEU 127 HN LEU 127 -18.939 11.243 2.650 837 HA LEU 127 HA LEU 127 -21.447 9.959 3.184 838 HB2 LEU 127 HB2 LEU 127 -19.675 8.890 1.835 839 HB3 LEU 127 HB1 LEU 127 -18.653 8.818 3.259 840 HG LEU 127 HG LEU 127 -20.240 7.299 4.342 841 HD11 LEU 127 HD11 LEU 127 -22.083 6.328 3.034 842 HD12 LEU 127 HD12 LEU 127 -21.763 7.493 1.748 843 HD13 LEU 127 HD13 LEU 127 -22.303 8.052 3.332 844 HD21 LEU 127 HD21 LEU 127 -19.435 6.407 1.578 845 HD22 LEU 127 HD22 LEU 127 -19.849 5.351 2.930 846 HD23 LEU 127 HD23 LEU 127 -18.415 6.375 3.016 847 H LEU 128 HN LEU 128 -18.587 10.810 5.064 848 HA LEU 128 HA LEU 128 -19.158 9.563 7.467 849 HB2 LEU 128 HB2 LEU 128 -18.005 12.326 7.083 850 HB3 LEU 128 HB1 LEU 128 -17.894 11.371 8.549 851 HG LEU 128 HG LEU 128 -16.635 10.715 5.893 852 HD11 LEU 128 HD11 LEU 128 -15.381 11.461 8.528 853 HD12 LEU 128 HD12 LEU 128 -15.550 12.537 7.142 854 HD13 LEU 128 HD13 LEU 128 -14.534 11.101 7.023 855 HD21 LEU 128 HD21 LEU 128 -15.582 8.844 7.077 856 HD22 LEU 128 HD22 LEU 128 -17.337 8.689 6.999 857 HD23 LEU 128 HD23 LEU 128 -16.563 9.207 8.497 858 H GLU 129 HN GLU 129 -20.014 12.871 6.537 859 HA GLU 129 HA GLU 129 -21.738 13.361 8.722 860 HB2 GLU 129 HB2 GLU 129 -21.766 14.667 5.999 861 HB3 GLU 129 HB1 GLU 129 -22.407 15.339 7.493 862 HG2 GLU 129 HG2 GLU 129 -19.510 14.659 7.088 863 HG3 GLU 129 HG1 GLU 129 -20.200 16.243 6.756 864 H SER 130 HN SER 130 -22.198 11.811 5.663 865 HA SER 130 HA SER 130 -25.009 11.933 5.488 866 HB2 SER 130 HB2 SER 130 -23.576 11.295 3.593 867 HB3 SER 130 HB1 SER 130 -23.116 9.817 4.434 868 HG SER 130 HG SER 130 -25.797 10.468 3.789 869 H GLY 131 HN GLY 131 -23.012 10.279 7.683 870 HA2 GLY 131 HA2 GLY 131 -24.234 9.402 9.627 871 HA3 GLY 131 HA1 GLY 131 -25.329 8.630 8.490 872 H LEU 132 HN LEU 132 -21.927 8.606 7.793 873 HA LEU 132 HA LEU 132 -21.794 5.754 8.085 874 HB2 LEU 132 HB2 LEU 132 -20.537 7.254 6.415 875 HB3 LEU 132 HB1 LEU 132 -19.477 7.640 7.748 876 HG LEU 132 HG LEU 132 -18.936 5.218 7.962 877 HD11 LEU 132 HD11 LEU 132 -20.929 4.292 6.918 878 HD12 LEU 132 HD12 LEU 132 -19.477 3.748 6.079 879 HD13 LEU 132 HD13 LEU 132 -20.477 5.019 5.377 880 HD21 LEU 132 HD21 LEU 132 -17.522 5.172 5.926 881 HD22 LEU 132 HD22 LEU 132 -17.436 6.692 6.816 882 HD23 LEU 132 HD23 LEU 132 -18.394 6.589 5.340 883 H THR 133 HN THR 133 -19.932 8.409 9.496 884 HA THR 133 HA THR 133 -19.275 6.797 11.821 885 HB THR 133 HB THR 133 -17.970 8.898 12.464 886 HG1 THR 133 HG1 THR 133 -19.221 10.247 10.965 887 HG21 THR 133 HG21 THR 133 -17.302 7.502 9.869 888 HG22 THR 133 HG22 THR 133 -16.889 6.940 11.488 889 HG23 THR 133 HG23 THR 133 -16.166 8.420 10.859 Start of MODEL 6 1 H1 MET 1 HT1 MET 1 29.297 -6.993 8.416 2 H2 MET 1 HT2 MET 1 30.301 -7.300 7.088 3 H3 MET 1 HT3 MET 1 29.040 -6.183 6.955 4 HA MET 1 HA MET 1 30.085 -4.709 8.496 5 HB2 MET 1 HB2 MET 1 32.314 -6.751 8.543 6 HB3 MET 1 HB1 MET 1 32.334 -5.190 9.343 7 HG2 MET 1 HG2 MET 1 30.465 -7.464 9.970 8 HG3 MET 1 HG1 MET 1 31.888 -7.007 10.901 9 HE1 MET 1 HE1 MET 1 30.860 -3.479 12.255 10 HE2 MET 1 HE2 MET 1 31.685 -3.788 10.730 11 HE3 MET 1 HE3 MET 1 32.130 -4.699 12.172 12 H ASP 2 HN ASP 2 30.378 -3.178 6.993 13 HA ASP 2 HA ASP 2 32.279 -3.742 4.808 14 HB2 ASP 2 HB2 ASP 2 29.814 -3.380 4.227 15 HB3 ASP 2 HB1 ASP 2 30.057 -1.703 4.705 16 H SER 3 HN SER 3 33.808 -2.180 4.272 17 HA SER 3 HA SER 3 34.395 -0.354 6.467 18 HB2 SER 3 HB2 SER 3 36.159 -1.899 5.751 19 HB3 SER 3 HB1 SER 3 36.099 -1.229 4.124 20 HG SER 3 HG SER 3 36.434 0.796 5.788 21 H ALA 4 HN ALA 4 32.847 -0.176 3.535 22 HA ALA 4 HA ALA 4 33.610 2.646 3.173 23 HB1 ALA 4 HB1 ALA 4 33.929 1.258 1.185 24 HB2 ALA 4 HB2 ALA 4 32.674 2.470 0.924 25 HB3 ALA 4 HB3 ALA 4 32.230 0.791 1.234 26 H ILE 5 HN ILE 5 30.821 0.442 3.194 27 HA ILE 5 HA ILE 5 28.929 2.588 3.492 28 HB ILE 5 HB ILE 5 28.515 -0.362 4.020 29 HG12 ILE 5 HG12 ILE 5 27.996 1.205 1.483 30 HG13 ILE 5 HG11 ILE 5 29.360 0.120 1.724 31 HG21 ILE 5 HG21 ILE 5 26.783 1.045 4.985 32 HG22 ILE 5 HG22 ILE 5 26.147 0.159 3.600 33 HG23 ILE 5 HG23 ILE 5 26.563 1.866 3.439 34 HD11 ILE 5 HD11 ILE 5 27.604 -0.949 0.443 35 HD12 ILE 5 HD12 ILE 5 26.454 -0.659 1.748 36 HD13 ILE 5 HD13 ILE 5 27.817 -1.751 1.999 37 H SER 6 HN SER 6 29.224 3.771 5.303 38 HA SER 6 HA SER 6 29.779 2.479 7.843 39 HB2 SER 6 HB2 SER 6 30.938 4.589 7.179 40 HB3 SER 6 HB1 SER 6 29.382 5.425 7.206 41 HG SER 6 HG SER 6 31.049 4.939 9.230 42 H LYS 7 HN LYS 7 28.456 3.520 9.778 43 HA LYS 7 HA LYS 7 25.743 2.862 9.591 44 HB2 LYS 7 HB2 LYS 7 27.038 3.129 11.719 45 HB3 LYS 7 HB1 LYS 7 26.991 4.872 11.479 46 HG2 LYS 7 HG2 LYS 7 24.484 4.690 11.463 47 HG3 LYS 7 HG1 LYS 7 24.688 3.018 11.981 48 HD2 LYS 7 HD2 LYS 7 25.725 5.438 13.450 49 HD3 LYS 7 HD1 LYS 7 24.263 4.544 13.865 50 HE2 LYS 7 HE2 LYS 7 25.555 2.564 14.335 51 HE3 LYS 7 HE1 LYS 7 27.033 3.360 13.791 52 HZ1 LYS 7 HZ1 LYS 7 26.846 4.912 15.607 53 HZ2 LYS 7 HZ2 LYS 7 26.822 3.334 16.211 54 HZ3 LYS 7 HZ3 LYS 7 25.389 4.221 16.106 55 H GLU 8 HN GLU 8 27.532 5.684 8.769 56 HA GLU 8 HA GLU 8 25.674 7.677 8.595 57 HB2 GLU 8 HB2 GLU 8 28.067 7.921 8.226 58 HB3 GLU 8 HB1 GLU 8 27.961 6.950 6.768 59 HG2 GLU 8 HG2 GLU 8 28.115 9.157 6.093 60 HG3 GLU 8 HG1 GLU 8 26.438 8.685 5.850 61 H ASP 9 HN ASP 9 26.669 5.573 5.873 62 HA ASP 9 HA ASP 9 24.544 6.310 4.181 63 HB2 ASP 9 HB2 ASP 9 26.599 5.257 3.333 64 HB3 ASP 9 HB1 ASP 9 26.178 3.762 4.159 65 H GLU 10 HN GLU 10 24.917 3.704 6.501 66 HA GLU 10 HA GLU 10 22.686 2.162 5.897 67 HB2 GLU 10 HB2 GLU 10 24.414 1.463 7.484 68 HB3 GLU 10 HB1 GLU 10 23.928 2.738 8.593 69 HG2 GLU 10 HG2 GLU 10 23.031 0.689 9.386 70 HG3 GLU 10 HG1 GLU 10 21.700 1.663 8.759 71 H GLU 11 HN GLU 11 22.904 4.591 8.488 72 HA GLU 11 HA GLU 11 20.229 4.725 9.119 73 HB2 GLU 11 HB2 GLU 11 22.359 6.847 9.270 74 HB3 GLU 11 HB1 GLU 11 20.764 7.022 9.988 75 HG2 GLU 11 HG2 GLU 11 22.614 4.754 10.651 76 HG3 GLU 11 HG1 GLU 11 22.611 6.277 11.533 77 H ARG 12 HN ARG 12 21.957 6.339 6.501 78 HA ARG 12 HA ARG 12 19.924 8.169 5.794 79 HB2 ARG 12 HB2 ARG 12 22.031 6.858 4.068 80 HB3 ARG 12 HB1 ARG 12 20.985 8.160 3.526 81 HG2 ARG 12 HG2 ARG 12 23.026 8.308 5.734 82 HG3 ARG 12 HG1 ARG 12 23.170 9.005 4.123 83 HD2 ARG 12 HD2 ARG 12 22.546 10.809 5.459 84 HD3 ARG 12 HD1 ARG 12 21.038 10.301 4.706 85 HE ARG 12 HE ARG 12 21.621 9.200 7.331 86 HH11 ARG 12 HH11 ARG 12 19.912 11.609 5.461 87 HH12 ARG 12 HH12 ARG 12 18.780 11.970 6.723 88 HH21 ARG 12 HH21 ARG 12 20.134 9.667 8.994 89 HH22 ARG 12 HH22 ARG 12 18.904 10.859 8.736 90 H TYR 13 HN TYR 13 20.531 4.817 4.897 91 HA TYR 13 HA TYR 13 18.330 4.659 3.072 92 HB2 TYR 13 HB2 TYR 13 20.092 3.116 2.707 93 HB3 TYR 13 HB1 TYR 13 20.108 2.610 4.390 94 HD1 TYR 13 HD1 TYR 13 19.162 0.585 4.904 95 HD2 TYR 13 HD2 TYR 13 17.759 2.671 1.471 96 HE1 TYR 13 HE1 TYR 13 17.673 -1.299 4.378 97 HE2 TYR 13 HE2 TYR 13 16.257 0.797 0.943 98 HH TYR 13 HH TYR 13 16.099 -1.629 1.394 99 H GLN 14 HN GLN 14 18.902 3.633 6.407 100 HA GLN 14 HA GLN 14 16.513 2.333 6.938 101 HB2 GLN 14 HB2 GLN 14 18.209 4.038 8.757 102 HB3 GLN 14 HB1 GLN 14 16.903 3.007 9.316 103 HG2 GLN 14 HG2 GLN 14 19.314 2.029 7.811 104 HG3 GLN 14 HG1 GLN 14 19.169 2.044 9.564 105 HE21 GLN 14 HE21 GLN 14 19.343 -0.172 9.744 106 HE22 GLN 14 HE22 GLN 14 18.095 -1.257 9.238 107 H LYS 15 HN LYS 15 17.251 5.741 7.652 108 HA LYS 15 HA LYS 15 14.715 6.488 8.473 109 HB2 LYS 15 HB2 LYS 15 16.743 8.186 7.017 110 HB3 LYS 15 HB1 LYS 15 15.352 8.803 7.896 111 HG2 LYS 15 HG2 LYS 15 17.609 7.238 9.125 112 HG3 LYS 15 HG1 LYS 15 17.459 8.992 9.154 113 HD2 LYS 15 HD2 LYS 15 15.483 7.048 10.342 114 HD3 LYS 15 HD1 LYS 15 16.701 7.945 11.247 115 HE2 LYS 15 HE2 LYS 15 15.662 10.051 10.391 116 HE3 LYS 15 HE1 LYS 15 14.367 9.067 9.713 117 HZ1 LYS 15 HZ1 LYS 15 13.938 8.237 11.984 118 HZ2 LYS 15 HZ2 LYS 15 13.679 9.897 11.826 119 HZ3 LYS 15 HZ3 LYS 15 15.082 9.331 12.580 120 H LEU 16 HN LEU 16 15.953 6.018 5.266 121 HA LEU 16 HA LEU 16 13.931 7.445 3.883 122 HB2 LEU 16 HB2 LEU 16 16.228 6.795 3.037 123 HB3 LEU 16 HB1 LEU 16 15.584 5.181 2.803 124 HG LEU 16 HG LEU 16 14.108 5.903 1.092 125 HD11 LEU 16 HD11 LEU 16 14.088 8.407 0.521 126 HD12 LEU 16 HD12 LEU 16 14.710 8.643 2.152 127 HD13 LEU 16 HD13 LEU 16 13.141 7.863 1.910 128 HD21 LEU 16 HD21 LEU 16 16.693 7.408 0.766 129 HD22 LEU 16 HD22 LEU 16 15.620 6.858 -0.523 130 HD23 LEU 16 HD23 LEU 16 16.474 5.683 0.478 131 H VAL 17 HN VAL 17 14.438 4.009 4.537 132 HA VAL 17 HA VAL 17 12.007 3.129 3.384 133 HB VAL 17 HB VAL 17 12.471 1.036 4.223 134 HG11 VAL 17 HG11 VAL 17 15.098 2.484 4.356 135 HG12 VAL 17 HG12 VAL 17 14.356 1.768 2.923 136 HG13 VAL 17 HG13 VAL 17 14.914 0.732 4.238 137 HG21 VAL 17 HG21 VAL 17 13.821 2.293 6.615 138 HG22 VAL 17 HG22 VAL 17 13.659 0.560 6.321 139 HG23 VAL 17 HG23 VAL 17 12.220 1.549 6.590 140 H THR 18 HN THR 18 12.900 4.428 6.471 141 HA THR 18 HA THR 18 10.615 3.874 7.945 142 HB THR 18 HB THR 18 12.774 5.936 8.017 143 HG1 THR 18 HG1 THR 18 13.527 4.612 9.473 144 HG21 THR 18 HG21 THR 18 10.927 7.236 8.658 145 HG22 THR 18 HG22 THR 18 11.789 6.794 10.133 146 HG23 THR 18 HG23 THR 18 10.294 5.959 9.696 147 H GLU 19 HN GLU 19 11.505 6.774 6.067 148 HA GLU 19 HA GLU 19 9.174 8.232 6.288 149 HB2 GLU 19 HB2 GLU 19 10.978 7.941 3.864 150 HB3 GLU 19 HB1 GLU 19 9.758 9.198 4.064 151 HG2 GLU 19 HG2 GLU 19 10.954 9.927 6.128 152 HG3 GLU 19 HG1 GLU 19 12.227 8.768 5.732 153 H ASN 20 HN ASN 20 9.961 5.617 4.125 154 HA ASN 20 HA ASN 20 7.677 5.741 2.502 155 HB2 ASN 20 HB2 ASN 20 9.819 3.755 3.038 156 HB3 ASN 20 HB1 ASN 20 8.366 3.189 2.217 157 HD21 ASN 20 HD21 ASN 20 11.087 5.373 2.063 158 HD22 ASN 20 HD22 ASN 20 11.001 5.644 0.352 159 H GLU 21 HN GLU 21 8.403 3.447 5.173 160 HA GLU 21 HA GLU 21 5.991 2.085 4.996 161 HB2 GLU 21 HB2 GLU 21 7.651 2.571 7.475 162 HB3 GLU 21 HB1 GLU 21 6.487 1.270 7.247 163 HG2 GLU 21 HG2 GLU 21 8.771 1.616 5.375 164 HG3 GLU 21 HG1 GLU 21 8.999 0.802 6.915 165 H GLN 22 HN GLN 22 6.710 5.124 6.605 166 HA GLN 22 HA GLN 22 4.492 5.286 8.321 167 HB2 GLN 22 HB2 GLN 22 5.640 7.651 6.840 168 HB3 GLN 22 HB1 GLN 22 4.813 7.650 8.388 169 HG2 GLN 22 HG2 GLN 22 6.679 6.484 9.425 170 HG3 GLN 22 HG1 GLN 22 7.505 6.417 7.871 171 HE21 GLN 22 HE21 GLN 22 8.321 7.658 10.393 172 HE22 GLN 22 HE22 GLN 22 8.622 9.319 10.017 173 H LEU 23 HN LEU 23 4.875 6.817 5.120 174 HA LEU 23 HA LEU 23 2.087 7.449 5.115 175 HB2 LEU 23 HB2 LEU 23 2.496 8.866 3.361 176 HB3 LEU 23 HB1 LEU 23 3.991 8.906 4.247 177 HG LEU 23 HG LEU 23 3.482 7.501 1.627 178 HD11 LEU 23 HD11 LEU 23 3.707 9.910 1.473 179 HD12 LEU 23 HD12 LEU 23 5.126 9.109 0.798 180 HD13 LEU 23 HD13 LEU 23 5.206 9.845 2.399 181 HD21 LEU 23 HD21 LEU 23 5.870 6.982 1.639 182 HD22 LEU 23 HD22 LEU 23 5.009 6.155 2.940 183 HD23 LEU 23 HD23 LEU 23 5.988 7.584 3.293 184 H GLN 24 HN GLN 24 4.037 4.899 3.853 185 HA GLN 24 HA GLN 24 2.325 3.707 2.031 186 HB2 GLN 24 HB2 GLN 24 4.077 2.576 4.170 187 HB3 GLN 24 HB1 GLN 24 3.127 1.516 3.156 188 HG2 GLN 24 HG2 GLN 24 4.248 2.538 1.203 189 HG3 GLN 24 HG1 GLN 24 5.310 3.373 2.323 190 HE21 GLN 24 HE21 GLN 24 7.080 2.322 1.559 191 HE22 GLN 24 HE22 GLN 24 7.424 0.671 1.917 192 H ARG 25 HN ARG 25 2.266 3.609 5.554 193 HA ARG 25 HA ARG 25 -0.016 1.998 5.858 194 HB2 ARG 25 HB2 ARG 25 1.106 2.093 7.835 195 HB3 ARG 25 HB1 ARG 25 1.723 3.707 7.518 196 HG2 ARG 25 HG2 ARG 25 -0.709 4.435 7.964 197 HG3 ARG 25 HG1 ARG 25 -0.840 2.877 8.785 198 HD2 ARG 25 HD2 ARG 25 1.144 3.493 10.148 199 HD3 ARG 25 HD1 ARG 25 1.145 5.079 9.369 200 HE ARG 25 HE ARG 25 -1.303 4.282 10.730 201 HH11 ARG 25 HH11 ARG 25 1.685 6.102 10.850 202 HH12 ARG 25 HH12 ARG 25 1.148 7.142 12.130 203 HH21 ARG 25 HH21 ARG 25 -2.009 5.649 12.426 204 HH22 ARG 25 HH22 ARG 25 -0.950 6.891 13.018 205 H LEU 26 HN LEU 26 0.505 5.479 5.767 206 HA LEU 26 HA LEU 26 -2.089 6.310 6.398 207 HB2 LEU 26 HB2 LEU 26 -0.043 7.710 4.673 208 HB3 LEU 26 HB1 LEU 26 -1.385 8.475 5.514 209 HG LEU 26 HG LEU 26 0.925 7.050 6.850 210 HD11 LEU 26 HD11 LEU 26 0.353 10.002 6.777 211 HD12 LEU 26 HD12 LEU 26 1.557 9.190 5.776 212 HD13 LEU 26 HD13 LEU 26 1.728 9.190 7.530 213 HD21 LEU 26 HD21 LEU 26 -1.333 8.647 8.040 214 HD22 LEU 26 HD22 LEU 26 0.020 7.941 8.923 215 HD23 LEU 26 HD23 LEU 26 -1.152 6.894 8.119 216 H ILE 27 HN ILE 27 -0.550 5.664 3.281 217 HA ILE 27 HA ILE 27 -2.726 6.156 1.597 218 HB ILE 27 HB ILE 27 -0.526 4.095 1.398 219 HG12 ILE 27 HG12 ILE 27 -0.879 6.729 -0.039 220 HG13 ILE 27 HG11 ILE 27 0.152 6.484 1.376 221 HG21 ILE 27 HG21 ILE 27 -1.096 3.938 -1.000 222 HG22 ILE 27 HG22 ILE 27 -2.533 4.913 -0.694 223 HG23 ILE 27 HG23 ILE 27 -2.370 3.326 0.054 224 HD11 ILE 27 HD11 ILE 27 1.421 6.451 -0.705 225 HD12 ILE 27 HD12 ILE 27 0.452 5.092 -1.273 226 HD13 ILE 27 HD13 ILE 27 1.498 4.901 0.134 227 H THR 28 HN THR 28 -1.664 3.137 3.111 228 HA THR 28 HA THR 28 -3.630 1.468 2.139 229 HB THR 28 HB THR 28 -1.467 1.194 3.841 230 HG1 THR 28 HG1 THR 28 -1.758 -0.945 3.375 231 HG21 THR 28 HG21 THR 28 -3.988 0.389 5.293 232 HG22 THR 28 HG22 THR 28 -2.725 1.489 5.860 233 HG23 THR 28 HG23 THR 28 -2.386 -0.234 5.686 234 H GLN 29 HN GLN 29 -3.814 3.585 4.990 235 HA GLN 29 HA GLN 29 -6.180 2.542 6.111 236 HB2 GLN 29 HB2 GLN 29 -5.629 5.499 6.080 237 HB3 GLN 29 HB1 GLN 29 -6.368 4.533 7.346 238 HG2 GLN 29 HG2 GLN 29 -4.151 3.489 7.730 239 HG3 GLN 29 HG1 GLN 29 -3.469 4.631 6.587 240 HE21 GLN 29 HE21 GLN 29 -4.823 4.210 9.748 241 HE22 GLN 29 HE22 GLN 29 -4.421 5.781 10.352 242 H LYS 30 HN LYS 30 -5.626 5.116 3.813 243 HA LYS 30 HA LYS 30 -8.391 5.743 3.483 244 HB2 LYS 30 HB2 LYS 30 -6.063 6.536 1.729 245 HB3 LYS 30 HB1 LYS 30 -7.640 7.311 1.796 246 HG2 LYS 30 HG2 LYS 30 -5.517 7.285 3.927 247 HG3 LYS 30 HG1 LYS 30 -6.114 8.669 3.011 248 HD2 LYS 30 HD2 LYS 30 -8.347 8.322 4.060 249 HD3 LYS 30 HD1 LYS 30 -7.638 7.045 5.046 250 HE2 LYS 30 HE2 LYS 30 -6.736 9.921 5.024 251 HE3 LYS 30 HE1 LYS 30 -7.794 9.202 6.234 252 HZ1 LYS 30 HZ1 LYS 30 -6.023 7.701 6.858 253 HZ2 LYS 30 HZ2 LYS 30 -5.496 9.302 6.977 254 HZ3 LYS 30 HZ3 LYS 30 -5.006 8.351 5.670 255 H GLU 31 HN GLU 31 -6.014 3.899 1.627 256 HA GLU 31 HA GLU 31 -7.466 3.598 -0.720 257 HB2 GLU 31 HB2 GLU 31 -5.244 2.108 0.565 258 HB3 GLU 31 HB1 GLU 31 -6.063 1.359 -0.800 259 HG2 GLU 31 HG2 GLU 31 -4.919 4.136 -0.868 260 HG3 GLU 31 HG1 GLU 31 -4.038 2.697 -1.379 261 H GLU 32 HN GLU 32 -7.527 1.508 2.174 262 HA GLU 32 HA GLU 32 -9.248 -0.406 0.985 263 HB2 GLU 32 HB2 GLU 32 -9.730 -1.086 3.376 264 HB3 GLU 32 HB1 GLU 32 -8.048 -1.147 2.875 265 HG2 GLU 32 HG2 GLU 32 -7.545 0.859 4.061 266 HG3 GLU 32 HG1 GLU 32 -9.254 1.147 4.398 267 H LYS 33 HN LYS 33 -9.817 2.591 2.709 268 HA LYS 33 HA LYS 33 -12.645 2.229 2.925 269 HB2 LYS 33 HB2 LYS 33 -10.967 4.743 3.034 270 HB3 LYS 33 HB1 LYS 33 -12.673 4.653 3.451 271 HG2 LYS 33 HG2 LYS 33 -10.479 3.129 4.839 272 HG3 LYS 33 HG1 LYS 33 -11.188 4.636 5.416 273 HD2 LYS 33 HD2 LYS 33 -12.803 2.148 4.889 274 HD3 LYS 33 HD1 LYS 33 -12.097 2.530 6.459 275 HE2 LYS 33 HE2 LYS 33 -14.009 4.314 4.959 276 HE3 LYS 33 HE1 LYS 33 -14.473 3.206 6.250 277 HZ1 LYS 33 HZ1 LYS 33 -14.163 5.457 7.075 278 HZ2 LYS 33 HZ2 LYS 33 -12.568 5.463 6.521 279 HZ3 LYS 33 HZ3 LYS 33 -13.027 4.409 7.758 280 H ILE 34 HN ILE 34 -10.532 3.986 0.691 281 HA ILE 34 HA ILE 34 -12.577 4.982 -0.974 282 HB ILE 34 HB ILE 34 -9.691 4.375 -1.659 283 HG12 ILE 34 HG12 ILE 34 -10.944 7.052 -1.102 284 HG13 ILE 34 HG11 ILE 34 -10.250 6.069 0.183 285 HG21 ILE 34 HG21 ILE 34 -11.795 5.918 -3.153 286 HG22 ILE 34 HG22 ILE 34 -10.950 4.462 -3.680 287 HG23 ILE 34 HG23 ILE 34 -10.069 5.980 -3.518 288 HD11 ILE 34 HD11 ILE 34 -8.772 7.091 -2.231 289 HD12 ILE 34 HD12 ILE 34 -8.083 6.124 -0.925 290 HD13 ILE 34 HD13 ILE 34 -8.678 7.754 -0.599 291 H ARG 35 HN ARG 35 -10.869 1.925 -0.861 292 HA ARG 35 HA ARG 35 -11.425 0.797 -3.273 293 HB2 ARG 35 HB2 ARG 35 -10.203 -0.008 -1.055 294 HB3 ARG 35 HB1 ARG 35 -11.733 -0.841 -0.809 295 HG2 ARG 35 HG2 ARG 35 -11.495 -1.877 -2.989 296 HG3 ARG 35 HG1 ARG 35 -9.948 -1.068 -3.196 297 HD2 ARG 35 HD2 ARG 35 -9.050 -2.244 -1.267 298 HD3 ARG 35 HD1 ARG 35 -10.607 -3.027 -0.999 299 HE ARG 35 HE ARG 35 -10.168 -3.917 -3.395 300 HH11 ARG 35 HH11 ARG 35 -7.769 -3.469 -0.876 301 HH12 ARG 35 HH12 ARG 35 -6.729 -4.719 -1.477 302 HH21 ARG 35 HH21 ARG 35 -8.805 -5.567 -4.173 303 HH22 ARG 35 HH22 ARG 35 -7.318 -5.915 -3.346 304 H VAL 36 HN VAL 36 -13.462 0.918 -0.384 305 HA VAL 36 HA VAL 36 -15.610 -0.578 -1.458 306 HB VAL 36 HB VAL 36 -15.870 1.558 0.650 307 HG11 VAL 36 HG11 VAL 36 -17.612 0.025 1.510 308 HG12 VAL 36 HG12 VAL 36 -17.347 -1.012 0.104 309 HG13 VAL 36 HG13 VAL 36 -17.957 0.630 -0.112 310 HG21 VAL 36 HG21 VAL 36 -14.987 -1.296 1.062 311 HG22 VAL 36 HG22 VAL 36 -15.249 -0.087 2.317 312 HG23 VAL 36 HG23 VAL 36 -13.933 0.113 1.157 313 H LEU 37 HN LEU 37 -14.884 2.868 -1.320 314 HA LEU 37 HA LEU 37 -17.251 3.815 -2.525 315 HB2 LEU 37 HB2 LEU 37 -14.514 4.885 -2.063 316 HB3 LEU 37 HB1 LEU 37 -15.512 5.712 -3.242 317 HG LEU 37 HG LEU 37 -15.520 6.609 -0.848 318 HD11 LEU 37 HD11 LEU 37 -17.154 7.298 -2.520 319 HD12 LEU 37 HD12 LEU 37 -17.896 7.162 -0.922 320 HD13 LEU 37 HD13 LEU 37 -18.154 5.898 -2.127 321 HD21 LEU 37 HD21 LEU 37 -17.048 5.526 0.711 322 HD22 LEU 37 HD22 LEU 37 -15.702 4.463 0.296 323 HD23 LEU 37 HD23 LEU 37 -17.286 4.204 -0.434 324 H ARG 38 HN ARG 38 -14.233 2.598 -3.817 325 HA ARG 38 HA ARG 38 -14.575 3.270 -6.514 326 HB2 ARG 38 HB2 ARG 38 -13.193 0.923 -5.215 327 HB3 ARG 38 HB1 ARG 38 -13.158 1.205 -6.948 328 HG2 ARG 38 HG2 ARG 38 -12.145 3.124 -4.862 329 HG3 ARG 38 HG1 ARG 38 -11.145 2.027 -5.818 330 HD2 ARG 38 HD2 ARG 38 -12.887 4.242 -6.888 331 HD3 ARG 38 HD1 ARG 38 -11.128 4.271 -6.769 332 HE ARG 38 HE ARG 38 -11.530 2.094 -8.274 333 HH11 ARG 38 HH11 ARG 38 -12.811 5.342 -8.513 334 HH12 ARG 38 HH12 ARG 38 -13.039 5.267 -10.238 335 HH21 ARG 38 HH21 ARG 38 -11.795 1.994 -10.534 336 HH22 ARG 38 HH22 ARG 38 -12.426 3.367 -11.386 337 H GLN 39 HN GLN 39 -15.590 0.380 -4.738 338 HA GLN 39 HA GLN 39 -16.849 -0.944 -6.874 339 HB2 GLN 39 HB2 GLN 39 -17.754 -1.108 -4.004 340 HB3 GLN 39 HB1 GLN 39 -17.831 -2.358 -5.238 341 HG2 GLN 39 HG2 GLN 39 -15.309 -1.268 -4.019 342 HG3 GLN 39 HG1 GLN 39 -16.096 -2.768 -3.559 343 HE21 GLN 39 HE21 GLN 39 -16.806 -3.450 -6.320 344 HE22 GLN 39 HE22 GLN 39 -15.335 -3.948 -7.078 345 H ARG 40 HN ARG 40 -17.950 1.504 -4.624 346 HA ARG 40 HA ARG 40 -20.662 1.509 -5.381 347 HB2 ARG 40 HB2 ARG 40 -18.854 3.534 -4.107 348 HB3 ARG 40 HB1 ARG 40 -20.518 3.915 -4.500 349 HG2 ARG 40 HG2 ARG 40 -21.233 1.983 -3.115 350 HG3 ARG 40 HG1 ARG 40 -19.547 1.761 -2.645 351 HD2 ARG 40 HD2 ARG 40 -20.794 3.011 -0.956 352 HD3 ARG 40 HD1 ARG 40 -19.509 3.985 -1.668 353 HE ARG 40 HE ARG 40 -21.269 5.051 -3.041 354 HH11 ARG 40 HH11 ARG 40 -22.239 3.367 -0.123 355 HH12 ARG 40 HH12 ARG 40 -23.633 4.362 0.135 356 HH21 ARG 40 HH21 ARG 40 -23.099 6.360 -2.699 357 HH22 ARG 40 HH22 ARG 40 -24.116 6.077 -1.322 358 H LEU 41 HN LEU 41 -17.855 3.351 -6.538 359 HA LEU 41 HA LEU 41 -19.382 4.747 -8.512 360 HB2 LEU 41 HB2 LEU 41 -16.440 4.312 -8.811 361 HB3 LEU 41 HB1 LEU 41 -17.423 5.684 -9.286 362 HG LEU 41 HG LEU 41 -16.599 4.974 -6.472 363 HD11 LEU 41 HD11 LEU 41 -15.308 7.049 -6.608 364 HD12 LEU 41 HD12 LEU 41 -15.785 7.231 -8.295 365 HD13 LEU 41 HD13 LEU 41 -14.783 5.866 -7.804 366 HD21 LEU 41 HD21 LEU 41 -18.198 7.330 -7.466 367 HD22 LEU 41 HD22 LEU 41 -17.641 7.069 -5.812 368 HD23 LEU 41 HD23 LEU 41 -18.830 5.978 -6.526 369 H VAL 42 HN VAL 42 -17.999 1.603 -8.338 370 HA VAL 42 HA VAL 42 -17.930 0.960 -11.078 371 HB VAL 42 HB VAL 42 -18.600 -0.712 -8.649 372 HG11 VAL 42 HG11 VAL 42 -18.278 -1.642 -11.495 373 HG12 VAL 42 HG12 VAL 42 -19.753 -1.689 -10.526 374 HG13 VAL 42 HG13 VAL 42 -18.370 -2.691 -10.080 375 HG21 VAL 42 HG21 VAL 42 -16.294 0.024 -8.763 376 HG22 VAL 42 HG22 VAL 42 -16.158 -0.586 -10.415 377 HG23 VAL 42 HG23 VAL 42 -16.391 -1.710 -9.075 378 H GLU 43 HN GLU 43 -20.511 1.173 -8.741 379 HA GLU 43 HA GLU 43 -22.588 0.220 -10.426 380 HB2 GLU 43 HB2 GLU 43 -22.771 2.002 -7.990 381 HB3 GLU 43 HB1 GLU 43 -24.090 1.086 -8.707 382 HG2 GLU 43 HG2 GLU 43 -23.041 -0.989 -8.128 383 HG3 GLU 43 HG1 GLU 43 -21.600 -0.149 -7.559 384 H ARG 44 HN ARG 44 -21.030 3.297 -9.967 385 HA ARG 44 HA ARG 44 -23.040 4.762 -11.413 386 HB2 ARG 44 HB2 ARG 44 -21.915 6.644 -10.835 387 HB3 ARG 44 HB1 ARG 44 -21.230 5.592 -9.609 388 HG2 ARG 44 HG2 ARG 44 -19.218 5.477 -10.646 389 HG3 ARG 44 HG1 ARG 44 -19.921 5.806 -12.228 390 HD2 ARG 44 HD2 ARG 44 -18.553 7.688 -11.374 391 HD3 ARG 44 HD1 ARG 44 -20.230 8.132 -11.676 392 HE ARG 44 HE ARG 44 -20.299 7.547 -9.066 393 HH11 ARG 44 HH11 ARG 44 -18.048 9.481 -10.928 394 HH12 ARG 44 HH12 ARG 44 -17.708 10.572 -9.620 395 HH21 ARG 44 HH21 ARG 44 -19.848 8.991 -7.345 396 HH22 ARG 44 HH22 ARG 44 -18.728 10.294 -7.591 397 H GLY 45 HN GLY 45 -19.951 3.293 -12.023 398 HA2 GLY 45 HA2 GLY 45 -19.619 2.238 -14.189 399 HA3 GLY 45 HA1 GLY 45 -20.416 3.626 -14.915 400 H ASP 46 HN ASP 46 -18.160 4.123 -12.333 401 HA ASP 46 HA ASP 46 -16.595 5.864 -13.975 402 HB2 ASP 46 HB2 ASP 46 -16.988 6.314 -11.583 403 HB3 ASP 46 HB1 ASP 46 -16.069 4.875 -11.164 404 H ALA 47 HN ALA 47 -16.282 2.576 -12.867 405 HA ALA 47 HA ALA 47 -13.508 2.293 -13.417 406 HB1 ALA 47 HB1 ALA 47 -15.625 0.148 -13.277 407 HB2 ALA 47 HB2 ALA 47 -14.717 0.778 -11.905 408 HB3 ALA 47 HB3 ALA 47 -13.882 -0.094 -13.189 409 H LYS 48 HN LYS 48 -16.457 1.708 -15.266 410 HA LYS 48 HA LYS 48 -15.069 0.695 -17.561 411 HB2 LYS 48 HB2 LYS 48 -17.486 0.214 -16.966 412 HB3 LYS 48 HB1 LYS 48 -17.857 1.852 -17.492 413 HG2 LYS 48 HG2 LYS 48 -18.336 0.292 -19.265 414 HG3 LYS 48 HG1 LYS 48 -16.973 1.315 -19.722 415 HD2 LYS 48 HD2 LYS 48 -15.449 -0.516 -18.962 416 HD3 LYS 48 HD1 LYS 48 -16.871 -1.530 -18.730 417 HE2 LYS 48 HE2 LYS 48 -17.426 -1.249 -21.099 418 HE3 LYS 48 HE1 LYS 48 -15.973 -0.275 -21.308 419 HZ1 LYS 48 HZ1 LYS 48 -16.002 -3.109 -20.426 420 HZ2 LYS 48 HZ2 LYS 48 -14.628 -2.168 -20.720 421 HZ3 LYS 48 HZ3 LYS 48 -15.655 -2.587 -21.996 422 H GLY 49 HN GLY 49 -15.903 3.799 -16.323 423 HA2 GLY 49 HA2 GLY 49 -15.424 5.203 -18.811 424 HA3 GLY 49 HA1 GLY 49 -15.718 5.929 -17.237 425 H THR 50 HN THR 50 -13.354 3.488 -17.316 426 HA THR 50 HA THR 50 -11.173 5.450 -17.517 427 HB THR 50 HB THR 50 -11.228 3.078 -15.634 428 HG1 THR 50 HG1 THR 50 -12.726 4.688 -14.963 429 HG21 THR 50 HG21 THR 50 -8.984 3.746 -16.307 430 HG22 THR 50 HG22 THR 50 -9.269 4.184 -14.623 431 HG23 THR 50 HG23 THR 50 -9.334 5.421 -15.878 432 H GLU 51 HN GLU 51 -10.350 4.939 -19.487 433 HA GLU 51 HA GLU 51 -10.502 2.284 -20.498 434 HB2 GLU 51 HB2 GLU 51 -9.012 3.318 -22.374 435 HB3 GLU 51 HB1 GLU 51 -10.698 3.773 -22.228 436 HG2 GLU 51 HG2 GLU 51 -9.460 5.727 -22.675 437 HG3 GLU 51 HG1 GLU 51 -9.958 5.805 -20.993 438 H LEU 52 HN LEU 52 -9.161 0.712 -20.509 439 HA LEU 52 HA LEU 52 -6.314 1.132 -19.969 440 HB2 LEU 52 HB2 LEU 52 -8.055 -0.916 -18.577 441 HB3 LEU 52 HB1 LEU 52 -6.319 -0.745 -18.384 442 HG LEU 52 HG LEU 52 -8.092 1.576 -17.754 443 HD11 LEU 52 HD11 LEU 52 -8.296 0.788 -15.449 444 HD12 LEU 52 HD12 LEU 52 -7.564 -0.750 -15.914 445 HD13 LEU 52 HD13 LEU 52 -9.125 -0.272 -16.588 446 HD21 LEU 52 HD21 LEU 52 -5.482 0.578 -16.613 447 HD22 LEU 52 HD22 LEU 52 -6.314 2.061 -16.147 448 HD23 LEU 52 HD23 LEU 52 -5.671 1.887 -17.780 449 H ASN 53 HN ASN 53 -8.216 0.461 -22.180 450 HA ASN 53 HA ASN 53 -6.792 -1.709 -23.403 451 HB2 ASN 53 HB2 ASN 53 -8.709 -3.180 -23.713 452 HB3 ASN 53 HB1 ASN 53 -8.458 -2.924 -21.991 453 HD21 ASN 53 HD21 ASN 53 -10.847 -3.699 -23.537 454 HD22 ASN 53 HD22 ASN 53 -12.069 -2.550 -23.103 455 H GLY 84 HN GLY 84 11.477 -2.109 -22.725 456 HA2 GLY 84 HA2 GLY 84 10.984 -0.022 -20.742 457 HA3 GLY 84 HA1 GLY 84 11.780 -1.563 -20.456 458 HA PRO 85 HA PRO 85 15.019 1.732 -20.839 459 HB2 PRO 85 HB2 PRO 85 16.106 1.572 -18.411 460 HB3 PRO 85 HB1 PRO 85 14.584 2.438 -18.667 461 HG2 PRO 85 HG2 PRO 85 15.040 -0.322 -17.605 462 HG3 PRO 85 HG1 PRO 85 13.937 0.934 -17.011 463 HD2 PRO 85 HD2 PRO 85 13.159 -1.148 -18.630 464 HD3 PRO 85 HD1 PRO 85 12.318 0.412 -18.548 465 H LEU 86 HN LEU 86 17.451 1.444 -20.009 466 HA LEU 86 HA LEU 86 18.741 -0.451 -21.460 467 HB2 LEU 86 HB2 LEU 86 20.582 -0.194 -19.616 468 HB3 LEU 86 HB1 LEU 86 20.168 1.136 -20.673 469 HG LEU 86 HG LEU 86 18.788 2.127 -18.893 470 HD11 LEU 86 HD11 LEU 86 19.800 -0.145 -17.192 471 HD12 LEU 86 HD12 LEU 86 18.126 0.128 -17.686 472 HD13 LEU 86 HD13 LEU 86 18.927 1.271 -16.607 473 HD21 LEU 86 HD21 LEU 86 20.631 2.791 -17.432 474 HD22 LEU 86 HD22 LEU 86 21.107 2.786 -19.129 475 HD23 LEU 86 HD23 LEU 86 21.606 1.468 -18.070 476 H GLY 87 HN GLY 87 19.876 -2.385 -20.999 477 HA2 GLY 87 HA2 GLY 87 18.346 -4.237 -19.407 478 HA3 GLY 87 HA1 GLY 87 19.753 -4.614 -20.388 479 H SER 88 HN SER 88 20.320 -2.022 -18.334 480 HA SER 88 HA SER 88 21.804 -3.740 -16.481 481 HB2 SER 88 HB2 SER 88 22.072 -0.756 -16.914 482 HB3 SER 88 HB1 SER 88 23.162 -1.795 -15.996 483 HG SER 88 HG SER 88 24.041 -2.493 -17.792 484 H ARG 89 HN ARG 89 18.852 -2.925 -16.500 485 HA ARG 89 HA ARG 89 18.572 -1.330 -14.113 486 HB2 ARG 89 HB2 ARG 89 16.185 -1.598 -14.399 487 HB3 ARG 89 HB1 ARG 89 16.914 -1.187 -15.943 488 HG2 ARG 89 HG2 ARG 89 16.592 -3.331 -16.802 489 HG3 ARG 89 HG1 ARG 89 16.365 -4.035 -15.200 490 HD2 ARG 89 HD2 ARG 89 14.476 -2.116 -16.564 491 HD3 ARG 89 HD1 ARG 89 14.245 -3.859 -16.424 492 HE ARG 89 HE ARG 89 14.619 -2.657 -13.870 493 HH11 ARG 89 HH11 ARG 89 12.229 -3.128 -16.391 494 HH12 ARG 89 HH12 ARG 89 10.882 -2.977 -15.307 495 HH21 ARG 89 HH21 ARG 89 12.840 -2.462 -12.450 496 HH22 ARG 89 HH22 ARG 89 11.227 -2.606 -13.078 497 H ARG 90 HN ARG 90 19.666 -4.295 -14.396 498 HA ARG 90 HA ARG 90 18.397 -5.201 -11.905 499 HB2 ARG 90 HB2 ARG 90 19.136 -6.951 -14.265 500 HB3 ARG 90 HB1 ARG 90 18.576 -7.540 -12.708 501 HG2 ARG 90 HG2 ARG 90 16.996 -5.838 -14.625 502 HG3 ARG 90 HG1 ARG 90 16.800 -7.568 -14.364 503 HD2 ARG 90 HD2 ARG 90 16.376 -5.418 -12.294 504 HD3 ARG 90 HD1 ARG 90 15.103 -6.265 -13.167 505 HE ARG 90 HE ARG 90 16.517 -8.268 -12.001 506 HH11 ARG 90 HH11 ARG 90 14.993 -5.354 -10.801 507 HH12 ARG 90 HH12 ARG 90 14.675 -6.014 -9.230 508 HH21 ARG 90 HH21 ARG 90 16.100 -9.142 -9.926 509 HH22 ARG 90 HH22 ARG 90 15.301 -8.168 -8.733 510 H PHE 91 HN PHE 91 19.975 -7.470 -11.537 511 HA PHE 91 HA PHE 91 22.001 -8.249 -10.893 512 HB2 PHE 91 HB2 PHE 91 23.111 -6.028 -12.624 513 HB3 PHE 91 HB1 PHE 91 24.067 -7.313 -11.896 514 HD1 PHE 91 HD1 PHE 91 23.951 -9.584 -12.741 515 HD2 PHE 91 HD2 PHE 91 21.683 -6.454 -14.522 516 HE1 PHE 91 HE1 PHE 91 23.547 -11.000 -14.713 517 HE2 PHE 91 HE2 PHE 91 21.274 -7.864 -16.493 518 HZ PHE 91 HZ PHE 91 22.208 -10.141 -16.591 519 H VAL 92 HN VAL 92 24.359 -6.902 -10.188 520 HA VAL 92 HA VAL 92 23.694 -6.197 -7.561 521 HB VAL 92 HB VAL 92 26.269 -5.577 -9.014 522 HG11 VAL 92 HG11 VAL 92 25.675 -5.857 -6.068 523 HG12 VAL 92 HG12 VAL 92 26.066 -4.360 -6.915 524 HG13 VAL 92 HG13 VAL 92 27.276 -5.636 -6.774 525 HG21 VAL 92 HG21 VAL 92 25.476 -8.022 -7.434 526 HG22 VAL 92 HG22 VAL 92 27.076 -7.703 -8.104 527 HG23 VAL 92 HG23 VAL 92 25.700 -7.943 -9.181 528 H VAL 93 HN VAL 93 24.462 -4.181 -10.366 529 HA VAL 93 HA VAL 93 24.676 -1.738 -9.021 530 HB VAL 93 HB VAL 93 24.130 -0.664 -11.209 531 HG11 VAL 93 HG11 VAL 93 26.414 -1.222 -10.674 532 HG12 VAL 93 HG12 VAL 93 26.119 -1.541 -12.384 533 HG13 VAL 93 HG13 VAL 93 26.176 -2.877 -11.234 534 HG21 VAL 93 HG21 VAL 93 23.886 -2.087 -13.189 535 HG22 VAL 93 HG22 VAL 93 22.548 -2.313 -12.061 536 HG23 VAL 93 HG23 VAL 93 23.835 -3.516 -12.155 537 H ASP 94 HN ASP 94 21.851 -3.544 -10.024 538 HA ASP 94 HA ASP 94 20.066 -1.347 -9.631 539 HB2 ASP 94 HB2 ASP 94 19.323 -3.009 -11.152 540 HB3 ASP 94 HB1 ASP 94 19.557 -4.295 -9.973 541 H ASP 95 HN ASP 95 20.604 -4.379 -7.792 542 HA ASP 95 HA ASP 95 18.869 -3.649 -5.713 543 HB2 ASP 95 HB2 ASP 95 21.253 -5.500 -5.620 544 HB3 ASP 95 HB1 ASP 95 20.072 -5.320 -4.321 545 H ARG 96 HN ARG 96 22.131 -2.672 -6.374 546 HA ARG 96 HA ARG 96 22.520 -1.817 -3.618 547 HB2 ARG 96 HB2 ARG 96 24.389 -2.849 -4.863 548 HB3 ARG 96 HB1 ARG 96 24.363 -1.498 -5.987 549 HG2 ARG 96 HG2 ARG 96 25.045 0.029 -4.299 550 HG3 ARG 96 HG1 ARG 96 24.820 -1.179 -3.033 551 HD2 ARG 96 HD2 ARG 96 26.840 -1.325 -5.266 552 HD3 ARG 96 HD1 ARG 96 27.182 -0.879 -3.596 553 HE ARG 96 HE ARG 96 25.909 -3.434 -3.832 554 HH11 ARG 96 HH11 ARG 96 28.978 -1.760 -3.933 555 HH12 ARG 96 HH12 ARG 96 29.905 -3.174 -3.548 556 HH21 ARG 96 HH21 ARG 96 27.115 -5.291 -3.307 557 HH22 ARG 96 HH22 ARG 96 28.842 -5.191 -3.194 558 H ARG 97 HN ARG 97 23.028 -0.135 -6.723 559 HA ARG 97 HA ARG 97 22.704 2.399 -5.419 560 HB2 ARG 97 HB2 ARG 97 24.306 2.336 -7.155 561 HB3 ARG 97 HB1 ARG 97 23.200 1.548 -8.266 562 HG2 ARG 97 HG2 ARG 97 22.277 4.167 -7.377 563 HG3 ARG 97 HG1 ARG 97 23.816 4.210 -8.239 564 HD2 ARG 97 HD2 ARG 97 21.265 2.933 -9.222 565 HD3 ARG 97 HD1 ARG 97 21.932 4.470 -9.774 566 HE ARG 97 HE ARG 97 23.916 2.575 -10.143 567 HH11 ARG 97 HH11 ARG 97 20.660 3.131 -11.312 568 HH12 ARG 97 HH12 ARG 97 20.963 2.392 -12.856 569 HH21 ARG 97 HH21 ARG 97 24.297 1.584 -12.162 570 HH22 ARG 97 HH22 ARG 97 23.021 1.506 -13.334 571 H GLU 98 HN GLU 98 20.755 0.417 -7.597 572 HA GLU 98 HA GLU 98 18.815 2.445 -8.052 573 HB2 GLU 98 HB2 GLU 98 18.862 -0.505 -8.580 574 HB3 GLU 98 HB1 GLU 98 17.433 0.474 -8.905 575 HG2 GLU 98 HG2 GLU 98 20.145 1.063 -10.040 576 HG3 GLU 98 HG1 GLU 98 18.922 0.099 -10.871 577 H LEU 99 HN LEU 99 19.064 -0.219 -5.677 578 HA LEU 99 HA LEU 99 16.374 -0.093 -4.846 579 HB2 LEU 99 HB2 LEU 99 17.852 -1.953 -4.319 580 HB3 LEU 99 HB1 LEU 99 18.842 -0.913 -3.325 581 HG LEU 99 HG LEU 99 17.130 -2.571 -2.252 582 HD11 LEU 99 HD11 LEU 99 17.491 0.274 -1.337 583 HD12 LEU 99 HD12 LEU 99 18.549 -1.102 -0.999 584 HD13 LEU 99 HD13 LEU 99 16.916 -1.059 -0.331 585 HD21 LEU 99 HD21 LEU 99 15.378 -0.178 -2.795 586 HD22 LEU 99 HD22 LEU 99 14.984 -1.525 -1.725 587 HD23 LEU 99 HD23 LEU 99 15.165 -1.798 -3.458 588 H GLN 100 HN GLN 100 19.268 1.392 -3.355 589 HA GLN 100 HA GLN 100 18.074 2.956 -1.432 590 HB2 GLN 100 HB2 GLN 100 20.284 3.980 -3.223 591 HB3 GLN 100 HB1 GLN 100 19.987 4.399 -1.546 592 HG2 GLN 100 HG2 GLN 100 20.837 1.675 -2.491 593 HG3 GLN 100 HG1 GLN 100 21.939 2.919 -1.913 594 HE21 GLN 100 HE21 GLN 100 21.920 3.474 0.279 595 HE22 GLN 100 HE22 GLN 100 21.228 2.433 1.469 596 H TYR 101 HN TYR 101 18.527 3.624 -4.852 597 HA TYR 101 HA TYR 101 17.601 6.281 -4.887 598 HB2 TYR 101 HB2 TYR 101 19.013 5.354 -6.645 599 HB3 TYR 101 HB1 TYR 101 17.762 4.201 -7.080 600 HD1 TYR 101 HD1 TYR 101 18.862 7.680 -7.316 601 HD2 TYR 101 HD2 TYR 101 15.814 4.905 -8.366 602 HE1 TYR 101 HE1 TYR 101 17.998 9.265 -8.984 603 HE2 TYR 101 HE2 TYR 101 14.941 6.486 -10.034 604 HH TYR 101 HH TYR 101 14.974 8.908 -10.466 605 H ARG 102 HN ARG 102 15.886 3.192 -5.387 606 HA ARG 102 HA ARG 102 13.532 4.597 -6.244 607 HB2 ARG 102 HB2 ARG 102 12.396 2.378 -6.175 608 HB3 ARG 102 HB1 ARG 102 13.787 2.474 -7.235 609 HG2 ARG 102 HG2 ARG 102 15.127 1.236 -5.679 610 HG3 ARG 102 HG1 ARG 102 13.825 1.257 -4.484 611 HD2 ARG 102 HD2 ARG 102 12.486 -0.186 -5.751 612 HD3 ARG 102 HD1 ARG 102 13.411 0.099 -7.222 613 HE ARG 102 HE ARG 102 15.263 -1.128 -5.980 614 HH11 ARG 102 HH11 ARG 102 11.857 -1.794 -5.494 615 HH12 ARG 102 HH12 ARG 102 12.118 -3.450 -5.059 616 HH21 ARG 102 HH21 ARG 102 15.601 -3.315 -5.429 617 HH22 ARG 102 HH22 ARG 102 14.245 -4.315 -5.020 618 H VAL 103 HN VAL 103 14.770 3.644 -3.164 619 HA VAL 103 HA VAL 103 12.258 3.536 -1.824 620 HB VAL 103 HB VAL 103 14.859 4.340 -0.518 621 HG11 VAL 103 HG11 VAL 103 12.848 4.539 0.855 622 HG12 VAL 103 HG12 VAL 103 13.900 3.245 1.438 623 HG13 VAL 103 HG13 VAL 103 12.448 2.857 0.514 624 HG21 VAL 103 HG21 VAL 103 15.242 1.960 -0.082 625 HG22 VAL 103 HG22 VAL 103 15.306 2.341 -1.802 626 HG23 VAL 103 HG23 VAL 103 13.878 1.558 -1.124 627 H GLU 104 HN GLU 104 14.627 6.149 -2.321 628 HA GLU 104 HA GLU 104 13.150 8.103 -0.945 629 HB2 GLU 104 HB2 GLU 104 14.534 9.690 -2.545 630 HB3 GLU 104 HB1 GLU 104 15.280 8.853 -1.195 631 HG2 GLU 104 HG2 GLU 104 16.161 7.176 -2.633 632 HG3 GLU 104 HG1 GLU 104 15.281 7.829 -4.014 633 H VAL 105 HN VAL 105 13.110 7.242 -4.415 634 HA VAL 105 HA VAL 105 11.228 9.262 -5.041 635 HB VAL 105 HB VAL 105 12.150 8.494 -6.987 636 HG11 VAL 105 HG11 VAL 105 12.443 6.134 -7.600 637 HG12 VAL 105 HG12 VAL 105 11.794 5.674 -6.025 638 HG13 VAL 105 HG13 VAL 105 13.308 6.573 -6.128 639 HG21 VAL 105 HG21 VAL 105 9.644 6.861 -6.806 640 HG22 VAL 105 HG22 VAL 105 10.492 7.281 -8.294 641 HG23 VAL 105 HG23 VAL 105 9.762 8.548 -7.307 642 H GLN 106 HN GLN 106 10.843 5.889 -3.983 643 HA GLN 106 HA GLN 106 8.061 5.768 -4.196 644 HB2 GLN 106 HB2 GLN 106 9.969 4.423 -2.291 645 HB3 GLN 106 HB1 GLN 106 8.242 4.115 -2.249 646 HG2 GLN 106 HG2 GLN 106 10.111 3.592 -4.539 647 HG3 GLN 106 HG1 GLN 106 9.327 2.395 -3.512 648 HE21 GLN 106 HE21 GLN 106 8.924 4.639 -6.122 649 HE22 GLN 106 HE22 GLN 106 7.372 4.080 -6.640 650 H ASN 107 HN ASN 107 10.079 6.983 -1.535 651 HA ASN 107 HA ASN 107 8.143 7.736 0.297 652 HB2 ASN 107 HB2 ASN 107 10.349 8.072 0.984 653 HB3 ASN 107 HB1 ASN 107 10.774 8.963 -0.475 654 HD21 ASN 107 HD21 ASN 107 8.890 9.128 2.492 655 HD22 ASN 107 HD22 ASN 107 8.924 10.849 2.632 656 H ARG 108 HN ARG 108 9.356 9.617 -2.462 657 HA ARG 108 HA ARG 108 7.653 11.839 -2.058 658 HB2 ARG 108 HB2 ARG 108 9.166 10.887 -4.488 659 HB3 ARG 108 HB1 ARG 108 8.339 12.428 -4.389 660 HG2 ARG 108 HG2 ARG 108 9.787 13.026 -2.467 661 HG3 ARG 108 HG1 ARG 108 10.665 11.518 -2.713 662 HD2 ARG 108 HD2 ARG 108 11.853 13.350 -3.756 663 HD3 ARG 108 HD1 ARG 108 11.237 12.250 -4.989 664 HE ARG 108 HE ARG 108 9.330 14.240 -4.640 665 HH11 ARG 108 HH11 ARG 108 12.648 13.991 -5.718 666 HH12 ARG 108 HH12 ARG 108 12.535 15.345 -6.797 667 HH21 ARG 108 HH21 ARG 108 9.169 16.021 -6.061 668 HH22 ARG 108 HH22 ARG 108 10.555 16.506 -6.987 669 H VAL 109 HN VAL 109 7.524 9.102 -4.274 670 HA VAL 109 HA VAL 109 5.228 9.757 -5.686 671 HB VAL 109 HB VAL 109 6.222 7.003 -4.949 672 HG11 VAL 109 HG11 VAL 109 4.307 7.847 -7.124 673 HG12 VAL 109 HG12 VAL 109 3.889 6.939 -5.670 674 HG13 VAL 109 HG13 VAL 109 4.946 6.220 -6.887 675 HG21 VAL 109 HG21 VAL 109 6.723 8.727 -7.373 676 HG22 VAL 109 HG22 VAL 109 7.233 7.049 -7.199 677 HG23 VAL 109 HG23 VAL 109 7.903 8.288 -6.133 678 H TYR 110 HN TYR 110 5.516 7.810 -2.714 679 HA TYR 110 HA TYR 110 2.762 7.258 -2.510 680 HB2 TYR 110 HB2 TYR 110 4.914 7.320 -0.397 681 HB3 TYR 110 HB1 TYR 110 3.278 6.749 -0.108 682 HD1 TYR 110 HD1 TYR 110 3.078 5.420 -2.951 683 HD2 TYR 110 HD2 TYR 110 5.919 5.212 0.209 684 HE1 TYR 110 HE1 TYR 110 3.725 3.171 -3.690 685 HE2 TYR 110 HE2 TYR 110 6.576 2.960 -0.526 686 HH TYR 110 HH TYR 110 5.850 1.711 -3.484 687 H LYS 111 HN LYS 111 4.665 10.023 -1.541 688 HA LYS 111 HA LYS 111 2.690 11.256 0.078 689 HB2 LYS 111 HB2 LYS 111 5.042 11.990 0.086 690 HB3 LYS 111 HB1 LYS 111 4.880 12.530 -1.580 691 HG2 LYS 111 HG2 LYS 111 3.150 14.147 -0.835 692 HG3 LYS 111 HG1 LYS 111 3.470 13.662 0.830 693 HD2 LYS 111 HD2 LYS 111 5.515 14.820 -1.062 694 HD3 LYS 111 HD1 LYS 111 4.658 15.731 0.179 695 HE2 LYS 111 HE2 LYS 111 6.436 13.355 0.701 696 HE3 LYS 111 HE1 LYS 111 6.936 15.037 0.856 697 HZ1 LYS 111 HZ1 LYS 111 6.316 14.068 2.985 698 HZ2 LYS 111 HZ2 LYS 111 4.760 13.748 2.411 699 HZ3 LYS 111 HZ3 LYS 111 5.286 15.346 2.577 700 H LYS 112 HN LYS 112 3.485 11.424 -3.350 701 HA LYS 112 HA LYS 112 1.521 13.277 -4.137 702 HB2 LYS 112 HB2 LYS 112 2.760 10.994 -5.690 703 HB3 LYS 112 HB1 LYS 112 1.825 12.303 -6.400 704 HG2 LYS 112 HG2 LYS 112 3.481 13.897 -5.901 705 HG3 LYS 112 HG1 LYS 112 4.310 12.801 -4.795 706 HD2 LYS 112 HD2 LYS 112 5.542 12.976 -6.877 707 HD3 LYS 112 HD1 LYS 112 4.892 11.351 -6.690 708 HE2 LYS 112 HE2 LYS 112 4.586 12.054 -8.963 709 HE3 LYS 112 HE1 LYS 112 3.014 11.981 -8.174 710 HZ1 LYS 112 HZ1 LYS 112 3.064 14.368 -7.906 711 HZ2 LYS 112 HZ2 LYS 112 3.266 13.970 -9.534 712 HZ3 LYS 112 HZ3 LYS 112 4.598 14.456 -8.611 713 H GLU 113 HN GLU 113 1.464 9.777 -3.729 714 HA GLU 113 HA GLU 113 -1.059 9.209 -4.756 715 HB2 GLU 113 HB2 GLU 113 0.267 7.942 -2.350 716 HB3 GLU 113 HB1 GLU 113 -1.027 7.237 -3.313 717 HG2 GLU 113 HG2 GLU 113 1.664 7.959 -4.427 718 HG3 GLU 113 HG1 GLU 113 1.273 6.370 -3.784 719 H ILE 114 HN ILE 114 -0.154 9.970 -1.388 720 HA ILE 114 HA ILE 114 -2.704 9.893 -0.294 721 HB ILE 114 HB ILE 114 -0.339 11.568 0.534 722 HG12 ILE 114 HG12 ILE 114 -1.336 8.876 1.481 723 HG13 ILE 114 HG11 ILE 114 0.039 9.132 0.416 724 HG21 ILE 114 HG21 ILE 114 -2.882 10.902 2.010 725 HG22 ILE 114 HG22 ILE 114 -2.278 12.505 1.576 726 HG23 ILE 114 HG23 ILE 114 -1.430 11.535 2.786 727 HD11 ILE 114 HD11 ILE 114 1.228 10.273 2.156 728 HD12 ILE 114 HD12 ILE 114 0.683 8.696 2.732 729 HD13 ILE 114 HD13 ILE 114 -0.167 10.158 3.228 730 H GLN 115 HN GLN 115 -1.088 12.516 -1.982 731 HA GLN 115 HA GLN 115 -2.964 14.540 -1.406 732 HB2 GLN 115 HB2 GLN 115 -1.286 14.224 -3.887 733 HB3 GLN 115 HB1 GLN 115 -1.992 15.714 -3.269 734 HG2 GLN 115 HG2 GLN 115 -0.645 15.302 -1.165 735 HG3 GLN 115 HG1 GLN 115 0.207 14.072 -2.098 736 HE21 GLN 115 HE21 GLN 115 1.058 16.645 -0.914 737 HE22 GLN 115 HE22 GLN 115 1.793 17.507 -2.211 738 H ALA 116 HN ALA 116 -2.684 12.219 -4.046 739 HA ALA 116 HA ALA 116 -5.048 12.964 -5.429 740 HB1 ALA 116 HB1 ALA 116 -4.825 10.821 -6.566 741 HB2 ALA 116 HB2 ALA 116 -3.653 10.290 -5.357 742 HB3 ALA 116 HB3 ALA 116 -3.257 11.623 -6.446 743 H LEU 117 HN LEU 117 -4.336 10.549 -2.966 744 HA LEU 117 HA LEU 117 -6.882 9.359 -2.830 745 HB2 LEU 117 HB2 LEU 117 -4.791 9.606 -0.664 746 HB3 LEU 117 HB1 LEU 117 -6.121 8.465 -0.679 747 HG LEU 117 HG LEU 117 -3.938 8.500 -2.759 748 HD11 LEU 117 HD11 LEU 117 -2.951 6.631 -1.613 749 HD12 LEU 117 HD12 LEU 117 -4.188 6.704 -0.357 750 HD13 LEU 117 HD13 LEU 117 -3.025 8.018 -0.530 751 HD21 LEU 117 HD21 LEU 117 -6.056 7.474 -3.446 752 HD22 LEU 117 HD22 LEU 117 -5.975 6.399 -2.052 753 HD23 LEU 117 HD23 LEU 117 -4.751 6.296 -3.320 754 H ASP 118 HN ASP 118 -5.560 12.270 -1.467 755 HA ASP 118 HA ASP 118 -7.486 12.682 0.557 756 HB2 ASP 118 HB2 ASP 118 -5.323 13.907 0.410 757 HB3 ASP 118 HB1 ASP 118 -5.951 14.789 -0.979 758 H ALA 119 HN ALA 119 -7.441 13.374 -2.883 759 HA ALA 119 HA ALA 119 -9.845 14.866 -2.999 760 HB1 ALA 119 HB1 ALA 119 -9.901 14.244 -5.364 761 HB2 ALA 119 HB2 ALA 119 -8.648 13.036 -5.081 762 HB3 ALA 119 HB3 ALA 119 -8.281 14.748 -4.880 763 H GLU 120 HN GLU 120 -9.124 11.414 -3.126 764 HA GLU 120 HA GLU 120 -11.788 10.513 -3.345 765 HB2 GLU 120 HB2 GLU 120 -9.162 9.337 -2.600 766 HB3 GLU 120 HB1 GLU 120 -10.600 8.478 -2.108 767 HG2 GLU 120 HG2 GLU 120 -9.561 7.772 -4.280 768 HG3 GLU 120 HG1 GLU 120 -11.286 8.105 -4.300 769 H ILE 121 HN ILE 121 -9.817 11.539 -0.605 770 HA ILE 121 HA ILE 121 -11.424 10.585 1.460 771 HB ILE 121 HB ILE 121 -9.436 12.739 1.196 772 HG12 ILE 121 HG12 ILE 121 -8.649 11.779 3.331 773 HG13 ILE 121 HG11 ILE 121 -10.078 10.753 3.388 774 HG21 ILE 121 HG21 ILE 121 -11.484 12.893 3.400 775 HG22 ILE 121 HG22 ILE 121 -11.239 14.072 2.111 776 HG23 ILE 121 HG23 ILE 121 -9.983 13.817 3.322 777 HD11 ILE 121 HD11 ILE 121 -7.927 10.662 1.286 778 HD12 ILE 121 HD12 ILE 121 -9.349 9.621 1.360 779 HD13 ILE 121 HD13 ILE 121 -8.124 9.531 2.623 780 H ARG 122 HN ARG 122 -11.860 13.308 -0.700 781 HA ARG 122 HA ARG 122 -14.039 14.503 0.643 782 HB2 ARG 122 HB2 ARG 122 -12.737 15.621 -1.134 783 HB3 ARG 122 HB1 ARG 122 -13.409 14.505 -2.315 784 HG2 ARG 122 HG2 ARG 122 -15.634 15.374 -1.901 785 HG3 ARG 122 HG1 ARG 122 -14.998 16.459 -0.666 786 HD2 ARG 122 HD2 ARG 122 -13.608 17.553 -2.370 787 HD3 ARG 122 HD1 ARG 122 -14.293 16.489 -3.597 788 HE ARG 122 HE ARG 122 -16.489 17.618 -2.544 789 HH11 ARG 122 HH11 ARG 122 -13.488 18.974 -3.726 790 HH12 ARG 122 HH12 ARG 122 -14.206 20.484 -4.190 791 HH21 ARG 122 HH21 ARG 122 -17.448 19.591 -3.167 792 HH22 ARG 122 HH22 ARG 122 -16.465 20.840 -3.864 793 H LYS 123 HN LYS 123 -13.832 11.932 -1.777 794 HA LYS 123 HA LYS 123 -16.635 11.575 -2.123 795 HB2 LYS 123 HB2 LYS 123 -16.094 9.776 -3.453 796 HB3 LYS 123 HB1 LYS 123 -14.546 10.599 -3.463 797 HG2 LYS 123 HG2 LYS 123 -14.094 9.093 -1.370 798 HG3 LYS 123 HG1 LYS 123 -15.344 8.094 -2.082 799 HD2 LYS 123 HD2 LYS 123 -12.670 8.846 -3.205 800 HD3 LYS 123 HD1 LYS 123 -13.299 7.241 -2.871 801 HE2 LYS 123 HE2 LYS 123 -13.530 7.274 -5.125 802 HE3 LYS 123 HE1 LYS 123 -15.083 7.958 -4.663 803 HZ1 LYS 123 HZ1 LYS 123 -14.255 10.154 -5.095 804 HZ2 LYS 123 HZ2 LYS 123 -13.988 9.195 -6.455 805 HZ3 LYS 123 HZ3 LYS 123 -12.699 9.565 -5.423 806 H LEU 124 HN LEU 124 -14.261 10.364 0.132 807 HA LEU 124 HA LEU 124 -15.923 8.485 1.420 808 HB2 LEU 124 HB2 LEU 124 -13.434 9.943 2.264 809 HB3 LEU 124 HB1 LEU 124 -14.204 8.729 3.267 810 HG LEU 124 HG LEU 124 -13.089 8.241 0.495 811 HD11 LEU 124 HD11 LEU 124 -12.011 7.495 3.216 812 HD12 LEU 124 HD12 LEU 124 -11.322 8.694 2.123 813 HD13 LEU 124 HD13 LEU 124 -11.338 6.991 1.667 814 HD21 LEU 124 HD21 LEU 124 -13.449 5.893 1.032 815 HD22 LEU 124 HD22 LEU 124 -14.961 6.802 1.050 816 HD23 LEU 124 HD23 LEU 124 -14.184 6.352 2.567 817 H GLU 125 HN GLU 125 -15.032 11.846 2.216 818 HA GLU 125 HA GLU 125 -16.318 12.058 4.641 819 HB2 GLU 125 HB2 GLU 125 -16.008 14.177 2.523 820 HB3 GLU 125 HB1 GLU 125 -16.490 14.481 4.188 821 HG2 GLU 125 HG2 GLU 125 -14.373 13.668 4.993 822 HG3 GLU 125 HG1 GLU 125 -13.887 13.225 3.362 823 H ARG 126 HN ARG 126 -17.756 12.540 1.415 824 HA ARG 126 HA ARG 126 -20.279 13.349 2.405 825 HB2 ARG 126 HB2 ARG 126 -21.158 12.812 0.173 826 HB3 ARG 126 HB1 ARG 126 -19.680 13.758 0.086 827 HG2 ARG 126 HG2 ARG 126 -18.406 11.846 -0.530 828 HG3 ARG 126 HG1 ARG 126 -19.771 10.770 -0.224 829 HD2 ARG 126 HD2 ARG 126 -19.663 12.924 -2.335 830 HD3 ARG 126 HD1 ARG 126 -19.434 11.201 -2.622 831 HE ARG 126 HE ARG 126 -21.870 11.360 -1.407 832 HH11 ARG 126 HH11 ARG 126 -20.448 12.860 -4.230 833 HH12 ARG 126 HH12 ARG 126 -21.950 12.959 -5.092 834 HH21 ARG 126 HH21 ARG 126 -23.854 11.491 -2.536 835 HH22 ARG 126 HH22 ARG 126 -23.888 12.182 -4.130 836 H LEU 127 HN LEU 127 -18.863 10.192 1.817 837 HA LEU 127 HA LEU 127 -21.216 8.656 2.268 838 HB2 LEU 127 HB2 LEU 127 -18.856 8.039 1.272 839 HB3 LEU 127 HB1 LEU 127 -18.451 7.729 2.944 840 HG LEU 127 HG LEU 127 -19.193 5.782 1.394 841 HD11 LEU 127 HD11 LEU 127 -18.661 5.463 3.699 842 HD12 LEU 127 HD12 LEU 127 -20.180 4.633 3.360 843 HD13 LEU 127 HD13 LEU 127 -20.189 6.181 4.203 844 HD21 LEU 127 HD21 LEU 127 -21.276 6.864 0.658 845 HD22 LEU 127 HD22 LEU 127 -21.874 6.806 2.317 846 HD23 LEU 127 HD23 LEU 127 -21.559 5.310 1.440 847 H LEU 128 HN LEU 128 -18.399 9.352 4.327 848 HA LEU 128 HA LEU 128 -19.164 8.537 6.781 849 HB2 LEU 128 HB2 LEU 128 -17.608 10.893 5.786 850 HB3 LEU 128 HB1 LEU 128 -17.878 10.694 7.506 851 HG LEU 128 HG LEU 128 -16.720 8.585 7.479 852 HD11 LEU 128 HD11 LEU 128 -16.287 8.979 4.551 853 HD12 LEU 128 HD12 LEU 128 -17.298 7.746 5.300 854 HD13 LEU 128 HD13 LEU 128 -15.552 7.722 5.546 855 HD21 LEU 128 HD21 LEU 128 -15.167 10.734 6.061 856 HD22 LEU 128 HD22 LEU 128 -14.467 9.386 6.961 857 HD23 LEU 128 HD23 LEU 128 -15.414 10.609 7.805 858 H GLU 129 HN GLU 129 -19.629 11.896 5.697 859 HA GLU 129 HA GLU 129 -21.062 12.660 7.998 860 HB2 GLU 129 HB2 GLU 129 -20.869 13.986 5.293 861 HB3 GLU 129 HB1 GLU 129 -21.512 14.748 6.745 862 HG2 GLU 129 HG2 GLU 129 -19.361 14.504 7.837 863 HG3 GLU 129 HG1 GLU 129 -18.708 13.707 6.412 864 H SER 130 HN SER 130 -22.124 11.225 5.046 865 HA SER 130 HA SER 130 -24.861 12.038 5.290 866 HB2 SER 130 HB2 SER 130 -23.843 11.383 3.115 867 HB3 SER 130 HB1 SER 130 -23.727 9.726 3.699 868 HG SER 130 HG SER 130 -25.605 9.905 2.511 869 H GLY 131 HN GLY 131 -22.977 9.926 7.036 870 HA2 GLY 131 HA2 GLY 131 -23.765 8.860 8.976 871 HA3 GLY 131 HA1 GLY 131 -25.381 8.845 8.292 872 H LEU 132 HN LEU 132 -22.893 7.798 6.205 873 HA LEU 132 HA LEU 132 -23.829 5.050 6.462 874 HB2 LEU 132 HB2 LEU 132 -22.089 6.446 4.435 875 HB3 LEU 132 HB1 LEU 132 -22.232 4.700 4.486 876 HG LEU 132 HG LEU 132 -23.699 5.527 2.788 877 HD11 LEU 132 HD11 LEU 132 -24.492 3.640 4.136 878 HD12 LEU 132 HD12 LEU 132 -25.815 4.618 3.500 879 HD13 LEU 132 HD13 LEU 132 -25.343 4.767 5.191 880 HD21 LEU 132 HD21 LEU 132 -23.977 7.806 3.514 881 HD22 LEU 132 HD22 LEU 132 -24.898 7.281 4.922 882 HD23 LEU 132 HD23 LEU 132 -25.559 7.056 3.302 883 H THR 133 HN THR 133 -21.159 7.028 7.307 884 HA THR 133 HA THR 133 -19.989 4.824 8.773 885 HB THR 133 HB THR 133 -18.331 6.396 6.781 886 HG1 THR 133 HG1 THR 133 -19.791 4.176 6.497 887 HG21 THR 133 HG21 THR 133 -17.548 4.150 8.641 888 HG22 THR 133 HG22 THR 133 -17.093 5.842 8.828 889 HG23 THR 133 HG23 THR 133 -16.501 4.916 7.448 Start of MODEL 7 1 H1 MET 1 HT1 MET 1 31.335 -7.022 2.124 2 H2 MET 1 HT2 MET 1 30.377 -6.066 3.140 3 H3 MET 1 HT3 MET 1 31.918 -5.541 2.688 4 HA MET 1 HA MET 1 31.256 -5.308 0.415 5 HB2 MET 1 HB2 MET 1 28.576 -6.276 1.436 6 HB3 MET 1 HB1 MET 1 28.836 -5.578 -0.155 7 HG2 MET 1 HG2 MET 1 30.123 -8.092 0.881 8 HG3 MET 1 HG1 MET 1 28.740 -8.019 -0.209 9 HE1 MET 1 HE1 MET 1 29.500 -5.613 -2.144 10 HE2 MET 1 HE2 MET 1 28.846 -7.157 -2.690 11 HE3 MET 1 HE3 MET 1 30.295 -6.494 -3.448 12 H ASP 2 HN ASP 2 31.905 -3.488 2.178 13 HA ASP 2 HA ASP 2 29.948 -1.396 1.810 14 HB2 ASP 2 HB2 ASP 2 29.711 -0.805 4.147 15 HB3 ASP 2 HB1 ASP 2 29.205 -2.472 3.918 16 H SER 3 HN SER 3 32.615 -1.881 0.875 17 HA SER 3 HA SER 3 34.469 -0.292 2.340 18 HB2 SER 3 HB2 SER 3 35.206 -2.027 0.755 19 HB3 SER 3 HB1 SER 3 34.503 -1.113 -0.577 20 HG SER 3 HG SER 3 36.141 0.230 -0.546 21 H ALA 4 HN ALA 4 32.563 0.316 -0.608 22 HA ALA 4 HA ALA 4 33.261 3.136 -0.546 23 HB1 ALA 4 HB1 ALA 4 31.420 1.631 -2.407 24 HB2 ALA 4 HB2 ALA 4 33.122 1.980 -2.704 25 HB3 ALA 4 HB3 ALA 4 31.954 3.300 -2.605 26 H ILE 5 HN ILE 5 30.384 1.108 -0.238 27 HA ILE 5 HA ILE 5 28.540 3.125 0.402 28 HB ILE 5 HB ILE 5 28.566 0.223 1.258 29 HG12 ILE 5 HG12 ILE 5 27.127 1.542 -1.051 30 HG13 ILE 5 HG11 ILE 5 28.629 0.642 -1.207 31 HG21 ILE 5 HG21 ILE 5 26.293 2.203 1.199 32 HG22 ILE 5 HG22 ILE 5 27.075 1.567 2.644 33 HG23 ILE 5 HG23 ILE 5 26.158 0.490 1.591 34 HD11 ILE 5 HD11 ILE 5 25.995 -0.461 -0.266 35 HD12 ILE 5 HD12 ILE 5 27.501 -1.368 -0.403 36 HD13 ILE 5 HD13 ILE 5 26.731 -0.714 -1.849 37 H SER 6 HN SER 6 28.817 4.514 2.024 38 HA SER 6 HA SER 6 30.123 3.548 4.468 39 HB2 SER 6 HB2 SER 6 29.799 6.404 3.523 40 HB3 SER 6 HB1 SER 6 30.829 5.823 4.834 41 HG SER 6 HG SER 6 31.176 4.754 2.260 42 H LYS 7 HN LYS 7 29.350 5.468 6.275 43 HA LYS 7 HA LYS 7 26.835 4.604 7.103 44 HB2 LYS 7 HB2 LYS 7 28.642 5.620 8.510 45 HB3 LYS 7 HB1 LYS 7 28.222 7.183 7.831 46 HG2 LYS 7 HG2 LYS 7 27.194 7.039 9.928 47 HG3 LYS 7 HG1 LYS 7 25.916 6.858 8.730 48 HD2 LYS 7 HD2 LYS 7 25.536 5.254 10.468 49 HD3 LYS 7 HD1 LYS 7 26.082 4.386 9.033 50 HE2 LYS 7 HE2 LYS 7 27.169 3.511 11.022 51 HE3 LYS 7 HE1 LYS 7 28.350 4.286 9.969 52 HZ1 LYS 7 HZ1 LYS 7 28.712 4.883 12.269 53 HZ2 LYS 7 HZ2 LYS 7 27.142 5.487 12.397 54 HZ3 LYS 7 HZ3 LYS 7 28.257 6.248 11.385 55 H GLU 8 HN GLU 8 27.851 7.267 5.106 56 HA GLU 8 HA GLU 8 25.642 8.891 4.986 57 HB2 GLU 8 HB2 GLU 8 27.560 8.035 2.820 58 HB3 GLU 8 HB1 GLU 8 26.359 9.301 2.594 59 HG2 GLU 8 HG2 GLU 8 28.581 9.317 4.619 60 HG3 GLU 8 HG1 GLU 8 28.540 10.231 3.113 61 H ASP 9 HN ASP 9 26.305 6.296 2.621 62 HA ASP 9 HA ASP 9 23.785 6.408 1.399 63 HB2 ASP 9 HB2 ASP 9 25.719 5.369 0.319 64 HB3 ASP 9 HB1 ASP 9 25.735 4.096 1.534 65 H GLU 10 HN GLU 10 24.967 4.536 4.107 66 HA GLU 10 HA GLU 10 22.821 2.720 4.267 67 HB2 GLU 10 HB2 GLU 10 24.955 2.285 5.345 68 HB3 GLU 10 HB1 GLU 10 24.738 3.680 6.396 69 HG2 GLU 10 HG2 GLU 10 22.844 2.618 7.459 70 HG3 GLU 10 HG1 GLU 10 22.978 1.240 6.368 71 H GLU 11 HN GLU 11 23.505 5.457 6.462 72 HA GLU 11 HA GLU 11 21.053 5.396 7.756 73 HB2 GLU 11 HB2 GLU 11 23.031 7.626 7.352 74 HB3 GLU 11 HB1 GLU 11 21.610 7.784 8.378 75 HG2 GLU 11 HG2 GLU 11 23.674 5.635 8.743 76 HG3 GLU 11 HG1 GLU 11 23.746 7.198 9.550 77 H ARG 12 HN ARG 12 22.017 7.016 4.794 78 HA ARG 12 HA ARG 12 19.723 8.645 4.520 79 HB2 ARG 12 HB2 ARG 12 21.852 8.904 3.219 80 HB3 ARG 12 HB1 ARG 12 21.405 7.479 2.296 81 HG2 ARG 12 HG2 ARG 12 20.854 9.425 1.023 82 HG3 ARG 12 HG1 ARG 12 19.355 8.660 1.552 83 HD2 ARG 12 HD2 ARG 12 20.646 10.949 3.019 84 HD3 ARG 12 HD1 ARG 12 19.450 11.179 1.748 85 HE ARG 12 HE ARG 12 17.980 9.723 3.253 86 HH11 ARG 12 HH11 ARG 12 20.462 11.867 4.487 87 HH12 ARG 12 HH12 ARG 12 19.620 12.192 5.966 88 HH21 ARG 12 HH21 ARG 12 16.876 10.149 5.202 89 HH22 ARG 12 HH22 ARG 12 17.589 11.209 6.380 90 H TYR 13 HN TYR 13 20.436 5.315 3.648 91 HA TYR 13 HA TYR 13 17.967 4.928 2.243 92 HB2 TYR 13 HB2 TYR 13 19.714 3.488 1.582 93 HB3 TYR 13 HB1 TYR 13 20.122 3.075 3.243 94 HD1 TYR 13 HD1 TYR 13 19.607 0.929 3.843 95 HD2 TYR 13 HD2 TYR 13 17.064 2.935 1.089 96 HE1 TYR 13 HE1 TYR 13 18.155 -1.051 3.753 97 HE2 TYR 13 HE2 TYR 13 15.600 0.965 0.993 98 HH TYR 13 HH TYR 13 15.769 -1.550 3.228 99 H GLN 14 HN GLN 14 19.198 4.070 5.451 100 HA GLN 14 HA GLN 14 17.069 2.583 6.410 101 HB2 GLN 14 HB2 GLN 14 18.851 4.520 7.888 102 HB3 GLN 14 HB1 GLN 14 17.786 3.364 8.671 103 HG2 GLN 14 HG2 GLN 14 20.041 2.662 6.810 104 HG3 GLN 14 HG1 GLN 14 20.116 2.621 8.568 105 HE21 GLN 14 HE21 GLN 14 17.420 1.593 8.884 106 HE22 GLN 14 HE22 GLN 14 17.466 -0.067 8.395 107 H LYS 15 HN LYS 15 17.560 6.069 6.947 108 HA LYS 15 HA LYS 15 15.083 6.563 8.093 109 HB2 LYS 15 HB2 LYS 15 16.859 8.393 6.485 110 HB3 LYS 15 HB1 LYS 15 15.419 8.934 7.345 111 HG2 LYS 15 HG2 LYS 15 17.725 7.533 8.670 112 HG3 LYS 15 HG1 LYS 15 17.553 9.289 8.575 113 HD2 LYS 15 HD2 LYS 15 15.625 9.283 9.909 114 HD3 LYS 15 HD1 LYS 15 15.377 7.551 9.693 115 HE2 LYS 15 HE2 LYS 15 17.351 7.081 11.002 116 HE3 LYS 15 HE1 LYS 15 17.670 8.805 11.183 117 HZ1 LYS 15 HZ1 LYS 15 15.262 7.396 12.194 118 HZ2 LYS 15 HZ2 LYS 15 15.618 9.034 12.411 119 HZ3 LYS 15 HZ3 LYS 15 16.587 7.856 13.136 120 H LEU 16 HN LEU 16 15.991 6.277 4.744 121 HA LEU 16 HA LEU 16 13.723 7.454 3.566 122 HB2 LEU 16 HB2 LEU 16 15.936 6.849 2.476 123 HB3 LEU 16 HB1 LEU 16 15.343 5.199 2.407 124 HG LEU 16 HG LEU 16 13.551 5.847 0.915 125 HD11 LEU 16 HD11 LEU 16 14.588 8.642 1.360 126 HD12 LEU 16 HD12 LEU 16 12.978 8.021 1.738 127 HD13 LEU 16 HD13 LEU 16 13.492 8.196 0.058 128 HD21 LEU 16 HD21 LEU 16 14.877 6.487 -1.002 129 HD22 LEU 16 HD22 LEU 16 15.758 5.326 -0.008 130 HD23 LEU 16 HD23 LEU 16 16.177 7.038 0.055 131 H VAL 17 HN VAL 17 14.476 4.091 4.426 132 HA VAL 17 HA VAL 17 12.046 2.983 3.519 133 HB VAL 17 HB VAL 17 12.648 1.007 4.514 134 HG11 VAL 17 HG11 VAL 17 15.070 0.767 4.510 135 HG12 VAL 17 HG12 VAL 17 15.233 2.525 4.546 136 HG13 VAL 17 HG13 VAL 17 14.502 1.735 3.148 137 HG21 VAL 17 HG21 VAL 17 12.388 1.708 6.830 138 HG22 VAL 17 HG22 VAL 17 13.957 2.509 6.776 139 HG23 VAL 17 HG23 VAL 17 13.859 0.753 6.630 140 H THR 18 HN THR 18 12.987 4.591 6.471 141 HA THR 18 HA THR 18 10.739 4.014 8.014 142 HB THR 18 HB THR 18 12.893 6.070 8.007 143 HG1 THR 18 HG1 THR 18 11.954 4.028 9.731 144 HG21 THR 18 HG21 THR 18 10.985 7.405 8.539 145 HG22 THR 18 HG22 THR 18 11.934 7.135 9.999 146 HG23 THR 18 HG23 THR 18 10.437 6.231 9.733 147 H GLU 19 HN GLU 19 11.510 6.831 5.963 148 HA GLU 19 HA GLU 19 9.099 8.193 6.149 149 HB2 GLU 19 HB2 GLU 19 10.909 7.903 3.729 150 HB3 GLU 19 HB1 GLU 19 9.654 9.126 3.913 151 HG2 GLU 19 HG2 GLU 19 10.846 9.985 5.909 152 HG3 GLU 19 HG1 GLU 19 12.125 8.806 5.610 153 H ASN 20 HN ASN 20 10.065 5.581 4.046 154 HA ASN 20 HA ASN 20 7.820 5.539 2.358 155 HB2 ASN 20 HB2 ASN 20 10.118 4.542 1.995 156 HB3 ASN 20 HB1 ASN 20 9.631 3.224 3.049 157 HD21 ASN 20 HD21 ASN 20 10.066 1.851 1.288 158 HD22 ASN 20 HD22 ASN 20 8.939 1.673 -0.006 159 H GLU 21 HN GLU 21 8.565 3.671 5.319 160 HA GLU 21 HA GLU 21 6.271 2.032 5.216 161 HB2 GLU 21 HB2 GLU 21 7.952 2.885 7.566 162 HB3 GLU 21 HB1 GLU 21 6.799 1.555 7.567 163 HG2 GLU 21 HG2 GLU 21 8.988 1.646 5.562 164 HG3 GLU 21 HG1 GLU 21 9.310 1.086 7.195 165 H GLN 22 HN GLN 22 6.842 5.187 6.671 166 HA GLN 22 HA GLN 22 4.661 5.293 8.413 167 HB2 GLN 22 HB2 GLN 22 5.655 7.670 6.845 168 HB3 GLN 22 HB1 GLN 22 4.876 7.671 8.417 169 HG2 GLN 22 HG2 GLN 22 6.806 6.628 9.438 170 HG3 GLN 22 HG1 GLN 22 7.590 6.498 7.866 171 HE21 GLN 22 HE21 GLN 22 8.438 7.869 10.311 172 HE22 GLN 22 HE22 GLN 22 8.697 9.516 9.856 173 H LEU 23 HN LEU 23 4.859 6.685 5.146 174 HA LEU 23 HA LEU 23 2.113 7.483 5.360 175 HB2 LEU 23 HB2 LEU 23 2.464 8.854 3.523 176 HB3 LEU 23 HB1 LEU 23 3.980 8.872 4.382 177 HG LEU 23 HG LEU 23 3.374 7.445 1.819 178 HD11 LEU 23 HD11 LEU 23 5.219 9.705 2.523 179 HD12 LEU 23 HD12 LEU 23 3.737 9.809 1.571 180 HD13 LEU 23 HD13 LEU 23 5.128 8.923 0.945 181 HD21 LEU 23 HD21 LEU 23 5.715 6.759 1.787 182 HD22 LEU 23 HD22 LEU 23 4.841 6.031 3.134 183 HD23 LEU 23 HD23 LEU 23 5.918 7.399 3.418 184 H GLN 24 HN GLN 24 3.737 4.775 3.964 185 HA GLN 24 HA GLN 24 1.788 4.185 1.991 186 HB2 GLN 24 HB2 GLN 24 2.703 1.951 1.911 187 HB3 GLN 24 HB1 GLN 24 4.014 3.114 2.009 188 HG2 GLN 24 HG2 GLN 24 4.317 2.625 4.356 189 HG3 GLN 24 HG1 GLN 24 2.939 1.526 4.326 190 HE21 GLN 24 HE21 GLN 24 6.220 2.033 3.291 191 HE22 GLN 24 HE22 GLN 24 6.566 0.380 2.912 192 H ARG 25 HN ARG 25 1.995 3.595 5.431 193 HA ARG 25 HA ARG 25 -0.219 1.860 5.660 194 HB2 ARG 25 HB2 ARG 25 1.068 1.893 7.587 195 HB3 ARG 25 HB1 ARG 25 1.366 3.627 7.483 196 HG2 ARG 25 HG2 ARG 25 -1.080 3.907 7.985 197 HG3 ARG 25 HG1 ARG 25 -1.082 2.210 8.457 198 HD2 ARG 25 HD2 ARG 25 0.767 2.759 10.063 199 HD3 ARG 25 HD1 ARG 25 0.514 4.467 9.668 200 HE ARG 25 HE ARG 25 -1.922 3.215 10.436 201 HH11 ARG 25 HH11 ARG 25 1.056 4.457 11.788 202 HH12 ARG 25 HH12 ARG 25 0.342 4.861 13.316 203 HH21 ARG 25 HH21 ARG 25 -2.863 3.740 12.444 204 HH22 ARG 25 HH22 ARG 25 -1.886 4.460 13.686 205 H LEU 26 HN LEU 26 0.249 5.325 5.907 206 HA LEU 26 HA LEU 26 -2.341 6.067 6.648 207 HB2 LEU 26 HB2 LEU 26 -0.285 7.651 5.103 208 HB3 LEU 26 HB1 LEU 26 -1.607 8.317 6.055 209 HG LEU 26 HG LEU 26 0.660 6.663 7.187 210 HD11 LEU 26 HD11 LEU 26 1.374 8.900 6.349 211 HD12 LEU 26 HD12 LEU 26 1.599 8.646 8.077 212 HD13 LEU 26 HD13 LEU 26 0.247 9.625 7.497 213 HD21 LEU 26 HD21 LEU 26 -1.503 8.239 8.571 214 HD22 LEU 26 HD22 LEU 26 -0.196 7.352 9.355 215 HD23 LEU 26 HD23 LEU 26 -1.431 6.481 8.443 216 H ILE 27 HN ILE 27 -0.868 5.489 3.543 217 HA ILE 27 HA ILE 27 -3.026 6.309 1.912 218 HB ILE 27 HB ILE 27 -0.883 4.232 1.484 219 HG12 ILE 27 HG12 ILE 27 -1.196 7.032 0.401 220 HG13 ILE 27 HG11 ILE 27 -0.129 6.567 1.737 221 HG21 ILE 27 HG21 ILE 27 -2.860 3.760 0.089 222 HG22 ILE 27 HG22 ILE 27 -1.452 4.233 -0.861 223 HG23 ILE 27 HG23 ILE 27 -2.752 5.389 -0.577 224 HD11 ILE 27 HD11 ILE 27 0.031 5.537 -1.080 225 HD12 ILE 27 HD12 ILE 27 1.111 5.123 0.251 226 HD13 ILE 27 HD13 ILE 27 1.067 6.774 -0.369 227 H THR 28 HN THR 28 -2.033 3.098 3.064 228 HA THR 28 HA THR 28 -4.059 1.620 1.910 229 HB THR 28 HB THR 28 -1.894 1.019 3.464 230 HG1 THR 28 HG1 THR 28 -2.402 -0.570 2.145 231 HG21 THR 28 HG21 THR 28 -4.343 0.226 5.045 232 HG22 THR 28 HG22 THR 28 -3.081 1.344 5.567 233 HG23 THR 28 HG23 THR 28 -2.703 -0.363 5.331 234 H GLN 29 HN GLN 29 -4.137 3.433 4.941 235 HA GLN 29 HA GLN 29 -6.492 2.421 6.056 236 HB2 GLN 29 HB2 GLN 29 -5.809 5.355 6.098 237 HB3 GLN 29 HB1 GLN 29 -6.640 4.417 7.327 238 HG2 GLN 29 HG2 GLN 29 -4.489 3.191 7.683 239 HG3 GLN 29 HG1 GLN 29 -3.724 4.373 6.635 240 HE21 GLN 29 HE21 GLN 29 -5.257 3.828 9.700 241 HE22 GLN 29 HE22 GLN 29 -4.765 5.314 10.438 242 H LYS 30 HN LYS 30 -6.046 5.255 4.030 243 HA LYS 30 HA LYS 30 -8.847 5.739 3.748 244 HB2 LYS 30 HB2 LYS 30 -6.652 6.889 2.033 245 HB3 LYS 30 HB1 LYS 30 -8.226 7.588 2.383 246 HG2 LYS 30 HG2 LYS 30 -5.930 7.246 4.298 247 HG3 LYS 30 HG1 LYS 30 -6.552 8.756 3.638 248 HD2 LYS 30 HD2 LYS 30 -8.630 8.476 4.838 249 HD3 LYS 30 HD1 LYS 30 -8.132 6.878 5.391 250 HE2 LYS 30 HE2 LYS 30 -7.850 8.531 7.153 251 HE3 LYS 30 HE1 LYS 30 -6.297 7.874 6.648 252 HZ1 LYS 30 HZ1 LYS 30 -7.430 10.500 5.847 253 HZ2 LYS 30 HZ2 LYS 30 -5.965 9.871 5.291 254 HZ3 LYS 30 HZ3 LYS 30 -6.154 10.248 6.928 255 H GLU 31 HN GLU 31 -6.333 4.413 1.633 256 HA GLU 31 HA GLU 31 -7.640 4.135 -0.739 257 HB2 GLU 31 HB2 GLU 31 -5.491 2.670 0.633 258 HB3 GLU 31 HB1 GLU 31 -6.289 1.786 -0.662 259 HG2 GLU 31 HG2 GLU 31 -5.215 4.563 -1.014 260 HG3 GLU 31 HG1 GLU 31 -4.246 3.118 -1.289 261 H GLU 32 HN GLU 32 -7.622 1.578 1.784 262 HA GLU 32 HA GLU 32 -9.307 -0.129 0.341 263 HB2 GLU 32 HB2 GLU 32 -9.707 -1.295 2.487 264 HB3 GLU 32 HB1 GLU 32 -8.005 -1.005 2.159 265 HG2 GLU 32 HG2 GLU 32 -7.863 0.678 3.779 266 HG3 GLU 32 HG1 GLU 32 -9.620 0.833 3.892 267 H LYS 33 HN LYS 33 -10.070 2.438 2.640 268 HA LYS 33 HA LYS 33 -12.847 1.848 2.799 269 HB2 LYS 33 HB2 LYS 33 -11.373 4.443 3.297 270 HB3 LYS 33 HB1 LYS 33 -13.057 4.150 3.709 271 HG2 LYS 33 HG2 LYS 33 -10.656 2.735 4.856 272 HG3 LYS 33 HG1 LYS 33 -11.674 3.924 5.671 273 HD2 LYS 33 HD2 LYS 33 -13.601 2.381 5.404 274 HD3 LYS 33 HD1 LYS 33 -12.503 1.183 4.721 275 HE2 LYS 33 HE2 LYS 33 -12.349 2.360 7.493 276 HE3 LYS 33 HE1 LYS 33 -12.933 0.749 7.083 277 HZ1 LYS 33 HZ1 LYS 33 -10.714 0.214 6.239 278 HZ2 LYS 33 HZ2 LYS 33 -10.673 0.657 7.871 279 HZ3 LYS 33 HZ3 LYS 33 -10.166 1.754 6.691 280 H ILE 34 HN ILE 34 -10.921 4.000 0.766 281 HA ILE 34 HA ILE 34 -13.068 5.136 -0.679 282 HB ILE 34 HB ILE 34 -10.177 4.732 -1.468 283 HG12 ILE 34 HG12 ILE 34 -11.558 7.295 -0.733 284 HG13 ILE 34 HG11 ILE 34 -10.868 6.241 0.500 285 HG21 ILE 34 HG21 ILE 34 -10.586 6.393 -3.222 286 HG22 ILE 34 HG22 ILE 34 -12.305 6.374 -2.828 287 HG23 ILE 34 HG23 ILE 34 -11.530 4.926 -3.471 288 HD11 ILE 34 HD11 ILE 34 -9.341 8.043 -0.112 289 HD12 ILE 34 HD12 ILE 34 -9.344 7.476 -1.782 290 HD13 ILE 34 HD13 ILE 34 -8.670 6.459 -0.507 291 H ARG 35 HN ARG 35 -11.224 2.179 -1.065 292 HA ARG 35 HA ARG 35 -12.083 1.492 -3.651 293 HB2 ARG 35 HB2 ARG 35 -11.211 -0.242 -1.343 294 HB3 ARG 35 HB1 ARG 35 -11.431 -0.823 -2.997 295 HG2 ARG 35 HG2 ARG 35 -9.765 0.807 -3.783 296 HG3 ARG 35 HG1 ARG 35 -9.501 1.314 -2.118 297 HD2 ARG 35 HD2 ARG 35 -8.742 -0.966 -1.576 298 HD3 ARG 35 HD1 ARG 35 -8.954 -1.418 -3.271 299 HE ARG 35 HE ARG 35 -7.255 0.879 -2.780 300 HH11 ARG 35 HH11 ARG 35 -7.382 -2.574 -3.343 301 HH12 ARG 35 HH12 ARG 35 -5.737 -2.668 -3.880 302 HH21 ARG 35 HH21 ARG 35 -5.120 0.771 -3.502 303 HH22 ARG 35 HH22 ARG 35 -4.439 -0.763 -3.963 304 H VAL 36 HN VAL 36 -13.519 1.048 -0.511 305 HA VAL 36 HA VAL 36 -15.667 -0.624 -1.298 306 HB VAL 36 HB VAL 36 -15.608 1.406 0.936 307 HG11 VAL 36 HG11 VAL 36 -17.236 -0.086 2.012 308 HG12 VAL 36 HG12 VAL 36 -17.236 -1.108 0.575 309 HG13 VAL 36 HG13 VAL 36 -17.842 0.548 0.478 310 HG21 VAL 36 HG21 VAL 36 -13.661 -0.194 0.847 311 HG22 VAL 36 HG22 VAL 36 -14.835 -1.495 1.096 312 HG23 VAL 36 HG23 VAL 36 -14.634 -0.247 2.326 313 H LEU 37 HN LEU 37 -15.280 2.865 -0.979 314 HA LEU 37 HA LEU 37 -17.768 3.673 -1.986 315 HB2 LEU 37 HB2 LEU 37 -15.067 4.887 -1.759 316 HB3 LEU 37 HB1 LEU 37 -16.186 5.649 -2.869 317 HG LEU 37 HG LEU 37 -16.058 6.577 -0.492 318 HD11 LEU 37 HD11 LEU 37 -18.736 5.734 -1.588 319 HD12 LEU 37 HD12 LEU 37 -17.822 7.167 -2.066 320 HD13 LEU 37 HD13 LEU 37 -18.454 7.029 -0.425 321 HD21 LEU 37 HD21 LEU 37 -17.708 4.118 0.075 322 HD22 LEU 37 HD22 LEU 37 -17.407 5.454 1.188 323 HD23 LEU 37 HD23 LEU 37 -16.075 4.419 0.669 324 H ARG 38 HN ARG 38 -14.768 2.772 -3.577 325 HA ARG 38 HA ARG 38 -15.528 3.414 -6.210 326 HB2 ARG 38 HB2 ARG 38 -13.581 1.332 -5.229 327 HB3 ARG 38 HB1 ARG 38 -13.779 1.786 -6.914 328 HG2 ARG 38 HG2 ARG 38 -13.239 4.155 -6.165 329 HG3 ARG 38 HG1 ARG 38 -12.694 3.422 -4.655 330 HD2 ARG 38 HD2 ARG 38 -10.791 3.652 -6.080 331 HD3 ARG 38 HD1 ARG 38 -11.210 1.940 -5.999 332 HE ARG 38 HE ARG 38 -12.524 2.700 -8.200 333 HH11 ARG 38 HH11 ARG 38 -9.216 3.275 -7.194 334 HH12 ARG 38 HH12 ARG 38 -8.616 3.411 -8.814 335 HH21 ARG 38 HH21 ARG 38 -11.750 2.859 -10.312 336 HH22 ARG 38 HH22 ARG 38 -10.060 3.154 -10.600 337 H GLN 39 HN GLN 39 -15.910 0.432 -4.321 338 HA GLN 39 HA GLN 39 -17.023 -1.180 -6.303 339 HB2 GLN 39 HB2 GLN 39 -17.846 -1.074 -3.397 340 HB3 GLN 39 HB1 GLN 39 -18.067 -2.429 -4.496 341 HG2 GLN 39 HG2 GLN 39 -15.422 -1.310 -3.616 342 HG3 GLN 39 HG1 GLN 39 -16.184 -2.753 -2.981 343 HE21 GLN 39 HE21 GLN 39 -14.505 -1.349 -5.644 344 HE22 GLN 39 HE22 GLN 39 -14.216 -2.823 -6.493 345 H ARG 40 HN ARG 40 -18.514 1.238 -4.240 346 HA ARG 40 HA ARG 40 -21.153 0.972 -5.163 347 HB2 ARG 40 HB2 ARG 40 -19.618 3.303 -4.020 348 HB3 ARG 40 HB1 ARG 40 -21.339 3.345 -4.341 349 HG2 ARG 40 HG2 ARG 40 -21.749 1.614 -2.740 350 HG3 ARG 40 HG1 ARG 40 -20.019 1.339 -2.535 351 HD2 ARG 40 HD2 ARG 40 -20.910 2.613 -0.671 352 HD3 ARG 40 HD1 ARG 40 -19.775 3.583 -1.603 353 HE ARG 40 HE ARG 40 -21.742 4.671 -2.624 354 HH11 ARG 40 HH11 ARG 40 -22.168 2.982 0.420 355 HH12 ARG 40 HH12 ARG 40 -23.509 3.965 0.915 356 HH21 ARG 40 HH21 ARG 40 -23.494 5.966 -1.963 357 HH22 ARG 40 HH22 ARG 40 -24.249 5.677 -0.426 358 H LEU 41 HN LEU 41 -18.482 3.064 -6.215 359 HA LEU 41 HA LEU 41 -19.927 4.171 -8.401 360 HB2 LEU 41 HB2 LEU 41 -16.973 3.980 -8.593 361 HB3 LEU 41 HB1 LEU 41 -18.056 5.305 -8.986 362 HG LEU 41 HG LEU 41 -17.303 4.509 -6.171 363 HD11 LEU 41 HD11 LEU 41 -15.357 5.286 -7.407 364 HD12 LEU 41 HD12 LEU 41 -15.853 6.463 -6.193 365 HD13 LEU 41 HD13 LEU 41 -16.235 6.735 -7.894 366 HD21 LEU 41 HD21 LEU 41 -18.174 6.757 -5.617 367 HD22 LEU 41 HD22 LEU 41 -19.412 5.662 -6.236 368 HD23 LEU 41 HD23 LEU 41 -18.742 6.913 -7.283 369 H VAL 42 HN VAL 42 -18.348 1.144 -7.953 370 HA VAL 42 HA VAL 42 -17.882 0.434 -10.633 371 HB VAL 42 HB VAL 42 -18.617 -1.178 -8.193 372 HG11 VAL 42 HG11 VAL 42 -18.158 -3.219 -9.481 373 HG12 VAL 42 HG12 VAL 42 -18.081 -2.251 -10.956 374 HG13 VAL 42 HG13 VAL 42 -19.593 -2.360 -10.049 375 HG21 VAL 42 HG21 VAL 42 -16.305 -2.059 -8.543 376 HG22 VAL 42 HG22 VAL 42 -16.388 -0.336 -8.174 377 HG23 VAL 42 HG23 VAL 42 -16.111 -0.867 -9.829 378 H GLU 43 HN GLU 43 -20.722 0.667 -8.706 379 HA GLU 43 HA GLU 43 -22.501 -0.582 -10.551 380 HB2 GLU 43 HB2 GLU 43 -23.075 1.337 -8.288 381 HB3 GLU 43 HB1 GLU 43 -24.272 0.371 -9.138 382 HG2 GLU 43 HG2 GLU 43 -23.290 -1.662 -8.321 383 HG3 GLU 43 HG1 GLU 43 -21.968 -0.765 -7.578 384 H ARG 44 HN ARG 44 -21.235 2.644 -10.099 385 HA ARG 44 HA ARG 44 -23.014 3.826 -12.037 386 HB2 ARG 44 HB2 ARG 44 -22.018 5.843 -11.579 387 HB3 ARG 44 HB1 ARG 44 -21.724 5.001 -10.067 388 HG2 ARG 44 HG2 ARG 44 -19.502 4.604 -10.593 389 HG3 ARG 44 HG1 ARG 44 -19.771 5.015 -12.289 390 HD2 ARG 44 HD2 ARG 44 -18.573 6.787 -10.989 391 HD3 ARG 44 HD1 ARG 44 -20.059 7.334 -11.762 392 HE ARG 44 HE ARG 44 -20.818 6.592 -9.234 393 HH11 ARG 44 HH11 ARG 44 -18.474 8.835 -10.552 394 HH12 ARG 44 HH12 ARG 44 -18.598 9.943 -9.226 395 HH21 ARG 44 HH21 ARG 44 -20.996 8.055 -7.498 396 HH22 ARG 44 HH22 ARG 44 -20.035 9.500 -7.485 397 H GLY 45 HN GLY 45 -19.842 2.436 -11.947 398 HA2 GLY 45 HA2 GLY 45 -19.443 1.104 -14.050 399 HA3 GLY 45 HA1 GLY 45 -19.700 2.628 -14.885 400 H ASP 46 HN ASP 46 -17.944 2.283 -11.857 401 HA ASP 46 HA ASP 46 -15.654 3.615 -12.944 402 HB2 ASP 46 HB2 ASP 46 -16.311 3.980 -10.623 403 HB3 ASP 46 HB1 ASP 46 -16.074 2.274 -10.263 404 H ALA 47 HN ALA 47 -16.589 0.319 -12.517 405 HA ALA 47 HA ALA 47 -13.891 -0.719 -12.611 406 HB1 ALA 47 HB1 ALA 47 -16.556 -2.119 -12.696 407 HB2 ALA 47 HB2 ALA 47 -15.515 -1.913 -11.289 408 HB3 ALA 47 HB3 ALA 47 -14.993 -2.930 -12.630 409 H LYS 48 HN LYS 48 -15.403 0.792 -14.893 410 HA LYS 48 HA LYS 48 -15.249 -1.144 -17.028 411 HB2 LYS 48 HB2 LYS 48 -15.894 1.794 -16.965 412 HB3 LYS 48 HB1 LYS 48 -15.721 0.904 -18.472 413 HG2 LYS 48 HG2 LYS 48 -17.696 0.286 -16.284 414 HG3 LYS 48 HG1 LYS 48 -18.056 1.103 -17.807 415 HD2 LYS 48 HD2 LYS 48 -17.342 -0.893 -19.038 416 HD3 LYS 48 HD1 LYS 48 -16.998 -1.707 -17.513 417 HE2 LYS 48 HE2 LYS 48 -19.144 -2.404 -18.386 418 HE3 LYS 48 HE1 LYS 48 -19.345 -1.513 -16.880 419 HZ1 LYS 48 HZ1 LYS 48 -20.954 -0.894 -18.619 420 HZ2 LYS 48 HZ2 LYS 48 -19.683 -0.329 -19.581 421 HZ3 LYS 48 HZ3 LYS 48 -20.018 0.414 -18.101 422 H GLY 49 HN GLY 49 -13.431 1.711 -15.975 423 HA2 GLY 49 HA2 GLY 49 -11.157 2.106 -16.251 424 HA3 GLY 49 HA1 GLY 49 -11.044 0.630 -17.199 425 H THR 50 HN THR 50 -12.045 0.730 -19.398 426 HA THR 50 HA THR 50 -12.399 3.339 -20.547 427 HB THR 50 HB THR 50 -10.024 3.342 -20.679 428 HG1 THR 50 HG1 THR 50 -9.765 3.520 -22.894 429 HG21 THR 50 HG21 THR 50 -8.723 1.557 -21.755 430 HG22 THR 50 HG22 THR 50 -10.194 0.602 -21.940 431 HG23 THR 50 HG23 THR 50 -9.579 0.971 -20.330 432 H GLU 51 HN GLU 51 -14.409 2.589 -21.024 433 HA GLU 51 HA GLU 51 -16.083 1.460 -22.091 434 HB2 GLU 51 HB2 GLU 51 -14.203 2.078 -24.356 435 HB3 GLU 51 HB1 GLU 51 -15.914 1.723 -24.532 436 HG2 GLU 51 HG2 GLU 51 -16.486 3.704 -23.298 437 HG3 GLU 51 HG1 GLU 51 -14.783 4.026 -22.979 438 H LEU 52 HN LEU 52 -15.991 -0.650 -21.293 439 HA LEU 52 HA LEU 52 -15.536 -2.602 -23.331 440 HB2 LEU 52 HB2 LEU 52 -14.112 -4.042 -21.783 441 HB3 LEU 52 HB1 LEU 52 -13.327 -2.711 -22.609 442 HG LEU 52 HG LEU 52 -14.136 -1.629 -20.175 443 HD11 LEU 52 HD11 LEU 52 -13.225 -3.130 -18.502 444 HD12 LEU 52 HD12 LEU 52 -12.922 -4.351 -19.736 445 HD13 LEU 52 HD13 LEU 52 -14.578 -3.891 -19.339 446 HD21 LEU 52 HD21 LEU 52 -11.465 -2.713 -21.055 447 HD22 LEU 52 HD22 LEU 52 -11.725 -1.580 -19.729 448 HD23 LEU 52 HD23 LEU 52 -12.108 -1.102 -21.382 449 H ASN 53 HN ASN 53 -17.396 -3.518 -23.294 450 HA ASN 53 HA ASN 53 -19.111 -3.729 -21.063 451 HB2 ASN 53 HB2 ASN 53 -19.884 -3.729 -23.421 452 HB3 ASN 53 HB1 ASN 53 -19.156 -5.315 -23.643 453 HD21 ASN 53 HD21 ASN 53 -21.095 -6.277 -24.161 454 HD22 ASN 53 HD22 ASN 53 -22.328 -6.580 -22.987 455 H GLY 84 HN GLY 84 0.956 -8.427 -7.756 456 HA2 GLY 84 HA2 GLY 84 2.453 -10.762 -8.271 457 HA3 GLY 84 HA1 GLY 84 2.834 -9.150 -8.866 458 HA PRO 85 HA PRO 85 5.506 -10.508 -5.127 459 HB2 PRO 85 HB2 PRO 85 7.379 -12.165 -6.077 460 HB3 PRO 85 HB1 PRO 85 5.785 -12.758 -5.590 461 HG2 PRO 85 HG2 PRO 85 6.821 -12.142 -8.330 462 HG3 PRO 85 HG1 PRO 85 5.875 -13.542 -7.784 463 HD2 PRO 85 HD2 PRO 85 4.768 -11.382 -9.051 464 HD3 PRO 85 HD1 PRO 85 3.882 -12.398 -7.896 465 H LEU 86 HN LEU 86 8.090 -10.492 -5.084 466 HA LEU 86 HA LEU 86 8.910 -7.957 -5.627 467 HB2 LEU 86 HB2 LEU 86 11.170 -8.667 -5.205 468 HB3 LEU 86 HB1 LEU 86 10.070 -9.428 -4.090 469 HG LEU 86 HG LEU 86 11.547 -11.125 -4.513 470 HD11 LEU 86 HD11 LEU 86 9.477 -11.558 -6.651 471 HD12 LEU 86 HD12 LEU 86 9.394 -12.060 -4.961 472 HD13 LEU 86 HD13 LEU 86 10.584 -12.788 -6.038 473 HD21 LEU 86 HD21 LEU 86 12.549 -11.642 -6.696 474 HD22 LEU 86 HD22 LEU 86 12.931 -10.025 -6.111 475 HD23 LEU 86 HD23 LEU 86 11.723 -10.241 -7.377 476 H GLY 87 HN GLY 87 9.096 -6.858 -7.401 477 HA2 GLY 87 HA2 GLY 87 10.063 -8.229 -9.831 478 HA3 GLY 87 HA1 GLY 87 8.996 -6.832 -9.839 479 H SER 88 HN SER 88 10.420 -5.415 -7.784 480 HA SER 88 HA SER 88 12.359 -4.224 -9.598 481 HB2 SER 88 HB2 SER 88 10.500 -2.869 -8.629 482 HB3 SER 88 HB1 SER 88 11.195 -3.123 -7.030 483 HG SER 88 HG SER 88 13.136 -2.229 -8.581 484 H ARG 89 HN ARG 89 12.834 -6.625 -7.714 485 HA ARG 89 HA ARG 89 15.023 -5.527 -6.116 486 HB2 ARG 89 HB2 ARG 89 13.799 -8.279 -6.239 487 HB3 ARG 89 HB1 ARG 89 15.240 -7.914 -5.303 488 HG2 ARG 89 HG2 ARG 89 13.939 -6.238 -4.035 489 HG3 ARG 89 HG1 ARG 89 12.496 -6.742 -4.914 490 HD2 ARG 89 HD2 ARG 89 12.705 -7.796 -2.683 491 HD3 ARG 89 HD1 ARG 89 12.649 -8.960 -4.003 492 HE ARG 89 HE ARG 89 15.306 -8.211 -3.151 493 HH11 ARG 89 HH11 ARG 89 12.630 -10.426 -2.682 494 HH12 ARG 89 HH12 ARG 89 13.637 -11.708 -2.089 495 HH21 ARG 89 HH21 ARG 89 16.617 -9.894 -2.344 496 HH22 ARG 89 HH22 ARG 89 15.896 -11.406 -1.889 497 H ARG 90 HN ARG 90 14.780 -8.512 -8.034 498 HA ARG 90 HA ARG 90 16.183 -9.533 -9.485 499 HB2 ARG 90 HB2 ARG 90 15.648 -7.479 -10.796 500 HB3 ARG 90 HB1 ARG 90 17.105 -6.736 -10.155 501 HG2 ARG 90 HG2 ARG 90 18.476 -8.401 -11.241 502 HG3 ARG 90 HG1 ARG 90 17.036 -9.248 -11.811 503 HD2 ARG 90 HD2 ARG 90 17.873 -6.449 -12.556 504 HD3 ARG 90 HD1 ARG 90 17.996 -7.879 -13.579 505 HE ARG 90 HE ARG 90 15.326 -7.563 -12.748 506 HH11 ARG 90 HH11 ARG 90 17.689 -6.085 -14.867 507 HH12 ARG 90 HH12 ARG 90 16.492 -5.407 -15.925 508 HH21 ARG 90 HH21 ARG 90 13.762 -6.697 -14.139 509 HH22 ARG 90 HH22 ARG 90 14.252 -5.773 -15.524 510 H PHE 91 HN PHE 91 17.248 -10.362 -7.580 511 HA PHE 91 HA PHE 91 19.080 -11.045 -6.448 512 HB2 PHE 91 HB2 PHE 91 20.615 -9.562 -8.588 513 HB3 PHE 91 HB1 PHE 91 21.294 -10.725 -7.461 514 HD1 PHE 91 HD1 PHE 91 20.895 -13.095 -7.721 515 HD2 PHE 91 HD2 PHE 91 19.239 -10.281 -10.448 516 HE1 PHE 91 HE1 PHE 91 20.396 -14.915 -9.296 517 HE2 PHE 91 HE2 PHE 91 18.737 -12.100 -12.024 518 HZ PHE 91 HZ PHE 91 19.318 -14.419 -11.448 519 H VAL 92 HN VAL 92 21.540 -9.795 -5.863 520 HA VAL 92 HA VAL 92 20.533 -7.697 -4.113 521 HB VAL 92 HB VAL 92 22.540 -7.872 -2.854 522 HG11 VAL 92 HG11 VAL 92 20.954 -9.650 -2.459 523 HG12 VAL 92 HG12 VAL 92 22.599 -10.258 -2.278 524 HG13 VAL 92 HG13 VAL 92 21.681 -10.619 -3.739 525 HG21 VAL 92 HG21 VAL 92 24.166 -7.935 -4.642 526 HG22 VAL 92 HG22 VAL 92 23.655 -9.564 -5.086 527 HG23 VAL 92 HG23 VAL 92 24.440 -9.280 -3.533 528 H VAL 93 HN VAL 93 22.408 -8.042 -6.982 529 HA VAL 93 HA VAL 93 24.008 -5.754 -6.869 530 HB VAL 93 HB VAL 93 22.799 -6.969 -9.344 531 HG11 VAL 93 HG11 VAL 93 24.759 -6.031 -10.482 532 HG12 VAL 93 HG12 VAL 93 25.263 -5.276 -8.971 533 HG13 VAL 93 HG13 VAL 93 23.762 -4.776 -9.749 534 HG21 VAL 93 HG21 VAL 93 23.950 -8.668 -8.051 535 HG22 VAL 93 HG22 VAL 93 25.374 -7.636 -7.930 536 HG23 VAL 93 HG23 VAL 93 24.876 -8.273 -9.498 537 H ASP 94 HN ASP 94 20.933 -6.144 -8.664 538 HA ASP 94 HA ASP 94 20.694 -3.339 -9.054 539 HB2 ASP 94 HB2 ASP 94 18.562 -5.465 -9.295 540 HB3 ASP 94 HB1 ASP 94 18.395 -3.804 -9.812 541 H ASP 95 HN ASP 95 19.133 -5.637 -6.807 542 HA ASP 95 HA ASP 95 17.389 -3.774 -5.642 543 HB2 ASP 95 HB2 ASP 95 17.328 -6.302 -5.408 544 HB3 ASP 95 HB1 ASP 95 18.584 -6.125 -4.190 545 H ARG 96 HN ARG 96 20.766 -3.862 -5.403 546 HA ARG 96 HA ARG 96 20.883 -2.672 -2.788 547 HB2 ARG 96 HB2 ARG 96 22.857 -3.855 -3.689 548 HB3 ARG 96 HB1 ARG 96 22.971 -2.665 -4.983 549 HG2 ARG 96 HG2 ARG 96 24.587 -2.166 -3.258 550 HG3 ARG 96 HG1 ARG 96 23.357 -0.902 -3.316 551 HD2 ARG 96 HD2 ARG 96 22.211 -2.392 -1.472 552 HD3 ARG 96 HD1 ARG 96 23.852 -2.985 -1.238 553 HE ARG 96 HE ARG 96 23.792 -0.149 -1.269 554 HH11 ARG 96 HH11 ARG 96 23.113 -2.923 0.750 555 HH12 ARG 96 HH12 ARG 96 23.244 -2.038 2.233 556 HH21 ARG 96 HH21 ARG 96 23.940 1.045 0.698 557 HH22 ARG 96 HH22 ARG 96 23.728 0.201 2.206 558 H ARG 97 HN ARG 97 21.330 -1.473 -6.101 559 HA ARG 97 HA ARG 97 21.081 1.278 -5.189 560 HB2 ARG 97 HB2 ARG 97 22.713 1.028 -6.841 561 HB3 ARG 97 HB1 ARG 97 21.708 -0.038 -7.809 562 HG2 ARG 97 HG2 ARG 97 20.494 2.564 -7.538 563 HG3 ARG 97 HG1 ARG 97 22.131 2.678 -8.194 564 HD2 ARG 97 HD2 ARG 97 19.904 0.926 -9.242 565 HD3 ARG 97 HD1 ARG 97 20.500 2.414 -9.986 566 HE ARG 97 HE ARG 97 22.736 0.970 -9.877 567 HH11 ARG 97 HH11 ARG 97 19.525 0.148 -11.004 568 HH12 ARG 97 HH12 ARG 97 20.093 -1.072 -12.104 569 HH21 ARG 97 HH21 ARG 97 23.482 -0.623 -11.311 570 HH22 ARG 97 HH22 ARG 97 22.349 -1.517 -12.271 571 H GLU 98 HN GLU 98 19.320 -0.921 -7.319 572 HA GLU 98 HA GLU 98 17.311 0.810 -8.157 573 HB2 GLU 98 HB2 GLU 98 17.490 -2.183 -7.917 574 HB3 GLU 98 HB1 GLU 98 16.017 -1.390 -8.497 575 HG2 GLU 98 HG2 GLU 98 18.748 -1.053 -9.693 576 HG3 GLU 98 HG1 GLU 98 17.506 -2.143 -10.308 577 H LEU 99 HN LEU 99 17.466 -1.302 -5.308 578 HA LEU 99 HA LEU 99 14.766 -0.841 -4.555 579 HB2 LEU 99 HB2 LEU 99 15.719 -2.825 -3.811 580 HB3 LEU 99 HB1 LEU 99 17.163 -2.037 -3.240 581 HG LEU 99 HG LEU 99 15.482 -3.060 -1.563 582 HD11 LEU 99 HD11 LEU 99 17.470 -1.849 -0.951 583 HD12 LEU 99 HD12 LEU 99 16.127 -1.414 0.109 584 HD13 LEU 99 HD13 LEU 99 16.630 -0.313 -1.173 585 HD21 LEU 99 HD21 LEU 99 13.468 -1.964 -2.353 586 HD22 LEU 99 HD22 LEU 99 14.181 -0.385 -2.030 587 HD23 LEU 99 HD23 LEU 99 13.829 -1.483 -0.696 588 H GLN 100 HN GLN 100 17.851 0.519 -3.264 589 HA GLN 100 HA GLN 100 16.578 2.232 -1.435 590 HB2 GLN 100 HB2 GLN 100 18.651 3.540 -1.409 591 HB3 GLN 100 HB1 GLN 100 18.975 1.816 -1.301 592 HG2 GLN 100 HG2 GLN 100 19.740 1.729 -3.532 593 HG3 GLN 100 HG1 GLN 100 19.119 3.341 -3.883 594 HE21 GLN 100 HE21 GLN 100 20.752 2.595 -0.906 595 HE22 GLN 100 HE22 GLN 100 22.186 3.519 -1.227 596 H TYR 101 HN TYR 101 17.260 2.571 -4.847 597 HA TYR 101 HA TYR 101 16.554 5.314 -5.061 598 HB2 TYR 101 HB2 TYR 101 17.932 4.158 -6.745 599 HB3 TYR 101 HB1 TYR 101 16.559 3.143 -7.174 600 HD1 TYR 101 HD1 TYR 101 14.912 3.904 -8.701 601 HD2 TYR 101 HD2 TYR 101 17.831 6.616 -7.210 602 HE1 TYR 101 HE1 TYR 101 14.200 5.574 -10.359 603 HE2 TYR 101 HE2 TYR 101 17.125 8.293 -8.862 604 HH TYR 101 HH TYR 101 15.996 8.269 -11.135 605 H ARG 102 HN ARG 102 14.720 2.306 -5.186 606 HA ARG 102 HA ARG 102 12.391 3.630 -6.232 607 HB2 ARG 102 HB2 ARG 102 11.357 1.569 -6.363 608 HB3 ARG 102 HB1 ARG 102 13.048 1.145 -6.558 609 HG2 ARG 102 HG2 ARG 102 13.129 0.480 -4.189 610 HG3 ARG 102 HG1 ARG 102 11.409 0.855 -4.047 611 HD2 ARG 102 HD2 ARG 102 10.978 -0.782 -5.882 612 HD3 ARG 102 HD1 ARG 102 12.679 -1.232 -5.816 613 HE ARG 102 HE ARG 102 10.768 -1.610 -3.596 614 HH11 ARG 102 HH11 ARG 102 13.582 -2.624 -5.430 615 HH12 ARG 102 HH12 ARG 102 13.875 -4.030 -4.457 616 HH21 ARG 102 HH21 ARG 102 11.114 -3.500 -2.347 617 HH22 ARG 102 HH22 ARG 102 12.458 -4.533 -2.713 618 H VAL 103 HN VAL 103 13.674 2.974 -3.077 619 HA VAL 103 HA VAL 103 11.237 3.159 -1.633 620 HB VAL 103 HB VAL 103 13.964 3.942 -0.613 621 HG11 VAL 103 HG11 VAL 103 11.535 2.921 0.826 622 HG12 VAL 103 HG12 VAL 103 12.139 4.577 0.861 623 HG13 VAL 103 HG13 VAL 103 13.103 3.269 1.556 624 HG21 VAL 103 HG21 VAL 103 14.051 1.599 0.237 625 HG22 VAL 103 HG22 VAL 103 14.220 1.769 -1.509 626 HG23 VAL 103 HG23 VAL 103 12.686 1.240 -0.817 627 H GLU 104 HN GLU 104 13.670 5.633 -2.515 628 HA GLU 104 HA GLU 104 12.297 7.749 -1.280 629 HB2 GLU 104 HB2 GLU 104 13.586 9.200 -2.990 630 HB3 GLU 104 HB1 GLU 104 14.468 8.341 -1.738 631 HG2 GLU 104 HG2 GLU 104 15.210 6.716 -3.235 632 HG3 GLU 104 HG1 GLU 104 14.073 7.218 -4.483 633 H VAL 105 HN VAL 105 12.121 6.567 -4.657 634 HA VAL 105 HA VAL 105 10.238 8.522 -5.423 635 HB VAL 105 HB VAL 105 10.999 7.509 -7.320 636 HG11 VAL 105 HG11 VAL 105 11.309 5.112 -7.656 637 HG12 VAL 105 HG12 VAL 105 10.702 4.814 -6.027 638 HG13 VAL 105 HG13 VAL 105 12.209 5.700 -6.259 639 HG21 VAL 105 HG21 VAL 105 8.516 5.928 -6.746 640 HG22 VAL 105 HG22 VAL 105 9.264 6.112 -8.332 641 HG23 VAL 105 HG23 VAL 105 8.602 7.519 -7.500 642 H GLN 106 HN GLN 106 9.832 5.325 -3.927 643 HA GLN 106 HA GLN 106 7.021 5.337 -3.916 644 HB2 GLN 106 HB2 GLN 106 8.983 4.104 -1.974 645 HB3 GLN 106 HB1 GLN 106 7.256 3.818 -1.910 646 HG2 GLN 106 HG2 GLN 106 9.111 3.103 -4.160 647 HG3 GLN 106 HG1 GLN 106 8.360 1.992 -3.018 648 HE21 GLN 106 HE21 GLN 106 7.850 4.054 -5.766 649 HE22 GLN 106 HE22 GLN 106 6.315 3.405 -6.219 650 H ASN 107 HN ASN 107 9.346 6.536 -1.515 651 HA ASN 107 HA ASN 107 7.696 7.613 0.415 652 HB2 ASN 107 HB2 ASN 107 10.151 7.582 0.527 653 HB3 ASN 107 HB1 ASN 107 10.227 8.823 -0.719 654 HD21 ASN 107 HD21 ASN 107 11.335 10.221 0.622 655 HD22 ASN 107 HD22 ASN 107 10.584 11.034 1.953 656 H ARG 108 HN ARG 108 8.600 9.015 -2.708 657 HA ARG 108 HA ARG 108 7.217 11.491 -2.239 658 HB2 ARG 108 HB2 ARG 108 8.434 10.306 -4.736 659 HB3 ARG 108 HB1 ARG 108 7.823 11.943 -4.598 660 HG2 ARG 108 HG2 ARG 108 9.494 12.464 -2.925 661 HG3 ARG 108 HG1 ARG 108 10.075 10.798 -2.965 662 HD2 ARG 108 HD2 ARG 108 11.519 12.250 -4.277 663 HD3 ARG 108 HD1 ARG 108 10.705 11.078 -5.310 664 HE ARG 108 HE ARG 108 9.096 13.280 -5.380 665 HH11 ARG 108 HH11 ARG 108 12.472 12.684 -6.073 666 HH12 ARG 108 HH12 ARG 108 12.579 13.931 -7.272 667 HH21 ARG 108 HH21 ARG 108 9.228 14.927 -6.952 668 HH22 ARG 108 HH22 ARG 108 10.732 15.211 -7.771 669 H VAL 109 HN VAL 109 6.739 8.749 -4.430 670 HA VAL 109 HA VAL 109 4.370 9.507 -5.646 671 HB VAL 109 HB VAL 109 5.367 6.742 -4.950 672 HG11 VAL 109 HG11 VAL 109 2.888 6.853 -5.418 673 HG12 VAL 109 HG12 VAL 109 3.825 5.812 -6.487 674 HG13 VAL 109 HG13 VAL 109 3.310 7.402 -7.041 675 HG21 VAL 109 HG21 VAL 109 6.002 6.749 -7.362 676 HG22 VAL 109 HG22 VAL 109 6.893 7.892 -6.357 677 HG23 VAL 109 HG23 VAL 109 5.584 8.464 -7.400 678 H TYR 110 HN TYR 110 4.840 7.598 -2.699 679 HA TYR 110 HA TYR 110 2.116 7.141 -2.191 680 HB2 TYR 110 HB2 TYR 110 4.538 7.147 -0.402 681 HB3 TYR 110 HB1 TYR 110 2.932 6.770 0.198 682 HD1 TYR 110 HD1 TYR 110 2.423 5.386 -2.748 683 HD2 TYR 110 HD2 TYR 110 5.130 4.879 0.496 684 HE1 TYR 110 HE1 TYR 110 2.706 3.026 -3.360 685 HE2 TYR 110 HE2 TYR 110 5.423 2.518 -0.114 686 HH TYR 110 HH TYR 110 4.253 0.769 -1.300 687 H LYS 111 HN LYS 111 4.173 9.873 -1.509 688 HA LYS 111 HA LYS 111 2.487 11.154 0.373 689 HB2 LYS 111 HB2 LYS 111 4.820 11.799 0.120 690 HB3 LYS 111 HB1 LYS 111 4.534 12.296 -1.540 691 HG2 LYS 111 HG2 LYS 111 4.693 14.219 -0.074 692 HG3 LYS 111 HG1 LYS 111 3.072 14.089 -0.753 693 HD2 LYS 111 HD2 LYS 111 2.241 13.146 1.311 694 HD3 LYS 111 HD1 LYS 111 3.869 13.123 1.992 695 HE2 LYS 111 HE2 LYS 111 2.575 15.019 2.836 696 HE3 LYS 111 HE1 LYS 111 3.958 15.556 1.886 697 HZ1 LYS 111 HZ1 LYS 111 2.485 15.938 0.011 698 HZ2 LYS 111 HZ2 LYS 111 1.965 16.816 1.360 699 HZ3 LYS 111 HZ3 LYS 111 1.156 15.400 0.912 700 H LYS 112 HN LYS 112 2.696 11.219 -3.141 701 HA LYS 112 HA LYS 112 0.791 13.292 -3.507 702 HB2 LYS 112 HB2 LYS 112 1.331 13.092 -5.689 703 HB3 LYS 112 HB1 LYS 112 2.635 12.093 -5.061 704 HG2 LYS 112 HG2 LYS 112 1.073 10.151 -5.310 705 HG3 LYS 112 HG1 LYS 112 0.078 11.231 -6.279 706 HD2 LYS 112 HD2 LYS 112 1.768 11.506 -7.901 707 HD3 LYS 112 HD1 LYS 112 3.003 10.833 -6.824 708 HE2 LYS 112 HE2 LYS 112 2.373 9.241 -8.558 709 HE3 LYS 112 HE1 LYS 112 1.961 8.673 -6.942 710 HZ1 LYS 112 HZ1 LYS 112 0.235 8.335 -8.718 711 HZ2 LYS 112 HZ2 LYS 112 -0.016 10.009 -8.686 712 HZ3 LYS 112 HZ3 LYS 112 -0.299 9.079 -7.295 713 H GLU 113 HN GLU 113 0.666 9.810 -3.283 714 HA GLU 113 HA GLU 113 -1.947 9.343 -4.120 715 HB2 GLU 113 HB2 GLU 113 -0.426 7.940 -1.919 716 HB3 GLU 113 HB1 GLU 113 -1.851 7.315 -2.742 717 HG2 GLU 113 HG2 GLU 113 0.720 7.994 -4.115 718 HG3 GLU 113 HG1 GLU 113 0.308 6.388 -3.539 719 H ILE 114 HN ILE 114 -0.741 10.129 -0.868 720 HA ILE 114 HA ILE 114 -3.209 9.965 0.439 721 HB ILE 114 HB ILE 114 -0.814 11.661 1.134 722 HG12 ILE 114 HG12 ILE 114 -1.636 8.896 2.042 723 HG13 ILE 114 HG11 ILE 114 -0.373 9.239 0.867 724 HG21 ILE 114 HG21 ILE 114 -3.093 10.729 2.880 725 HG22 ILE 114 HG22 ILE 114 -2.857 12.379 2.299 726 HG23 ILE 114 HG23 ILE 114 -1.687 11.655 3.408 727 HD11 ILE 114 HD11 ILE 114 0.488 8.732 3.103 728 HD12 ILE 114 HD12 ILE 114 -0.342 10.160 3.724 729 HD13 ILE 114 HD13 ILE 114 0.948 10.335 2.532 730 H GLN 115 HN GLN 115 -1.808 12.530 -1.474 731 HA GLN 115 HA GLN 115 -3.630 14.551 -0.581 732 HB2 GLN 115 HB2 GLN 115 -2.028 14.530 -3.135 733 HB3 GLN 115 HB1 GLN 115 -2.650 15.927 -2.268 734 HG2 GLN 115 HG2 GLN 115 -1.184 15.272 -0.350 735 HG3 GLN 115 HG1 GLN 115 -0.464 14.064 -1.410 736 HE21 GLN 115 HE21 GLN 115 -1.508 17.249 -2.420 737 HE22 GLN 115 HE22 GLN 115 0.071 17.860 -2.753 738 H ALA 116 HN ALA 116 -3.396 12.418 -3.389 739 HA ALA 116 HA ALA 116 -5.808 13.210 -4.638 740 HB1 ALA 116 HB1 ALA 116 -5.691 11.052 -5.789 741 HB2 ALA 116 HB2 ALA 116 -4.451 10.514 -4.655 742 HB3 ALA 116 HB3 ALA 116 -4.114 11.843 -5.766 743 H LEU 117 HN LEU 117 -5.019 10.689 -2.324 744 HA LEU 117 HA LEU 117 -7.500 9.536 -1.888 745 HB2 LEU 117 HB2 LEU 117 -4.982 9.845 -0.366 746 HB3 LEU 117 HB1 LEU 117 -6.395 9.440 0.581 747 HG LEU 117 HG LEU 117 -6.555 7.318 -0.311 748 HD11 LEU 117 HD11 LEU 117 -5.566 6.606 -2.438 749 HD12 LEU 117 HD12 LEU 117 -4.985 8.251 -2.710 750 HD13 LEU 117 HD13 LEU 117 -6.717 7.924 -2.652 751 HD21 LEU 117 HD21 LEU 117 -4.398 7.673 0.890 752 HD22 LEU 117 HD22 LEU 117 -3.616 7.860 -0.686 753 HD23 LEU 117 HD23 LEU 117 -4.388 6.333 -0.254 754 H ASP 118 HN ASP 118 -6.129 12.505 -0.647 755 HA ASP 118 HA ASP 118 -7.965 12.963 1.437 756 HB2 ASP 118 HB2 ASP 118 -5.827 14.118 1.310 757 HB3 ASP 118 HB1 ASP 118 -6.323 14.921 -0.179 758 H ALA 119 HN ALA 119 -8.094 13.661 -2.001 759 HA ALA 119 HA ALA 119 -10.497 15.214 -1.879 760 HB1 ALA 119 HB1 ALA 119 -9.301 13.680 -4.186 761 HB2 ALA 119 HB2 ALA 119 -8.982 15.369 -3.790 762 HB3 ALA 119 HB3 ALA 119 -10.595 14.872 -4.300 763 H GLU 120 HN GLU 120 -9.721 11.817 -2.441 764 HA GLU 120 HA GLU 120 -12.383 10.906 -2.711 765 HB2 GLU 120 HB2 GLU 120 -9.761 9.641 -2.031 766 HB3 GLU 120 HB1 GLU 120 -11.241 8.735 -1.797 767 HG2 GLU 120 HG2 GLU 120 -10.251 8.196 -3.910 768 HG3 GLU 120 HG1 GLU 120 -11.799 8.997 -4.148 769 H ILE 121 HN ILE 121 -10.382 11.677 0.080 770 HA ILE 121 HA ILE 121 -11.914 10.569 2.108 771 HB ILE 121 HB ILE 121 -10.012 12.788 1.915 772 HG12 ILE 121 HG12 ILE 121 -9.238 11.829 4.066 773 HG13 ILE 121 HG11 ILE 121 -10.626 10.746 4.057 774 HG21 ILE 121 HG21 ILE 121 -12.090 12.887 4.094 775 HG22 ILE 121 HG22 ILE 121 -11.824 14.092 2.835 776 HG23 ILE 121 HG23 ILE 121 -10.592 13.819 4.065 777 HD11 ILE 121 HD11 ILE 121 -8.614 9.617 3.317 778 HD12 ILE 121 HD12 ILE 121 -8.412 10.796 2.022 779 HD13 ILE 121 HD13 ILE 121 -9.799 9.706 2.017 780 H ARG 122 HN ARG 122 -12.501 13.400 0.133 781 HA ARG 122 HA ARG 122 -14.700 14.479 1.486 782 HB2 ARG 122 HB2 ARG 122 -13.545 15.599 -0.362 783 HB3 ARG 122 HB1 ARG 122 -14.153 14.390 -1.482 784 HG2 ARG 122 HG2 ARG 122 -16.407 15.154 -1.170 785 HG3 ARG 122 HG1 ARG 122 -15.894 16.265 0.104 786 HD2 ARG 122 HD2 ARG 122 -15.170 16.367 -2.818 787 HD3 ARG 122 HD1 ARG 122 -16.159 17.521 -1.921 788 HE ARG 122 HE ARG 122 -14.031 17.921 -0.591 789 HH11 ARG 122 HH11 ARG 122 -14.052 17.047 -3.983 790 HH12 ARG 122 HH12 ARG 122 -12.488 17.726 -4.299 791 HH21 ARG 122 HH21 ARG 122 -11.971 18.816 -1.007 792 HH22 ARG 122 HH22 ARG 122 -11.307 18.734 -2.607 793 H LYS 123 HN LYS 123 -14.608 12.015 -1.101 794 HA LYS 123 HA LYS 123 -17.412 11.577 -1.151 795 HB2 LYS 123 HB2 LYS 123 -16.992 9.699 -2.509 796 HB3 LYS 123 HB1 LYS 123 -15.670 10.793 -2.866 797 HG2 LYS 123 HG2 LYS 123 -14.492 9.390 -0.950 798 HG3 LYS 123 HG1 LYS 123 -15.640 8.174 -1.495 799 HD2 LYS 123 HD2 LYS 123 -13.723 9.657 -3.285 800 HD3 LYS 123 HD1 LYS 123 -13.440 8.045 -2.628 801 HE2 LYS 123 HE2 LYS 123 -15.150 7.108 -3.887 802 HE3 LYS 123 HE1 LYS 123 -15.889 8.676 -4.213 803 HZ1 LYS 123 HZ1 LYS 123 -14.759 7.845 -6.164 804 HZ2 LYS 123 HZ2 LYS 123 -13.310 7.709 -5.310 805 HZ3 LYS 123 HZ3 LYS 123 -13.981 9.232 -5.597 806 H LEU 124 HN LEU 124 -14.801 10.212 0.741 807 HA LEU 124 HA LEU 124 -16.265 8.226 2.079 808 HB2 LEU 124 HB2 LEU 124 -13.840 9.807 2.908 809 HB3 LEU 124 HB1 LEU 124 -14.494 8.488 3.859 810 HG LEU 124 HG LEU 124 -13.393 8.260 1.051 811 HD11 LEU 124 HD11 LEU 124 -11.604 6.970 2.152 812 HD12 LEU 124 HD12 LEU 124 -12.295 7.376 3.722 813 HD13 LEU 124 HD13 LEU 124 -11.645 8.647 2.688 814 HD21 LEU 124 HD21 LEU 124 -14.438 6.158 2.943 815 HD22 LEU 124 HD22 LEU 124 -13.626 5.844 1.409 816 HD23 LEU 124 HD23 LEU 124 -15.183 6.671 1.429 817 H GLU 125 HN GLU 125 -15.590 11.614 2.929 818 HA GLU 125 HA GLU 125 -16.740 11.724 5.423 819 HB2 GLU 125 HB2 GLU 125 -16.711 13.835 3.267 820 HB3 GLU 125 HB1 GLU 125 -17.229 14.141 4.919 821 HG2 GLU 125 HG2 GLU 125 -14.992 13.408 5.695 822 HG3 GLU 125 HG1 GLU 125 -14.495 13.277 4.012 823 H ARG 126 HN ARG 126 -18.341 11.697 2.312 824 HA ARG 126 HA ARG 126 -20.927 12.399 3.144 825 HB2 ARG 126 HB2 ARG 126 -20.203 10.416 0.979 826 HB3 ARG 126 HB1 ARG 126 -21.710 11.310 1.124 827 HG2 ARG 126 HG2 ARG 126 -18.990 12.462 0.557 828 HG3 ARG 126 HG1 ARG 126 -20.326 12.295 -0.583 829 HD2 ARG 126 HD2 ARG 126 -21.664 13.839 0.716 830 HD3 ARG 126 HD1 ARG 126 -20.393 13.954 1.930 831 HE ARG 126 HE ARG 126 -20.008 14.853 -0.853 832 HH11 ARG 126 HH11 ARG 126 -19.728 15.353 2.602 833 HH12 ARG 126 HH12 ARG 126 -18.928 16.879 2.449 834 HH21 ARG 126 HH21 ARG 126 -18.949 16.870 -1.062 835 HH22 ARG 126 HH22 ARG 126 -18.474 17.737 0.366 836 H LEU 127 HN LEU 127 -19.306 9.250 2.964 837 HA LEU 127 HA LEU 127 -21.539 7.833 4.057 838 HB2 LEU 127 HB2 LEU 127 -18.731 7.134 3.354 839 HB3 LEU 127 HB1 LEU 127 -19.625 6.057 4.409 840 HG LEU 127 HG LEU 127 -19.746 5.323 2.078 841 HD11 LEU 127 HD11 LEU 127 -21.626 4.897 3.619 842 HD12 LEU 127 HD12 LEU 127 -22.132 5.023 1.936 843 HD13 LEU 127 HD13 LEU 127 -22.404 6.370 3.040 844 HD21 LEU 127 HD21 LEU 127 -20.866 6.609 0.384 845 HD22 LEU 127 HD22 LEU 127 -19.554 7.577 1.058 846 HD23 LEU 127 HD23 LEU 127 -21.219 7.896 1.536 847 H LEU 128 HN LEU 128 -18.427 8.954 5.443 848 HA LEU 128 HA LEU 128 -18.683 8.207 8.041 849 HB2 LEU 128 HB2 LEU 128 -17.709 10.702 6.723 850 HB3 LEU 128 HB1 LEU 128 -17.766 10.620 8.472 851 HG LEU 128 HG LEU 128 -16.322 8.625 8.373 852 HD11 LEU 128 HD11 LEU 128 -15.068 8.112 6.369 853 HD12 LEU 128 HD12 LEU 128 -16.044 9.273 5.469 854 HD13 LEU 128 HD13 LEU 128 -16.796 7.832 6.152 855 HD21 LEU 128 HD21 LEU 128 -14.269 9.861 7.872 856 HD22 LEU 128 HD22 LEU 128 -15.407 10.828 8.811 857 HD23 LEU 128 HD23 LEU 128 -15.234 11.107 7.077 858 H GLU 129 HN GLU 129 -19.933 11.282 6.753 859 HA GLU 129 HA GLU 129 -21.469 11.996 8.969 860 HB2 GLU 129 HB2 GLU 129 -21.925 12.649 6.056 861 HB3 GLU 129 HB1 GLU 129 -22.726 13.454 7.396 862 HG2 GLU 129 HG2 GLU 129 -20.522 14.198 8.216 863 HG3 GLU 129 HG1 GLU 129 -19.780 13.462 6.796 864 H SER 130 HN SER 130 -22.251 9.921 6.248 865 HA SER 130 HA SER 130 -25.029 9.715 6.715 866 HB2 SER 130 HB2 SER 130 -23.837 9.064 4.594 867 HB3 SER 130 HB1 SER 130 -23.248 7.632 5.433 868 HG SER 130 HG SER 130 -25.260 7.446 4.138 869 H GLY 131 HN GLY 131 -22.268 8.175 8.152 870 HA2 GLY 131 HA2 GLY 131 -22.569 7.400 10.434 871 HA3 GLY 131 HA1 GLY 131 -24.118 6.738 9.945 872 H LEU 132 HN LEU 132 -21.508 6.296 7.738 873 HA LEU 132 HA LEU 132 -21.557 3.450 8.242 874 HB2 LEU 132 HB2 LEU 132 -21.540 4.234 5.955 875 HB3 LEU 132 HB1 LEU 132 -20.063 5.130 6.237 876 HG LEU 132 HG LEU 132 -18.912 2.939 6.666 877 HD11 LEU 132 HD11 LEU 132 -19.981 0.910 5.844 878 HD12 LEU 132 HD12 LEU 132 -21.468 1.808 5.540 879 HD13 LEU 132 HD13 LEU 132 -20.883 1.605 7.189 880 HD21 LEU 132 HD21 LEU 132 -20.174 3.363 3.969 881 HD22 LEU 132 HD22 LEU 132 -18.741 2.385 4.290 882 HD23 LEU 132 HD23 LEU 132 -18.705 4.128 4.567 883 H THR 133 HN THR 133 -18.869 5.746 7.822 884 HA THR 133 HA THR 133 -17.161 4.030 9.424 885 HB THR 133 HB THR 133 -16.428 6.615 8.039 886 HG1 THR 133 HG1 THR 133 -16.372 3.930 7.072 887 HG21 THR 133 HG21 THR 133 -14.163 5.687 8.079 888 HG22 THR 133 HG22 THR 133 -14.760 4.256 8.919 889 HG23 THR 133 HG23 THR 133 -14.817 5.831 9.710 Start of MODEL 8 1 H1 MET 1 HT1 MET 1 27.136 -0.540 -9.451 2 H2 MET 1 HT2 MET 1 25.855 -0.591 -8.350 3 H3 MET 1 HT3 MET 1 26.995 -1.833 -8.377 4 HA MET 1 HA MET 1 28.704 -0.408 -7.601 5 HB2 MET 1 HB2 MET 1 26.579 1.728 -7.802 6 HB3 MET 1 HB1 MET 1 28.086 1.945 -6.927 7 HG2 MET 1 HG2 MET 1 28.338 2.948 -9.058 8 HG3 MET 1 HG1 MET 1 29.307 1.479 -9.043 9 HE1 MET 1 HE1 MET 1 25.385 1.904 -9.526 10 HE2 MET 1 HE2 MET 1 25.304 1.986 -11.286 11 HE3 MET 1 HE3 MET 1 26.115 3.263 -10.379 12 H ASP 2 HN ASP 2 27.376 -2.351 -6.398 13 HA ASP 2 HA ASP 2 25.815 -1.520 -4.155 14 HB2 ASP 2 HB2 ASP 2 26.023 -3.862 -3.396 15 HB3 ASP 2 HB1 ASP 2 25.531 -3.764 -5.082 16 H SER 3 HN SER 3 29.198 -2.099 -4.728 17 HA SER 3 HA SER 3 29.861 -2.148 -1.917 18 HB2 SER 3 HB2 SER 3 31.705 -2.030 -4.312 19 HB3 SER 3 HB1 SER 3 32.134 -2.499 -2.666 20 HG SER 3 HG SER 3 30.030 -3.929 -3.751 21 H ALA 4 HN ALA 4 29.169 0.220 -4.122 22 HA ALA 4 HA ALA 4 31.045 2.212 -3.179 23 HB1 ALA 4 HB1 ALA 4 29.823 3.728 -4.675 24 HB2 ALA 4 HB2 ALA 4 28.654 2.447 -4.994 25 HB3 ALA 4 HB3 ALA 4 30.331 2.255 -5.501 26 H ILE 5 HN ILE 5 28.117 0.917 -2.178 27 HA ILE 5 HA ILE 5 27.002 3.272 -0.965 28 HB ILE 5 HB ILE 5 26.336 0.374 -0.411 29 HG12 ILE 5 HG12 ILE 5 25.030 2.271 -2.376 30 HG13 ILE 5 HG11 ILE 5 26.136 0.977 -2.822 31 HG21 ILE 5 HG21 ILE 5 24.720 2.888 0.007 32 HG22 ILE 5 HG22 ILE 5 25.525 1.963 1.274 33 HG23 ILE 5 HG23 ILE 5 24.198 1.242 0.364 34 HD11 ILE 5 HD11 ILE 5 23.465 0.626 -1.482 35 HD12 ILE 5 HD12 ILE 5 24.570 -0.669 -1.941 36 HD13 ILE 5 HD13 ILE 5 23.823 0.335 -3.184 37 H SER 6 HN SER 6 28.257 4.179 0.615 38 HA SER 6 HA SER 6 29.588 2.482 2.561 39 HB2 SER 6 HB2 SER 6 29.399 5.503 2.557 40 HB3 SER 6 HB1 SER 6 30.595 4.501 3.378 41 HG SER 6 HG SER 6 30.501 5.357 0.770 42 H LYS 7 HN LYS 7 29.259 3.623 4.987 43 HA LYS 7 HA LYS 7 26.607 2.947 5.678 44 HB2 LYS 7 HB2 LYS 7 28.620 2.957 7.241 45 HB3 LYS 7 HB1 LYS 7 28.388 4.697 7.369 46 HG2 LYS 7 HG2 LYS 7 26.024 4.211 8.067 47 HG3 LYS 7 HG1 LYS 7 26.489 2.521 8.180 48 HD2 LYS 7 HD2 LYS 7 28.015 4.635 9.642 49 HD3 LYS 7 HD1 LYS 7 26.519 3.995 10.304 50 HE2 LYS 7 HE2 LYS 7 28.269 2.736 11.284 51 HE3 LYS 7 HE1 LYS 7 27.512 1.696 10.083 52 HZ1 LYS 7 HZ1 LYS 7 30.057 3.189 9.745 53 HZ2 LYS 7 HZ2 LYS 7 29.332 2.222 8.564 54 HZ3 LYS 7 HZ3 LYS 7 29.901 1.524 9.990 55 H GLU 8 HN GLU 8 28.140 5.868 4.686 56 HA GLU 8 HA GLU 8 26.391 7.870 5.345 57 HB2 GLU 8 HB2 GLU 8 27.819 7.371 2.726 58 HB3 GLU 8 HB1 GLU 8 27.058 8.899 3.164 59 HG2 GLU 8 HG2 GLU 8 29.280 7.595 4.711 60 HG3 GLU 8 HG1 GLU 8 29.507 8.858 3.504 61 H ASP 9 HN ASP 9 26.230 5.965 2.337 62 HA ASP 9 HA ASP 9 23.630 6.959 1.675 63 HB2 ASP 9 HB2 ASP 9 25.288 6.302 -0.040 64 HB3 ASP 9 HB1 ASP 9 25.164 4.638 0.494 65 H GLU 10 HN GLU 10 24.876 4.216 3.381 66 HA GLU 10 HA GLU 10 22.594 2.572 3.304 67 HB2 GLU 10 HB2 GLU 10 24.729 1.710 4.045 68 HB3 GLU 10 HB1 GLU 10 24.753 2.839 5.391 69 HG2 GLU 10 HG2 GLU 10 22.979 1.730 6.477 70 HG3 GLU 10 HG1 GLU 10 22.644 0.737 5.059 71 H GLU 11 HN GLU 11 23.681 4.759 5.928 72 HA GLU 11 HA GLU 11 21.358 4.715 7.431 73 HB2 GLU 11 HB2 GLU 11 23.321 6.978 7.053 74 HB3 GLU 11 HB1 GLU 11 22.052 6.974 8.267 75 HG2 GLU 11 HG2 GLU 11 23.076 4.859 9.166 76 HG3 GLU 11 HG1 GLU 11 24.438 5.157 8.087 77 H ARG 12 HN ARG 12 22.145 6.581 4.577 78 HA ARG 12 HA ARG 12 19.947 8.316 4.507 79 HB2 ARG 12 HB2 ARG 12 21.834 8.563 2.993 80 HB3 ARG 12 HB1 ARG 12 21.488 7.007 2.257 81 HG2 ARG 12 HG2 ARG 12 19.332 7.921 1.450 82 HG3 ARG 12 HG1 ARG 12 19.805 9.496 2.094 83 HD2 ARG 12 HD2 ARG 12 21.391 7.934 0.061 84 HD3 ARG 12 HD1 ARG 12 20.252 9.216 -0.339 85 HE ARG 12 HE ARG 12 21.804 10.586 1.231 86 HH11 ARG 12 HH11 ARG 12 22.888 8.026 -0.906 87 HH12 ARG 12 HH12 ARG 12 24.377 8.831 -1.299 88 HH21 ARG 12 HH21 ARG 12 23.773 11.616 0.733 89 HH22 ARG 12 HH22 ARG 12 24.886 10.864 -0.368 90 H TYR 13 HN TYR 13 20.369 5.087 3.089 91 HA TYR 13 HA TYR 13 17.746 4.810 2.115 92 HB2 TYR 13 HB2 TYR 13 19.324 3.335 1.203 93 HB3 TYR 13 HB1 TYR 13 19.939 2.863 2.780 94 HD1 TYR 13 HD1 TYR 13 16.656 2.798 0.972 95 HD2 TYR 13 HD2 TYR 13 19.455 0.728 3.419 96 HE1 TYR 13 HE1 TYR 13 15.191 0.825 0.962 97 HE2 TYR 13 HE2 TYR 13 18.008 -1.256 3.407 98 HH TYR 13 HH TYR 13 15.683 -1.824 3.085 99 H GLN 14 HN GLN 14 19.225 3.702 5.157 100 HA GLN 14 HA GLN 14 17.110 2.341 6.271 101 HB2 GLN 14 HB2 GLN 14 19.038 4.182 7.687 102 HB3 GLN 14 HB1 GLN 14 18.048 2.959 8.464 103 HG2 GLN 14 HG2 GLN 14 19.208 1.308 6.885 104 HG3 GLN 14 HG1 GLN 14 20.363 2.602 6.608 105 HE21 GLN 14 HE21 GLN 14 18.760 2.032 9.662 106 HE22 GLN 14 HE22 GLN 14 20.171 1.533 10.523 107 H LYS 15 HN LYS 15 17.791 5.791 6.871 108 HA LYS 15 HA LYS 15 15.414 6.403 8.154 109 HB2 LYS 15 HB2 LYS 15 17.235 8.093 6.454 110 HB3 LYS 15 HB1 LYS 15 15.842 8.763 7.291 111 HG2 LYS 15 HG2 LYS 15 18.095 7.308 8.653 112 HG3 LYS 15 HG1 LYS 15 17.995 9.058 8.486 113 HD2 LYS 15 HD2 LYS 15 15.949 7.327 9.873 114 HD3 LYS 15 HD1 LYS 15 17.208 8.256 10.685 115 HE2 LYS 15 HE2 LYS 15 16.283 10.319 9.775 116 HE3 LYS 15 HE1 LYS 15 15.036 9.401 8.935 117 HZ1 LYS 15 HZ1 LYS 15 14.223 8.646 11.095 118 HZ2 LYS 15 HZ2 LYS 15 14.169 10.328 10.963 119 HZ3 LYS 15 HZ3 LYS 15 15.387 9.591 11.877 120 H LEU 16 HN LEU 16 16.142 6.120 4.769 121 HA LEU 16 HA LEU 16 13.886 7.421 3.711 122 HB2 LEU 16 HB2 LEU 16 16.059 6.699 2.569 123 HB3 LEU 16 HB1 LEU 16 15.318 5.117 2.424 124 HG LEU 16 HG LEU 16 13.582 5.993 1.003 125 HD11 LEU 16 HD11 LEU 16 14.827 8.660 1.642 126 HD12 LEU 16 HD12 LEU 16 13.155 8.146 1.906 127 HD13 LEU 16 HD13 LEU 16 13.757 8.406 0.268 128 HD21 LEU 16 HD21 LEU 16 16.281 7.025 0.158 129 HD22 LEU 16 HD22 LEU 16 14.936 6.581 -0.896 130 HD23 LEU 16 HD23 LEU 16 15.757 5.344 0.057 131 H VAL 17 HN VAL 17 14.506 4.004 4.457 132 HA VAL 17 HA VAL 17 12.066 2.984 3.522 133 HB VAL 17 HB VAL 17 12.555 0.987 4.570 134 HG11 VAL 17 HG11 VAL 17 14.395 1.620 3.138 135 HG12 VAL 17 HG12 VAL 17 14.965 0.651 4.501 136 HG13 VAL 17 HG13 VAL 17 15.196 2.402 4.504 137 HG21 VAL 17 HG21 VAL 17 12.395 1.735 6.880 138 HG22 VAL 17 HG22 VAL 17 13.994 2.471 6.766 139 HG23 VAL 17 HG23 VAL 17 13.820 0.718 6.653 140 H THR 18 HN THR 18 12.974 4.461 6.563 141 HA THR 18 HA THR 18 10.633 3.938 8.002 142 HB THR 18 HB THR 18 13.002 5.514 8.340 143 HG1 THR 18 HG1 THR 18 12.087 5.354 10.622 144 HG21 THR 18 HG21 THR 18 10.462 6.925 9.158 145 HG22 THR 18 HG22 THR 18 11.640 7.484 7.959 146 HG23 THR 18 HG23 THR 18 12.095 7.372 9.662 147 H GLU 19 HN GLU 19 11.529 6.673 5.930 148 HA GLU 19 HA GLU 19 9.199 8.186 6.198 149 HB2 GLU 19 HB2 GLU 19 11.015 7.894 3.786 150 HB3 GLU 19 HB1 GLU 19 9.881 9.214 4.067 151 HG2 GLU 19 HG2 GLU 19 12.125 8.550 5.953 152 HG3 GLU 19 HG1 GLU 19 12.293 9.684 4.625 153 H ASN 20 HN ASN 20 10.025 5.522 4.139 154 HA ASN 20 HA ASN 20 7.781 5.666 2.406 155 HB2 ASN 20 HB2 ASN 20 10.058 4.631 1.978 156 HB3 ASN 20 HB1 ASN 20 9.536 3.279 2.970 157 HD21 ASN 20 HD21 ASN 20 9.862 1.937 1.198 158 HD22 ASN 20 HD22 ASN 20 8.742 1.872 -0.114 159 H GLU 21 HN GLU 21 8.563 3.671 5.268 160 HA GLU 21 HA GLU 21 6.261 2.061 5.169 161 HB2 GLU 21 HB2 GLU 21 7.924 2.860 7.549 162 HB3 GLU 21 HB1 GLU 21 6.812 1.497 7.476 163 HG2 GLU 21 HG2 GLU 21 9.055 1.779 5.543 164 HG3 GLU 21 HG1 GLU 21 9.309 1.067 7.128 165 H GLN 22 HN GLN 22 6.810 5.243 6.526 166 HA GLN 22 HA GLN 22 4.676 5.342 8.340 167 HB2 GLN 22 HB2 GLN 22 5.568 7.717 6.718 168 HB3 GLN 22 HB1 GLN 22 4.863 7.709 8.322 169 HG2 GLN 22 HG2 GLN 22 6.890 6.677 9.221 170 HG3 GLN 22 HG1 GLN 22 7.603 6.686 7.610 171 HE21 GLN 22 HE21 GLN 22 9.283 8.009 8.158 172 HE22 GLN 22 HE22 GLN 22 9.090 9.685 8.521 173 H LEU 23 HN LEU 23 4.809 6.714 5.069 174 HA LEU 23 HA LEU 23 2.048 7.446 5.325 175 HB2 LEU 23 HB2 LEU 23 2.337 8.821 3.470 176 HB3 LEU 23 HB1 LEU 23 3.827 8.918 4.367 177 HG LEU 23 HG LEU 23 3.342 7.537 1.760 178 HD11 LEU 23 HD11 LEU 23 5.118 9.048 1.002 179 HD12 LEU 23 HD12 LEU 23 5.182 9.750 2.618 180 HD13 LEU 23 HD13 LEU 23 3.722 9.915 1.641 181 HD21 LEU 23 HD21 LEU 23 5.707 6.868 1.794 182 HD22 LEU 23 HD22 LEU 23 4.750 6.046 3.026 183 HD23 LEU 23 HD23 LEU 23 5.803 7.387 3.478 184 H GLN 24 HN GLN 24 3.717 4.797 3.848 185 HA GLN 24 HA GLN 24 1.675 4.150 1.986 186 HB2 GLN 24 HB2 GLN 24 2.637 1.919 1.890 187 HB3 GLN 24 HB1 GLN 24 3.906 3.133 1.844 188 HG2 GLN 24 HG2 GLN 24 4.423 2.729 4.169 189 HG3 GLN 24 HG1 GLN 24 3.092 1.577 4.285 190 HE21 GLN 24 HE21 GLN 24 6.243 2.185 2.940 191 HE22 GLN 24 HE22 GLN 24 6.621 0.539 2.562 192 H ARG 25 HN ARG 25 2.098 3.622 5.398 193 HA ARG 25 HA ARG 25 -0.054 1.835 5.806 194 HB2 ARG 25 HB2 ARG 25 1.213 1.907 7.705 195 HB3 ARG 25 HB1 ARG 25 1.700 3.575 7.435 196 HG2 ARG 25 HG2 ARG 25 -0.714 4.143 8.066 197 HG3 ARG 25 HG1 ARG 25 -0.757 2.520 8.763 198 HD2 ARG 25 HD2 ARG 25 1.190 3.086 10.151 199 HD3 ARG 25 HD1 ARG 25 1.213 4.708 9.446 200 HE ARG 25 HE ARG 25 -1.286 3.964 10.686 201 HH11 ARG 25 HH11 ARG 25 1.863 5.414 11.188 202 HH12 ARG 25 HH12 ARG 25 1.353 6.350 12.554 203 HH21 ARG 25 HH21 ARG 25 -1.962 5.204 12.477 204 HH22 ARG 25 HH22 ARG 25 -0.826 6.232 13.289 205 H LEU 26 HN LEU 26 0.317 5.324 5.808 206 HA LEU 26 HA LEU 26 -2.299 6.002 6.604 207 HB2 LEU 26 HB2 LEU 26 -0.376 7.611 4.917 208 HB3 LEU 26 HB1 LEU 26 -1.695 8.245 5.888 209 HG LEU 26 HG LEU 26 0.696 6.791 7.028 210 HD11 LEU 26 HD11 LEU 26 1.657 8.837 7.613 211 HD12 LEU 26 HD12 LEU 26 0.198 9.740 7.199 212 HD13 LEU 26 HD13 LEU 26 1.183 9.027 5.924 213 HD21 LEU 26 HD21 LEU 26 -1.302 6.643 8.404 214 HD22 LEU 26 HD22 LEU 26 -1.485 8.396 8.345 215 HD23 LEU 26 HD23 LEU 26 -0.092 7.681 9.157 216 H ILE 27 HN ILE 27 -0.788 5.456 3.482 217 HA ILE 27 HA ILE 27 -2.962 6.089 1.822 218 HB ILE 27 HB ILE 27 -0.740 4.082 1.476 219 HG12 ILE 27 HG12 ILE 27 -1.172 6.801 0.239 220 HG13 ILE 27 HG11 ILE 27 -0.107 6.471 1.613 221 HG21 ILE 27 HG21 ILE 27 -1.324 4.113 -0.934 222 HG22 ILE 27 HG22 ILE 27 -2.798 4.989 -0.526 223 HG23 ILE 27 HG23 ILE 27 -2.546 3.355 0.083 224 HD11 ILE 27 HD11 ILE 27 1.120 6.614 -0.481 225 HD12 ILE 27 HD12 ILE 27 0.161 5.284 -1.132 226 HD13 ILE 27 HD13 ILE 27 1.236 5.010 0.240 227 H THR 28 HN THR 28 -1.918 2.934 3.115 228 HA THR 28 HA THR 28 -3.941 1.380 2.052 229 HB THR 28 HB THR 28 -1.822 0.777 3.588 230 HG1 THR 28 HG1 THR 28 -3.178 -1.337 3.907 231 HG21 THR 28 HG21 THR 28 -2.657 -0.265 5.697 232 HG22 THR 28 HG22 THR 28 -4.207 0.544 5.431 233 HG23 THR 28 HG23 THR 28 -2.744 1.498 5.699 234 H GLN 29 HN GLN 29 -4.097 3.539 4.794 235 HA GLN 29 HA GLN 29 -6.533 2.622 5.926 236 HB2 GLN 29 HB2 GLN 29 -5.391 5.425 5.907 237 HB3 GLN 29 HB1 GLN 29 -6.632 4.824 6.996 238 HG2 GLN 29 HG2 GLN 29 -3.843 3.725 6.865 239 HG3 GLN 29 HG1 GLN 29 -4.359 4.993 7.971 240 HE21 GLN 29 HE21 GLN 29 -4.577 1.626 7.167 241 HE22 GLN 29 HE22 GLN 29 -5.314 1.110 8.642 242 H LYS 30 HN LYS 30 -5.822 5.371 3.827 243 HA LYS 30 HA LYS 30 -8.497 6.069 3.280 244 HB2 LYS 30 HB2 LYS 30 -6.169 6.546 1.417 245 HB3 LYS 30 HB1 LYS 30 -7.617 7.524 1.603 246 HG2 LYS 30 HG2 LYS 30 -5.469 7.201 3.693 247 HG3 LYS 30 HG1 LYS 30 -5.614 8.564 2.584 248 HD2 LYS 30 HD2 LYS 30 -7.781 9.126 3.537 249 HD3 LYS 30 HD1 LYS 30 -7.684 7.735 4.618 250 HE2 LYS 30 HE2 LYS 30 -5.771 8.688 5.733 251 HE3 LYS 30 HE1 LYS 30 -5.722 10.022 4.583 252 HZ1 LYS 30 HZ1 LYS 30 -7.877 10.756 5.396 253 HZ2 LYS 30 HZ2 LYS 30 -6.754 10.689 6.657 254 HZ3 LYS 30 HZ3 LYS 30 -7.922 9.476 6.503 255 H GLU 31 HN GLU 31 -6.201 3.975 1.660 256 HA GLU 31 HA GLU 31 -7.477 3.461 -0.728 257 HB2 GLU 31 HB2 GLU 31 -5.575 1.962 0.993 258 HB3 GLU 31 HB1 GLU 31 -6.333 1.096 -0.338 259 HG2 GLU 31 HG2 GLU 31 -5.134 3.741 -0.920 260 HG3 GLU 31 HG1 GLU 31 -4.046 2.392 -0.609 261 H GLU 32 HN GLU 32 -7.737 1.458 2.232 262 HA GLU 32 HA GLU 32 -9.546 -0.369 1.170 263 HB2 GLU 32 HB2 GLU 32 -10.255 -0.702 3.620 264 HB3 GLU 32 HB1 GLU 32 -8.589 -1.039 3.180 265 HG2 GLU 32 HG2 GLU 32 -7.829 0.988 4.161 266 HG3 GLU 32 HG1 GLU 32 -9.485 1.569 4.374 267 H LYS 33 HN LYS 33 -10.126 2.805 2.550 268 HA LYS 33 HA LYS 33 -12.964 2.496 2.707 269 HB2 LYS 33 HB2 LYS 33 -11.423 5.082 2.475 270 HB3 LYS 33 HB1 LYS 33 -13.038 4.862 3.130 271 HG2 LYS 33 HG2 LYS 33 -10.464 3.878 4.338 272 HG3 LYS 33 HG1 LYS 33 -11.451 5.222 4.907 273 HD2 LYS 33 HD2 LYS 33 -13.319 3.572 5.243 274 HD3 LYS 33 HD1 LYS 33 -12.150 2.292 4.913 275 HE2 LYS 33 HE2 LYS 33 -12.027 4.324 7.137 276 HE3 LYS 33 HE1 LYS 33 -12.372 2.604 7.303 277 HZ1 LYS 33 HZ1 LYS 33 -10.071 3.199 7.874 278 HZ2 LYS 33 HZ2 LYS 33 -9.812 3.716 6.285 279 HZ3 LYS 33 HZ3 LYS 33 -10.150 2.083 6.602 280 H ILE 34 HN ILE 34 -10.768 4.062 0.391 281 HA ILE 34 HA ILE 34 -12.848 5.011 -1.290 282 HB ILE 34 HB ILE 34 -9.890 4.718 -1.830 283 HG12 ILE 34 HG12 ILE 34 -11.413 7.256 -1.416 284 HG13 ILE 34 HG11 ILE 34 -10.895 6.303 -0.019 285 HG21 ILE 34 HG21 ILE 34 -12.045 6.051 -3.442 286 HG22 ILE 34 HG22 ILE 34 -10.990 4.728 -3.943 287 HG23 ILE 34 HG23 ILE 34 -10.319 6.339 -3.667 288 HD11 ILE 34 HD11 ILE 34 -9.305 8.072 -0.530 289 HD12 ILE 34 HD12 ILE 34 -9.082 7.413 -2.151 290 HD13 ILE 34 HD13 ILE 34 -8.578 6.480 -0.741 291 H ARG 35 HN ARG 35 -10.953 2.058 -1.271 292 HA ARG 35 HA ARG 35 -11.576 1.184 -3.869 293 HB2 ARG 35 HB2 ARG 35 -10.960 -0.394 -1.376 294 HB3 ARG 35 HB1 ARG 35 -11.070 -1.101 -2.990 295 HG2 ARG 35 HG2 ARG 35 -9.288 0.451 -3.744 296 HG3 ARG 35 HG1 ARG 35 -9.114 0.999 -2.079 297 HD2 ARG 35 HD2 ARG 35 -8.509 -1.274 -1.404 298 HD3 ARG 35 HD1 ARG 35 -8.678 -1.811 -3.078 299 HE ARG 35 HE ARG 35 -6.822 0.383 -2.593 300 HH11 ARG 35 HH11 ARG 35 -7.261 -3.041 -3.181 301 HH12 ARG 35 HH12 ARG 35 -5.605 -3.306 -3.615 302 HH21 ARG 35 HH21 ARG 35 -4.641 0.040 -3.174 303 HH22 ARG 35 HH22 ARG 35 -4.115 -1.563 -3.608 304 H VAL 36 HN VAL 36 -13.299 0.910 -0.839 305 HA VAL 36 HA VAL 36 -15.402 -0.737 -1.797 306 HB VAL 36 HB VAL 36 -15.506 1.307 0.422 307 HG11 VAL 36 HG11 VAL 36 -17.219 -0.166 1.372 308 HG12 VAL 36 HG12 VAL 36 -17.107 -1.204 -0.048 309 HG13 VAL 36 HG13 VAL 36 -17.694 0.450 -0.211 310 HG21 VAL 36 HG21 VAL 36 -14.678 -0.361 1.898 311 HG22 VAL 36 HG22 VAL 36 -13.572 -0.291 0.515 312 HG23 VAL 36 HG23 VAL 36 -14.759 -1.596 0.641 313 H LEU 37 HN LEU 37 -14.809 2.710 -1.741 314 HA LEU 37 HA LEU 37 -17.309 3.491 -2.877 315 HB2 LEU 37 HB2 LEU 37 -14.707 4.777 -2.332 316 HB3 LEU 37 HB1 LEU 37 -15.639 5.477 -3.645 317 HG LEU 37 HG LEU 37 -15.918 6.479 -1.298 318 HD11 LEU 37 HD11 LEU 37 -17.393 6.960 -3.213 319 HD12 LEU 37 HD12 LEU 37 -18.257 6.960 -1.669 320 HD13 LEU 37 HD13 LEU 37 -18.397 5.571 -2.759 321 HD21 LEU 37 HD21 LEU 37 -17.508 5.372 0.161 322 HD22 LEU 37 HD22 LEU 37 -16.117 4.324 -0.130 323 HD23 LEU 37 HD23 LEU 37 -17.637 4.025 -0.972 324 H ARG 38 HN ARG 38 -14.267 2.388 -4.158 325 HA ARG 38 HA ARG 38 -14.688 3.035 -6.866 326 HB2 ARG 38 HB2 ARG 38 -13.161 0.745 -5.615 327 HB3 ARG 38 HB1 ARG 38 -13.169 1.070 -7.342 328 HG2 ARG 38 HG2 ARG 38 -12.208 3.286 -6.915 329 HG3 ARG 38 HG1 ARG 38 -12.165 2.923 -5.190 330 HD2 ARG 38 HD2 ARG 38 -9.981 2.559 -6.175 331 HD3 ARG 38 HD1 ARG 38 -10.668 1.026 -5.644 332 HE ARG 38 HE ARG 38 -11.391 1.071 -8.216 333 HH11 ARG 38 HH11 ARG 38 -8.307 1.764 -6.710 334 HH12 ARG 38 HH12 ARG 38 -7.377 1.203 -8.061 335 HH21 ARG 38 HH21 ARG 38 -10.181 0.328 -9.987 336 HH22 ARG 38 HH22 ARG 38 -8.445 0.357 -9.923 337 H GLN 39 HN GLN 39 -15.699 0.291 -4.897 338 HA GLN 39 HA GLN 39 -16.944 -1.207 -6.920 339 HB2 GLN 39 HB2 GLN 39 -17.785 -1.016 -4.029 340 HB3 GLN 39 HB1 GLN 39 -18.079 -2.352 -5.135 341 HG2 GLN 39 HG2 GLN 39 -15.382 -1.444 -4.171 342 HG3 GLN 39 HG1 GLN 39 -16.275 -2.828 -3.569 343 HE21 GLN 39 HE21 GLN 39 -14.379 -1.554 -6.135 344 HE22 GLN 39 HE22 GLN 39 -14.177 -3.031 -6.999 345 H ARG 40 HN ARG 40 -18.102 1.432 -4.884 346 HA ARG 40 HA ARG 40 -20.753 1.544 -5.768 347 HB2 ARG 40 HB2 ARG 40 -18.824 3.494 -4.618 348 HB3 ARG 40 HB1 ARG 40 -20.248 4.143 -5.404 349 HG2 ARG 40 HG2 ARG 40 -20.558 3.939 -3.009 350 HG3 ARG 40 HG1 ARG 40 -21.681 2.906 -3.888 351 HD2 ARG 40 HD2 ARG 40 -19.077 1.833 -2.882 352 HD3 ARG 40 HD1 ARG 40 -20.458 1.989 -1.801 353 HE ARG 40 HE ARG 40 -21.328 0.651 -4.100 354 HH11 ARG 40 HH11 ARG 40 -19.105 0.096 -1.448 355 HH12 ARG 40 HH12 ARG 40 -19.298 -1.627 -1.484 356 HH21 ARG 40 HH21 ARG 40 -21.594 -1.591 -4.140 357 HH22 ARG 40 HH22 ARG 40 -20.709 -2.590 -3.024 358 H LEU 41 HN LEU 41 -17.794 2.958 -7.083 359 HA LEU 41 HA LEU 41 -19.086 4.327 -9.212 360 HB2 LEU 41 HB2 LEU 41 -16.231 3.406 -9.303 361 HB3 LEU 41 HB1 LEU 41 -16.948 4.824 -10.038 362 HG LEU 41 HG LEU 41 -16.399 4.419 -7.099 363 HD11 LEU 41 HD11 LEU 41 -14.421 4.854 -8.454 364 HD12 LEU 41 HD12 LEU 41 -14.793 6.210 -7.393 365 HD13 LEU 41 HD13 LEU 41 -15.185 6.302 -9.110 366 HD21 LEU 41 HD21 LEU 41 -17.569 6.827 -8.488 367 HD22 LEU 41 HD22 LEU 41 -17.157 6.698 -6.775 368 HD23 LEU 41 HD23 LEU 41 -18.458 5.713 -7.448 369 H VAL 42 HN VAL 42 -17.758 1.119 -8.788 370 HA VAL 42 HA VAL 42 -17.878 0.156 -11.403 371 HB VAL 42 HB VAL 42 -18.459 -1.247 -8.785 372 HG11 VAL 42 HG11 VAL 42 -18.089 -2.446 -11.525 373 HG12 VAL 42 HG12 VAL 42 -19.543 -2.504 -10.526 374 HG13 VAL 42 HG13 VAL 42 -18.086 -3.356 -10.015 375 HG21 VAL 42 HG21 VAL 42 -16.191 -0.443 -8.944 376 HG22 VAL 42 HG22 VAL 42 -16.008 -1.174 -10.538 377 HG23 VAL 42 HG23 VAL 42 -16.203 -2.198 -9.117 378 H GLU 43 HN GLU 43 -20.382 0.307 -8.910 379 HA GLU 43 HA GLU 43 -22.477 -0.766 -10.452 380 HB2 GLU 43 HB2 GLU 43 -22.638 1.201 -8.162 381 HB3 GLU 43 HB1 GLU 43 -23.950 0.189 -8.751 382 HG2 GLU 43 HG2 GLU 43 -22.790 -1.801 -8.054 383 HG3 GLU 43 HG1 GLU 43 -21.381 -0.854 -7.581 384 H ARG 44 HN ARG 44 -21.414 2.545 -9.860 385 HA ARG 44 HA ARG 44 -23.408 3.836 -11.387 386 HB2 ARG 44 HB2 ARG 44 -20.616 4.743 -10.650 387 HB3 ARG 44 HB1 ARG 44 -21.856 5.779 -11.350 388 HG2 ARG 44 HG2 ARG 44 -23.267 5.462 -9.415 389 HG3 ARG 44 HG1 ARG 44 -22.103 4.328 -8.729 390 HD2 ARG 44 HD2 ARG 44 -21.925 6.555 -7.719 391 HD3 ARG 44 HD1 ARG 44 -20.447 6.087 -8.554 392 HE ARG 44 HE ARG 44 -21.720 7.505 -10.442 393 HH11 ARG 44 HH11 ARG 44 -21.053 8.162 -7.077 394 HH12 ARG 44 HH12 ARG 44 -20.978 9.881 -7.289 395 HH21 ARG 44 HH21 ARG 44 -21.630 9.783 -10.735 396 HH22 ARG 44 HH22 ARG 44 -21.311 10.802 -9.369 397 H GLY 45 HN GLY 45 -20.428 2.304 -12.213 398 HA2 GLY 45 HA2 GLY 45 -19.733 1.598 -14.316 399 HA3 GLY 45 HA1 GLY 45 -21.015 2.559 -15.041 400 H ASP 46 HN ASP 46 -18.461 3.538 -12.794 401 HA ASP 46 HA ASP 46 -18.004 5.972 -14.176 402 HB2 ASP 46 HB2 ASP 46 -17.619 5.673 -11.751 403 HB3 ASP 46 HB1 ASP 46 -16.253 4.623 -12.110 404 H ALA 47 HN ALA 47 -16.824 2.817 -14.665 405 HA ALA 47 HA ALA 47 -14.358 3.241 -15.892 406 HB1 ALA 47 HB1 ALA 47 -15.242 1.019 -15.392 407 HB2 ALA 47 HB2 ALA 47 -14.774 1.149 -17.087 408 HB3 ALA 47 HB3 ALA 47 -16.477 1.225 -16.633 409 H LYS 48 HN LYS 48 -17.593 3.868 -17.015 410 HA LYS 48 HA LYS 48 -16.444 5.062 -19.453 411 HB2 LYS 48 HB2 LYS 48 -19.210 3.958 -18.945 412 HB3 LYS 48 HB1 LYS 48 -18.813 4.947 -20.341 413 HG2 LYS 48 HG2 LYS 48 -17.129 2.564 -19.866 414 HG3 LYS 48 HG1 LYS 48 -18.789 2.285 -20.389 415 HD2 LYS 48 HD2 LYS 48 -17.334 2.385 -22.319 416 HD3 LYS 48 HD1 LYS 48 -18.401 3.787 -22.313 417 HE2 LYS 48 HE2 LYS 48 -16.621 5.169 -21.442 418 HE3 LYS 48 HE1 LYS 48 -15.553 3.770 -21.340 419 HZ1 LYS 48 HZ1 LYS 48 -16.705 4.864 -23.849 420 HZ2 LYS 48 HZ2 LYS 48 -15.631 3.560 -23.731 421 HZ3 LYS 48 HZ3 LYS 48 -15.122 5.112 -23.311 422 H GLY 49 HN GLY 49 -19.006 5.380 -17.033 423 HA2 GLY 49 HA2 GLY 49 -18.503 7.966 -16.232 424 HA3 GLY 49 HA1 GLY 49 -19.580 8.107 -17.619 425 H THR 50 HN THR 50 -21.688 7.374 -17.474 426 HA THR 50 HA THR 50 -22.628 5.938 -15.166 427 HB THR 50 HB THR 50 -23.689 8.741 -15.628 428 HG1 THR 50 HG1 THR 50 -21.573 7.944 -14.232 429 HG21 THR 50 HG21 THR 50 -25.010 8.330 -13.607 430 HG22 THR 50 HG22 THR 50 -24.361 6.693 -13.511 431 HG23 THR 50 HG23 THR 50 -25.393 7.154 -14.864 432 H GLU 51 HN GLU 51 -23.487 4.409 -16.528 433 HA GLU 51 HA GLU 51 -24.972 5.091 -18.866 434 HB2 GLU 51 HB2 GLU 51 -24.744 2.477 -17.368 435 HB3 GLU 51 HB1 GLU 51 -25.633 2.668 -18.864 436 HG2 GLU 51 HG2 GLU 51 -23.527 1.715 -19.360 437 HG3 GLU 51 HG1 GLU 51 -23.526 3.371 -19.959 438 H LEU 52 HN LEU 52 -26.820 6.174 -18.660 439 HA LEU 52 HA LEU 52 -28.555 5.766 -16.405 440 HB2 LEU 52 HB2 LEU 52 -29.005 7.392 -18.905 441 HB3 LEU 52 HB1 LEU 52 -29.971 7.467 -17.444 442 HG LEU 52 HG LEU 52 -27.093 8.325 -17.736 443 HD11 LEU 52 HD11 LEU 52 -28.626 9.904 -18.712 444 HD12 LEU 52 HD12 LEU 52 -28.009 10.550 -17.192 445 HD13 LEU 52 HD13 LEU 52 -29.635 9.870 -17.266 446 HD21 LEU 52 HD21 LEU 52 -28.870 8.345 -15.304 447 HD22 LEU 52 HD22 LEU 52 -27.270 9.078 -15.416 448 HD23 LEU 52 HD23 LEU 52 -27.451 7.328 -15.551 449 H ASN 53 HN ASN 53 -28.300 4.668 -19.637 450 HA ASN 53 HA ASN 53 -30.939 3.427 -19.587 451 HB2 ASN 53 HB2 ASN 53 -28.774 3.473 -21.700 452 HB3 ASN 53 HB1 ASN 53 -30.273 2.569 -21.866 453 HD21 ASN 53 HD21 ASN 53 -31.873 4.609 -20.522 454 HD22 ASN 53 HD22 ASN 53 -32.030 5.908 -21.650 455 H GLY 84 HN GLY 84 -0.886 -8.874 -7.293 456 HA2 GLY 84 HA2 GLY 84 0.947 -9.129 -9.040 457 HA3 GLY 84 HA1 GLY 84 1.267 -7.433 -8.702 458 HA PRO 85 HA PRO 85 3.097 -10.301 -5.370 459 HB2 PRO 85 HB2 PRO 85 5.015 -11.805 -6.427 460 HB3 PRO 85 HB1 PRO 85 3.316 -12.278 -6.576 461 HG2 PRO 85 HG2 PRO 85 5.101 -10.949 -8.577 462 HG3 PRO 85 HG1 PRO 85 3.938 -12.268 -8.819 463 HD2 PRO 85 HD2 PRO 85 3.417 -9.607 -9.363 464 HD3 PRO 85 HD1 PRO 85 2.173 -10.829 -9.036 465 H LEU 86 HN LEU 86 5.582 -10.627 -4.814 466 HA LEU 86 HA LEU 86 6.700 -8.219 -4.242 467 HB2 LEU 86 HB2 LEU 86 8.927 -9.747 -4.356 468 HB3 LEU 86 HB1 LEU 86 7.785 -9.745 -3.030 469 HG LEU 86 HG LEU 86 6.656 -11.717 -4.051 470 HD11 LEU 86 HD11 LEU 86 8.984 -11.663 -5.964 471 HD12 LEU 86 HD12 LEU 86 7.280 -11.445 -6.374 472 HD13 LEU 86 HD13 LEU 86 7.853 -13.002 -5.770 473 HD21 LEU 86 HD21 LEU 86 9.593 -12.052 -3.479 474 HD22 LEU 86 HD22 LEU 86 8.372 -13.323 -3.413 475 HD23 LEU 86 HD23 LEU 86 8.303 -11.974 -2.280 476 H GLY 87 HN GLY 87 7.008 -6.654 -5.706 477 HA2 GLY 87 HA2 GLY 87 8.790 -7.250 -7.986 478 HA3 GLY 87 HA1 GLY 87 7.641 -5.919 -7.935 479 H SER 88 HN SER 88 8.810 -5.987 -4.941 480 HA SER 88 HA SER 88 10.418 -3.659 -5.382 481 HB2 SER 88 HB2 SER 88 8.888 -3.812 -3.474 482 HB3 SER 88 HB1 SER 88 9.795 -5.183 -2.842 483 HG SER 88 HG SER 88 11.512 -3.856 -2.419 484 H ARG 89 HN ARG 89 11.115 -6.980 -5.280 485 HA ARG 89 HA ARG 89 13.829 -6.527 -4.298 486 HB2 ARG 89 HB2 ARG 89 12.529 -8.413 -3.362 487 HB3 ARG 89 HB1 ARG 89 12.462 -9.135 -4.962 488 HG2 ARG 89 HG2 ARG 89 14.830 -9.467 -4.985 489 HG3 ARG 89 HG1 ARG 89 15.021 -8.552 -3.488 490 HD2 ARG 89 HD2 ARG 89 15.137 -10.949 -3.066 491 HD3 ARG 89 HD1 ARG 89 13.725 -10.240 -2.288 492 HE ARG 89 HE ARG 89 13.370 -11.483 -4.908 493 HH11 ARG 89 HH11 ARG 89 12.936 -11.645 -1.438 494 HH12 ARG 89 HH12 ARG 89 11.748 -12.906 -1.517 495 HH21 ARG 89 HH21 ARG 89 11.825 -13.163 -5.013 496 HH22 ARG 89 HH22 ARG 89 11.127 -13.778 -3.548 497 H ARG 90 HN ARG 90 12.528 -8.598 -6.893 498 HA ARG 90 HA ARG 90 13.311 -9.087 -8.963 499 HB2 ARG 90 HB2 ARG 90 13.839 -6.138 -8.777 500 HB3 ARG 90 HB1 ARG 90 14.268 -7.042 -10.223 501 HG2 ARG 90 HG2 ARG 90 11.963 -7.716 -10.523 502 HG3 ARG 90 HG1 ARG 90 11.509 -6.906 -9.023 503 HD2 ARG 90 HD2 ARG 90 12.828 -5.411 -11.263 504 HD3 ARG 90 HD1 ARG 90 11.089 -5.692 -11.257 505 HE ARG 90 HE ARG 90 11.234 -4.586 -8.936 506 HH11 ARG 90 HH11 ARG 90 13.307 -3.754 -11.639 507 HH12 ARG 90 HH12 ARG 90 13.450 -2.079 -11.185 508 HH21 ARG 90 HH21 ARG 90 11.401 -2.383 -8.347 509 HH22 ARG 90 HH22 ARG 90 12.354 -1.304 -9.317 510 H PHE 91 HN PHE 91 14.969 -10.026 -7.119 511 HA PHE 91 HA PHE 91 17.002 -10.972 -6.874 512 HB2 PHE 91 HB2 PHE 91 17.514 -9.789 -9.605 513 HB3 PHE 91 HB1 PHE 91 18.618 -10.881 -8.777 514 HD1 PHE 91 HD1 PHE 91 15.410 -10.587 -10.512 515 HD2 PHE 91 HD2 PHE 91 18.109 -13.224 -8.545 516 HE1 PHE 91 HE1 PHE 91 14.201 -12.515 -11.444 517 HE2 PHE 91 HE2 PHE 91 16.905 -15.155 -9.475 518 HZ PHE 91 HZ PHE 91 14.946 -14.802 -10.926 519 H VAL 92 HN VAL 92 19.501 -10.386 -6.950 520 HA VAL 92 HA VAL 92 19.774 -8.268 -5.125 521 HB VAL 92 HB VAL 92 21.299 -10.167 -5.112 522 HG11 VAL 92 HG11 VAL 92 22.357 -9.077 -7.713 523 HG12 VAL 92 HG12 VAL 92 21.492 -10.597 -7.486 524 HG13 VAL 92 HG13 VAL 92 23.093 -10.378 -6.777 525 HG21 VAL 92 HG21 VAL 92 22.053 -8.099 -4.088 526 HG22 VAL 92 HG22 VAL 92 22.719 -7.559 -5.629 527 HG23 VAL 92 HG23 VAL 92 23.411 -8.960 -4.812 528 H VAL 93 HN VAL 93 20.303 -8.435 -8.597 529 HA VAL 93 HA VAL 93 21.855 -6.178 -8.972 530 HB VAL 93 HB VAL 93 21.510 -7.694 -10.792 531 HG11 VAL 93 HG11 VAL 93 18.616 -6.848 -10.796 532 HG12 VAL 93 HG12 VAL 93 19.238 -8.419 -10.290 533 HG13 VAL 93 HG13 VAL 93 19.383 -7.914 -11.973 534 HG21 VAL 93 HG21 VAL 93 22.011 -5.394 -11.405 535 HG22 VAL 93 HG22 VAL 93 20.289 -5.022 -11.454 536 HG23 VAL 93 HG23 VAL 93 20.978 -6.154 -12.616 537 H ASP 94 HN ASP 94 18.284 -6.363 -8.941 538 HA ASP 94 HA ASP 94 18.189 -3.475 -9.207 539 HB2 ASP 94 HB2 ASP 94 15.992 -5.537 -9.159 540 HB3 ASP 94 HB1 ASP 94 15.693 -3.812 -9.228 541 H ASP 95 HN ASP 95 17.569 -5.937 -6.743 542 HA ASP 95 HA ASP 95 16.353 -4.366 -4.819 543 HB2 ASP 95 HB2 ASP 95 16.552 -6.589 -4.210 544 HB3 ASP 95 HB1 ASP 95 18.259 -6.672 -4.629 545 H ARG 96 HN ARG 96 19.626 -4.238 -5.955 546 HA ARG 96 HA ARG 96 20.566 -2.783 -3.645 547 HB2 ARG 96 HB2 ARG 96 21.878 -3.383 -6.297 548 HB3 ARG 96 HB1 ARG 96 22.655 -2.469 -5.014 549 HG2 ARG 96 HG2 ARG 96 21.712 -5.326 -4.822 550 HG3 ARG 96 HG1 ARG 96 23.380 -4.797 -5.033 551 HD2 ARG 96 HD2 ARG 96 23.147 -5.286 -2.735 552 HD3 ARG 96 HD1 ARG 96 23.116 -3.528 -2.858 553 HE ARG 96 HE ARG 96 20.556 -4.953 -2.775 554 HH11 ARG 96 HH11 ARG 96 22.936 -2.986 -1.098 555 HH12 ARG 96 HH12 ARG 96 21.814 -2.463 0.119 556 HH21 ARG 96 HH21 ARG 96 19.099 -4.260 -1.184 557 HH22 ARG 96 HH22 ARG 96 19.638 -3.183 0.074 558 H ARG 97 HN ARG 97 20.555 -1.894 -7.102 559 HA ARG 97 HA ARG 97 20.688 0.893 -6.437 560 HB2 ARG 97 HB2 ARG 97 21.799 0.102 -8.421 561 HB3 ARG 97 HB1 ARG 97 20.305 -0.570 -9.050 562 HG2 ARG 97 HG2 ARG 97 20.372 2.339 -8.511 563 HG3 ARG 97 HG1 ARG 97 21.298 1.735 -9.883 564 HD2 ARG 97 HD2 ARG 97 18.374 1.154 -9.412 565 HD3 ARG 97 HD1 ARG 97 18.978 2.449 -10.447 566 HE ARG 97 HE ARG 97 19.886 -0.256 -11.039 567 HH11 ARG 97 HH11 ARG 97 17.753 2.406 -11.800 568 HH12 ARG 97 HH12 ARG 97 17.371 1.817 -13.385 569 HH21 ARG 97 HH21 ARG 97 19.371 -1.048 -13.130 570 HH22 ARG 97 HH22 ARG 97 18.285 -0.149 -14.140 571 H GLU 98 HN GLU 98 18.220 -1.174 -7.887 572 HA GLU 98 HA GLU 98 16.353 0.856 -8.408 573 HB2 GLU 98 HB2 GLU 98 16.235 -2.124 -8.183 574 HB3 GLU 98 HB1 GLU 98 14.755 -1.188 -8.418 575 HG2 GLU 98 HG2 GLU 98 17.117 -0.890 -10.231 576 HG3 GLU 98 HG1 GLU 98 15.906 -2.153 -10.472 577 H LEU 99 HN LEU 99 16.629 -1.422 -5.654 578 HA LEU 99 HA LEU 99 14.100 -0.718 -4.606 579 HB2 LEU 99 HB2 LEU 99 15.086 -2.831 -4.092 580 HB3 LEU 99 HB1 LEU 99 16.493 -2.075 -3.389 581 HG LEU 99 HG LEU 99 14.700 -3.160 -1.864 582 HD11 LEU 99 HD11 LEU 99 15.215 -1.561 -0.092 583 HD12 LEU 99 HD12 LEU 99 15.835 -0.433 -1.299 584 HD13 LEU 99 HD13 LEU 99 16.634 -1.986 -1.049 585 HD21 LEU 99 HD21 LEU 99 13.442 -0.467 -2.346 586 HD22 LEU 99 HD22 LEU 99 12.982 -1.607 -1.082 587 HD23 LEU 99 HD23 LEU 99 12.756 -2.033 -2.778 588 H GLN 100 HN GLN 100 17.399 0.298 -3.577 589 HA GLN 100 HA GLN 100 16.445 1.982 -1.530 590 HB2 GLN 100 HB2 GLN 100 18.655 3.044 -1.566 591 HB3 GLN 100 HB1 GLN 100 18.772 1.292 -1.586 592 HG2 GLN 100 HG2 GLN 100 19.331 1.282 -3.903 593 HG3 GLN 100 HG1 GLN 100 18.995 3.005 -4.048 594 HE21 GLN 100 HE21 GLN 100 20.246 3.629 -1.498 595 HE22 GLN 100 HE22 GLN 100 21.958 3.520 -1.743 596 H TYR 101 HN TYR 101 17.029 2.585 -4.954 597 HA TYR 101 HA TYR 101 16.617 5.411 -4.768 598 HB2 TYR 101 HB2 TYR 101 17.964 4.312 -6.565 599 HB3 TYR 101 HB1 TYR 101 16.475 3.641 -7.218 600 HD1 TYR 101 HD1 TYR 101 15.034 4.955 -8.588 601 HD2 TYR 101 HD2 TYR 101 18.322 6.783 -6.601 602 HE1 TYR 101 HE1 TYR 101 14.714 6.987 -9.936 603 HE2 TYR 101 HE2 TYR 101 18.007 8.818 -7.941 604 HH TYR 101 HH TYR 101 15.253 9.450 -9.721 605 H ARG 102 HN ARG 102 14.553 2.639 -5.169 606 HA ARG 102 HA ARG 102 12.362 4.188 -6.203 607 HB2 ARG 102 HB2 ARG 102 11.184 2.231 -6.409 608 HB3 ARG 102 HB1 ARG 102 12.824 1.610 -6.460 609 HG2 ARG 102 HG2 ARG 102 12.695 0.899 -4.178 610 HG3 ARG 102 HG1 ARG 102 11.134 1.696 -3.972 611 HD2 ARG 102 HD2 ARG 102 10.290 0.178 -5.825 612 HD3 ARG 102 HD1 ARG 102 11.788 -0.729 -5.625 613 HE ARG 102 HE ARG 102 11.027 -1.519 -3.585 614 HH11 ARG 102 HH11 ARG 102 8.778 0.825 -4.911 615 HH12 ARG 102 HH12 ARG 102 7.533 0.461 -3.758 616 HH21 ARG 102 HH21 ARG 102 9.376 -1.999 -2.084 617 HH22 ARG 102 HH22 ARG 102 7.876 -1.124 -2.146 618 H VAL 103 HN VAL 103 13.486 3.188 -3.036 619 HA VAL 103 HA VAL 103 11.080 3.582 -1.627 620 HB VAL 103 HB VAL 103 13.868 3.984 -0.551 621 HG11 VAL 103 HG11 VAL 103 12.928 3.365 1.592 622 HG12 VAL 103 HG12 VAL 103 11.328 3.237 0.855 623 HG13 VAL 103 HG13 VAL 103 12.132 4.803 0.942 624 HG21 VAL 103 HG21 VAL 103 12.234 1.477 -0.777 625 HG22 VAL 103 HG22 VAL 103 13.699 1.638 0.188 626 HG23 VAL 103 HG23 VAL 103 13.776 1.819 -1.564 627 H GLU 104 HN GLU 104 13.722 5.844 -2.416 628 HA GLU 104 HA GLU 104 12.589 8.041 -1.059 629 HB2 GLU 104 HB2 GLU 104 13.997 9.374 -2.846 630 HB3 GLU 104 HB1 GLU 104 14.770 8.514 -1.524 631 HG2 GLU 104 HG2 GLU 104 15.286 6.670 -2.971 632 HG3 GLU 104 HG1 GLU 104 14.406 7.423 -4.299 633 H VAL 105 HN VAL 105 12.278 7.065 -4.491 634 HA VAL 105 HA VAL 105 10.538 9.211 -5.104 635 HB VAL 105 HB VAL 105 11.244 8.327 -7.076 636 HG11 VAL 105 HG11 VAL 105 11.463 5.951 -7.604 637 HG12 VAL 105 HG12 VAL 105 10.849 5.548 -6.001 638 HG13 VAL 105 HG13 VAL 105 12.387 6.395 -6.170 639 HG21 VAL 105 HG21 VAL 105 8.859 8.440 -7.279 640 HG22 VAL 105 HG22 VAL 105 8.696 6.808 -6.629 641 HG23 VAL 105 HG23 VAL 105 9.466 7.061 -8.195 642 H GLN 106 HN GLN 106 9.925 5.945 -3.878 643 HA GLN 106 HA GLN 106 7.120 6.077 -3.911 644 HB2 GLN 106 HB2 GLN 106 8.973 4.611 -2.022 645 HB3 GLN 106 HB1 GLN 106 7.234 4.373 -2.072 646 HG2 GLN 106 HG2 GLN 106 9.124 3.878 -4.354 647 HG3 GLN 106 HG1 GLN 106 8.454 2.643 -3.293 648 HE21 GLN 106 HE21 GLN 106 7.756 4.925 -5.834 649 HE22 GLN 106 HE22 GLN 106 6.241 4.238 -6.304 650 H ASN 107 HN ASN 107 9.452 7.055 -1.421 651 HA ASN 107 HA ASN 107 7.786 7.958 0.582 652 HB2 ASN 107 HB2 ASN 107 10.202 7.936 0.805 653 HB3 ASN 107 HB1 ASN 107 10.367 9.191 -0.420 654 HD21 ASN 107 HD21 ASN 107 11.431 10.579 0.947 655 HD22 ASN 107 HD22 ASN 107 10.648 11.391 2.256 656 H ARG 108 HN ARG 108 8.616 9.571 -2.450 657 HA ARG 108 HA ARG 108 7.148 11.962 -1.775 658 HB2 ARG 108 HB2 ARG 108 8.459 11.069 -4.344 659 HB3 ARG 108 HB1 ARG 108 7.747 12.650 -4.078 660 HG2 ARG 108 HG2 ARG 108 9.366 13.066 -2.283 661 HG3 ARG 108 HG1 ARG 108 10.088 11.485 -2.591 662 HD2 ARG 108 HD2 ARG 108 9.957 13.822 -4.491 663 HD3 ARG 108 HD1 ARG 108 11.391 13.197 -3.681 664 HE ARG 108 HE ARG 108 9.889 11.792 -5.798 665 HH11 ARG 108 HH11 ARG 108 12.835 12.328 -3.985 666 HH12 ARG 108 HH12 ARG 108 13.802 11.322 -5.009 667 HH21 ARG 108 HH21 ARG 108 11.167 10.489 -7.166 668 HH22 ARG 108 HH22 ARG 108 12.854 10.263 -6.820 669 H VAL 109 HN VAL 109 6.843 9.392 -4.212 670 HA VAL 109 HA VAL 109 4.476 10.235 -5.399 671 HB VAL 109 HB VAL 109 5.434 7.393 -5.056 672 HG11 VAL 109 HG11 VAL 109 4.068 6.889 -7.018 673 HG12 VAL 109 HG12 VAL 109 3.482 8.551 -7.044 674 HG13 VAL 109 HG13 VAL 109 3.074 7.493 -5.691 675 HG21 VAL 109 HG21 VAL 109 7.119 8.720 -6.123 676 HG22 VAL 109 HG22 VAL 109 5.927 9.432 -7.214 677 HG23 VAL 109 HG23 VAL 109 6.335 7.721 -7.348 678 H TYR 110 HN TYR 110 4.941 8.041 -2.655 679 HA TYR 110 HA TYR 110 2.228 7.395 -2.303 680 HB2 TYR 110 HB2 TYR 110 4.575 7.385 -0.421 681 HB3 TYR 110 HB1 TYR 110 2.963 6.930 0.107 682 HD1 TYR 110 HD1 TYR 110 2.969 5.847 -3.142 683 HD2 TYR 110 HD2 TYR 110 4.818 4.948 0.584 684 HE1 TYR 110 HE1 TYR 110 3.339 3.537 -3.889 685 HE2 TYR 110 HE2 TYR 110 5.199 2.636 -0.158 686 HH TYR 110 HH TYR 110 4.866 1.664 -3.383 687 H LYS 111 HN LYS 111 4.171 10.079 -1.044 688 HA LYS 111 HA LYS 111 2.206 11.215 0.611 689 HB2 LYS 111 HB2 LYS 111 4.497 12.015 0.666 690 HB3 LYS 111 HB1 LYS 111 4.392 12.537 -1.009 691 HG2 LYS 111 HG2 LYS 111 2.705 14.200 -0.375 692 HG3 LYS 111 HG1 LYS 111 2.850 13.688 1.306 693 HD2 LYS 111 HD2 LYS 111 5.173 14.370 1.349 694 HD3 LYS 111 HD1 LYS 111 5.109 14.789 -0.363 695 HE2 LYS 111 HE2 LYS 111 3.463 16.087 1.804 696 HE3 LYS 111 HE1 LYS 111 4.943 16.756 1.126 697 HZ1 LYS 111 HZ1 LYS 111 3.047 17.760 0.085 698 HZ2 LYS 111 HZ2 LYS 111 2.408 16.257 -0.338 699 HZ3 LYS 111 HZ3 LYS 111 3.842 16.797 -1.054 700 H LYS 112 HN LYS 112 2.890 11.599 -2.818 701 HA LYS 112 HA LYS 112 0.894 13.518 -3.370 702 HB2 LYS 112 HB2 LYS 112 2.148 11.487 -5.227 703 HB3 LYS 112 HB1 LYS 112 1.289 12.942 -5.716 704 HG2 LYS 112 HG2 LYS 112 2.985 14.348 -4.890 705 HG3 LYS 112 HG1 LYS 112 3.741 13.037 -3.986 706 HD2 LYS 112 HD2 LYS 112 5.092 13.435 -5.901 707 HD3 LYS 112 HD1 LYS 112 4.220 11.931 -6.186 708 HE2 LYS 112 HE2 LYS 112 4.202 13.254 -8.194 709 HE3 LYS 112 HE1 LYS 112 2.571 13.181 -7.529 710 HZ1 LYS 112 HZ1 LYS 112 4.453 15.448 -7.158 711 HZ2 LYS 112 HZ2 LYS 112 2.849 15.379 -6.619 712 HZ3 LYS 112 HZ3 LYS 112 3.184 15.411 -8.275 713 H GLU 113 HN GLU 113 0.885 9.981 -3.337 714 HA GLU 113 HA GLU 113 -1.640 9.510 -4.419 715 HB2 GLU 113 HB2 GLU 113 -0.259 8.049 -2.158 716 HB3 GLU 113 HB1 GLU 113 -1.639 7.441 -3.066 717 HG2 GLU 113 HG2 GLU 113 0.952 8.175 -4.375 718 HG3 GLU 113 HG1 GLU 113 0.640 6.572 -3.726 719 H ILE 114 HN ILE 114 -0.716 10.014 -1.021 720 HA ILE 114 HA ILE 114 -3.234 9.785 0.115 721 HB ILE 114 HB ILE 114 -0.917 11.498 1.001 722 HG12 ILE 114 HG12 ILE 114 -1.763 8.708 1.795 723 HG13 ILE 114 HG11 ILE 114 -0.446 9.089 0.696 724 HG21 ILE 114 HG21 ILE 114 -3.346 10.570 2.531 725 HG22 ILE 114 HG22 ILE 114 -2.938 12.236 2.107 726 HG23 ILE 114 HG23 ILE 114 -1.930 11.340 3.249 727 HD11 ILE 114 HD11 ILE 114 0.755 10.194 2.465 728 HD12 ILE 114 HD12 ILE 114 0.341 8.546 2.938 729 HD13 ILE 114 HD13 ILE 114 -0.577 9.907 3.583 730 H GLN 115 HN GLN 115 -1.725 12.595 -1.383 731 HA GLN 115 HA GLN 115 -3.647 14.501 -0.588 732 HB2 GLN 115 HB2 GLN 115 -2.060 14.542 -3.141 733 HB3 GLN 115 HB1 GLN 115 -2.705 15.915 -2.253 734 HG2 GLN 115 HG2 GLN 115 -1.207 15.229 -0.347 735 HG3 GLN 115 HG1 GLN 115 -0.445 14.111 -1.479 736 HE21 GLN 115 HE21 GLN 115 -0.934 16.009 -3.701 737 HE22 GLN 115 HE22 GLN 115 0.280 17.221 -3.527 738 H ALA 116 HN ALA 116 -3.344 12.461 -3.448 739 HA ALA 116 HA ALA 116 -5.724 13.277 -4.740 740 HB1 ALA 116 HB1 ALA 116 -4.279 10.629 -4.880 741 HB2 ALA 116 HB2 ALA 116 -3.939 12.042 -5.880 742 HB3 ALA 116 HB3 ALA 116 -5.487 11.209 -6.027 743 H LEU 117 HN LEU 117 -4.955 10.620 -2.552 744 HA LEU 117 HA LEU 117 -7.484 9.423 -2.469 745 HB2 LEU 117 HB2 LEU 117 -5.354 9.486 -0.322 746 HB3 LEU 117 HB1 LEU 117 -6.686 8.348 -0.410 747 HG LEU 117 HG LEU 117 -4.505 8.576 -2.488 748 HD11 LEU 117 HD11 LEU 117 -4.835 6.505 -0.325 749 HD12 LEU 117 HD12 LEU 117 -3.630 7.794 -0.331 750 HD13 LEU 117 HD13 LEU 117 -3.588 6.543 -1.573 751 HD21 LEU 117 HD21 LEU 117 -6.602 7.701 -3.363 752 HD22 LEU 117 HD22 LEU 117 -6.650 6.500 -2.073 753 HD23 LEU 117 HD23 LEU 117 -5.370 6.441 -3.287 754 H ASP 118 HN ASP 118 -6.189 12.217 -0.840 755 HA ASP 118 HA ASP 118 -8.215 12.459 1.140 756 HB2 ASP 118 HB2 ASP 118 -6.154 13.637 1.462 757 HB3 ASP 118 HB1 ASP 118 -6.328 14.478 -0.076 758 H ALA 119 HN ALA 119 -7.910 13.576 -2.184 759 HA ALA 119 HA ALA 119 -10.308 15.110 -2.211 760 HB1 ALA 119 HB1 ALA 119 -8.919 13.715 -4.501 761 HB2 ALA 119 HB2 ALA 119 -8.572 15.348 -3.934 762 HB3 ALA 119 HB3 ALA 119 -10.144 14.976 -4.639 763 H GLU 120 HN GLU 120 -9.493 11.750 -2.845 764 HA GLU 120 HA GLU 120 -12.088 10.867 -3.463 765 HB2 GLU 120 HB2 GLU 120 -9.563 9.597 -2.543 766 HB3 GLU 120 HB1 GLU 120 -11.044 8.680 -2.401 767 HG2 GLU 120 HG2 GLU 120 -9.819 8.171 -4.435 768 HG3 GLU 120 HG1 GLU 120 -11.426 8.809 -4.763 769 H ILE 121 HN ILE 121 -10.471 11.545 -0.412 770 HA ILE 121 HA ILE 121 -12.279 10.348 1.324 771 HB ILE 121 HB ILE 121 -10.282 12.457 1.558 772 HG12 ILE 121 HG12 ILE 121 -9.889 11.330 3.722 773 HG13 ILE 121 HG11 ILE 121 -11.339 10.366 3.468 774 HG21 ILE 121 HG21 ILE 121 -11.102 13.451 3.622 775 HG22 ILE 121 HG22 ILE 121 -12.621 12.567 3.458 776 HG23 ILE 121 HG23 ILE 121 -12.185 13.802 2.275 777 HD11 ILE 121 HD11 ILE 121 -9.531 8.999 2.885 778 HD12 ILE 121 HD12 ILE 121 -8.761 10.281 1.949 779 HD13 ILE 121 HD13 ILE 121 -10.240 9.525 1.360 780 H ARG 122 HN ARG 122 -12.610 13.238 -0.601 781 HA ARG 122 HA ARG 122 -14.973 14.235 0.550 782 HB2 ARG 122 HB2 ARG 122 -13.712 15.542 -1.059 783 HB3 ARG 122 HB1 ARG 122 -14.014 14.347 -2.312 784 HG2 ARG 122 HG2 ARG 122 -16.401 14.850 -2.220 785 HG3 ARG 122 HG1 ARG 122 -16.099 16.052 -0.963 786 HD2 ARG 122 HD2 ARG 122 -14.736 17.344 -2.486 787 HD3 ARG 122 HD1 ARG 122 -14.919 16.114 -3.734 788 HE ARG 122 HE ARG 122 -17.450 17.062 -2.881 789 HH11 ARG 122 HH11 ARG 122 -14.669 17.965 -4.795 790 HH12 ARG 122 HH12 ARG 122 -15.568 19.003 -5.855 791 HH21 ARG 122 HH21 ARG 122 -18.652 18.415 -4.272 792 HH22 ARG 122 HH22 ARG 122 -17.849 19.241 -5.570 793 H LYS 123 HN LYS 123 -14.485 11.905 -2.111 794 HA LYS 123 HA LYS 123 -17.215 11.362 -2.573 795 HB2 LYS 123 HB2 LYS 123 -16.538 9.590 -3.904 796 HB3 LYS 123 HB1 LYS 123 -15.090 10.579 -3.898 797 HG2 LYS 123 HG2 LYS 123 -14.449 9.081 -1.848 798 HG3 LYS 123 HG1 LYS 123 -15.597 7.965 -2.571 799 HD2 LYS 123 HD2 LYS 123 -13.130 9.132 -3.833 800 HD3 LYS 123 HD1 LYS 123 -13.397 7.454 -3.373 801 HE2 LYS 123 HE2 LYS 123 -15.054 8.889 -5.420 802 HE3 LYS 123 HE1 LYS 123 -13.601 7.970 -5.809 803 HZ1 LYS 123 HZ1 LYS 123 -14.623 6.004 -4.970 804 HZ2 LYS 123 HZ2 LYS 123 -15.666 6.715 -6.095 805 HZ3 LYS 123 HZ3 LYS 123 -15.983 6.868 -4.445 806 H LEU 124 HN LEU 124 -14.933 10.109 -0.243 807 HA LEU 124 HA LEU 124 -16.548 8.067 0.827 808 HB2 LEU 124 HB2 LEU 124 -14.310 9.700 2.009 809 HB3 LEU 124 HB1 LEU 124 -15.063 8.359 2.849 810 HG LEU 124 HG LEU 124 -13.597 8.153 0.214 811 HD11 LEU 124 HD11 LEU 124 -12.777 7.315 3.000 812 HD12 LEU 124 HD12 LEU 124 -12.099 8.663 2.093 813 HD13 LEU 124 HD13 LEU 124 -11.870 7.016 1.518 814 HD21 LEU 124 HD21 LEU 124 -13.791 5.760 0.562 815 HD22 LEU 124 HD22 LEU 124 -15.382 6.513 0.497 816 HD23 LEU 124 HD23 LEU 124 -14.699 6.033 2.048 817 H GLU 125 HN GLU 125 -15.809 11.276 2.221 818 HA GLU 125 HA GLU 125 -17.478 11.024 4.402 819 HB2 GLU 125 HB2 GLU 125 -16.726 13.566 2.965 820 HB3 GLU 125 HB1 GLU 125 -17.414 13.476 4.581 821 HG2 GLU 125 HG2 GLU 125 -15.427 12.087 5.240 822 HG3 GLU 125 HG1 GLU 125 -14.730 12.476 3.673 823 H ARG 126 HN ARG 126 -18.323 12.167 1.156 824 HA ARG 126 HA ARG 126 -20.901 13.098 1.865 825 HB2 ARG 126 HB2 ARG 126 -21.407 13.072 -0.528 826 HB3 ARG 126 HB1 ARG 126 -19.838 13.797 -0.216 827 HG2 ARG 126 HG2 ARG 126 -18.781 11.641 -0.837 828 HG3 ARG 126 HG1 ARG 126 -20.379 11.038 -1.281 829 HD2 ARG 126 HD2 ARG 126 -19.095 13.495 -2.465 830 HD3 ARG 126 HD1 ARG 126 -19.040 11.895 -3.199 831 HE ARG 126 HE ARG 126 -21.692 12.334 -2.833 832 HH11 ARG 126 HH11 ARG 126 -19.144 14.171 -4.380 833 HH12 ARG 126 HH12 ARG 126 -20.199 14.857 -5.577 834 HH21 ARG 126 HH21 ARG 126 -23.073 13.223 -4.420 835 HH22 ARG 126 HH22 ARG 126 -22.423 14.320 -5.602 836 H LEU 127 HN LEU 127 -19.686 9.887 1.078 837 HA LEU 127 HA LEU 127 -22.392 8.816 1.087 838 HB2 LEU 127 HB2 LEU 127 -20.044 8.052 -0.145 839 HB3 LEU 127 HB1 LEU 127 -20.207 6.879 1.146 840 HG LEU 127 HG LEU 127 -22.289 7.464 -0.970 841 HD11 LEU 127 HD11 LEU 127 -20.369 6.329 -1.905 842 HD12 LEU 127 HD12 LEU 127 -21.744 5.229 -1.809 843 HD13 LEU 127 HD13 LEU 127 -20.437 5.114 -0.629 844 HD21 LEU 127 HD21 LEU 127 -23.245 6.753 1.193 845 HD22 LEU 127 HD22 LEU 127 -22.255 5.295 1.121 846 HD23 LEU 127 HD23 LEU 127 -23.500 5.574 -0.093 847 H LEU 128 HN LEU 128 -19.421 8.503 3.074 848 HA LEU 128 HA LEU 128 -20.213 7.058 5.190 849 HB2 LEU 128 HB2 LEU 128 -18.573 9.525 4.896 850 HB3 LEU 128 HB1 LEU 128 -18.883 8.896 6.501 851 HG LEU 128 HG LEU 128 -17.804 6.839 5.957 852 HD11 LEU 128 HD11 LEU 128 -16.707 6.385 3.859 853 HD12 LEU 128 HD12 LEU 128 -17.356 7.886 3.198 854 HD13 LEU 128 HD13 LEU 128 -18.447 6.576 3.649 855 HD21 LEU 128 HD21 LEU 128 -15.513 7.663 5.535 856 HD22 LEU 128 HD22 LEU 128 -16.382 8.601 6.749 857 HD23 LEU 128 HD23 LEU 128 -16.204 9.231 5.112 858 H GLU 129 HN GLU 129 -20.648 10.596 5.060 859 HA GLU 129 HA GLU 129 -22.221 10.774 7.380 860 HB2 GLU 129 HB2 GLU 129 -22.089 12.604 4.983 861 HB3 GLU 129 HB1 GLU 129 -22.835 13.020 6.520 862 HG2 GLU 129 HG2 GLU 129 -20.718 12.831 7.644 863 HG3 GLU 129 HG1 GLU 129 -19.941 12.282 6.165 864 H SER 130 HN SER 130 -23.028 9.900 4.156 865 HA SER 130 HA SER 130 -25.852 10.326 4.382 866 HB2 SER 130 HB2 SER 130 -24.666 10.309 2.197 867 HB3 SER 130 HB1 SER 130 -24.323 8.595 2.418 868 HG SER 130 HG SER 130 -26.980 9.466 2.592 869 H GLY 131 HN GLY 131 -23.837 8.173 5.872 870 HA2 GLY 131 HA2 GLY 131 -24.830 6.717 7.510 871 HA3 GLY 131 HA1 GLY 131 -26.120 6.381 6.369 872 H LEU 132 HN LEU 132 -22.760 6.393 5.359 873 HA LEU 132 HA LEU 132 -22.991 3.554 4.768 874 HB2 LEU 132 HB2 LEU 132 -22.187 5.049 3.031 875 HB3 LEU 132 HB1 LEU 132 -20.879 5.580 4.067 876 HG LEU 132 HG LEU 132 -20.009 3.227 4.040 877 HD11 LEU 132 HD11 LEU 132 -22.057 2.913 1.850 878 HD12 LEU 132 HD12 LEU 132 -22.063 2.084 3.407 879 HD13 LEU 132 HD13 LEU 132 -20.780 1.762 2.241 880 HD21 LEU 132 HD21 LEU 132 -19.012 3.461 1.834 881 HD22 LEU 132 HD22 LEU 132 -19.085 5.013 2.668 882 HD23 LEU 132 HD23 LEU 132 -20.245 4.643 1.397 883 H THR 133 HN THR 133 -20.789 5.740 6.477 884 HA THR 133 HA THR 133 -19.274 5.436 8.132 885 HB THR 133 HB THR 133 -20.425 2.675 8.568 886 HG1 THR 133 HG1 THR 133 -22.187 3.949 8.791 887 HG21 THR 133 HG21 THR 133 -19.060 4.628 10.430 888 HG22 THR 133 HG22 THR 133 -18.340 3.162 9.764 889 HG23 THR 133 HG23 THR 133 -19.699 3.048 10.883 Start of MODEL 9 1 H1 MET 1 HT1 MET 1 27.852 -5.097 8.375 2 H2 MET 1 HT2 MET 1 28.567 -6.045 9.575 3 H3 MET 1 HT3 MET 1 29.536 -5.221 8.462 4 HA MET 1 HA MET 1 27.775 -3.973 10.476 5 HB2 MET 1 HB2 MET 1 29.790 -3.296 11.626 6 HB3 MET 1 HB1 MET 1 29.804 -5.040 11.430 7 HG2 MET 1 HG2 MET 1 31.329 -3.080 9.728 8 HG3 MET 1 HG1 MET 1 32.000 -4.028 11.051 9 HE1 MET 1 HE1 MET 1 33.908 -4.960 9.495 10 HE2 MET 1 HE2 MET 1 33.286 -4.004 8.150 11 HE3 MET 1 HE3 MET 1 33.622 -5.722 7.931 12 H ASP 2 HN ASP 2 27.492 -1.799 10.306 13 HA ASP 2 HA ASP 2 28.472 -0.570 7.833 14 HB2 ASP 2 HB2 ASP 2 26.293 0.308 9.743 15 HB3 ASP 2 HB1 ASP 2 26.776 1.197 8.303 16 H SER 3 HN SER 3 30.615 -0.522 8.945 17 HA SER 3 HA SER 3 30.810 1.667 10.891 18 HB2 SER 3 HB2 SER 3 32.813 -0.501 10.237 19 HB3 SER 3 HB1 SER 3 32.969 0.705 11.515 20 HG SER 3 HG SER 3 30.596 -0.621 11.649 21 H ALA 4 HN ALA 4 31.763 0.664 7.697 22 HA ALA 4 HA ALA 4 33.587 2.870 7.322 23 HB1 ALA 4 HB1 ALA 4 33.604 2.205 4.975 24 HB2 ALA 4 HB2 ALA 4 32.273 1.089 5.269 25 HB3 ALA 4 HB3 ALA 4 33.842 0.803 6.018 26 H ILE 5 HN ILE 5 30.263 2.056 6.514 27 HA ILE 5 HA ILE 5 29.541 4.666 5.575 28 HB ILE 5 HB ILE 5 27.780 2.507 6.773 29 HG12 ILE 5 HG12 ILE 5 28.392 3.021 3.856 30 HG13 ILE 5 HG11 ILE 5 29.115 1.731 4.810 31 HG21 ILE 5 HG21 ILE 5 25.968 3.588 5.555 32 HG22 ILE 5 HG22 ILE 5 27.086 4.815 4.963 33 HG23 ILE 5 HG23 ILE 5 26.725 4.710 6.686 34 HD11 ILE 5 HD11 ILE 5 26.196 2.056 4.163 35 HD12 ILE 5 HD12 ILE 5 26.877 0.790 5.184 36 HD13 ILE 5 HD13 ILE 5 27.304 0.868 3.476 37 H SER 6 HN SER 6 28.847 6.428 6.832 38 HA SER 6 HA SER 6 29.254 6.069 9.703 39 HB2 SER 6 HB2 SER 6 30.445 7.924 8.545 40 HB3 SER 6 HB1 SER 6 28.885 8.636 8.139 41 HG SER 6 HG SER 6 30.224 9.150 10.248 42 H LYS 7 HN LYS 7 27.719 7.387 11.135 43 HA LYS 7 HA LYS 7 25.095 6.492 10.866 44 HB2 LYS 7 HB2 LYS 7 26.200 7.402 12.956 45 HB3 LYS 7 HB1 LYS 7 25.907 9.014 12.317 46 HG2 LYS 7 HG2 LYS 7 23.494 8.526 12.271 47 HG3 LYS 7 HG1 LYS 7 23.822 6.952 12.994 48 HD2 LYS 7 HD2 LYS 7 24.369 9.653 14.218 49 HD3 LYS 7 HD1 LYS 7 23.120 8.509 14.702 50 HE2 LYS 7 HE2 LYS 7 26.098 8.049 14.871 51 HE3 LYS 7 HE1 LYS 7 25.037 8.440 16.221 52 HZ1 LYS 7 HZ1 LYS 7 24.875 5.993 14.547 53 HZ2 LYS 7 HZ2 LYS 7 23.854 6.363 15.839 54 HZ3 LYS 7 HZ3 LYS 7 25.496 6.074 16.115 55 H GLU 8 HN GLU 8 26.724 9.280 9.632 56 HA GLU 8 HA GLU 8 24.806 10.969 8.716 57 HB2 GLU 8 HB2 GLU 8 27.262 9.932 7.285 58 HB3 GLU 8 HB1 GLU 8 26.321 11.319 6.740 59 HG2 GLU 8 HG2 GLU 8 27.751 11.095 9.377 60 HG3 GLU 8 HG1 GLU 8 28.304 12.007 7.972 61 H ASP 9 HN ASP 9 26.081 8.278 6.771 62 HA ASP 9 HA ASP 9 23.985 8.544 4.848 63 HB2 ASP 9 HB2 ASP 9 26.303 6.677 5.176 64 HB3 ASP 9 HB1 ASP 9 25.075 6.367 3.958 65 H GLU 10 HN GLU 10 24.579 6.535 7.602 66 HA GLU 10 HA GLU 10 22.725 4.500 7.076 67 HB2 GLU 10 HB2 GLU 10 24.371 4.323 8.857 68 HB3 GLU 10 HB1 GLU 10 23.644 5.683 9.701 69 HG2 GLU 10 HG2 GLU 10 21.669 4.433 10.153 70 HG3 GLU 10 HG1 GLU 10 22.231 3.092 9.154 71 H GLU 11 HN GLU 11 22.311 7.362 9.158 72 HA GLU 11 HA GLU 11 19.581 7.209 9.504 73 HB2 GLU 11 HB2 GLU 11 21.378 9.627 9.396 74 HB3 GLU 11 HB1 GLU 11 19.698 9.681 9.920 75 HG2 GLU 11 HG2 GLU 11 21.792 7.947 11.199 76 HG3 GLU 11 HG1 GLU 11 21.380 9.564 11.760 77 H ARG 12 HN ARG 12 21.375 8.475 6.748 78 HA ARG 12 HA ARG 12 19.258 9.816 5.466 79 HB2 ARG 12 HB2 ARG 12 21.638 8.374 4.282 80 HB3 ARG 12 HB1 ARG 12 20.522 9.351 3.341 81 HG2 ARG 12 HG2 ARG 12 21.140 11.322 4.606 82 HG3 ARG 12 HG1 ARG 12 22.212 10.353 5.619 83 HD2 ARG 12 HD2 ARG 12 23.584 11.414 4.005 84 HD3 ARG 12 HD1 ARG 12 23.449 9.729 3.519 85 HE ARG 12 HE ARG 12 21.503 11.405 2.257 86 HH11 ARG 12 HH11 ARG 12 24.756 10.119 2.072 87 HH12 ARG 12 HH12 ARG 12 24.974 10.586 0.411 88 HH21 ARG 12 HH21 ARG 12 21.777 11.966 0.048 89 HH22 ARG 12 HH22 ARG 12 23.284 11.618 -0.740 90 H TYR 13 HN TYR 13 20.390 6.463 5.174 91 HA TYR 13 HA TYR 13 18.370 5.763 3.286 92 HB2 TYR 13 HB2 TYR 13 20.505 4.617 3.274 93 HB3 TYR 13 HB1 TYR 13 20.258 4.069 4.929 94 HD1 TYR 13 HD1 TYR 13 19.790 1.830 5.090 95 HD2 TYR 13 HD2 TYR 13 18.274 3.998 1.763 96 HE1 TYR 13 HE1 TYR 13 18.709 -0.219 4.259 97 HE2 TYR 13 HE2 TYR 13 17.188 1.961 0.918 98 HH TYR 13 HH TYR 13 16.830 -0.850 2.797 99 H GLN 14 HN GLN 14 18.889 4.986 6.720 100 HA GLN 14 HA GLN 14 16.731 3.270 7.072 101 HB2 GLN 14 HB2 GLN 14 18.016 5.182 9.021 102 HB3 GLN 14 HB1 GLN 14 16.865 3.937 9.482 103 HG2 GLN 14 HG2 GLN 14 19.493 3.420 8.122 104 HG3 GLN 14 HG1 GLN 14 19.215 3.322 9.857 105 HE21 GLN 14 HE21 GLN 14 19.728 1.168 9.964 106 HE22 GLN 14 HE22 GLN 14 18.706 -0.073 9.327 107 H LYS 15 HN LYS 15 16.853 6.718 7.902 108 HA LYS 15 HA LYS 15 14.192 6.955 8.637 109 HB2 LYS 15 HB2 LYS 15 16.027 9.059 7.501 110 HB3 LYS 15 HB1 LYS 15 14.485 9.391 8.280 111 HG2 LYS 15 HG2 LYS 15 16.848 8.063 9.590 112 HG3 LYS 15 HG1 LYS 15 16.389 9.752 9.778 113 HD2 LYS 15 HD2 LYS 15 14.722 7.363 10.572 114 HD3 LYS 15 HD1 LYS 15 15.630 8.402 11.670 115 HE2 LYS 15 HE2 LYS 15 14.261 10.323 10.848 116 HE3 LYS 15 HE1 LYS 15 13.276 9.165 9.957 117 HZ1 LYS 15 HZ1 LYS 15 13.646 9.255 12.902 118 HZ2 LYS 15 HZ2 LYS 15 12.754 8.079 12.075 119 HZ3 LYS 15 HZ3 LYS 15 12.248 9.691 12.052 120 H LEU 16 HN LEU 16 15.625 6.903 5.478 121 HA LEU 16 HA LEU 16 13.425 8.068 4.090 122 HB2 LEU 16 HB2 LEU 16 15.785 7.940 3.263 123 HB3 LEU 16 HB1 LEU 16 15.544 6.225 3.007 124 HG LEU 16 HG LEU 16 14.068 6.573 1.201 125 HD11 LEU 16 HD11 LEU 16 13.255 8.902 0.665 126 HD12 LEU 16 HD12 LEU 16 13.814 9.382 2.264 127 HD13 LEU 16 HD13 LEU 16 12.550 8.159 2.101 128 HD21 LEU 16 HD21 LEU 16 15.301 8.041 -0.283 129 HD22 LEU 16 HD22 LEU 16 16.404 7.087 0.712 130 HD23 LEU 16 HD23 LEU 16 16.111 8.782 1.100 131 H VAL 17 HN VAL 17 14.548 4.717 4.495 132 HA VAL 17 HA VAL 17 12.319 3.505 3.252 133 HB VAL 17 HB VAL 17 13.108 1.463 4.018 134 HG11 VAL 17 HG11 VAL 17 15.572 1.567 4.014 135 HG12 VAL 17 HG12 VAL 17 15.460 3.322 4.179 136 HG13 VAL 17 HG13 VAL 17 14.834 2.529 2.731 137 HG21 VAL 17 HG21 VAL 17 14.300 2.816 6.437 138 HG22 VAL 17 HG22 VAL 17 14.349 1.088 6.086 139 HG23 VAL 17 HG23 VAL 17 12.805 1.881 6.411 140 H THR 18 HN THR 18 12.918 4.777 6.399 141 HA THR 18 HA THR 18 10.746 3.753 7.820 142 HB THR 18 HB THR 18 12.536 6.135 8.033 143 HG1 THR 18 HG1 THR 18 13.305 4.087 8.704 144 HG21 THR 18 HG21 THR 18 10.498 7.006 8.820 145 HG22 THR 18 HG22 THR 18 11.487 6.616 10.230 146 HG23 THR 18 HG23 THR 18 10.160 5.552 9.758 147 H GLU 19 HN GLU 19 11.170 6.800 6.021 148 HA GLU 19 HA GLU 19 8.636 7.865 6.398 149 HB2 GLU 19 HB2 GLU 19 10.459 8.054 3.992 150 HB3 GLU 19 HB1 GLU 19 9.033 9.058 4.237 151 HG2 GLU 19 HG2 GLU 19 10.028 9.887 6.342 152 HG3 GLU 19 HG1 GLU 19 11.484 8.954 5.989 153 H ASN 20 HN ASN 20 9.806 5.625 3.942 154 HA ASN 20 HA ASN 20 7.466 5.314 2.478 155 HB2 ASN 20 HB2 ASN 20 9.811 3.529 2.999 156 HB3 ASN 20 HB1 ASN 20 8.434 2.929 2.074 157 HD21 ASN 20 HD21 ASN 20 11.112 3.299 1.153 158 HD22 ASN 20 HD22 ASN 20 11.060 4.479 -0.110 159 H GLU 21 HN GLU 21 8.552 3.523 5.361 160 HA GLU 21 HA GLU 21 6.401 1.771 5.582 161 HB2 GLU 21 HB2 GLU 21 7.993 3.090 7.781 162 HB3 GLU 21 HB1 GLU 21 7.021 1.633 7.950 163 HG2 GLU 21 HG2 GLU 21 9.213 1.774 5.939 164 HG3 GLU 21 HG1 GLU 21 9.563 1.424 7.624 165 H GLN 22 HN GLN 22 6.773 5.092 6.697 166 HA GLN 22 HA GLN 22 4.442 5.125 8.318 167 HB2 GLN 22 HB2 GLN 22 5.811 7.515 7.088 168 HB3 GLN 22 HB1 GLN 22 4.808 7.484 8.531 169 HG2 GLN 22 HG2 GLN 22 6.531 5.974 9.578 170 HG3 GLN 22 HG1 GLN 22 7.566 6.333 8.196 171 HE21 GLN 22 HE21 GLN 22 8.409 8.415 7.972 172 HE22 GLN 22 HE22 GLN 22 8.441 9.535 9.283 173 H LEU 23 HN LEU 23 5.108 6.558 5.103 174 HA LEU 23 HA LEU 23 2.432 7.586 5.061 175 HB2 LEU 23 HB2 LEU 23 3.050 8.918 3.330 176 HB3 LEU 23 HB1 LEU 23 4.583 8.657 4.111 177 HG LEU 23 HG LEU 23 3.632 7.336 1.589 178 HD11 LEU 23 HD11 LEU 23 5.421 8.637 0.559 179 HD12 LEU 23 HD12 LEU 23 5.775 9.374 2.119 180 HD13 LEU 23 HD13 LEU 23 4.227 9.678 1.335 181 HD21 LEU 23 HD21 LEU 23 6.262 7.063 3.023 182 HD22 LEU 23 HD22 LEU 23 5.888 6.419 1.425 183 HD23 LEU 23 HD23 LEU 23 5.042 5.803 2.845 184 H GLN 24 HN GLN 24 3.934 4.713 3.840 185 HA GLN 24 HA GLN 24 1.956 4.058 1.919 186 HB2 GLN 24 HB2 GLN 24 2.753 1.799 2.043 187 HB3 GLN 24 HB1 GLN 24 4.150 2.854 2.187 188 HG2 GLN 24 HG2 GLN 24 4.084 2.548 4.633 189 HG3 GLN 24 HG1 GLN 24 2.750 1.418 4.429 190 HE21 GLN 24 HE21 GLN 24 5.460 1.643 2.236 191 HE22 GLN 24 HE22 GLN 24 6.157 0.112 2.629 192 H ARG 25 HN ARG 25 2.161 3.807 5.388 193 HA ARG 25 HA ARG 25 -0.200 2.307 5.805 194 HB2 ARG 25 HB2 ARG 25 1.132 2.275 7.667 195 HB3 ARG 25 HB1 ARG 25 1.725 3.907 7.401 196 HG2 ARG 25 HG2 ARG 25 -0.703 4.566 8.023 197 HG3 ARG 25 HG1 ARG 25 -0.724 2.987 8.814 198 HD2 ARG 25 HD2 ARG 25 1.080 5.339 9.349 199 HD3 ARG 25 HD1 ARG 25 -0.025 4.535 10.465 200 HE ARG 25 HE ARG 25 1.587 2.541 10.060 201 HH11 ARG 25 HH11 ARG 25 2.473 5.921 10.329 202 HH12 ARG 25 HH12 ARG 25 4.061 5.585 10.933 203 HH21 ARG 25 HH21 ARG 25 3.691 2.098 10.822 204 HH22 ARG 25 HH22 ARG 25 4.762 3.411 11.200 205 H LEU 26 HN LEU 26 0.612 5.738 5.741 206 HA LEU 26 HA LEU 26 -1.862 6.760 6.556 207 HB2 LEU 26 HB2 LEU 26 0.226 8.006 4.771 208 HB3 LEU 26 HB1 LEU 26 -1.041 8.881 5.623 209 HG LEU 26 HG LEU 26 1.174 7.291 6.930 210 HD11 LEU 26 HD11 LEU 26 1.939 9.375 5.862 211 HD12 LEU 26 HD12 LEU 26 2.103 9.385 7.615 212 HD13 LEU 26 HD13 LEU 26 0.783 10.271 6.847 213 HD21 LEU 26 HD21 LEU 26 0.350 8.247 9.019 214 HD22 LEU 26 HD22 LEU 26 -0.883 7.256 8.236 215 HD23 LEU 26 HD23 LEU 26 -0.976 9.017 8.148 216 H ILE 27 HN ILE 27 -0.620 5.966 3.350 217 HA ILE 27 HA ILE 27 -2.809 6.782 1.812 218 HB ILE 27 HB ILE 27 -1.041 4.358 1.449 219 HG12 ILE 27 HG12 ILE 27 -0.875 7.062 0.121 220 HG13 ILE 27 HG11 ILE 27 0.092 6.593 1.523 221 HG21 ILE 27 HG21 ILE 27 -2.835 5.718 -0.550 222 HG22 ILE 27 HG22 ILE 27 -3.108 4.136 0.175 223 HG23 ILE 27 HG23 ILE 27 -1.727 4.394 -0.891 224 HD11 ILE 27 HD11 ILE 27 1.327 6.365 -0.566 225 HD12 ILE 27 HD12 ILE 27 0.114 5.231 -1.159 226 HD13 ILE 27 HD13 ILE 27 1.107 4.809 0.235 227 H THR 28 HN THR 28 -2.123 3.668 3.348 228 HA THR 28 HA THR 28 -4.437 2.324 2.638 229 HB THR 28 HB THR 28 -2.172 1.834 4.251 230 HG1 THR 28 HG1 THR 28 -3.547 0.554 2.577 231 HG21 THR 28 HG21 THR 28 -4.739 1.198 5.701 232 HG22 THR 28 HG22 THR 28 -3.415 2.223 6.266 233 HG23 THR 28 HG23 THR 28 -3.171 0.485 6.083 234 H GLN 29 HN GLN 29 -3.863 4.476 5.411 235 HA GLN 29 HA GLN 29 -6.297 3.881 6.747 236 HB2 GLN 29 HB2 GLN 29 -4.851 6.519 6.933 237 HB3 GLN 29 HB1 GLN 29 -5.833 5.732 8.160 238 HG2 GLN 29 HG2 GLN 29 -3.938 3.875 7.846 239 HG3 GLN 29 HG1 GLN 29 -3.018 5.302 7.411 240 HE21 GLN 29 HE21 GLN 29 -4.710 3.650 9.936 241 HE22 GLN 29 HE22 GLN 29 -4.120 4.618 11.244 242 H LYS 30 HN LYS 30 -5.327 6.393 4.499 243 HA LYS 30 HA LYS 30 -7.803 7.794 4.528 244 HB2 LYS 30 HB2 LYS 30 -5.469 7.822 2.618 245 HB3 LYS 30 HB1 LYS 30 -6.865 8.882 2.450 246 HG2 LYS 30 HG2 LYS 30 -6.414 9.888 4.590 247 HG3 LYS 30 HG1 LYS 30 -5.094 8.757 4.880 248 HD2 LYS 30 HD2 LYS 30 -3.774 9.718 3.160 249 HD3 LYS 30 HD1 LYS 30 -5.138 10.655 2.545 250 HE2 LYS 30 HE2 LYS 30 -3.561 12.038 3.835 251 HE3 LYS 30 HE1 LYS 30 -5.168 12.001 4.553 252 HZ1 LYS 30 HZ1 LYS 30 -3.558 11.765 6.269 253 HZ2 LYS 30 HZ2 LYS 30 -2.773 10.505 5.463 254 HZ3 LYS 30 HZ3 LYS 30 -4.328 10.271 6.090 255 H GLU 31 HN GLU 31 -6.379 5.452 2.259 256 HA GLU 31 HA GLU 31 -8.267 5.516 0.253 257 HB2 GLU 31 HB2 GLU 31 -6.468 3.367 1.294 258 HB3 GLU 31 HB1 GLU 31 -7.637 2.982 0.040 259 HG2 GLU 31 HG2 GLU 31 -5.696 5.253 -0.230 260 HG3 GLU 31 HG1 GLU 31 -5.291 3.603 -0.699 261 H GLU 32 HN GLU 32 -8.292 3.247 3.026 262 HA GLU 32 HA GLU 32 -10.763 2.095 2.256 263 HB2 GLU 32 HB2 GLU 32 -10.754 1.087 4.532 264 HB3 GLU 32 HB1 GLU 32 -9.290 0.799 3.610 265 HG2 GLU 32 HG2 GLU 32 -8.157 2.566 4.870 266 HG3 GLU 32 HG1 GLU 32 -9.632 2.828 5.805 267 H LYS 33 HN LYS 33 -9.948 4.857 4.201 268 HA LYS 33 HA LYS 33 -12.478 5.094 5.499 269 HB2 LYS 33 HB2 LYS 33 -10.327 6.117 6.300 270 HB3 LYS 33 HB1 LYS 33 -10.447 7.272 4.981 271 HG2 LYS 33 HG2 LYS 33 -12.559 8.097 5.894 272 HG3 LYS 33 HG1 LYS 33 -12.437 6.939 7.217 273 HD2 LYS 33 HD2 LYS 33 -10.486 9.164 6.628 274 HD3 LYS 33 HD1 LYS 33 -11.698 9.167 7.909 275 HE2 LYS 33 HE2 LYS 33 -9.344 7.298 7.649 276 HE3 LYS 33 HE1 LYS 33 -9.531 8.600 8.820 277 HZ1 LYS 33 HZ1 LYS 33 -11.439 7.419 9.751 278 HZ2 LYS 33 HZ2 LYS 33 -10.035 6.482 9.825 279 HZ3 LYS 33 HZ3 LYS 33 -11.206 6.155 8.653 280 H ILE 34 HN ILE 34 -11.013 6.490 2.608 281 HA ILE 34 HA ILE 34 -13.139 8.209 1.913 282 HB ILE 34 HB ILE 34 -11.037 6.889 0.182 283 HG12 ILE 34 HG12 ILE 34 -11.219 9.779 0.989 284 HG13 ILE 34 HG11 ILE 34 -10.459 8.589 2.048 285 HG21 ILE 34 HG21 ILE 34 -13.083 8.993 -0.490 286 HG22 ILE 34 HG22 ILE 34 -12.829 7.435 -1.281 287 HG23 ILE 34 HG23 ILE 34 -11.627 8.716 -1.446 288 HD11 ILE 34 HD11 ILE 34 -9.616 9.210 -0.776 289 HD12 ILE 34 HD12 ILE 34 -8.845 8.052 0.309 290 HD13 ILE 34 HD13 ILE 34 -8.817 9.776 0.691 291 H ARG 35 HN ARG 35 -12.553 4.772 1.259 292 HA ARG 35 HA ARG 35 -14.498 4.275 -0.609 293 HB2 ARG 35 HB2 ARG 35 -12.690 2.765 0.539 294 HB3 ARG 35 HB1 ARG 35 -14.008 2.376 1.644 295 HG2 ARG 35 HG2 ARG 35 -15.377 1.834 -0.359 296 HG3 ARG 35 HG1 ARG 35 -13.905 1.992 -1.307 297 HD2 ARG 35 HD2 ARG 35 -12.868 0.188 -0.106 298 HD3 ARG 35 HD1 ARG 35 -14.227 0.098 1.014 299 HE ARG 35 HE ARG 35 -15.091 -0.287 -1.663 300 HH11 ARG 35 HH11 ARG 35 -13.430 -1.912 0.949 301 HH12 ARG 35 HH12 ARG 35 -13.963 -3.493 0.472 302 HH21 ARG 35 HH21 ARG 35 -15.777 -2.371 -2.308 303 HH22 ARG 35 HH22 ARG 35 -15.285 -3.755 -1.383 304 H VAL 36 HN VAL 36 -14.734 4.642 2.876 305 HA VAL 36 HA VAL 36 -17.454 3.785 3.052 306 HB VAL 36 HB VAL 36 -16.085 5.545 5.070 307 HG11 VAL 36 HG11 VAL 36 -18.444 5.037 5.434 308 HG12 VAL 36 HG12 VAL 36 -17.435 4.257 6.654 309 HG13 VAL 36 HG13 VAL 36 -18.098 3.311 5.321 310 HG21 VAL 36 HG21 VAL 36 -15.115 3.546 6.074 311 HG22 VAL 36 HG22 VAL 36 -14.509 3.784 4.431 312 HG23 VAL 36 HG23 VAL 36 -15.747 2.567 4.750 313 H LEU 37 HN LEU 37 -15.811 6.801 2.487 314 HA LEU 37 HA LEU 37 -18.137 8.466 2.688 315 HB2 LEU 37 HB2 LEU 37 -15.329 8.789 2.020 316 HB3 LEU 37 HB1 LEU 37 -16.361 9.713 0.938 317 HG LEU 37 HG LEU 37 -15.547 10.956 2.952 318 HD11 LEU 37 HD11 LEU 37 -17.737 11.965 3.441 319 HD12 LEU 37 HD12 LEU 37 -18.530 10.604 2.643 320 HD13 LEU 37 HD13 LEU 37 -17.500 11.702 1.713 321 HD21 LEU 37 HD21 LEU 37 -17.449 9.110 4.387 322 HD22 LEU 37 HD22 LEU 37 -16.595 10.483 5.097 323 HD23 LEU 37 HD23 LEU 37 -15.694 9.077 4.524 324 H ARG 38 HN ARG 38 -16.604 6.563 0.284 325 HA ARG 38 HA ARG 38 -17.952 7.554 -1.985 326 HB2 ARG 38 HB2 ARG 38 -16.200 6.368 -2.721 327 HB3 ARG 38 HB1 ARG 38 -16.141 5.390 -1.270 328 HG2 ARG 38 HG2 ARG 38 -17.858 3.933 -2.179 329 HG3 ARG 38 HG1 ARG 38 -17.917 4.915 -3.651 330 HD2 ARG 38 HD2 ARG 38 -15.566 4.448 -4.072 331 HD3 ARG 38 HD1 ARG 38 -15.469 3.514 -2.584 332 HE ARG 38 HE ARG 38 -17.457 2.464 -4.315 333 HH11 ARG 38 HH11 ARG 38 -13.997 2.661 -3.824 334 HH12 ARG 38 HH12 ARG 38 -13.654 1.183 -4.674 335 HH21 ARG 38 HH21 ARG 38 -17.011 0.508 -5.446 336 HH22 ARG 38 HH22 ARG 38 -15.372 -0.047 -5.576 337 H GLN 39 HN GLN 39 -18.810 5.329 0.528 338 HA GLN 39 HA GLN 39 -21.191 4.327 -0.664 339 HB2 GLN 39 HB2 GLN 39 -20.611 4.666 2.279 340 HB3 GLN 39 HB1 GLN 39 -21.729 3.529 1.535 341 HG2 GLN 39 HG2 GLN 39 -18.749 3.504 1.159 342 HG3 GLN 39 HG1 GLN 39 -19.629 2.494 2.294 343 HE21 GLN 39 HE21 GLN 39 -21.867 2.137 0.425 344 HE22 GLN 39 HE22 GLN 39 -21.308 1.011 -0.760 345 H ARG 40 HN ARG 40 -20.441 7.117 1.399 346 HA ARG 40 HA ARG 40 -23.081 8.087 1.624 347 HB2 ARG 40 HB2 ARG 40 -20.366 9.295 1.899 348 HB3 ARG 40 HB1 ARG 40 -21.732 10.375 1.725 349 HG2 ARG 40 HG2 ARG 40 -21.550 10.214 4.006 350 HG3 ARG 40 HG1 ARG 40 -22.752 8.972 3.659 351 HD2 ARG 40 HD2 ARG 40 -20.905 7.299 3.638 352 HD3 ARG 40 HD1 ARG 40 -19.812 8.573 4.164 353 HE ARG 40 HE ARG 40 -22.113 8.277 5.861 354 HH11 ARG 40 HH11 ARG 40 -18.878 7.132 5.207 355 HH12 ARG 40 HH12 ARG 40 -18.615 6.550 6.822 356 HH21 ARG 40 HH21 ARG 40 -21.774 7.510 7.995 357 HH22 ARG 40 HH22 ARG 40 -20.262 6.756 8.400 358 H LEU 41 HN LEU 41 -20.540 8.526 -0.758 359 HA LEU 41 HA LEU 41 -21.853 10.400 -2.393 360 HB2 LEU 41 HB2 LEU 41 -19.962 8.275 -3.379 361 HB3 LEU 41 HB1 LEU 41 -20.278 9.842 -4.094 362 HG LEU 41 HG LEU 41 -18.780 9.292 -1.536 363 HD11 LEU 41 HD11 LEU 41 -17.546 8.815 -3.582 364 HD12 LEU 41 HD12 LEU 41 -16.894 10.228 -2.756 365 HD13 LEU 41 HD13 LEU 41 -17.908 10.432 -4.183 366 HD21 LEU 41 HD21 LEU 41 -18.399 11.671 -1.379 367 HD22 LEU 41 HD22 LEU 41 -20.132 11.340 -1.349 368 HD23 LEU 41 HD23 LEU 41 -19.378 11.952 -2.821 369 H VAL 42 HN VAL 42 -22.198 6.956 -2.037 370 HA VAL 42 HA VAL 42 -23.553 6.314 -4.400 371 HB VAL 42 HB VAL 42 -23.848 5.210 -1.598 372 HG11 VAL 42 HG11 VAL 42 -24.993 3.276 -2.650 373 HG12 VAL 42 HG12 VAL 42 -25.088 4.194 -4.151 374 HG13 VAL 42 HG13 VAL 42 -25.927 4.769 -2.711 375 HG21 VAL 42 HG21 VAL 42 -22.590 3.305 -2.507 376 HG22 VAL 42 HG22 VAL 42 -21.683 4.814 -2.606 377 HG23 VAL 42 HG23 VAL 42 -22.449 4.148 -4.049 378 H GLU 43 HN GLU 43 -24.811 7.546 -1.313 379 HA GLU 43 HA GLU 43 -27.510 7.625 -2.116 380 HB2 GLU 43 HB2 GLU 43 -26.042 9.265 -0.047 381 HB3 GLU 43 HB1 GLU 43 -27.790 9.235 -0.233 382 HG2 GLU 43 HG2 GLU 43 -27.805 6.848 0.266 383 HG3 GLU 43 HG1 GLU 43 -26.053 6.876 0.456 384 H ARG 44 HN ARG 44 -24.844 9.823 -2.554 385 HA ARG 44 HA ARG 44 -26.469 11.989 -3.518 386 HB2 ARG 44 HB2 ARG 44 -23.484 11.541 -3.716 387 HB3 ARG 44 HB1 ARG 44 -24.317 13.044 -4.098 388 HG2 ARG 44 HG2 ARG 44 -25.095 13.171 -1.760 389 HG3 ARG 44 HG1 ARG 44 -24.169 11.713 -1.400 390 HD2 ARG 44 HD2 ARG 44 -22.917 13.668 -0.728 391 HD3 ARG 44 HD1 ARG 44 -22.112 12.883 -2.085 392 HE ARG 44 HE ARG 44 -23.519 14.699 -3.383 393 HH11 ARG 44 HH11 ARG 44 -21.654 15.037 -0.437 394 HH12 ARG 44 HH12 ARG 44 -21.318 16.718 -0.699 395 HH21 ARG 44 HH21 ARG 44 -23.066 16.899 -3.731 396 HH22 ARG 44 HH22 ARG 44 -22.121 17.778 -2.568 397 H GLY 45 HN GLY 45 -24.634 9.350 -4.918 398 HA2 GLY 45 HA2 GLY 45 -25.820 8.384 -6.868 399 HA3 GLY 45 HA1 GLY 45 -25.843 10.013 -7.528 400 H ASP 46 HN ASP 46 -23.075 8.638 -5.859 401 HA ASP 46 HA ASP 46 -21.517 8.793 -8.315 402 HB2 ASP 46 HB2 ASP 46 -20.514 9.698 -6.288 403 HB3 ASP 46 HB1 ASP 46 -20.706 8.151 -5.473 404 H ALA 47 HN ALA 47 -23.471 6.582 -6.910 405 HA ALA 47 HA ALA 47 -21.888 4.209 -7.113 406 HB1 ALA 47 HB1 ALA 47 -23.940 3.028 -6.600 407 HB2 ALA 47 HB2 ALA 47 -24.875 4.498 -6.880 408 HB3 ALA 47 HB3 ALA 47 -23.744 4.417 -5.532 409 H LYS 48 HN LYS 48 -22.639 6.056 -9.532 410 HA LYS 48 HA LYS 48 -24.125 4.504 -11.341 411 HB2 LYS 48 HB2 LYS 48 -22.201 6.773 -11.616 412 HB3 LYS 48 HB1 LYS 48 -22.746 5.921 -13.059 413 HG2 LYS 48 HG2 LYS 48 -24.600 7.123 -11.016 414 HG3 LYS 48 HG1 LYS 48 -24.083 7.941 -12.495 415 HD2 LYS 48 HD2 LYS 48 -25.166 6.378 -13.870 416 HD3 LYS 48 HD1 LYS 48 -25.342 5.214 -12.560 417 HE2 LYS 48 HE2 LYS 48 -26.719 7.882 -12.662 418 HE3 LYS 48 HE1 LYS 48 -27.436 6.368 -13.195 419 HZ1 LYS 48 HZ1 LYS 48 -28.113 6.930 -10.950 420 HZ2 LYS 48 HZ2 LYS 48 -26.503 6.952 -10.439 421 HZ3 LYS 48 HZ3 LYS 48 -27.206 5.497 -10.961 422 H GLY 49 HN GLY 49 -20.741 4.448 -10.447 423 HA2 GLY 49 HA2 GLY 49 -19.787 2.862 -12.582 424 HA3 GLY 49 HA1 GLY 49 -19.041 3.009 -10.998 425 H THR 50 HN THR 50 -21.337 2.043 -9.537 426 HA THR 50 HA THR 50 -21.809 -0.650 -10.524 427 HB THR 50 HB THR 50 -20.646 -0.262 -7.762 428 HG1 THR 50 HG1 THR 50 -19.389 -0.333 -10.185 429 HG21 THR 50 HG21 THR 50 -22.021 -2.266 -8.101 430 HG22 THR 50 HG22 THR 50 -20.326 -2.686 -7.856 431 HG23 THR 50 HG23 THR 50 -21.019 -2.720 -9.478 432 H GLU 51 HN GLU 51 -23.993 -0.058 -10.622 433 HA GLU 51 HA GLU 51 -25.239 1.171 -8.330 434 HB2 GLU 51 HB2 GLU 51 -26.480 0.206 -10.912 435 HB3 GLU 51 HB1 GLU 51 -27.272 1.199 -9.698 436 HG2 GLU 51 HG2 GLU 51 -25.501 2.912 -10.075 437 HG3 GLU 51 HG1 GLU 51 -24.952 1.947 -11.440 438 H LEU 52 HN LEU 52 -25.348 -0.154 -6.649 439 HA LEU 52 HA LEU 52 -26.476 -2.840 -7.010 440 HB2 LEU 52 HB2 LEU 52 -25.107 -1.651 -4.597 441 HB3 LEU 52 HB1 LEU 52 -25.584 -3.326 -4.799 442 HG LEU 52 HG LEU 52 -23.451 -1.883 -6.375 443 HD11 LEU 52 HD11 LEU 52 -21.919 -3.413 -5.242 444 HD12 LEU 52 HD12 LEU 52 -23.263 -4.068 -4.308 445 HD13 LEU 52 HD13 LEU 52 -22.778 -2.386 -4.093 446 HD21 LEU 52 HD21 LEU 52 -22.977 -4.114 -7.320 447 HD22 LEU 52 HD22 LEU 52 -24.559 -3.488 -7.788 448 HD23 LEU 52 HD23 LEU 52 -24.434 -4.728 -6.538 449 H ASN 53 HN ASN 53 -27.753 -0.011 -6.693 450 HA ASN 53 HA ASN 53 -29.767 0.768 -6.014 451 HB2 ASN 53 HB2 ASN 53 -30.751 -1.417 -6.339 452 HB3 ASN 53 HB1 ASN 53 -30.119 -1.975 -4.794 453 HD21 ASN 53 HD21 ASN 53 -31.178 -1.455 -2.926 454 HD22 ASN 53 HD22 ASN 53 -32.713 -0.661 -2.894 455 H GLY 84 HN GLY 84 20.756 11.271 -11.742 456 HA2 GLY 84 HA2 GLY 84 22.509 13.402 -12.612 457 HA3 GLY 84 HA1 GLY 84 22.388 12.744 -10.985 458 HA PRO 85 HA PRO 85 25.962 10.786 -13.430 459 HB2 PRO 85 HB2 PRO 85 27.950 12.540 -13.515 460 HB3 PRO 85 HB1 PRO 85 26.598 12.671 -14.649 461 HG2 PRO 85 HG2 PRO 85 27.116 14.202 -12.132 462 HG3 PRO 85 HG1 PRO 85 26.547 14.797 -13.705 463 HD2 PRO 85 HD2 PRO 85 24.899 14.225 -11.549 464 HD3 PRO 85 HD1 PRO 85 24.368 14.272 -13.240 465 H LEU 86 HN LEU 86 28.437 10.677 -12.660 466 HA LEU 86 HA LEU 86 28.592 9.613 -10.125 467 HB2 LEU 86 HB2 LEU 86 30.936 9.609 -10.366 468 HB3 LEU 86 HB1 LEU 86 30.299 9.451 -11.987 469 HG LEU 86 HG LEU 86 31.373 12.011 -10.795 470 HD11 LEU 86 HD11 LEU 86 32.603 10.097 -12.769 471 HD12 LEU 86 HD12 LEU 86 33.130 10.373 -11.108 472 HD13 LEU 86 HD13 LEU 86 33.268 11.663 -12.303 473 HD21 LEU 86 HD21 LEU 86 31.313 12.837 -13.111 474 HD22 LEU 86 HD22 LEU 86 29.701 12.461 -12.498 475 HD23 LEU 86 HD23 LEU 86 30.507 11.351 -13.611 476 H GLY 87 HN GLY 87 29.052 10.372 -8.107 477 HA2 GLY 87 HA2 GLY 87 28.783 13.239 -7.715 478 HA3 GLY 87 HA1 GLY 87 28.768 12.010 -6.459 479 H SER 88 HN SER 88 30.934 10.917 -6.059 480 HA SER 88 HA SER 88 33.026 12.968 -6.295 481 HB2 SER 88 HB2 SER 88 32.790 10.796 -4.204 482 HB3 SER 88 HB1 SER 88 33.975 12.102 -4.233 483 HG SER 88 HG SER 88 32.555 13.313 -3.290 484 H ARG 89 HN ARG 89 32.734 9.382 -6.069 485 HA ARG 89 HA ARG 89 35.191 9.244 -7.673 486 HB2 ARG 89 HB2 ARG 89 35.134 7.972 -5.540 487 HB3 ARG 89 HB1 ARG 89 33.801 7.020 -6.172 488 HG2 ARG 89 HG2 ARG 89 35.702 5.693 -6.474 489 HG3 ARG 89 HG1 ARG 89 35.354 6.364 -8.066 490 HD2 ARG 89 HD2 ARG 89 37.355 7.543 -6.153 491 HD3 ARG 89 HD1 ARG 89 37.773 6.372 -7.397 492 HE ARG 89 HE ARG 89 36.666 8.217 -8.905 493 HH11 ARG 89 HH11 ARG 89 38.831 8.627 -6.184 494 HH12 ARG 89 HH12 ARG 89 39.527 10.096 -6.791 495 HH21 ARG 89 HH21 ARG 89 37.581 10.167 -9.704 496 HH22 ARG 89 HH22 ARG 89 38.811 10.978 -8.785 497 H ARG 90 HN ARG 90 32.358 7.105 -7.431 498 HA ARG 90 HA ARG 90 31.253 7.545 -9.933 499 HB2 ARG 90 HB2 ARG 90 33.515 6.736 -10.710 500 HB3 ARG 90 HB1 ARG 90 33.125 5.174 -10.007 501 HG2 ARG 90 HG2 ARG 90 31.218 4.959 -11.504 502 HG3 ARG 90 HG1 ARG 90 31.582 6.542 -12.198 503 HD2 ARG 90 HD2 ARG 90 33.806 5.676 -12.872 504 HD3 ARG 90 HD1 ARG 90 33.324 4.083 -12.287 505 HE ARG 90 HE ARG 90 31.445 5.113 -14.152 506 HH11 ARG 90 HH11 ARG 90 34.583 3.590 -13.913 507 HH12 ARG 90 HH12 ARG 90 34.521 2.917 -15.511 508 HH21 ARG 90 HH21 ARG 90 31.353 4.242 -16.249 509 HH22 ARG 90 HH22 ARG 90 32.681 3.304 -16.851 510 H PHE 91 HN PHE 91 32.218 4.363 -8.672 511 HA PHE 91 HA PHE 91 29.484 3.487 -8.760 512 HB2 PHE 91 HB2 PHE 91 31.992 2.074 -7.842 513 HB3 PHE 91 HB1 PHE 91 30.412 1.313 -7.986 514 HD1 PHE 91 HD1 PHE 91 29.327 1.229 -10.267 515 HD2 PHE 91 HD2 PHE 91 33.416 2.242 -9.676 516 HE1 PHE 91 HE1 PHE 91 29.799 0.686 -12.620 517 HE2 PHE 91 HE2 PHE 91 33.893 1.703 -12.027 518 HZ PHE 91 HZ PHE 91 32.085 0.925 -13.501 519 H VAL 92 HN VAL 92 31.857 4.145 -6.232 520 HA VAL 92 HA VAL 92 30.462 3.105 -4.052 521 HB VAL 92 HB VAL 92 32.283 5.519 -4.019 522 HG11 VAL 92 HG11 VAL 92 32.744 4.824 -1.701 523 HG12 VAL 92 HG12 VAL 92 31.515 3.569 -1.851 524 HG13 VAL 92 HG13 VAL 92 31.056 5.269 -1.949 525 HG21 VAL 92 HG21 VAL 92 34.090 3.942 -3.553 526 HG22 VAL 92 HG22 VAL 92 33.354 3.624 -5.124 527 HG23 VAL 92 HG23 VAL 92 32.970 2.595 -3.745 528 H VAL 93 HN VAL 93 30.445 6.413 -5.344 529 HA VAL 93 HA VAL 93 28.473 7.313 -3.490 530 HB VAL 93 HB VAL 93 30.068 8.876 -4.499 531 HG11 VAL 93 HG11 VAL 93 30.236 7.867 -6.710 532 HG12 VAL 93 HG12 VAL 93 29.857 9.585 -6.817 533 HG13 VAL 93 HG13 VAL 93 28.590 8.385 -7.078 534 HG21 VAL 93 HG21 VAL 93 28.521 10.679 -5.014 535 HG22 VAL 93 HG22 VAL 93 27.938 9.726 -3.652 536 HG23 VAL 93 HG23 VAL 93 27.220 9.516 -5.248 537 H ASP 94 HN ASP 94 28.349 5.551 -6.434 538 HA ASP 94 HA ASP 94 25.768 6.435 -7.249 539 HB2 ASP 94 HB2 ASP 94 27.742 4.667 -8.306 540 HB3 ASP 94 HB1 ASP 94 26.191 3.828 -8.243 541 H ASP 95 HN ASP 95 26.819 3.310 -5.767 542 HA ASP 95 HA ASP 95 24.154 2.461 -5.310 543 HB2 ASP 95 HB2 ASP 95 25.025 0.786 -3.810 544 HB3 ASP 95 HB1 ASP 95 26.108 0.908 -5.200 545 H ARG 96 HN ARG 96 26.038 4.806 -3.857 546 HA ARG 96 HA ARG 96 24.820 4.826 -1.259 547 HB2 ARG 96 HB2 ARG 96 27.085 5.730 -1.735 548 HB3 ARG 96 HB1 ARG 96 26.357 6.974 -2.736 549 HG2 ARG 96 HG2 ARG 96 25.182 7.837 -0.745 550 HG3 ARG 96 HG1 ARG 96 26.030 6.636 0.235 551 HD2 ARG 96 HD2 ARG 96 28.181 7.584 -0.625 552 HD3 ARG 96 HD1 ARG 96 27.243 8.872 -1.378 553 HE ARG 96 HE ARG 96 26.691 8.618 1.420 554 HH11 ARG 96 HH11 ARG 96 28.905 9.987 -0.924 555 HH12 ARG 96 HH12 ARG 96 29.514 11.188 0.165 556 HH21 ARG 96 HH21 ARG 96 27.513 10.167 2.858 557 HH22 ARG 96 HH22 ARG 96 28.715 11.302 2.318 558 H ARG 97 HN ARG 97 24.694 6.992 -4.062 559 HA ARG 97 HA ARG 97 22.394 8.404 -3.102 560 HB2 ARG 97 HB2 ARG 97 24.002 9.634 -4.350 561 HB3 ARG 97 HB1 ARG 97 24.001 8.460 -5.652 562 HG2 ARG 97 HG2 ARG 97 21.475 9.911 -5.075 563 HG3 ARG 97 HG1 ARG 97 22.788 10.786 -5.862 564 HD2 ARG 97 HD2 ARG 97 21.390 8.295 -6.829 565 HD3 ARG 97 HD1 ARG 97 21.388 9.890 -7.579 566 HE ARG 97 HE ARG 97 23.457 7.873 -7.752 567 HH11 ARG 97 HH11 ARG 97 22.638 11.240 -8.211 568 HH12 ARG 97 HH12 ARG 97 23.951 11.545 -9.298 569 HH21 ARG 97 HH21 ARG 97 25.179 8.246 -9.218 570 HH22 ARG 97 HH22 ARG 97 25.386 9.845 -9.884 571 H GLU 98 HN GLU 98 23.006 6.161 -5.763 572 HA GLU 98 HA GLU 98 20.500 6.255 -6.978 573 HB2 GLU 98 HB2 GLU 98 22.809 4.363 -6.992 574 HB3 GLU 98 HB1 GLU 98 21.292 3.857 -7.749 575 HG2 GLU 98 HG2 GLU 98 22.723 6.412 -8.424 576 HG3 GLU 98 HG1 GLU 98 22.950 4.897 -9.296 577 H LEU 99 HN LEU 99 21.711 4.063 -4.467 578 HA LEU 99 HA LEU 99 19.464 2.355 -4.508 579 HB2 LEU 99 HB2 LEU 99 21.664 1.777 -3.546 580 HB3 LEU 99 HB1 LEU 99 21.383 2.927 -2.260 581 HG LEU 99 HG LEU 99 20.989 0.330 -1.939 582 HD11 LEU 99 HD11 LEU 99 20.843 1.974 -0.206 583 HD12 LEU 99 HD12 LEU 99 19.436 0.911 -0.120 584 HD13 LEU 99 HD13 LEU 99 19.279 2.532 -0.807 585 HD21 LEU 99 HD21 LEU 99 18.657 -0.278 -2.142 586 HD22 LEU 99 HD22 LEU 99 19.293 0.175 -3.723 587 HD23 LEU 99 HD23 LEU 99 18.274 1.303 -2.825 588 H GLN 100 HN GLN 100 20.322 4.963 -2.183 589 HA GLN 100 HA GLN 100 17.815 4.872 -0.890 590 HB2 GLN 100 HB2 GLN 100 18.407 7.016 0.094 591 HB3 GLN 100 HB1 GLN 100 19.763 5.906 0.168 592 HG2 GLN 100 HG2 GLN 100 20.751 7.050 -1.776 593 HG3 GLN 100 HG1 GLN 100 19.406 8.191 -1.758 594 HE21 GLN 100 HE21 GLN 100 22.309 7.156 -0.183 595 HE22 GLN 100 HE22 GLN 100 22.463 8.512 0.883 596 H TYR 101 HN TYR 101 18.926 6.401 -3.770 597 HA TYR 101 HA TYR 101 17.055 8.382 -4.227 598 HB2 TYR 101 HB2 TYR 101 19.102 7.694 -5.624 599 HB3 TYR 101 HB1 TYR 101 18.027 6.545 -6.407 600 HD1 TYR 101 HD1 TYR 101 18.711 10.118 -5.856 601 HD2 TYR 101 HD2 TYR 101 16.437 7.268 -8.047 602 HE1 TYR 101 HE1 TYR 101 18.025 11.879 -7.424 603 HE2 TYR 101 HE2 TYR 101 15.740 9.027 -9.617 604 HH TYR 101 HH TYR 101 17.254 12.053 -9.743 605 H ARG 102 HN ARG 102 16.812 4.911 -5.043 606 HA ARG 102 HA ARG 102 14.193 5.129 -6.156 607 HB2 ARG 102 HB2 ARG 102 14.144 2.747 -6.218 608 HB3 ARG 102 HB1 ARG 102 15.791 3.228 -6.591 609 HG2 ARG 102 HG2 ARG 102 16.510 2.663 -4.362 610 HG3 ARG 102 HG1 ARG 102 14.851 2.302 -3.887 611 HD2 ARG 102 HD2 ARG 102 16.077 0.256 -4.341 612 HD3 ARG 102 HD1 ARG 102 14.786 0.480 -5.520 613 HE ARG 102 HE ARG 102 16.842 1.540 -6.828 614 HH11 ARG 102 HH11 ARG 102 16.649 -1.424 -4.980 615 HH12 ARG 102 HH12 ARG 102 17.813 -2.260 -5.956 616 HH21 ARG 102 HH21 ARG 102 18.373 0.433 -8.120 617 HH22 ARG 102 HH22 ARG 102 18.781 -1.208 -7.743 618 H VAL 103 HN VAL 103 15.412 4.935 -2.964 619 HA VAL 103 HA VAL 103 12.988 3.994 -1.748 620 HB VAL 103 HB VAL 103 15.186 5.479 -0.322 621 HG11 VAL 103 HG11 VAL 103 14.544 4.128 1.562 622 HG12 VAL 103 HG12 VAL 103 13.418 3.207 0.567 623 HG13 VAL 103 HG13 VAL 103 13.104 4.910 0.901 624 HG21 VAL 103 HG21 VAL 103 16.362 3.367 -0.014 625 HG22 VAL 103 HG22 VAL 103 16.252 3.764 -1.727 626 HG23 VAL 103 HG23 VAL 103 15.186 2.544 -1.032 627 H GLU 104 HN GLU 104 14.556 7.161 -2.185 628 HA GLU 104 HA GLU 104 12.439 8.558 -0.902 629 HB2 GLU 104 HB2 GLU 104 13.507 10.605 -2.030 630 HB3 GLU 104 HB1 GLU 104 14.400 9.756 -0.781 631 HG2 GLU 104 HG2 GLU 104 15.730 8.647 -2.430 632 HG3 GLU 104 HG1 GLU 104 14.779 9.355 -3.729 633 H VAL 105 HN VAL 105 12.922 7.636 -4.294 634 HA VAL 105 HA VAL 105 10.817 9.289 -5.236 635 HB VAL 105 HB VAL 105 11.811 8.447 -7.094 636 HG11 VAL 105 HG11 VAL 105 12.649 6.177 -7.385 637 HG12 VAL 105 HG12 VAL 105 12.033 5.750 -5.789 638 HG13 VAL 105 HG13 VAL 105 13.326 6.940 -5.947 639 HG21 VAL 105 HG21 VAL 105 9.695 6.378 -6.618 640 HG22 VAL 105 HG22 VAL 105 10.480 6.691 -8.164 641 HG23 VAL 105 HG23 VAL 105 9.490 7.942 -7.408 642 H GLN 106 HN GLN 106 10.870 6.099 -3.740 643 HA GLN 106 HA GLN 106 8.118 5.592 -3.896 644 HB2 GLN 106 HB2 GLN 106 10.177 4.792 -1.838 645 HB3 GLN 106 HB1 GLN 106 8.525 4.198 -1.822 646 HG2 GLN 106 HG2 GLN 106 10.519 3.806 -4.032 647 HG3 GLN 106 HG1 GLN 106 10.017 2.595 -2.854 648 HE21 GLN 106 HE21 GLN 106 9.094 4.418 -5.671 649 HE22 GLN 106 HE22 GLN 106 7.716 3.464 -6.082 650 H ASN 107 HN ASN 107 10.026 7.316 -1.457 651 HA ASN 107 HA ASN 107 7.981 8.085 0.277 652 HB2 ASN 107 HB2 ASN 107 10.191 8.467 0.996 653 HB3 ASN 107 HB1 ASN 107 10.606 9.356 -0.466 654 HD21 ASN 107 HD21 ASN 107 8.840 9.487 2.546 655 HD22 ASN 107 HD22 ASN 107 8.755 11.208 2.640 656 H ARG 108 HN ARG 108 9.141 9.617 -2.689 657 HA ARG 108 HA ARG 108 7.410 11.872 -2.519 658 HB2 ARG 108 HB2 ARG 108 9.017 10.654 -4.754 659 HB3 ARG 108 HB1 ARG 108 8.013 12.076 -4.990 660 HG2 ARG 108 HG2 ARG 108 9.315 13.359 -3.480 661 HG3 ARG 108 HG1 ARG 108 10.176 11.928 -2.910 662 HD2 ARG 108 HD2 ARG 108 11.456 13.378 -4.510 663 HD3 ARG 108 HD1 ARG 108 11.313 11.685 -4.983 664 HE ARG 108 HE ARG 108 9.343 13.533 -6.074 665 HH11 ARG 108 HH11 ARG 108 12.350 11.812 -6.557 666 HH12 ARG 108 HH12 ARG 108 12.223 11.823 -8.286 667 HH21 ARG 108 HH21 ARG 108 9.179 13.553 -8.351 668 HH22 ARG 108 HH22 ARG 108 10.422 12.807 -9.307 669 H VAL 109 HN VAL 109 7.307 8.861 -4.367 670 HA VAL 109 HA VAL 109 4.966 9.329 -5.812 671 HB VAL 109 HB VAL 109 6.201 6.732 -4.906 672 HG11 VAL 109 HG11 VAL 109 4.818 5.604 -6.547 673 HG12 VAL 109 HG12 VAL 109 4.039 7.126 -6.975 674 HG13 VAL 109 HG13 VAL 109 3.793 6.432 -5.370 675 HG21 VAL 109 HG21 VAL 109 7.637 7.973 -6.372 676 HG22 VAL 109 HG22 VAL 109 6.300 8.276 -7.490 677 HG23 VAL 109 HG23 VAL 109 6.924 6.638 -7.285 678 H TYR 110 HN TYR 110 5.372 7.463 -2.802 679 HA TYR 110 HA TYR 110 2.620 6.955 -2.481 680 HB2 TYR 110 HB2 TYR 110 4.876 6.980 -0.482 681 HB3 TYR 110 HB1 TYR 110 3.235 6.504 -0.069 682 HD1 TYR 110 HD1 TYR 110 6.086 5.008 -0.215 683 HD2 TYR 110 HD2 TYR 110 2.504 4.955 -2.510 684 HE1 TYR 110 HE1 TYR 110 6.577 2.705 -0.921 685 HE2 TYR 110 HE2 TYR 110 2.986 2.654 -3.219 686 HH TYR 110 HH TYR 110 4.960 1.174 -3.459 687 H LYS 111 HN LYS 111 4.596 9.699 -1.624 688 HA LYS 111 HA LYS 111 2.640 10.935 0.042 689 HB2 LYS 111 HB2 LYS 111 4.917 11.630 0.302 690 HB3 LYS 111 HB1 LYS 111 5.056 12.026 -1.405 691 HG2 LYS 111 HG2 LYS 111 3.829 13.978 -1.186 692 HG3 LYS 111 HG1 LYS 111 3.081 13.457 0.322 693 HD2 LYS 111 HD2 LYS 111 4.787 15.253 0.596 694 HD3 LYS 111 HD1 LYS 111 5.117 13.800 1.533 695 HE2 LYS 111 HE2 LYS 111 6.339 14.055 -1.171 696 HE3 LYS 111 HE1 LYS 111 7.007 15.019 0.144 697 HZ1 LYS 111 HZ1 LYS 111 6.769 12.058 0.052 698 HZ2 LYS 111 HZ2 LYS 111 7.247 12.926 1.419 699 HZ3 LYS 111 HZ3 LYS 111 8.197 12.966 0.020 700 H LYS 112 HN LYS 112 3.475 11.118 -3.378 701 HA LYS 112 HA LYS 112 1.645 13.066 -4.192 702 HB2 LYS 112 HB2 LYS 112 2.747 10.634 -5.596 703 HB3 LYS 112 HB1 LYS 112 1.698 11.794 -6.399 704 HG2 LYS 112 HG2 LYS 112 3.282 13.512 -6.219 705 HG3 LYS 112 HG1 LYS 112 4.241 12.617 -5.040 706 HD2 LYS 112 HD2 LYS 112 5.219 12.674 -7.340 707 HD3 LYS 112 HD1 LYS 112 4.946 11.053 -6.702 708 HE2 LYS 112 HE2 LYS 112 2.961 10.802 -8.017 709 HE3 LYS 112 HE1 LYS 112 3.034 12.484 -8.538 710 HZ1 LYS 112 HZ1 LYS 112 3.842 10.992 -10.250 711 HZ2 LYS 112 HZ2 LYS 112 5.016 10.376 -9.203 712 HZ3 LYS 112 HZ3 LYS 112 5.094 11.989 -9.701 713 H GLU 113 HN GLU 113 1.248 9.614 -3.629 714 HA GLU 113 HA GLU 113 -1.398 9.303 -4.449 715 HB2 GLU 113 HB2 GLU 113 -0.162 7.980 -2.042 716 HB3 GLU 113 HB1 GLU 113 -1.485 7.374 -3.035 717 HG2 GLU 113 HG2 GLU 113 1.381 7.728 -3.888 718 HG3 GLU 113 HG1 GLU 113 0.572 6.213 -3.535 719 H ILE 114 HN ILE 114 -0.104 10.062 -1.237 720 HA ILE 114 HA ILE 114 -2.501 10.475 0.099 721 HB ILE 114 HB ILE 114 0.211 11.710 0.565 722 HG12 ILE 114 HG12 ILE 114 -1.150 9.324 1.820 723 HG13 ILE 114 HG11 ILE 114 0.094 9.239 0.580 724 HG21 ILE 114 HG21 ILE 114 -2.207 11.612 2.360 725 HG22 ILE 114 HG22 ILE 114 -1.396 13.051 1.728 726 HG23 ILE 114 HG23 ILE 114 -0.578 12.016 2.905 727 HD11 ILE 114 HD11 ILE 114 0.453 10.409 3.323 728 HD12 ILE 114 HD12 ILE 114 1.693 10.244 2.079 729 HD13 ILE 114 HD13 ILE 114 0.975 8.806 2.806 730 H GLN 115 HN GLN 115 -0.658 12.716 -1.928 731 HA GLN 115 HA GLN 115 -2.113 15.045 -1.241 732 HB2 GLN 115 HB2 GLN 115 -0.830 14.468 -3.898 733 HB3 GLN 115 HB1 GLN 115 -1.164 16.041 -3.191 734 HG2 GLN 115 HG2 GLN 115 0.407 15.392 -1.325 735 HG3 GLN 115 HG1 GLN 115 0.868 14.020 -2.335 736 HE21 GLN 115 HE21 GLN 115 0.448 15.630 -4.775 737 HE22 GLN 115 HE22 GLN 115 1.826 16.655 -4.891 738 H ALA 116 HN ALA 116 -2.518 12.600 -3.744 739 HA ALA 116 HA ALA 116 -4.839 13.655 -4.955 740 HB1 ALA 116 HB1 ALA 116 -4.023 10.763 -4.628 741 HB2 ALA 116 HB2 ALA 116 -3.524 11.830 -5.943 742 HB3 ALA 116 HB3 ALA 116 -5.220 11.377 -5.768 743 H LEU 117 HN LEU 117 -4.354 11.375 -2.316 744 HA LEU 117 HA LEU 117 -7.064 10.901 -1.722 745 HB2 LEU 117 HB2 LEU 117 -4.768 10.815 0.230 746 HB3 LEU 117 HB1 LEU 117 -6.269 9.918 0.319 747 HG LEU 117 HG LEU 117 -4.050 9.503 -1.682 748 HD11 LEU 117 HD11 LEU 117 -3.777 7.359 -0.601 749 HD12 LEU 117 HD12 LEU 117 -5.064 7.745 0.538 750 HD13 LEU 117 HD13 LEU 117 -3.562 8.670 0.557 751 HD21 LEU 117 HD21 LEU 117 -6.658 8.018 -1.406 752 HD22 LEU 117 HD22 LEU 117 -5.332 7.607 -2.495 753 HD23 LEU 117 HD23 LEU 117 -6.224 9.111 -2.720 754 H ASP 118 HN ASP 118 -4.891 13.470 -0.916 755 HA ASP 118 HA ASP 118 -6.176 14.548 1.329 756 HB2 ASP 118 HB2 ASP 118 -3.943 15.234 0.766 757 HB3 ASP 118 HB1 ASP 118 -4.466 15.842 -0.799 758 H ALA 119 HN ALA 119 -6.777 14.939 -2.111 759 HA ALA 119 HA ALA 119 -8.706 17.001 -1.927 760 HB1 ALA 119 HB1 ALA 119 -8.477 14.773 -3.953 761 HB2 ALA 119 HB2 ALA 119 -7.691 16.349 -4.050 762 HB3 ALA 119 HB3 ALA 119 -9.448 16.234 -4.133 763 H GLU 120 HN GLU 120 -8.883 13.490 -1.725 764 HA GLU 120 HA GLU 120 -11.688 13.396 -1.298 765 HB2 GLU 120 HB2 GLU 120 -9.415 11.495 -1.035 766 HB3 GLU 120 HB1 GLU 120 -10.927 11.107 -0.240 767 HG2 GLU 120 HG2 GLU 120 -10.672 10.098 -2.474 768 HG3 GLU 120 HG1 GLU 120 -12.110 11.095 -2.297 769 H ILE 121 HN ILE 121 -8.907 13.843 0.809 770 HA ILE 121 HA ILE 121 -10.158 13.504 3.268 771 HB ILE 121 HB ILE 121 -7.797 14.983 2.327 772 HG12 ILE 121 HG12 ILE 121 -6.796 13.923 4.323 773 HG13 ILE 121 HG11 ILE 121 -8.390 13.349 4.804 774 HG21 ILE 121 HG21 ILE 121 -7.488 16.265 4.379 775 HG22 ILE 121 HG22 ILE 121 -9.105 15.803 4.913 776 HG23 ILE 121 HG23 ILE 121 -8.903 16.809 3.479 777 HD11 ILE 121 HD11 ILE 121 -8.478 12.064 2.672 778 HD12 ILE 121 HD12 ILE 121 -7.224 11.546 3.796 779 HD13 ILE 121 HD13 ILE 121 -6.800 12.527 2.391 780 H ARG 122 HN ARG 122 -10.377 16.128 0.961 781 HA ARG 122 HA ARG 122 -11.796 18.004 2.451 782 HB2 ARG 122 HB2 ARG 122 -10.950 18.350 0.144 783 HB3 ARG 122 HB1 ARG 122 -12.202 17.277 -0.455 784 HG2 ARG 122 HG2 ARG 122 -13.912 18.839 0.365 785 HG3 ARG 122 HG1 ARG 122 -12.632 19.926 0.908 786 HD2 ARG 122 HD2 ARG 122 -13.192 19.063 -1.929 787 HD3 ARG 122 HD1 ARG 122 -13.451 20.666 -1.241 788 HE ARG 122 HE ARG 122 -10.820 20.275 -0.830 789 HH11 ARG 122 HH11 ARG 122 -12.824 19.992 -3.686 790 HH12 ARG 122 HH12 ARG 122 -11.530 20.347 -4.783 791 HH21 ARG 122 HH21 ARG 122 -9.114 20.748 -2.263 792 HH22 ARG 122 HH22 ARG 122 -9.416 20.783 -3.972 793 H LYS 123 HN LYS 123 -13.023 15.232 0.553 794 HA LYS 123 HA LYS 123 -15.749 15.621 1.288 795 HB2 LYS 123 HB2 LYS 123 -16.225 13.578 0.245 796 HB3 LYS 123 HB1 LYS 123 -14.805 14.144 -0.609 797 HG2 LYS 123 HG2 LYS 123 -13.618 12.675 1.287 798 HG3 LYS 123 HG1 LYS 123 -15.140 11.808 1.155 799 HD2 LYS 123 HD2 LYS 123 -13.342 12.482 -1.166 800 HD3 LYS 123 HD1 LYS 123 -13.343 10.935 -0.324 801 HE2 LYS 123 HE2 LYS 123 -15.514 10.434 -1.052 802 HE3 LYS 123 HE1 LYS 123 -15.803 12.091 -1.582 803 HZ1 LYS 123 HZ1 LYS 123 -15.384 10.696 -3.478 804 HZ2 LYS 123 HZ2 LYS 123 -13.933 10.143 -2.819 805 HZ3 LYS 123 HZ3 LYS 123 -14.085 11.760 -3.292 806 H LEU 124 HN LEU 124 -13.108 13.828 2.719 807 HA LEU 124 HA LEU 124 -14.566 12.402 4.641 808 HB2 LEU 124 HB2 LEU 124 -11.710 13.331 4.561 809 HB3 LEU 124 HB1 LEU 124 -12.339 12.320 5.847 810 HG LEU 124 HG LEU 124 -12.257 11.562 2.917 811 HD11 LEU 124 HD11 LEU 124 -10.027 11.655 3.901 812 HD12 LEU 124 HD12 LEU 124 -10.514 9.987 3.611 813 HD13 LEU 124 HD13 LEU 124 -10.565 10.650 5.244 814 HD21 LEU 124 HD21 LEU 124 -14.106 10.529 4.067 815 HD22 LEU 124 HD22 LEU 124 -13.044 10.006 5.370 816 HD23 LEU 124 HD23 LEU 124 -12.852 9.333 3.751 817 H GLU 125 HN GLU 125 -12.818 15.511 4.939 818 HA GLU 125 HA GLU 125 -13.333 15.788 7.691 819 HB2 GLU 125 HB2 GLU 125 -12.762 17.982 5.705 820 HB3 GLU 125 HB1 GLU 125 -12.629 18.107 7.453 821 HG2 GLU 125 HG2 GLU 125 -10.893 16.316 7.368 822 HG3 GLU 125 HG1 GLU 125 -10.956 16.423 5.614 823 H ARG 126 HN ARG 126 -15.151 16.939 4.875 824 HA ARG 126 HA ARG 126 -16.952 18.487 6.446 825 HB2 ARG 126 HB2 ARG 126 -18.357 18.603 4.430 826 HB3 ARG 126 HB1 ARG 126 -16.685 19.024 4.109 827 HG2 ARG 126 HG2 ARG 126 -16.344 16.736 3.202 828 HG3 ARG 126 HG1 ARG 126 -18.077 16.453 3.402 829 HD2 ARG 126 HD2 ARG 126 -18.589 18.282 1.908 830 HD3 ARG 126 HD1 ARG 126 -16.883 18.697 1.784 831 HE ARG 126 HE ARG 126 -17.743 16.047 0.883 832 HH11 ARG 126 HH11 ARG 126 -16.622 19.276 0.105 833 HH12 ARG 126 HH12 ARG 126 -16.202 18.872 -1.530 834 HH21 ARG 126 HH21 ARG 126 -17.174 15.519 -1.278 835 HH22 ARG 126 HH22 ARG 126 -16.500 16.744 -2.307 836 H LEU 127 HN LEU 127 -16.679 15.147 5.792 837 HA LEU 127 HA LEU 127 -19.373 14.549 6.691 838 HB2 LEU 127 HB2 LEU 127 -17.760 13.202 5.050 839 HB3 LEU 127 HB1 LEU 127 -17.218 12.488 6.554 840 HG LEU 127 HG LEU 127 -18.925 11.134 5.367 841 HD11 LEU 127 HD11 LEU 127 -18.673 10.855 7.752 842 HD12 LEU 127 HD12 LEU 127 -20.372 10.715 7.299 843 HD13 LEU 127 HD13 LEU 127 -19.778 12.197 8.051 844 HD21 LEU 127 HD21 LEU 127 -20.789 13.408 6.027 845 HD22 LEU 127 HD22 LEU 127 -21.237 11.860 5.315 846 HD23 LEU 127 HD23 LEU 127 -20.217 12.980 4.414 847 H LEU 128 HN LEU 128 -16.052 14.507 7.877 848 HA LEU 128 HA LEU 128 -16.406 13.465 10.416 849 HB2 LEU 128 HB2 LEU 128 -14.631 15.763 9.622 850 HB3 LEU 128 HB1 LEU 128 -14.468 14.813 11.082 851 HG LEU 128 HG LEU 128 -14.075 13.843 8.261 852 HD11 LEU 128 HD11 LEU 128 -12.274 15.254 9.185 853 HD12 LEU 128 HD12 LEU 128 -11.760 13.591 8.893 854 HD13 LEU 128 HD13 LEU 128 -12.120 14.129 10.536 855 HD21 LEU 128 HD21 LEU 128 -13.960 12.350 10.871 856 HD22 LEU 128 HD22 LEU 128 -13.339 11.735 9.340 857 HD23 LEU 128 HD23 LEU 128 -15.060 12.068 9.521 858 H GLU 129 HN GLU 129 -16.508 16.864 9.451 859 HA GLU 129 HA GLU 129 -17.463 17.873 11.905 860 HB2 GLU 129 HB2 GLU 129 -17.755 19.037 9.130 861 HB3 GLU 129 HB1 GLU 129 -17.934 19.919 10.641 862 HG2 GLU 129 HG2 GLU 129 -15.598 19.447 11.182 863 HG3 GLU 129 HG1 GLU 129 -15.418 18.600 9.650 864 H SER 130 HN SER 130 -19.029 16.025 9.601 865 HA SER 130 HA SER 130 -21.677 17.108 10.157 866 HB2 SER 130 HB2 SER 130 -21.059 16.461 7.827 867 HB3 SER 130 HB1 SER 130 -20.909 14.789 8.366 868 HG SER 130 HG SER 130 -23.257 15.564 9.194 869 H GLY 131 HN GLY 131 -19.618 15.082 11.699 870 HA2 GLY 131 HA2 GLY 131 -20.526 14.262 13.821 871 HA3 GLY 131 HA1 GLY 131 -21.903 13.662 12.918 872 H LEU 132 HN LEU 132 -18.763 13.232 11.526 873 HA LEU 132 HA LEU 132 -18.913 10.383 12.111 874 HB2 LEU 132 HB2 LEU 132 -18.414 11.481 9.798 875 HB3 LEU 132 HB1 LEU 132 -16.808 11.717 10.440 876 HG LEU 132 HG LEU 132 -16.935 9.734 9.022 877 HD11 LEU 132 HD11 LEU 132 -15.287 9.738 10.770 878 HD12 LEU 132 HD12 LEU 132 -15.955 8.113 10.599 879 HD13 LEU 132 HD13 LEU 132 -16.473 9.147 11.932 880 HD21 LEU 132 HD21 LEU 132 -18.196 7.769 9.759 881 HD22 LEU 132 HD22 LEU 132 -19.251 9.131 9.386 882 HD23 LEU 132 HD23 LEU 132 -18.902 8.720 11.064 883 H THR 133 HN THR 133 -16.675 13.110 12.361 884 HA THR 133 HA THR 133 -15.150 13.707 13.914 885 HB THR 133 HB THR 133 -16.115 11.405 15.616 886 HG1 THR 133 HG1 THR 133 -17.929 12.475 15.772 887 HG21 THR 133 HG21 THR 133 -14.058 12.521 16.374 888 HG22 THR 133 HG22 THR 133 -15.405 12.837 17.467 889 HG23 THR 133 HG23 THR 133 -14.888 14.076 16.325 Start of MODEL 10 1 H1 MET 1 HT1 MET 1 26.992 -1.825 6.459 2 H2 MET 1 HT2 MET 1 26.422 -3.262 7.142 3 H3 MET 1 HT3 MET 1 25.549 -1.822 7.350 4 HA MET 1 HA MET 1 24.509 -3.248 5.725 5 HB2 MET 1 HB2 MET 1 24.491 -0.717 5.552 6 HB3 MET 1 HB1 MET 1 25.762 -0.870 4.346 7 HG2 MET 1 HG2 MET 1 24.303 -2.126 2.901 8 HG3 MET 1 HG1 MET 1 23.041 -2.137 4.132 9 HE1 MET 1 HE1 MET 1 21.425 0.206 1.498 10 HE2 MET 1 HE2 MET 1 21.199 -1.189 2.554 11 HE3 MET 1 HE3 MET 1 22.351 -1.268 1.221 12 H ASP 2 HN ASP 2 27.620 -2.035 4.400 13 HA ASP 2 HA ASP 2 28.113 -4.703 3.318 14 HB2 ASP 2 HB2 ASP 2 28.000 -2.189 1.655 15 HB3 ASP 2 HB1 ASP 2 28.891 -3.615 1.142 16 H SER 3 HN SER 3 30.424 -4.464 2.064 17 HA SER 3 HA SER 3 32.299 -3.995 4.100 18 HB2 SER 3 HB2 SER 3 32.807 -4.127 1.116 19 HB3 SER 3 HB1 SER 3 33.996 -4.386 2.392 20 HG SER 3 HG SER 3 33.332 -6.392 1.810 21 H ALA 4 HN ALA 4 31.525 -2.090 1.199 22 HA ALA 4 HA ALA 4 33.188 0.101 2.120 23 HB1 ALA 4 HB1 ALA 4 31.419 -0.115 -0.313 24 HB2 ALA 4 HB2 ALA 4 33.148 -0.450 -0.257 25 HB3 ALA 4 HB3 ALA 4 32.559 1.187 0.023 26 H ILE 5 HN ILE 5 29.742 -0.426 1.389 27 HA ILE 5 HA ILE 5 28.903 2.119 2.327 28 HB ILE 5 HB ILE 5 27.210 -0.375 2.103 29 HG12 ILE 5 HG12 ILE 5 27.760 1.746 0.010 30 HG13 ILE 5 HG11 ILE 5 28.433 0.119 -0.004 31 HG21 ILE 5 HG21 ILE 5 26.488 2.551 2.007 32 HG22 ILE 5 HG22 ILE 5 26.187 1.456 3.356 33 HG23 ILE 5 HG23 ILE 5 25.368 1.202 1.814 34 HD11 ILE 5 HD11 ILE 5 26.181 -0.804 -0.207 35 HD12 ILE 5 HD12 ILE 5 26.559 0.304 -1.526 36 HD13 ILE 5 HD13 ILE 5 25.517 0.829 -0.203 37 H SER 6 HN SER 6 29.201 2.716 4.365 38 HA SER 6 HA SER 6 29.209 0.724 6.485 39 HB2 SER 6 HB2 SER 6 29.856 3.677 6.632 40 HB3 SER 6 HB1 SER 6 30.236 2.447 7.835 41 HG SER 6 HG SER 6 31.221 1.637 5.507 42 H LYS 7 HN LYS 7 28.385 2.164 8.682 43 HA LYS 7 HA LYS 7 25.596 1.961 8.462 44 HB2 LYS 7 HB2 LYS 7 26.887 1.660 10.571 45 HB3 LYS 7 HB1 LYS 7 27.116 3.405 10.628 46 HG2 LYS 7 HG2 LYS 7 24.763 3.774 10.835 47 HG3 LYS 7 HG1 LYS 7 24.430 2.064 10.567 48 HD2 LYS 7 HD2 LYS 7 25.991 3.153 12.899 49 HD3 LYS 7 HD1 LYS 7 24.274 2.769 12.945 50 HE2 LYS 7 HE2 LYS 7 26.470 0.804 12.301 51 HE3 LYS 7 HE1 LYS 7 25.679 0.964 13.866 52 HZ1 LYS 7 HZ1 LYS 7 24.765 -0.846 12.504 53 HZ2 LYS 7 HZ2 LYS 7 24.269 0.275 11.336 54 HZ3 LYS 7 HZ3 LYS 7 23.605 0.315 12.890 55 H GLU 8 HN GLU 8 27.753 4.485 7.755 56 HA GLU 8 HA GLU 8 26.389 6.835 8.127 57 HB2 GLU 8 HB2 GLU 8 27.994 6.080 5.687 58 HB3 GLU 8 HB1 GLU 8 27.673 7.708 6.247 59 HG2 GLU 8 HG2 GLU 8 29.017 7.343 8.177 60 HG3 GLU 8 HG1 GLU 8 29.231 5.647 7.773 61 H ASP 9 HN ASP 9 26.387 5.018 5.056 62 HA ASP 9 HA ASP 9 24.078 6.486 4.130 63 HB2 ASP 9 HB2 ASP 9 26.080 5.682 2.716 64 HB3 ASP 9 HB1 ASP 9 25.306 4.101 2.756 65 H GLU 10 HN GLU 10 24.752 3.526 5.688 66 HA GLU 10 HA GLU 10 22.550 1.936 5.072 67 HB2 GLU 10 HB2 GLU 10 24.457 1.142 6.360 68 HB3 GLU 10 HB1 GLU 10 24.072 2.268 7.647 69 HG2 GLU 10 HG2 GLU 10 21.975 1.064 8.063 70 HG3 GLU 10 HG1 GLU 10 22.429 -0.101 6.813 71 H GLU 11 HN GLU 11 22.947 3.980 7.953 72 HA GLU 11 HA GLU 11 20.315 3.848 8.814 73 HB2 GLU 11 HB2 GLU 11 22.447 5.923 9.271 74 HB3 GLU 11 HB1 GLU 11 20.895 5.937 10.099 75 HG2 GLU 11 HG2 GLU 11 22.746 3.580 10.172 76 HG3 GLU 11 HG1 GLU 11 22.833 4.892 11.345 77 H ARG 12 HN ARG 12 21.819 5.889 6.424 78 HA ARG 12 HA ARG 12 19.745 7.791 6.158 79 HB2 ARG 12 HB2 ARG 12 22.012 8.063 5.185 80 HB3 ARG 12 HB1 ARG 12 21.658 6.777 4.042 81 HG2 ARG 12 HG2 ARG 12 21.416 8.937 2.988 82 HG3 ARG 12 HG1 ARG 12 19.852 8.127 3.090 83 HD2 ARG 12 HD2 ARG 12 19.667 10.494 3.666 84 HD3 ARG 12 HD1 ARG 12 19.272 9.466 5.041 85 HE ARG 12 HE ARG 12 21.971 10.080 5.241 86 HH11 ARG 12 HH11 ARG 12 18.916 11.783 5.302 87 HH12 ARG 12 HH12 ARG 12 19.504 13.056 6.319 88 HH21 ARG 12 HH21 ARG 12 22.743 11.743 6.597 89 HH22 ARG 12 HH22 ARG 12 21.680 13.035 7.059 90 H TYR 13 HN TYR 13 20.416 4.731 4.475 91 HA TYR 13 HA TYR 13 18.076 4.645 2.918 92 HB2 TYR 13 HB2 TYR 13 19.731 3.099 2.315 93 HB3 TYR 13 HB1 TYR 13 19.973 2.563 3.970 94 HD1 TYR 13 HD1 TYR 13 19.152 0.501 4.548 95 HD2 TYR 13 HD2 TYR 13 17.275 2.629 1.380 96 HE1 TYR 13 HE1 TYR 13 17.646 -1.402 4.174 97 HE2 TYR 13 HE2 TYR 13 15.753 0.738 1.002 98 HH TYR 13 HH TYR 13 15.329 -1.747 3.191 99 H GLN 14 HN GLN 14 18.795 3.433 6.145 100 HA GLN 14 HA GLN 14 16.419 2.152 6.767 101 HB2 GLN 14 HB2 GLN 14 18.211 3.807 8.547 102 HB3 GLN 14 HB1 GLN 14 16.962 2.718 9.129 103 HG2 GLN 14 HG2 GLN 14 19.338 1.921 7.470 104 HG3 GLN 14 HG1 GLN 14 19.196 1.725 9.213 105 HE21 GLN 14 HE21 GLN 14 19.552 -0.253 7.078 106 HE22 GLN 14 HE22 GLN 14 18.243 -1.369 7.239 107 H LYS 15 HN LYS 15 17.249 5.524 7.498 108 HA LYS 15 HA LYS 15 14.737 6.338 8.343 109 HB2 LYS 15 HB2 LYS 15 16.842 7.957 6.911 110 HB3 LYS 15 HB1 LYS 15 15.437 8.637 7.721 111 HG2 LYS 15 HG2 LYS 15 17.553 6.998 9.082 112 HG3 LYS 15 HG1 LYS 15 17.512 8.754 9.059 113 HD2 LYS 15 HD2 LYS 15 15.319 7.005 10.156 114 HD3 LYS 15 HD1 LYS 15 16.592 7.740 11.131 115 HE2 LYS 15 HE2 LYS 15 14.698 9.273 9.381 116 HE3 LYS 15 HE1 LYS 15 14.453 9.013 11.105 117 HZ1 LYS 15 HZ1 LYS 15 16.754 10.430 9.867 118 HZ2 LYS 15 HZ2 LYS 15 16.544 10.167 11.522 119 HZ3 LYS 15 HZ3 LYS 15 15.464 11.161 10.683 120 H LEU 16 HN LEU 16 15.978 5.969 5.092 121 HA LEU 16 HA LEU 16 13.924 7.364 3.750 122 HB2 LEU 16 HB2 LEU 16 16.169 6.650 2.822 123 HB3 LEU 16 HB1 LEU 16 15.496 5.041 2.655 124 HG LEU 16 HG LEU 16 13.919 5.782 1.005 125 HD11 LEU 16 HD11 LEU 16 14.845 8.540 1.763 126 HD12 LEU 16 HD12 LEU 16 13.203 7.886 1.825 127 HD13 LEU 16 HD13 LEU 16 13.983 8.195 0.268 128 HD21 LEU 16 HD21 LEU 16 16.606 7.024 0.481 129 HD22 LEU 16 HD22 LEU 16 15.411 6.562 -0.734 130 HD23 LEU 16 HD23 LEU 16 16.193 5.325 0.254 131 H VAL 17 HN VAL 17 14.351 3.897 4.450 132 HA VAL 17 HA VAL 17 11.855 3.096 3.379 133 HB VAL 17 HB VAL 17 12.212 0.998 4.276 134 HG11 VAL 17 HG11 VAL 17 14.929 2.269 4.267 135 HG12 VAL 17 HG12 VAL 17 14.076 1.601 2.874 136 HG13 VAL 17 HG13 VAL 17 14.615 0.536 4.174 137 HG21 VAL 17 HG21 VAL 17 13.770 2.218 6.558 138 HG22 VAL 17 HG22 VAL 17 13.448 0.499 6.331 139 HG23 VAL 17 HG23 VAL 17 12.116 1.613 6.640 140 H THR 18 HN THR 18 12.867 4.374 6.453 141 HA THR 18 HA THR 18 10.581 3.951 7.963 142 HB THR 18 HB THR 18 12.760 6.009 7.953 143 HG1 THR 18 HG1 THR 18 13.343 4.019 8.784 144 HG21 THR 18 HG21 THR 18 10.370 5.921 9.757 145 HG22 THR 18 HG22 THR 18 10.916 7.241 8.717 146 HG23 THR 18 HG23 THR 18 11.860 6.788 10.135 147 H GLU 19 HN GLU 19 11.563 6.780 6.035 148 HA GLU 19 HA GLU 19 9.291 8.327 6.253 149 HB2 GLU 19 HB2 GLU 19 11.133 7.971 3.866 150 HB3 GLU 19 HB1 GLU 19 9.943 9.261 4.026 151 HG2 GLU 19 HG2 GLU 19 11.084 10.001 6.095 152 HG3 GLU 19 HG1 GLU 19 12.312 8.763 5.821 153 H ASN 20 HN ASN 20 9.890 5.538 4.285 154 HA ASN 20 HA ASN 20 7.577 5.856 2.634 155 HB2 ASN 20 HB2 ASN 20 9.757 3.855 2.905 156 HB3 ASN 20 HB1 ASN 20 8.271 3.363 2.090 157 HD21 ASN 20 HD21 ASN 20 10.935 5.637 2.059 158 HD22 ASN 20 HD22 ASN 20 10.797 6.040 0.378 159 H GLU 21 HN GLU 21 8.452 3.466 5.175 160 HA GLU 21 HA GLU 21 6.082 2.029 5.052 161 HB2 GLU 21 HB2 GLU 21 7.784 2.581 7.491 162 HB3 GLU 21 HB1 GLU 21 6.643 1.253 7.308 163 HG2 GLU 21 HG2 GLU 21 8.858 1.616 5.361 164 HG3 GLU 21 HG1 GLU 21 9.166 0.848 6.912 165 H GLN 22 HN GLN 22 6.767 5.074 6.658 166 HA GLN 22 HA GLN 22 4.518 5.240 8.331 167 HB2 GLN 22 HB2 GLN 22 5.717 7.575 6.841 168 HB3 GLN 22 HB1 GLN 22 4.830 7.614 8.356 169 HG2 GLN 22 HG2 GLN 22 6.685 6.301 9.403 170 HG3 GLN 22 HG1 GLN 22 7.582 6.504 7.903 171 HE21 GLN 22 HE21 GLN 22 8.163 7.431 10.612 172 HE22 GLN 22 HE22 GLN 22 8.357 9.146 10.490 173 H LEU 23 HN LEU 23 4.944 6.770 5.130 174 HA LEU 23 HA LEU 23 2.169 7.435 5.116 175 HB2 LEU 23 HB2 LEU 23 2.600 8.838 3.361 176 HB3 LEU 23 HB1 LEU 23 4.111 8.838 4.223 177 HG LEU 23 HG LEU 23 3.525 7.417 1.629 178 HD11 LEU 23 HD11 LEU 23 3.794 9.844 1.484 179 HD12 LEU 23 HD12 LEU 23 5.118 8.980 0.703 180 HD13 LEU 23 HD13 LEU 23 5.356 9.707 2.292 181 HD21 LEU 23 HD21 LEU 23 5.055 6.072 2.940 182 HD22 LEU 23 HD22 LEU 23 6.065 7.492 3.232 183 HD23 LEU 23 HD23 LEU 23 5.896 6.852 1.598 184 H GLN 24 HN GLN 24 4.061 4.837 3.875 185 HA GLN 24 HA GLN 24 2.387 3.653 2.031 186 HB2 GLN 24 HB2 GLN 24 4.023 2.536 4.264 187 HB3 GLN 24 HB1 GLN 24 3.060 1.465 3.276 188 HG2 GLN 24 HG2 GLN 24 4.281 2.371 1.307 189 HG3 GLN 24 HG1 GLN 24 5.356 3.177 2.439 190 HE21 GLN 24 HE21 GLN 24 7.085 1.980 1.739 191 HE22 GLN 24 HE22 GLN 24 7.314 0.329 2.177 192 H ARG 25 HN ARG 25 2.176 3.597 5.541 193 HA ARG 25 HA ARG 25 -0.163 2.028 5.748 194 HB2 ARG 25 HB2 ARG 25 0.931 1.997 7.738 195 HB3 ARG 25 HB1 ARG 25 1.630 3.590 7.490 196 HG2 ARG 25 HG2 ARG 25 -0.747 4.441 7.958 197 HG3 ARG 25 HG1 ARG 25 -1.003 2.850 8.680 198 HD2 ARG 25 HD2 ARG 25 1.048 4.925 9.452 199 HD3 ARG 25 HD1 ARG 25 -0.322 4.363 10.414 200 HE ARG 25 HE ARG 25 1.352 2.180 9.782 201 HH11 ARG 25 HH11 ARG 25 1.277 5.037 11.803 202 HH12 ARG 25 HH12 ARG 25 2.316 4.358 13.017 203 HH21 ARG 25 HH21 ARG 25 2.709 1.281 11.388 204 HH22 ARG 25 HH22 ARG 25 3.120 2.226 12.785 205 H LEU 26 HN LEU 26 0.489 5.496 5.850 206 HA LEU 26 HA LEU 26 -2.092 6.398 6.426 207 HB2 LEU 26 HB2 LEU 26 0.090 7.751 4.831 208 HB3 LEU 26 HB1 LEU 26 -1.294 8.559 5.556 209 HG LEU 26 HG LEU 26 0.784 7.045 7.142 210 HD11 LEU 26 HD11 LEU 26 0.538 10.017 6.730 211 HD12 LEU 26 HD12 LEU 26 1.809 8.983 6.079 212 HD13 LEU 26 HD13 LEU 26 1.660 9.200 7.819 213 HD21 LEU 26 HD21 LEU 26 -1.417 8.925 7.983 214 HD22 LEU 26 HD22 LEU 26 -0.207 8.216 9.053 215 HD23 LEU 26 HD23 LEU 26 -1.376 7.180 8.236 216 H ILE 27 HN ILE 27 -0.575 5.504 3.405 217 HA ILE 27 HA ILE 27 -2.685 6.307 1.685 218 HB ILE 27 HB ILE 27 -0.570 4.177 1.382 219 HG12 ILE 27 HG12 ILE 27 -0.826 6.931 0.167 220 HG13 ILE 27 HG11 ILE 27 0.242 6.495 1.511 221 HG21 ILE 27 HG21 ILE 27 -2.466 3.595 -0.014 222 HG22 ILE 27 HG22 ILE 27 -1.121 4.158 -1.008 223 HG23 ILE 27 HG23 ILE 27 -2.490 5.222 -0.691 224 HD11 ILE 27 HD11 ILE 27 1.444 6.586 -0.594 225 HD12 ILE 27 HD12 ILE 27 0.359 5.373 -1.274 226 HD13 ILE 27 HD13 ILE 27 1.426 4.949 0.064 227 H THR 28 HN THR 28 -1.785 3.122 2.994 228 HA THR 28 HA THR 28 -3.817 1.640 1.868 229 HB THR 28 HB THR 28 -1.737 0.942 3.383 230 HG1 THR 28 HG1 THR 28 -3.574 -0.313 2.146 231 HG21 THR 28 HG21 THR 28 -2.653 1.720 5.504 232 HG22 THR 28 HG22 THR 28 -2.505 -0.036 5.513 233 HG23 THR 28 HG23 THR 28 -4.086 0.715 5.273 234 H GLN 29 HN GLN 29 -3.920 3.565 4.820 235 HA GLN 29 HA GLN 29 -6.357 2.707 5.883 236 HB2 GLN 29 HB2 GLN 29 -5.193 5.498 5.889 237 HB3 GLN 29 HB1 GLN 29 -6.459 4.918 6.960 238 HG2 GLN 29 HG2 GLN 29 -3.731 3.684 6.854 239 HG3 GLN 29 HG1 GLN 29 -4.139 5.038 7.901 240 HE21 GLN 29 HE21 GLN 29 -3.729 3.819 9.752 241 HE22 GLN 29 HE22 GLN 29 -4.808 2.578 10.293 242 H LYS 30 HN LYS 30 -5.686 5.438 3.758 243 HA LYS 30 HA LYS 30 -8.433 6.068 3.363 244 HB2 LYS 30 HB2 LYS 30 -6.154 6.890 1.573 245 HB3 LYS 30 HB1 LYS 30 -7.674 7.731 1.834 246 HG2 LYS 30 HG2 LYS 30 -5.367 7.459 3.740 247 HG3 LYS 30 HG1 LYS 30 -5.998 8.930 2.999 248 HD2 LYS 30 HD2 LYS 30 -8.103 8.628 4.264 249 HD3 LYS 30 HD1 LYS 30 -7.414 7.197 5.028 250 HE2 LYS 30 HE2 LYS 30 -7.247 9.153 6.480 251 HE3 LYS 30 HE1 LYS 30 -5.656 8.549 6.022 252 HZ1 LYS 30 HZ1 LYS 30 -5.516 10.299 4.355 253 HZ2 LYS 30 HZ2 LYS 30 -5.753 10.953 5.896 254 HZ3 LYS 30 HZ3 LYS 30 -7.041 10.879 4.807 255 H GLU 31 HN GLU 31 -6.044 4.220 1.555 256 HA GLU 31 HA GLU 31 -7.341 3.802 -0.842 257 HB2 GLU 31 HB2 GLU 31 -5.434 2.194 0.785 258 HB3 GLU 31 HB1 GLU 31 -6.205 1.418 -0.589 259 HG2 GLU 31 HG2 GLU 31 -4.757 4.034 -0.830 260 HG3 GLU 31 HG1 GLU 31 -3.939 2.481 -0.983 261 H GLU 32 HN GLU 32 -7.492 1.594 1.965 262 HA GLU 32 HA GLU 32 -9.322 -0.170 0.853 263 HB2 GLU 32 HB2 GLU 32 -9.828 -0.809 3.255 264 HB3 GLU 32 HB1 GLU 32 -8.145 -0.899 2.761 265 HG2 GLU 32 HG2 GLU 32 -7.630 1.137 3.907 266 HG3 GLU 32 HG1 GLU 32 -9.337 1.421 4.259 267 H LYS 33 HN LYS 33 -9.920 2.801 2.654 268 HA LYS 33 HA LYS 33 -12.724 2.333 2.939 269 HB2 LYS 33 HB2 LYS 33 -11.138 4.887 3.222 270 HB3 LYS 33 HB1 LYS 33 -12.814 4.674 3.710 271 HG2 LYS 33 HG2 LYS 33 -12.091 2.917 5.290 272 HG3 LYS 33 HG1 LYS 33 -10.416 3.258 4.850 273 HD2 LYS 33 HD2 LYS 33 -10.691 5.568 5.620 274 HD3 LYS 33 HD1 LYS 33 -12.359 5.215 6.075 275 HE2 LYS 33 HE2 LYS 33 -9.884 3.931 7.220 276 HE3 LYS 33 HE1 LYS 33 -10.897 5.134 8.017 277 HZ1 LYS 33 HZ1 LYS 33 -12.742 3.552 7.929 278 HZ2 LYS 33 HZ2 LYS 33 -11.431 2.937 8.800 279 HZ3 LYS 33 HZ3 LYS 33 -11.727 2.396 7.229 280 H ILE 34 HN ILE 34 -10.761 4.298 0.725 281 HA ILE 34 HA ILE 34 -12.948 5.490 -0.615 282 HB ILE 34 HB ILE 34 -10.098 5.047 -1.511 283 HG12 ILE 34 HG12 ILE 34 -11.432 7.659 -0.882 284 HG13 ILE 34 HG11 ILE 34 -10.818 6.639 0.420 285 HG21 ILE 34 HG21 ILE 34 -10.538 6.614 -3.324 286 HG22 ILE 34 HG22 ILE 34 -12.242 6.667 -2.874 287 HG23 ILE 34 HG23 ILE 34 -11.536 5.167 -3.478 288 HD11 ILE 34 HD11 ILE 34 -8.582 6.736 -0.532 289 HD12 ILE 34 HD12 ILE 34 -9.208 8.358 -0.234 290 HD13 ILE 34 HD13 ILE 34 -9.185 7.711 -1.873 291 H ARG 35 HN ARG 35 -11.345 2.413 -0.981 292 HA ARG 35 HA ARG 35 -12.325 1.699 -3.519 293 HB2 ARG 35 HB2 ARG 35 -11.669 -0.039 -1.142 294 HB3 ARG 35 HB1 ARG 35 -11.936 -0.636 -2.779 295 HG2 ARG 35 HG2 ARG 35 -10.031 0.635 -3.583 296 HG3 ARG 35 HG1 ARG 35 -9.776 1.299 -1.971 297 HD2 ARG 35 HD2 ARG 35 -9.409 -1.007 -1.135 298 HD3 ARG 35 HD1 ARG 35 -9.529 -1.589 -2.797 299 HE ARG 35 HE ARG 35 -7.619 0.320 -2.950 300 HH11 ARG 35 HH11 ARG 35 -8.036 -2.510 -0.935 301 HH12 ARG 35 HH12 ARG 35 -6.336 -2.734 -0.679 302 HH21 ARG 35 HH21 ARG 35 -5.385 0.054 -2.601 303 HH22 ARG 35 HH22 ARG 35 -4.822 -1.281 -1.633 304 H VAL 36 HN VAL 36 -13.701 1.502 -0.316 305 HA VAL 36 HA VAL 36 -16.068 0.101 -1.043 306 HB VAL 36 HB VAL 36 -15.727 2.012 1.266 307 HG11 VAL 36 HG11 VAL 36 -17.466 -0.427 0.920 308 HG12 VAL 36 HG12 VAL 36 -18.010 1.250 0.875 309 HG13 VAL 36 HG13 VAL 36 -17.363 0.572 2.369 310 HG21 VAL 36 HG21 VAL 36 -14.814 0.226 2.565 311 HG22 VAL 36 HG22 VAL 36 -13.852 0.373 1.086 312 HG23 VAL 36 HG23 VAL 36 -15.046 -0.919 1.245 313 H LEU 37 HN LEU 37 -15.100 3.456 -0.891 314 HA LEU 37 HA LEU 37 -17.661 4.562 -1.474 315 HB2 LEU 37 HB2 LEU 37 -14.931 5.523 -1.132 316 HB3 LEU 37 HB1 LEU 37 -15.812 6.401 -2.370 317 HG LEU 37 HG LEU 37 -15.912 7.357 -0.024 318 HD11 LEU 37 HD11 LEU 37 -18.540 6.631 -1.322 319 HD12 LEU 37 HD12 LEU 37 -17.482 7.953 -1.841 320 HD13 LEU 37 HD13 LEU 37 -18.237 7.997 -0.244 321 HD21 LEU 37 HD21 LEU 37 -17.458 6.321 1.531 322 HD22 LEU 37 HD22 LEU 37 -16.167 5.191 1.115 323 HD23 LEU 37 HD23 LEU 37 -17.760 5.014 0.387 324 H ARG 38 HN ARG 38 -15.051 3.305 -3.360 325 HA ARG 38 HA ARG 38 -15.838 4.279 -5.885 326 HB2 ARG 38 HB2 ARG 38 -14.417 1.724 -5.131 327 HB3 ARG 38 HB1 ARG 38 -14.664 2.242 -6.793 328 HG2 ARG 38 HG2 ARG 38 -13.396 4.297 -6.317 329 HG3 ARG 38 HG1 ARG 38 -13.105 3.712 -4.679 330 HD2 ARG 38 HD2 ARG 38 -11.181 3.246 -6.058 331 HD3 ARG 38 HD1 ARG 38 -11.974 1.735 -5.615 332 HE ARG 38 HE ARG 38 -12.922 2.693 -8.120 333 HH11 ARG 38 HH11 ARG 38 -10.206 1.086 -6.606 334 HH12 ARG 38 HH12 ARG 38 -9.720 0.261 -8.049 335 HH21 ARG 38 HH21 ARG 38 -12.283 1.591 -10.038 336 HH22 ARG 38 HH22 ARG 38 -10.908 0.531 -9.993 337 H GLN 39 HN GLN 39 -16.862 1.510 -3.977 338 HA GLN 39 HA GLN 39 -18.624 0.366 -5.837 339 HB2 GLN 39 HB2 GLN 39 -18.963 0.455 -2.837 340 HB3 GLN 39 HB1 GLN 39 -19.644 -0.730 -3.942 341 HG2 GLN 39 HG2 GLN 39 -16.703 -0.330 -3.493 342 HG3 GLN 39 HG1 GLN 39 -17.681 -1.521 -2.650 343 HE21 GLN 39 HE21 GLN 39 -19.301 -2.053 -5.054 344 HE22 GLN 39 HE22 GLN 39 -18.296 -3.013 -6.080 345 H ARG 40 HN ARG 40 -19.044 2.980 -3.498 346 HA ARG 40 HA ARG 40 -21.764 3.498 -4.002 347 HB2 ARG 40 HB2 ARG 40 -19.488 5.022 -2.846 348 HB3 ARG 40 HB1 ARG 40 -20.868 5.950 -3.395 349 HG2 ARG 40 HG2 ARG 40 -21.076 5.514 -1.049 350 HG3 ARG 40 HG1 ARG 40 -22.317 4.619 -1.921 351 HD2 ARG 40 HD2 ARG 40 -19.719 3.321 -1.233 352 HD3 ARG 40 HD1 ARG 40 -20.992 3.455 -0.026 353 HE ARG 40 HE ARG 40 -22.111 2.377 -2.366 354 HH11 ARG 40 HH11 ARG 40 -19.854 1.528 0.168 355 HH12 ARG 40 HH12 ARG 40 -20.113 -0.179 0.005 356 HH21 ARG 40 HH21 ARG 40 -22.475 0.128 -2.567 357 HH22 ARG 40 HH22 ARG 40 -21.611 -0.977 -1.547 358 H LEU 41 HN LEU 41 -18.787 4.612 -5.538 359 HA LEU 41 HA LEU 41 -20.024 6.439 -7.311 360 HB2 LEU 41 HB2 LEU 41 -17.501 4.945 -7.956 361 HB3 LEU 41 HB1 LEU 41 -17.992 6.549 -8.464 362 HG LEU 41 HG LEU 41 -17.174 5.777 -5.663 363 HD11 LEU 41 HD11 LEU 41 -15.156 7.003 -6.089 364 HD12 LEU 41 HD12 LEU 41 -15.716 7.447 -7.700 365 HD13 LEU 41 HD13 LEU 41 -15.343 5.765 -7.328 366 HD21 LEU 41 HD21 LEU 41 -17.802 8.485 -6.835 367 HD22 LEU 41 HD22 LEU 41 -17.221 8.163 -5.199 368 HD23 LEU 41 HD23 LEU 41 -18.814 7.593 -5.699 369 H VAL 42 HN VAL 42 -19.277 2.998 -7.492 370 HA VAL 42 HA VAL 42 -20.060 2.409 -10.089 371 HB VAL 42 HB VAL 42 -20.578 0.846 -7.547 372 HG11 VAL 42 HG11 VAL 42 -20.770 -0.078 -10.408 373 HG12 VAL 42 HG12 VAL 42 -22.105 0.105 -9.268 374 HG13 VAL 42 HG13 VAL 42 -20.865 -1.116 -8.985 375 HG21 VAL 42 HG21 VAL 42 -18.225 1.204 -7.949 376 HG22 VAL 42 HG22 VAL 42 -18.393 0.635 -9.612 377 HG23 VAL 42 HG23 VAL 42 -18.631 -0.483 -8.266 378 H GLU 43 HN GLU 43 -21.997 2.818 -7.186 379 HA GLU 43 HA GLU 43 -24.516 2.323 -8.387 380 HB2 GLU 43 HB2 GLU 43 -23.880 3.852 -5.859 381 HB3 GLU 43 HB1 GLU 43 -25.434 3.152 -6.288 382 HG2 GLU 43 HG2 GLU 43 -24.478 0.921 -6.187 383 HG3 GLU 43 HG1 GLU 43 -22.900 1.603 -5.799 384 H ARG 44 HN ARG 44 -22.429 4.977 -8.556 385 HA ARG 44 HA ARG 44 -24.624 6.831 -9.166 386 HB2 ARG 44 HB2 ARG 44 -21.681 7.440 -8.773 387 HB3 ARG 44 HB1 ARG 44 -22.969 8.615 -9.010 388 HG2 ARG 44 HG2 ARG 44 -24.001 7.591 -6.901 389 HG3 ARG 44 HG1 ARG 44 -22.393 6.921 -6.627 390 HD2 ARG 44 HD2 ARG 44 -23.271 9.784 -6.704 391 HD3 ARG 44 HD1 ARG 44 -22.372 8.936 -5.450 392 HE ARG 44 HE ARG 44 -21.097 9.356 -8.051 393 HH11 ARG 44 HH11 ARG 44 -21.270 10.086 -4.629 394 HH12 ARG 44 HH12 ARG 44 -19.774 10.967 -4.618 395 HH21 ARG 44 HH21 ARG 44 -19.131 10.546 -8.043 396 HH22 ARG 44 HH22 ARG 44 -18.571 11.233 -6.546 397 H GLY 45 HN GLY 45 -22.022 5.070 -10.530 398 HA2 GLY 45 HA2 GLY 45 -21.362 4.779 -12.723 399 HA3 GLY 45 HA1 GLY 45 -22.653 5.874 -13.219 400 H ASP 46 HN ASP 46 -20.094 6.464 -10.892 401 HA ASP 46 HA ASP 46 -19.830 9.150 -11.686 402 HB2 ASP 46 HB2 ASP 46 -19.337 8.199 -9.418 403 HB3 ASP 46 HB1 ASP 46 -17.851 7.535 -10.088 404 H ALA 47 HN ALA 47 -18.148 6.272 -12.675 405 HA ALA 47 HA ALA 47 -15.884 7.636 -13.778 406 HB1 ALA 47 HB1 ALA 47 -15.738 5.328 -12.981 407 HB2 ALA 47 HB2 ALA 47 -15.256 5.466 -14.671 408 HB3 ALA 47 HB3 ALA 47 -16.844 4.820 -14.257 409 H LYS 48 HN LYS 48 -19.058 6.905 -14.899 410 HA LYS 48 HA LYS 48 -18.247 7.436 -17.687 411 HB2 LYS 48 HB2 LYS 48 -19.649 5.315 -16.766 412 HB3 LYS 48 HB1 LYS 48 -20.971 6.422 -17.102 413 HG2 LYS 48 HG2 LYS 48 -18.861 5.618 -19.092 414 HG3 LYS 48 HG1 LYS 48 -20.464 4.896 -18.972 415 HD2 LYS 48 HD2 LYS 48 -21.505 6.988 -19.534 416 HD3 LYS 48 HD1 LYS 48 -19.950 7.822 -19.482 417 HE2 LYS 48 HE2 LYS 48 -19.167 6.449 -21.343 418 HE3 LYS 48 HE1 LYS 48 -20.734 5.643 -21.403 419 HZ1 LYS 48 HZ1 LYS 48 -21.753 7.793 -21.900 420 HZ2 LYS 48 HZ2 LYS 48 -20.608 7.365 -23.065 421 HZ3 LYS 48 HZ3 LYS 48 -20.229 8.527 -21.897 422 H GLY 49 HN GLY 49 -20.790 8.102 -15.304 423 HA2 GLY 49 HA2 GLY 49 -21.189 10.667 -15.249 424 HA3 GLY 49 HA1 GLY 49 -21.697 10.386 -16.910 425 H THR 50 HN THR 50 -23.182 8.266 -16.955 426 HA THR 50 HA THR 50 -25.000 8.107 -14.714 427 HB THR 50 HB THR 50 -26.023 8.985 -17.428 428 HG1 THR 50 HG1 THR 50 -25.070 10.414 -15.332 429 HG21 THR 50 HG21 THR 50 -28.180 9.198 -16.298 430 HG22 THR 50 HG22 THR 50 -27.462 8.623 -14.795 431 HG23 THR 50 HG23 THR 50 -27.580 7.545 -16.185 432 H GLU 51 HN GLU 51 -25.377 6.008 -14.476 433 HA GLU 51 HA GLU 51 -24.779 4.110 -16.526 434 HB2 GLU 51 HB2 GLU 51 -26.067 3.789 -13.816 435 HB3 GLU 51 HB1 GLU 51 -25.663 2.445 -14.874 436 HG2 GLU 51 HG2 GLU 51 -23.720 4.417 -13.717 437 HG3 GLU 51 HG1 GLU 51 -23.986 2.772 -13.154 438 H LEU 52 HN LEU 52 -26.043 3.795 -18.205 439 HA LEU 52 HA LEU 52 -28.923 4.150 -17.920 440 HB2 LEU 52 HB2 LEU 52 -27.271 3.793 -20.415 441 HB3 LEU 52 HB1 LEU 52 -28.981 4.169 -20.365 442 HG LEU 52 HG LEU 52 -26.740 5.961 -19.430 443 HD11 LEU 52 HD11 LEU 52 -27.443 7.388 -21.289 444 HD12 LEU 52 HD12 LEU 52 -28.621 6.168 -21.776 445 HD13 LEU 52 HD13 LEU 52 -26.895 5.810 -21.850 446 HD21 LEU 52 HD21 LEU 52 -28.685 6.261 -18.026 447 HD22 LEU 52 HD22 LEU 52 -29.722 6.399 -19.445 448 HD23 LEU 52 HD23 LEU 52 -28.512 7.638 -19.115 449 H ASN 53 HN ASN 53 -26.530 1.761 -18.354 450 HA ASN 53 HA ASN 53 -28.488 -0.258 -19.148 451 HB2 ASN 53 HB2 ASN 53 -25.477 -0.345 -18.940 452 HB3 ASN 53 HB1 ASN 53 -26.460 -1.764 -19.290 453 HD21 ASN 53 HD21 ASN 53 -25.214 1.227 -20.491 454 HD22 ASN 53 HD22 ASN 53 -25.690 1.005 -22.137 455 H GLY 84 HN GLY 84 10.331 -15.654 -17.681 456 HA2 GLY 84 HA2 GLY 84 11.715 -17.406 -16.472 457 HA3 GLY 84 HA1 GLY 84 12.923 -16.133 -16.359 458 HA PRO 85 HA PRO 85 10.395 -15.501 -12.633 459 HB2 PRO 85 HB2 PRO 85 12.337 -15.423 -10.831 460 HB3 PRO 85 HB1 PRO 85 11.860 -16.966 -11.554 461 HG2 PRO 85 HG2 PRO 85 14.217 -15.236 -12.154 462 HG3 PRO 85 HG1 PRO 85 14.118 -17.005 -12.071 463 HD2 PRO 85 HD2 PRO 85 14.014 -15.470 -14.415 464 HD3 PRO 85 HD1 PRO 85 13.515 -17.165 -14.265 465 H LEU 86 HN LEU 86 10.969 -13.796 -10.762 466 HA LEU 86 HA LEU 86 10.776 -11.247 -11.783 467 HB2 LEU 86 HB2 LEU 86 11.052 -10.442 -9.587 468 HB3 LEU 86 HB1 LEU 86 10.297 -12.011 -9.429 469 HG LEU 86 HG LEU 86 13.218 -11.407 -8.936 470 HD11 LEU 86 HD11 LEU 86 11.760 -10.459 -7.238 471 HD12 LEU 86 HD12 LEU 86 12.666 -11.826 -6.593 472 HD13 LEU 86 HD13 LEU 86 10.969 -12.021 -7.028 473 HD21 LEU 86 HD21 LEU 86 12.896 -13.691 -9.756 474 HD22 LEU 86 HD22 LEU 86 11.676 -13.963 -8.511 475 HD23 LEU 86 HD23 LEU 86 13.352 -13.675 -8.052 476 H GLY 87 HN GLY 87 12.202 -9.461 -11.881 477 HA2 GLY 87 HA2 GLY 87 14.836 -10.207 -12.856 478 HA3 GLY 87 HA1 GLY 87 14.094 -8.617 -12.958 479 H SER 88 HN SER 88 13.861 -9.896 -9.864 480 HA SER 88 HA SER 88 15.796 -8.001 -8.858 481 HB2 SER 88 HB2 SER 88 14.072 -9.928 -7.292 482 HB3 SER 88 HB1 SER 88 14.856 -8.467 -6.693 483 HG SER 88 HG SER 88 12.624 -8.149 -7.146 484 H ARG 89 HN ARG 89 16.364 -10.756 -10.220 485 HA ARG 89 HA ARG 89 17.604 -12.375 -8.246 486 HB2 ARG 89 HB2 ARG 89 17.793 -12.346 -11.255 487 HB3 ARG 89 HB1 ARG 89 18.624 -13.532 -10.255 488 HG2 ARG 89 HG2 ARG 89 15.645 -13.095 -10.246 489 HG3 ARG 89 HG1 ARG 89 16.474 -14.328 -11.198 490 HD2 ARG 89 HD2 ARG 89 17.347 -15.334 -9.163 491 HD3 ARG 89 HD1 ARG 89 16.577 -14.082 -8.193 492 HE ARG 89 HE ARG 89 14.465 -15.084 -9.419 493 HH11 ARG 89 HH11 ARG 89 17.175 -16.750 -7.969 494 HH12 ARG 89 HH12 ARG 89 16.243 -18.140 -7.511 495 HH21 ARG 89 HH21 ARG 89 13.220 -16.916 -8.800 496 HH22 ARG 89 HH22 ARG 89 14.003 -18.238 -7.996 497 H ARG 90 HN ARG 90 18.657 -9.590 -9.951 498 HA ARG 90 HA ARG 90 21.477 -10.136 -9.542 499 HB2 ARG 90 HB2 ARG 90 20.198 -7.527 -10.381 500 HB3 ARG 90 HB1 ARG 90 21.877 -8.000 -10.579 501 HG2 ARG 90 HG2 ARG 90 21.251 -9.686 -12.194 502 HG3 ARG 90 HG1 ARG 90 19.543 -9.315 -11.952 503 HD2 ARG 90 HD2 ARG 90 20.002 -6.995 -12.722 504 HD3 ARG 90 HD1 ARG 90 21.653 -7.489 -13.090 505 HE ARG 90 HE ARG 90 20.030 -9.271 -14.425 506 HH11 ARG 90 HH11 ARG 90 20.521 -5.810 -14.433 507 HH12 ARG 90 HH12 ARG 90 20.053 -5.616 -16.090 508 HH21 ARG 90 HH21 ARG 90 19.420 -9.024 -16.607 509 HH22 ARG 90 HH22 ARG 90 19.427 -7.448 -17.331 510 H PHE 91 HN PHE 91 21.209 -10.491 -7.264 511 HA PHE 91 HA PHE 91 19.921 -8.839 -5.473 512 HB2 PHE 91 HB2 PHE 91 22.267 -10.672 -4.996 513 HB3 PHE 91 HB1 PHE 91 21.291 -9.954 -3.720 514 HD1 PHE 91 HD1 PHE 91 21.707 -12.759 -5.794 515 HD2 PHE 91 HD2 PHE 91 18.719 -10.389 -3.905 516 HE1 PHE 91 HE1 PHE 91 20.120 -14.632 -5.958 517 HE2 PHE 91 HE2 PHE 91 17.130 -12.260 -4.064 518 HZ PHE 91 HZ PHE 91 17.830 -14.384 -5.092 519 H VAL 92 HN VAL 92 23.443 -8.795 -6.198 520 HA VAL 92 HA VAL 92 23.734 -6.596 -4.351 521 HB VAL 92 HB VAL 92 25.529 -8.284 -4.593 522 HG11 VAL 92 HG11 VAL 92 25.475 -8.701 -6.960 523 HG12 VAL 92 HG12 VAL 92 27.076 -8.121 -6.510 524 HG13 VAL 92 HG13 VAL 92 25.936 -7.035 -7.303 525 HG21 VAL 92 HG21 VAL 92 27.391 -6.699 -4.565 526 HG22 VAL 92 HG22 VAL 92 26.013 -6.106 -3.641 527 HG23 VAL 92 HG23 VAL 92 26.341 -5.459 -5.248 528 H VAL 93 HN VAL 93 23.445 -7.031 -7.793 529 HA VAL 93 HA VAL 93 24.497 -4.568 -8.622 530 HB VAL 93 HB VAL 93 22.356 -6.184 -9.984 531 HG11 VAL 93 HG11 VAL 93 23.171 -5.106 -12.036 532 HG12 VAL 93 HG12 VAL 93 24.265 -4.121 -11.067 533 HG13 VAL 93 HG13 VAL 93 22.521 -3.938 -10.886 534 HG21 VAL 93 HG21 VAL 93 25.356 -6.317 -10.251 535 HG22 VAL 93 HG22 VAL 93 24.201 -7.188 -11.259 536 HG23 VAL 93 HG23 VAL 93 24.315 -7.549 -9.538 537 H ASP 94 HN ASP 94 21.028 -5.477 -8.398 538 HA ASP 94 HA ASP 94 20.440 -2.642 -8.648 539 HB2 ASP 94 HB2 ASP 94 18.524 -4.956 -8.656 540 HB3 ASP 94 HB1 ASP 94 18.110 -3.290 -8.980 541 H ASP 95 HN ASP 95 19.878 -5.245 -6.249 542 HA ASP 95 HA ASP 95 18.162 -3.758 -4.625 543 HB2 ASP 95 HB2 ASP 95 18.403 -6.077 -4.173 544 HB3 ASP 95 HB1 ASP 95 20.125 -5.915 -3.861 545 H ARG 96 HN ARG 96 21.558 -3.372 -5.114 546 HA ARG 96 HA ARG 96 21.898 -1.897 -2.630 547 HB2 ARG 96 HB2 ARG 96 23.757 -2.352 -4.960 548 HB3 ARG 96 HB1 ARG 96 24.176 -1.375 -3.563 549 HG2 ARG 96 HG2 ARG 96 23.468 -4.300 -3.484 550 HG3 ARG 96 HG1 ARG 96 25.102 -3.643 -3.455 551 HD2 ARG 96 HD2 ARG 96 24.710 -3.983 -1.219 552 HD3 ARG 96 HD1 ARG 96 24.225 -2.301 -1.402 553 HE ARG 96 HE ARG 96 21.939 -3.792 -1.800 554 HH11 ARG 96 HH11 ARG 96 24.279 -3.328 0.771 555 HH12 ARG 96 HH12 ARG 96 23.138 -3.707 2.031 556 HH21 ARG 96 HH21 ARG 96 20.450 -4.299 -0.158 557 HH22 ARG 96 HH22 ARG 96 20.958 -4.233 1.509 558 H ARG 97 HN ARG 97 22.558 -1.003 -6.018 559 HA ARG 97 HA ARG 97 22.465 1.760 -5.573 560 HB2 ARG 97 HB2 ARG 97 21.911 0.352 -8.173 561 HB3 ARG 97 HB1 ARG 97 22.655 1.904 -7.918 562 HG2 ARG 97 HG2 ARG 97 24.689 0.988 -7.270 563 HG3 ARG 97 HG1 ARG 97 23.967 -0.598 -6.970 564 HD2 ARG 97 HD2 ARG 97 25.252 -0.577 -9.058 565 HD3 ARG 97 HD1 ARG 97 23.535 -0.874 -9.346 566 HE ARG 97 HE ARG 97 24.837 1.743 -9.771 567 HH11 ARG 97 HH11 ARG 97 22.561 -0.739 -10.727 568 HH12 ARG 97 HH12 ARG 97 21.951 0.156 -12.077 569 HH21 ARG 97 HH21 ARG 97 24.054 2.918 -11.561 570 HH22 ARG 97 HH22 ARG 97 22.804 2.236 -12.555 571 H GLU 98 HN GLU 98 20.178 -0.539 -6.898 572 HA GLU 98 HA GLU 98 18.379 1.479 -7.829 573 HB2 GLU 98 HB2 GLU 98 18.258 -1.521 -7.804 574 HB3 GLU 98 HB1 GLU 98 17.087 -0.462 -8.619 575 HG2 GLU 98 HG2 GLU 98 20.024 -0.386 -9.191 576 HG3 GLU 98 HG1 GLU 98 18.922 -1.482 -10.037 577 H LEU 99 HN LEU 99 18.375 -0.948 -5.215 578 HA LEU 99 HA LEU 99 15.604 -0.658 -4.698 579 HB2 LEU 99 HB2 LEU 99 16.736 -2.650 -4.036 580 HB3 LEU 99 HB1 LEU 99 17.862 -1.759 -3.044 581 HG LEU 99 HG LEU 99 15.996 -3.132 -1.927 582 HD11 LEU 99 HD11 LEU 99 15.850 -1.505 -0.095 583 HD12 LEU 99 HD12 LEU 99 16.558 -0.281 -1.153 584 HD13 LEU 99 HD13 LEU 99 17.490 -1.715 -0.711 585 HD21 LEU 99 HD21 LEU 99 14.118 -2.316 -3.212 586 HD22 LEU 99 HD22 LEU 99 14.441 -0.664 -2.687 587 HD23 LEU 99 HD23 LEU 99 13.924 -1.878 -1.515 588 H GLN 100 HN GLN 100 18.487 0.764 -3.095 589 HA GLN 100 HA GLN 100 16.987 2.380 -1.325 590 HB2 GLN 100 HB2 GLN 100 19.027 3.712 -1.077 591 HB3 GLN 100 HB1 GLN 100 19.386 1.994 -1.011 592 HG2 GLN 100 HG2 GLN 100 21.058 2.598 -2.387 593 HG3 GLN 100 HG1 GLN 100 19.806 2.437 -3.616 594 HE21 GLN 100 HE21 GLN 100 20.717 3.909 -5.004 595 HE22 GLN 100 HE22 GLN 100 20.768 5.608 -4.671 596 H TYR 101 HN TYR 101 17.885 2.707 -4.648 597 HA TYR 101 HA TYR 101 17.292 5.433 -5.057 598 HB2 TYR 101 HB2 TYR 101 18.644 4.127 -6.623 599 HB3 TYR 101 HB1 TYR 101 17.269 3.084 -6.988 600 HD1 TYR 101 HD1 TYR 101 18.707 6.449 -7.442 601 HD2 TYR 101 HD2 TYR 101 15.562 3.792 -8.518 602 HE1 TYR 101 HE1 TYR 101 18.089 7.939 -9.298 603 HE2 TYR 101 HE2 TYR 101 14.936 5.277 -10.373 604 HH TYR 101 HH TYR 101 16.915 7.791 -11.468 605 H ARG 102 HN ARG 102 15.279 2.525 -5.225 606 HA ARG 102 HA ARG 102 13.066 4.021 -6.306 607 HB2 ARG 102 HB2 ARG 102 11.806 1.962 -6.224 608 HB3 ARG 102 HB1 ARG 102 13.392 1.666 -6.919 609 HG2 ARG 102 HG2 ARG 102 14.133 0.805 -4.715 610 HG3 ARG 102 HG1 ARG 102 12.474 0.981 -4.140 611 HD2 ARG 102 HD2 ARG 102 12.939 -1.310 -4.855 612 HD3 ARG 102 HD1 ARG 102 11.697 -0.557 -5.855 613 HE ARG 102 HE ARG 102 13.884 -0.075 -7.303 614 HH11 ARG 102 HH11 ARG 102 12.800 -3.001 -5.727 615 HH12 ARG 102 HH12 ARG 102 13.533 -4.056 -6.891 616 HH21 ARG 102 HH21 ARG 102 14.838 -1.446 -8.849 617 HH22 ARG 102 HH22 ARG 102 14.692 -3.168 -8.681 618 H VAL 103 HN VAL 103 14.223 3.269 -3.140 619 HA VAL 103 HA VAL 103 11.721 3.485 -1.797 620 HB VAL 103 HB VAL 103 14.419 4.084 -0.575 621 HG11 VAL 103 HG11 VAL 103 13.386 3.211 1.459 622 HG12 VAL 103 HG12 VAL 103 11.871 2.974 0.582 623 HG13 VAL 103 HG13 VAL 103 12.496 4.602 0.829 624 HG21 VAL 103 HG21 VAL 103 13.102 1.405 -0.975 625 HG22 VAL 103 HG22 VAL 103 14.524 1.708 0.018 626 HG23 VAL 103 HG23 VAL 103 14.598 1.962 -1.723 627 H GLU 104 HN GLU 104 14.332 5.832 -2.446 628 HA GLU 104 HA GLU 104 13.070 8.029 -1.257 629 HB2 GLU 104 HB2 GLU 104 14.477 9.336 -3.064 630 HB3 GLU 104 HB1 GLU 104 15.239 8.556 -1.687 631 HG2 GLU 104 HG2 GLU 104 15.991 6.775 -2.965 632 HG3 GLU 104 HG1 GLU 104 14.927 7.166 -4.313 633 H VAL 105 HN VAL 105 12.873 6.927 -4.669 634 HA VAL 105 HA VAL 105 11.105 8.997 -5.414 635 HB VAL 105 HB VAL 105 11.818 8.006 -7.331 636 HG11 VAL 105 HG11 VAL 105 12.985 6.152 -6.306 637 HG12 VAL 105 HG12 VAL 105 12.066 5.605 -7.708 638 HG13 VAL 105 HG13 VAL 105 11.458 5.299 -6.080 639 HG21 VAL 105 HG21 VAL 105 9.280 6.502 -6.786 640 HG22 VAL 105 HG22 VAL 105 10.056 6.632 -8.363 641 HG23 VAL 105 HG23 VAL 105 9.438 8.077 -7.564 642 H GLN 106 HN GLN 106 10.476 5.776 -4.057 643 HA GLN 106 HA GLN 106 7.673 5.938 -4.169 644 HB2 GLN 106 HB2 GLN 106 9.520 4.420 -2.335 645 HB3 GLN 106 HB1 GLN 106 7.773 4.287 -2.228 646 HG2 GLN 106 HG2 GLN 106 9.518 3.538 -4.550 647 HG3 GLN 106 HG1 GLN 106 8.589 2.460 -3.514 648 HE21 GLN 106 HE21 GLN 106 8.490 4.669 -6.171 649 HE22 GLN 106 HE22 GLN 106 6.869 4.330 -6.666 650 H ASN 107 HN ASN 107 9.968 7.079 -1.731 651 HA ASN 107 HA ASN 107 8.274 7.970 0.270 652 HB2 ASN 107 HB2 ASN 107 10.592 8.188 0.646 653 HB3 ASN 107 HB1 ASN 107 10.836 9.118 -0.830 654 HD21 ASN 107 HD21 ASN 107 9.464 9.205 2.389 655 HD22 ASN 107 HD22 ASN 107 9.532 10.919 2.581 656 H ARG 108 HN ARG 108 9.148 9.587 -2.749 657 HA ARG 108 HA ARG 108 7.514 11.885 -2.244 658 HB2 ARG 108 HB2 ARG 108 8.942 10.897 -4.714 659 HB3 ARG 108 HB1 ARG 108 8.076 12.419 -4.631 660 HG2 ARG 108 HG2 ARG 108 9.584 13.146 -2.818 661 HG3 ARG 108 HG1 ARG 108 10.473 11.632 -2.989 662 HD2 ARG 108 HD2 ARG 108 11.020 12.219 -5.302 663 HD3 ARG 108 HD1 ARG 108 10.130 13.733 -5.130 664 HE ARG 108 HE ARG 108 12.139 13.465 -3.128 665 HH11 ARG 108 HH11 ARG 108 11.681 14.282 -6.505 666 HH12 ARG 108 HH12 ARG 108 13.091 15.288 -6.580 667 HH21 ARG 108 HH21 ARG 108 13.982 14.798 -3.223 668 HH22 ARG 108 HH22 ARG 108 14.394 15.592 -4.710 669 H VAL 109 HN VAL 109 7.314 9.081 -4.387 670 HA VAL 109 HA VAL 109 4.957 9.773 -5.709 671 HB VAL 109 HB VAL 109 6.043 7.015 -5.172 672 HG11 VAL 109 HG11 VAL 109 3.679 6.942 -5.804 673 HG12 VAL 109 HG12 VAL 109 4.706 6.306 -7.090 674 HG13 VAL 109 HG13 VAL 109 4.028 7.928 -7.224 675 HG21 VAL 109 HG21 VAL 109 7.646 8.369 -6.338 676 HG22 VAL 109 HG22 VAL 109 6.408 8.934 -7.466 677 HG23 VAL 109 HG23 VAL 109 6.919 7.245 -7.489 678 H TYR 110 HN TYR 110 5.389 7.730 -2.824 679 HA TYR 110 HA TYR 110 2.671 7.089 -2.515 680 HB2 TYR 110 HB2 TYR 110 4.955 7.228 -0.554 681 HB3 TYR 110 HB1 TYR 110 3.333 6.779 -0.058 682 HD1 TYR 110 HD1 TYR 110 2.604 5.122 -2.509 683 HD2 TYR 110 HD2 TYR 110 6.091 5.221 -0.071 684 HE1 TYR 110 HE1 TYR 110 3.037 2.764 -3.043 685 HE2 TYR 110 HE2 TYR 110 6.538 2.864 -0.610 686 HH TYR 110 HH TYR 110 5.042 1.222 -3.108 687 H LYS 111 HN LYS 111 4.548 9.889 -1.575 688 HA LYS 111 HA LYS 111 2.593 11.060 0.119 689 HB2 LYS 111 HB2 LYS 111 5.016 11.676 0.083 690 HB3 LYS 111 HB1 LYS 111 4.755 12.453 -1.471 691 HG2 LYS 111 HG2 LYS 111 3.195 14.017 -0.438 692 HG3 LYS 111 HG1 LYS 111 3.433 13.229 1.122 693 HD2 LYS 111 HD2 LYS 111 5.745 14.368 -0.417 694 HD3 LYS 111 HD1 LYS 111 4.749 15.388 0.617 695 HE2 LYS 111 HE2 LYS 111 6.680 14.672 1.854 696 HE3 LYS 111 HE1 LYS 111 5.253 13.890 2.520 697 HZ1 LYS 111 HZ1 LYS 111 5.851 11.856 1.508 698 HZ2 LYS 111 HZ2 LYS 111 7.249 12.440 2.250 699 HZ3 LYS 111 HZ3 LYS 111 7.066 12.574 0.573 700 H LYS 112 HN LYS 112 3.287 11.252 -3.324 701 HA LYS 112 HA LYS 112 1.433 13.250 -4.015 702 HB2 LYS 112 HB2 LYS 112 2.429 10.888 -5.624 703 HB3 LYS 112 HB1 LYS 112 1.539 12.249 -6.286 704 HG2 LYS 112 HG2 LYS 112 3.312 13.736 -5.902 705 HG3 LYS 112 HG1 LYS 112 4.132 12.603 -4.829 706 HD2 LYS 112 HD2 LYS 112 5.315 12.596 -6.893 707 HD3 LYS 112 HD1 LYS 112 4.418 11.087 -6.800 708 HE2 LYS 112 HE2 LYS 112 3.360 13.484 -8.260 709 HE3 LYS 112 HE1 LYS 112 4.429 12.313 -9.028 710 HZ1 LYS 112 HZ1 LYS 112 1.769 11.724 -7.843 711 HZ2 LYS 112 HZ2 LYS 112 2.798 10.580 -8.542 712 HZ3 LYS 112 HZ3 LYS 112 2.129 11.809 -9.490 713 H GLU 113 HN GLU 113 1.133 9.745 -3.685 714 HA GLU 113 HA GLU 113 -1.463 9.456 -4.676 715 HB2 GLU 113 HB2 GLU 113 -0.207 7.856 -2.438 716 HB3 GLU 113 HB1 GLU 113 -1.570 7.363 -3.441 717 HG2 GLU 113 HG2 GLU 113 0.033 7.597 -5.417 718 HG3 GLU 113 HG1 GLU 113 1.313 7.650 -4.204 719 H ILE 114 HN ILE 114 -0.332 10.067 -1.373 720 HA ILE 114 HA ILE 114 -2.799 10.009 -0.087 721 HB ILE 114 HB ILE 114 -0.322 11.608 0.553 722 HG12 ILE 114 HG12 ILE 114 -1.338 8.944 1.549 723 HG13 ILE 114 HG11 ILE 114 -0.025 9.177 0.402 724 HG21 ILE 114 HG21 ILE 114 -2.723 11.004 2.274 725 HG22 ILE 114 HG22 ILE 114 -2.180 12.595 1.730 726 HG23 ILE 114 HG23 ILE 114 -1.199 11.665 2.868 727 HD11 ILE 114 HD11 ILE 114 0.770 8.690 2.657 728 HD12 ILE 114 HD12 ILE 114 -0.020 10.155 3.242 729 HD13 ILE 114 HD13 ILE 114 1.302 10.268 2.079 730 H GLN 115 HN GLN 115 -1.264 12.628 -1.885 731 HA GLN 115 HA GLN 115 -3.061 14.671 -1.097 732 HB2 GLN 115 HB2 GLN 115 -1.595 14.463 -3.715 733 HB3 GLN 115 HB1 GLN 115 -2.208 15.920 -2.952 734 HG2 GLN 115 HG2 GLN 115 -0.632 15.417 -1.040 735 HG3 GLN 115 HG1 GLN 115 0.094 14.211 -2.106 736 HE21 GLN 115 HE21 GLN 115 -0.466 15.825 -4.482 737 HE22 GLN 115 HE22 GLN 115 0.702 17.094 -4.475 738 H ALA 116 HN ALA 116 -2.942 12.457 -3.825 739 HA ALA 116 HA ALA 116 -5.320 13.248 -5.101 740 HB1 ALA 116 HB1 ALA 116 -5.215 11.080 -6.214 741 HB2 ALA 116 HB2 ALA 116 -4.037 10.516 -5.028 742 HB3 ALA 116 HB3 ALA 116 -3.613 11.816 -6.144 743 H LEU 117 HN LEU 117 -4.644 10.715 -2.749 744 HA LEU 117 HA LEU 117 -7.238 9.698 -2.487 745 HB2 LEU 117 HB2 LEU 117 -4.995 9.779 -0.459 746 HB3 LEU 117 HB1 LEU 117 -6.409 8.750 -0.360 747 HG LEU 117 HG LEU 117 -4.305 8.621 -2.521 748 HD11 LEU 117 HD11 LEU 117 -4.830 6.798 -0.184 749 HD12 LEU 117 HD12 LEU 117 -3.431 7.850 -0.406 750 HD13 LEU 117 HD13 LEU 117 -3.693 6.489 -1.496 751 HD21 LEU 117 HD21 LEU 117 -6.647 6.806 -1.982 752 HD22 LEU 117 HD22 LEU 117 -5.411 6.582 -3.220 753 HD23 LEU 117 HD23 LEU 117 -6.515 7.952 -3.315 754 H ASP 118 HN ASP 118 -5.656 12.448 -1.066 755 HA ASP 118 HA ASP 118 -7.390 12.960 1.072 756 HB2 ASP 118 HB2 ASP 118 -5.282 14.074 0.958 757 HB3 ASP 118 HB1 ASP 118 -5.674 14.793 -0.600 758 H ALA 119 HN ALA 119 -7.638 13.794 -2.347 759 HA ALA 119 HA ALA 119 -9.921 15.468 -2.097 760 HB1 ALA 119 HB1 ALA 119 -10.223 15.081 -4.495 761 HB2 ALA 119 HB2 ALA 119 -9.032 13.782 -4.438 762 HB3 ALA 119 HB3 ALA 119 -8.539 15.444 -4.117 763 H GLU 120 HN GLU 120 -9.454 12.022 -2.670 764 HA GLU 120 HA GLU 120 -12.164 11.308 -2.770 765 HB2 GLU 120 HB2 GLU 120 -9.624 9.850 -2.204 766 HB3 GLU 120 HB1 GLU 120 -11.161 9.057 -1.929 767 HG2 GLU 120 HG2 GLU 120 -10.366 8.432 -4.058 768 HG3 GLU 120 HG1 GLU 120 -11.761 9.482 -4.282 769 H ILE 121 HN ILE 121 -9.996 11.941 -0.085 770 HA ILE 121 HA ILE 121 -11.502 10.852 1.988 771 HB ILE 121 HB ILE 121 -9.463 12.961 1.786 772 HG12 ILE 121 HG12 ILE 121 -8.583 11.778 3.770 773 HG13 ILE 121 HG11 ILE 121 -10.037 10.780 3.801 774 HG21 ILE 121 HG21 ILE 121 -9.817 13.860 4.019 775 HG22 ILE 121 HG22 ILE 121 -11.328 12.957 4.152 776 HG23 ILE 121 HG23 ILE 121 -11.168 14.240 2.952 777 HD11 ILE 121 HD11 ILE 121 -9.460 9.784 1.709 778 HD12 ILE 121 HD12 ILE 121 -8.061 9.690 2.777 779 HD13 ILE 121 HD13 ILE 121 -8.111 10.896 1.497 780 H ARG 122 HN ARG 122 -11.985 13.786 0.129 781 HA ARG 122 HA ARG 122 -14.019 14.941 1.670 782 HB2 ARG 122 HB2 ARG 122 -12.973 16.156 -0.147 783 HB3 ARG 122 HB1 ARG 122 -13.587 15.002 -1.319 784 HG2 ARG 122 HG2 ARG 122 -15.854 15.712 -0.893 785 HG3 ARG 122 HG1 ARG 122 -15.302 16.790 0.390 786 HD2 ARG 122 HD2 ARG 122 -14.482 17.004 -2.502 787 HD3 ARG 122 HD1 ARG 122 -15.765 17.953 -1.756 788 HE ARG 122 HE ARG 122 -13.847 18.660 -0.169 789 HH11 ARG 122 HH11 ARG 122 -13.536 18.042 -3.603 790 HH12 ARG 122 HH12 ARG 122 -12.229 19.163 -3.816 791 HH21 ARG 122 HH21 ARG 122 -12.137 20.154 -0.457 792 HH22 ARG 122 HH22 ARG 122 -11.441 20.368 -2.030 793 H LYS 123 HN LYS 123 -14.177 12.465 -0.906 794 HA LYS 123 HA LYS 123 -17.017 12.248 -0.818 795 HB2 LYS 123 HB2 LYS 123 -16.821 10.431 -2.266 796 HB3 LYS 123 HB1 LYS 123 -15.383 11.373 -2.620 797 HG2 LYS 123 HG2 LYS 123 -14.177 9.829 -0.988 798 HG3 LYS 123 HG1 LYS 123 -15.603 8.826 -1.088 799 HD2 LYS 123 HD2 LYS 123 -13.442 8.606 -2.682 800 HD3 LYS 123 HD1 LYS 123 -15.058 8.042 -3.097 801 HE2 LYS 123 HE2 LYS 123 -15.503 10.234 -4.099 802 HE3 LYS 123 HE1 LYS 123 -13.824 10.680 -3.798 803 HZ1 LYS 123 HZ1 LYS 123 -14.045 9.965 -6.050 804 HZ2 LYS 123 HZ2 LYS 123 -14.799 8.530 -5.588 805 HZ3 LYS 123 HZ3 LYS 123 -13.171 8.782 -5.216 806 H LEU 124 HN LEU 124 -14.401 10.621 0.885 807 HA LEU 124 HA LEU 124 -15.913 8.735 2.294 808 HB2 LEU 124 HB2 LEU 124 -13.385 10.195 3.048 809 HB3 LEU 124 HB1 LEU 124 -14.072 8.906 4.016 810 HG LEU 124 HG LEU 124 -13.092 8.616 1.171 811 HD11 LEU 124 HD11 LEU 124 -11.255 8.962 2.717 812 HD12 LEU 124 HD12 LEU 124 -11.302 7.276 2.208 813 HD13 LEU 124 HD13 LEU 124 -11.903 7.733 3.801 814 HD21 LEU 124 HD21 LEU 124 -14.919 7.102 1.665 815 HD22 LEU 124 HD22 LEU 124 -14.115 6.580 3.143 816 HD23 LEU 124 HD23 LEU 124 -13.397 6.218 1.574 817 H GLU 125 HN GLU 125 -14.919 12.019 3.228 818 HA GLU 125 HA GLU 125 -16.068 12.089 5.745 819 HB2 GLU 125 HB2 GLU 125 -15.651 14.331 3.776 820 HB3 GLU 125 HB1 GLU 125 -16.131 14.577 5.450 821 HG2 GLU 125 HG2 GLU 125 -14.049 13.356 6.122 822 HG3 GLU 125 HG1 GLU 125 -13.562 13.400 4.433 823 H ARG 126 HN ARG 126 -17.608 12.403 2.642 824 HA ARG 126 HA ARG 126 -20.059 13.505 3.403 825 HB2 ARG 126 HB2 ARG 126 -19.435 11.421 1.304 826 HB3 ARG 126 HB1 ARG 126 -21.006 12.187 1.480 827 HG2 ARG 126 HG2 ARG 126 -20.053 14.346 0.983 828 HG3 ARG 126 HG1 ARG 126 -18.434 13.646 0.918 829 HD2 ARG 126 HD2 ARG 126 -19.374 14.003 -1.321 830 HD3 ARG 126 HD1 ARG 126 -19.063 12.299 -0.997 831 HE ARG 126 HE ARG 126 -21.658 12.569 -0.314 832 HH11 ARG 126 HH11 ARG 126 -19.881 13.525 -3.178 833 HH12 ARG 126 HH12 ARG 126 -21.227 13.287 -4.246 834 HH21 ARG 126 HH21 ARG 126 -23.425 12.250 -1.710 835 HH22 ARG 126 HH22 ARG 126 -23.244 12.540 -3.412 836 H LEU 127 HN LEU 127 -19.116 10.070 3.204 837 HA LEU 127 HA LEU 127 -21.481 9.048 4.355 838 HB2 LEU 127 HB2 LEU 127 -18.700 7.944 4.101 839 HB3 LEU 127 HB1 LEU 127 -19.953 7.055 4.938 840 HG LEU 127 HG LEU 127 -19.702 6.249 2.662 841 HD11 LEU 127 HD11 LEU 127 -22.274 7.769 3.023 842 HD12 LEU 127 HD12 LEU 127 -21.915 6.170 3.672 843 HD13 LEU 127 HD13 LEU 127 -22.013 6.412 1.929 844 HD21 LEU 127 HD21 LEU 127 -20.218 7.637 0.738 845 HD22 LEU 127 HD22 LEU 127 -18.857 8.307 1.641 846 HD23 LEU 127 HD23 LEU 127 -20.457 9.032 1.790 847 H LEU 128 HN LEU 128 -18.293 9.666 5.841 848 HA LEU 128 HA LEU 128 -18.738 9.125 8.448 849 HB2 LEU 128 HB2 LEU 128 -17.236 11.330 7.090 850 HB3 LEU 128 HB1 LEU 128 -17.269 11.223 8.837 851 HG LEU 128 HG LEU 128 -16.268 8.992 8.708 852 HD11 LEU 128 HD11 LEU 128 -15.311 8.146 6.655 853 HD12 LEU 128 HD12 LEU 128 -16.050 9.475 5.763 854 HD13 LEU 128 HD13 LEU 128 -17.067 8.267 6.549 855 HD21 LEU 128 HD21 LEU 128 -14.834 10.920 8.995 856 HD22 LEU 128 HD22 LEU 128 -14.754 11.140 7.247 857 HD23 LEU 128 HD23 LEU 128 -14.027 9.715 7.992 858 H GLU 129 HN GLU 129 -19.242 12.397 7.104 859 HA GLU 129 HA GLU 129 -20.441 13.437 9.407 860 HB2 GLU 129 HB2 GLU 129 -20.658 14.308 6.531 861 HB3 GLU 129 HB1 GLU 129 -21.305 15.236 7.879 862 HG2 GLU 129 HG2 GLU 129 -18.992 15.274 8.834 863 HG3 GLU 129 HG1 GLU 129 -18.430 14.568 7.320 864 H SER 130 HN SER 130 -21.918 11.794 6.648 865 HA SER 130 HA SER 130 -24.578 12.440 7.274 866 HB2 SER 130 HB2 SER 130 -23.374 10.173 5.690 867 HB3 SER 130 HB1 SER 130 -25.081 10.558 5.740 868 HG SER 130 HG SER 130 -22.974 11.967 4.563 869 H GLY 131 HN GLY 131 -22.378 10.178 8.662 870 HA2 GLY 131 HA2 GLY 131 -23.008 9.384 10.883 871 HA3 GLY 131 HA1 GLY 131 -24.618 9.096 10.246 872 H LEU 132 HN LEU 132 -23.187 8.067 7.731 873 HA LEU 132 HA LEU 132 -23.396 5.333 8.341 874 HB2 LEU 132 HB2 LEU 132 -23.682 6.437 6.090 875 HB3 LEU 132 HB1 LEU 132 -21.940 6.589 6.010 876 HG LEU 132 HG LEU 132 -22.966 4.677 4.711 877 HD11 LEU 132 HD11 LEU 132 -21.197 3.099 5.317 878 HD12 LEU 132 HD12 LEU 132 -20.892 4.025 6.789 879 HD13 LEU 132 HD13 LEU 132 -20.599 4.756 5.213 880 HD21 LEU 132 HD21 LEU 132 -23.288 3.484 7.460 881 HD22 LEU 132 HD22 LEU 132 -23.562 2.666 5.922 882 HD23 LEU 132 HD23 LEU 132 -24.605 4.002 6.408 883 H THR 133 HN THR 133 -20.556 7.348 7.632 884 HA THR 133 HA THR 133 -18.376 7.214 8.231 885 HB THR 133 HB THR 133 -19.254 5.368 10.456 886 HG1 THR 133 HG1 THR 133 -20.511 7.129 10.778 887 HG21 THR 133 HG21 THR 133 -17.344 6.346 11.645 888 HG22 THR 133 HG22 THR 133 -16.962 7.327 10.232 889 HG23 THR 133 HG23 THR 133 -16.829 5.572 10.147 Start of MODEL 11 1 H1 MET 1 HT1 MET 1 28.537 -5.366 9.216 2 H2 MET 1 HT2 MET 1 27.641 -4.014 8.744 3 H3 MET 1 HT3 MET 1 28.153 -4.171 10.345 4 HA MET 1 HA MET 1 30.434 -3.966 9.704 5 HB2 MET 1 HB2 MET 1 29.297 -3.702 6.916 6 HB3 MET 1 HB1 MET 1 30.959 -3.318 7.342 7 HG2 MET 1 HG2 MET 1 29.622 -6.005 7.491 8 HG3 MET 1 HG1 MET 1 30.882 -5.500 6.368 9 HE1 MET 1 HE1 MET 1 32.255 -7.701 7.010 10 HE2 MET 1 HE2 MET 1 31.006 -8.169 8.166 11 HE3 MET 1 HE3 MET 1 32.698 -8.126 8.664 12 H ASP 2 HN ASP 2 29.595 -2.325 11.183 13 HA ASP 2 HA ASP 2 28.438 0.074 10.054 14 HB2 ASP 2 HB2 ASP 2 29.241 -0.567 12.901 15 HB3 ASP 2 HB1 ASP 2 28.349 0.862 12.394 16 H SER 3 HN SER 3 31.562 -1.081 10.659 17 HA SER 3 HA SER 3 32.862 1.369 11.265 18 HB2 SER 3 HB2 SER 3 33.981 -1.124 9.960 19 HB3 SER 3 HB1 SER 3 34.927 0.176 10.685 20 HG SER 3 HG SER 3 33.112 -0.654 12.459 21 H ALA 4 HN ALA 4 31.932 -0.228 8.299 22 HA ALA 4 HA ALA 4 33.324 1.722 6.658 23 HB1 ALA 4 HB1 ALA 4 32.459 0.429 4.766 24 HB2 ALA 4 HB2 ALA 4 31.531 -0.577 5.877 25 HB3 ALA 4 HB3 ALA 4 33.295 -0.602 5.926 26 H ILE 5 HN ILE 5 29.963 0.588 7.027 27 HA ILE 5 HA ILE 5 28.943 2.936 5.706 28 HB ILE 5 HB ILE 5 27.421 0.776 7.174 29 HG12 ILE 5 HG12 ILE 5 28.076 1.001 4.226 30 HG13 ILE 5 HG11 ILE 5 28.860 -0.103 5.347 31 HG21 ILE 5 HG21 ILE 5 25.525 1.516 5.821 32 HG22 ILE 5 HG22 ILE 5 26.530 2.766 5.088 33 HG23 ILE 5 HG23 ILE 5 26.151 2.838 6.808 34 HD11 ILE 5 HD11 ILE 5 26.763 -1.254 5.713 35 HD12 ILE 5 HD12 ILE 5 27.164 -1.213 3.996 36 HD13 ILE 5 HD13 ILE 5 25.937 -0.123 4.641 37 H SER 6 HN SER 6 28.976 4.800 6.775 38 HA SER 6 HA SER 6 28.815 4.854 9.675 39 HB2 SER 6 HB2 SER 6 30.489 6.243 8.506 40 HB3 SER 6 HB1 SER 6 29.202 7.076 7.642 41 HG SER 6 HG SER 6 29.827 7.170 10.403 42 H LYS 7 HN LYS 7 27.387 6.845 10.519 43 HA LYS 7 HA LYS 7 24.694 6.286 9.902 44 HB2 LYS 7 HB2 LYS 7 26.027 8.517 11.406 45 HB3 LYS 7 HB1 LYS 7 24.298 8.542 11.101 46 HG2 LYS 7 HG2 LYS 7 24.395 6.132 12.128 47 HG3 LYS 7 HG1 LYS 7 25.889 6.735 12.843 48 HD2 LYS 7 HD2 LYS 7 23.167 8.010 13.094 49 HD3 LYS 7 HD1 LYS 7 23.982 7.069 14.340 50 HE2 LYS 7 HE2 LYS 7 25.689 8.711 14.574 51 HE3 LYS 7 HE1 LYS 7 25.139 9.574 13.140 52 HZ1 LYS 7 HZ1 LYS 7 23.576 9.275 15.647 53 HZ2 LYS 7 HZ2 LYS 7 23.114 10.158 14.281 54 HZ3 LYS 7 HZ3 LYS 7 24.444 10.656 15.200 55 H GLU 8 HN GLU 8 27.024 8.175 8.325 56 HA GLU 8 HA GLU 8 25.546 10.079 6.995 57 HB2 GLU 8 HB2 GLU 8 27.988 9.868 6.960 58 HB3 GLU 8 HB1 GLU 8 27.851 8.368 6.051 59 HG2 GLU 8 HG2 GLU 8 28.438 10.144 4.590 60 HG3 GLU 8 HG1 GLU 8 26.802 9.606 4.229 61 H ASP 9 HN ASP 9 26.431 6.829 5.833 62 HA ASP 9 HA ASP 9 24.490 6.941 3.725 63 HB2 ASP 9 HB2 ASP 9 26.597 5.740 3.405 64 HB3 ASP 9 HB1 ASP 9 26.182 4.642 4.715 65 H GLU 10 HN GLU 10 24.773 5.259 6.815 66 HA GLU 10 HA GLU 10 22.627 3.500 6.433 67 HB2 GLU 10 HB2 GLU 10 24.288 3.107 8.165 68 HB3 GLU 10 HB1 GLU 10 23.798 4.573 9.004 69 HG2 GLU 10 HG2 GLU 10 21.578 3.599 9.363 70 HG3 GLU 10 HG1 GLU 10 22.118 2.114 8.584 71 H GLU 11 HN GLU 11 22.674 6.389 8.526 72 HA GLU 11 HA GLU 11 19.986 6.382 9.112 73 HB2 GLU 11 HB2 GLU 11 21.922 8.679 8.958 74 HB3 GLU 11 HB1 GLU 11 20.297 8.822 9.608 75 HG2 GLU 11 HG2 GLU 11 22.354 6.902 10.666 76 HG3 GLU 11 HG1 GLU 11 22.101 8.522 11.302 77 H ARG 12 HN ARG 12 21.618 7.674 6.250 78 HA ARG 12 HA ARG 12 19.374 9.198 5.376 79 HB2 ARG 12 HB2 ARG 12 21.771 8.139 3.901 80 HB3 ARG 12 HB1 ARG 12 20.501 9.048 3.097 81 HG2 ARG 12 HG2 ARG 12 22.377 9.992 5.245 82 HG3 ARG 12 HG1 ARG 12 22.238 10.571 3.587 83 HD2 ARG 12 HD2 ARG 12 21.122 12.226 4.716 84 HD3 ARG 12 HD1 ARG 12 19.789 11.144 4.318 85 HE ARG 12 HE ARG 12 21.091 10.812 6.911 86 HH11 ARG 12 HH11 ARG 12 18.313 11.933 5.089 87 HH12 ARG 12 HH12 ARG 12 17.300 12.071 6.489 88 HH21 ARG 12 HH21 ARG 12 19.756 11.004 8.748 89 HH22 ARG 12 HH22 ARG 12 18.121 11.549 8.565 90 H TYR 13 HN TYR 13 20.426 5.874 4.756 91 HA TYR 13 HA TYR 13 18.252 5.354 2.955 92 HB2 TYR 13 HB2 TYR 13 20.145 3.986 2.620 93 HB3 TYR 13 HB1 TYR 13 20.288 3.615 4.334 94 HD1 TYR 13 HD1 TYR 13 19.816 1.434 4.845 95 HD2 TYR 13 HD2 TYR 13 17.609 3.316 1.736 96 HE1 TYR 13 HE1 TYR 13 18.502 -0.623 4.544 97 HE2 TYR 13 HE2 TYR 13 16.276 1.272 1.422 98 HH TYR 13 HH TYR 13 16.535 -1.175 1.866 99 H GLN 14 HN GLN 14 18.962 4.608 6.328 100 HA GLN 14 HA GLN 14 16.750 3.071 6.986 101 HB2 GLN 14 HB2 GLN 14 18.287 5.079 8.630 102 HB3 GLN 14 HB1 GLN 14 17.093 3.983 9.307 103 HG2 GLN 14 HG2 GLN 14 19.475 3.032 7.759 104 HG3 GLN 14 HG1 GLN 14 19.502 3.297 9.498 105 HE21 GLN 14 HE21 GLN 14 18.373 1.926 10.840 106 HE22 GLN 14 HE22 GLN 14 17.743 0.406 10.304 107 H LYS 15 HN LYS 15 17.102 6.583 7.428 108 HA LYS 15 HA LYS 15 14.489 7.014 8.257 109 HB2 LYS 15 HB2 LYS 15 16.448 8.877 6.937 110 HB3 LYS 15 HB1 LYS 15 14.886 9.403 7.554 111 HG2 LYS 15 HG2 LYS 15 17.029 8.076 9.196 112 HG3 LYS 15 HG1 LYS 15 16.723 9.813 9.132 113 HD2 LYS 15 HD2 LYS 15 14.652 9.606 10.196 114 HD3 LYS 15 HD1 LYS 15 14.546 7.881 9.861 115 HE2 LYS 15 HE2 LYS 15 16.404 7.479 11.395 116 HE3 LYS 15 HE1 LYS 15 16.476 9.204 11.754 117 HZ1 LYS 15 HZ1 LYS 15 14.190 9.052 12.593 118 HZ2 LYS 15 HZ2 LYS 15 15.245 8.049 13.455 119 HZ3 LYS 15 HZ3 LYS 15 14.196 7.385 12.310 120 H LEU 16 HN LEU 16 15.778 6.584 5.060 121 HA LEU 16 HA LEU 16 13.573 7.659 3.631 122 HB2 LEU 16 HB2 LEU 16 15.893 7.155 2.718 123 HB3 LEU 16 HB1 LEU 16 15.407 5.469 2.666 124 HG LEU 16 HG LEU 16 13.716 5.926 1.014 125 HD11 LEU 16 HD11 LEU 16 14.407 8.818 1.507 126 HD12 LEU 16 HD12 LEU 16 12.844 8.027 1.751 127 HD13 LEU 16 HD13 LEU 16 13.483 8.256 0.118 128 HD21 LEU 16 HD21 LEU 16 16.004 5.639 0.231 129 HD22 LEU 16 HD22 LEU 16 16.268 7.377 0.348 130 HD23 LEU 16 HD23 LEU 16 15.100 6.739 -0.811 131 H VAL 17 HN VAL 17 14.468 4.335 4.562 132 HA VAL 17 HA VAL 17 12.105 3.129 3.579 133 HB VAL 17 HB VAL 17 12.739 1.169 4.610 134 HG11 VAL 17 HG11 VAL 17 14.543 1.923 3.198 135 HG12 VAL 17 HG12 VAL 17 15.172 1.005 4.568 136 HG13 VAL 17 HG13 VAL 17 15.276 2.767 4.563 137 HG21 VAL 17 HG21 VAL 17 14.069 2.729 6.824 138 HG22 VAL 17 HG22 VAL 17 13.990 0.970 6.704 139 HG23 VAL 17 HG23 VAL 17 12.510 1.908 6.923 140 H THR 18 HN THR 18 12.934 4.760 6.536 141 HA THR 18 HA THR 18 10.719 4.132 8.084 142 HB THR 18 HB THR 18 12.628 6.438 7.942 143 HG1 THR 18 HG1 THR 18 13.285 4.417 8.879 144 HG21 THR 18 HG21 THR 18 10.253 6.180 9.751 145 HG22 THR 18 HG22 THR 18 10.646 7.491 8.634 146 HG23 THR 18 HG23 THR 18 11.630 7.236 10.075 147 H GLU 19 HN GLU 19 11.324 6.972 6.010 148 HA GLU 19 HA GLU 19 8.818 8.137 6.094 149 HB2 GLU 19 HB2 GLU 19 10.738 7.971 3.744 150 HB3 GLU 19 HB1 GLU 19 9.370 9.079 3.854 151 HG2 GLU 19 HG2 GLU 19 10.394 10.039 5.908 152 HG3 GLU 19 HG1 GLU 19 11.803 9.010 5.628 153 H ASN 20 HN ASN 20 10.045 5.609 4.022 154 HA ASN 20 HA ASN 20 7.889 5.348 2.268 155 HB2 ASN 20 HB2 ASN 20 10.281 4.464 2.111 156 HB3 ASN 20 HB1 ASN 20 9.740 3.128 3.115 157 HD21 ASN 20 HD21 ASN 20 10.387 1.802 1.374 158 HD22 ASN 20 HD22 ASN 20 9.371 1.594 -0.005 159 H GLU 21 HN GLU 21 8.629 3.539 5.270 160 HA GLU 21 HA GLU 21 6.388 1.845 5.150 161 HB2 GLU 21 HB2 GLU 21 7.987 2.794 7.521 162 HB3 GLU 21 HB1 GLU 21 6.880 1.423 7.521 163 HG2 GLU 21 HG2 GLU 21 9.139 1.584 5.588 164 HG3 GLU 21 HG1 GLU 21 9.388 0.992 7.221 165 H GLN 22 HN GLN 22 6.876 4.968 6.754 166 HA GLN 22 HA GLN 22 4.577 4.942 8.353 167 HB2 GLN 22 HB2 GLN 22 5.784 7.423 7.129 168 HB3 GLN 22 HB1 GLN 22 4.840 7.314 8.605 169 HG2 GLN 22 HG2 GLN 22 6.617 6.114 9.715 170 HG3 GLN 22 HG1 GLN 22 7.553 6.072 8.222 171 HE21 GLN 22 HE21 GLN 22 6.511 8.004 10.895 172 HE22 GLN 22 HE22 GLN 22 7.532 9.359 10.574 173 H LEU 23 HN LEU 23 5.037 6.409 5.131 174 HA LEU 23 HA LEU 23 2.417 7.552 5.328 175 HB2 LEU 23 HB2 LEU 23 2.964 8.928 3.597 176 HB3 LEU 23 HB1 LEU 23 4.523 8.607 4.307 177 HG LEU 23 HG LEU 23 3.439 7.386 1.786 178 HD11 LEU 23 HD11 LEU 23 4.068 9.721 1.587 179 HD12 LEU 23 HD12 LEU 23 5.189 8.680 0.711 180 HD13 LEU 23 HD13 LEU 23 5.651 9.358 2.270 181 HD21 LEU 23 HD21 LEU 23 4.858 5.776 2.909 182 HD22 LEU 23 HD22 LEU 23 6.105 7.003 3.128 183 HD23 LEU 23 HD23 LEU 23 5.690 6.447 1.508 184 H GLN 24 HN GLN 24 3.705 4.696 3.844 185 HA GLN 24 HA GLN 24 1.555 4.366 1.998 186 HB2 GLN 24 HB2 GLN 24 2.291 2.058 1.774 187 HB3 GLN 24 HB1 GLN 24 3.669 3.148 1.719 188 HG2 GLN 24 HG2 GLN 24 4.186 2.616 4.039 189 HG3 GLN 24 HG1 GLN 24 2.799 1.530 4.098 190 HE21 GLN 24 HE21 GLN 24 5.984 2.046 2.825 191 HE22 GLN 24 HE22 GLN 24 6.267 0.410 2.331 192 H ARG 25 HN ARG 25 2.033 3.701 5.360 193 HA ARG 25 HA ARG 25 -0.278 2.115 5.794 194 HB2 ARG 25 HB2 ARG 25 1.088 1.939 7.611 195 HB3 ARG 25 HB1 ARG 25 1.755 3.551 7.388 196 HG2 ARG 25 HG2 ARG 25 -0.538 4.357 8.213 197 HG3 ARG 25 HG1 ARG 25 -0.713 2.717 8.843 198 HD2 ARG 25 HD2 ARG 25 1.469 4.704 9.491 199 HD3 ARG 25 HD1 ARG 25 0.185 4.150 10.569 200 HE ARG 25 HE ARG 25 1.483 1.862 9.841 201 HH11 ARG 25 HH11 ARG 25 2.453 4.881 11.328 202 HH12 ARG 25 HH12 ARG 25 3.755 4.166 12.223 203 HH21 ARG 25 HH21 ARG 25 3.210 0.916 11.002 204 HH22 ARG 25 HH22 ARG 25 4.188 1.909 12.035 205 H LEU 26 HN LEU 26 0.490 5.541 5.954 206 HA LEU 26 HA LEU 26 -1.996 6.474 6.868 207 HB2 LEU 26 HB2 LEU 26 0.117 7.840 5.192 208 HB3 LEU 26 HB1 LEU 26 -1.202 8.669 6.011 209 HG LEU 26 HG LEU 26 0.904 7.027 7.431 210 HD11 LEU 26 HD11 LEU 26 0.715 10.024 7.219 211 HD12 LEU 26 HD12 LEU 26 1.889 9.015 6.375 212 HD13 LEU 26 HD13 LEU 26 1.905 9.096 8.135 213 HD21 LEU 26 HD21 LEU 26 0.035 8.118 9.439 214 HD22 LEU 26 HD22 LEU 26 -1.209 7.169 8.625 215 HD23 LEU 26 HD23 LEU 26 -1.195 8.925 8.467 216 H ILE 27 HN ILE 27 -0.716 5.865 3.653 217 HA ILE 27 HA ILE 27 -2.900 6.734 2.134 218 HB ILE 27 HB ILE 27 -1.007 4.432 1.650 219 HG12 ILE 27 HG12 ILE 27 -1.043 7.229 0.513 220 HG13 ILE 27 HG11 ILE 27 0.015 6.682 1.822 221 HG21 ILE 27 HG21 ILE 27 -3.084 4.161 0.361 222 HG22 ILE 27 HG22 ILE 27 -1.693 4.484 -0.672 223 HG23 ILE 27 HG23 ILE 27 -2.849 5.767 -0.328 224 HD11 ILE 27 HD11 ILE 27 1.170 6.706 -0.309 225 HD12 ILE 27 HD12 ILE 27 -0.029 5.605 -0.987 226 HD13 ILE 27 HD13 ILE 27 1.030 5.064 0.314 227 H THR 28 HN THR 28 -2.120 3.483 3.317 228 HA THR 28 HA THR 28 -4.341 2.153 2.367 229 HB THR 28 HB THR 28 -2.116 1.410 3.737 230 HG1 THR 28 HG1 THR 28 -2.752 -0.413 2.913 231 HG21 THR 28 HG21 THR 28 -2.899 0.151 5.742 232 HG22 THR 28 HG22 THR 28 -4.438 1.010 5.625 233 HG23 THR 28 HG23 THR 28 -2.947 1.904 5.938 234 H GLN 29 HN GLN 29 -4.014 3.987 5.364 235 HA GLN 29 HA GLN 29 -6.470 3.229 6.549 236 HB2 GLN 29 HB2 GLN 29 -4.809 5.734 6.831 237 HB3 GLN 29 HB1 GLN 29 -6.204 5.366 7.834 238 HG2 GLN 29 HG2 GLN 29 -3.738 3.664 7.632 239 HG3 GLN 29 HG1 GLN 29 -4.057 4.854 8.890 240 HE21 GLN 29 HE21 GLN 29 -4.903 1.748 7.606 241 HE22 GLN 29 HE22 GLN 29 -5.843 1.216 8.953 242 H LYS 30 HN LYS 30 -5.567 6.218 4.917 243 HA LYS 30 HA LYS 30 -8.083 7.371 4.770 244 HB2 LYS 30 HB2 LYS 30 -5.802 7.649 2.804 245 HB3 LYS 30 HB1 LYS 30 -7.151 8.767 2.975 246 HG2 LYS 30 HG2 LYS 30 -6.453 9.360 5.194 247 HG3 LYS 30 HG1 LYS 30 -5.195 8.126 5.171 248 HD2 LYS 30 HD2 LYS 30 -4.081 9.318 3.331 249 HD3 LYS 30 HD1 LYS 30 -5.330 10.563 3.400 250 HE2 LYS 30 HE2 LYS 30 -3.458 9.827 5.648 251 HE3 LYS 30 HE1 LYS 30 -3.291 11.232 4.598 252 HZ1 LYS 30 HZ1 LYS 30 -5.620 10.721 6.372 253 HZ2 LYS 30 HZ2 LYS 30 -5.341 12.110 5.442 254 HZ3 LYS 30 HZ3 LYS 30 -4.331 11.749 6.745 255 H GLU 31 HN GLU 31 -6.443 5.376 2.320 256 HA GLU 31 HA GLU 31 -8.340 5.352 0.336 257 HB2 GLU 31 HB2 GLU 31 -6.419 3.238 1.269 258 HB3 GLU 31 HB1 GLU 31 -7.464 2.982 -0.123 259 HG2 GLU 31 HG2 GLU 31 -5.667 5.370 0.082 260 HG3 GLU 31 HG1 GLU 31 -5.096 3.823 -0.542 261 H GLU 32 HN GLU 32 -8.155 2.979 3.026 262 HA GLU 32 HA GLU 32 -10.415 1.533 2.153 263 HB2 GLU 32 HB2 GLU 32 -10.419 0.512 4.409 264 HB3 GLU 32 HB1 GLU 32 -8.845 0.469 3.635 265 HG2 GLU 32 HG2 GLU 32 -7.992 2.153 5.039 266 HG3 GLU 32 HG1 GLU 32 -9.602 2.592 5.616 267 H LYS 33 HN LYS 33 -10.072 4.309 4.251 268 HA LYS 33 HA LYS 33 -12.733 4.170 5.293 269 HB2 LYS 33 HB2 LYS 33 -10.664 5.296 6.328 270 HB3 LYS 33 HB1 LYS 33 -11.009 6.636 5.243 271 HG2 LYS 33 HG2 LYS 33 -13.223 6.880 6.249 272 HG3 LYS 33 HG1 LYS 33 -12.870 5.541 7.342 273 HD2 LYS 33 HD2 LYS 33 -11.386 8.165 7.201 274 HD3 LYS 33 HD1 LYS 33 -12.530 7.684 8.454 275 HE2 LYS 33 HE2 LYS 33 -9.906 6.324 7.839 276 HE3 LYS 33 HE1 LYS 33 -10.209 7.413 9.190 277 HZ1 LYS 33 HZ1 LYS 33 -11.584 4.815 8.755 278 HZ2 LYS 33 HZ2 LYS 33 -11.797 5.849 10.078 279 HZ3 LYS 33 HZ3 LYS 33 -10.314 5.078 9.838 280 H ILE 34 HN ILE 34 -11.148 5.869 2.643 281 HA ILE 34 HA ILE 34 -13.326 7.527 1.926 282 HB ILE 34 HB ILE 34 -11.008 6.497 0.277 283 HG12 ILE 34 HG12 ILE 34 -11.492 9.313 1.189 284 HG13 ILE 34 HG11 ILE 34 -10.754 8.137 2.276 285 HG21 ILE 34 HG21 ILE 34 -11.593 8.266 -1.344 286 HG22 ILE 34 HG22 ILE 34 -13.093 8.545 -0.457 287 HG23 ILE 34 HG23 ILE 34 -12.811 6.992 -1.245 288 HD11 ILE 34 HD11 ILE 34 -9.686 8.931 -0.425 289 HD12 ILE 34 HD12 ILE 34 -8.943 7.782 0.688 290 HD13 ILE 34 HD13 ILE 34 -9.074 9.484 1.133 291 H ARG 35 HN ARG 35 -12.517 4.193 1.200 292 HA ARG 35 HA ARG 35 -14.261 3.701 -0.928 293 HB2 ARG 35 HB2 ARG 35 -13.546 1.829 1.329 294 HB3 ARG 35 HB1 ARG 35 -14.248 1.352 -0.208 295 HG2 ARG 35 HG2 ARG 35 -12.215 2.247 -1.335 296 HG3 ARG 35 HG1 ARG 35 -11.515 2.516 0.263 297 HD2 ARG 35 HD2 ARG 35 -12.345 -0.114 -0.950 298 HD3 ARG 35 HD1 ARG 35 -10.707 0.423 -0.586 299 HE ARG 35 HE ARG 35 -12.410 0.352 1.727 300 HH11 ARG 35 HH11 ARG 35 -10.359 -1.575 -0.355 301 HH12 ARG 35 HH12 ARG 35 -10.024 -2.765 0.862 302 HH21 ARG 35 HH21 ARG 35 -11.977 -1.218 3.329 303 HH22 ARG 35 HH22 ARG 35 -10.936 -2.559 2.960 304 H VAL 36 HN VAL 36 -14.790 3.620 2.549 305 HA VAL 36 HA VAL 36 -17.479 2.750 2.453 306 HB VAL 36 HB VAL 36 -16.253 4.447 4.620 307 HG11 VAL 36 HG11 VAL 36 -18.637 4.150 4.826 308 HG12 VAL 36 HG12 VAL 36 -17.822 3.180 6.053 309 HG13 VAL 36 HG13 VAL 36 -18.473 2.408 4.606 310 HG21 VAL 36 HG21 VAL 36 -16.105 1.449 4.322 311 HG22 VAL 36 HG22 VAL 36 -15.468 2.405 5.660 312 HG23 VAL 36 HG23 VAL 36 -14.767 2.567 4.048 313 H LEU 37 HN LEU 37 -15.960 5.937 2.563 314 HA LEU 37 HA LEU 37 -18.254 7.518 2.703 315 HB2 LEU 37 HB2 LEU 37 -15.476 7.898 1.854 316 HB3 LEU 37 HB1 LEU 37 -16.613 8.952 1.028 317 HG LEU 37 HG LEU 37 -15.527 9.854 3.152 318 HD11 LEU 37 HD11 LEU 37 -17.463 10.887 2.092 319 HD12 LEU 37 HD12 LEU 37 -17.577 10.970 3.850 320 HD13 LEU 37 HD13 LEU 37 -18.533 9.783 2.962 321 HD21 LEU 37 HD21 LEU 37 -17.537 8.012 4.426 322 HD22 LEU 37 HD22 LEU 37 -16.497 9.170 5.253 323 HD23 LEU 37 HD23 LEU 37 -15.793 7.769 4.443 324 H ARG 38 HN ARG 38 -16.646 6.059 -0.048 325 HA ARG 38 HA ARG 38 -18.175 7.206 -2.086 326 HB2 ARG 38 HB2 ARG 38 -16.885 4.477 -1.969 327 HB3 ARG 38 HB1 ARG 38 -17.537 5.206 -3.431 328 HG2 ARG 38 HG2 ARG 38 -15.938 7.013 -3.284 329 HG3 ARG 38 HG1 ARG 38 -15.321 6.374 -1.760 330 HD2 ARG 38 HD2 ARG 38 -13.839 5.764 -3.566 331 HD3 ARG 38 HD1 ARG 38 -14.626 4.324 -2.927 332 HE ARG 38 HE ARG 38 -16.233 4.890 -4.958 333 HH11 ARG 38 HH11 ARG 38 -12.732 4.928 -4.823 334 HH12 ARG 38 HH12 ARG 38 -12.538 4.448 -6.477 335 HH21 ARG 38 HH21 ARG 38 -15.982 4.291 -7.138 336 HH22 ARG 38 HH22 ARG 38 -14.391 4.096 -7.801 337 H GLN 39 HN GLN 39 -18.742 4.193 -0.283 338 HA GLN 39 HA GLN 39 -21.149 3.453 -1.528 339 HB2 GLN 39 HB2 GLN 39 -20.406 3.016 1.372 340 HB3 GLN 39 HB1 GLN 39 -21.541 2.069 0.426 341 HG2 GLN 39 HG2 GLN 39 -18.626 2.279 -0.244 342 HG3 GLN 39 HG1 GLN 39 -19.282 1.043 0.824 343 HE21 GLN 39 HE21 GLN 39 -21.757 0.788 -0.709 344 HE22 GLN 39 HE22 GLN 39 -21.341 -0.073 -2.146 345 H ARG 40 HN ARG 40 -20.490 5.517 1.237 346 HA ARG 40 HA ARG 40 -23.155 6.082 1.929 347 HB2 ARG 40 HB2 ARG 40 -20.531 7.485 2.369 348 HB3 ARG 40 HB1 ARG 40 -22.041 8.150 2.962 349 HG2 ARG 40 HG2 ARG 40 -22.401 6.292 4.397 350 HG3 ARG 40 HG1 ARG 40 -21.111 5.371 3.626 351 HD2 ARG 40 HD2 ARG 40 -19.451 6.900 4.509 352 HD3 ARG 40 HD1 ARG 40 -20.714 7.913 5.203 353 HE ARG 40 HE ARG 40 -21.222 5.575 6.383 354 HH11 ARG 40 HH11 ARG 40 -18.185 7.272 5.945 355 HH12 ARG 40 HH12 ARG 40 -17.470 6.628 7.389 356 HH21 ARG 40 HH21 ARG 40 -20.284 4.753 8.296 357 HH22 ARG 40 HH22 ARG 40 -18.668 5.217 8.731 358 H LEU 41 HN LEU 41 -20.854 7.675 -0.216 359 HA LEU 41 HA LEU 41 -22.524 9.798 -1.021 360 HB2 LEU 41 HB2 LEU 41 -20.438 8.486 -2.750 361 HB3 LEU 41 HB1 LEU 41 -21.056 10.120 -2.875 362 HG LEU 41 HG LEU 41 -19.333 9.060 -0.636 363 HD11 LEU 41 HD11 LEU 41 -18.127 9.261 -2.727 364 HD12 LEU 41 HD12 LEU 41 -17.627 10.519 -1.600 365 HD13 LEU 41 HD13 LEU 41 -18.717 10.909 -2.927 366 HD21 LEU 41 HD21 LEU 41 -20.337 11.853 -1.181 367 HD22 LEU 41 HD22 LEU 41 -19.169 11.396 0.062 368 HD23 LEU 41 HD23 LEU 41 -20.831 10.809 0.154 369 H VAL 42 HN VAL 42 -22.349 6.435 -2.013 370 HA VAL 42 HA VAL 42 -23.694 6.582 -4.459 371 HB VAL 42 HB VAL 42 -23.793 4.426 -2.337 372 HG11 VAL 42 HG11 VAL 42 -24.624 2.931 -4.092 373 HG12 VAL 42 HG12 VAL 42 -24.743 4.302 -5.197 374 HG13 VAL 42 HG13 VAL 42 -25.754 4.242 -3.752 375 HG21 VAL 42 HG21 VAL 42 -21.574 4.764 -3.219 376 HG22 VAL 42 HG22 VAL 42 -22.185 4.687 -4.874 377 HG23 VAL 42 HG23 VAL 42 -22.232 3.252 -3.848 378 H GLU 43 HN GLU 43 -24.986 6.375 -1.181 379 HA GLU 43 HA GLU 43 -27.717 6.348 -1.946 380 HB2 GLU 43 HB2 GLU 43 -26.473 7.178 0.682 381 HB3 GLU 43 HB1 GLU 43 -28.167 6.779 0.424 382 HG2 GLU 43 HG2 GLU 43 -27.600 4.501 -0.096 383 HG3 GLU 43 HG1 GLU 43 -25.880 4.871 0.001 384 H ARG 44 HN ARG 44 -25.383 8.861 -1.524 385 HA ARG 44 HA ARG 44 -27.385 10.962 -1.373 386 HB2 ARG 44 HB2 ARG 44 -24.375 11.179 -1.592 387 HB3 ARG 44 HB1 ARG 44 -25.489 12.478 -1.179 388 HG2 ARG 44 HG2 ARG 44 -26.111 11.287 0.866 389 HG3 ARG 44 HG1 ARG 44 -24.979 10.000 0.453 390 HD2 ARG 44 HD2 ARG 44 -23.142 11.650 0.503 391 HD3 ARG 44 HD1 ARG 44 -24.297 12.883 1.010 392 HE ARG 44 HE ARG 44 -24.234 10.535 2.688 393 HH11 ARG 44 HH11 ARG 44 -22.976 13.753 2.144 394 HH12 ARG 44 HH12 ARG 44 -22.399 13.941 3.769 395 HH21 ARG 44 HH21 ARG 44 -23.476 10.779 4.835 396 HH22 ARG 44 HH22 ARG 44 -22.682 12.252 5.297 397 H GLY 45 HN GLY 45 -25.292 9.457 -3.665 398 HA2 GLY 45 HA2 GLY 45 -25.609 9.545 -6.007 399 HA3 GLY 45 HA1 GLY 45 -26.365 11.128 -5.821 400 H ASP 46 HN ASP 46 -23.320 9.380 -5.791 401 HA ASP 46 HA ASP 46 -21.636 11.582 -5.311 402 HB2 ASP 46 HB2 ASP 46 -19.894 10.100 -5.639 403 HB3 ASP 46 HB1 ASP 46 -21.192 9.004 -5.217 404 H ALA 47 HN ALA 47 -23.360 10.559 -8.073 405 HA ALA 47 HA ALA 47 -21.750 11.596 -10.134 406 HB1 ALA 47 HB1 ALA 47 -23.752 11.485 -11.508 407 HB2 ALA 47 HB2 ALA 47 -24.747 11.291 -10.065 408 HB3 ALA 47 HB3 ALA 47 -23.595 10.035 -10.517 409 H LYS 48 HN LYS 48 -23.603 13.170 -7.741 410 HA LYS 48 HA LYS 48 -24.200 15.568 -9.167 411 HB2 LYS 48 HB2 LYS 48 -23.934 15.091 -6.194 412 HB3 LYS 48 HB1 LYS 48 -24.624 16.526 -6.932 413 HG2 LYS 48 HG2 LYS 48 -25.757 13.776 -7.359 414 HG3 LYS 48 HG1 LYS 48 -26.253 14.823 -6.031 415 HD2 LYS 48 HD2 LYS 48 -27.839 15.409 -7.548 416 HD3 LYS 48 HD1 LYS 48 -26.582 16.543 -8.031 417 HE2 LYS 48 HE2 LYS 48 -25.864 14.991 -9.774 418 HE3 LYS 48 HE1 LYS 48 -27.119 13.859 -9.286 419 HZ1 LYS 48 HZ1 LYS 48 -28.783 15.501 -9.874 420 HZ2 LYS 48 HZ2 LYS 48 -27.792 15.166 -11.202 421 HZ3 LYS 48 HZ3 LYS 48 -27.579 16.599 -10.330 422 H GLY 49 HN GLY 49 -21.357 14.278 -7.791 423 HA2 GLY 49 HA2 GLY 49 -19.211 15.209 -8.155 424 HA3 GLY 49 HA1 GLY 49 -19.952 16.797 -8.311 425 H THR 50 HN THR 50 -17.706 15.863 -6.610 426 HA THR 50 HA THR 50 -18.687 17.082 -4.157 427 HB THR 50 HB THR 50 -17.087 14.528 -4.025 428 HG1 THR 50 HG1 THR 50 -19.833 14.950 -4.262 429 HG21 THR 50 HG21 THR 50 -18.635 16.078 -1.943 430 HG22 THR 50 HG22 THR 50 -16.880 16.010 -2.094 431 HG23 THR 50 HG23 THR 50 -17.784 14.557 -1.670 432 H GLU 51 HN GLU 51 -17.405 18.857 -4.796 433 HA GLU 51 HA GLU 51 -14.518 18.410 -4.395 434 HB2 GLU 51 HB2 GLU 51 -15.224 19.397 -6.634 435 HB3 GLU 51 HB1 GLU 51 -15.751 20.808 -5.729 436 HG2 GLU 51 HG2 GLU 51 -13.461 21.060 -4.862 437 HG3 GLU 51 HG1 GLU 51 -12.962 19.729 -5.902 438 H LEU 52 HN LEU 52 -14.079 18.850 -2.365 439 HA LEU 52 HA LEU 52 -15.518 21.054 -1.049 440 HB2 LEU 52 HB2 LEU 52 -14.336 18.597 0.239 441 HB3 LEU 52 HB1 LEU 52 -15.257 19.851 1.047 442 HG LEU 52 HG LEU 52 -16.328 17.944 -1.038 443 HD11 LEU 52 HD11 LEU 52 -15.867 16.857 1.092 444 HD12 LEU 52 HD12 LEU 52 -17.602 16.992 0.809 445 HD13 LEU 52 HD13 LEU 52 -16.804 18.091 1.933 446 HD21 LEU 52 HD21 LEU 52 -18.512 18.885 -0.494 447 HD22 LEU 52 HD22 LEU 52 -17.431 20.123 -1.132 448 HD23 LEU 52 HD23 LEU 52 -17.749 20.040 0.599 449 H ASN 53 HN ASN 53 -13.407 21.837 -2.437 450 HA ASN 53 HA ASN 53 -11.497 23.052 -2.317 451 HB2 ASN 53 HB2 ASN 53 -11.932 22.878 0.672 452 HB3 ASN 53 HB1 ASN 53 -10.800 23.960 -0.129 453 HD21 ASN 53 HD21 ASN 53 -11.598 25.712 -1.311 454 HD22 ASN 53 HD22 ASN 53 -13.211 26.291 -1.095 455 H GLY 84 HN GLY 84 33.752 -4.358 2.754 456 HA2 GLY 84 HA2 GLY 84 31.321 -4.529 4.284 457 HA3 GLY 84 HA1 GLY 84 31.459 -4.123 2.580 458 HA PRO 85 HA PRO 85 29.710 -8.359 2.772 459 HB2 PRO 85 HB2 PRO 85 27.473 -7.958 1.413 460 HB3 PRO 85 HB1 PRO 85 27.624 -7.357 3.069 461 HG2 PRO 85 HG2 PRO 85 27.902 -5.880 0.485 462 HG3 PRO 85 HG1 PRO 85 27.056 -5.387 1.965 463 HD2 PRO 85 HD2 PRO 85 29.618 -4.584 1.278 464 HD3 PRO 85 HD1 PRO 85 28.972 -4.589 2.930 465 H LEU 86 HN LEU 86 28.609 -9.540 0.732 466 HA LEU 86 HA LEU 86 30.610 -10.030 -1.112 467 HB2 LEU 86 HB2 LEU 86 28.521 -10.934 -2.507 468 HB3 LEU 86 HB1 LEU 86 29.225 -11.797 -1.165 469 HG LEU 86 HG LEU 86 26.684 -11.689 -1.314 470 HD11 LEU 86 HD11 LEU 86 27.756 -12.521 0.645 471 HD12 LEU 86 HD12 LEU 86 26.420 -11.479 1.129 472 HD13 LEU 86 HD13 LEU 86 28.077 -10.893 1.230 473 HD21 LEU 86 HD21 LEU 86 26.364 -9.355 -1.814 474 HD22 LEU 86 HD22 LEU 86 27.167 -8.880 -0.317 475 HD23 LEU 86 HD23 LEU 86 25.619 -9.727 -0.261 476 H GLY 87 HN GLY 87 31.441 -8.394 -2.271 477 HA2 GLY 87 HA2 GLY 87 29.820 -6.393 -3.527 478 HA3 GLY 87 HA1 GLY 87 31.550 -6.621 -3.744 479 H SER 88 HN SER 88 30.881 -9.531 -4.404 480 HA SER 88 HA SER 88 30.880 -9.108 -7.234 481 HB2 SER 88 HB2 SER 88 30.852 -11.676 -5.636 482 HB3 SER 88 HB1 SER 88 31.163 -11.549 -7.368 483 HG SER 88 HG SER 88 32.732 -10.582 -5.221 484 H ARG 89 HN ARG 89 28.352 -9.369 -5.033 485 HA ARG 89 HA ARG 89 26.573 -10.815 -6.784 486 HB2 ARG 89 HB2 ARG 89 26.203 -9.394 -4.174 487 HB3 ARG 89 HB1 ARG 89 24.805 -9.846 -5.138 488 HG2 ARG 89 HG2 ARG 89 25.736 -12.202 -5.127 489 HG3 ARG 89 HG1 ARG 89 26.854 -11.639 -3.881 490 HD2 ARG 89 HD2 ARG 89 24.864 -12.690 -2.908 491 HD3 ARG 89 HD1 ARG 89 24.987 -10.986 -2.470 492 HE ARG 89 HE ARG 89 23.369 -11.450 -4.798 493 HH11 ARG 89 HH11 ARG 89 23.362 -11.411 -1.296 494 HH12 ARG 89 HH12 ARG 89 21.670 -11.053 -1.177 495 HH21 ARG 89 HH21 ARG 89 21.136 -10.967 -4.643 496 HH22 ARG 89 HH22 ARG 89 20.404 -10.800 -3.078 497 H ARG 90 HN ARG 90 26.259 -7.531 -5.443 498 HA ARG 90 HA ARG 90 25.436 -6.615 -8.116 499 HB2 ARG 90 HB2 ARG 90 24.019 -5.963 -5.523 500 HB3 ARG 90 HB1 ARG 90 23.622 -5.301 -7.102 501 HG2 ARG 90 HG2 ARG 90 22.922 -7.450 -7.893 502 HG3 ARG 90 HG1 ARG 90 23.486 -8.225 -6.411 503 HD2 ARG 90 HD2 ARG 90 21.302 -6.155 -6.569 504 HD3 ARG 90 HD1 ARG 90 21.043 -7.895 -6.442 505 HE ARG 90 HE ARG 90 22.544 -7.463 -4.295 506 HH11 ARG 90 HH11 ARG 90 19.837 -5.635 -5.526 507 HH12 ARG 90 HH12 ARG 90 19.297 -5.124 -3.962 508 HH21 ARG 90 HH21 ARG 90 21.849 -6.788 -2.224 509 HH22 ARG 90 HH22 ARG 90 20.440 -5.785 -2.078 510 H PHE 91 HN PHE 91 27.715 -6.353 -5.969 511 HA PHE 91 HA PHE 91 29.157 -4.801 -5.175 512 HB2 PHE 91 HB2 PHE 91 27.859 -3.004 -7.240 513 HB3 PHE 91 HB1 PHE 91 29.345 -2.636 -6.371 514 HD1 PHE 91 HD1 PHE 91 31.389 -3.930 -6.814 515 HD2 PHE 91 HD2 PHE 91 27.838 -4.512 -9.083 516 HE1 PHE 91 HE1 PHE 91 32.689 -5.096 -8.548 517 HE2 PHE 91 HE2 PHE 91 29.130 -5.677 -10.819 518 HZ PHE 91 HZ PHE 91 31.560 -5.972 -10.551 519 H VAL 92 HN VAL 92 29.295 -3.032 -3.713 520 HA VAL 92 HA VAL 92 27.040 -2.817 -2.022 521 HB VAL 92 HB VAL 92 29.488 -1.036 -2.021 522 HG11 VAL 92 HG11 VAL 92 27.678 -0.210 -0.614 523 HG12 VAL 92 HG12 VAL 92 29.018 -0.793 0.373 524 HG13 VAL 92 HG13 VAL 92 27.568 -1.778 0.187 525 HG21 VAL 92 HG21 VAL 92 30.170 -3.369 -1.991 526 HG22 VAL 92 HG22 VAL 92 29.058 -3.697 -0.663 527 HG23 VAL 92 HG23 VAL 92 30.442 -2.633 -0.412 528 H VAL 93 HN VAL 93 28.010 -1.129 -4.799 529 HA VAL 93 HA VAL 93 26.801 1.375 -4.366 530 HB VAL 93 HB VAL 93 27.225 -0.059 -6.980 531 HG11 VAL 93 HG11 VAL 93 25.679 1.807 -7.192 532 HG12 VAL 93 HG12 VAL 93 27.217 2.186 -7.967 533 HG13 VAL 93 HG13 VAL 93 26.834 2.870 -6.389 534 HG21 VAL 93 HG21 VAL 93 29.319 1.201 -7.118 535 HG22 VAL 93 HG22 VAL 93 29.300 0.131 -5.716 536 HG23 VAL 93 HG23 VAL 93 29.025 1.862 -5.510 537 H ASP 94 HN ASP 94 25.548 -1.668 -5.754 538 HA ASP 94 HA ASP 94 23.118 -0.426 -6.604 539 HB2 ASP 94 HB2 ASP 94 23.961 -2.324 -7.805 540 HB3 ASP 94 HB1 ASP 94 23.844 -3.344 -6.379 541 H ASP 95 HN ASP 95 23.921 -2.603 -3.875 542 HA ASP 95 HA ASP 95 21.244 -2.667 -2.963 543 HB2 ASP 95 HB2 ASP 95 22.071 -3.569 -0.869 544 HB3 ASP 95 HB1 ASP 95 22.884 -4.346 -2.220 545 H ARG 96 HN ARG 96 23.742 -0.312 -2.677 546 HA ARG 96 HA ARG 96 22.438 0.984 -0.411 547 HB2 ARG 96 HB2 ARG 96 24.809 0.998 -0.243 548 HB3 ARG 96 HB1 ARG 96 24.995 1.549 -1.901 549 HG2 ARG 96 HG2 ARG 96 23.865 3.687 -1.202 550 HG3 ARG 96 HG1 ARG 96 24.011 3.123 0.463 551 HD2 ARG 96 HD2 ARG 96 26.353 3.354 -1.409 552 HD3 ARG 96 HD1 ARG 96 25.837 4.664 -0.350 553 HE ARG 96 HE ARG 96 26.131 2.829 1.468 554 HH11 ARG 96 HH11 ARG 96 28.146 3.354 -1.353 555 HH12 ARG 96 HH12 ARG 96 29.581 2.736 -0.603 556 HH21 ARG 96 HH21 ARG 96 28.029 2.046 2.464 557 HH22 ARG 96 HH22 ARG 96 29.522 2.009 1.576 558 H ARG 97 HN ARG 97 23.734 2.220 -3.480 559 HA ARG 97 HA ARG 97 22.136 4.569 -3.324 560 HB2 ARG 97 HB2 ARG 97 24.413 4.359 -4.401 561 HB3 ARG 97 HB1 ARG 97 23.642 3.493 -5.719 562 HG2 ARG 97 HG2 ARG 97 22.783 6.259 -4.945 563 HG3 ARG 97 HG1 ARG 97 24.142 5.978 -6.027 564 HD2 ARG 97 HD2 ARG 97 22.633 4.688 -7.514 565 HD3 ARG 97 HD1 ARG 97 21.288 5.102 -6.449 566 HE ARG 97 HE ARG 97 22.442 7.502 -7.112 567 HH11 ARG 97 HH11 ARG 97 21.003 4.843 -8.908 568 HH12 ARG 97 HH12 ARG 97 20.461 5.871 -10.203 569 HH21 ARG 97 HH21 ARG 97 21.703 8.832 -8.809 570 HH22 ARG 97 HH22 ARG 97 20.846 8.126 -10.144 571 H GLU 98 HN GLU 98 21.962 1.550 -5.096 572 HA GLU 98 HA GLU 98 19.833 2.487 -6.768 573 HB2 GLU 98 HB2 GLU 98 21.270 -0.130 -6.488 574 HB3 GLU 98 HB1 GLU 98 19.832 0.055 -7.507 575 HG2 GLU 98 HG2 GLU 98 22.289 1.757 -7.760 576 HG3 GLU 98 HG1 GLU 98 22.008 0.291 -8.702 577 H LEU 99 HN LEU 99 20.045 0.383 -3.874 578 HA LEU 99 HA LEU 99 17.312 -0.416 -4.135 579 HB2 LEU 99 HB2 LEU 99 18.933 -1.746 -2.868 580 HB3 LEU 99 HB1 LEU 99 19.109 -0.446 -1.712 581 HG LEU 99 HG LEU 99 17.658 -2.466 -1.070 582 HD11 LEU 99 HD11 LEU 99 16.060 -1.024 0.141 583 HD12 LEU 99 HD12 LEU 99 16.631 0.350 -0.809 584 HD13 LEU 99 HD13 LEU 99 17.735 -0.491 0.282 585 HD21 LEU 99 HD21 LEU 99 15.341 -2.387 -1.743 586 HD22 LEU 99 HD22 LEU 99 16.370 -2.551 -3.168 587 HD23 LEU 99 HD23 LEU 99 15.658 -0.987 -2.766 588 H GLN 100 HN GLN 100 18.985 2.080 -2.205 589 HA GLN 100 HA GLN 100 16.645 3.073 -0.978 590 HB2 GLN 100 HB2 GLN 100 17.922 4.992 -0.367 591 HB3 GLN 100 HB1 GLN 100 19.023 3.625 -0.321 592 HG2 GLN 100 HG2 GLN 100 19.994 4.254 -2.414 593 HG3 GLN 100 HG1 GLN 100 18.804 5.534 -2.627 594 HE21 GLN 100 HE21 GLN 100 18.992 7.419 -1.425 595 HE22 GLN 100 HE22 GLN 100 20.442 7.836 -0.583 596 H TYR 101 HN TYR 101 18.087 3.484 -4.082 597 HA TYR 101 HA TYR 101 16.925 5.794 -5.038 598 HB2 TYR 101 HB2 TYR 101 18.645 4.502 -6.234 599 HB3 TYR 101 HB1 TYR 101 17.473 3.232 -6.575 600 HD1 TYR 101 HD1 TYR 101 15.700 3.611 -8.240 601 HD2 TYR 101 HD2 TYR 101 18.651 6.571 -7.444 602 HE1 TYR 101 HE1 TYR 101 15.102 4.761 -10.327 603 HE2 TYR 101 HE2 TYR 101 18.057 7.733 -9.527 604 HH TYR 101 HH TYR 101 15.249 7.059 -11.267 605 H ARG 102 HN ARG 102 15.537 2.530 -4.890 606 HA ARG 102 HA ARG 102 13.113 3.418 -6.198 607 HB2 ARG 102 HB2 ARG 102 12.315 1.157 -5.953 608 HB3 ARG 102 HB1 ARG 102 13.971 1.122 -6.535 609 HG2 ARG 102 HG2 ARG 102 14.749 0.607 -4.271 610 HG3 ARG 102 HG1 ARG 102 13.078 0.619 -3.704 611 HD2 ARG 102 HD2 ARG 102 13.824 -1.660 -4.101 612 HD3 ARG 102 HD1 ARG 102 12.554 -1.220 -5.240 613 HE ARG 102 HE ARG 102 15.063 -0.691 -6.398 614 HH11 ARG 102 HH11 ARG 102 13.077 -3.411 -5.438 615 HH12 ARG 102 HH12 ARG 102 13.714 -4.463 -6.665 616 HH21 ARG 102 HH21 ARG 102 15.915 -2.079 -7.987 617 HH22 ARG 102 HH22 ARG 102 15.324 -3.708 -8.108 618 H VAL 103 HN VAL 103 14.287 3.188 -2.972 619 HA VAL 103 HA VAL 103 11.737 3.041 -1.672 620 HB VAL 103 HB VAL 103 14.302 4.095 -0.485 621 HG11 VAL 103 HG11 VAL 103 13.403 3.184 1.609 622 HG12 VAL 103 HG12 VAL 103 11.906 2.782 0.759 623 HG13 VAL 103 HG13 VAL 103 12.395 4.468 0.928 624 HG21 VAL 103 HG21 VAL 103 14.799 1.830 0.243 625 HG22 VAL 103 HG22 VAL 103 14.764 1.942 -1.516 626 HG23 VAL 103 HG23 VAL 103 13.402 1.232 -0.650 627 H GLU 104 HN GLU 104 14.005 5.695 -2.416 628 HA GLU 104 HA GLU 104 12.428 7.736 -1.315 629 HB2 GLU 104 HB2 GLU 104 13.700 9.203 -3.056 630 HB3 GLU 104 HB1 GLU 104 14.558 8.480 -1.704 631 HG2 GLU 104 HG2 GLU 104 15.434 6.772 -3.069 632 HG3 GLU 104 HG1 GLU 104 14.407 7.229 -4.421 633 H VAL 105 HN VAL 105 12.412 6.422 -4.649 634 HA VAL 105 HA VAL 105 10.482 8.259 -5.572 635 HB VAL 105 HB VAL 105 11.198 7.196 -7.428 636 HG11 VAL 105 HG11 VAL 105 11.338 4.607 -5.909 637 HG12 VAL 105 HG12 VAL 105 12.692 5.674 -6.284 638 HG13 VAL 105 HG13 VAL 105 11.839 4.841 -7.582 639 HG21 VAL 105 HG21 VAL 105 8.813 6.845 -7.515 640 HG22 VAL 105 HG22 VAL 105 8.986 5.319 -6.648 641 HG23 VAL 105 HG23 VAL 105 9.655 5.491 -8.269 642 H GLN 106 HN GLN 106 10.142 5.096 -4.007 643 HA GLN 106 HA GLN 106 7.341 5.014 -4.003 644 HB2 GLN 106 HB2 GLN 106 9.387 3.882 -2.090 645 HB3 GLN 106 HB1 GLN 106 7.673 3.544 -1.949 646 HG2 GLN 106 HG2 GLN 106 9.373 2.917 -4.343 647 HG3 GLN 106 HG1 GLN 106 8.897 1.765 -3.098 648 HE21 GLN 106 HE21 GLN 106 7.800 3.703 -5.782 649 HE22 GLN 106 HE22 GLN 106 6.292 2.889 -6.006 650 H ASN 107 HN ASN 107 9.623 6.350 -1.649 651 HA ASN 107 HA ASN 107 7.918 7.416 0.250 652 HB2 ASN 107 HB2 ASN 107 10.344 7.409 0.474 653 HB3 ASN 107 HB1 ASN 107 10.496 8.556 -0.854 654 HD21 ASN 107 HD21 ASN 107 11.591 10.019 0.444 655 HD22 ASN 107 HD22 ASN 107 10.796 10.940 1.671 656 H ARG 108 HN ARG 108 8.964 8.876 -2.821 657 HA ARG 108 HA ARG 108 7.536 11.315 -2.423 658 HB2 ARG 108 HB2 ARG 108 8.760 10.065 -4.883 659 HB3 ARG 108 HB1 ARG 108 8.071 11.677 -4.842 660 HG2 ARG 108 HG2 ARG 108 9.723 12.413 -3.268 661 HG3 ARG 108 HG1 ARG 108 10.342 10.769 -3.092 662 HD2 ARG 108 HD2 ARG 108 10.870 10.831 -5.554 663 HD3 ARG 108 HD1 ARG 108 10.496 12.553 -5.512 664 HE ARG 108 HE ARG 108 12.321 12.749 -3.839 665 HH11 ARG 108 HH11 ARG 108 12.274 10.055 -6.085 666 HH12 ARG 108 HH12 ARG 108 13.978 9.759 -5.958 667 HH21 ARG 108 HH21 ARG 108 14.574 12.348 -3.681 668 HH22 ARG 108 HH22 ARG 108 15.279 11.049 -4.597 669 H VAL 109 HN VAL 109 6.984 8.469 -4.462 670 HA VAL 109 HA VAL 109 4.623 9.290 -5.686 671 HB VAL 109 HB VAL 109 5.489 6.487 -4.972 672 HG11 VAL 109 HG11 VAL 109 3.366 7.394 -6.919 673 HG12 VAL 109 HG12 VAL 109 3.076 6.577 -5.380 674 HG13 VAL 109 HG13 VAL 109 3.915 5.734 -6.685 675 HG21 VAL 109 HG21 VAL 109 6.180 6.399 -7.342 676 HG22 VAL 109 HG22 VAL 109 7.076 7.597 -6.408 677 HG23 VAL 109 HG23 VAL 109 5.779 8.111 -7.496 678 H TYR 110 HN TYR 110 5.065 7.402 -2.705 679 HA TYR 110 HA TYR 110 2.320 7.064 -2.207 680 HB2 TYR 110 HB2 TYR 110 4.692 7.008 -0.352 681 HB3 TYR 110 HB1 TYR 110 3.057 6.634 0.169 682 HD1 TYR 110 HD1 TYR 110 5.439 4.803 0.372 683 HD2 TYR 110 HD2 TYR 110 2.470 5.222 -2.647 684 HE1 TYR 110 HE1 TYR 110 5.768 2.457 -0.269 685 HE2 TYR 110 HE2 TYR 110 2.792 2.876 -3.291 686 HH TYR 110 HH TYR 110 4.727 1.167 -3.113 687 H LYS 111 HN LYS 111 4.473 9.735 -1.564 688 HA LYS 111 HA LYS 111 2.791 11.157 0.211 689 HB2 LYS 111 HB2 LYS 111 5.034 11.925 -1.614 690 HB3 LYS 111 HB1 LYS 111 4.047 13.187 -0.887 691 HG2 LYS 111 HG2 LYS 111 4.647 12.487 1.312 692 HG3 LYS 111 HG1 LYS 111 5.454 11.047 0.688 693 HD2 LYS 111 HD2 LYS 111 7.177 12.340 -0.307 694 HD3 LYS 111 HD1 LYS 111 6.300 13.845 -0.025 695 HE2 LYS 111 HE2 LYS 111 8.154 13.507 1.563 696 HE3 LYS 111 HE1 LYS 111 6.585 13.616 2.355 697 HZ1 LYS 111 HZ1 LYS 111 7.991 11.836 3.249 698 HZ2 LYS 111 HZ2 LYS 111 7.986 11.067 1.743 699 HZ3 LYS 111 HZ3 LYS 111 6.546 11.243 2.610 700 H LYS 112 HN LYS 112 3.069 11.106 -3.306 701 HA LYS 112 HA LYS 112 1.208 13.164 -3.814 702 HB2 LYS 112 HB2 LYS 112 1.728 12.795 -5.972 703 HB3 LYS 112 HB1 LYS 112 3.006 11.810 -5.281 704 HG2 LYS 112 HG2 LYS 112 1.288 9.917 -5.381 705 HG3 LYS 112 HG1 LYS 112 0.453 10.969 -6.511 706 HD2 LYS 112 HD2 LYS 112 3.335 10.170 -6.816 707 HD3 LYS 112 HD1 LYS 112 2.012 9.266 -7.541 708 HE2 LYS 112 HE2 LYS 112 2.884 10.685 -9.219 709 HE3 LYS 112 HE1 LYS 112 1.346 11.381 -8.716 710 HZ1 LYS 112 HZ1 LYS 112 3.141 13.025 -9.012 711 HZ2 LYS 112 HZ2 LYS 112 3.995 12.305 -7.744 712 HZ3 LYS 112 HZ3 LYS 112 2.497 13.033 -7.450 713 H GLU 113 HN GLU 113 0.954 9.717 -3.363 714 HA GLU 113 HA GLU 113 -1.744 9.325 -3.995 715 HB2 GLU 113 HB2 GLU 113 -0.221 8.011 -1.734 716 HB3 GLU 113 HB1 GLU 113 -1.654 7.384 -2.534 717 HG2 GLU 113 HG2 GLU 113 0.866 7.910 -4.034 718 HG3 GLU 113 HG1 GLU 113 0.624 6.405 -3.159 719 H ILE 114 HN ILE 114 -0.240 10.108 -0.869 720 HA ILE 114 HA ILE 114 -2.587 10.390 0.598 721 HB ILE 114 HB ILE 114 0.108 11.670 1.000 722 HG12 ILE 114 HG12 ILE 114 -1.176 9.211 2.193 723 HG13 ILE 114 HG11 ILE 114 0.058 9.210 0.941 724 HG21 ILE 114 HG21 ILE 114 -0.617 11.885 3.379 725 HG22 ILE 114 HG22 ILE 114 -2.254 11.472 2.865 726 HG23 ILE 114 HG23 ILE 114 -1.482 12.942 2.260 727 HD11 ILE 114 HD11 ILE 114 0.950 8.708 3.151 728 HD12 ILE 114 HD12 ILE 114 0.420 10.294 3.714 729 HD13 ILE 114 HD13 ILE 114 1.649 10.169 2.455 730 H GLN 115 HN GLN 115 -0.834 12.772 -1.359 731 HA GLN 115 HA GLN 115 -2.327 15.024 -0.562 732 HB2 GLN 115 HB2 GLN 115 -1.109 14.548 -3.274 733 HB3 GLN 115 HB1 GLN 115 -1.506 16.097 -2.546 734 HG2 GLN 115 HG2 GLN 115 0.130 15.481 -0.710 735 HG3 GLN 115 HG1 GLN 115 0.649 14.181 -1.786 736 HE21 GLN 115 HE21 GLN 115 0.114 15.805 -4.168 737 HE22 GLN 115 HE22 GLN 115 1.419 16.926 -4.266 738 H ALA 116 HN ALA 116 -2.757 12.747 -3.236 739 HA ALA 116 HA ALA 116 -5.169 13.827 -4.230 740 HB1 ALA 116 HB1 ALA 116 -4.267 10.945 -4.256 741 HB2 ALA 116 HB2 ALA 116 -3.833 12.165 -5.453 742 HB3 ALA 116 HB3 ALA 116 -5.511 11.655 -5.284 743 H LEU 117 HN LEU 117 -4.520 11.310 -1.844 744 HA LEU 117 HA LEU 117 -7.129 10.675 -1.082 745 HB2 LEU 117 HB2 LEU 117 -4.454 10.575 0.222 746 HB3 LEU 117 HB1 LEU 117 -5.860 10.341 1.232 747 HG LEU 117 HG LEU 117 -6.263 8.251 0.422 748 HD11 LEU 117 HD11 LEU 117 -5.715 7.476 -1.844 749 HD12 LEU 117 HD12 LEU 117 -5.061 9.073 -2.215 750 HD13 LEU 117 HD13 LEU 117 -6.776 8.882 -1.849 751 HD21 LEU 117 HD21 LEU 117 -4.227 7.046 0.084 752 HD22 LEU 117 HD22 LEU 117 -3.914 8.343 1.237 753 HD23 LEU 117 HD23 LEU 117 -3.386 8.503 -0.442 754 H ASP 118 HN ASP 118 -5.139 13.420 -0.305 755 HA ASP 118 HA ASP 118 -6.439 14.247 2.052 756 HB2 ASP 118 HB2 ASP 118 -4.178 14.972 1.345 757 HB3 ASP 118 HB1 ASP 118 -4.910 15.942 0.073 758 H ALA 119 HN ALA 119 -7.129 14.832 -1.343 759 HA ALA 119 HA ALA 119 -9.122 16.822 -0.936 760 HB1 ALA 119 HB1 ALA 119 -9.915 16.202 -3.186 761 HB2 ALA 119 HB2 ALA 119 -8.823 14.817 -3.172 762 HB3 ALA 119 HB3 ALA 119 -8.171 16.454 -3.138 763 H GLU 120 HN GLU 120 -9.166 13.304 -1.109 764 HA GLU 120 HA GLU 120 -11.950 13.045 -0.668 765 HB2 GLU 120 HB2 GLU 120 -9.595 11.214 -0.591 766 HB3 GLU 120 HB1 GLU 120 -11.118 10.683 0.091 767 HG2 GLU 120 HG2 GLU 120 -10.796 9.932 -2.210 768 HG3 GLU 120 HG1 GLU 120 -12.230 10.935 -2.014 769 H ILE 121 HN ILE 121 -9.167 13.381 1.450 770 HA ILE 121 HA ILE 121 -10.317 12.729 3.879 771 HB ILE 121 HB ILE 121 -8.106 14.443 3.050 772 HG12 ILE 121 HG12 ILE 121 -7.076 13.427 5.076 773 HG13 ILE 121 HG11 ILE 121 -8.630 12.683 5.450 774 HG21 ILE 121 HG21 ILE 121 -9.295 16.183 4.219 775 HG22 ILE 121 HG22 ILE 121 -7.907 15.667 5.176 776 HG23 ILE 121 HG23 ILE 121 -9.531 15.132 5.617 777 HD11 ILE 121 HD11 ILE 121 -8.521 11.458 3.325 778 HD12 ILE 121 HD12 ILE 121 -7.169 11.090 4.395 779 HD13 ILE 121 HD13 ILE 121 -6.935 12.168 3.019 780 H ARG 122 HN ARG 122 -10.834 15.576 1.891 781 HA ARG 122 HA ARG 122 -12.226 17.120 3.754 782 HB2 ARG 122 HB2 ARG 122 -12.485 17.022 0.747 783 HB3 ARG 122 HB1 ARG 122 -13.020 18.320 1.787 784 HG2 ARG 122 HG2 ARG 122 -10.172 17.433 1.526 785 HG3 ARG 122 HG1 ARG 122 -10.881 18.793 0.654 786 HD2 ARG 122 HD2 ARG 122 -10.858 18.575 3.660 787 HD3 ARG 122 HD1 ARG 122 -9.593 19.386 2.738 788 HE ARG 122 HE ARG 122 -11.648 20.701 1.820 789 HH11 ARG 122 HH11 ARG 122 -11.255 19.577 5.128 790 HH12 ARG 122 HH12 ARG 122 -12.051 20.966 5.811 791 HH21 ARG 122 HH21 ARG 122 -12.709 22.494 2.728 792 HH22 ARG 122 HH22 ARG 122 -12.890 22.611 4.448 793 H LYS 123 HN LYS 123 -13.334 14.714 1.377 794 HA LYS 123 HA LYS 123 -16.091 14.937 2.055 795 HB2 LYS 123 HB2 LYS 123 -16.476 13.022 0.749 796 HB3 LYS 123 HB1 LYS 123 -15.080 13.771 0.002 797 HG2 LYS 123 HG2 LYS 123 -13.801 12.113 1.632 798 HG3 LYS 123 HG1 LYS 123 -15.297 11.205 1.457 799 HD2 LYS 123 HD2 LYS 123 -13.571 12.200 -0.804 800 HD3 LYS 123 HD1 LYS 123 -13.590 10.550 -0.190 801 HE2 LYS 123 HE2 LYS 123 -15.683 10.128 -1.032 802 HE3 LYS 123 HE1 LYS 123 -16.110 11.838 -1.110 803 HZ1 LYS 123 HZ1 LYS 123 -14.597 12.111 -2.960 804 HZ2 LYS 123 HZ2 LYS 123 -15.710 10.888 -3.313 805 HZ3 LYS 123 HZ3 LYS 123 -14.131 10.489 -2.864 806 H LEU 124 HN LEU 124 -13.457 12.950 3.271 807 HA LEU 124 HA LEU 124 -14.883 11.376 5.087 808 HB2 LEU 124 HB2 LEU 124 -12.057 12.421 5.131 809 HB3 LEU 124 HB1 LEU 124 -12.670 11.298 6.327 810 HG LEU 124 HG LEU 124 -12.516 10.739 3.355 811 HD11 LEU 124 HD11 LEU 124 -10.291 10.900 4.351 812 HD12 LEU 124 HD12 LEU 124 -10.681 9.227 3.966 813 HD13 LEU 124 HD13 LEU 124 -10.770 9.793 5.632 814 HD21 LEU 124 HD21 LEU 124 -13.038 8.467 3.981 815 HD22 LEU 124 HD22 LEU 124 -14.305 9.557 4.542 816 HD23 LEU 124 HD23 LEU 124 -13.119 8.926 5.681 817 H GLU 125 HN GLU 125 -13.302 14.534 5.530 818 HA GLU 125 HA GLU 125 -13.711 14.806 8.257 819 HB2 GLU 125 HB2 GLU 125 -13.610 16.962 6.143 820 HB3 GLU 125 HB1 GLU 125 -13.507 17.258 7.874 821 HG2 GLU 125 HG2 GLU 125 -11.481 15.847 7.953 822 HG3 GLU 125 HG1 GLU 125 -11.572 15.668 6.211 823 H ARG 126 HN ARG 126 -15.935 15.417 5.618 824 HA ARG 126 HA ARG 126 -17.917 16.719 7.187 825 HB2 ARG 126 HB2 ARG 126 -18.057 15.269 4.549 826 HB3 ARG 126 HB1 ARG 126 -19.462 16.021 5.293 827 HG2 ARG 126 HG2 ARG 126 -16.939 17.403 4.404 828 HG3 ARG 126 HG1 ARG 126 -18.529 17.502 3.646 829 HD2 ARG 126 HD2 ARG 126 -19.353 18.393 5.890 830 HD3 ARG 126 HD1 ARG 126 -17.654 18.589 6.308 831 HE ARG 126 HE ARG 126 -18.500 19.823 3.823 832 HH11 ARG 126 HH11 ARG 126 -17.782 20.223 7.234 833 HH12 ARG 126 HH12 ARG 126 -17.762 21.959 7.144 834 HH21 ARG 126 HH21 ARG 126 -18.448 22.097 3.709 835 HH22 ARG 126 HH22 ARG 126 -18.130 23.024 5.139 836 H LEU 127 HN LEU 127 -17.068 13.405 6.662 837 HA LEU 127 HA LEU 127 -19.483 12.362 7.852 838 HB2 LEU 127 HB2 LEU 127 -17.308 11.328 6.338 839 HB3 LEU 127 HB1 LEU 127 -17.365 10.442 7.846 840 HG LEU 127 HG LEU 127 -18.645 9.322 6.079 841 HD11 LEU 127 HD11 LEU 127 -20.370 10.447 8.278 842 HD12 LEU 127 HD12 LEU 127 -19.332 9.028 8.394 843 HD13 LEU 127 HD13 LEU 127 -20.727 9.014 7.316 844 HD21 LEU 127 HD21 LEU 127 -19.299 11.333 4.825 845 HD22 LEU 127 HD22 LEU 127 -20.401 11.774 6.129 846 HD23 LEU 127 HD23 LEU 127 -20.681 10.304 5.198 847 H LEU 128 HN LEU 128 -16.056 12.727 8.831 848 HA LEU 128 HA LEU 128 -16.135 12.115 11.472 849 HB2 LEU 128 HB2 LEU 128 -14.842 14.355 9.955 850 HB3 LEU 128 HB1 LEU 128 -14.634 14.227 11.687 851 HG LEU 128 HG LEU 128 -13.624 12.017 11.386 852 HD11 LEU 128 HD11 LEU 128 -13.806 12.541 8.449 853 HD12 LEU 128 HD12 LEU 128 -14.702 11.313 9.342 854 HD13 LEU 128 HD13 LEU 128 -12.947 11.207 9.218 855 HD21 LEU 128 HD21 LEU 128 -12.225 14.013 11.480 856 HD22 LEU 128 HD22 LEU 128 -12.350 14.176 9.726 857 HD23 LEU 128 HD23 LEU 128 -11.516 12.786 10.427 858 H GLU 129 HN GLU 129 -16.880 15.340 10.155 859 HA GLU 129 HA GLU 129 -17.831 16.507 12.500 860 HB2 GLU 129 HB2 GLU 129 -18.638 17.076 9.647 861 HB3 GLU 129 HB1 GLU 129 -19.005 18.114 11.015 862 HG2 GLU 129 HG2 GLU 129 -16.611 18.438 11.398 863 HG3 GLU 129 HG1 GLU 129 -16.260 17.420 10.002 864 H SER 130 HN SER 130 -19.514 14.510 10.160 865 HA SER 130 HA SER 130 -22.144 15.092 10.976 866 HB2 SER 130 HB2 SER 130 -21.477 13.986 8.822 867 HB3 SER 130 HB1 SER 130 -21.162 12.512 9.735 868 HG SER 130 HG SER 130 -23.663 13.788 9.950 869 H GLY 131 HN GLY 131 -19.690 13.175 12.434 870 HA2 GLY 131 HA2 GLY 131 -19.796 12.474 14.675 871 HA3 GLY 131 HA1 GLY 131 -21.549 12.537 14.597 872 H LEU 132 HN LEU 132 -20.128 10.979 11.962 873 HA LEU 132 HA LEU 132 -20.965 8.383 13.018 874 HB2 LEU 132 HB2 LEU 132 -20.405 9.404 10.248 875 HB3 LEU 132 HB1 LEU 132 -20.456 7.685 10.575 876 HG LEU 132 HG LEU 132 -22.572 8.417 9.667 877 HD11 LEU 132 HD11 LEU 132 -22.814 7.800 12.603 878 HD12 LEU 132 HD12 LEU 132 -22.604 6.621 11.310 879 HD13 LEU 132 HD13 LEU 132 -24.074 7.591 11.388 880 HD21 LEU 132 HD21 LEU 132 -24.010 9.998 10.835 881 HD22 LEU 132 HD22 LEU 132 -22.495 10.758 10.350 882 HD23 LEU 132 HD23 LEU 132 -22.743 10.280 12.028 883 H THR 133 HN THR 133 -18.222 9.877 11.361 884 HA THR 133 HA THR 133 -16.535 7.622 12.115 885 HB THR 133 HB THR 133 -15.845 10.005 10.386 886 HG1 THR 133 HG1 THR 133 -17.100 7.539 9.837 887 HG21 THR 133 HG21 THR 133 -14.530 7.300 10.680 888 HG22 THR 133 HG22 THR 133 -13.906 8.820 11.316 889 HG23 THR 133 HG23 THR 133 -14.030 8.579 9.575 Start of MODEL 12 1 H1 MET 1 HT1 MET 1 29.240 2.627 14.237 2 H2 MET 1 HT2 MET 1 30.758 3.067 14.833 3 H3 MET 1 HT3 MET 1 29.952 1.736 15.486 4 HA MET 1 HA MET 1 31.737 1.060 14.017 5 HB2 MET 1 HB2 MET 1 28.926 0.472 13.083 6 HB3 MET 1 HB1 MET 1 30.340 -0.390 12.501 7 HG2 MET 1 HG2 MET 1 29.427 -0.271 15.365 8 HG3 MET 1 HG1 MET 1 29.155 -1.613 14.254 9 HE1 MET 1 HE1 MET 1 30.215 -3.292 15.980 10 HE2 MET 1 HE2 MET 1 30.526 -1.987 17.124 11 HE3 MET 1 HE3 MET 1 31.818 -3.106 16.690 12 H ASP 2 HN ASP 2 31.264 3.864 13.291 13 HA ASP 2 HA ASP 2 31.937 3.574 10.469 14 HB2 ASP 2 HB2 ASP 2 30.602 5.617 9.900 15 HB3 ASP 2 HB1 ASP 2 29.632 4.213 10.319 16 H SER 3 HN SER 3 33.807 4.475 10.092 17 HA SER 3 HA SER 3 34.679 6.688 11.822 18 HB2 SER 3 HB2 SER 3 36.376 4.735 10.254 19 HB3 SER 3 HB1 SER 3 36.975 6.004 11.321 20 HG SER 3 HG SER 3 35.708 3.581 11.953 21 H ALA 4 HN ALA 4 34.794 5.469 8.490 22 HA ALA 4 HA ALA 4 35.563 8.084 7.485 23 HB1 ALA 4 HB1 ALA 4 34.961 5.514 6.019 24 HB2 ALA 4 HB2 ALA 4 36.560 6.095 6.478 25 HB3 ALA 4 HB3 ALA 4 35.607 6.985 5.294 26 H ILE 5 HN ILE 5 32.830 5.876 7.417 27 HA ILE 5 HA ILE 5 31.086 7.714 6.042 28 HB ILE 5 HB ILE 5 30.405 5.211 7.609 29 HG12 ILE 5 HG12 ILE 5 30.914 5.513 4.641 30 HG13 ILE 5 HG11 ILE 5 32.040 4.796 5.786 31 HG21 ILE 5 HG21 ILE 5 28.374 5.171 6.239 32 HG22 ILE 5 HG22 ILE 5 28.857 6.690 5.485 33 HG23 ILE 5 HG23 ILE 5 28.477 6.643 7.206 34 HD11 ILE 5 HD11 ILE 5 29.300 3.751 5.115 35 HD12 ILE 5 HD12 ILE 5 30.422 3.034 6.270 36 HD13 ILE 5 HD13 ILE 5 30.837 3.091 4.557 37 H SER 6 HN SER 6 29.408 8.957 7.031 38 HA SER 6 HA SER 6 29.673 9.229 9.944 39 HB2 SER 6 HB2 SER 6 28.292 11.081 7.980 40 HB3 SER 6 HB1 SER 6 28.604 11.403 9.686 41 HG SER 6 HG SER 6 30.934 10.888 8.840 42 H LYS 7 HN LYS 7 27.427 9.870 10.982 43 HA LYS 7 HA LYS 7 25.592 7.766 10.590 44 HB2 LYS 7 HB2 LYS 7 25.867 9.172 12.670 45 HB3 LYS 7 HB1 LYS 7 24.998 10.452 11.839 46 HG2 LYS 7 HG2 LYS 7 23.033 9.101 11.687 47 HG3 LYS 7 HG1 LYS 7 23.892 7.703 12.330 48 HD2 LYS 7 HD2 LYS 7 23.685 10.244 13.904 49 HD3 LYS 7 HD1 LYS 7 22.367 9.076 13.902 50 HE2 LYS 7 HE2 LYS 7 23.784 8.679 15.815 51 HE3 LYS 7 HE1 LYS 7 23.932 7.338 14.686 52 HZ1 LYS 7 HZ1 LYS 7 26.059 8.136 15.674 53 HZ2 LYS 7 HZ2 LYS 7 25.872 9.578 14.815 54 HZ3 LYS 7 HZ3 LYS 7 26.042 8.116 13.985 55 H GLU 8 HN GLU 8 26.042 10.809 9.096 56 HA GLU 8 HA GLU 8 23.695 11.531 7.942 57 HB2 GLU 8 HB2 GLU 8 26.439 11.423 6.689 58 HB3 GLU 8 HB1 GLU 8 25.085 12.324 6.021 59 HG2 GLU 8 HG2 GLU 8 25.016 13.657 8.057 60 HG3 GLU 8 HG1 GLU 8 26.398 12.777 8.687 61 H ASP 9 HN ASP 9 25.926 9.066 6.698 62 HA ASP 9 HA ASP 9 24.460 8.515 4.340 63 HB2 ASP 9 HB2 ASP 9 26.874 8.029 4.654 64 HB3 ASP 9 HB1 ASP 9 26.448 6.757 5.791 65 H GLU 10 HN GLU 10 24.573 6.989 7.518 66 HA GLU 10 HA GLU 10 22.906 4.801 6.867 67 HB2 GLU 10 HB2 GLU 10 24.331 4.664 8.793 68 HB3 GLU 10 HB1 GLU 10 23.582 6.084 9.514 69 HG2 GLU 10 HG2 GLU 10 21.536 4.914 9.859 70 HG3 GLU 10 HG1 GLU 10 22.122 3.520 8.955 71 H GLU 11 HN GLU 11 22.184 7.755 8.726 72 HA GLU 11 HA GLU 11 19.459 7.409 8.960 73 HB2 GLU 11 HB2 GLU 11 21.067 9.952 8.766 74 HB3 GLU 11 HB1 GLU 11 19.373 9.892 9.241 75 HG2 GLU 11 HG2 GLU 11 21.583 8.435 10.661 76 HG3 GLU 11 HG1 GLU 11 20.961 10.011 11.145 77 H ARG 12 HN ARG 12 21.313 8.601 6.253 78 HA ARG 12 HA ARG 12 19.303 9.661 4.668 79 HB2 ARG 12 HB2 ARG 12 21.404 9.948 3.764 80 HB3 ARG 12 HB1 ARG 12 21.909 8.312 4.146 81 HG2 ARG 12 HG2 ARG 12 21.778 8.591 1.770 82 HG3 ARG 12 HG1 ARG 12 20.527 7.473 2.300 83 HD2 ARG 12 HD2 ARG 12 18.879 9.304 2.183 84 HD3 ARG 12 HD1 ARG 12 20.148 10.383 1.590 85 HE ARG 12 HE ARG 12 20.203 8.210 -0.084 86 HH11 ARG 12 HH11 ARG 12 17.745 10.545 0.831 87 HH12 ARG 12 HH12 ARG 12 16.943 10.471 -0.705 88 HH21 ARG 12 HH21 ARG 12 19.144 8.108 -2.067 89 HH22 ARG 12 HH22 ARG 12 17.732 9.082 -2.368 90 H TYR 13 HN TYR 13 20.421 6.264 4.770 91 HA TYR 13 HA TYR 13 18.266 5.453 3.056 92 HB2 TYR 13 HB2 TYR 13 20.284 4.221 2.816 93 HB3 TYR 13 HB1 TYR 13 20.390 3.914 4.547 94 HD1 TYR 13 HD1 TYR 13 20.050 1.708 5.060 95 HD2 TYR 13 HD2 TYR 13 17.735 3.449 1.952 96 HE1 TYR 13 HE1 TYR 13 18.816 -0.405 4.808 97 HE2 TYR 13 HE2 TYR 13 16.487 1.348 1.688 98 HH TYR 13 HH TYR 13 16.805 -1.060 2.159 99 H GLN 14 HN GLN 14 19.079 4.950 6.476 100 HA GLN 14 HA GLN 14 17.020 3.177 7.117 101 HB2 GLN 14 HB2 GLN 14 18.401 5.257 8.816 102 HB3 GLN 14 HB1 GLN 14 17.322 4.033 9.462 103 HG2 GLN 14 HG2 GLN 14 19.801 3.392 7.896 104 HG3 GLN 14 HG1 GLN 14 19.762 3.551 9.650 105 HE21 GLN 14 HE21 GLN 14 18.836 1.622 6.926 106 HE22 GLN 14 HE22 GLN 14 18.355 0.222 7.819 107 H LYS 15 HN LYS 15 17.070 6.691 7.691 108 HA LYS 15 HA LYS 15 14.406 6.828 8.519 109 HB2 LYS 15 HB2 LYS 15 16.104 9.007 7.306 110 HB3 LYS 15 HB1 LYS 15 14.588 9.260 8.158 111 HG2 LYS 15 HG2 LYS 15 17.049 8.037 9.385 112 HG3 LYS 15 HG1 LYS 15 16.598 9.732 9.526 113 HD2 LYS 15 HD2 LYS 15 14.858 7.445 10.436 114 HD3 LYS 15 HD1 LYS 15 15.970 8.316 11.492 115 HE2 LYS 15 HE2 LYS 15 14.771 10.414 10.908 116 HE3 LYS 15 HE1 LYS 15 13.602 9.446 10.013 117 HZ1 LYS 15 HZ1 LYS 15 13.012 8.310 12.053 118 HZ2 LYS 15 HZ2 LYS 15 12.831 9.978 12.251 119 HZ3 LYS 15 HZ3 LYS 15 14.169 9.191 12.919 120 H LEU 16 HN LEU 16 15.806 6.729 5.336 121 HA LEU 16 HA LEU 16 13.592 7.761 3.899 122 HB2 LEU 16 HB2 LEU 16 15.932 7.398 3.012 123 HB3 LEU 16 HB1 LEU 16 15.553 5.688 2.918 124 HG LEU 16 HG LEU 16 13.859 6.091 1.230 125 HD11 LEU 16 HD11 LEU 16 14.459 9.004 1.733 126 HD12 LEU 16 HD12 LEU 16 12.919 8.169 1.966 127 HD13 LEU 16 HD13 LEU 16 13.563 8.406 0.339 128 HD21 LEU 16 HD21 LEU 16 16.371 7.639 0.624 129 HD22 LEU 16 HD22 LEU 16 15.262 6.933 -0.555 130 HD23 LEU 16 HD23 LEU 16 16.192 5.887 0.522 131 H VAL 17 HN VAL 17 14.547 4.448 4.771 132 HA VAL 17 HA VAL 17 12.301 3.170 3.638 133 HB VAL 17 HB VAL 17 13.014 1.233 4.605 134 HG11 VAL 17 HG11 VAL 17 15.415 1.202 4.909 135 HG12 VAL 17 HG12 VAL 17 15.419 2.959 5.072 136 HG13 VAL 17 HG13 VAL 17 14.951 2.215 3.540 137 HG21 VAL 17 HG21 VAL 17 13.939 0.982 6.863 138 HG22 VAL 17 HG22 VAL 17 12.357 1.768 6.875 139 HG23 VAL 17 HG23 VAL 17 13.822 2.729 7.093 140 H THR 18 HN THR 18 12.845 4.808 6.660 141 HA THR 18 HA THR 18 10.522 4.024 7.994 142 HB THR 18 HB THR 18 12.525 6.220 8.237 143 HG1 THR 18 HG1 THR 18 13.103 5.077 9.976 144 HG21 THR 18 HG21 THR 18 9.964 6.088 9.793 145 HG22 THR 18 HG22 THR 18 10.478 7.365 8.691 146 HG23 THR 18 HG23 THR 18 11.350 7.099 10.199 147 H GLU 19 HN GLU 19 11.292 6.986 6.134 148 HA GLU 19 HA GLU 19 8.780 8.163 6.132 149 HB2 GLU 19 HB2 GLU 19 10.793 8.075 3.857 150 HB3 GLU 19 HB1 GLU 19 9.444 9.202 3.975 151 HG2 GLU 19 HG2 GLU 19 10.416 10.105 6.054 152 HG3 GLU 19 HG1 GLU 19 11.787 9.009 5.867 153 H ASN 20 HN ASN 20 10.146 5.724 4.051 154 HA ASN 20 HA ASN 20 8.105 5.523 2.167 155 HB2 ASN 20 HB2 ASN 20 10.410 4.671 1.927 156 HB3 ASN 20 HB1 ASN 20 10.056 3.416 3.105 157 HD21 ASN 20 HD21 ASN 20 10.782 2.034 1.395 158 HD22 ASN 20 HD22 ASN 20 9.691 1.556 0.152 159 H GLU 21 HN GLU 21 8.637 3.538 5.125 160 HA GLU 21 HA GLU 21 6.307 1.979 4.645 161 HB2 GLU 21 HB2 GLU 21 7.884 2.411 7.186 162 HB3 GLU 21 HB1 GLU 21 6.716 1.123 6.910 163 HG2 GLU 21 HG2 GLU 21 9.029 1.483 5.079 164 HG3 GLU 21 HG1 GLU 21 9.234 0.659 6.614 165 H GLN 22 HN GLN 22 6.922 4.852 6.639 166 HA GLN 22 HA GLN 22 4.642 4.781 8.241 167 HB2 GLN 22 HB2 GLN 22 5.938 7.262 7.105 168 HB3 GLN 22 HB1 GLN 22 4.832 7.216 8.467 169 HG2 GLN 22 HG2 GLN 22 6.490 5.790 9.670 170 HG3 GLN 22 HG1 GLN 22 7.610 6.087 8.338 171 HE21 GLN 22 HE21 GLN 22 8.406 8.176 8.013 172 HE22 GLN 22 HE22 GLN 22 8.375 9.367 9.265 173 H LEU 23 HN LEU 23 5.058 6.472 5.143 174 HA LEU 23 HA LEU 23 2.403 7.491 5.306 175 HB2 LEU 23 HB2 LEU 23 2.943 8.861 3.561 176 HB3 LEU 23 HB1 LEU 23 4.498 8.574 4.287 177 HG LEU 23 HG LEU 23 3.452 7.395 1.739 178 HD11 LEU 23 HD11 LEU 23 5.316 8.630 0.759 179 HD12 LEU 23 HD12 LEU 23 5.729 9.260 2.354 180 HD13 LEU 23 HD13 LEU 23 4.196 9.700 1.601 181 HD21 LEU 23 HD21 LEU 23 5.646 6.350 1.496 182 HD22 LEU 23 HD22 LEU 23 4.752 5.696 2.868 183 HD23 LEU 23 HD23 LEU 23 6.057 6.856 3.134 184 H GLN 24 HN GLN 24 3.814 4.674 3.900 185 HA GLN 24 HA GLN 24 1.886 3.825 2.111 186 HB2 GLN 24 HB2 GLN 24 3.311 2.269 4.245 187 HB3 GLN 24 HB1 GLN 24 2.369 1.514 2.986 188 HG2 GLN 24 HG2 GLN 24 3.867 2.505 1.329 189 HG3 GLN 24 HG1 GLN 24 4.845 3.140 2.643 190 HE21 GLN 24 HE21 GLN 24 6.591 1.982 2.057 191 HE22 GLN 24 HE22 GLN 24 6.730 0.280 2.307 192 H ARG 25 HN ARG 25 1.875 3.683 5.620 193 HA ARG 25 HA ARG 25 -0.624 2.402 5.930 194 HB2 ARG 25 HB2 ARG 25 0.560 2.191 7.858 195 HB3 ARG 25 HB1 ARG 25 1.431 3.694 7.601 196 HG2 ARG 25 HG2 ARG 25 -0.809 4.806 8.207 197 HG3 ARG 25 HG1 ARG 25 -1.201 3.241 8.924 198 HD2 ARG 25 HD2 ARG 25 1.134 5.033 9.597 199 HD3 ARG 25 HD1 ARG 25 -0.253 4.662 10.623 200 HE ARG 25 HE ARG 25 1.069 2.272 9.907 201 HH11 ARG 25 HH11 ARG 25 1.468 5.086 11.959 202 HH12 ARG 25 HH12 ARG 25 2.462 4.254 13.111 203 HH21 ARG 25 HH21 ARG 25 2.362 1.180 11.418 204 HH22 ARG 25 HH22 ARG 25 2.962 2.029 12.810 205 H LEU 26 HN LEU 26 0.454 5.755 5.968 206 HA LEU 26 HA LEU 26 -1.936 6.923 6.848 207 HB2 LEU 26 HB2 LEU 26 0.197 8.143 5.098 208 HB3 LEU 26 HB1 LEU 26 -0.955 9.015 6.100 209 HG LEU 26 HG LEU 26 1.196 7.157 7.134 210 HD11 LEU 26 HD11 LEU 26 2.088 9.249 6.198 211 HD12 LEU 26 HD12 LEU 26 2.316 9.121 7.942 212 HD13 LEU 26 HD13 LEU 26 1.045 10.159 7.291 213 HD21 LEU 26 HD21 LEU 26 -0.791 7.189 8.552 214 HD22 LEU 26 HD22 LEU 26 -0.717 8.950 8.619 215 HD23 LEU 26 HD23 LEU 26 0.574 7.988 9.335 216 H ILE 27 HN ILE 27 -0.752 6.166 3.618 217 HA ILE 27 HA ILE 27 -2.863 7.244 2.115 218 HB ILE 27 HB ILE 27 -1.246 4.742 1.608 219 HG12 ILE 27 HG12 ILE 27 -0.911 7.513 0.462 220 HG13 ILE 27 HG11 ILE 27 0.037 6.872 1.812 221 HG21 ILE 27 HG21 ILE 27 -3.302 4.712 0.308 222 HG22 ILE 27 HG22 ILE 27 -1.910 4.991 -0.738 223 HG23 ILE 27 HG23 ILE 27 -2.961 6.334 -0.294 224 HD11 ILE 27 HD11 ILE 27 1.203 6.719 -0.337 225 HD12 ILE 27 HD12 ILE 27 -0.083 5.677 -0.943 226 HD13 ILE 27 HD13 ILE 27 0.926 5.139 0.399 227 H THR 28 HN THR 28 -2.401 3.996 3.446 228 HA THR 28 HA THR 28 -4.740 2.855 2.473 229 HB THR 28 HB THR 28 -2.588 1.934 3.881 230 HG1 THR 28 HG1 THR 28 -4.739 0.938 2.647 231 HG21 THR 28 HG21 THR 28 -3.443 2.496 6.058 232 HG22 THR 28 HG22 THR 28 -3.535 0.744 5.858 233 HG23 THR 28 HG23 THR 28 -4.991 1.728 5.696 234 H GLN 29 HN GLN 29 -4.246 4.828 5.335 235 HA GLN 29 HA GLN 29 -6.659 4.294 6.694 236 HB2 GLN 29 HB2 GLN 29 -5.316 6.995 6.575 237 HB3 GLN 29 HB1 GLN 29 -6.280 6.327 7.882 238 HG2 GLN 29 HG2 GLN 29 -4.525 4.649 8.244 239 HG3 GLN 29 HG1 GLN 29 -3.547 5.445 7.027 240 HE21 GLN 29 HE21 GLN 29 -3.082 5.029 9.900 241 HE22 GLN 29 HE22 GLN 29 -2.789 6.604 10.550 242 H LYS 30 HN LYS 30 -5.765 6.697 4.337 243 HA LYS 30 HA LYS 30 -8.371 7.911 4.318 244 HB2 LYS 30 HB2 LYS 30 -6.169 8.406 2.323 245 HB3 LYS 30 HB1 LYS 30 -7.465 9.496 2.800 246 HG2 LYS 30 HG2 LYS 30 -5.045 8.687 4.385 247 HG3 LYS 30 HG1 LYS 30 -5.503 10.298 3.835 248 HD2 LYS 30 HD2 LYS 30 -7.407 10.297 5.357 249 HD3 LYS 30 HD1 LYS 30 -7.021 8.654 5.862 250 HE2 LYS 30 HE2 LYS 30 -6.195 10.131 7.536 251 HE3 LYS 30 HE1 LYS 30 -4.810 9.496 6.651 252 HZ1 LYS 30 HZ1 LYS 30 -6.046 12.172 6.322 253 HZ2 LYS 30 HZ2 LYS 30 -4.796 11.571 5.351 254 HZ3 LYS 30 HZ3 LYS 30 -4.535 11.831 7.001 255 H GLU 31 HN GLU 31 -6.504 5.889 2.085 256 HA GLU 31 HA GLU 31 -8.131 5.708 -0.087 257 HB2 GLU 31 HB2 GLU 31 -6.415 3.706 1.311 258 HB3 GLU 31 HB1 GLU 31 -7.426 3.172 -0.023 259 HG2 GLU 31 HG2 GLU 31 -5.481 5.448 -0.239 260 HG3 GLU 31 HG1 GLU 31 -5.068 3.774 -0.611 261 H GLU 32 HN GLU 32 -8.415 3.526 2.745 262 HA GLU 32 HA GLU 32 -10.622 2.106 1.879 263 HB2 GLU 32 HB2 GLU 32 -11.116 1.759 4.353 264 HB3 GLU 32 HB1 GLU 32 -9.524 1.274 3.788 265 HG2 GLU 32 HG2 GLU 32 -8.458 2.990 4.881 266 HG3 GLU 32 HG1 GLU 32 -9.904 3.997 4.927 267 H LYS 33 HN LYS 33 -10.569 5.130 3.733 268 HA LYS 33 HA LYS 33 -13.401 5.221 4.028 269 HB2 LYS 33 HB2 LYS 33 -11.319 7.386 4.349 270 HB3 LYS 33 HB1 LYS 33 -13.002 7.523 4.845 271 HG2 LYS 33 HG2 LYS 33 -12.710 5.700 6.423 272 HG3 LYS 33 HG1 LYS 33 -11.037 5.500 5.903 273 HD2 LYS 33 HD2 LYS 33 -10.539 7.776 6.675 274 HD3 LYS 33 HD1 LYS 33 -12.209 7.952 7.216 275 HE2 LYS 33 HE2 LYS 33 -10.767 7.390 9.087 276 HE3 LYS 33 HE1 LYS 33 -11.896 6.077 8.764 277 HZ1 LYS 33 HZ1 LYS 33 -10.175 4.824 7.705 278 HZ2 LYS 33 HZ2 LYS 33 -9.581 5.352 9.203 279 HZ3 LYS 33 HZ3 LYS 33 -9.096 6.129 7.786 280 H ILE 34 HN ILE 34 -11.128 6.758 1.769 281 HA ILE 34 HA ILE 34 -13.059 8.412 0.522 282 HB ILE 34 HB ILE 34 -10.393 7.421 -0.505 283 HG12 ILE 34 HG12 ILE 34 -11.153 10.199 0.343 284 HG13 ILE 34 HG11 ILE 34 -10.612 9.002 1.519 285 HG21 ILE 34 HG21 ILE 34 -11.832 7.939 -2.391 286 HG22 ILE 34 HG22 ILE 34 -10.574 9.163 -2.211 287 HG23 ILE 34 HG23 ILE 34 -12.222 9.504 -1.679 288 HD11 ILE 34 HD11 ILE 34 -8.503 8.756 0.323 289 HD12 ILE 34 HD12 ILE 34 -8.776 10.426 0.820 290 HD13 ILE 34 HD13 ILE 34 -9.035 9.953 -0.858 291 H ARG 35 HN ARG 35 -12.060 5.080 -0.019 292 HA ARG 35 HA ARG 35 -13.188 4.707 -2.566 293 HB2 ARG 35 HB2 ARG 35 -12.812 2.741 -0.309 294 HB3 ARG 35 HB1 ARG 35 -13.274 2.287 -1.946 295 HG2 ARG 35 HG2 ARG 35 -10.705 3.655 -1.159 296 HG3 ARG 35 HG1 ARG 35 -10.890 1.950 -1.577 297 HD2 ARG 35 HD2 ARG 35 -11.466 2.489 -3.827 298 HD3 ARG 35 HD1 ARG 35 -11.601 4.203 -3.448 299 HE ARG 35 HE ARG 35 -8.988 3.310 -2.870 300 HH11 ARG 35 HH11 ARG 35 -11.085 3.969 -5.590 301 HH12 ARG 35 HH12 ARG 35 -9.790 4.401 -6.654 302 HH21 ARG 35 HH21 ARG 35 -7.279 3.902 -4.239 303 HH22 ARG 35 HH22 ARG 35 -7.613 4.362 -5.886 304 H VAL 36 HN VAL 36 -14.566 4.607 0.633 305 HA VAL 36 HA VAL 36 -17.138 3.660 -0.178 306 HB VAL 36 HB VAL 36 -16.465 5.273 2.283 307 HG11 VAL 36 HG11 VAL 36 -18.348 4.048 3.278 308 HG12 VAL 36 HG12 VAL 36 -18.646 3.268 1.725 309 HG13 VAL 36 HG13 VAL 36 -18.845 5.012 1.887 310 HG21 VAL 36 HG21 VAL 36 -15.922 3.234 3.414 311 HG22 VAL 36 HG22 VAL 36 -14.932 3.333 1.949 312 HG23 VAL 36 HG23 VAL 36 -16.349 2.279 1.995 313 H LEU 37 HN LEU 37 -15.719 6.823 0.496 314 HA LEU 37 HA LEU 37 -17.960 8.424 -0.024 315 HB2 LEU 37 HB2 LEU 37 -15.014 8.833 -0.077 316 HB3 LEU 37 HB1 LEU 37 -16.018 10.055 -0.829 317 HG LEU 37 HG LEU 37 -15.324 10.464 1.574 318 HD11 LEU 37 HD11 LEU 37 -17.491 11.395 2.198 319 HD12 LEU 37 HD12 LEU 37 -18.266 10.445 0.930 320 HD13 LEU 37 HD13 LEU 37 -17.115 11.713 0.503 321 HD21 LEU 37 HD21 LEU 37 -17.440 8.396 2.133 322 HD22 LEU 37 HD22 LEU 37 -16.558 9.356 3.321 323 HD23 LEU 37 HD23 LEU 37 -15.708 8.153 2.352 324 H ARG 38 HN ARG 38 -15.735 6.805 -2.136 325 HA ARG 38 HA ARG 38 -16.197 8.307 -4.461 326 HB2 ARG 38 HB2 ARG 38 -14.181 7.101 -4.285 327 HB3 ARG 38 HB1 ARG 38 -15.008 5.623 -3.819 328 HG2 ARG 38 HG2 ARG 38 -15.942 5.466 -6.029 329 HG3 ARG 38 HG1 ARG 38 -15.052 6.904 -6.530 330 HD2 ARG 38 HD2 ARG 38 -12.962 5.658 -5.759 331 HD3 ARG 38 HD1 ARG 38 -13.973 4.219 -5.711 332 HE ARG 38 HE ARG 38 -13.715 5.784 -8.184 333 HH11 ARG 38 HH11 ARG 38 -13.404 2.755 -6.451 334 HH12 ARG 38 HH12 ARG 38 -12.963 1.851 -7.863 335 HH21 ARG 38 HH21 ARG 38 -13.109 4.592 -10.038 336 HH22 ARG 38 HH22 ARG 38 -12.780 2.894 -9.893 337 H GLN 39 HN GLN 39 -17.644 5.381 -3.090 338 HA GLN 39 HA GLN 39 -19.373 4.954 -5.351 339 HB2 GLN 39 HB2 GLN 39 -19.871 2.987 -4.331 340 HB3 GLN 39 HB1 GLN 39 -18.435 3.362 -3.389 341 HG2 GLN 39 HG2 GLN 39 -19.771 2.989 -1.658 342 HG3 GLN 39 HG1 GLN 39 -20.258 4.652 -1.949 343 HE21 GLN 39 HE21 GLN 39 -21.162 2.037 -4.081 344 HE22 GLN 39 HE22 GLN 39 -22.846 2.058 -3.699 345 H ARG 40 HN ARG 40 -19.434 6.632 -2.325 346 HA ARG 40 HA ARG 40 -22.187 7.215 -2.200 347 HB2 ARG 40 HB2 ARG 40 -19.732 8.572 -1.125 348 HB3 ARG 40 HB1 ARG 40 -21.337 9.218 -0.864 349 HG2 ARG 40 HG2 ARG 40 -21.984 7.099 0.222 350 HG3 ARG 40 HG1 ARG 40 -20.321 6.537 0.030 351 HD2 ARG 40 HD2 ARG 40 -20.846 7.492 2.280 352 HD3 ARG 40 HD1 ARG 40 -19.496 8.261 1.452 353 HE ARG 40 HE ARG 40 -20.978 10.101 0.909 354 HH11 ARG 40 HH11 ARG 40 -22.103 7.878 3.373 355 HH12 ARG 40 HH12 ARG 40 -23.205 9.020 4.072 356 HH21 ARG 40 HH21 ARG 40 -22.406 11.609 1.843 357 HH22 ARG 40 HH22 ARG 40 -23.368 11.146 3.210 358 H LEU 41 HN LEU 41 -19.434 8.917 -3.634 359 HA LEU 41 HA LEU 41 -20.789 11.118 -4.684 360 HB2 LEU 41 HB2 LEU 41 -18.535 9.675 -6.069 361 HB3 LEU 41 HB1 LEU 41 -19.013 11.347 -6.267 362 HG LEU 41 HG LEU 41 -17.772 10.156 -3.791 363 HD11 LEU 41 HD11 LEU 41 -15.834 11.501 -4.398 364 HD12 LEU 41 HD12 LEU 41 -16.652 12.026 -5.870 365 HD13 LEU 41 HD13 LEU 41 -16.218 10.330 -5.659 366 HD21 LEU 41 HD21 LEU 41 -17.632 12.456 -2.994 367 HD22 LEU 41 HD22 LEU 41 -19.309 11.973 -3.249 368 HD23 LEU 41 HD23 LEU 41 -18.502 13.013 -4.424 369 H VAL 42 HN VAL 42 -20.546 7.827 -5.790 370 HA VAL 42 HA VAL 42 -21.519 8.004 -8.382 371 HB VAL 42 HB VAL 42 -22.023 5.880 -6.288 372 HG11 VAL 42 HG11 VAL 42 -23.696 5.707 -8.027 373 HG12 VAL 42 HG12 VAL 42 -22.545 4.376 -8.147 374 HG13 VAL 42 HG13 VAL 42 -22.442 5.735 -9.268 375 HG21 VAL 42 HG21 VAL 42 -19.677 6.207 -6.766 376 HG22 VAL 42 HG22 VAL 42 -19.983 6.041 -8.497 377 HG23 VAL 42 HG23 VAL 42 -20.228 4.664 -7.420 378 H GLU 43 HN GLU 43 -23.284 7.737 -5.333 379 HA GLU 43 HA GLU 43 -25.875 7.781 -6.480 380 HB2 GLU 43 HB2 GLU 43 -25.072 8.586 -3.681 381 HB3 GLU 43 HB1 GLU 43 -26.664 8.060 -4.213 382 HG2 GLU 43 HG2 GLU 43 -25.832 5.841 -4.646 383 HG3 GLU 43 HG1 GLU 43 -24.189 6.347 -4.255 384 H ARG 44 HN ARG 44 -23.583 10.243 -5.750 385 HA ARG 44 HA ARG 44 -25.572 12.369 -5.759 386 HB2 ARG 44 HB2 ARG 44 -22.550 12.549 -5.634 387 HB3 ARG 44 HB1 ARG 44 -23.683 13.876 -5.401 388 HG2 ARG 44 HG2 ARG 44 -24.624 12.400 -3.510 389 HG3 ARG 44 HG1 ARG 44 -23.057 11.596 -3.601 390 HD2 ARG 44 HD2 ARG 44 -23.661 14.472 -2.962 391 HD3 ARG 44 HD1 ARG 44 -22.848 13.279 -1.954 392 HE ARG 44 HE ARG 44 -21.465 13.840 -4.409 393 HH11 ARG 44 HH11 ARG 44 -21.947 14.818 -1.090 394 HH12 ARG 44 HH12 ARG 44 -20.442 15.674 -0.984 395 HH21 ARG 44 HH21 ARG 44 -19.478 14.995 -4.293 396 HH22 ARG 44 HH22 ARG 44 -19.037 15.771 -2.801 397 H GLY 45 HN GLY 45 -23.340 10.827 -7.860 398 HA2 GLY 45 HA2 GLY 45 -22.934 11.087 -10.113 399 HA3 GLY 45 HA1 GLY 45 -24.170 12.345 -10.155 400 H ASP 46 HN ASP 46 -21.180 11.996 -8.299 401 HA ASP 46 HA ASP 46 -20.623 14.789 -8.434 402 HB2 ASP 46 HB2 ASP 46 -19.972 13.154 -6.582 403 HB3 ASP 46 HB1 ASP 46 -18.677 12.624 -7.648 404 H ALA 47 HN ALA 47 -19.899 12.103 -10.418 405 HA ALA 47 HA ALA 47 -17.497 13.006 -11.615 406 HB1 ALA 47 HB1 ALA 47 -17.922 11.315 -13.308 407 HB2 ALA 47 HB2 ALA 47 -19.581 11.139 -12.738 408 HB3 ALA 47 HB3 ALA 47 -18.237 10.673 -11.696 409 H LYS 48 HN LYS 48 -20.556 14.305 -11.778 410 HA LYS 48 HA LYS 48 -20.696 15.123 -14.477 411 HB2 LYS 48 HB2 LYS 48 -21.883 16.262 -11.953 412 HB3 LYS 48 HB1 LYS 48 -22.200 16.946 -13.540 413 HG2 LYS 48 HG2 LYS 48 -22.798 14.112 -12.725 414 HG3 LYS 48 HG1 LYS 48 -23.974 15.427 -12.797 415 HD2 LYS 48 HD2 LYS 48 -23.667 15.643 -15.168 416 HD3 LYS 48 HD1 LYS 48 -22.337 14.486 -15.146 417 HE2 LYS 48 HE2 LYS 48 -23.840 12.728 -14.473 418 HE3 LYS 48 HE1 LYS 48 -25.181 13.867 -14.398 419 HZ1 LYS 48 HZ1 LYS 48 -25.201 12.591 -16.448 420 HZ2 LYS 48 HZ2 LYS 48 -23.657 13.154 -16.844 421 HZ3 LYS 48 HZ3 LYS 48 -24.956 14.232 -16.773 422 H GLY 49 HN GLY 49 -18.719 16.155 -11.867 423 HA2 GLY 49 HA2 GLY 49 -16.714 17.339 -12.849 424 HA3 GLY 49 HA1 GLY 49 -17.886 18.492 -13.469 425 H THR 50 HN THR 50 -16.086 17.434 -10.727 426 HA THR 50 HA THR 50 -16.505 20.027 -9.515 427 HB THR 50 HB THR 50 -17.045 17.514 -7.911 428 HG1 THR 50 HG1 THR 50 -18.668 19.074 -9.416 429 HG21 THR 50 HG21 THR 50 -17.602 19.049 -6.093 430 HG22 THR 50 HG22 THR 50 -17.204 20.427 -7.118 431 HG23 THR 50 HG23 THR 50 -15.937 19.302 -6.624 432 H GLU 51 HN GLU 51 -14.330 20.336 -10.049 433 HA GLU 51 HA GLU 51 -12.479 18.928 -8.250 434 HB2 GLU 51 HB2 GLU 51 -12.177 18.223 -10.631 435 HB3 GLU 51 HB1 GLU 51 -11.806 19.891 -11.039 436 HG2 GLU 51 HG2 GLU 51 -9.858 19.834 -9.624 437 HG3 GLU 51 HG1 GLU 51 -10.260 18.199 -9.105 438 H LEU 52 HN LEU 52 -11.068 20.213 -7.148 439 HA LEU 52 HA LEU 52 -11.318 23.089 -7.605 440 HB2 LEU 52 HB2 LEU 52 -11.125 23.314 -5.091 441 HB3 LEU 52 HB1 LEU 52 -12.641 22.700 -5.699 442 HG LEU 52 HG LEU 52 -10.506 20.843 -4.658 443 HD11 LEU 52 HD11 LEU 52 -11.650 20.885 -2.505 444 HD12 LEU 52 HD12 LEU 52 -12.727 22.152 -3.092 445 HD13 LEU 52 HD13 LEU 52 -11.004 22.477 -2.906 446 HD21 LEU 52 HD21 LEU 52 -13.509 20.602 -4.926 447 HD22 LEU 52 HD22 LEU 52 -12.436 19.379 -4.245 448 HD23 LEU 52 HD23 LEU 52 -12.306 19.813 -5.948 449 H ASN 53 HN ASN 53 -9.437 23.069 -5.066 450 HA ASN 53 HA ASN 53 -7.097 23.488 -6.659 451 HB2 ASN 53 HB2 ASN 53 -7.575 24.835 -4.635 452 HB3 ASN 53 HB1 ASN 53 -7.331 23.404 -3.643 453 HD21 ASN 53 HD21 ASN 53 -5.834 25.896 -5.485 454 HD22 ASN 53 HD22 ASN 53 -4.203 25.542 -5.035 455 H GLY 84 HN GLY 84 35.604 -14.050 -11.120 456 HA2 GLY 84 HA2 GLY 84 33.409 -13.449 -11.424 457 HA3 GLY 84 HA1 GLY 84 33.063 -14.330 -9.945 458 HA PRO 85 HA PRO 85 33.883 -9.863 -8.548 459 HB2 PRO 85 HB2 PRO 85 34.603 -7.967 -10.254 460 HB3 PRO 85 HB1 PRO 85 35.766 -9.204 -9.753 461 HG2 PRO 85 HG2 PRO 85 34.185 -9.000 -12.281 462 HG3 PRO 85 HG1 PRO 85 35.879 -9.471 -12.056 463 HD2 PRO 85 HD2 PRO 85 33.750 -11.241 -12.356 464 HD3 PRO 85 HD1 PRO 85 35.326 -11.650 -11.652 465 H LEU 86 HN LEU 86 32.997 -7.481 -9.024 466 HA LEU 86 HA LEU 86 30.282 -7.527 -9.022 467 HB2 LEU 86 HB2 LEU 86 30.519 -5.038 -9.838 468 HB3 LEU 86 HB1 LEU 86 30.999 -5.531 -8.236 469 HG LEU 86 HG LEU 86 32.519 -3.892 -9.393 470 HD11 LEU 86 HD11 LEU 86 34.460 -4.702 -8.421 471 HD12 LEU 86 HD12 LEU 86 34.037 -6.380 -8.730 472 HD13 LEU 86 HD13 LEU 86 33.169 -5.470 -7.496 473 HD21 LEU 86 HD21 LEU 86 32.498 -4.812 -11.637 474 HD22 LEU 86 HD22 LEU 86 33.293 -6.278 -11.061 475 HD23 LEU 86 HD23 LEU 86 34.142 -4.733 -11.007 476 H GLY 87 HN GLY 87 28.860 -8.177 -10.464 477 HA2 GLY 87 HA2 GLY 87 29.419 -7.595 -13.300 478 HA3 GLY 87 HA1 GLY 87 28.400 -8.912 -12.734 479 H SER 88 HN SER 88 26.395 -8.254 -11.555 480 HA SER 88 HA SER 88 25.372 -5.723 -12.653 481 HB2 SER 88 HB2 SER 88 23.846 -8.247 -11.991 482 HB3 SER 88 HB1 SER 88 23.128 -6.747 -12.572 483 HG SER 88 HG SER 88 24.739 -8.604 -13.926 484 H ARG 89 HN ARG 89 25.459 -7.799 -9.803 485 HA ARG 89 HA ARG 89 23.673 -6.126 -8.309 486 HB2 ARG 89 HB2 ARG 89 23.889 -8.593 -7.966 487 HB3 ARG 89 HB1 ARG 89 25.483 -8.316 -7.283 488 HG2 ARG 89 HG2 ARG 89 23.929 -8.589 -5.494 489 HG3 ARG 89 HG1 ARG 89 24.429 -6.897 -5.538 490 HD2 ARG 89 HD2 ARG 89 22.373 -6.344 -6.771 491 HD3 ARG 89 HD1 ARG 89 21.874 -8.030 -6.668 492 HE ARG 89 HE ARG 89 22.397 -6.608 -4.171 493 HH11 ARG 89 HH11 ARG 89 20.090 -8.002 -6.408 494 HH12 ARG 89 HH12 ARG 89 18.764 -7.907 -5.295 495 HH21 ARG 89 HH21 ARG 89 20.653 -6.476 -2.707 496 HH22 ARG 89 HH22 ARG 89 19.088 -7.050 -3.180 497 H ARG 90 HN ARG 90 27.101 -6.506 -8.629 498 HA ARG 90 HA ARG 90 28.902 -5.323 -7.933 499 HB2 ARG 90 HB2 ARG 90 26.967 -3.018 -7.721 500 HB3 ARG 90 HB1 ARG 90 28.704 -2.921 -7.943 501 HG2 ARG 90 HG2 ARG 90 28.487 -3.946 -10.147 502 HG3 ARG 90 HG1 ARG 90 26.738 -4.041 -9.926 503 HD2 ARG 90 HD2 ARG 90 26.637 -1.603 -9.725 504 HD3 ARG 90 HD1 ARG 90 28.381 -1.512 -9.956 505 HE ARG 90 HE ARG 90 26.378 -2.179 -11.986 506 HH11 ARG 90 HH11 ARG 90 29.733 -1.686 -11.126 507 HH12 ARG 90 HH12 ARG 90 30.250 -1.405 -12.760 508 HH21 ARG 90 HH21 ARG 90 27.039 -1.806 -14.143 509 HH22 ARG 90 HH22 ARG 90 28.706 -1.475 -14.484 510 H PHE 91 HN PHE 91 27.366 -6.654 -5.892 511 HA PHE 91 HA PHE 91 26.947 -6.764 -3.670 512 HB2 PHE 91 HB2 PHE 91 29.393 -7.119 -3.830 513 HB3 PHE 91 HB1 PHE 91 29.644 -5.405 -3.534 514 HD1 PHE 91 HD1 PHE 91 27.814 -8.277 -1.996 515 HD2 PHE 91 HD2 PHE 91 30.180 -4.794 -1.388 516 HE1 PHE 91 HE1 PHE 91 27.822 -8.705 0.428 517 HE2 PHE 91 HE2 PHE 91 30.191 -5.217 1.034 518 HZ PHE 91 HZ PHE 91 29.012 -7.174 1.945 519 H VAL 92 HN VAL 92 28.828 -3.958 -2.886 520 HA VAL 92 HA VAL 92 26.457 -2.889 -1.581 521 HB VAL 92 HB VAL 92 28.580 -3.215 -0.305 522 HG11 VAL 92 HG11 VAL 92 29.580 -0.905 -1.962 523 HG12 VAL 92 HG12 VAL 92 30.157 -2.568 -2.043 524 HG13 VAL 92 HG13 VAL 92 30.402 -1.622 -0.576 525 HG21 VAL 92 HG21 VAL 92 26.886 -1.694 0.525 526 HG22 VAL 92 HG22 VAL 92 27.549 -0.384 -0.452 527 HG23 VAL 92 HG23 VAL 92 28.495 -1.060 0.874 528 H VAL 93 HN VAL 93 28.419 -2.255 -4.329 529 HA VAL 93 HA VAL 93 28.149 0.562 -4.413 530 HB VAL 93 HB VAL 93 28.614 -1.347 -6.692 531 HG11 VAL 93 HG11 VAL 93 29.070 1.628 -6.531 532 HG12 VAL 93 HG12 VAL 93 27.823 0.821 -7.482 533 HG13 VAL 93 HG13 VAL 93 29.526 0.589 -7.880 534 HG21 VAL 93 HG21 VAL 93 30.328 -1.554 -5.004 535 HG22 VAL 93 HG22 VAL 93 30.539 0.196 -4.966 536 HG23 VAL 93 HG23 VAL 93 30.980 -0.713 -6.410 537 H ASP 94 HN ASP 94 26.383 -2.012 -6.157 538 HA ASP 94 HA ASP 94 24.562 -0.142 -7.339 539 HB2 ASP 94 HB2 ASP 94 25.138 -2.748 -7.894 540 HB3 ASP 94 HB1 ASP 94 23.618 -2.905 -7.021 541 H ASP 95 HN ASP 95 24.276 -2.504 -4.669 542 HA ASP 95 HA ASP 95 21.543 -1.969 -4.172 543 HB2 ASP 95 HB2 ASP 95 23.024 -3.964 -3.390 544 HB3 ASP 95 HB1 ASP 95 23.403 -2.919 -2.026 545 H ARG 96 HN ARG 96 24.260 -0.094 -3.540 546 HA ARG 96 HA ARG 96 23.190 1.225 -1.193 547 HB2 ARG 96 HB2 ARG 96 25.663 0.984 -1.642 548 HB3 ARG 96 HB1 ARG 96 25.468 2.128 -2.961 549 HG2 ARG 96 HG2 ARG 96 24.762 3.845 -1.397 550 HG3 ARG 96 HG1 ARG 96 24.890 2.697 -0.061 551 HD2 ARG 96 HD2 ARG 96 27.292 2.407 -0.611 552 HD3 ARG 96 HD1 ARG 96 27.130 3.663 -1.833 553 HE ARG 96 HE ARG 96 26.231 4.725 0.579 554 HH11 ARG 96 HH11 ARG 96 29.202 3.554 -0.854 555 HH12 ARG 96 HH12 ARG 96 30.226 4.512 0.164 556 HH21 ARG 96 HH21 ARG 96 27.567 6.023 1.904 557 HH22 ARG 96 HH22 ARG 96 29.297 5.929 1.728 558 H ARG 97 HN ARG 97 24.048 2.252 -4.482 559 HA ARG 97 HA ARG 97 22.519 4.644 -4.357 560 HB2 ARG 97 HB2 ARG 97 24.478 4.336 -5.843 561 HB3 ARG 97 HB1 ARG 97 23.578 3.143 -6.766 562 HG2 ARG 97 HG2 ARG 97 22.466 5.888 -6.454 563 HG3 ARG 97 HG1 ARG 97 23.776 5.608 -7.597 564 HD2 ARG 97 HD2 ARG 97 22.465 4.094 -8.867 565 HD3 ARG 97 HD1 ARG 97 21.230 3.982 -7.606 566 HE ARG 97 HE ARG 97 21.307 6.637 -8.268 567 HH11 ARG 97 HH11 ARG 97 20.749 3.689 -10.112 568 HH12 ARG 97 HH12 ARG 97 19.749 4.499 -11.283 569 HH21 ARG 97 HH21 ARG 97 20.021 7.660 -9.810 570 HH22 ARG 97 HH22 ARG 97 19.339 6.741 -11.113 571 H GLU 98 HN GLU 98 22.027 1.539 -5.953 572 HA GLU 98 HA GLU 98 19.686 2.254 -7.319 573 HB2 GLU 98 HB2 GLU 98 20.934 -0.376 -6.586 574 HB3 GLU 98 HB1 GLU 98 19.448 -0.256 -7.546 575 HG2 GLU 98 HG2 GLU 98 22.075 0.999 -8.233 576 HG3 GLU 98 HG1 GLU 98 21.474 -0.515 -8.908 577 H LEU 99 HN LEU 99 20.160 0.420 -4.313 578 HA LEU 99 HA LEU 99 17.410 -0.216 -4.041 579 HB2 LEU 99 HB2 LEU 99 19.195 -1.592 -3.111 580 HB3 LEU 99 HB1 LEU 99 19.670 -0.286 -2.053 581 HG LEU 99 HG LEU 99 18.298 -2.298 -1.142 582 HD11 LEU 99 HD11 LEU 99 17.320 -0.816 0.550 583 HD12 LEU 99 HD12 LEU 99 17.696 0.573 -0.474 584 HD13 LEU 99 HD13 LEU 99 19.000 -0.428 0.178 585 HD21 LEU 99 HD21 LEU 99 16.094 -0.531 -2.198 586 HD22 LEU 99 HD22 LEU 99 15.891 -1.900 -1.105 587 HD23 LEU 99 HD23 LEU 99 16.469 -2.162 -2.750 588 H GLN 100 HN GLN 100 19.479 2.244 -2.443 589 HA GLN 100 HA GLN 100 17.409 3.278 -0.823 590 HB2 GLN 100 HB2 GLN 100 18.810 5.184 -0.436 591 HB3 GLN 100 HB1 GLN 100 19.854 3.778 -0.539 592 HG2 GLN 100 HG2 GLN 100 20.561 4.369 -2.740 593 HG3 GLN 100 HG1 GLN 100 19.380 5.671 -2.826 594 HE21 GLN 100 HE21 GLN 100 22.283 5.737 -3.113 595 HE22 GLN 100 HE22 GLN 100 22.863 6.851 -1.927 596 H TYR 101 HN TYR 101 18.330 3.781 -4.118 597 HA TYR 101 HA TYR 101 17.009 6.201 -4.638 598 HB2 TYR 101 HB2 TYR 101 18.754 4.969 -6.060 599 HB3 TYR 101 HB1 TYR 101 17.407 4.020 -6.679 600 HD1 TYR 101 HD1 TYR 101 18.761 7.446 -6.399 601 HD2 TYR 101 HD2 TYR 101 15.987 4.894 -8.371 602 HE1 TYR 101 HE1 TYR 101 18.329 9.207 -8.052 603 HE2 TYR 101 HE2 TYR 101 15.546 6.654 -10.034 604 HH TYR 101 HH TYR 101 15.728 9.129 -10.192 605 H ARG 102 HN ARG 102 15.887 2.854 -4.724 606 HA ARG 102 HA ARG 102 13.386 3.586 -5.950 607 HB2 ARG 102 HB2 ARG 102 12.746 1.268 -5.704 608 HB3 ARG 102 HB1 ARG 102 14.379 1.367 -6.343 609 HG2 ARG 102 HG2 ARG 102 15.298 0.812 -4.179 610 HG3 ARG 102 HG1 ARG 102 13.683 0.820 -3.466 611 HD2 ARG 102 HD2 ARG 102 14.629 -1.038 -5.646 612 HD3 ARG 102 HD1 ARG 102 14.465 -1.458 -3.941 613 HE ARG 102 HE ARG 102 12.085 -0.459 -5.284 614 HH11 ARG 102 HH11 ARG 102 13.887 -3.245 -4.174 615 HH12 ARG 102 HH12 ARG 102 12.501 -4.286 -4.138 616 HH21 ARG 102 HH21 ARG 102 10.259 -1.825 -5.238 617 HH22 ARG 102 HH22 ARG 102 10.439 -3.478 -4.744 618 H VAL 103 HN VAL 103 14.607 3.456 -2.744 619 HA VAL 103 HA VAL 103 12.065 3.138 -1.441 620 HB VAL 103 HB VAL 103 14.528 4.345 -0.208 621 HG11 VAL 103 HG11 VAL 103 13.682 3.275 1.838 622 HG12 VAL 103 HG12 VAL 103 12.239 2.791 0.944 623 HG13 VAL 103 HG13 VAL 103 12.592 4.502 1.184 624 HG21 VAL 103 HG21 VAL 103 15.201 2.089 0.471 625 HG22 VAL 103 HG22 VAL 103 15.246 2.294 -1.279 626 HG23 VAL 103 HG23 VAL 103 13.913 1.418 -0.525 627 H GLU 104 HN GLU 104 14.170 5.916 -2.217 628 HA GLU 104 HA GLU 104 12.480 7.857 -1.103 629 HB2 GLU 104 HB2 GLU 104 13.631 9.412 -2.835 630 HB3 GLU 104 HB1 GLU 104 14.555 8.729 -1.506 631 HG2 GLU 104 HG2 GLU 104 15.649 7.241 -2.858 632 HG3 GLU 104 HG1 GLU 104 14.447 7.343 -4.137 633 H VAL 105 HN VAL 105 12.545 6.555 -4.443 634 HA VAL 105 HA VAL 105 10.501 8.252 -5.381 635 HB VAL 105 HB VAL 105 11.296 7.210 -7.217 636 HG11 VAL 105 HG11 VAL 105 12.017 4.863 -7.348 637 HG12 VAL 105 HG12 VAL 105 11.557 4.656 -5.656 638 HG13 VAL 105 HG13 VAL 105 12.858 5.767 -6.089 639 HG21 VAL 105 HG21 VAL 105 9.846 5.414 -8.050 640 HG22 VAL 105 HG22 VAL 105 8.940 6.749 -7.338 641 HG23 VAL 105 HG23 VAL 105 9.159 5.249 -6.435 642 H GLN 106 HN GLN 106 10.366 5.161 -3.680 643 HA GLN 106 HA GLN 106 7.583 4.861 -3.727 644 HB2 GLN 106 HB2 GLN 106 9.683 3.983 -1.758 645 HB3 GLN 106 HB1 GLN 106 7.988 3.581 -1.546 646 HG2 GLN 106 HG2 GLN 106 9.661 2.866 -3.934 647 HG3 GLN 106 HG1 GLN 106 9.245 1.780 -2.611 648 HE21 GLN 106 HE21 GLN 106 8.035 3.511 -5.392 649 HE22 GLN 106 HE22 GLN 106 6.563 2.622 -5.544 650 H ASN 107 HN ASN 107 9.663 6.493 -1.330 651 HA ASN 107 HA ASN 107 7.714 7.572 0.330 652 HB2 ASN 107 HB2 ASN 107 9.976 7.859 0.959 653 HB3 ASN 107 HB1 ASN 107 10.378 8.666 -0.557 654 HD21 ASN 107 HD21 ASN 107 8.498 8.991 2.404 655 HD22 ASN 107 HD22 ASN 107 8.536 10.718 2.451 656 H ARG 108 HN ARG 108 9.041 8.933 -2.683 657 HA ARG 108 HA ARG 108 7.532 11.296 -2.733 658 HB2 ARG 108 HB2 ARG 108 8.714 9.667 -4.982 659 HB3 ARG 108 HB1 ARG 108 8.023 11.265 -5.191 660 HG2 ARG 108 HG2 ARG 108 9.704 12.238 -3.780 661 HG3 ARG 108 HG1 ARG 108 10.347 10.641 -3.389 662 HD2 ARG 108 HD2 ARG 108 11.694 11.795 -5.089 663 HD3 ARG 108 HD1 ARG 108 10.989 10.300 -5.701 664 HE ARG 108 HE ARG 108 9.350 12.569 -6.268 665 HH11 ARG 108 HH11 ARG 108 12.201 10.832 -7.325 666 HH12 ARG 108 HH12 ARG 108 12.087 11.387 -8.964 667 HH21 ARG 108 HH21 ARG 108 9.200 13.292 -8.437 668 HH22 ARG 108 HH22 ARG 108 10.384 12.782 -9.595 669 H VAL 109 HN VAL 109 6.983 8.258 -4.488 670 HA VAL 109 HA VAL 109 4.629 8.960 -5.791 671 HB VAL 109 HB VAL 109 5.496 6.227 -4.841 672 HG11 VAL 109 HG11 VAL 109 4.006 5.306 -6.491 673 HG12 VAL 109 HG12 VAL 109 3.534 6.921 -7.020 674 HG13 VAL 109 HG13 VAL 109 3.083 6.357 -5.410 675 HG21 VAL 109 HG21 VAL 109 5.943 7.691 -7.438 676 HG22 VAL 109 HG22 VAL 109 6.294 5.982 -7.181 677 HG23 VAL 109 HG23 VAL 109 7.170 7.208 -6.260 678 H TYR 110 HN TYR 110 5.071 7.297 -2.695 679 HA TYR 110 HA TYR 110 2.300 7.014 -2.198 680 HB2 TYR 110 HB2 TYR 110 4.696 6.855 -0.379 681 HB3 TYR 110 HB1 TYR 110 3.056 6.533 0.161 682 HD1 TYR 110 HD1 TYR 110 2.223 5.140 -2.505 683 HD2 TYR 110 HD2 TYR 110 5.520 4.660 0.142 684 HE1 TYR 110 HE1 TYR 110 2.425 2.792 -3.191 685 HE2 TYR 110 HE2 TYR 110 5.731 2.309 -0.544 686 HH TYR 110 HH TYR 110 4.232 1.032 -3.247 687 H LYS 111 HN LYS 111 4.641 9.526 -1.411 688 HA LYS 111 HA LYS 111 2.972 11.029 0.308 689 HB2 LYS 111 HB2 LYS 111 5.379 11.462 0.149 690 HB3 LYS 111 HB1 LYS 111 5.196 11.952 -1.528 691 HG2 LYS 111 HG2 LYS 111 5.424 13.912 -0.185 692 HG3 LYS 111 HG1 LYS 111 3.764 13.830 -0.771 693 HD2 LYS 111 HD2 LYS 111 3.065 12.893 1.399 694 HD3 LYS 111 HD1 LYS 111 4.726 13.042 1.981 695 HE2 LYS 111 HE2 LYS 111 4.606 15.480 1.557 696 HE3 LYS 111 HE1 LYS 111 2.916 15.287 1.099 697 HZ1 LYS 111 HZ1 LYS 111 4.066 14.660 3.765 698 HZ2 LYS 111 HZ2 LYS 111 2.442 14.477 3.326 699 HZ3 LYS 111 HZ3 LYS 111 3.131 16.016 3.384 700 H LYS 112 HN LYS 112 3.492 11.054 -3.172 701 HA LYS 112 HA LYS 112 1.810 13.167 -3.871 702 HB2 LYS 112 HB2 LYS 112 2.547 10.642 -5.354 703 HB3 LYS 112 HB1 LYS 112 1.638 11.958 -6.085 704 HG2 LYS 112 HG2 LYS 112 3.460 13.442 -5.927 705 HG3 LYS 112 HG1 LYS 112 4.330 12.377 -4.824 706 HD2 LYS 112 HD2 LYS 112 5.303 12.286 -7.051 707 HD3 LYS 112 HD1 LYS 112 4.588 10.734 -6.622 708 HE2 LYS 112 HE2 LYS 112 4.073 11.314 -8.924 709 HE3 LYS 112 HE1 LYS 112 2.607 11.285 -7.948 710 HZ1 LYS 112 HZ1 LYS 112 2.619 13.665 -7.846 711 HZ2 LYS 112 HZ2 LYS 112 2.738 13.202 -9.466 712 HZ3 LYS 112 HZ3 LYS 112 4.107 13.751 -8.645 713 H GLU 113 HN GLU 113 1.085 9.775 -3.207 714 HA GLU 113 HA GLU 113 -1.628 9.826 -3.960 715 HB2 GLU 113 HB2 GLU 113 -0.405 8.189 -1.731 716 HB3 GLU 113 HB1 GLU 113 -1.923 7.866 -2.552 717 HG2 GLU 113 HG2 GLU 113 -0.327 7.805 -4.668 718 HG3 GLU 113 HG1 GLU 113 0.860 7.391 -3.430 719 H ILE 114 HN ILE 114 -0.045 10.384 -0.834 720 HA ILE 114 HA ILE 114 -2.349 10.845 0.665 721 HB ILE 114 HB ILE 114 0.442 11.898 1.078 722 HG12 ILE 114 HG12 ILE 114 -0.995 9.494 2.207 723 HG13 ILE 114 HG11 ILE 114 0.216 9.446 0.931 724 HG21 ILE 114 HG21 ILE 114 -1.873 11.728 3.004 725 HG22 ILE 114 HG22 ILE 114 -1.140 13.205 2.373 726 HG23 ILE 114 HG23 ILE 114 -0.214 12.145 3.436 727 HD11 ILE 114 HD11 ILE 114 1.105 8.823 3.114 728 HD12 ILE 114 HD12 ILE 114 0.696 10.427 3.727 729 HD13 ILE 114 HD13 ILE 114 1.893 10.248 2.442 730 H GLN 115 HN GLN 115 -0.392 13.122 -1.234 731 HA GLN 115 HA GLN 115 -1.681 15.458 -0.302 732 HB2 GLN 115 HB2 GLN 115 -0.431 15.038 -3.019 733 HB3 GLN 115 HB1 GLN 115 -0.712 16.573 -2.211 734 HG2 GLN 115 HG2 GLN 115 0.817 15.701 -0.376 735 HG3 GLN 115 HG1 GLN 115 1.259 14.439 -1.528 736 HE21 GLN 115 HE21 GLN 115 1.397 17.838 -0.810 737 HE22 GLN 115 HE22 GLN 115 2.627 18.237 -1.961 738 H ALA 116 HN ALA 116 -2.218 13.401 -3.119 739 HA ALA 116 HA ALA 116 -4.499 14.699 -4.136 740 HB1 ALA 116 HB1 ALA 116 -3.249 12.969 -5.358 741 HB2 ALA 116 HB2 ALA 116 -4.971 12.595 -5.270 742 HB3 ALA 116 HB3 ALA 116 -3.832 11.758 -4.215 743 H LEU 117 HN LEU 117 -4.104 12.092 -1.825 744 HA LEU 117 HA LEU 117 -6.782 11.561 -1.243 745 HB2 LEU 117 HB2 LEU 117 -4.156 11.041 -0.046 746 HB3 LEU 117 HB1 LEU 117 -5.469 11.071 1.110 747 HG LEU 117 HG LEU 117 -6.465 9.164 0.230 748 HD11 LEU 117 HD11 LEU 117 -4.888 9.578 -2.306 749 HD12 LEU 117 HD12 LEU 117 -6.621 9.825 -2.095 750 HD13 LEU 117 HD13 LEU 117 -5.940 8.204 -1.967 751 HD21 LEU 117 HD21 LEU 117 -3.536 8.756 -0.343 752 HD22 LEU 117 HD22 LEU 117 -4.725 7.505 0.029 753 HD23 LEU 117 HD23 LEU 117 -4.277 8.690 1.258 754 H ASP 118 HN ASP 118 -4.636 14.087 -0.089 755 HA ASP 118 HA ASP 118 -6.087 14.758 2.243 756 HB2 ASP 118 HB2 ASP 118 -3.742 15.467 1.813 757 HB3 ASP 118 HB1 ASP 118 -4.335 16.592 0.596 758 H ALA 119 HN ALA 119 -6.399 15.763 -1.105 759 HA ALA 119 HA ALA 119 -8.356 17.768 -0.702 760 HB1 ALA 119 HB1 ALA 119 -7.148 17.450 -2.826 761 HB2 ALA 119 HB2 ALA 119 -8.899 17.460 -3.049 762 HB3 ALA 119 HB3 ALA 119 -8.014 15.934 -3.074 763 H GLU 120 HN GLU 120 -8.542 14.296 -1.323 764 HA GLU 120 HA GLU 120 -11.321 14.074 -1.157 765 HB2 GLU 120 HB2 GLU 120 -9.006 12.240 -1.053 766 HB3 GLU 120 HB1 GLU 120 -10.499 11.660 -0.358 767 HG2 GLU 120 HG2 GLU 120 -10.061 11.063 -2.760 768 HG3 GLU 120 HG1 GLU 120 -11.632 11.749 -2.377 769 H ILE 121 HN ILE 121 -8.820 14.172 1.295 770 HA ILE 121 HA ILE 121 -10.262 13.365 3.515 771 HB ILE 121 HB ILE 121 -7.921 15.076 3.064 772 HG12 ILE 121 HG12 ILE 121 -7.058 13.769 4.975 773 HG13 ILE 121 HG11 ILE 121 -8.652 13.050 5.183 774 HG21 ILE 121 HG21 ILE 121 -7.862 16.039 5.298 775 HG22 ILE 121 HG22 ILE 121 -9.486 15.429 5.609 776 HG23 ILE 121 HG23 ILE 121 -9.229 16.653 4.368 777 HD11 ILE 121 HD11 ILE 121 -7.087 11.583 4.006 778 HD12 ILE 121 HD12 ILE 121 -6.940 12.783 2.726 779 HD13 ILE 121 HD13 ILE 121 -8.489 11.995 3.022 780 H ARG 122 HN ARG 122 -10.484 16.325 1.664 781 HA ARG 122 HA ARG 122 -12.039 17.783 3.526 782 HB2 ARG 122 HB2 ARG 122 -10.869 18.826 1.625 783 HB3 ARG 122 HB1 ARG 122 -11.971 18.024 0.516 784 HG2 ARG 122 HG2 ARG 122 -13.773 19.344 1.158 785 HG3 ARG 122 HG1 ARG 122 -12.988 19.851 2.656 786 HD2 ARG 122 HD2 ARG 122 -12.126 20.610 -0.135 787 HD3 ARG 122 HD1 ARG 122 -12.997 21.652 0.993 788 HE ARG 122 HE ARG 122 -10.716 20.793 2.308 789 HH11 ARG 122 HH11 ARG 122 -11.500 22.715 -0.507 790 HH12 ARG 122 HH12 ARG 122 -10.041 23.647 -0.436 791 HH21 ARG 122 HH21 ARG 122 -8.796 22.020 2.416 792 HH22 ARG 122 HH22 ARG 122 -8.499 23.252 1.231 793 H LYS 123 HN LYS 123 -12.930 15.606 0.845 794 HA LYS 123 HA LYS 123 -15.742 15.905 1.215 795 HB2 LYS 123 HB2 LYS 123 -16.028 14.133 -0.296 796 HB3 LYS 123 HB1 LYS 123 -14.514 14.858 -0.797 797 HG2 LYS 123 HG2 LYS 123 -13.572 13.001 0.882 798 HG3 LYS 123 HG1 LYS 123 -15.045 12.197 0.356 799 HD2 LYS 123 HD2 LYS 123 -12.880 13.287 -1.430 800 HD3 LYS 123 HD1 LYS 123 -13.138 11.591 -1.043 801 HE2 LYS 123 HE2 LYS 123 -15.055 11.472 -2.306 802 HE3 LYS 123 HE1 LYS 123 -15.312 13.218 -2.284 803 HZ1 LYS 123 HZ1 LYS 123 -13.103 13.269 -3.603 804 HZ2 LYS 123 HZ2 LYS 123 -14.526 12.839 -4.409 805 HZ3 LYS 123 HZ3 LYS 123 -13.437 11.638 -3.928 806 H LEU 124 HN LEU 124 -13.318 13.786 2.577 807 HA LEU 124 HA LEU 124 -14.998 12.109 4.060 808 HB2 LEU 124 HB2 LEU 124 -12.147 12.986 4.415 809 HB3 LEU 124 HB1 LEU 124 -12.910 11.855 5.514 810 HG LEU 124 HG LEU 124 -12.531 11.418 2.542 811 HD11 LEU 124 HD11 LEU 124 -10.928 9.686 3.297 812 HD12 LEU 124 HD12 LEU 124 -11.104 10.277 4.948 813 HD13 LEU 124 HD13 LEU 124 -10.414 11.320 3.706 814 HD21 LEU 124 HD21 LEU 124 -13.277 9.148 3.034 815 HD22 LEU 124 HD22 LEU 124 -14.522 10.341 3.398 816 HD23 LEU 124 HD23 LEU 124 -13.592 9.613 4.706 817 H GLU 125 HN GLU 125 -13.268 15.079 5.011 818 HA GLU 125 HA GLU 125 -14.060 15.143 7.663 819 HB2 GLU 125 HB2 GLU 125 -13.415 17.417 5.796 820 HB3 GLU 125 HB1 GLU 125 -13.667 17.623 7.524 821 HG2 GLU 125 HG2 GLU 125 -11.819 16.004 7.913 822 HG3 GLU 125 HG1 GLU 125 -11.515 16.016 6.180 823 H ARG 126 HN ARG 126 -15.804 16.125 4.803 824 HA ARG 126 HA ARG 126 -17.926 17.510 5.953 825 HB2 ARG 126 HB2 ARG 126 -17.961 15.562 3.640 826 HB3 ARG 126 HB1 ARG 126 -19.272 16.661 4.038 827 HG2 ARG 126 HG2 ARG 126 -16.502 17.643 3.439 828 HG3 ARG 126 HG1 ARG 126 -17.689 17.341 2.171 829 HD2 ARG 126 HD2 ARG 126 -17.762 19.666 2.733 830 HD3 ARG 126 HD1 ARG 126 -19.235 18.905 3.323 831 HE ARG 126 HE ARG 126 -17.074 19.170 5.248 832 HH11 ARG 126 HH11 ARG 126 -20.040 20.476 3.941 833 HH12 ARG 126 HH12 ARG 126 -20.367 21.471 5.321 834 HH21 ARG 126 HH21 ARG 126 -17.490 20.490 7.082 835 HH22 ARG 126 HH22 ARG 126 -18.914 21.492 7.099 836 H LEU 127 HN LEU 127 -17.520 14.012 5.453 837 HA LEU 127 HA LEU 127 -19.920 13.317 6.811 838 HB2 LEU 127 HB2 LEU 127 -17.566 11.821 5.792 839 HB3 LEU 127 HB1 LEU 127 -18.587 11.034 6.979 840 HG LEU 127 HG LEU 127 -20.534 11.345 5.509 841 HD11 LEU 127 HD11 LEU 127 -20.206 12.055 3.190 842 HD12 LEU 127 HD12 LEU 127 -18.528 12.457 3.559 843 HD13 LEU 127 HD13 LEU 127 -19.837 13.344 4.338 844 HD21 LEU 127 HD21 LEU 127 -19.890 9.706 3.816 845 HD22 LEU 127 HD22 LEU 127 -19.267 9.276 5.408 846 HD23 LEU 127 HD23 LEU 127 -18.191 9.979 4.201 847 H LEU 128 HN LEU 128 -16.478 13.260 7.863 848 HA LEU 128 HA LEU 128 -16.717 12.511 10.460 849 HB2 LEU 128 HB2 LEU 128 -15.059 14.615 9.137 850 HB3 LEU 128 HB1 LEU 128 -14.964 14.389 10.869 851 HG LEU 128 HG LEU 128 -14.363 12.011 10.446 852 HD11 LEU 128 HD11 LEU 128 -13.526 11.355 8.277 853 HD12 LEU 128 HD12 LEU 128 -14.049 12.899 7.605 854 HD13 LEU 128 HD13 LEU 128 -15.244 11.751 8.210 855 HD21 LEU 128 HD21 LEU 128 -12.039 12.534 9.805 856 HD22 LEU 128 HD22 LEU 128 -12.687 13.649 11.008 857 HD23 LEU 128 HD23 LEU 128 -12.575 14.144 9.320 858 H GLU 129 HN GLU 129 -16.986 15.886 9.365 859 HA GLU 129 HA GLU 129 -17.927 16.963 11.763 860 HB2 GLU 129 HB2 GLU 129 -18.417 17.847 8.919 861 HB3 GLU 129 HB1 GLU 129 -18.809 18.815 10.333 862 HG2 GLU 129 HG2 GLU 129 -16.426 18.744 10.982 863 HG3 GLU 129 HG1 GLU 129 -16.077 17.896 9.478 864 H SER 130 HN SER 130 -19.610 15.182 9.320 865 HA SER 130 HA SER 130 -22.246 15.908 10.205 866 HB2 SER 130 HB2 SER 130 -21.742 15.226 7.861 867 HB3 SER 130 HB1 SER 130 -21.390 13.601 8.441 868 HG SER 130 HG SER 130 -23.828 14.907 8.148 869 H GLY 131 HN GLY 131 -19.846 13.761 11.288 870 HA2 GLY 131 HA2 GLY 131 -20.200 12.848 13.519 871 HA3 GLY 131 HA1 GLY 131 -21.833 12.450 13.031 872 H LEU 132 HN LEU 132 -19.183 11.844 10.842 873 HA LEU 132 HA LEU 132 -19.815 9.064 10.751 874 HB2 LEU 132 HB2 LEU 132 -19.096 10.222 8.765 875 HB3 LEU 132 HB1 LEU 132 -17.580 10.666 9.522 876 HG LEU 132 HG LEU 132 -17.079 8.176 9.657 877 HD11 LEU 132 HD11 LEU 132 -19.344 8.064 7.673 878 HD12 LEU 132 HD12 LEU 132 -19.352 7.368 9.292 879 HD13 LEU 132 HD13 LEU 132 -18.244 6.745 8.071 880 HD21 LEU 132 HD21 LEU 132 -16.266 8.118 7.372 881 HD22 LEU 132 HD22 LEU 132 -16.031 9.719 8.078 882 HD23 LEU 132 HD23 LEU 132 -17.348 9.442 6.941 883 H THR 133 HN THR 133 -17.086 10.926 12.040 884 HA THR 133 HA THR 133 -16.105 8.457 13.307 885 HB THR 133 HB THR 133 -14.397 10.816 12.487 886 HG1 THR 133 HG1 THR 133 -14.885 8.328 11.173 887 HG21 THR 133 HG21 THR 133 -12.537 9.267 12.856 888 HG22 THR 133 HG22 THR 133 -13.673 8.005 13.332 889 HG23 THR 133 HG23 THR 133 -13.496 9.452 14.325 Start of MODEL 13 1 H1 MET 1 HT1 MET 1 28.991 -3.806 9.777 2 H2 MET 1 HT2 MET 1 28.632 -2.478 10.754 3 H3 MET 1 HT3 MET 1 30.233 -2.784 10.303 4 HA MET 1 HA MET 1 29.692 -2.382 7.994 5 HB2 MET 1 HB2 MET 1 27.356 -3.036 8.043 6 HB3 MET 1 HB1 MET 1 26.974 -1.711 9.128 7 HG2 MET 1 HG2 MET 1 27.693 -0.139 7.316 8 HG3 MET 1 HG1 MET 1 27.805 -1.536 6.247 9 HE1 MET 1 HE1 MET 1 24.540 0.333 5.071 10 HE2 MET 1 HE2 MET 1 26.107 -0.296 4.565 11 HE3 MET 1 HE3 MET 1 26.023 1.063 5.684 12 H ASP 2 HN ASP 2 29.181 -0.720 11.012 13 HA ASP 2 HA ASP 2 29.683 1.855 9.700 14 HB2 ASP 2 HB2 ASP 2 28.807 2.907 11.736 15 HB3 ASP 2 HB1 ASP 2 27.646 1.781 11.047 16 H SER 3 HN SER 3 31.927 0.401 9.794 17 HA SER 3 HA SER 3 33.432 1.150 12.169 18 HB2 SER 3 HB2 SER 3 34.364 -0.259 9.655 19 HB3 SER 3 HB1 SER 3 35.270 -0.104 11.159 20 HG SER 3 HG SER 3 33.240 -1.165 12.070 21 H ALA 4 HN ALA 4 33.644 1.716 8.662 22 HA ALA 4 HA ALA 4 35.108 4.206 9.193 23 HB1 ALA 4 HB1 ALA 4 34.662 2.759 6.578 24 HB2 ALA 4 HB2 ALA 4 36.126 2.685 7.558 25 HB3 ALA 4 HB3 ALA 4 35.642 4.206 6.810 26 H ILE 5 HN ILE 5 32.303 2.859 7.578 27 HA ILE 5 HA ILE 5 31.077 5.316 6.863 28 HB ILE 5 HB ILE 5 29.816 2.619 7.436 29 HG12 ILE 5 HG12 ILE 5 30.661 3.834 4.795 30 HG13 ILE 5 HG11 ILE 5 31.544 2.576 5.652 31 HG21 ILE 5 HG21 ILE 5 27.947 3.412 6.073 32 HG22 ILE 5 HG22 ILE 5 28.728 4.986 5.918 33 HG23 ILE 5 HG23 ILE 5 28.183 4.423 7.499 34 HD11 ILE 5 HD11 ILE 5 30.213 1.660 3.836 35 HD12 ILE 5 HD12 ILE 5 28.751 2.329 4.561 36 HD13 ILE 5 HD13 ILE 5 29.653 1.066 5.399 37 H SER 6 HN SER 6 29.571 6.557 8.033 38 HA SER 6 HA SER 6 29.631 6.075 10.913 39 HB2 SER 6 HB2 SER 6 30.332 8.304 10.113 40 HB3 SER 6 HB1 SER 6 28.757 8.528 9.351 41 HG SER 6 HG SER 6 29.454 9.081 11.840 42 H LYS 7 HN LYS 7 27.577 6.604 12.113 43 HA LYS 7 HA LYS 7 25.344 5.167 11.245 44 HB2 LYS 7 HB2 LYS 7 25.815 5.852 13.596 45 HB3 LYS 7 HB1 LYS 7 25.412 7.505 13.162 46 HG2 LYS 7 HG2 LYS 7 23.145 6.781 12.578 47 HG3 LYS 7 HG1 LYS 7 23.559 5.143 13.080 48 HD2 LYS 7 HD2 LYS 7 23.869 7.469 14.947 49 HD3 LYS 7 HD1 LYS 7 22.313 6.672 14.740 50 HE2 LYS 7 HE2 LYS 7 23.446 5.749 16.656 51 HE3 LYS 7 HE1 LYS 7 23.345 4.533 15.387 52 HZ1 LYS 7 HZ1 LYS 7 25.625 4.823 14.879 53 HZ2 LYS 7 HZ2 LYS 7 25.524 4.673 16.558 54 HZ3 LYS 7 HZ3 LYS 7 25.756 6.196 15.858 55 H GLU 8 HN GLU 8 26.476 8.332 10.590 56 HA GLU 8 HA GLU 8 24.349 9.786 9.735 57 HB2 GLU 8 HB2 GLU 8 26.599 10.620 9.865 58 HB3 GLU 8 HB1 GLU 8 27.146 9.473 8.645 59 HG2 GLU 8 HG2 GLU 8 26.971 11.681 7.746 60 HG3 GLU 8 HG1 GLU 8 25.810 10.602 6.981 61 H ASP 9 HN ASP 9 26.316 7.595 7.729 62 HA ASP 9 HA ASP 9 24.782 7.930 5.383 63 HB2 ASP 9 HB2 ASP 9 27.152 7.132 5.478 64 HB3 ASP 9 HB1 ASP 9 26.566 5.601 6.115 65 H GLU 10 HN GLU 10 24.671 5.632 8.015 66 HA GLU 10 HA GLU 10 22.864 3.800 6.834 67 HB2 GLU 10 HB2 GLU 10 24.182 3.048 8.675 68 HB3 GLU 10 HB1 GLU 10 23.640 4.374 9.692 69 HG2 GLU 10 HG2 GLU 10 21.391 3.434 9.727 70 HG3 GLU 10 HG1 GLU 10 21.930 2.105 8.705 71 H GLU 11 HN GLU 11 22.370 6.312 9.301 72 HA GLU 11 HA GLU 11 19.650 6.120 9.582 73 HB2 GLU 11 HB2 GLU 11 21.529 8.442 9.833 74 HB3 GLU 11 HB1 GLU 11 19.812 8.602 10.181 75 HG2 GLU 11 HG2 GLU 11 21.563 6.546 11.478 76 HG3 GLU 11 HG1 GLU 11 21.296 8.151 12.152 77 H ARG 12 HN ARG 12 21.455 7.811 7.067 78 HA ARG 12 HA ARG 12 19.282 9.286 6.037 79 HB2 ARG 12 HB2 ARG 12 21.764 8.261 4.655 80 HB3 ARG 12 HB1 ARG 12 20.615 9.368 3.917 81 HG2 ARG 12 HG2 ARG 12 22.247 9.894 6.393 82 HG3 ARG 12 HG1 ARG 12 22.537 10.564 4.787 83 HD2 ARG 12 HD2 ARG 12 20.397 11.724 4.867 84 HD3 ARG 12 HD1 ARG 12 20.057 11.019 6.445 85 HE ARG 12 HE ARG 12 22.441 12.311 6.785 86 HH11 ARG 12 HH11 ARG 12 19.241 13.256 5.704 87 HH12 ARG 12 HH12 ARG 12 19.404 14.895 6.248 88 HH21 ARG 12 HH21 ARG 12 22.644 14.475 7.502 89 HH22 ARG 12 HH22 ARG 12 21.339 15.591 7.254 90 H TYR 13 HN TYR 13 20.404 6.001 5.432 91 HA TYR 13 HA TYR 13 18.410 5.525 3.414 92 HB2 TYR 13 HB2 TYR 13 20.418 4.253 3.222 93 HB3 TYR 13 HB1 TYR 13 20.321 3.721 4.897 94 HD1 TYR 13 HD1 TYR 13 19.866 1.488 5.086 95 HD2 TYR 13 HD2 TYR 13 17.988 3.690 1.973 96 HE1 TYR 13 HE1 TYR 13 18.643 -0.533 4.404 97 HE2 TYR 13 HE2 TYR 13 16.751 1.680 1.281 98 HH TYR 13 HH TYR 13 16.992 -0.793 1.470 99 H GLN 14 HN GLN 14 18.896 4.565 6.796 100 HA GLN 14 HA GLN 14 16.654 2.973 7.171 101 HB2 GLN 14 HB2 GLN 14 17.962 4.881 9.115 102 HB3 GLN 14 HB1 GLN 14 16.808 3.638 9.565 103 HG2 GLN 14 HG2 GLN 14 19.492 3.166 8.296 104 HG3 GLN 14 HG1 GLN 14 19.109 2.978 10.004 105 HE21 GLN 14 HE21 GLN 14 17.849 1.226 10.667 106 HE22 GLN 14 HE22 GLN 14 17.590 -0.149 9.645 107 H LYS 15 HN LYS 15 16.947 6.429 7.931 108 HA LYS 15 HA LYS 15 14.302 6.851 8.610 109 HB2 LYS 15 HB2 LYS 15 16.313 8.762 7.441 110 HB3 LYS 15 HB1 LYS 15 14.729 9.260 8.026 111 HG2 LYS 15 HG2 LYS 15 16.785 7.842 9.704 112 HG3 LYS 15 HG1 LYS 15 16.559 9.592 9.663 113 HD2 LYS 15 HD2 LYS 15 14.453 9.463 10.663 114 HD3 LYS 15 HD1 LYS 15 14.271 7.752 10.277 115 HE2 LYS 15 HE2 LYS 15 15.978 7.173 11.875 116 HE3 LYS 15 HE1 LYS 15 16.278 8.876 12.217 117 HZ1 LYS 15 HZ1 LYS 15 13.723 7.455 12.732 118 HZ2 LYS 15 HZ2 LYS 15 14.056 9.068 13.108 119 HZ3 LYS 15 HZ3 LYS 15 14.884 7.829 13.903 120 H LEU 16 HN LEU 16 15.779 6.695 5.440 121 HA LEU 16 HA LEU 16 13.628 7.861 4.013 122 HB2 LEU 16 HB2 LEU 16 15.978 7.539 3.175 123 HB3 LEU 16 HB1 LEU 16 15.602 5.839 2.972 124 HG LEU 16 HG LEU 16 14.064 6.273 1.215 125 HD11 LEU 16 HD11 LEU 16 12.806 8.081 2.078 126 HD12 LEU 16 HD12 LEU 16 13.542 8.663 0.583 127 HD13 LEU 16 HD13 LEU 16 14.220 9.134 2.137 128 HD21 LEU 16 HD21 LEU 16 16.419 6.441 0.599 129 HD22 LEU 16 HD22 LEU 16 16.382 8.176 0.916 130 HD23 LEU 16 HD23 LEU 16 15.413 7.497 -0.396 131 H VAL 17 HN VAL 17 14.523 4.472 4.613 132 HA VAL 17 HA VAL 17 12.220 3.348 3.415 133 HB VAL 17 HB VAL 17 12.896 1.306 4.214 134 HG11 VAL 17 HG11 VAL 17 14.761 2.303 3.036 135 HG12 VAL 17 HG12 VAL 17 15.336 1.231 4.317 136 HG13 VAL 17 HG13 VAL 17 15.367 2.981 4.550 137 HG21 VAL 17 HG21 VAL 17 13.974 2.630 6.703 138 HG22 VAL 17 HG22 VAL 17 14.019 0.898 6.364 139 HG23 VAL 17 HG23 VAL 17 12.468 1.720 6.571 140 H THR 18 HN THR 18 12.887 4.699 6.542 141 HA THR 18 HA THR 18 10.606 3.899 7.928 142 HB THR 18 HB THR 18 12.530 6.187 8.101 143 HG1 THR 18 HG1 THR 18 13.002 4.016 8.909 144 HG21 THR 18 HG21 THR 18 11.429 6.905 10.172 145 HG22 THR 18 HG22 THR 18 10.088 5.820 9.800 146 HG23 THR 18 HG23 THR 18 10.458 7.170 8.729 147 H GLU 19 HN GLU 19 11.316 6.896 6.133 148 HA GLU 19 HA GLU 19 8.831 8.104 6.249 149 HB2 GLU 19 HB2 GLU 19 10.809 8.108 3.961 150 HB3 GLU 19 HB1 GLU 19 9.468 9.233 4.130 151 HG2 GLU 19 HG2 GLU 19 10.440 10.033 6.246 152 HG3 GLU 19 HG1 GLU 19 11.810 8.948 6.005 153 H ASN 20 HN ASN 20 10.020 5.600 4.099 154 HA ASN 20 HA ASN 20 7.824 5.434 2.364 155 HB2 ASN 20 HB2 ASN 20 9.974 3.546 3.218 156 HB3 ASN 20 HB1 ASN 20 8.602 2.900 2.323 157 HD21 ASN 20 HD21 ASN 20 10.069 6.071 1.913 158 HD22 ASN 20 HD22 ASN 20 10.656 5.786 0.311 159 H GLU 21 HN GLU 21 8.537 3.368 5.209 160 HA GLU 21 HA GLU 21 6.168 1.909 5.018 161 HB2 GLU 21 HB2 GLU 21 7.764 2.483 7.524 162 HB3 GLU 21 HB1 GLU 21 6.683 1.119 7.261 163 HG2 GLU 21 HG2 GLU 21 8.975 1.555 5.422 164 HG3 GLU 21 HG1 GLU 21 9.255 0.840 7.004 165 H GLN 22 HN GLN 22 6.856 4.930 6.697 166 HA GLN 22 HA GLN 22 4.610 5.120 8.342 167 HB2 GLN 22 HB2 GLN 22 5.993 7.363 6.862 168 HB3 GLN 22 HB1 GLN 22 4.912 7.556 8.231 169 HG2 GLN 22 HG2 GLN 22 6.468 6.418 9.684 170 HG3 GLN 22 HG1 GLN 22 7.541 6.098 8.322 171 HE21 GLN 22 HE21 GLN 22 8.010 7.587 10.801 172 HE22 GLN 22 HE22 GLN 22 8.526 9.163 10.306 173 H LEU 23 HN LEU 23 5.033 6.510 5.084 174 HA LEU 23 HA LEU 23 2.338 7.469 5.203 175 HB2 LEU 23 HB2 LEU 23 2.883 8.910 3.550 176 HB3 LEU 23 HB1 LEU 23 4.451 8.628 4.255 177 HG LEU 23 HG LEU 23 3.401 7.497 1.669 178 HD11 LEU 23 HD11 LEU 23 5.225 8.823 0.710 179 HD12 LEU 23 HD12 LEU 23 5.612 9.436 2.318 180 HD13 LEU 23 HD13 LEU 23 4.062 9.827 1.574 181 HD21 LEU 23 HD21 LEU 23 6.044 7.006 3.021 182 HD22 LEU 23 HD22 LEU 23 5.639 6.548 1.367 183 HD23 LEU 23 HD23 LEU 23 4.779 5.809 2.721 184 H GLN 24 HN GLN 24 3.918 4.732 3.795 185 HA GLN 24 HA GLN 24 2.001 3.866 1.979 186 HB2 GLN 24 HB2 GLN 24 3.353 2.170 4.058 187 HB3 GLN 24 HB1 GLN 24 2.594 1.574 2.599 188 HG2 GLN 24 HG2 GLN 24 4.356 3.086 1.430 189 HG3 GLN 24 HG1 GLN 24 5.182 2.987 2.969 190 HE21 GLN 24 HE21 GLN 24 4.108 0.287 3.439 191 HE22 GLN 24 HE22 GLN 24 5.082 -0.759 2.468 192 H ARG 25 HN ARG 25 2.089 3.645 5.478 193 HA ARG 25 HA ARG 25 -0.365 2.316 5.848 194 HB2 ARG 25 HB2 ARG 25 0.950 2.154 7.716 195 HB3 ARG 25 HB1 ARG 25 1.653 3.749 7.486 196 HG2 ARG 25 HG2 ARG 25 -0.691 4.586 8.130 197 HG3 ARG 25 HG1 ARG 25 -0.889 2.981 8.838 198 HD2 ARG 25 HD2 ARG 25 1.321 3.420 10.029 199 HD3 ARG 25 HD1 ARG 25 1.140 5.103 9.516 200 HE ARG 25 HE ARG 25 -0.959 3.775 11.104 201 HH11 ARG 25 HH11 ARG 25 1.411 6.329 10.725 202 HH12 ARG 25 HH12 ARG 25 0.835 7.229 12.089 203 HH21 ARG 25 HH21 ARG 25 -1.701 4.956 12.901 204 HH22 ARG 25 HH22 ARG 25 -0.917 6.442 13.336 205 H LEU 26 HN LEU 26 0.636 5.707 5.936 206 HA LEU 26 HA LEU 26 -1.756 6.832 6.817 207 HB2 LEU 26 HB2 LEU 26 0.369 8.011 5.028 208 HB3 LEU 26 HB1 LEU 26 -0.866 8.938 5.866 209 HG LEU 26 HG LEU 26 1.221 7.235 7.238 210 HD11 LEU 26 HD11 LEU 26 1.102 10.231 6.993 211 HD12 LEU 26 HD12 LEU 26 2.210 9.178 6.116 212 HD13 LEU 26 HD13 LEU 26 2.302 9.283 7.872 213 HD21 LEU 26 HD21 LEU 26 -0.808 9.182 8.323 214 HD22 LEU 26 HD22 LEU 26 0.472 8.419 9.264 215 HD23 LEU 26 HD23 LEU 26 -0.801 7.433 8.547 216 H ILE 27 HN ILE 27 -0.660 6.091 3.543 217 HA ILE 27 HA ILE 27 -2.853 7.112 2.127 218 HB ILE 27 HB ILE 27 -1.169 4.669 1.545 219 HG12 ILE 27 HG12 ILE 27 -1.013 7.463 0.404 220 HG13 ILE 27 HG11 ILE 27 0.034 6.849 1.689 221 HG21 ILE 27 HG21 ILE 27 -3.278 4.540 0.341 222 HG22 ILE 27 HG22 ILE 27 -1.949 4.876 -0.769 223 HG23 ILE 27 HG23 ILE 27 -3.039 6.171 -0.282 224 HD11 ILE 27 HD11 ILE 27 1.107 6.780 -0.505 225 HD12 ILE 27 HD12 ILE 27 -0.170 5.716 -1.092 226 HD13 ILE 27 HD13 ILE 27 0.914 5.169 0.188 227 H THR 28 HN THR 28 -2.258 3.813 3.291 228 HA THR 28 HA THR 28 -4.670 2.672 2.575 229 HB THR 28 HB THR 28 -2.379 1.865 3.948 230 HG1 THR 28 HG1 THR 28 -4.457 0.027 3.746 231 HG21 THR 28 HG21 THR 28 -3.343 2.224 6.118 232 HG22 THR 28 HG22 THR 28 -3.304 0.486 5.806 233 HG23 THR 28 HG23 THR 28 -4.820 1.375 5.654 234 H GLN 29 HN GLN 29 -3.868 4.466 5.518 235 HA GLN 29 HA GLN 29 -6.198 3.942 6.994 236 HB2 GLN 29 HB2 GLN 29 -4.519 6.456 6.986 237 HB3 GLN 29 HB1 GLN 29 -5.633 5.963 8.253 238 HG2 GLN 29 HG2 GLN 29 -3.258 4.328 7.434 239 HG3 GLN 29 HG1 GLN 29 -3.205 5.563 8.686 240 HE21 GLN 29 HE21 GLN 29 -2.835 2.618 8.772 241 HE22 GLN 29 HE22 GLN 29 -3.950 2.059 9.966 242 H LYS 30 HN LYS 30 -5.368 6.722 4.981 243 HA LYS 30 HA LYS 30 -7.917 7.948 5.208 244 HB2 LYS 30 HB2 LYS 30 -5.715 8.410 3.200 245 HB3 LYS 30 HB1 LYS 30 -7.108 9.458 3.440 246 HG2 LYS 30 HG2 LYS 30 -4.929 8.869 5.435 247 HG3 LYS 30 HG1 LYS 30 -5.214 10.389 4.587 248 HD2 LYS 30 HD2 LYS 30 -7.401 10.580 5.712 249 HD3 LYS 30 HD1 LYS 30 -7.068 9.084 6.580 250 HE2 LYS 30 HE2 LYS 30 -5.425 11.604 6.753 251 HE3 LYS 30 HE1 LYS 30 -6.617 11.077 7.939 252 HZ1 LYS 30 HZ1 LYS 30 -5.290 9.065 8.280 253 HZ2 LYS 30 HZ2 LYS 30 -4.427 10.469 8.656 254 HZ3 LYS 30 HZ3 LYS 30 -4.120 9.656 7.209 255 H GLU 31 HN GLU 31 -6.485 5.824 2.772 256 HA GLU 31 HA GLU 31 -8.411 6.112 0.778 257 HB2 GLU 31 HB2 GLU 31 -6.518 3.925 1.524 258 HB3 GLU 31 HB1 GLU 31 -7.731 3.629 0.285 259 HG2 GLU 31 HG2 GLU 31 -5.832 5.952 0.190 260 HG3 GLU 31 HG1 GLU 31 -5.473 4.381 -0.525 261 H GLU 32 HN GLU 32 -8.309 3.655 3.378 262 HA GLU 32 HA GLU 32 -10.778 2.481 2.618 263 HB2 GLU 32 HB2 GLU 32 -10.696 1.348 4.807 264 HB3 GLU 32 HB1 GLU 32 -9.178 1.222 3.933 265 HG2 GLU 32 HG2 GLU 32 -8.209 2.965 5.311 266 HG3 GLU 32 HG1 GLU 32 -9.743 3.166 6.159 267 H LYS 33 HN LYS 33 -9.937 5.201 4.574 268 HA LYS 33 HA LYS 33 -12.425 5.387 5.966 269 HB2 LYS 33 HB2 LYS 33 -10.176 6.361 6.679 270 HB3 LYS 33 HB1 LYS 33 -10.455 7.621 5.488 271 HG2 LYS 33 HG2 LYS 33 -11.094 8.413 7.660 272 HG3 LYS 33 HG1 LYS 33 -12.536 8.225 6.659 273 HD2 LYS 33 HD2 LYS 33 -13.038 6.110 7.737 274 HD3 LYS 33 HD1 LYS 33 -11.558 6.223 8.692 275 HE2 LYS 33 HE2 LYS 33 -13.877 8.146 8.798 276 HE3 LYS 33 HE1 LYS 33 -13.539 6.880 9.978 277 HZ1 LYS 33 HZ1 LYS 33 -11.439 7.976 10.480 278 HZ2 LYS 33 HZ2 LYS 33 -12.744 9.016 10.746 279 HZ3 LYS 33 HZ3 LYS 33 -11.786 9.198 9.366 280 H ILE 34 HN ILE 34 -10.976 7.102 3.205 281 HA ILE 34 HA ILE 34 -13.218 8.704 2.601 282 HB ILE 34 HB ILE 34 -10.960 7.741 0.831 283 HG12 ILE 34 HG12 ILE 34 -11.397 10.566 1.708 284 HG13 ILE 34 HG11 ILE 34 -10.724 9.411 2.866 285 HG21 ILE 34 HG21 ILE 34 -13.136 9.733 0.232 286 HG22 ILE 34 HG22 ILE 34 -12.820 8.213 -0.605 287 HG23 ILE 34 HG23 ILE 34 -11.665 9.540 -0.722 288 HD11 ILE 34 HD11 ILE 34 -9.555 10.018 0.158 289 HD12 ILE 34 HD12 ILE 34 -8.867 8.949 1.383 290 HD13 ILE 34 HD13 ILE 34 -8.988 10.683 1.689 291 H ARG 35 HN ARG 35 -12.345 5.412 1.748 292 HA ARG 35 HA ARG 35 -14.016 4.895 -0.366 293 HB2 ARG 35 HB2 ARG 35 -12.257 3.494 1.115 294 HB3 ARG 35 HB1 ARG 35 -13.761 2.821 1.728 295 HG2 ARG 35 HG2 ARG 35 -13.122 2.999 -1.187 296 HG3 ARG 35 HG1 ARG 35 -12.673 1.617 -0.195 297 HD2 ARG 35 HD2 ARG 35 -14.944 1.098 0.263 298 HD3 ARG 35 HD1 ARG 35 -15.497 2.633 -0.403 299 HE ARG 35 HE ARG 35 -14.205 1.327 -2.460 300 HH11 ARG 35 HH11 ARG 35 -16.928 0.655 -0.373 301 HH12 ARG 35 HH12 ARG 35 -17.820 -0.192 -1.599 302 HH21 ARG 35 HH21 ARG 35 -15.376 0.206 -4.080 303 HH22 ARG 35 HH22 ARG 35 -16.945 -0.438 -3.701 304 H VAL 36 HN VAL 36 -14.712 4.856 3.098 305 HA VAL 36 HA VAL 36 -17.394 3.939 2.813 306 HB VAL 36 HB VAL 36 -16.268 5.511 5.122 307 HG11 VAL 36 HG11 VAL 36 -18.643 5.297 5.241 308 HG12 VAL 36 HG12 VAL 36 -17.948 4.149 6.388 309 HG13 VAL 36 HG13 VAL 36 -18.563 3.583 4.832 310 HG21 VAL 36 HG21 VAL 36 -14.801 3.622 4.552 311 HG22 VAL 36 HG22 VAL 36 -16.182 2.529 4.684 312 HG23 VAL 36 HG23 VAL 36 -15.606 3.397 6.108 313 H LEU 37 HN LEU 37 -15.887 7.110 3.207 314 HA LEU 37 HA LEU 37 -18.143 8.728 3.277 315 HB2 LEU 37 HB2 LEU 37 -15.331 9.066 2.487 316 HB3 LEU 37 HB1 LEU 37 -16.436 10.195 1.726 317 HG LEU 37 HG LEU 37 -15.312 10.939 3.886 318 HD11 LEU 37 HD11 LEU 37 -18.323 11.000 3.745 319 HD12 LEU 37 HD12 LEU 37 -17.226 12.084 2.879 320 HD13 LEU 37 HD13 LEU 37 -17.295 12.120 4.645 321 HD21 LEU 37 HD21 LEU 37 -17.372 9.086 5.070 322 HD22 LEU 37 HD22 LEU 37 -16.320 10.188 5.961 323 HD23 LEU 37 HD23 LEU 37 -15.630 8.819 5.086 324 H ARG 38 HN ARG 38 -16.431 7.363 0.531 325 HA ARG 38 HA ARG 38 -17.807 8.545 -1.561 326 HB2 ARG 38 HB2 ARG 38 -16.834 5.684 -1.419 327 HB3 ARG 38 HB1 ARG 38 -17.258 6.543 -2.893 328 HG2 ARG 38 HG2 ARG 38 -15.458 8.191 -2.344 329 HG3 ARG 38 HG1 ARG 38 -14.968 7.118 -1.033 330 HD2 ARG 38 HD2 ARG 38 -13.594 6.689 -2.966 331 HD3 ARG 38 HD1 ARG 38 -14.653 5.305 -2.685 332 HE ARG 38 HE ARG 38 -15.980 6.946 -4.467 333 HH11 ARG 38 HH11 ARG 38 -12.976 5.150 -4.413 334 HH12 ARG 38 HH12 ARG 38 -12.945 4.910 -6.130 335 HH21 ARG 38 HH21 ARG 38 -15.931 6.642 -6.721 336 HH22 ARG 38 HH22 ARG 38 -14.619 5.762 -7.441 337 H GLN 39 HN GLN 39 -18.620 5.486 0.074 338 HA GLN 39 HA GLN 39 -20.989 4.943 -1.307 339 HB2 GLN 39 HB2 GLN 39 -20.420 4.268 1.585 340 HB3 GLN 39 HB1 GLN 39 -21.504 3.419 0.493 341 HG2 GLN 39 HG2 GLN 39 -18.530 3.610 0.115 342 HG3 GLN 39 HG1 GLN 39 -19.352 2.267 0.891 343 HE21 GLN 39 HE21 GLN 39 -18.780 3.919 -2.096 344 HE22 GLN 39 HE22 GLN 39 -19.385 2.678 -3.127 345 H ARG 40 HN ARG 40 -20.402 6.774 1.632 346 HA ARG 40 HA ARG 40 -23.047 7.337 2.320 347 HB2 ARG 40 HB2 ARG 40 -20.454 8.798 2.781 348 HB3 ARG 40 HB1 ARG 40 -21.972 9.320 3.480 349 HG2 ARG 40 HG2 ARG 40 -22.187 7.230 4.679 350 HG3 ARG 40 HG1 ARG 40 -20.730 6.613 3.900 351 HD2 ARG 40 HD2 ARG 40 -19.423 8.390 4.978 352 HD3 ARG 40 HD1 ARG 40 -20.880 8.964 5.782 353 HE ARG 40 HE ARG 40 -20.067 6.191 6.225 354 HH11 ARG 40 HH11 ARG 40 -20.481 9.434 7.475 355 HH12 ARG 40 HH12 ARG 40 -20.126 8.977 9.113 356 HH21 ARG 40 HH21 ARG 40 -19.657 5.588 8.396 357 HH22 ARG 40 HH22 ARG 40 -19.679 6.799 9.638 358 H LEU 41 HN LEU 41 -20.744 9.098 0.295 359 HA LEU 41 HA LEU 41 -22.468 11.226 -0.397 360 HB2 LEU 41 HB2 LEU 41 -20.342 10.154 -2.230 361 HB3 LEU 41 HB1 LEU 41 -20.950 11.791 -2.101 362 HG LEU 41 HG LEU 41 -19.261 10.415 -0.013 363 HD11 LEU 41 HD11 LEU 41 -18.021 10.775 -2.069 364 HD12 LEU 41 HD12 LEU 41 -17.470 11.872 -0.803 365 HD13 LEU 41 HD13 LEU 41 -18.520 12.466 -2.089 366 HD21 LEU 41 HD21 LEU 41 -20.153 13.282 -0.281 367 HD22 LEU 41 HD22 LEU 41 -18.987 12.676 0.898 368 HD23 LEU 41 HD23 LEU 41 -20.668 12.134 0.957 369 H VAL 42 HN VAL 42 -22.011 7.992 -1.739 370 HA VAL 42 HA VAL 42 -23.133 8.278 -4.249 371 HB VAL 42 HB VAL 42 -23.354 5.934 -2.348 372 HG11 VAL 42 HG11 VAL 42 -23.955 6.042 -5.301 373 HG12 VAL 42 HG12 VAL 42 -25.101 5.718 -3.998 374 HG13 VAL 42 HG13 VAL 42 -23.812 4.565 -4.348 375 HG21 VAL 42 HG21 VAL 42 -21.539 4.994 -3.716 376 HG22 VAL 42 HG22 VAL 42 -21.070 6.494 -2.917 377 HG23 VAL 42 HG23 VAL 42 -21.473 6.498 -4.636 378 H GLU 43 HN GLU 43 -24.864 7.569 -1.219 379 HA GLU 43 HA GLU 43 -27.422 7.490 -2.427 380 HB2 GLU 43 HB2 GLU 43 -26.686 8.081 0.441 381 HB3 GLU 43 HB1 GLU 43 -28.292 7.659 -0.137 382 HG2 GLU 43 HG2 GLU 43 -27.468 5.474 -0.841 383 HG3 GLU 43 HG1 GLU 43 -25.857 5.895 -0.258 384 H ARG 44 HN ARG 44 -25.497 10.033 -1.009 385 HA ARG 44 HA ARG 44 -27.530 12.024 -0.964 386 HB2 ARG 44 HB2 ARG 44 -24.508 12.247 -0.972 387 HB3 ARG 44 HB1 ARG 44 -25.609 13.591 -0.687 388 HG2 ARG 44 HG2 ARG 44 -26.478 12.441 1.299 389 HG3 ARG 44 HG1 ARG 44 -25.328 11.131 1.024 390 HD2 ARG 44 HD2 ARG 44 -23.474 12.616 1.342 391 HD3 ARG 44 HD1 ARG 44 -24.542 14.012 1.419 392 HE ARG 44 HE ARG 44 -24.328 11.911 3.473 393 HH11 ARG 44 HH11 ARG 44 -25.280 15.123 2.473 394 HH12 ARG 44 HH12 ARG 44 -25.548 15.691 4.087 395 HH21 ARG 44 HH21 ARG 44 -24.665 12.654 5.627 396 HH22 ARG 44 HH22 ARG 44 -25.192 14.291 5.879 397 H GLY 45 HN GLY 45 -25.071 11.048 -3.276 398 HA2 GLY 45 HA2 GLY 45 -24.714 11.662 -5.463 399 HA3 GLY 45 HA1 GLY 45 -26.245 12.542 -5.426 400 H ASP 46 HN ASP 46 -22.854 12.679 -4.543 401 HA ASP 46 HA ASP 46 -22.837 15.179 -3.291 402 HB2 ASP 46 HB2 ASP 46 -21.036 13.514 -3.084 403 HB3 ASP 46 HB1 ASP 46 -20.577 13.807 -4.756 404 H ALA 47 HN ALA 47 -22.799 14.373 -6.670 405 HA ALA 47 HA ALA 47 -21.688 16.758 -7.682 406 HB1 ALA 47 HB1 ALA 47 -23.691 14.920 -8.991 407 HB2 ALA 47 HB2 ALA 47 -21.937 14.728 -9.027 408 HB3 ALA 47 HB3 ALA 47 -22.689 16.120 -9.810 409 H LYS 48 HN LYS 48 -24.875 15.973 -6.516 410 HA LYS 48 HA LYS 48 -25.884 18.574 -7.444 411 HB2 LYS 48 HB2 LYS 48 -27.180 16.535 -8.066 412 HB3 LYS 48 HB1 LYS 48 -27.432 16.211 -6.359 413 HG2 LYS 48 HG2 LYS 48 -29.390 17.245 -7.354 414 HG3 LYS 48 HG1 LYS 48 -28.670 18.301 -6.137 415 HD2 LYS 48 HD2 LYS 48 -27.437 19.403 -8.089 416 HD3 LYS 48 HD1 LYS 48 -28.576 18.550 -9.129 417 HE2 LYS 48 HE2 LYS 48 -30.429 19.637 -8.035 418 HE3 LYS 48 HE1 LYS 48 -29.331 20.413 -6.895 419 HZ1 LYS 48 HZ1 LYS 48 -29.946 21.944 -8.629 420 HZ2 LYS 48 HZ2 LYS 48 -29.423 20.871 -9.825 421 HZ3 LYS 48 HZ3 LYS 48 -28.304 21.570 -8.771 422 H GLY 49 HN GLY 49 -24.316 17.402 -4.910 423 HA2 GLY 49 HA2 GLY 49 -25.834 17.886 -2.626 424 HA3 GLY 49 HA1 GLY 49 -24.083 17.970 -2.706 425 H THR 50 HN THR 50 -26.887 19.682 -2.156 426 HA THR 50 HA THR 50 -25.516 22.253 -2.557 427 HB THR 50 HB THR 50 -28.495 21.842 -2.252 428 HG1 THR 50 HG1 THR 50 -27.858 20.846 -4.178 429 HG21 THR 50 HG21 THR 50 -28.630 24.098 -3.198 430 HG22 THR 50 HG22 THR 50 -26.871 24.172 -3.287 431 HG23 THR 50 HG23 THR 50 -27.672 24.094 -1.718 432 H GLU 51 HN GLU 51 -24.420 22.225 -0.610 433 HA GLU 51 HA GLU 51 -25.774 21.714 1.878 434 HB2 GLU 51 HB2 GLU 51 -23.517 22.464 2.825 435 HB3 GLU 51 HB1 GLU 51 -23.526 21.013 1.834 436 HG2 GLU 51 HG2 GLU 51 -22.725 22.280 -0.061 437 HG3 GLU 51 HG1 GLU 51 -22.764 23.758 0.894 438 H LEU 52 HN LEU 52 -26.604 23.155 3.274 439 HA LEU 52 HA LEU 52 -26.236 26.011 2.663 440 HB2 LEU 52 HB2 LEU 52 -28.772 24.671 3.599 441 HB3 LEU 52 HB1 LEU 52 -28.568 26.390 3.319 442 HG LEU 52 HG LEU 52 -28.405 24.246 1.196 443 HD11 LEU 52 HD11 LEU 52 -30.519 25.205 0.401 444 HD12 LEU 52 HD12 LEU 52 -30.556 26.264 1.810 445 HD13 LEU 52 HD13 LEU 52 -30.667 24.517 2.018 446 HD21 LEU 52 HD21 LEU 52 -26.982 26.138 0.665 447 HD22 LEU 52 HD22 LEU 52 -28.308 27.255 0.992 448 HD23 LEU 52 HD23 LEU 52 -28.409 26.140 -0.372 449 H ASN 53 HN ASN 53 -25.916 23.586 4.932 450 HA ASN 53 HA ASN 53 -25.831 25.555 7.124 451 HB2 ASN 53 HB2 ASN 53 -26.723 22.672 7.198 452 HB3 ASN 53 HB1 ASN 53 -26.280 23.563 8.650 453 HD21 ASN 53 HD21 ASN 53 -28.838 22.402 7.903 454 HD22 ASN 53 HD22 ASN 53 -29.976 23.706 7.919 455 H GLY 84 HN GLY 84 27.956 11.301 -4.057 456 HA2 GLY 84 HA2 GLY 84 30.445 10.862 -2.528 457 HA3 GLY 84 HA1 GLY 84 28.936 10.065 -2.098 458 HA PRO 85 HA PRO 85 30.544 8.137 -6.188 459 HB2 PRO 85 HB2 PRO 85 33.108 8.468 -6.832 460 HB3 PRO 85 HB1 PRO 85 31.917 9.732 -7.167 461 HG2 PRO 85 HG2 PRO 85 33.894 9.536 -4.928 462 HG3 PRO 85 HG1 PRO 85 33.453 10.946 -5.909 463 HD2 PRO 85 HD2 PRO 85 32.443 10.419 -3.396 464 HD3 PRO 85 HD1 PRO 85 31.626 11.419 -4.614 465 H LEU 86 HN LEU 86 32.442 6.497 -6.779 466 HA LEU 86 HA LEU 86 32.400 4.334 -5.193 467 HB2 LEU 86 HB2 LEU 86 34.821 3.926 -6.198 468 HB3 LEU 86 HB1 LEU 86 33.366 3.826 -7.166 469 HG LEU 86 HG LEU 86 33.776 6.177 -7.922 470 HD11 LEU 86 HD11 LEU 86 35.164 6.981 -6.115 471 HD12 LEU 86 HD12 LEU 86 36.035 7.100 -7.645 472 HD13 LEU 86 HD13 LEU 86 36.413 5.799 -6.514 473 HD21 LEU 86 HD21 LEU 86 35.953 4.174 -8.485 474 HD22 LEU 86 HD22 LEU 86 35.565 5.581 -9.475 475 HD23 LEU 86 HD23 LEU 86 34.392 4.277 -9.298 476 H GLY 87 HN GLY 87 33.394 3.458 -3.485 477 HA2 GLY 87 HA2 GLY 87 34.984 5.281 -1.838 478 HA3 GLY 87 HA1 GLY 87 34.154 3.839 -1.276 479 H SER 88 HN SER 88 35.046 1.728 -2.179 480 HA SER 88 HA SER 88 37.970 1.966 -2.373 481 HB2 SER 88 HB2 SER 88 37.083 0.684 -0.413 482 HB3 SER 88 HB1 SER 88 36.387 -0.476 -1.542 483 HG SER 88 HG SER 88 38.292 -1.372 -1.191 484 H ARG 89 HN ARG 89 35.314 -0.153 -3.540 485 HA ARG 89 HA ARG 89 36.808 -0.390 -6.050 486 HB2 ARG 89 HB2 ARG 89 36.192 -2.533 -5.149 487 HB3 ARG 89 HB1 ARG 89 34.522 -2.031 -4.970 488 HG2 ARG 89 HG2 ARG 89 34.649 -3.466 -6.858 489 HG3 ARG 89 HG1 ARG 89 34.385 -1.829 -7.452 490 HD2 ARG 89 HD2 ARG 89 37.095 -3.143 -7.306 491 HD3 ARG 89 HD1 ARG 89 36.068 -3.183 -8.734 492 HE ARG 89 HE ARG 89 37.495 -0.873 -7.659 493 HH11 ARG 89 HH11 ARG 89 35.319 -2.180 -10.081 494 HH12 ARG 89 HH12 ARG 89 35.498 -0.826 -11.153 495 HH21 ARG 89 HH21 ARG 89 37.738 0.902 -9.081 496 HH22 ARG 89 HH22 ARG 89 36.878 0.922 -10.589 497 H ARG 90 HN ARG 90 33.316 -0.295 -5.250 498 HA ARG 90 HA ARG 90 32.651 1.997 -6.669 499 HB2 ARG 90 HB2 ARG 90 33.681 0.821 -8.583 500 HB3 ARG 90 HB1 ARG 90 32.529 -0.489 -8.386 501 HG2 ARG 90 HG2 ARG 90 30.700 1.044 -8.898 502 HG3 ARG 90 HG1 ARG 90 31.865 2.356 -9.105 503 HD2 ARG 90 HD2 ARG 90 32.934 1.126 -10.921 504 HD3 ARG 90 HD1 ARG 90 31.793 -0.200 -10.706 505 HE ARG 90 HE ARG 90 30.296 2.089 -11.139 506 HH11 ARG 90 HH11 ARG 90 32.645 0.163 -12.866 507 HH12 ARG 90 HH12 ARG 90 32.001 0.549 -14.430 508 HH21 ARG 90 HH21 ARG 90 29.438 2.595 -13.196 509 HH22 ARG 90 HH22 ARG 90 30.176 1.931 -14.616 510 H PHE 91 HN PHE 91 31.553 -1.402 -6.534 511 HA PHE 91 HA PHE 91 28.873 -0.829 -7.032 512 HB2 PHE 91 HB2 PHE 91 29.998 -3.230 -5.590 513 HB3 PHE 91 HB1 PHE 91 28.414 -3.126 -6.349 514 HD1 PHE 91 HD1 PHE 91 31.886 -3.845 -6.816 515 HD2 PHE 91 HD2 PHE 91 28.302 -2.781 -8.849 516 HE1 PHE 91 HE1 PHE 91 32.861 -4.619 -8.935 517 HE2 PHE 91 HE2 PHE 91 29.272 -3.555 -10.971 518 HZ PHE 91 HZ PHE 91 31.556 -4.474 -11.017 519 H VAL 92 HN VAL 92 30.594 -0.931 -3.976 520 HA VAL 92 HA VAL 92 28.437 -1.208 -2.236 521 HB VAL 92 HB VAL 92 31.025 0.293 -1.830 522 HG11 VAL 92 HG11 VAL 92 28.990 -0.543 0.233 523 HG12 VAL 92 HG12 VAL 92 29.339 1.113 -0.261 524 HG13 VAL 92 HG13 VAL 92 30.571 0.161 0.567 525 HG21 VAL 92 HG21 VAL 92 30.137 -2.462 -0.983 526 HG22 VAL 92 HG22 VAL 92 31.680 -1.711 -0.580 527 HG23 VAL 92 HG23 VAL 92 31.296 -2.089 -2.257 528 H VAL 93 HN VAL 93 29.744 1.742 -3.733 529 HA VAL 93 HA VAL 93 27.860 3.390 -2.295 530 HB VAL 93 HB VAL 93 28.730 5.276 -3.512 531 HG11 VAL 93 HG11 VAL 93 31.093 5.147 -2.874 532 HG12 VAL 93 HG12 VAL 93 30.937 3.401 -2.679 533 HG13 VAL 93 HG13 VAL 93 30.034 4.490 -1.627 534 HG21 VAL 93 HG21 VAL 93 30.305 3.304 -5.164 535 HG22 VAL 93 HG22 VAL 93 30.422 5.062 -5.253 536 HG23 VAL 93 HG23 VAL 93 28.927 4.253 -5.723 537 H ASP 94 HN ASP 94 27.942 1.641 -5.266 538 HA ASP 94 HA ASP 94 25.916 3.057 -6.625 539 HB2 ASP 94 HB2 ASP 94 27.068 0.300 -6.860 540 HB3 ASP 94 HB1 ASP 94 25.627 0.744 -7.752 541 H ASP 95 HN ASP 95 25.815 -0.030 -4.788 542 HA ASP 95 HA ASP 95 22.989 -0.191 -4.921 543 HB2 ASP 95 HB2 ASP 95 23.087 -2.004 -3.377 544 HB3 ASP 95 HB1 ASP 95 24.492 -2.149 -4.429 545 H ARG 96 HN ARG 96 24.977 1.823 -3.145 546 HA ARG 96 HA ARG 96 23.111 2.259 -0.977 547 HB2 ARG 96 HB2 ARG 96 25.501 2.676 -0.596 548 HB3 ARG 96 HB1 ARG 96 25.506 3.883 -1.876 549 HG2 ARG 96 HG2 ARG 96 23.880 5.214 -0.567 550 HG3 ARG 96 HG1 ARG 96 24.020 4.035 0.738 551 HD2 ARG 96 HD2 ARG 96 25.446 5.905 1.222 552 HD3 ARG 96 HD1 ARG 96 26.446 4.506 0.842 553 HE ARG 96 HE ARG 96 26.250 5.771 -1.535 554 HH11 ARG 96 HH11 ARG 96 27.068 6.903 1.671 555 HH12 ARG 96 HH12 ARG 96 28.215 8.080 1.098 556 HH21 ARG 96 HH21 ARG 96 27.733 7.363 -2.293 557 HH22 ARG 96 HH22 ARG 96 28.586 8.338 -1.143 558 H ARG 97 HN ARG 97 24.396 4.367 -3.525 559 HA ARG 97 HA ARG 97 22.379 6.320 -3.208 560 HB2 ARG 97 HB2 ARG 97 24.366 7.170 -3.991 561 HB3 ARG 97 HB1 ARG 97 24.644 5.824 -5.078 562 HG2 ARG 97 HG2 ARG 97 22.339 7.480 -5.795 563 HG3 ARG 97 HG1 ARG 97 23.891 8.323 -5.831 564 HD2 ARG 97 HD2 ARG 97 23.132 5.802 -7.304 565 HD3 ARG 97 HD1 ARG 97 23.522 7.379 -7.999 566 HE ARG 97 HE ARG 97 25.768 6.742 -6.626 567 HH11 ARG 97 HH11 ARG 97 23.913 5.147 -9.121 568 HH12 ARG 97 HH12 ARG 97 25.239 4.165 -9.653 569 HH21 ARG 97 HH21 ARG 97 27.514 5.454 -7.329 570 HH22 ARG 97 HH22 ARG 97 27.278 4.324 -8.628 571 H GLU 98 HN GLU 98 22.725 3.578 -5.361 572 HA GLU 98 HA GLU 98 20.605 4.364 -7.111 573 HB2 GLU 98 HB2 GLU 98 22.310 1.935 -6.763 574 HB3 GLU 98 HB1 GLU 98 20.841 1.824 -7.744 575 HG2 GLU 98 HG2 GLU 98 23.064 3.799 -8.160 576 HG3 GLU 98 HG1 GLU 98 22.862 2.298 -9.059 577 H LEU 99 HN LEU 99 20.889 2.065 -4.412 578 HA LEU 99 HA LEU 99 18.213 1.118 -4.719 579 HB2 LEU 99 HB2 LEU 99 19.972 -0.257 -3.729 580 HB3 LEU 99 HB1 LEU 99 20.128 0.872 -2.404 581 HG LEU 99 HG LEU 99 18.844 -1.359 -2.068 582 HD11 LEU 99 HD11 LEU 99 17.760 1.286 -1.128 583 HD12 LEU 99 HD12 LEU 99 19.036 0.327 -0.370 584 HD13 LEU 99 HD13 LEU 99 17.382 -0.285 -0.414 585 HD21 LEU 99 HD21 LEU 99 17.349 -1.129 -3.982 586 HD22 LEU 99 HD22 LEU 99 16.668 0.337 -3.277 587 HD23 LEU 99 HD23 LEU 99 16.450 -1.215 -2.467 588 H GLN 100 HN GLN 100 19.766 3.503 -2.569 589 HA GLN 100 HA GLN 100 17.467 3.992 -1.000 590 HB2 GLN 100 HB2 GLN 100 18.594 5.939 -0.191 591 HB3 GLN 100 HB1 GLN 100 19.816 4.704 -0.446 592 HG2 GLN 100 HG2 GLN 100 20.491 5.735 -2.515 593 HG3 GLN 100 HG1 GLN 100 19.219 6.941 -2.356 594 HE21 GLN 100 HE21 GLN 100 20.667 8.640 -2.379 595 HE22 GLN 100 HE22 GLN 100 21.721 8.983 -1.048 596 H TYR 101 HN TYR 101 18.527 5.113 -4.111 597 HA TYR 101 HA TYR 101 16.952 7.398 -4.382 598 HB2 TYR 101 HB2 TYR 101 18.774 6.721 -5.950 599 HB3 TYR 101 HB1 TYR 101 17.697 5.490 -6.605 600 HD1 TYR 101 HD1 TYR 101 16.213 6.032 -8.339 601 HD2 TYR 101 HD2 TYR 101 17.982 9.153 -6.057 602 HE1 TYR 101 HE1 TYR 101 15.257 7.693 -9.880 603 HE2 TYR 101 HE2 TYR 101 17.035 10.823 -7.590 604 HH TYR 101 HH TYR 101 14.658 10.024 -9.933 605 H ARG 102 HN ARG 102 16.181 4.002 -5.142 606 HA ARG 102 HA ARG 102 13.589 4.640 -6.147 607 HB2 ARG 102 HB2 ARG 102 13.141 2.281 -6.185 608 HB3 ARG 102 HB1 ARG 102 14.774 2.551 -6.760 609 HG2 ARG 102 HG2 ARG 102 15.045 0.707 -5.433 610 HG3 ARG 102 HG1 ARG 102 15.438 2.003 -4.304 611 HD2 ARG 102 HD2 ARG 102 13.978 0.319 -3.281 612 HD3 ARG 102 HD1 ARG 102 13.192 1.894 -3.370 613 HE ARG 102 HE ARG 102 12.480 0.456 -5.653 614 HH11 ARG 102 HH11 ARG 102 11.991 0.286 -2.186 615 HH12 ARG 102 HH12 ARG 102 10.454 -0.506 -2.319 616 HH21 ARG 102 HH21 ARG 102 10.455 -0.597 -5.816 617 HH22 ARG 102 HH22 ARG 102 9.593 -1.020 -4.370 618 H VAL 103 HN VAL 103 14.880 4.302 -2.997 619 HA VAL 103 HA VAL 103 12.382 3.727 -1.692 620 HB VAL 103 HB VAL 103 14.830 4.932 -0.396 621 HG11 VAL 103 HG11 VAL 103 14.038 3.752 1.584 622 HG12 VAL 103 HG12 VAL 103 12.666 3.125 0.669 623 HG13 VAL 103 HG13 VAL 103 12.801 4.857 0.972 624 HG21 VAL 103 HG21 VAL 103 15.599 2.653 0.057 625 HG22 VAL 103 HG22 VAL 103 15.553 2.985 -1.674 626 HG23 VAL 103 HG23 VAL 103 14.285 2.012 -0.928 627 H GLU 104 HN GLU 104 14.369 6.650 -2.201 628 HA GLU 104 HA GLU 104 12.518 8.344 -0.902 629 HB2 GLU 104 HB2 GLU 104 13.752 10.196 -2.190 630 HB3 GLU 104 HB1 GLU 104 14.614 9.284 -0.963 631 HG2 GLU 104 HG2 GLU 104 15.691 7.960 -2.624 632 HG3 GLU 104 HG1 GLU 104 14.733 8.699 -3.899 633 H VAL 105 HN VAL 105 12.730 7.336 -4.315 634 HA VAL 105 HA VAL 105 10.729 9.168 -5.143 635 HB VAL 105 HB VAL 105 11.649 8.295 -7.039 636 HG11 VAL 105 HG11 VAL 105 13.013 6.596 -5.998 637 HG12 VAL 105 HG12 VAL 105 12.200 5.939 -7.419 638 HG13 VAL 105 HG13 VAL 105 11.603 5.557 -5.804 639 HG21 VAL 105 HG21 VAL 105 9.277 8.053 -7.326 640 HG22 VAL 105 HG22 VAL 105 9.327 6.449 -6.595 641 HG23 VAL 105 HG23 VAL 105 10.115 6.735 -8.144 642 H GLN 106 HN GLN 106 10.559 5.857 -3.873 643 HA GLN 106 HA GLN 106 7.779 5.592 -3.892 644 HB2 GLN 106 HB2 GLN 106 9.872 4.528 -1.992 645 HB3 GLN 106 HB1 GLN 106 8.181 4.086 -1.871 646 HG2 GLN 106 HG2 GLN 106 9.926 3.617 -4.269 647 HG3 GLN 106 HG1 GLN 106 9.516 2.409 -3.054 648 HE21 GLN 106 HE21 GLN 106 8.362 4.298 -5.725 649 HE22 GLN 106 HE22 GLN 106 6.894 3.420 -5.974 650 H ASN 107 HN ASN 107 9.930 7.105 -1.551 651 HA ASN 107 HA ASN 107 8.074 7.835 0.414 652 HB2 ASN 107 HB2 ASN 107 10.494 7.951 0.736 653 HB3 ASN 107 HB1 ASN 107 10.608 9.234 -0.465 654 HD21 ASN 107 HD21 ASN 107 11.541 10.629 1.005 655 HD22 ASN 107 HD22 ASN 107 10.641 11.373 2.279 656 H ARG 108 HN ARG 108 9.021 9.455 -2.585 657 HA ARG 108 HA ARG 108 7.470 11.807 -2.013 658 HB2 ARG 108 HB2 ARG 108 8.916 10.872 -4.486 659 HB3 ARG 108 HB1 ARG 108 8.082 12.410 -4.367 660 HG2 ARG 108 HG2 ARG 108 9.560 13.032 -2.488 661 HG3 ARG 108 HG1 ARG 108 10.427 11.512 -2.708 662 HD2 ARG 108 HD2 ARG 108 11.650 13.255 -3.811 663 HD3 ARG 108 HD1 ARG 108 10.940 12.205 -5.036 664 HE ARG 108 HE ARG 108 9.374 14.541 -4.348 665 HH11 ARG 108 HH11 ARG 108 11.745 13.135 -6.500 666 HH12 ARG 108 HH12 ARG 108 11.507 14.316 -7.747 667 HH21 ARG 108 HH21 ARG 108 9.054 16.105 -5.992 668 HH22 ARG 108 HH22 ARG 108 9.961 15.991 -7.466 669 H VAL 109 HN VAL 109 7.209 9.110 -4.293 670 HA VAL 109 HA VAL 109 4.895 9.824 -5.620 671 HB VAL 109 HB VAL 109 5.866 7.065 -4.887 672 HG11 VAL 109 HG11 VAL 109 4.414 6.211 -6.637 673 HG12 VAL 109 HG12 VAL 109 3.802 7.833 -6.950 674 HG13 VAL 109 HG13 VAL 109 3.455 7.045 -5.409 675 HG21 VAL 109 HG21 VAL 109 7.467 8.206 -6.227 676 HG22 VAL 109 HG22 VAL 109 6.213 8.804 -7.323 677 HG23 VAL 109 HG23 VAL 109 6.606 7.082 -7.284 678 H TYR 110 HN TYR 110 5.168 7.786 -2.728 679 HA TYR 110 HA TYR 110 2.390 7.409 -2.411 680 HB2 TYR 110 HB2 TYR 110 4.686 7.182 -0.470 681 HB3 TYR 110 HB1 TYR 110 3.034 6.774 -0.043 682 HD1 TYR 110 HD1 TYR 110 3.349 4.495 0.437 683 HD2 TYR 110 HD2 TYR 110 4.619 6.033 -3.317 684 HE1 TYR 110 HE1 TYR 110 3.718 2.200 -0.364 685 HE2 TYR 110 HE2 TYR 110 4.987 3.748 -4.137 686 HH TYR 110 HH TYR 110 5.454 1.521 -3.204 687 H LYS 111 HN LYS 111 4.546 9.959 -1.504 688 HA LYS 111 HA LYS 111 2.858 11.217 0.412 689 HB2 LYS 111 HB2 LYS 111 5.377 11.534 0.070 690 HB3 LYS 111 HB1 LYS 111 4.960 12.564 -1.286 691 HG2 LYS 111 HG2 LYS 111 3.904 13.094 1.470 692 HG3 LYS 111 HG1 LYS 111 5.488 13.670 0.953 693 HD2 LYS 111 HD2 LYS 111 4.359 14.797 -0.971 694 HD3 LYS 111 HD1 LYS 111 2.810 14.347 -0.253 695 HE2 LYS 111 HE2 LYS 111 3.381 16.624 0.355 696 HE3 LYS 111 HE1 LYS 111 3.415 15.588 1.781 697 HZ1 LYS 111 HZ1 LYS 111 5.800 16.409 0.218 698 HZ2 LYS 111 HZ2 LYS 111 5.806 15.489 1.636 699 HZ3 LYS 111 HZ3 LYS 111 5.312 17.103 1.679 700 H LYS 112 HN LYS 112 3.417 11.588 -3.049 701 HA LYS 112 HA LYS 112 1.669 13.724 -3.554 702 HB2 LYS 112 HB2 LYS 112 2.331 11.379 -5.352 703 HB3 LYS 112 HB1 LYS 112 1.609 12.894 -5.869 704 HG2 LYS 112 HG2 LYS 112 3.572 14.081 -5.571 705 HG3 LYS 112 HG1 LYS 112 4.256 12.871 -4.486 706 HD2 LYS 112 HD2 LYS 112 5.428 12.637 -6.520 707 HD3 LYS 112 HD1 LYS 112 4.282 11.304 -6.472 708 HE2 LYS 112 HE2 LYS 112 3.760 13.875 -7.926 709 HE3 LYS 112 HE1 LYS 112 4.509 12.471 -8.678 710 HZ1 LYS 112 HZ1 LYS 112 2.495 11.206 -8.103 711 HZ2 LYS 112 HZ2 LYS 112 2.184 12.482 -9.158 712 HZ3 LYS 112 HZ3 LYS 112 1.776 12.622 -7.526 713 H GLU 113 HN GLU 113 1.129 10.249 -3.328 714 HA GLU 113 HA GLU 113 -1.539 10.100 -4.082 715 HB2 GLU 113 HB2 GLU 113 -0.253 8.544 -1.839 716 HB3 GLU 113 HB1 GLU 113 -1.678 8.080 -2.765 717 HG2 GLU 113 HG2 GLU 113 1.129 8.349 -3.824 718 HG3 GLU 113 HG1 GLU 113 0.278 6.853 -3.492 719 H ILE 114 HN ILE 114 -0.154 10.641 -0.861 720 HA ILE 114 HA ILE 114 -2.533 10.974 0.551 721 HB ILE 114 HB ILE 114 0.206 12.124 1.074 722 HG12 ILE 114 HG12 ILE 114 -1.170 9.653 2.140 723 HG13 ILE 114 HG11 ILE 114 0.060 9.662 0.883 724 HG21 ILE 114 HG21 ILE 114 -1.390 13.378 2.359 725 HG22 ILE 114 HG22 ILE 114 -0.541 12.262 3.437 726 HG23 ILE 114 HG23 ILE 114 -2.182 11.894 2.901 727 HD11 ILE 114 HD11 ILE 114 0.456 10.585 3.714 728 HD12 ILE 114 HD12 ILE 114 1.683 10.528 2.447 729 HD13 ILE 114 HD13 ILE 114 0.964 9.034 3.049 730 H GLN 115 HN GLN 115 -0.761 13.255 -1.438 731 HA GLN 115 HA GLN 115 -2.125 15.577 -0.497 732 HB2 GLN 115 HB2 GLN 115 -0.806 15.164 -3.178 733 HB3 GLN 115 HB1 GLN 115 -1.135 16.697 -2.384 734 HG2 GLN 115 HG2 GLN 115 0.378 15.948 -0.531 735 HG3 GLN 115 HG1 GLN 115 0.813 14.583 -1.555 736 HE21 GLN 115 HE21 GLN 115 1.027 18.029 -1.143 737 HE22 GLN 115 HE22 GLN 115 2.282 18.293 -2.302 738 H ALA 116 HN ALA 116 -2.561 13.373 -3.214 739 HA ALA 116 HA ALA 116 -4.904 14.498 -4.288 740 HB1 ALA 116 HB1 ALA 116 -4.124 11.582 -4.118 741 HB2 ALA 116 HB2 ALA 116 -3.648 12.703 -5.397 742 HB3 ALA 116 HB3 ALA 116 -5.344 12.265 -5.194 743 H LEU 117 HN LEU 117 -4.406 12.042 -1.809 744 HA LEU 117 HA LEU 117 -7.102 11.583 -1.168 745 HB2 LEU 117 HB2 LEU 117 -4.763 11.367 0.726 746 HB3 LEU 117 HB1 LEU 117 -6.286 10.506 0.822 747 HG LEU 117 HG LEU 117 -4.165 10.115 -1.288 748 HD11 LEU 117 HD11 LEU 117 -3.531 9.253 0.905 749 HD12 LEU 117 HD12 LEU 117 -3.820 7.957 -0.253 750 HD13 LEU 117 HD13 LEU 117 -5.032 8.328 0.973 751 HD21 LEU 117 HD21 LEU 117 -6.733 8.602 -0.850 752 HD22 LEU 117 HD22 LEU 117 -5.497 8.250 -2.061 753 HD23 LEU 117 HD23 LEU 117 -6.428 9.746 -2.158 754 H ASP 118 HN ASP 118 -4.907 14.111 -0.296 755 HA ASP 118 HA ASP 118 -6.054 14.966 2.113 756 HB2 ASP 118 HB2 ASP 118 -3.832 15.653 1.360 757 HB3 ASP 118 HB1 ASP 118 -4.553 16.586 0.054 758 H ALA 119 HN ALA 119 -6.846 15.714 -1.235 759 HA ALA 119 HA ALA 119 -8.774 17.725 -0.704 760 HB1 ALA 119 HB1 ALA 119 -7.900 17.322 -2.947 761 HB2 ALA 119 HB2 ALA 119 -9.659 17.193 -2.929 762 HB3 ALA 119 HB3 ALA 119 -8.669 15.735 -2.971 763 H GLU 120 HN GLU 120 -8.977 14.210 -0.999 764 HA GLU 120 HA GLU 120 -11.742 14.045 -0.383 765 HB2 GLU 120 HB2 GLU 120 -9.477 12.082 -0.374 766 HB3 GLU 120 HB1 GLU 120 -11.046 11.638 0.267 767 HG2 GLU 120 HG2 GLU 120 -10.786 10.891 -2.008 768 HG3 GLU 120 HG1 GLU 120 -12.082 12.074 -1.875 769 H ILE 121 HN ILE 121 -8.832 14.248 1.571 770 HA ILE 121 HA ILE 121 -9.882 13.516 4.046 771 HB ILE 121 HB ILE 121 -7.582 15.078 3.144 772 HG12 ILE 121 HG12 ILE 121 -6.495 13.846 5.015 773 HG13 ILE 121 HG11 ILE 121 -8.073 13.198 5.457 774 HG21 ILE 121 HG21 ILE 121 -8.538 16.822 4.516 775 HG22 ILE 121 HG22 ILE 121 -7.105 16.150 5.292 776 HG23 ILE 121 HG23 ILE 121 -8.711 15.699 5.865 777 HD11 ILE 121 HD11 ILE 121 -8.211 12.114 3.261 778 HD12 ILE 121 HD12 ILE 121 -6.809 11.580 4.187 779 HD13 ILE 121 HD13 ILE 121 -6.608 12.737 2.868 780 H ARG 122 HN ARG 122 -10.322 16.435 2.171 781 HA ARG 122 HA ARG 122 -11.466 18.039 4.152 782 HB2 ARG 122 HB2 ARG 122 -12.039 17.985 1.191 783 HB3 ARG 122 HB1 ARG 122 -12.354 19.305 2.286 784 HG2 ARG 122 HG2 ARG 122 -9.674 18.251 1.450 785 HG3 ARG 122 HG1 ARG 122 -10.381 19.815 1.045 786 HD2 ARG 122 HD2 ARG 122 -10.278 20.491 3.370 787 HD3 ARG 122 HD1 ARG 122 -9.671 18.902 3.831 788 HE ARG 122 HE ARG 122 -8.048 20.248 1.876 789 HH11 ARG 122 HH11 ARG 122 -8.644 19.741 5.294 790 HH12 ARG 122 HH12 ARG 122 -7.068 20.304 5.767 791 HH21 ARG 122 HH21 ARG 122 -5.976 20.948 2.501 792 HH22 ARG 122 HH22 ARG 122 -5.547 20.977 4.181 793 H LYS 123 HN LYS 123 -12.858 15.666 1.905 794 HA LYS 123 HA LYS 123 -15.548 15.999 2.766 795 HB2 LYS 123 HB2 LYS 123 -16.088 14.181 1.458 796 HB3 LYS 123 HB1 LYS 123 -14.581 14.680 0.718 797 HG2 LYS 123 HG2 LYS 123 -13.453 12.952 2.202 798 HG3 LYS 123 HG1 LYS 123 -15.067 12.350 2.538 799 HD2 LYS 123 HD2 LYS 123 -13.381 11.777 0.338 800 HD3 LYS 123 HD1 LYS 123 -14.992 11.150 0.676 801 HE2 LYS 123 HE2 LYS 123 -15.937 13.159 -0.397 802 HE3 LYS 123 HE1 LYS 123 -14.298 13.661 -0.813 803 HZ1 LYS 123 HZ1 LYS 123 -15.368 12.579 -2.674 804 HZ2 LYS 123 HZ2 LYS 123 -15.626 11.183 -1.758 805 HZ3 LYS 123 HZ3 LYS 123 -14.054 11.661 -2.142 806 H LEU 124 HN LEU 124 -12.865 14.105 3.968 807 HA LEU 124 HA LEU 124 -14.315 12.653 5.911 808 HB2 LEU 124 HB2 LEU 124 -11.415 13.466 5.779 809 HB3 LEU 124 HB1 LEU 124 -12.070 12.414 7.018 810 HG LEU 124 HG LEU 124 -12.063 11.814 4.051 811 HD11 LEU 124 HD11 LEU 124 -9.820 11.731 4.987 812 HD12 LEU 124 HD12 LEU 124 -10.404 10.100 4.663 813 HD13 LEU 124 HD13 LEU 124 -10.389 10.718 6.312 814 HD21 LEU 124 HD21 LEU 124 -12.783 9.586 4.758 815 HD22 LEU 124 HD22 LEU 124 -13.957 10.827 5.190 816 HD23 LEU 124 HD23 LEU 124 -12.895 10.156 6.423 817 H GLU 125 HN GLU 125 -12.446 15.673 6.094 818 HA GLU 125 HA GLU 125 -12.839 16.132 8.820 819 HB2 GLU 125 HB2 GLU 125 -12.395 18.130 6.607 820 HB3 GLU 125 HB1 GLU 125 -12.254 18.476 8.327 821 HG2 GLU 125 HG2 GLU 125 -10.445 16.867 8.515 822 HG3 GLU 125 HG1 GLU 125 -10.592 16.485 6.806 823 H ARG 126 HN ARG 126 -14.895 16.945 6.064 824 HA ARG 126 HA ARG 126 -16.674 18.560 7.600 825 HB2 ARG 126 HB2 ARG 126 -18.168 18.512 5.731 826 HB3 ARG 126 HB1 ARG 126 -16.533 18.660 5.110 827 HG2 ARG 126 HG2 ARG 126 -16.538 16.244 4.626 828 HG3 ARG 126 HG1 ARG 126 -18.216 16.169 5.165 829 HD2 ARG 126 HD2 ARG 126 -17.161 17.825 2.874 830 HD3 ARG 126 HD1 ARG 126 -18.064 16.318 2.728 831 HE ARG 126 HE ARG 126 -19.397 18.434 4.192 832 HH11 ARG 126 HH11 ARG 126 -18.914 16.894 1.082 833 HH12 ARG 126 HH12 ARG 126 -20.388 17.510 0.409 834 HH21 ARG 126 HH21 ARG 126 -21.352 19.230 3.306 835 HH22 ARG 126 HH22 ARG 126 -21.779 18.823 1.677 836 H LEU 127 HN LEU 127 -16.225 15.168 7.279 837 HA LEU 127 HA LEU 127 -18.751 14.483 8.508 838 HB2 LEU 127 HB2 LEU 127 -16.997 13.067 7.024 839 HB3 LEU 127 HB1 LEU 127 -16.415 12.640 8.617 840 HG LEU 127 HG LEU 127 -17.883 10.918 7.918 841 HD11 LEU 127 HD11 LEU 127 -18.124 11.523 10.253 842 HD12 LEU 127 HD12 LEU 127 -19.663 10.978 9.586 843 HD13 LEU 127 HD13 LEU 127 -19.370 12.699 9.835 844 HD21 LEU 127 HD21 LEU 127 -19.015 12.187 6.150 845 HD22 LEU 127 HD22 LEU 127 -19.969 13.015 7.380 846 HD23 LEU 127 HD23 LEU 127 -20.141 11.278 7.155 847 H LEU 128 HN LEU 128 -15.363 14.112 9.526 848 HA LEU 128 HA LEU 128 -15.511 13.756 12.174 849 HB2 LEU 128 HB2 LEU 128 -13.648 15.389 10.486 850 HB3 LEU 128 HB1 LEU 128 -13.393 15.239 12.211 851 HG LEU 128 HG LEU 128 -13.081 12.864 12.005 852 HD11 LEU 128 HD11 LEU 128 -14.632 12.330 10.239 853 HD12 LEU 128 HD12 LEU 128 -13.025 11.696 9.883 854 HD13 LEU 128 HD13 LEU 128 -13.597 13.154 9.072 855 HD21 LEU 128 HD21 LEU 128 -11.025 12.832 10.670 856 HD22 LEU 128 HD22 LEU 128 -11.139 14.289 11.659 857 HD23 LEU 128 HD23 LEU 128 -11.495 14.365 9.930 858 H GLU 129 HN GLU 129 -15.169 17.016 10.771 859 HA GLU 129 HA GLU 129 -15.596 18.184 13.376 860 HB2 GLU 129 HB2 GLU 129 -15.076 19.515 10.723 861 HB3 GLU 129 HB1 GLU 129 -14.967 20.270 12.305 862 HG2 GLU 129 HG2 GLU 129 -13.132 18.783 12.896 863 HG3 GLU 129 HG1 GLU 129 -13.241 18.018 11.312 864 H SER 130 HN SER 130 -17.393 17.976 10.341 865 HA SER 130 HA SER 130 -19.214 20.053 11.303 866 HB2 SER 130 HB2 SER 130 -18.338 20.258 9.009 867 HB3 SER 130 HB1 SER 130 -19.072 18.713 8.593 868 HG SER 130 HG SER 130 -20.830 20.505 9.704 869 H GLY 131 HN GLY 131 -18.972 16.715 11.301 870 HA2 GLY 131 HA2 GLY 131 -20.411 15.089 12.039 871 HA3 GLY 131 HA1 GLY 131 -21.481 16.384 12.554 872 H LEU 132 HN LEU 132 -20.439 16.022 9.251 873 HA LEU 132 HA LEU 132 -22.896 16.331 8.078 874 HB2 LEU 132 HB2 LEU 132 -20.777 16.514 6.905 875 HB3 LEU 132 HB1 LEU 132 -20.500 14.796 7.084 876 HG LEU 132 HG LEU 132 -22.596 14.452 5.684 877 HD11 LEU 132 HD11 LEU 132 -23.491 16.718 5.950 878 HD12 LEU 132 HD12 LEU 132 -23.261 16.292 4.254 879 HD13 LEU 132 HD13 LEU 132 -22.110 17.358 5.060 880 HD21 LEU 132 HD21 LEU 132 -21.370 14.768 3.610 881 HD22 LEU 132 HD22 LEU 132 -20.314 14.122 4.869 882 HD23 LEU 132 HD23 LEU 132 -20.227 15.828 4.436 883 H THR 133 HN THR 133 -21.276 13.299 8.907 884 HA THR 133 HA THR 133 -22.046 11.218 9.338 885 HB THR 133 HB THR 133 -24.845 12.337 9.117 886 HG1 THR 133 HG1 THR 133 -23.700 13.502 10.693 887 HG21 THR 133 HG21 THR 133 -23.775 9.947 10.621 888 HG22 THR 133 HG22 THR 133 -24.643 9.870 9.089 889 HG23 THR 133 HG23 THR 133 -25.456 10.465 10.536 Start of MODEL 14 1 H1 MET 1 HT1 MET 1 36.261 -1.021 1.261 2 H2 MET 1 HT2 MET 1 36.211 -0.259 -0.243 3 H3 MET 1 HT3 MET 1 35.268 -1.634 0.039 4 HA MET 1 HA MET 1 34.951 0.976 1.405 5 HB2 MET 1 HB2 MET 1 33.171 -0.360 -0.645 6 HB3 MET 1 HB1 MET 1 32.860 1.174 0.150 7 HG2 MET 1 HG2 MET 1 34.850 2.119 -0.931 8 HG3 MET 1 HG1 MET 1 35.108 0.585 -1.760 9 HE1 MET 1 HE1 MET 1 31.844 0.383 -3.979 10 HE2 MET 1 HE2 MET 1 31.963 -0.190 -2.317 11 HE3 MET 1 HE3 MET 1 33.290 -0.472 -3.443 12 H ASP 2 HN ASP 2 35.254 -0.805 3.210 13 HA ASP 2 HA ASP 2 32.620 -2.017 3.748 14 HB2 ASP 2 HB2 ASP 2 35.308 -2.767 4.923 15 HB3 ASP 2 HB1 ASP 2 33.778 -3.558 5.270 16 H SER 3 HN SER 3 35.403 -0.912 5.657 17 HA SER 3 HA SER 3 33.691 -0.116 7.828 18 HB2 SER 3 HB2 SER 3 36.666 0.341 7.536 19 HB3 SER 3 HB1 SER 3 35.728 0.292 9.030 20 HG SER 3 HG SER 3 35.700 -1.832 8.970 21 H ALA 4 HN ALA 4 34.593 1.341 4.991 22 HA ALA 4 HA ALA 4 34.970 4.023 5.928 23 HB1 ALA 4 HB1 ALA 4 34.816 4.641 3.556 24 HB2 ALA 4 HB2 ALA 4 34.338 2.989 3.166 25 HB3 ALA 4 HB3 ALA 4 35.944 3.312 3.818 26 H ILE 5 HN ILE 5 32.275 2.014 5.234 27 HA ILE 5 HA ILE 5 30.384 4.158 4.891 28 HB ILE 5 HB ILE 5 29.887 1.230 5.455 29 HG12 ILE 5 HG12 ILE 5 29.978 2.704 2.815 30 HG13 ILE 5 HG11 ILE 5 31.224 1.614 3.408 31 HG21 ILE 5 HG21 ILE 5 27.668 1.644 4.529 32 HG22 ILE 5 HG22 ILE 5 28.068 3.346 4.308 33 HG23 ILE 5 HG23 ILE 5 27.963 2.669 5.934 34 HD11 ILE 5 HD11 ILE 5 29.784 0.546 1.763 35 HD12 ILE 5 HD12 ILE 5 28.382 0.849 2.789 36 HD13 ILE 5 HD13 ILE 5 29.660 -0.236 3.338 37 H SER 6 HN SER 6 29.965 5.427 6.598 38 HA SER 6 HA SER 6 30.091 4.337 9.293 39 HB2 SER 6 HB2 SER 6 29.497 7.183 8.452 40 HB3 SER 6 HB1 SER 6 30.039 6.623 10.033 41 HG SER 6 HG SER 6 31.902 5.768 8.607 42 H LYS 7 HN LYS 7 28.220 5.765 10.678 43 HA LYS 7 HA LYS 7 25.766 4.510 9.952 44 HB2 LYS 7 HB2 LYS 7 26.406 4.922 12.293 45 HB3 LYS 7 HB1 LYS 7 26.317 6.654 12.012 46 HG2 LYS 7 HG2 LYS 7 23.961 6.511 11.595 47 HG3 LYS 7 HG1 LYS 7 24.001 4.756 11.738 48 HD2 LYS 7 HD2 LYS 7 24.792 6.628 13.958 49 HD3 LYS 7 HD1 LYS 7 23.164 5.987 13.763 50 HE2 LYS 7 HE2 LYS 7 25.637 4.286 14.048 51 HE3 LYS 7 HE1 LYS 7 24.576 4.725 15.385 52 HZ1 LYS 7 HZ1 LYS 7 23.722 3.207 12.969 53 HZ2 LYS 7 HZ2 LYS 7 22.771 3.565 14.323 54 HZ3 LYS 7 HZ3 LYS 7 24.088 2.521 14.474 55 H GLU 8 HN GLU 8 27.309 7.363 9.020 56 HA GLU 8 HA GLU 8 25.242 9.118 8.438 57 HB2 GLU 8 HB2 GLU 8 27.829 8.556 6.985 58 HB3 GLU 8 HB1 GLU 8 26.769 9.903 6.587 59 HG2 GLU 8 HG2 GLU 8 28.093 9.446 9.251 60 HG3 GLU 8 HG1 GLU 8 28.630 10.584 8.014 61 H ASP 9 HN ASP 9 26.702 6.702 6.267 62 HA ASP 9 HA ASP 9 24.808 6.970 4.193 63 HB2 ASP 9 HB2 ASP 9 27.018 5.939 3.875 64 HB3 ASP 9 HB1 ASP 9 26.553 4.604 4.920 65 H GLU 10 HN GLU 10 24.994 4.889 7.003 66 HA GLU 10 HA GLU 10 22.919 3.114 6.426 67 HB2 GLU 10 HB2 GLU 10 24.503 2.700 8.206 68 HB3 GLU 10 HB1 GLU 10 23.971 4.138 9.064 69 HG2 GLU 10 HG2 GLU 10 21.763 3.097 9.377 70 HG3 GLU 10 HG1 GLU 10 22.370 1.638 8.595 71 H GLU 11 HN GLU 11 22.767 5.883 8.661 72 HA GLU 11 HA GLU 11 20.038 5.860 9.075 73 HB2 GLU 11 HB2 GLU 11 22.043 8.098 9.184 74 HB3 GLU 11 HB1 GLU 11 20.366 8.308 9.669 75 HG2 GLU 11 HG2 GLU 11 22.132 6.189 10.844 76 HG3 GLU 11 HG1 GLU 11 22.045 7.824 11.500 77 H ARG 12 HN ARG 12 21.840 7.101 6.378 78 HA ARG 12 HA ARG 12 19.900 8.861 5.335 79 HB2 ARG 12 HB2 ARG 12 22.281 8.786 4.611 80 HB3 ARG 12 HB1 ARG 12 21.963 7.251 3.817 81 HG2 ARG 12 HG2 ARG 12 21.953 9.001 2.186 82 HG3 ARG 12 HG1 ARG 12 20.312 8.382 2.371 83 HD2 ARG 12 HD2 ARG 12 19.767 10.275 3.821 84 HD3 ARG 12 HD1 ARG 12 21.410 10.886 3.644 85 HE ARG 12 HE ARG 12 19.821 10.520 1.221 86 HH11 ARG 12 HH11 ARG 12 21.200 12.698 3.592 87 HH12 ARG 12 HH12 ARG 12 21.020 14.103 2.589 88 HH21 ARG 12 HH21 ARG 12 19.559 12.374 -0.093 89 HH22 ARG 12 HH22 ARG 12 20.078 13.922 0.500 90 H TYR 13 HN TYR 13 20.533 5.416 4.800 91 HA TYR 13 HA TYR 13 18.316 5.130 2.994 92 HB2 TYR 13 HB2 TYR 13 20.168 3.658 2.673 93 HB3 TYR 13 HB1 TYR 13 20.137 3.146 4.357 94 HD1 TYR 13 HD1 TYR 13 17.763 3.269 1.467 95 HD2 TYR 13 HD2 TYR 13 19.315 1.043 4.739 96 HE1 TYR 13 HE1 TYR 13 16.292 1.388 0.871 97 HE2 TYR 13 HE2 TYR 13 17.865 -0.855 4.148 98 HH TYR 13 HH TYR 13 16.345 -1.174 1.232 99 H GLN 14 HN GLN 14 19.002 4.232 6.351 100 HA GLN 14 HA GLN 14 16.708 2.825 6.978 101 HB2 GLN 14 HB2 GLN 14 18.256 4.743 8.721 102 HB3 GLN 14 HB1 GLN 14 17.087 3.576 9.312 103 HG2 GLN 14 HG2 GLN 14 19.635 2.922 7.854 104 HG3 GLN 14 HG1 GLN 14 19.394 2.834 9.594 105 HE21 GLN 14 HE21 GLN 14 16.676 1.779 9.328 106 HE22 GLN 14 HE22 GLN 14 16.854 0.131 8.843 107 H LYS 15 HN LYS 15 17.240 6.293 7.525 108 HA LYS 15 HA LYS 15 14.683 6.893 8.388 109 HB2 LYS 15 HB2 LYS 15 16.668 8.643 6.943 110 HB3 LYS 15 HB1 LYS 15 15.186 9.246 7.677 111 HG2 LYS 15 HG2 LYS 15 17.412 7.832 9.134 112 HG3 LYS 15 HG1 LYS 15 17.125 9.574 9.126 113 HD2 LYS 15 HD2 LYS 15 15.112 9.352 10.326 114 HD3 LYS 15 HD1 LYS 15 15.027 7.617 10.030 115 HE2 LYS 15 HE2 LYS 15 15.694 8.060 12.315 116 HE3 LYS 15 HE1 LYS 15 16.999 7.284 11.422 117 HZ1 LYS 15 HZ1 LYS 15 17.844 9.083 12.764 118 HZ2 LYS 15 HZ2 LYS 15 16.786 10.182 12.040 119 HZ3 LYS 15 HZ3 LYS 15 18.020 9.469 11.130 120 H LEU 16 HN LEU 16 15.899 6.576 5.107 121 HA LEU 16 HA LEU 16 13.681 7.781 3.827 122 HB2 LEU 16 HB2 LEU 16 15.957 7.326 2.827 123 HB3 LEU 16 HB1 LEU 16 15.458 5.650 2.662 124 HG LEU 16 HG LEU 16 13.759 6.220 1.065 125 HD11 LEU 16 HD11 LEU 16 13.364 8.575 0.412 126 HD12 LEU 16 HD12 LEU 16 14.418 9.095 1.724 127 HD13 LEU 16 HD13 LEU 16 12.910 8.251 2.083 128 HD21 LEU 16 HD21 LEU 16 15.097 7.187 -0.695 129 HD22 LEU 16 HD22 LEU 16 16.068 6.070 0.268 130 HD23 LEU 16 HD23 LEU 16 16.246 7.811 0.489 131 H VAL 17 HN VAL 17 14.485 4.400 4.520 132 HA VAL 17 HA VAL 17 12.119 3.318 3.404 133 HB VAL 17 HB VAL 17 12.718 1.268 4.306 134 HG11 VAL 17 HG11 VAL 17 15.152 1.104 4.137 135 HG12 VAL 17 HG12 VAL 17 15.256 2.863 4.237 136 HG13 VAL 17 HG13 VAL 17 14.460 2.103 2.857 137 HG21 VAL 17 HG21 VAL 17 14.167 2.686 6.541 138 HG22 VAL 17 HG22 VAL 17 14.066 0.937 6.323 139 HG23 VAL 17 HG23 VAL 17 12.607 1.872 6.667 140 H THR 18 HN THR 18 12.934 4.638 6.523 141 HA THR 18 HA THR 18 10.664 3.855 7.960 142 HB THR 18 HB THR 18 12.900 5.613 8.331 143 HG1 THR 18 HG1 THR 18 12.757 4.776 10.289 144 HG21 THR 18 HG21 THR 18 11.849 7.308 9.785 145 HG22 THR 18 HG22 THR 18 10.261 6.766 9.232 146 HG23 THR 18 HG23 THR 18 11.402 7.483 8.083 147 H GLU 19 HN GLU 19 11.322 6.741 6.019 148 HA GLU 19 HA GLU 19 8.869 8.024 6.270 149 HB2 GLU 19 HB2 GLU 19 10.765 7.902 3.906 150 HB3 GLU 19 HB1 GLU 19 9.469 9.082 4.102 151 HG2 GLU 19 HG2 GLU 19 11.613 8.749 6.166 152 HG3 GLU 19 HG1 GLU 19 11.847 9.767 4.757 153 H ASN 20 HN ASN 20 9.971 5.590 4.000 154 HA ASN 20 HA ASN 20 7.733 5.431 2.341 155 HB2 ASN 20 HB2 ASN 20 10.102 4.398 2.131 156 HB3 ASN 20 HB1 ASN 20 9.444 3.062 3.064 157 HD21 ASN 20 HD21 ASN 20 10.476 3.212 0.345 158 HD22 ASN 20 HD22 ASN 20 9.231 2.607 -0.679 159 H GLU 21 HN GLU 21 8.554 3.555 5.268 160 HA GLU 21 HA GLU 21 6.267 1.934 5.252 161 HB2 GLU 21 HB2 GLU 21 7.944 2.806 7.596 162 HB3 GLU 21 HB1 GLU 21 6.875 1.408 7.546 163 HG2 GLU 21 HG2 GLU 21 9.113 1.743 5.607 164 HG3 GLU 21 HG1 GLU 21 9.374 1.036 7.191 165 H GLN 22 HN GLN 22 6.859 5.125 6.646 166 HA GLN 22 HA GLN 22 4.646 5.275 8.359 167 HB2 GLN 22 HB2 GLN 22 5.753 7.585 6.763 168 HB3 GLN 22 HB1 GLN 22 4.862 7.669 8.273 169 HG2 GLN 22 HG2 GLN 22 6.734 6.572 9.426 170 HG3 GLN 22 HG1 GLN 22 7.635 6.553 7.910 171 HE21 GLN 22 HE21 GLN 22 8.283 7.851 10.423 172 HE22 GLN 22 HE22 GLN 22 8.449 9.534 10.066 173 H LEU 23 HN LEU 23 4.982 6.610 5.082 174 HA LEU 23 HA LEU 23 2.266 7.503 5.232 175 HB2 LEU 23 HB2 LEU 23 2.723 8.897 3.469 176 HB3 LEU 23 HB1 LEU 23 4.259 8.773 4.278 177 HG LEU 23 HG LEU 23 3.473 7.451 1.704 178 HD11 LEU 23 HD11 LEU 23 5.225 8.879 0.779 179 HD12 LEU 23 HD12 LEU 23 5.464 9.596 2.372 180 HD13 LEU 23 HD13 LEU 23 3.932 9.815 1.528 181 HD21 LEU 23 HD21 LEU 23 5.775 6.658 1.567 182 HD22 LEU 23 HD22 LEU 23 4.930 5.950 2.945 183 HD23 LEU 23 HD23 LEU 23 6.079 7.266 3.194 184 H GLN 24 HN GLN 24 3.848 4.761 3.851 185 HA GLN 24 HA GLN 24 1.864 4.076 1.954 186 HB2 GLN 24 HB2 GLN 24 2.735 1.835 2.027 187 HB3 GLN 24 HB1 GLN 24 4.095 2.941 2.161 188 HG2 GLN 24 HG2 GLN 24 4.159 2.580 4.569 189 HG3 GLN 24 HG1 GLN 24 2.786 1.485 4.444 190 HE21 GLN 24 HE21 GLN 24 5.401 1.643 2.117 191 HE22 GLN 24 HE22 GLN 24 6.056 0.084 2.476 192 H ARG 25 HN ARG 25 2.122 3.695 5.416 193 HA ARG 25 HA ARG 25 -0.195 2.111 5.805 194 HB2 ARG 25 HB2 ARG 25 1.035 2.023 7.719 195 HB3 ARG 25 HB1 ARG 25 1.753 3.604 7.442 196 HG2 ARG 25 HG2 ARG 25 -0.612 4.470 8.057 197 HG3 ARG 25 HG1 ARG 25 -0.781 2.893 8.833 198 HD2 ARG 25 HD2 ARG 25 1.200 3.326 10.175 199 HD3 ARG 25 HD1 ARG 25 1.449 4.866 9.343 200 HE ARG 25 HE ARG 25 -1.103 4.928 10.440 201 HH11 ARG 25 HH11 ARG 25 2.194 4.693 11.594 202 HH12 ARG 25 HH12 ARG 25 1.870 5.551 13.067 203 HH21 ARG 25 HH21 ARG 25 -1.528 6.064 12.360 204 HH22 ARG 25 HH22 ARG 25 -0.248 6.339 13.497 205 H LEU 26 HN LEU 26 0.523 5.565 5.966 206 HA LEU 26 HA LEU 26 -1.985 6.475 6.786 207 HB2 LEU 26 HB2 LEU 26 0.040 7.882 5.040 208 HB3 LEU 26 HB1 LEU 26 -1.248 8.655 5.953 209 HG LEU 26 HG LEU 26 1.012 7.086 7.202 210 HD11 LEU 26 HD11 LEU 26 1.806 9.151 6.114 211 HD12 LEU 26 HD12 LEU 26 1.962 9.184 7.868 212 HD13 LEU 26 HD13 LEU 26 0.656 10.074 7.082 213 HD21 LEU 26 HD21 LEU 26 -1.118 8.848 8.406 214 HD22 LEU 26 HD22 LEU 26 0.228 8.123 9.284 215 HD23 LEU 26 HD23 LEU 26 -1.002 7.094 8.551 216 H ILE 27 HN ILE 27 -0.664 5.911 3.558 217 HA ILE 27 HA ILE 27 -2.888 6.664 2.038 218 HB ILE 27 HB ILE 27 -0.896 4.441 1.565 219 HG12 ILE 27 HG12 ILE 27 -1.074 7.208 0.364 220 HG13 ILE 27 HG11 ILE 27 0.019 6.747 1.676 221 HG21 ILE 27 HG21 ILE 27 -2.924 5.623 -0.327 222 HG22 ILE 27 HG22 ILE 27 -2.885 3.970 0.287 223 HG23 ILE 27 HG23 ILE 27 -1.614 4.540 -0.795 224 HD11 ILE 27 HD11 ILE 27 1.120 5.162 0.219 225 HD12 ILE 27 HD12 ILE 27 1.125 6.772 -0.504 226 HD13 ILE 27 HD13 ILE 27 -0.003 5.548 -1.083 227 H THR 28 HN THR 28 -1.990 3.428 3.217 228 HA THR 28 HA THR 28 -4.214 2.065 2.311 229 HB THR 28 HB THR 28 -1.956 1.343 3.664 230 HG1 THR 28 HG1 THR 28 -2.736 -0.200 2.421 231 HG21 THR 28 HG21 THR 28 -2.740 0.034 5.641 232 HG22 THR 28 HG22 THR 28 -4.289 0.874 5.529 233 HG23 THR 28 HG23 THR 28 -2.813 1.782 5.874 234 H GLN 29 HN GLN 29 -3.852 3.921 5.293 235 HA GLN 29 HA GLN 29 -6.212 3.102 6.589 236 HB2 GLN 29 HB2 GLN 29 -4.852 5.803 6.667 237 HB3 GLN 29 HB1 GLN 29 -6.054 5.235 7.816 238 HG2 GLN 29 HG2 GLN 29 -3.384 3.936 7.367 239 HG3 GLN 29 HG1 GLN 29 -3.729 5.120 8.623 240 HE21 GLN 29 HE21 GLN 29 -4.203 1.865 7.546 241 HE22 GLN 29 HE22 GLN 29 -4.878 1.258 9.016 242 H LYS 30 HN LYS 30 -5.585 6.043 4.753 243 HA LYS 30 HA LYS 30 -8.233 6.944 4.649 244 HB2 LYS 30 HB2 LYS 30 -6.026 7.513 2.661 245 HB3 LYS 30 HB1 LYS 30 -7.446 8.505 2.967 246 HG2 LYS 30 HG2 LYS 30 -6.662 9.037 5.180 247 HG3 LYS 30 HG1 LYS 30 -5.305 7.924 5.004 248 HD2 LYS 30 HD2 LYS 30 -4.479 9.305 3.115 249 HD3 LYS 30 HD1 LYS 30 -5.781 10.454 3.431 250 HE2 LYS 30 HE2 LYS 30 -3.641 9.665 5.405 251 HE3 LYS 30 HE1 LYS 30 -3.631 11.135 4.435 252 HZ1 LYS 30 HZ1 LYS 30 -5.668 10.415 6.472 253 HZ2 LYS 30 HZ2 LYS 30 -5.679 11.818 5.527 254 HZ3 LYS 30 HZ3 LYS 30 -4.445 11.568 6.651 255 H GLU 31 HN GLU 31 -6.336 5.040 2.343 256 HA GLU 31 HA GLU 31 -8.086 5.000 0.204 257 HB2 GLU 31 HB2 GLU 31 -6.006 3.085 1.181 258 HB3 GLU 31 HB1 GLU 31 -7.004 2.666 -0.205 259 HG2 GLU 31 HG2 GLU 31 -5.536 5.268 -0.099 260 HG3 GLU 31 HG1 GLU 31 -4.733 3.784 -0.609 261 H GLU 32 HN GLU 32 -7.912 2.569 2.843 262 HA GLU 32 HA GLU 32 -10.010 0.999 1.801 263 HB2 GLU 32 HB2 GLU 32 -10.134 -0.009 4.083 264 HB3 GLU 32 HB1 GLU 32 -8.525 -0.009 3.378 265 HG2 GLU 32 HG2 GLU 32 -7.877 1.862 4.753 266 HG3 GLU 32 HG1 GLU 32 -9.517 1.988 5.399 267 H LYS 33 HN LYS 33 -10.012 3.795 3.897 268 HA LYS 33 HA LYS 33 -12.760 3.599 4.644 269 HB2 LYS 33 HB2 LYS 33 -10.970 6.035 4.552 270 HB3 LYS 33 HB1 LYS 33 -12.502 5.911 5.405 271 HG2 LYS 33 HG2 LYS 33 -11.569 4.216 6.873 272 HG3 LYS 33 HG1 LYS 33 -10.039 4.286 5.998 273 HD2 LYS 33 HD2 LYS 33 -9.777 5.596 7.960 274 HD3 LYS 33 HD1 LYS 33 -9.922 6.720 6.609 275 HE2 LYS 33 HE2 LYS 33 -11.237 7.455 8.534 276 HE3 LYS 33 HE1 LYS 33 -12.266 7.091 7.150 277 HZ1 LYS 33 HZ1 LYS 33 -13.140 6.215 9.251 278 HZ2 LYS 33 HZ2 LYS 33 -11.770 5.236 9.415 279 HZ3 LYS 33 HZ3 LYS 33 -12.838 4.990 8.126 280 H ILE 34 HN ILE 34 -10.971 5.406 2.185 281 HA ILE 34 HA ILE 34 -13.213 6.686 1.043 282 HB ILE 34 HB ILE 34 -10.512 6.052 -0.169 283 HG12 ILE 34 HG12 ILE 34 -11.500 8.754 0.683 284 HG13 ILE 34 HG11 ILE 34 -10.834 7.640 1.883 285 HG21 ILE 34 HG21 ILE 34 -12.747 7.789 -1.186 286 HG22 ILE 34 HG22 ILE 34 -12.062 6.358 -1.959 287 HG23 ILE 34 HG23 ILE 34 -11.094 7.829 -1.805 288 HD11 ILE 34 HD11 ILE 34 -9.395 8.624 -0.572 289 HD12 ILE 34 HD12 ILE 34 -8.734 7.549 0.662 290 HD13 ILE 34 HD13 ILE 34 -9.154 9.212 1.072 291 H ARG 35 HN ARG 35 -11.800 3.516 0.592 292 HA ARG 35 HA ARG 35 -12.971 2.679 -1.773 293 HB2 ARG 35 HB2 ARG 35 -12.542 1.137 0.783 294 HB3 ARG 35 HB1 ARG 35 -13.087 0.390 -0.710 295 HG2 ARG 35 HG2 ARG 35 -10.468 1.816 -0.298 296 HG3 ARG 35 HG1 ARG 35 -10.706 0.070 -0.392 297 HD2 ARG 35 HD2 ARG 35 -11.531 0.313 -2.684 298 HD3 ARG 35 HD1 ARG 35 -11.285 2.055 -2.588 299 HE ARG 35 HE ARG 35 -9.260 0.012 -2.923 300 HH11 ARG 35 HH11 ARG 35 -9.942 3.337 -2.091 301 HH12 ARG 35 HH12 ARG 35 -8.341 3.904 -2.449 302 HH21 ARG 35 HH21 ARG 35 -7.139 0.753 -3.420 303 HH22 ARG 35 HH22 ARG 35 -6.750 2.435 -3.215 304 H VAL 36 HN VAL 36 -14.362 2.666 1.481 305 HA VAL 36 HA VAL 36 -16.843 1.539 0.727 306 HB VAL 36 HB VAL 36 -16.405 3.381 3.070 307 HG11 VAL 36 HG11 VAL 36 -18.323 1.124 2.520 308 HG12 VAL 36 HG12 VAL 36 -18.710 2.839 2.700 309 HG13 VAL 36 HG13 VAL 36 -18.140 1.912 4.090 310 HG21 VAL 36 HG21 VAL 36 -15.716 1.449 4.359 311 HG22 VAL 36 HG22 VAL 36 -14.631 1.672 2.983 312 HG23 VAL 36 HG23 VAL 36 -15.871 0.418 2.937 313 H LEU 37 HN LEU 37 -15.726 4.864 1.095 314 HA LEU 37 HA LEU 37 -18.154 6.155 0.504 315 HB2 LEU 37 HB2 LEU 37 -15.294 6.888 0.513 316 HB3 LEU 37 HB1 LEU 37 -16.327 7.878 -0.505 317 HG LEU 37 HG LEU 37 -15.926 8.698 1.873 318 HD11 LEU 37 HD11 LEU 37 -18.756 8.264 0.929 319 HD12 LEU 37 HD12 LEU 37 -17.685 9.581 0.441 320 HD13 LEU 37 HD13 LEU 37 -18.238 9.464 2.115 321 HD21 LEU 37 HD21 LEU 37 -17.275 7.711 3.624 322 HD22 LEU 37 HD22 LEU 37 -16.175 6.504 2.955 323 HD23 LEU 37 HD23 LEU 37 -17.877 6.491 2.502 324 H ARG 38 HN ARG 38 -15.549 4.981 -1.525 325 HA ARG 38 HA ARG 38 -16.526 5.935 -3.975 326 HB2 ARG 38 HB2 ARG 38 -14.412 5.298 -4.352 327 HB3 ARG 38 HB1 ARG 38 -14.419 4.186 -2.997 328 HG2 ARG 38 HG2 ARG 38 -15.473 2.493 -4.387 329 HG3 ARG 38 HG1 ARG 38 -15.456 3.606 -5.760 330 HD2 ARG 38 HD2 ARG 38 -13.040 3.715 -5.678 331 HD3 ARG 38 HD1 ARG 38 -13.016 2.698 -4.243 332 HE ARG 38 HE ARG 38 -14.332 1.354 -6.349 333 HH11 ARG 38 HH11 ARG 38 -11.128 2.405 -5.392 334 HH12 ARG 38 HH12 ARG 38 -10.326 1.067 -6.146 335 HH21 ARG 38 HH21 ARG 38 -13.270 -0.401 -7.360 336 HH22 ARG 38 HH22 ARG 38 -11.542 -0.524 -7.269 337 H GLN 39 HN GLN 39 -17.029 2.867 -2.248 338 HA GLN 39 HA GLN 39 -18.711 1.588 -4.045 339 HB2 GLN 39 HB2 GLN 39 -18.681 1.657 -1.036 340 HB3 GLN 39 HB1 GLN 39 -19.745 0.601 -1.955 341 HG2 GLN 39 HG2 GLN 39 -16.779 0.607 -2.337 342 HG3 GLN 39 HG1 GLN 39 -17.582 -0.388 -1.124 343 HE21 GLN 39 HE21 GLN 39 -16.073 -1.128 -3.560 344 HE22 GLN 39 HE22 GLN 39 -17.151 -2.103 -4.498 345 H ARG 40 HN ARG 40 -19.518 3.946 -1.535 346 HA ARG 40 HA ARG 40 -22.262 4.105 -1.980 347 HB2 ARG 40 HB2 ARG 40 -20.291 6.222 -1.109 348 HB3 ARG 40 HB1 ARG 40 -22.029 6.385 -1.007 349 HG2 ARG 40 HG2 ARG 40 -22.117 4.459 0.513 350 HG3 ARG 40 HG1 ARG 40 -20.361 4.331 0.420 351 HD2 ARG 40 HD2 ARG 40 -20.933 5.486 2.441 352 HD3 ARG 40 HD1 ARG 40 -20.204 6.641 1.326 353 HE ARG 40 HE ARG 40 -23.094 6.511 1.257 354 HH11 ARG 40 HH11 ARG 40 -20.289 8.112 2.608 355 HH12 ARG 40 HH12 ARG 40 -21.176 9.518 3.102 356 HH21 ARG 40 HH21 ARG 40 -24.261 8.347 1.921 357 HH22 ARG 40 HH22 ARG 40 -23.434 9.645 2.726 358 H LEU 41 HN LEU 41 -19.586 5.918 -3.395 359 HA LEU 41 HA LEU 41 -21.079 7.491 -5.173 360 HB2 LEU 41 HB2 LEU 41 -18.335 6.472 -5.830 361 HB3 LEU 41 HB1 LEU 41 -19.072 7.995 -6.279 362 HG LEU 41 HG LEU 41 -18.117 7.231 -3.522 363 HD11 LEU 41 HD11 LEU 41 -16.310 7.650 -5.089 364 HD12 LEU 41 HD12 LEU 41 -16.430 8.953 -3.908 365 HD13 LEU 41 HD13 LEU 41 -17.044 9.188 -5.545 366 HD21 LEU 41 HD21 LEU 41 -20.084 8.709 -3.453 367 HD22 LEU 41 HD22 LEU 41 -19.234 9.861 -4.486 368 HD23 LEU 41 HD23 LEU 41 -18.617 9.498 -2.870 369 H VAL 42 HN VAL 42 -19.993 4.164 -5.380 370 HA VAL 42 HA VAL 42 -20.314 3.724 -8.130 371 HB VAL 42 HB VAL 42 -20.751 1.809 -5.824 372 HG11 VAL 42 HG11 VAL 42 -21.894 0.971 -7.790 373 HG12 VAL 42 HG12 VAL 42 -20.446 0.014 -7.472 374 HG13 VAL 42 HG13 VAL 42 -20.443 1.215 -8.765 375 HG21 VAL 42 HG21 VAL 42 -18.495 2.660 -5.896 376 HG22 VAL 42 HG22 VAL 42 -18.374 2.281 -7.617 377 HG23 VAL 42 HG23 VAL 42 -18.509 0.979 -6.434 378 H GLU 43 HN GLU 43 -22.648 3.289 -5.477 379 HA GLU 43 HA GLU 43 -24.812 2.650 -7.200 380 HB2 GLU 43 HB2 GLU 43 -24.769 3.612 -4.338 381 HB3 GLU 43 HB1 GLU 43 -26.227 3.098 -5.176 382 HG2 GLU 43 HG2 GLU 43 -25.165 0.882 -5.540 383 HG3 GLU 43 HG1 GLU 43 -23.810 1.418 -4.545 384 H ARG 44 HN ARG 44 -23.509 5.641 -5.954 385 HA ARG 44 HA ARG 44 -25.653 7.299 -6.862 386 HB2 ARG 44 HB2 ARG 44 -22.771 7.959 -6.227 387 HB3 ARG 44 HB1 ARG 44 -24.015 9.153 -6.568 388 HG2 ARG 44 HG2 ARG 44 -25.293 8.321 -4.624 389 HG3 ARG 44 HG1 ARG 44 -23.958 7.222 -4.270 390 HD2 ARG 44 HD2 ARG 44 -22.461 9.075 -3.914 391 HD3 ARG 44 HD1 ARG 44 -23.695 10.222 -4.436 392 HE ARG 44 HE ARG 44 -24.670 8.717 -2.262 393 HH11 ARG 44 HH11 ARG 44 -22.336 11.227 -2.984 394 HH12 ARG 44 HH12 ARG 44 -22.439 11.948 -1.409 395 HH21 ARG 44 HH21 ARG 44 -24.810 9.678 -0.182 396 HH22 ARG 44 HH22 ARG 44 -23.842 11.072 0.181 397 H GLY 45 HN GLY 45 -22.982 5.780 -8.317 398 HA2 GLY 45 HA2 GLY 45 -22.694 5.395 -10.587 399 HA3 GLY 45 HA1 GLY 45 -23.880 6.645 -10.935 400 H ASP 46 HN ASP 46 -21.080 7.120 -8.860 401 HA ASP 46 HA ASP 46 -20.244 9.423 -10.271 402 HB2 ASP 46 HB2 ASP 46 -19.699 9.128 -7.915 403 HB3 ASP 46 HB1 ASP 46 -18.718 7.715 -8.296 404 H ALA 47 HN ALA 47 -19.389 6.052 -10.531 405 HA ALA 47 HA ALA 47 -17.078 6.318 -12.118 406 HB1 ALA 47 HB1 ALA 47 -17.466 3.995 -12.762 407 HB2 ALA 47 HB2 ALA 47 -19.100 4.077 -12.105 408 HB3 ALA 47 HB3 ALA 47 -17.710 4.216 -11.029 409 H LYS 48 HN LYS 48 -20.449 6.643 -12.810 410 HA LYS 48 HA LYS 48 -20.033 6.606 -15.692 411 HB2 LYS 48 HB2 LYS 48 -22.507 6.923 -13.992 412 HB3 LYS 48 HB1 LYS 48 -22.519 7.056 -15.746 413 HG2 LYS 48 HG2 LYS 48 -21.645 4.629 -14.193 414 HG3 LYS 48 HG1 LYS 48 -23.214 4.840 -14.973 415 HD2 LYS 48 HD2 LYS 48 -22.186 4.948 -17.141 416 HD3 LYS 48 HD1 LYS 48 -20.574 4.950 -16.425 417 HE2 LYS 48 HE2 LYS 48 -20.988 2.721 -15.527 418 HE3 LYS 48 HE1 LYS 48 -22.576 2.714 -16.288 419 HZ1 LYS 48 HZ1 LYS 48 -19.971 2.880 -17.700 420 HZ2 LYS 48 HZ2 LYS 48 -21.488 2.903 -18.447 421 HZ3 LYS 48 HZ3 LYS 48 -20.971 1.520 -17.626 422 H GLY 49 HN GLY 49 -19.728 8.769 -13.203 423 HA2 GLY 49 HA2 GLY 49 -20.828 11.117 -14.434 424 HA3 GLY 49 HA1 GLY 49 -19.791 11.068 -13.015 425 H THR 50 HN THR 50 -17.943 9.356 -14.801 426 HA THR 50 HA THR 50 -16.826 11.555 -16.391 427 HB THR 50 HB THR 50 -15.208 9.343 -15.109 428 HG1 THR 50 HG1 THR 50 -16.299 11.426 -13.907 429 HG21 THR 50 HG21 THR 50 -14.362 11.965 -16.354 430 HG22 THR 50 HG22 THR 50 -14.265 10.397 -17.153 431 HG23 THR 50 HG23 THR 50 -13.297 10.714 -15.711 432 H GLU 51 HN GLU 51 -17.354 11.094 -18.399 433 HA GLU 51 HA GLU 51 -17.681 8.439 -19.401 434 HB2 GLU 51 HB2 GLU 51 -18.031 9.591 -21.584 435 HB3 GLU 51 HB1 GLU 51 -19.049 10.202 -20.294 436 HG2 GLU 51 HG2 GLU 51 -17.445 12.060 -19.992 437 HG3 GLU 51 HG1 GLU 51 -16.590 11.488 -21.421 438 H LEU 52 HN LEU 52 -16.560 8.512 -21.920 439 HA LEU 52 HA LEU 52 -14.674 8.274 -23.169 440 HB2 LEU 52 HB2 LEU 52 -13.129 9.462 -20.864 441 HB3 LEU 52 HB1 LEU 52 -12.551 9.227 -22.501 442 HG LEU 52 HG LEU 52 -14.939 10.848 -22.497 443 HD11 LEU 52 HD11 LEU 52 -14.051 12.792 -21.350 444 HD12 LEU 52 HD12 LEU 52 -12.611 11.886 -20.884 445 HD13 LEU 52 HD13 LEU 52 -14.189 11.434 -20.228 446 HD21 LEU 52 HD21 LEU 52 -12.082 11.381 -23.307 447 HD22 LEU 52 HD22 LEU 52 -13.478 12.367 -23.744 448 HD23 LEU 52 HD23 LEU 52 -13.348 10.711 -24.337 449 H ASN 53 HN ASN 53 -15.486 6.721 -20.503 450 HA ASN 53 HA ASN 53 -14.786 4.983 -19.227 451 HB2 ASN 53 HB2 ASN 53 -14.268 2.954 -20.531 452 HB3 ASN 53 HB1 ASN 53 -15.650 3.832 -21.157 453 HD21 ASN 53 HD21 ASN 53 -15.549 4.744 -23.178 454 HD22 ASN 53 HD22 ASN 53 -14.266 4.413 -24.288 455 H GLY 84 HN GLY 84 19.358 -13.898 -15.092 456 HA2 GLY 84 HA2 GLY 84 19.526 -16.493 -13.899 457 HA3 GLY 84 HA1 GLY 84 20.953 -16.111 -14.849 458 HA PRO 85 HA PRO 85 22.525 -14.330 -11.189 459 HB2 PRO 85 HB2 PRO 85 24.660 -13.021 -12.141 460 HB3 PRO 85 HB1 PRO 85 24.561 -14.785 -12.179 461 HG2 PRO 85 HG2 PRO 85 24.025 -12.813 -14.367 462 HG3 PRO 85 HG1 PRO 85 24.943 -14.329 -14.432 463 HD2 PRO 85 HD2 PRO 85 22.354 -14.114 -15.265 464 HD3 PRO 85 HD1 PRO 85 23.047 -15.614 -14.621 465 H LEU 86 HN LEU 86 23.683 -12.102 -10.597 466 HA LEU 86 HA LEU 86 21.807 -10.274 -10.001 467 HB2 LEU 86 HB2 LEU 86 23.538 -8.718 -9.483 468 HB3 LEU 86 HB1 LEU 86 24.115 -10.326 -9.111 469 HG LEU 86 HG LEU 86 24.898 -8.711 -11.548 470 HD11 LEU 86 HD11 LEU 86 25.771 -7.797 -9.450 471 HD12 LEU 86 HD12 LEU 86 27.048 -8.467 -10.463 472 HD13 LEU 86 HD13 LEU 86 26.467 -9.369 -9.064 473 HD21 LEU 86 HD21 LEU 86 25.008 -11.079 -12.029 474 HD22 LEU 86 HD22 LEU 86 25.904 -11.369 -10.537 475 HD23 LEU 86 HD23 LEU 86 26.638 -10.433 -11.839 476 H GLY 87 HN GLY 87 20.408 -9.254 -11.222 477 HA2 GLY 87 HA2 GLY 87 21.348 -8.032 -13.736 478 HA3 GLY 87 HA1 GLY 87 19.679 -8.481 -13.399 479 H SER 88 HN SER 88 19.011 -7.417 -11.128 480 HA SER 88 HA SER 88 19.179 -4.563 -11.582 481 HB2 SER 88 HB2 SER 88 17.629 -6.069 -9.463 482 HB3 SER 88 HB1 SER 88 17.378 -4.400 -9.970 483 HG SER 88 HG SER 88 16.851 -5.245 -12.071 484 H ARG 89 HN ARG 89 20.293 -6.950 -9.273 485 HA ARG 89 HA ARG 89 21.065 -5.269 -7.173 486 HB2 ARG 89 HB2 ARG 89 21.949 -7.967 -8.105 487 HB3 ARG 89 HB1 ARG 89 22.900 -7.144 -6.881 488 HG2 ARG 89 HG2 ARG 89 21.431 -8.562 -5.725 489 HG3 ARG 89 HG1 ARG 89 20.779 -6.937 -5.539 490 HD2 ARG 89 HD2 ARG 89 19.073 -7.353 -7.140 491 HD3 ARG 89 HD1 ARG 89 19.828 -8.865 -7.642 492 HE ARG 89 HE ARG 89 19.161 -8.883 -4.870 493 HH11 ARG 89 HH11 ARG 89 17.773 -9.236 -8.060 494 HH12 ARG 89 HH12 ARG 89 16.518 -10.315 -7.540 495 HH21 ARG 89 HH21 ARG 89 17.504 -10.317 -4.181 496 HH22 ARG 89 HH22 ARG 89 16.365 -10.927 -5.336 497 H ARG 90 HN ARG 90 23.316 -6.773 -9.481 498 HA ARG 90 HA ARG 90 25.291 -6.106 -10.370 499 HB2 ARG 90 HB2 ARG 90 24.121 -3.333 -10.112 500 HB3 ARG 90 HB1 ARG 90 25.476 -3.797 -11.127 501 HG2 ARG 90 HG2 ARG 90 23.997 -5.242 -12.435 502 HG3 ARG 90 HG1 ARG 90 22.637 -4.742 -11.427 503 HD2 ARG 90 HD2 ARG 90 23.126 -2.379 -12.101 504 HD3 ARG 90 HD1 ARG 90 24.301 -3.016 -13.250 505 HE ARG 90 HE ARG 90 22.026 -4.358 -13.865 506 HH11 ARG 90 HH11 ARG 90 22.812 -0.966 -13.504 507 HH12 ARG 90 HH12 ARG 90 21.625 -0.439 -14.653 508 HH21 ARG 90 HH21 ARG 90 20.456 -3.661 -15.374 509 HH22 ARG 90 HH22 ARG 90 20.279 -1.970 -15.708 510 H PHE 91 HN PHE 91 25.561 -6.711 -7.820 511 HA PHE 91 HA PHE 91 26.933 -6.552 -6.036 512 HB2 PHE 91 HB2 PHE 91 28.285 -4.409 -7.689 513 HB3 PHE 91 HB1 PHE 91 28.923 -5.048 -6.181 514 HD1 PHE 91 HD1 PHE 91 29.573 -7.463 -6.060 515 HD2 PHE 91 HD2 PHE 91 28.599 -5.538 -9.728 516 HE1 PHE 91 HE1 PHE 91 30.704 -9.262 -7.298 517 HE2 PHE 91 HE2 PHE 91 29.725 -7.337 -10.975 518 HZ PHE 91 HZ PHE 91 30.780 -9.203 -9.759 519 H VAL 92 HN VAL 92 28.065 -4.470 -4.653 520 HA VAL 92 HA VAL 92 25.797 -3.267 -3.430 521 HB VAL 92 HB VAL 92 27.915 -3.847 -2.230 522 HG11 VAL 92 HG11 VAL 92 29.514 -3.059 -3.882 523 HG12 VAL 92 HG12 VAL 92 29.798 -2.290 -2.322 524 HG13 VAL 92 HG13 VAL 92 28.995 -1.395 -3.610 525 HG21 VAL 92 HG21 VAL 92 27.915 -1.888 -0.763 526 HG22 VAL 92 HG22 VAL 92 26.276 -2.357 -1.212 527 HG23 VAL 92 HG23 VAL 92 27.039 -0.970 -1.988 528 H VAL 93 HN VAL 93 27.652 -2.465 -6.133 529 HA VAL 93 HA VAL 93 27.828 0.304 -6.073 530 HB VAL 93 HB VAL 93 27.348 -1.372 -8.524 531 HG11 VAL 93 HG11 VAL 93 27.128 1.019 -8.916 532 HG12 VAL 93 HG12 VAL 93 28.583 0.390 -9.689 533 HG13 VAL 93 HG13 VAL 93 28.707 1.296 -8.180 534 HG21 VAL 93 HG21 VAL 93 29.190 -2.297 -7.236 535 HG22 VAL 93 HG22 VAL 93 29.944 -0.706 -7.143 536 HG23 VAL 93 HG23 VAL 93 29.793 -1.521 -8.700 537 H ASP 94 HN ASP 94 25.365 -1.537 -7.924 538 HA ASP 94 HA ASP 94 23.712 0.803 -8.099 539 HB2 ASP 94 HB2 ASP 94 23.159 -2.053 -8.880 540 HB3 ASP 94 HB1 ASP 94 22.009 -0.758 -9.087 541 H ASP 95 HN ASP 95 23.621 -2.223 -6.239 542 HA ASP 95 HA ASP 95 21.119 -2.002 -5.102 543 HB2 ASP 95 HB2 ASP 95 23.661 -3.237 -4.199 544 HB3 ASP 95 HB1 ASP 95 22.411 -2.995 -2.980 545 H ARG 96 HN ARG 96 23.861 -0.020 -4.516 546 HA ARG 96 HA ARG 96 22.907 0.973 -1.977 547 HB2 ARG 96 HB2 ARG 96 25.328 0.920 -2.488 548 HB3 ARG 96 HB1 ARG 96 25.066 2.076 -3.788 549 HG2 ARG 96 HG2 ARG 96 24.244 3.705 -2.135 550 HG3 ARG 96 HG1 ARG 96 24.607 2.552 -0.853 551 HD2 ARG 96 HD2 ARG 96 26.414 4.100 -0.990 552 HD3 ARG 96 HD1 ARG 96 26.976 2.552 -1.618 553 HE ARG 96 HE ARG 96 26.192 3.840 -3.850 554 HH11 ARG 96 HH11 ARG 96 28.270 4.747 -1.191 555 HH12 ARG 96 HH12 ARG 96 29.245 5.818 -2.146 556 HH21 ARG 96 HH21 ARG 96 27.450 5.263 -5.120 557 HH22 ARG 96 HH22 ARG 96 28.777 6.110 -4.388 558 H ARG 97 HN ARG 97 23.581 2.600 -5.067 559 HA ARG 97 HA ARG 97 21.963 4.844 -4.364 560 HB2 ARG 97 HB2 ARG 97 23.915 5.180 -5.729 561 HB3 ARG 97 HB1 ARG 97 23.334 4.040 -6.931 562 HG2 ARG 97 HG2 ARG 97 21.619 6.381 -6.365 563 HG3 ARG 97 HG1 ARG 97 23.133 6.676 -7.218 564 HD2 ARG 97 HD2 ARG 97 22.520 5.109 -8.943 565 HD3 ARG 97 HD1 ARG 97 21.068 4.636 -8.057 566 HE ARG 97 HE ARG 97 20.558 7.190 -8.366 567 HH11 ARG 97 HH11 ARG 97 21.973 4.996 -10.700 568 HH12 ARG 97 HH12 ARG 97 21.347 5.856 -12.070 569 HH21 ARG 97 HH21 ARG 97 19.738 8.320 -10.164 570 HH22 ARG 97 HH22 ARG 97 20.083 7.747 -11.765 571 H GLU 98 HN GLU 98 21.605 2.145 -6.597 572 HA GLU 98 HA GLU 98 19.270 3.089 -7.868 573 HB2 GLU 98 HB2 GLU 98 20.673 0.433 -7.720 574 HB3 GLU 98 HB1 GLU 98 19.129 0.610 -8.572 575 HG2 GLU 98 HG2 GLU 98 21.532 2.310 -9.140 576 HG3 GLU 98 HG1 GLU 98 21.206 0.790 -9.974 577 H LEU 99 HN LEU 99 19.784 0.925 -5.088 578 HA LEU 99 HA LEU 99 17.019 0.203 -4.957 579 HB2 LEU 99 HB2 LEU 99 18.843 -1.216 -4.088 580 HB3 LEU 99 HB1 LEU 99 19.171 -0.017 -2.859 581 HG LEU 99 HG LEU 99 17.812 -2.144 -2.255 582 HD11 LEU 99 HD11 LEU 99 18.220 -0.344 -0.708 583 HD12 LEU 99 HD12 LEU 99 16.543 -0.877 -0.579 584 HD13 LEU 99 HD13 LEU 99 16.931 0.615 -1.438 585 HD21 LEU 99 HD21 LEU 99 15.433 -1.966 -2.514 586 HD22 LEU 99 HD22 LEU 99 16.188 -1.876 -4.105 587 HD23 LEU 99 HD23 LEU 99 15.597 -0.407 -3.323 588 H GLN 100 HN GLN 100 19.076 2.444 -3.059 589 HA GLN 100 HA GLN 100 16.986 3.309 -1.375 590 HB2 GLN 100 HB2 GLN 100 18.405 5.154 -0.750 591 HB3 GLN 100 HB1 GLN 100 19.377 3.701 -0.865 592 HG2 GLN 100 HG2 GLN 100 20.787 4.956 -2.037 593 HG3 GLN 100 HG1 GLN 100 19.641 4.781 -3.363 594 HE21 GLN 100 HE21 GLN 100 17.643 6.468 -1.967 595 HE22 GLN 100 HE22 GLN 100 18.199 8.092 -2.179 596 H TYR 101 HN TYR 101 18.017 4.301 -4.551 597 HA TYR 101 HA TYR 101 16.695 6.705 -4.852 598 HB2 TYR 101 HB2 TYR 101 18.177 5.858 -6.577 599 HB3 TYR 101 HB1 TYR 101 17.093 4.507 -6.895 600 HD1 TYR 101 HD1 TYR 101 17.398 8.198 -7.117 601 HD2 TYR 101 HD2 TYR 101 15.283 4.734 -8.400 602 HE1 TYR 101 HE1 TYR 101 16.218 9.546 -8.801 603 HE2 TYR 101 HE2 TYR 101 14.101 6.076 -10.087 604 HH TYR 101 HH TYR 101 15.055 9.184 -10.974 605 H ARG 102 HN ARG 102 15.395 3.429 -5.432 606 HA ARG 102 HA ARG 102 12.865 4.364 -6.292 607 HB2 ARG 102 HB2 ARG 102 12.162 2.141 -6.344 608 HB3 ARG 102 HB1 ARG 102 13.890 2.031 -6.635 609 HG2 ARG 102 HG2 ARG 102 14.286 1.319 -4.382 610 HG3 ARG 102 HG1 ARG 102 12.598 1.602 -3.952 611 HD2 ARG 102 HD2 ARG 102 11.964 -0.098 -5.673 612 HD3 ARG 102 HD1 ARG 102 13.678 -0.464 -5.861 613 HE ARG 102 HE ARG 102 12.929 -0.647 -3.137 614 HH11 ARG 102 HH11 ARG 102 12.628 -2.339 -6.185 615 HH12 ARG 102 HH12 ARG 102 12.454 -3.900 -5.448 616 HH21 ARG 102 HH21 ARG 102 12.676 -2.694 -2.163 617 HH22 ARG 102 HH22 ARG 102 12.464 -4.101 -3.157 618 H VAL 103 HN VAL 103 14.240 3.927 -3.166 619 HA VAL 103 HA VAL 103 11.777 3.658 -1.739 620 HB VAL 103 HB VAL 103 14.347 4.665 -0.553 621 HG11 VAL 103 HG11 VAL 103 13.581 3.446 1.422 622 HG12 VAL 103 HG12 VAL 103 12.116 2.987 0.552 623 HG13 VAL 103 HG13 VAL 103 12.426 4.684 0.915 624 HG21 VAL 103 HG21 VAL 103 14.922 2.709 -1.903 625 HG22 VAL 103 HG22 VAL 103 13.647 1.786 -1.107 626 HG23 VAL 103 HG23 VAL 103 15.033 2.354 -0.180 627 H GLU 104 HN GLU 104 13.970 6.402 -2.416 628 HA GLU 104 HA GLU 104 12.300 8.248 -1.054 629 HB2 GLU 104 HB2 GLU 104 13.651 10.006 -2.332 630 HB3 GLU 104 HB1 GLU 104 14.468 9.015 -1.139 631 HG2 GLU 104 HG2 GLU 104 15.427 7.656 -2.850 632 HG3 GLU 104 HG1 GLU 104 14.505 8.497 -4.094 633 H VAL 105 HN VAL 105 12.355 7.193 -4.439 634 HA VAL 105 HA VAL 105 10.474 9.184 -5.225 635 HB VAL 105 HB VAL 105 11.325 8.290 -7.142 636 HG11 VAL 105 HG11 VAL 105 12.584 6.485 -6.132 637 HG12 VAL 105 HG12 VAL 105 11.738 5.922 -7.575 638 HG13 VAL 105 HG13 VAL 105 11.109 5.532 -5.973 639 HG21 VAL 105 HG21 VAL 105 8.926 8.206 -7.377 640 HG22 VAL 105 HG22 VAL 105 8.904 6.566 -6.725 641 HG23 VAL 105 HG23 VAL 105 9.680 6.889 -8.274 642 H GLN 106 HN GLN 106 10.147 5.888 -3.948 643 HA GLN 106 HA GLN 106 7.350 5.784 -3.941 644 HB2 GLN 106 HB2 GLN 106 9.399 4.567 -2.081 645 HB3 GLN 106 HB1 GLN 106 7.682 4.231 -1.945 646 HG2 GLN 106 HG2 GLN 106 9.342 3.710 -4.392 647 HG3 GLN 106 HG1 GLN 106 8.921 2.503 -3.181 648 HE21 GLN 106 HE21 GLN 106 7.714 4.532 -5.749 649 HE22 GLN 106 HE22 GLN 106 6.221 3.690 -5.976 650 H ASN 107 HN ASN 107 9.619 7.123 -1.585 651 HA ASN 107 HA ASN 107 7.913 8.042 0.396 652 HB2 ASN 107 HB2 ASN 107 10.418 8.166 0.386 653 HB3 ASN 107 HB1 ASN 107 10.312 9.521 -0.729 654 HD21 ASN 107 HD21 ASN 107 11.560 9.516 1.790 655 HD22 ASN 107 HD22 ASN 107 10.743 10.660 2.795 656 H ARG 108 HN ARG 108 8.706 9.516 -2.727 657 HA ARG 108 HA ARG 108 7.184 11.893 -2.205 658 HB2 ARG 108 HB2 ARG 108 8.505 10.838 -4.701 659 HB3 ARG 108 HB1 ARG 108 7.706 12.397 -4.595 660 HG2 ARG 108 HG2 ARG 108 9.283 13.114 -2.892 661 HG3 ARG 108 HG1 ARG 108 10.067 11.535 -2.944 662 HD2 ARG 108 HD2 ARG 108 11.339 13.119 -4.247 663 HD3 ARG 108 HD1 ARG 108 10.617 11.915 -5.312 664 HE ARG 108 HE ARG 108 8.940 14.187 -5.088 665 HH11 ARG 108 HH11 ARG 108 11.858 13.023 -6.621 666 HH12 ARG 108 HH12 ARG 108 11.795 14.177 -7.914 667 HH21 ARG 108 HH21 ARG 108 8.843 15.710 -6.797 668 HH22 ARG 108 HH22 ARG 108 10.078 15.709 -8.015 669 H VAL 109 HN VAL 109 6.827 9.147 -4.435 670 HA VAL 109 HA VAL 109 4.455 9.969 -5.646 671 HB VAL 109 HB VAL 109 5.344 7.121 -5.189 672 HG11 VAL 109 HG11 VAL 109 3.525 8.286 -7.295 673 HG12 VAL 109 HG12 VAL 109 3.002 7.338 -5.902 674 HG13 VAL 109 HG13 VAL 109 4.006 6.595 -7.150 675 HG21 VAL 109 HG21 VAL 109 7.124 8.344 -6.247 676 HG22 VAL 109 HG22 VAL 109 5.995 9.063 -7.402 677 HG23 VAL 109 HG23 VAL 109 6.336 7.333 -7.461 678 H TYR 110 HN TYR 110 4.939 7.869 -2.822 679 HA TYR 110 HA TYR 110 2.212 7.314 -2.375 680 HB2 TYR 110 HB2 TYR 110 4.629 7.289 -0.579 681 HB3 TYR 110 HB1 TYR 110 3.027 6.887 0.017 682 HD1 TYR 110 HD1 TYR 110 4.347 4.763 0.643 683 HD2 TYR 110 HD2 TYR 110 3.402 5.850 -3.357 684 HE1 TYR 110 HE1 TYR 110 4.644 2.427 -0.054 685 HE2 TYR 110 HE2 TYR 110 3.695 3.517 -4.065 686 HH TYR 110 HH TYR 110 4.882 1.508 -3.314 687 H LYS 111 HN LYS 111 4.306 9.932 -1.387 688 HA LYS 111 HA LYS 111 2.542 11.152 0.457 689 HB2 LYS 111 HB2 LYS 111 5.008 11.563 0.251 690 HB3 LYS 111 HB1 LYS 111 4.687 12.466 -1.218 691 HG2 LYS 111 HG2 LYS 111 3.469 14.129 -0.008 692 HG3 LYS 111 HG1 LYS 111 3.553 13.176 1.476 693 HD2 LYS 111 HD2 LYS 111 5.915 14.346 0.000 694 HD3 LYS 111 HD1 LYS 111 5.199 14.998 1.475 695 HE2 LYS 111 HE2 LYS 111 5.731 12.875 2.625 696 HE3 LYS 111 HE1 LYS 111 6.516 12.300 1.159 697 HZ1 LYS 111 HZ1 LYS 111 8.094 14.117 1.334 698 HZ2 LYS 111 HZ2 LYS 111 8.115 13.171 2.734 699 HZ3 LYS 111 HZ3 LYS 111 7.338 14.669 2.741 700 H LYS 112 HN LYS 112 3.132 11.534 -2.988 701 HA LYS 112 HA LYS 112 1.349 13.637 -3.496 702 HB2 LYS 112 HB2 LYS 112 2.287 11.355 -5.235 703 HB3 LYS 112 HB1 LYS 112 1.336 12.706 -5.835 704 HG2 LYS 112 HG2 LYS 112 3.069 14.247 -5.384 705 HG3 LYS 112 HG1 LYS 112 3.970 13.063 -4.441 706 HD2 LYS 112 HD2 LYS 112 4.965 13.369 -6.647 707 HD3 LYS 112 HD1 LYS 112 4.340 11.734 -6.445 708 HE2 LYS 112 HE2 LYS 112 3.801 12.607 -8.654 709 HE3 LYS 112 HE1 LYS 112 2.339 12.332 -7.712 710 HZ1 LYS 112 HZ1 LYS 112 2.294 14.444 -8.922 711 HZ2 LYS 112 HZ2 LYS 112 3.658 14.971 -8.078 712 HZ3 LYS 112 HZ3 LYS 112 2.210 14.686 -7.252 713 H GLU 113 HN GLU 113 0.862 10.136 -3.320 714 HA GLU 113 HA GLU 113 -1.815 10.072 -4.155 715 HB2 GLU 113 HB2 GLU 113 -0.553 8.305 -2.048 716 HB3 GLU 113 HB1 GLU 113 -2.011 7.956 -2.969 717 HG2 GLU 113 HG2 GLU 113 -0.499 8.107 -5.039 718 HG3 GLU 113 HG1 GLU 113 0.836 7.981 -3.891 719 H ILE 114 HN ILE 114 -0.420 10.378 -0.904 720 HA ILE 114 HA ILE 114 -2.770 10.494 0.558 721 HB ILE 114 HB ILE 114 -0.124 11.837 1.080 722 HG12 ILE 114 HG12 ILE 114 -1.304 9.230 2.052 723 HG13 ILE 114 HG11 ILE 114 -0.069 9.392 0.811 724 HG21 ILE 114 HG21 ILE 114 -2.447 11.357 2.940 725 HG22 ILE 114 HG22 ILE 114 -1.818 12.920 2.418 726 HG23 ILE 114 HG23 ILE 114 -0.840 11.873 3.448 727 HD11 ILE 114 HD11 ILE 114 0.235 10.231 3.677 728 HD12 ILE 114 HD12 ILE 114 1.469 10.310 2.417 729 HD13 ILE 114 HD13 ILE 114 0.860 8.746 2.960 730 H GLN 115 HN GLN 115 -1.013 13.157 -1.005 731 HA GLN 115 HA GLN 115 -2.578 15.256 -0.001 732 HB2 GLN 115 HB2 GLN 115 -1.262 15.127 -2.713 733 HB3 GLN 115 HB1 GLN 115 -1.683 16.575 -1.807 734 HG2 GLN 115 HG2 GLN 115 -0.102 15.853 -0.036 735 HG3 GLN 115 HG1 GLN 115 0.382 14.524 -1.085 736 HE21 GLN 115 HE21 GLN 115 -0.435 17.693 -2.262 737 HE22 GLN 115 HE22 GLN 115 1.158 18.130 -2.752 738 H ALA 116 HN ALA 116 -2.880 13.324 -2.934 739 HA ALA 116 HA ALA 116 -5.278 14.437 -3.905 740 HB1 ALA 116 HB1 ALA 116 -3.821 12.948 -5.224 741 HB2 ALA 116 HB2 ALA 116 -5.495 12.392 -5.204 742 HB3 ALA 116 HB3 ALA 116 -4.290 11.596 -4.189 743 H LEU 117 HN LEU 117 -4.656 11.657 -1.811 744 HA LEU 117 HA LEU 117 -7.322 10.850 -1.445 745 HB2 LEU 117 HB2 LEU 117 -4.959 10.494 0.398 746 HB3 LEU 117 HB1 LEU 117 -6.457 9.591 0.481 747 HG LEU 117 HG LEU 117 -4.552 9.532 -1.857 748 HD11 LEU 117 HD11 LEU 117 -4.955 7.539 0.364 749 HD12 LEU 117 HD12 LEU 117 -3.528 8.542 0.104 750 HD13 LEU 117 HD13 LEU 117 -3.957 7.299 -1.070 751 HD21 LEU 117 HD21 LEU 117 -5.857 7.608 -2.578 752 HD22 LEU 117 HD22 LEU 117 -6.864 9.053 -2.469 753 HD23 LEU 117 HD23 LEU 117 -6.948 7.822 -1.208 754 H ASP 118 HN ASP 118 -5.468 13.380 0.006 755 HA ASP 118 HA ASP 118 -7.011 13.776 2.334 756 HB2 ASP 118 HB2 ASP 118 -4.798 14.774 2.040 757 HB3 ASP 118 HB1 ASP 118 -5.406 15.766 0.722 758 H ALA 119 HN ALA 119 -7.392 14.804 -0.997 759 HA ALA 119 HA ALA 119 -9.643 16.489 -0.561 760 HB1 ALA 119 HB1 ALA 119 -8.363 16.539 -2.647 761 HB2 ALA 119 HB2 ALA 119 -10.073 16.222 -2.951 762 HB3 ALA 119 HB3 ALA 119 -8.905 14.901 -3.018 763 H GLU 120 HN GLU 120 -9.261 13.028 -1.221 764 HA GLU 120 HA GLU 120 -12.007 12.408 -1.171 765 HB2 GLU 120 HB2 GLU 120 -9.493 10.836 -0.807 766 HB3 GLU 120 HB1 GLU 120 -11.036 10.108 -0.425 767 HG2 GLU 120 HG2 GLU 120 -10.329 9.513 -2.641 768 HG3 GLU 120 HG1 GLU 120 -11.804 10.471 -2.693 769 H ILE 121 HN ILE 121 -9.614 12.905 1.354 770 HA ILE 121 HA ILE 121 -11.007 11.917 3.538 771 HB ILE 121 HB ILE 121 -8.906 13.901 3.163 772 HG12 ILE 121 HG12 ILE 121 -8.077 12.877 5.261 773 HG13 ILE 121 HG11 ILE 121 -9.591 11.980 5.394 774 HG21 ILE 121 HG21 ILE 121 -10.769 14.290 5.504 775 HG22 ILE 121 HG22 ILE 121 -10.455 15.439 4.203 776 HG23 ILE 121 HG23 ILE 121 -9.172 15.022 5.337 777 HD11 ILE 121 HD11 ILE 121 -9.085 10.839 3.294 778 HD12 ILE 121 HD12 ILE 121 -7.829 10.586 4.504 779 HD13 ILE 121 HD13 ILE 121 -7.565 11.727 3.184 780 H ARG 122 HN ARG 122 -11.554 14.839 1.665 781 HA ARG 122 HA ARG 122 -13.462 16.002 3.374 782 HB2 ARG 122 HB2 ARG 122 -12.463 17.273 1.550 783 HB3 ARG 122 HB1 ARG 122 -13.200 16.201 0.368 784 HG2 ARG 122 HG2 ARG 122 -14.409 18.312 0.550 785 HG3 ARG 122 HG1 ARG 122 -15.414 16.945 1.038 786 HD2 ARG 122 HD2 ARG 122 -14.749 17.463 3.417 787 HD3 ARG 122 HD1 ARG 122 -14.043 18.960 2.808 788 HE ARG 122 HE ARG 122 -16.451 19.256 1.866 789 HH11 ARG 122 HH11 ARG 122 -15.529 17.974 5.000 790 HH12 ARG 122 HH12 ARG 122 -17.041 18.402 5.756 791 HH21 ARG 122 HH21 ARG 122 -18.405 19.847 2.857 792 HH22 ARG 122 HH22 ARG 122 -18.665 19.488 4.535 793 H LYS 123 HN LYS 123 -13.749 13.597 0.776 794 HA LYS 123 HA LYS 123 -16.582 13.427 0.896 795 HB2 LYS 123 HB2 LYS 123 -16.430 11.672 -0.594 796 HB3 LYS 123 HB1 LYS 123 -14.895 12.471 -0.876 797 HG2 LYS 123 HG2 LYS 123 -13.899 10.819 0.775 798 HG3 LYS 123 HG1 LYS 123 -15.416 9.948 0.651 799 HD2 LYS 123 HD2 LYS 123 -13.153 9.846 -1.060 800 HD3 LYS 123 HD1 LYS 123 -14.644 8.915 -1.149 801 HE2 LYS 123 HE2 LYS 123 -15.678 10.790 -2.377 802 HE3 LYS 123 HE1 LYS 123 -14.116 11.608 -2.364 803 HZ1 LYS 123 HZ1 LYS 123 -13.178 9.813 -3.648 804 HZ2 LYS 123 HZ2 LYS 123 -14.519 10.451 -4.454 805 HZ3 LYS 123 HZ3 LYS 123 -14.647 8.981 -3.631 806 H LEU 124 HN LEU 124 -13.985 11.869 2.658 807 HA LEU 124 HA LEU 124 -15.579 10.067 4.139 808 HB2 LEU 124 HB2 LEU 124 -12.923 11.348 4.768 809 HB3 LEU 124 HB1 LEU 124 -13.656 10.091 5.746 810 HG LEU 124 HG LEU 124 -12.839 9.781 2.851 811 HD11 LEU 124 HD11 LEU 124 -11.058 8.360 3.736 812 HD12 LEU 124 HD12 LEU 124 -11.560 8.747 5.381 813 HD13 LEU 124 HD13 LEU 124 -10.912 10.011 4.337 814 HD21 LEU 124 HD21 LEU 124 -14.723 8.376 3.440 815 HD22 LEU 124 HD22 LEU 124 -13.868 7.788 4.864 816 HD23 LEU 124 HD23 LEU 124 -13.266 7.403 3.251 817 H GLU 125 HN GLU 125 -14.590 13.419 4.675 818 HA GLU 125 HA GLU 125 -15.735 13.712 7.231 819 HB2 GLU 125 HB2 GLU 125 -15.420 15.816 5.086 820 HB3 GLU 125 HB1 GLU 125 -15.695 16.118 6.796 821 HG2 GLU 125 HG2 GLU 125 -13.537 15.055 7.310 822 HG3 GLU 125 HG1 GLU 125 -13.268 14.816 5.587 823 H ARG 126 HN ARG 126 -17.087 13.859 4.006 824 HA ARG 126 HA ARG 126 -19.643 14.840 4.698 825 HB2 ARG 126 HB2 ARG 126 -18.861 12.967 2.452 826 HB3 ARG 126 HB1 ARG 126 -20.380 13.844 2.564 827 HG2 ARG 126 HG2 ARG 126 -19.180 15.962 2.416 828 HG3 ARG 126 HG1 ARG 126 -17.649 15.092 2.332 829 HD2 ARG 126 HD2 ARG 126 -18.309 15.746 0.113 830 HD3 ARG 126 HD1 ARG 126 -18.432 13.995 0.260 831 HE ARG 126 HE ARG 126 -20.908 15.286 0.830 832 HH11 ARG 126 HH11 ARG 126 -18.827 14.233 -1.779 833 HH12 ARG 126 HH12 ARG 126 -20.118 14.098 -2.932 834 HH21 ARG 126 HH21 ARG 126 -22.619 15.114 -0.675 835 HH22 ARG 126 HH22 ARG 126 -22.283 14.609 -2.302 836 H LEU 127 HN LEU 127 -18.181 11.673 4.796 837 HA LEU 127 HA LEU 127 -20.520 10.193 5.496 838 HB2 LEU 127 HB2 LEU 127 -18.478 9.171 4.607 839 HB3 LEU 127 HB1 LEU 127 -17.589 9.668 6.028 840 HG LEU 127 HG LEU 127 -19.415 8.200 7.255 841 HD11 LEU 127 HD11 LEU 127 -20.089 6.290 5.950 842 HD12 LEU 127 HD12 LEU 127 -19.260 6.926 4.530 843 HD13 LEU 127 HD13 LEU 127 -20.669 7.767 5.177 844 HD21 LEU 127 HD21 LEU 127 -17.048 7.092 5.751 845 HD22 LEU 127 HD22 LEU 127 -17.872 6.291 7.089 846 HD23 LEU 127 HD23 LEU 127 -17.026 7.814 7.361 847 H LEU 128 HN LEU 128 -17.840 11.595 7.299 848 HA LEU 128 HA LEU 128 -18.584 10.872 9.882 849 HB2 LEU 128 HB2 LEU 128 -17.129 13.378 9.051 850 HB3 LEU 128 HB1 LEU 128 -17.058 12.601 10.625 851 HG LEU 128 HG LEU 128 -16.026 11.431 8.047 852 HD11 LEU 128 HD11 LEU 128 -13.813 11.791 8.977 853 HD12 LEU 128 HD12 LEU 128 -14.521 12.521 10.420 854 HD13 LEU 128 HD13 LEU 128 -14.685 13.320 8.857 855 HD21 LEU 128 HD21 LEU 128 -15.050 9.700 9.471 856 HD22 LEU 128 HD22 LEU 128 -16.812 9.707 9.548 857 HD23 LEU 128 HD23 LEU 128 -15.869 10.398 10.869 858 H GLU 129 HN GLU 129 -19.043 14.010 8.277 859 HA GLU 129 HA GLU 129 -20.433 15.206 10.411 860 HB2 GLU 129 HB2 GLU 129 -20.275 15.895 7.485 861 HB3 GLU 129 HB1 GLU 129 -21.069 16.919 8.673 862 HG2 GLU 129 HG2 GLU 129 -18.892 17.001 9.905 863 HG3 GLU 129 HG1 GLU 129 -18.160 16.181 8.529 864 H SER 130 HN SER 130 -21.576 13.414 7.603 865 HA SER 130 HA SER 130 -24.316 14.160 7.972 866 HB2 SER 130 HB2 SER 130 -23.357 13.462 5.772 867 HB3 SER 130 HB1 SER 130 -23.211 11.821 6.398 868 HG SER 130 HG SER 130 -25.468 13.248 5.615 869 H GLY 131 HN GLY 131 -22.287 12.118 9.660 870 HA2 GLY 131 HA2 GLY 131 -22.728 10.737 11.448 871 HA3 GLY 131 HA1 GLY 131 -24.437 11.093 11.242 872 H LEU 132 HN LEU 132 -22.463 9.824 8.658 873 HA LEU 132 HA LEU 132 -24.243 7.591 8.371 874 HB2 LEU 132 HB2 LEU 132 -23.048 9.088 6.577 875 HB3 LEU 132 HB1 LEU 132 -21.705 7.992 6.817 876 HG LEU 132 HG LEU 132 -23.023 7.372 4.860 877 HD11 LEU 132 HD11 LEU 132 -23.281 5.430 7.136 878 HD12 LEU 132 HD12 LEU 132 -21.928 5.581 6.018 879 HD13 LEU 132 HD13 LEU 132 -23.496 5.023 5.434 880 HD21 LEU 132 HD21 LEU 132 -25.318 6.594 5.060 881 HD22 LEU 132 HD22 LEU 132 -25.176 8.274 5.578 882 HD23 LEU 132 HD23 LEU 132 -25.317 6.990 6.777 883 H THR 133 HN THR 133 -20.961 8.215 9.439 884 HA THR 133 HA THR 133 -20.955 5.668 10.826 885 HB THR 133 HB THR 133 -18.663 6.425 8.998 886 HG1 THR 133 HG1 THR 133 -20.970 5.060 8.528 887 HG21 THR 133 HG21 THR 133 -17.960 5.215 11.010 888 HG22 THR 133 HG22 THR 133 -17.787 4.206 9.574 889 HG23 THR 133 HG23 THR 133 -19.143 3.954 10.672 Start of MODEL 15 1 H1 MET 1 HT1 MET 1 32.213 -2.287 8.544 2 H2 MET 1 HT2 MET 1 30.903 -1.227 8.680 3 H3 MET 1 HT3 MET 1 31.389 -2.144 10.013 4 HA MET 1 HA MET 1 32.109 0.138 10.235 5 HB2 MET 1 HB2 MET 1 34.346 -1.824 9.696 6 HB3 MET 1 HB1 MET 1 34.536 -0.302 10.552 7 HG2 MET 1 HG2 MET 1 33.076 -1.071 12.315 8 HG3 MET 1 HG1 MET 1 32.772 -2.571 11.440 9 HE1 MET 1 HE1 MET 1 34.938 -3.799 14.452 10 HE2 MET 1 HE2 MET 1 33.445 -4.028 13.541 11 HE3 MET 1 HE3 MET 1 33.700 -2.543 14.458 12 H ASP 2 HN ASP 2 31.714 1.621 8.636 13 HA ASP 2 HA ASP 2 33.638 1.672 6.401 14 HB2 ASP 2 HB2 ASP 2 30.777 2.642 6.504 15 HB3 ASP 2 HB1 ASP 2 31.884 3.003 5.184 16 H SER 3 HN SER 3 34.595 3.593 5.872 17 HA SER 3 HA SER 3 34.621 5.596 7.985 18 HB2 SER 3 HB2 SER 3 36.375 5.380 5.528 19 HB3 SER 3 HB1 SER 3 36.664 6.384 6.947 20 HG SER 3 HG SER 3 37.404 4.705 7.992 21 H ALA 4 HN ALA 4 34.107 5.356 4.482 22 HA ALA 4 HA ALA 4 33.382 8.105 4.173 23 HB1 ALA 4 HB1 ALA 4 32.663 7.443 1.925 24 HB2 ALA 4 HB2 ALA 4 32.860 5.746 2.360 25 HB3 ALA 4 HB3 ALA 4 34.265 6.810 2.298 26 H ILE 5 HN ILE 5 31.561 5.058 4.279 27 HA ILE 5 HA ILE 5 29.036 6.450 4.521 28 HB ILE 5 HB ILE 5 29.574 3.503 4.938 29 HG12 ILE 5 HG12 ILE 5 28.776 4.884 2.369 30 HG13 ILE 5 HG11 ILE 5 30.400 4.308 2.722 31 HG21 ILE 5 HG21 ILE 5 27.063 4.973 4.142 32 HG22 ILE 5 HG22 ILE 5 27.412 4.339 5.750 33 HG23 ILE 5 HG23 ILE 5 27.222 3.234 4.389 34 HD11 ILE 5 HD11 ILE 5 29.210 2.747 1.307 35 HD12 ILE 5 HD12 ILE 5 27.927 2.609 2.508 36 HD13 ILE 5 HD13 ILE 5 29.549 2.026 2.881 37 H SER 6 HN SER 6 28.969 7.572 6.434 38 HA SER 6 HA SER 6 29.805 6.196 8.874 39 HB2 SER 6 HB2 SER 6 28.894 9.061 8.490 40 HB3 SER 6 HB1 SER 6 29.657 8.388 9.928 41 HG SER 6 HG SER 6 31.006 8.118 7.498 42 H LYS 7 HN LYS 7 28.196 6.983 10.830 43 HA LYS 7 HA LYS 7 25.770 5.669 10.488 44 HB2 LYS 7 HB2 LYS 7 26.837 6.182 12.656 45 HB3 LYS 7 HB1 LYS 7 26.452 7.880 12.429 46 HG2 LYS 7 HG2 LYS 7 24.920 6.802 13.950 47 HG3 LYS 7 HG1 LYS 7 24.083 7.377 12.514 48 HD2 LYS 7 HD2 LYS 7 23.246 5.191 13.087 49 HD3 LYS 7 HD1 LYS 7 24.180 5.070 11.599 50 HE2 LYS 7 HE2 LYS 7 24.685 3.208 13.068 51 HE3 LYS 7 HE1 LYS 7 26.100 4.242 12.887 52 HZ1 LYS 7 HZ1 LYS 7 25.753 3.555 15.182 53 HZ2 LYS 7 HZ2 LYS 7 24.232 4.287 15.193 54 HZ3 LYS 7 HZ3 LYS 7 25.621 5.233 15.023 55 H GLU 8 HN GLU 8 26.751 8.909 9.805 56 HA GLU 8 HA GLU 8 24.341 10.232 9.451 57 HB2 GLU 8 HB2 GLU 8 26.951 10.457 7.949 58 HB3 GLU 8 HB1 GLU 8 25.629 11.610 7.797 59 HG2 GLU 8 HG2 GLU 8 27.102 10.976 10.342 60 HG3 GLU 8 HG1 GLU 8 27.375 12.388 9.322 61 H ASP 9 HN ASP 9 26.218 8.381 7.045 62 HA ASP 9 HA ASP 9 24.212 8.704 5.015 63 HB2 ASP 9 HB2 ASP 9 26.745 8.347 4.670 64 HB3 ASP 9 HB1 ASP 9 26.416 6.647 4.968 65 H GLU 10 HN GLU 10 25.019 6.371 7.435 66 HA GLU 10 HA GLU 10 23.493 4.185 6.551 67 HB2 GLU 10 HB2 GLU 10 25.200 4.070 8.327 68 HB3 GLU 10 HB1 GLU 10 24.182 5.056 9.364 69 HG2 GLU 10 HG2 GLU 10 23.969 2.800 10.053 70 HG3 GLU 10 HG1 GLU 10 22.464 3.276 9.265 71 H GLU 11 HN GLU 11 22.701 6.479 9.154 72 HA GLU 11 HA GLU 11 20.032 5.882 9.439 73 HB2 GLU 11 HB2 GLU 11 21.520 8.466 9.843 74 HB3 GLU 11 HB1 GLU 11 19.834 8.256 10.298 75 HG2 GLU 11 HG2 GLU 11 22.046 6.496 11.309 76 HG3 GLU 11 HG1 GLU 11 21.506 7.953 12.137 77 H ARG 12 HN ARG 12 21.594 7.879 7.035 78 HA ARG 12 HA ARG 12 19.414 9.243 5.982 79 HB2 ARG 12 HB2 ARG 12 21.679 9.692 5.250 80 HB3 ARG 12 HB1 ARG 12 21.817 8.077 4.570 81 HG2 ARG 12 HG2 ARG 12 19.955 8.679 3.008 82 HG3 ARG 12 HG1 ARG 12 20.090 10.336 3.599 83 HD2 ARG 12 HD2 ARG 12 21.343 9.951 1.505 84 HD3 ARG 12 HD1 ARG 12 22.372 10.468 2.840 85 HE ARG 12 HE ARG 12 23.479 8.476 2.719 86 HH11 ARG 12 HH11 ARG 12 20.446 8.164 0.986 87 HH12 ARG 12 HH12 ARG 12 20.818 6.587 0.372 88 HH21 ARG 12 HH21 ARG 12 23.961 6.384 1.942 89 HH22 ARG 12 HH22 ARG 12 22.807 5.572 0.910 90 H TYR 13 HN TYR 13 20.628 5.992 5.182 91 HA TYR 13 HA TYR 13 18.518 5.409 3.354 92 HB2 TYR 13 HB2 TYR 13 20.397 4.075 3.009 93 HB3 TYR 13 HB1 TYR 13 20.635 3.787 4.729 94 HD1 TYR 13 HD1 TYR 13 17.981 3.159 2.161 95 HD2 TYR 13 HD2 TYR 13 20.227 1.640 5.437 96 HE1 TYR 13 HE1 TYR 13 16.796 1.017 1.971 97 HE2 TYR 13 HE2 TYR 13 19.061 -0.514 5.248 98 HH TYR 13 HH TYR 13 17.216 -1.383 2.584 99 H GLN 14 HN GLN 14 19.133 4.566 6.731 100 HA GLN 14 HA GLN 14 16.956 2.913 7.200 101 HB2 GLN 14 HB2 GLN 14 18.256 4.870 9.092 102 HB3 GLN 14 HB1 GLN 14 17.202 3.551 9.573 103 HG2 GLN 14 HG2 GLN 14 19.856 3.294 8.189 104 HG3 GLN 14 HG1 GLN 14 19.527 2.974 9.886 105 HE21 GLN 14 HE21 GLN 14 16.938 1.716 9.300 106 HE22 GLN 14 HE22 GLN 14 17.309 0.161 8.639 107 H LYS 15 HN LYS 15 17.152 6.373 7.965 108 HA LYS 15 HA LYS 15 14.488 6.742 8.620 109 HB2 LYS 15 HB2 LYS 15 16.435 8.693 7.398 110 HB3 LYS 15 HB1 LYS 15 14.866 9.149 8.040 111 HG2 LYS 15 HG2 LYS 15 17.085 7.871 9.621 112 HG3 LYS 15 HG1 LYS 15 16.697 9.587 9.612 113 HD2 LYS 15 HD2 LYS 15 14.884 7.359 10.542 114 HD3 LYS 15 HD1 LYS 15 15.767 8.481 11.579 115 HE2 LYS 15 HE2 LYS 15 14.525 10.349 10.531 116 HE3 LYS 15 HE1 LYS 15 13.589 9.171 9.619 117 HZ1 LYS 15 HZ1 LYS 15 13.629 9.547 12.556 118 HZ2 LYS 15 HZ2 LYS 15 12.909 8.216 11.806 119 HZ3 LYS 15 HZ3 LYS 15 12.321 9.773 11.505 120 H LEU 16 HN LEU 16 15.994 6.525 5.479 121 HA LEU 16 HA LEU 16 13.868 7.635 3.970 122 HB2 LEU 16 HB2 LEU 16 16.216 7.277 3.157 123 HB3 LEU 16 HB1 LEU 16 15.864 5.562 3.061 124 HG LEU 16 HG LEU 16 14.182 5.961 1.346 125 HD11 LEU 16 HD11 LEU 16 13.988 8.266 0.392 126 HD12 LEU 16 HD12 LEU 16 14.854 8.860 1.807 127 HD13 LEU 16 HD13 LEU 16 13.286 8.068 1.997 128 HD21 LEU 16 HD21 LEU 16 16.761 7.397 0.743 129 HD22 LEU 16 HD22 LEU 16 15.649 6.700 -0.439 130 HD23 LEU 16 HD23 LEU 16 16.519 5.652 0.685 131 H VAL 17 HN VAL 17 14.692 4.301 4.892 132 HA VAL 17 HA VAL 17 12.486 3.103 3.604 133 HB VAL 17 HB VAL 17 13.001 1.123 4.646 134 HG11 VAL 17 HG11 VAL 17 14.987 1.912 3.537 135 HG12 VAL 17 HG12 VAL 17 15.417 0.966 4.963 136 HG13 VAL 17 HG13 VAL 17 15.509 2.728 5.011 137 HG21 VAL 17 HG21 VAL 17 13.971 2.604 7.087 138 HG22 VAL 17 HG22 VAL 17 13.950 0.851 6.886 139 HG23 VAL 17 HG23 VAL 17 12.434 1.754 6.925 140 H THR 18 HN THR 18 12.926 4.524 6.773 141 HA THR 18 HA THR 18 10.486 3.850 7.912 142 HB THR 18 HB THR 18 12.608 5.874 8.344 143 HG1 THR 18 HG1 THR 18 12.609 4.866 10.393 144 HG21 THR 18 HG21 THR 18 10.673 7.251 8.586 145 HG22 THR 18 HG22 THR 18 11.351 6.916 10.180 146 HG23 THR 18 HG23 THR 18 9.904 6.063 9.638 147 H GLU 19 HN GLU 19 11.458 6.560 5.859 148 HA GLU 19 HA GLU 19 9.164 8.105 6.073 149 HB2 GLU 19 HB2 GLU 19 11.098 7.773 3.781 150 HB3 GLU 19 HB1 GLU 19 9.799 8.963 3.780 151 HG2 GLU 19 HG2 GLU 19 10.735 9.896 5.882 152 HG3 GLU 19 HG1 GLU 19 12.094 8.784 5.720 153 H ASN 20 HN ASN 20 9.844 5.427 3.817 154 HA ASN 20 HA ASN 20 7.285 5.810 2.557 155 HB2 ASN 20 HB2 ASN 20 7.826 4.061 1.058 156 HB3 ASN 20 HB1 ASN 20 9.309 4.967 1.312 157 HD21 ASN 20 HD21 ASN 20 11.033 3.986 2.266 158 HD22 ASN 20 HD22 ASN 20 11.078 2.296 2.636 159 H GLU 21 HN GLU 21 8.536 3.798 5.138 160 HA GLU 21 HA GLU 21 6.431 1.938 5.257 161 HB2 GLU 21 HB2 GLU 21 8.070 3.109 7.507 162 HB3 GLU 21 HB1 GLU 21 7.097 1.648 7.607 163 HG2 GLU 21 HG2 GLU 21 9.194 1.860 5.524 164 HG3 GLU 21 HG1 GLU 21 9.663 1.532 7.183 165 H GLN 22 HN GLN 22 6.830 5.136 6.711 166 HA GLN 22 HA GLN 22 4.567 5.101 8.362 167 HB2 GLN 22 HB2 GLN 22 5.846 7.496 7.029 168 HB3 GLN 22 HB1 GLN 22 4.762 7.543 8.412 169 HG2 GLN 22 HG2 GLN 22 6.390 6.278 9.735 170 HG3 GLN 22 HG1 GLN 22 7.486 6.262 8.359 171 HE21 GLN 22 HE21 GLN 22 6.807 8.995 7.572 172 HE22 GLN 22 HE22 GLN 22 7.592 10.024 8.717 173 H LEU 23 HN LEU 23 4.933 6.637 5.155 174 HA LEU 23 HA LEU 23 2.204 7.463 5.305 175 HB2 LEU 23 HB2 LEU 23 2.638 8.896 3.587 176 HB3 LEU 23 HB1 LEU 23 4.189 8.766 4.366 177 HG LEU 23 HG LEU 23 3.369 7.450 1.779 178 HD11 LEU 23 HD11 LEU 23 5.042 8.940 0.816 179 HD12 LEU 23 HD12 LEU 23 5.333 9.644 2.406 180 HD13 LEU 23 HD13 LEU 23 3.765 9.846 1.626 181 HD21 LEU 23 HD21 LEU 23 4.886 5.990 2.978 182 HD22 LEU 23 HD22 LEU 23 5.991 7.336 3.252 183 HD23 LEU 23 HD23 LEU 23 5.707 6.748 1.614 184 H GLN 24 HN GLN 24 3.798 4.740 3.889 185 HA GLN 24 HA GLN 24 1.805 4.127 1.972 186 HB2 GLN 24 HB2 GLN 24 2.681 1.903 1.915 187 HB3 GLN 24 HB1 GLN 24 4.044 2.993 2.112 188 HG2 GLN 24 HG2 GLN 24 4.120 2.478 4.493 189 HG3 GLN 24 HG1 GLN 24 2.742 1.396 4.304 190 HE21 GLN 24 HE21 GLN 24 5.325 1.700 1.967 191 HE22 GLN 24 HE22 GLN 24 5.981 0.120 2.203 192 H ARG 25 HN ARG 25 2.102 3.662 5.403 193 HA ARG 25 HA ARG 25 -0.225 2.079 5.781 194 HB2 ARG 25 HB2 ARG 25 1.044 1.925 7.666 195 HB3 ARG 25 HB1 ARG 25 1.776 3.503 7.416 196 HG2 ARG 25 HG2 ARG 25 -0.572 4.369 8.120 197 HG3 ARG 25 HG1 ARG 25 -0.715 2.778 8.870 198 HD2 ARG 25 HD2 ARG 25 1.457 4.821 9.364 199 HD3 ARG 25 HD1 ARG 25 0.135 4.413 10.460 200 HE ARG 25 HE ARG 25 1.792 2.166 9.743 201 HH11 ARG 25 HH11 ARG 25 1.375 4.840 11.955 202 HH12 ARG 25 HH12 ARG 25 2.277 4.095 13.235 203 HH21 ARG 25 HH21 ARG 25 3.000 1.179 11.421 204 HH22 ARG 25 HH22 ARG 25 3.214 2.014 12.925 205 H LEU 26 HN LEU 26 0.533 5.521 6.037 206 HA LEU 26 HA LEU 26 -1.930 6.492 6.871 207 HB2 LEU 26 HB2 LEU 26 0.108 7.789 5.053 208 HB3 LEU 26 HB1 LEU 26 -1.170 8.646 5.907 209 HG LEU 26 HG LEU 26 1.038 7.073 7.252 210 HD11 LEU 26 HD11 LEU 26 2.079 9.117 7.811 211 HD12 LEU 26 HD12 LEU 26 0.753 10.061 7.131 212 HD13 LEU 26 HD13 LEU 26 1.815 9.137 6.069 213 HD21 LEU 26 HD21 LEU 26 -0.971 7.150 8.585 214 HD22 LEU 26 HD22 LEU 26 -1.086 8.895 8.364 215 HD23 LEU 26 HD23 LEU 26 0.252 8.210 9.285 216 H ILE 27 HN ILE 27 -0.756 5.754 3.646 217 HA ILE 27 HA ILE 27 -2.954 6.578 2.136 218 HB ILE 27 HB ILE 27 -1.072 4.254 1.745 219 HG12 ILE 27 HG12 ILE 27 -1.176 6.948 0.386 220 HG13 ILE 27 HG11 ILE 27 -0.107 6.551 1.740 221 HG21 ILE 27 HG21 ILE 27 -1.822 4.332 -0.640 222 HG22 ILE 27 HG22 ILE 27 -3.149 5.368 -0.124 223 HG23 ILE 27 HG23 ILE 27 -3.024 3.725 0.494 224 HD11 ILE 27 HD11 ILE 27 0.925 4.805 0.378 225 HD12 ILE 27 HD12 ILE 27 1.071 6.399 -0.359 226 HD13 ILE 27 HD13 ILE 27 -0.116 5.249 -0.971 227 H THR 28 HN THR 28 -2.244 3.342 3.449 228 HA THR 28 HA THR 28 -4.555 2.107 2.540 229 HB THR 28 HB THR 28 -2.365 1.154 3.748 230 HG1 THR 28 HG1 THR 28 -4.398 -0.579 4.254 231 HG21 THR 28 HG21 THR 28 -2.897 1.887 5.991 232 HG22 THR 28 HG22 THR 28 -3.019 0.127 5.918 233 HG23 THR 28 HG23 THR 28 -4.483 1.117 5.904 234 H GLN 29 HN GLN 29 -4.066 4.019 5.458 235 HA GLN 29 HA GLN 29 -6.440 3.252 6.805 236 HB2 GLN 29 HB2 GLN 29 -5.177 5.977 7.023 237 HB3 GLN 29 HB1 GLN 29 -6.057 5.088 8.253 238 HG2 GLN 29 HG2 GLN 29 -3.442 4.113 7.178 239 HG3 GLN 29 HG1 GLN 29 -3.527 5.302 8.467 240 HE21 GLN 29 HE21 GLN 29 -5.809 2.651 8.129 241 HE22 GLN 29 HE22 GLN 29 -5.278 1.776 9.515 242 H LYS 30 HN LYS 30 -5.664 5.983 4.708 243 HA LYS 30 HA LYS 30 -8.306 7.049 4.714 244 HB2 LYS 30 HB2 LYS 30 -6.039 7.488 2.766 245 HB3 LYS 30 HB1 LYS 30 -7.506 8.455 2.856 246 HG2 LYS 30 HG2 LYS 30 -5.355 8.214 4.951 247 HG3 LYS 30 HG1 LYS 30 -5.743 9.630 3.971 248 HD2 LYS 30 HD2 LYS 30 -8.006 9.653 5.039 249 HD3 LYS 30 HD1 LYS 30 -7.460 8.358 6.102 250 HE2 LYS 30 HE2 LYS 30 -6.202 11.091 5.889 251 HE3 LYS 30 HE1 LYS 30 -7.304 10.573 7.162 252 HZ1 LYS 30 HZ1 LYS 30 -5.689 8.857 7.776 253 HZ2 LYS 30 HZ2 LYS 30 -5.037 10.410 7.907 254 HZ3 LYS 30 HZ3 LYS 30 -4.623 9.431 6.593 255 H GLU 31 HN GLU 31 -6.501 4.943 2.524 256 HA GLU 31 HA GLU 31 -8.280 4.799 0.406 257 HB2 GLU 31 HB2 GLU 31 -6.262 2.884 1.514 258 HB3 GLU 31 HB1 GLU 31 -7.282 2.411 0.164 259 HG2 GLU 31 HG2 GLU 31 -5.729 4.958 0.064 260 HG3 GLU 31 HG1 GLU 31 -4.955 3.417 -0.298 261 H GLU 32 HN GLU 32 -8.158 2.667 3.279 262 HA GLU 32 HA GLU 32 -10.220 0.959 2.463 263 HB2 GLU 32 HB2 GLU 32 -10.466 0.429 4.927 264 HB3 GLU 32 HB1 GLU 32 -8.862 0.208 4.247 265 HG2 GLU 32 HG2 GLU 32 -8.075 2.218 5.258 266 HG3 GLU 32 HG1 GLU 32 -9.706 2.661 5.767 267 H LYS 33 HN LYS 33 -10.353 4.021 4.213 268 HA LYS 33 HA LYS 33 -13.175 3.824 4.686 269 HB2 LYS 33 HB2 LYS 33 -11.242 6.128 4.940 270 HB3 LYS 33 HB1 LYS 33 -12.952 6.248 5.343 271 HG2 LYS 33 HG2 LYS 33 -12.645 4.420 6.987 272 HG3 LYS 33 HG1 LYS 33 -10.917 4.444 6.636 273 HD2 LYS 33 HD2 LYS 33 -12.474 6.827 7.632 274 HD3 LYS 33 HD1 LYS 33 -11.583 5.723 8.679 275 HE2 LYS 33 HE2 LYS 33 -9.514 6.276 7.485 276 HE3 LYS 33 HE1 LYS 33 -10.411 7.392 6.455 277 HZ1 LYS 33 HZ1 LYS 33 -10.161 7.626 9.405 278 HZ2 LYS 33 HZ2 LYS 33 -10.955 8.713 8.384 279 HZ3 LYS 33 HZ3 LYS 33 -9.278 8.527 8.282 280 H ILE 34 HN ILE 34 -11.132 5.421 2.279 281 HA ILE 34 HA ILE 34 -13.214 6.829 0.986 282 HB ILE 34 HB ILE 34 -10.554 5.879 -0.096 283 HG12 ILE 34 HG12 ILE 34 -11.421 8.695 0.510 284 HG13 ILE 34 HG11 ILE 34 -10.742 7.658 1.766 285 HG21 ILE 34 HG21 ILE 34 -12.592 7.699 -1.362 286 HG22 ILE 34 HG22 ILE 34 -12.092 6.109 -1.940 287 HG23 ILE 34 HG23 ILE 34 -10.945 7.449 -1.948 288 HD11 ILE 34 HD11 ILE 34 -9.052 9.118 0.791 289 HD12 ILE 34 HD12 ILE 34 -9.366 8.425 -0.799 290 HD13 ILE 34 HD13 ILE 34 -8.689 7.419 0.483 291 H ARG 35 HN ARG 35 -12.063 3.526 0.752 292 HA ARG 35 HA ARG 35 -13.301 2.710 -1.608 293 HB2 ARG 35 HB2 ARG 35 -12.841 1.208 0.963 294 HB3 ARG 35 HB1 ARG 35 -13.465 0.449 -0.491 295 HG2 ARG 35 HG2 ARG 35 -11.386 1.188 -1.667 296 HG3 ARG 35 HG1 ARG 35 -10.763 1.703 -0.098 297 HD2 ARG 35 HD2 ARG 35 -9.984 -0.546 -0.730 298 HD3 ARG 35 HD1 ARG 35 -10.941 -0.557 0.750 299 HE ARG 35 HE ARG 35 -12.685 -1.052 -1.355 300 HH11 ARG 35 HH11 ARG 35 -9.914 -2.590 0.123 301 HH12 ARG 35 HH12 ARG 35 -10.429 -4.195 -0.282 302 HH21 ARG 35 HH21 ARG 35 -13.376 -3.146 -1.885 303 HH22 ARG 35 HH22 ARG 35 -12.413 -4.516 -1.422 304 H VAL 36 HN VAL 36 -14.553 2.809 1.690 305 HA VAL 36 HA VAL 36 -17.131 1.840 1.064 306 HB VAL 36 HB VAL 36 -16.490 3.684 3.353 307 HG11 VAL 36 HG11 VAL 36 -18.245 2.299 4.470 308 HG12 VAL 36 HG12 VAL 36 -18.536 1.518 2.912 309 HG13 VAL 36 HG13 VAL 36 -18.827 3.250 3.102 310 HG21 VAL 36 HG21 VAL 36 -16.065 0.700 3.223 311 HG22 VAL 36 HG22 VAL 36 -15.850 1.719 4.648 312 HG23 VAL 36 HG23 VAL 36 -14.789 1.919 3.247 313 H LEU 37 HN LEU 37 -15.742 5.070 1.283 314 HA LEU 37 HA LEU 37 -18.067 6.566 0.869 315 HB2 LEU 37 HB2 LEU 37 -15.181 7.007 0.619 316 HB3 LEU 37 HB1 LEU 37 -16.147 8.009 -0.450 317 HG LEU 37 HG LEU 37 -15.570 9.027 1.782 318 HD11 LEU 37 HD11 LEU 37 -17.406 9.848 0.381 319 HD12 LEU 37 HD12 LEU 37 -17.773 9.999 2.099 320 HD13 LEU 37 HD13 LEU 37 -18.501 8.700 1.153 321 HD21 LEU 37 HD21 LEU 37 -16.894 8.305 3.709 322 HD22 LEU 37 HD22 LEU 37 -15.843 7.011 3.128 323 HD23 LEU 37 HD23 LEU 37 -17.562 6.983 2.750 324 H ARG 38 HN ARG 38 -15.865 5.041 -1.392 325 HA ARG 38 HA ARG 38 -16.966 6.102 -3.738 326 HB2 ARG 38 HB2 ARG 38 -14.838 5.235 -3.987 327 HB3 ARG 38 HB1 ARG 38 -15.184 3.823 -3.001 328 HG2 ARG 38 HG2 ARG 38 -16.475 2.872 -4.758 329 HG3 ARG 38 HG1 ARG 38 -16.222 4.290 -5.779 330 HD2 ARG 38 HD2 ARG 38 -13.759 3.848 -5.627 331 HD3 ARG 38 HD1 ARG 38 -14.139 2.336 -4.802 332 HE ARG 38 HE ARG 38 -15.466 2.645 -7.340 333 HH11 ARG 38 HH11 ARG 38 -12.512 1.582 -5.777 334 HH12 ARG 38 HH12 ARG 38 -12.075 0.500 -7.062 335 HH21 ARG 38 HH21 ARG 38 -14.921 1.212 -9.002 336 HH22 ARG 38 HH22 ARG 38 -13.450 0.282 -8.896 337 H GLN 39 HN GLN 39 -17.562 3.087 -1.955 338 HA GLN 39 HA GLN 39 -19.633 2.063 -3.546 339 HB2 GLN 39 HB2 GLN 39 -19.257 1.890 -0.550 340 HB3 GLN 39 HB1 GLN 39 -20.330 0.873 -1.497 341 HG2 GLN 39 HG2 GLN 39 -17.387 0.979 -2.022 342 HG3 GLN 39 HG1 GLN 39 -18.084 -0.083 -0.808 343 HE21 GLN 39 HE21 GLN 39 -17.736 0.560 -4.178 344 HE22 GLN 39 HE22 GLN 39 -18.411 -0.925 -4.736 345 H ARG 40 HN ARG 40 -19.712 4.234 -0.760 346 HA ARG 40 HA ARG 40 -22.455 4.558 -0.538 347 HB2 ARG 40 HB2 ARG 40 -20.094 6.258 0.153 348 HB3 ARG 40 HB1 ARG 40 -21.716 6.881 0.368 349 HG2 ARG 40 HG2 ARG 40 -22.257 5.153 1.927 350 HG3 ARG 40 HG1 ARG 40 -20.754 4.299 1.572 351 HD2 ARG 40 HD2 ARG 40 -19.455 6.042 2.570 352 HD3 ARG 40 HD1 ARG 40 -20.875 7.067 2.750 353 HE ARG 40 HE ARG 40 -21.292 4.646 4.123 354 HH11 ARG 40 HH11 ARG 40 -19.376 7.565 4.353 355 HH12 ARG 40 HH12 ARG 40 -19.273 7.526 6.086 356 HH21 ARG 40 HH21 ARG 40 -21.173 4.589 6.402 357 HH22 ARG 40 HH22 ARG 40 -20.325 5.840 7.253 358 H LEU 41 HN LEU 41 -20.126 6.269 -2.578 359 HA LEU 41 HA LEU 41 -22.077 8.070 -3.607 360 HB2 LEU 41 HB2 LEU 41 -19.644 7.368 -5.182 361 HB3 LEU 41 HB1 LEU 41 -20.500 8.891 -5.051 362 HG LEU 41 HG LEU 41 -18.721 7.698 -2.929 363 HD11 LEU 41 HD11 LEU 41 -17.201 9.508 -3.515 364 HD12 LEU 41 HD12 LEU 41 -18.289 10.009 -4.808 365 HD13 LEU 41 HD13 LEU 41 -17.490 8.439 -4.885 366 HD21 LEU 41 HD21 LEU 41 -20.484 9.047 -1.939 367 HD22 LEU 41 HD22 LEU 41 -20.116 10.370 -3.048 368 HD23 LEU 41 HD23 LEU 41 -18.928 9.878 -1.836 369 H VAL 42 HN VAL 42 -21.165 4.806 -4.399 370 HA VAL 42 HA VAL 42 -22.181 4.650 -7.015 371 HB VAL 42 HB VAL 42 -22.214 2.573 -4.810 372 HG11 VAL 42 HG11 VAL 42 -23.891 2.009 -6.442 373 HG12 VAL 42 HG12 VAL 42 -22.514 0.917 -6.608 374 HG13 VAL 42 HG13 VAL 42 -22.739 2.237 -7.758 375 HG21 VAL 42 HG21 VAL 42 -20.313 3.055 -7.099 376 HG22 VAL 42 HG22 VAL 42 -20.289 1.628 -6.062 377 HG23 VAL 42 HG23 VAL 42 -19.973 3.221 -5.374 378 H GLU 43 HN GLU 43 -23.782 4.375 -3.892 379 HA GLU 43 HA GLU 43 -26.356 4.138 -5.162 380 HB2 GLU 43 HB2 GLU 43 -25.616 4.348 -2.242 381 HB3 GLU 43 HB1 GLU 43 -27.234 4.023 -2.857 382 HG2 GLU 43 HG2 GLU 43 -26.370 1.986 -3.948 383 HG3 GLU 43 HG1 GLU 43 -24.797 2.299 -3.224 384 H ARG 44 HN ARG 44 -24.344 6.712 -4.383 385 HA ARG 44 HA ARG 44 -26.520 8.613 -4.102 386 HB2 ARG 44 HB2 ARG 44 -24.959 10.187 -3.627 387 HB3 ARG 44 HB1 ARG 44 -23.937 8.801 -3.294 388 HG2 ARG 44 HG2 ARG 44 -22.681 9.132 -5.131 389 HG3 ARG 44 HG1 ARG 44 -24.035 9.795 -6.037 390 HD2 ARG 44 HD2 ARG 44 -22.173 11.412 -5.462 391 HD3 ARG 44 HD1 ARG 44 -23.807 11.917 -5.063 392 HE ARG 44 HE ARG 44 -23.064 10.910 -2.738 393 HH11 ARG 44 HH11 ARG 44 -21.227 12.899 -4.956 394 HH12 ARG 44 HH12 ARG 44 -20.357 13.723 -3.704 395 HH21 ARG 44 HH21 ARG 44 -21.948 12.008 -1.078 396 HH22 ARG 44 HH22 ARG 44 -20.785 13.227 -1.486 397 H GLY 45 HN GLY 45 -24.470 7.242 -6.454 398 HA2 GLY 45 HA2 GLY 45 -25.114 6.930 -8.705 399 HA3 GLY 45 HA1 GLY 45 -26.091 8.397 -8.606 400 H ASP 46 HN ASP 46 -22.810 8.066 -7.448 401 HA ASP 46 HA ASP 46 -21.920 10.280 -9.072 402 HB2 ASP 46 HB2 ASP 46 -21.148 9.961 -6.739 403 HB3 ASP 46 HB1 ASP 46 -20.366 8.460 -7.212 404 H ALA 47 HN ALA 47 -22.483 7.175 -9.741 405 HA ALA 47 HA ALA 47 -20.123 6.358 -11.113 406 HB1 ALA 47 HB1 ALA 47 -21.729 4.757 -10.198 407 HB2 ALA 47 HB2 ALA 47 -21.489 4.516 -11.928 408 HB3 ALA 47 HB3 ALA 47 -22.943 5.323 -11.342 409 H LYS 48 HN LYS 48 -21.826 8.902 -11.829 410 HA LYS 48 HA LYS 48 -22.573 8.596 -14.537 411 HB2 LYS 48 HB2 LYS 48 -21.791 11.099 -13.029 412 HB3 LYS 48 HB1 LYS 48 -22.598 11.061 -14.591 413 HG2 LYS 48 HG2 LYS 48 -23.713 9.978 -12.011 414 HG3 LYS 48 HG1 LYS 48 -24.173 11.498 -12.783 415 HD2 LYS 48 HD2 LYS 48 -25.131 10.364 -14.637 416 HD3 LYS 48 HD1 LYS 48 -24.422 8.827 -14.145 417 HE2 LYS 48 HE2 LYS 48 -25.818 8.768 -12.189 418 HE3 LYS 48 HE1 LYS 48 -26.490 10.347 -12.584 419 HZ1 LYS 48 HZ1 LYS 48 -27.966 8.528 -13.220 420 HZ2 LYS 48 HZ2 LYS 48 -26.778 7.900 -14.245 421 HZ3 LYS 48 HZ3 LYS 48 -27.466 9.411 -14.571 422 H GLY 49 HN GLY 49 -19.557 9.160 -12.924 423 HA2 GLY 49 HA2 GLY 49 -18.107 9.858 -15.318 424 HA3 GLY 49 HA1 GLY 49 -17.410 9.437 -13.757 425 H THR 50 HN THR 50 -16.840 7.326 -13.329 426 HA THR 50 HA THR 50 -17.637 5.255 -15.211 427 HB THR 50 HB THR 50 -14.715 5.732 -14.575 428 HG1 THR 50 HG1 THR 50 -15.415 7.233 -16.113 429 HG21 THR 50 HG21 THR 50 -14.380 3.956 -16.303 430 HG22 THR 50 HG22 THR 50 -16.122 3.675 -16.283 431 HG23 THR 50 HG23 THR 50 -15.165 3.383 -14.832 432 H GLU 51 HN GLU 51 -18.835 4.428 -13.495 433 HA GLU 51 HA GLU 51 -17.227 2.741 -11.737 434 HB2 GLU 51 HB2 GLU 51 -18.060 4.839 -10.501 435 HB3 GLU 51 HB1 GLU 51 -19.660 4.138 -10.689 436 HG2 GLU 51 HG2 GLU 51 -18.742 3.647 -8.509 437 HG3 GLU 51 HG1 GLU 51 -18.970 2.172 -9.448 438 H LEU 52 HN LEU 52 -17.771 1.040 -13.003 439 HA LEU 52 HA LEU 52 -20.551 0.580 -13.681 440 HB2 LEU 52 HB2 LEU 52 -18.290 -1.217 -14.463 441 HB3 LEU 52 HB1 LEU 52 -19.822 -0.978 -15.274 442 HG LEU 52 HG LEU 52 -17.555 1.015 -15.179 443 HD11 LEU 52 HD11 LEU 52 -17.327 0.525 -17.557 444 HD12 LEU 52 HD12 LEU 52 -18.582 -0.705 -17.426 445 HD13 LEU 52 HD13 LEU 52 -17.053 -0.911 -16.573 446 HD21 LEU 52 HD21 LEU 52 -19.788 2.066 -15.267 447 HD22 LEU 52 HD22 LEU 52 -20.142 1.133 -16.722 448 HD23 LEU 52 HD23 LEU 52 -18.845 2.330 -16.734 449 H ASN 53 HN ASN 53 -18.110 -1.781 -12.883 450 HA ASN 53 HA ASN 53 -19.685 -2.748 -10.622 451 HB2 ASN 53 HB2 ASN 53 -18.871 -4.527 -12.938 452 HB3 ASN 53 HB1 ASN 53 -19.631 -5.070 -11.449 453 HD21 ASN 53 HD21 ASN 53 -21.813 -4.621 -11.098 454 HD22 ASN 53 HD22 ASN 53 -22.867 -4.160 -12.388 455 H GLY 84 HN GLY 84 19.845 -16.101 -5.627 456 HA2 GLY 84 HA2 GLY 84 19.756 -13.347 -6.201 457 HA3 GLY 84 HA1 GLY 84 21.189 -13.676 -5.241 458 HA PRO 85 HA PRO 85 21.961 -14.817 -9.757 459 HB2 PRO 85 HB2 PRO 85 22.648 -12.522 -10.916 460 HB3 PRO 85 HB1 PRO 85 20.946 -12.967 -10.731 461 HG2 PRO 85 HG2 PRO 85 22.603 -11.088 -9.094 462 HG3 PRO 85 HG1 PRO 85 20.939 -10.892 -9.675 463 HD2 PRO 85 HD2 PRO 85 21.613 -11.722 -7.131 464 HD3 PRO 85 HD1 PRO 85 20.066 -12.074 -7.925 465 H LEU 86 HN LEU 86 24.099 -14.003 -11.030 466 HA LEU 86 HA LEU 86 26.326 -14.754 -9.647 467 HB2 LEU 86 HB2 LEU 86 27.562 -13.180 -11.377 468 HB3 LEU 86 HB1 LEU 86 26.860 -14.709 -11.834 469 HG LEU 86 HG LEU 86 26.538 -12.781 -13.433 470 HD11 LEU 86 HD11 LEU 86 25.166 -14.890 -13.382 471 HD12 LEU 86 HD12 LEU 86 24.431 -13.493 -14.162 472 HD13 LEU 86 HD13 LEU 86 23.925 -13.959 -12.544 473 HD21 LEU 86 HD21 LEU 86 24.597 -11.847 -11.330 474 HD22 LEU 86 HD22 LEU 86 24.670 -11.247 -12.987 475 HD23 LEU 86 HD23 LEU 86 26.036 -11.000 -11.899 476 H GLY 87 HN GLY 87 27.744 -13.905 -8.280 477 HA2 GLY 87 HA2 GLY 87 27.000 -11.400 -7.028 478 HA3 GLY 87 HA1 GLY 87 28.200 -12.545 -6.451 479 H SER 88 HN SER 88 28.812 -12.051 -9.638 480 HA SER 88 HA SER 88 31.218 -10.661 -9.175 481 HB2 SER 88 HB2 SER 88 31.104 -10.480 -11.787 482 HB3 SER 88 HB1 SER 88 31.293 -12.059 -11.024 483 HG SER 88 HG SER 88 29.364 -12.615 -11.675 484 H ARG 89 HN ARG 89 28.064 -9.477 -9.432 485 HA ARG 89 HA ARG 89 28.762 -6.911 -10.572 486 HB2 ARG 89 HB2 ARG 89 26.283 -7.399 -8.970 487 HB3 ARG 89 HB1 ARG 89 26.521 -6.305 -10.318 488 HG2 ARG 89 HG2 ARG 89 26.580 -8.205 -11.850 489 HG3 ARG 89 HG1 ARG 89 26.340 -9.303 -10.486 490 HD2 ARG 89 HD2 ARG 89 24.438 -7.289 -11.638 491 HD3 ARG 89 HD1 ARG 89 24.186 -9.012 -11.358 492 HE ARG 89 HE ARG 89 24.662 -7.617 -8.921 493 HH11 ARG 89 HH11 ARG 89 22.174 -8.231 -11.301 494 HH12 ARG 89 HH12 ARG 89 20.872 -7.968 -10.181 495 HH21 ARG 89 HH21 ARG 89 22.958 -7.233 -7.462 496 HH22 ARG 89 HH22 ARG 89 21.318 -7.407 -8.006 497 H ARG 90 HN ARG 90 28.964 -8.410 -7.546 498 HA ARG 90 HA ARG 90 29.369 -7.756 -5.423 499 HB2 ARG 90 HB2 ARG 90 29.853 -5.016 -6.612 500 HB3 ARG 90 HB1 ARG 90 30.245 -5.499 -4.967 501 HG2 ARG 90 HG2 ARG 90 31.802 -7.180 -5.848 502 HG3 ARG 90 HG1 ARG 90 31.433 -6.641 -7.487 503 HD2 ARG 90 HD2 ARG 90 32.244 -4.385 -6.883 504 HD3 ARG 90 HD1 ARG 90 32.692 -5.002 -5.293 505 HE ARG 90 HE ARG 90 33.833 -6.213 -7.713 506 HH11 ARG 90 HH11 ARG 90 34.270 -4.414 -4.736 507 HH12 ARG 90 HH12 ARG 90 35.990 -4.617 -4.727 508 HH21 ARG 90 HH21 ARG 90 36.085 -6.468 -7.707 509 HH22 ARG 90 HH22 ARG 90 37.029 -5.778 -6.424 510 H PHE 91 HN PHE 91 27.394 -8.144 -4.601 511 HA PHE 91 HA PHE 91 25.066 -6.656 -5.122 512 HB2 PHE 91 HB2 PHE 91 25.716 -8.483 -2.804 513 HB3 PHE 91 HB1 PHE 91 24.110 -7.861 -3.168 514 HD1 PHE 91 HD1 PHE 91 23.458 -8.239 -5.758 515 HD2 PHE 91 HD2 PHE 91 26.130 -10.627 -3.466 516 HE1 PHE 91 HE1 PHE 91 23.047 -10.137 -7.263 517 HE2 PHE 91 HE2 PHE 91 25.723 -12.530 -4.969 518 HZ PHE 91 HZ PHE 91 24.178 -12.285 -6.871 519 H VAL 92 HN VAL 92 27.620 -6.229 -2.837 520 HA VAL 92 HA VAL 92 26.395 -4.606 -0.936 521 HB VAL 92 HB VAL 92 29.222 -4.399 -1.997 522 HG11 VAL 92 HG11 VAL 92 28.031 -3.427 0.598 523 HG12 VAL 92 HG12 VAL 92 28.616 -2.422 -0.728 524 HG13 VAL 92 HG13 VAL 92 29.747 -3.414 0.193 525 HG21 VAL 92 HG21 VAL 92 28.701 -6.641 -1.212 526 HG22 VAL 92 HG22 VAL 92 28.101 -5.985 0.311 527 HG23 VAL 92 HG23 VAL 92 29.809 -5.838 -0.099 528 H VAL 93 HN VAL 93 27.436 -3.915 -4.198 529 HA VAL 93 HA VAL 93 27.276 -1.066 -3.937 530 HB VAL 93 HB VAL 93 27.317 -2.723 -6.450 531 HG11 VAL 93 HG11 VAL 93 28.113 -0.676 -7.527 532 HG12 VAL 93 HG12 VAL 93 27.934 0.194 -6.004 533 HG13 VAL 93 HG13 VAL 93 26.512 -0.454 -6.823 534 HG21 VAL 93 HG21 VAL 93 29.717 -2.252 -6.508 535 HG22 VAL 93 HG22 VAL 93 29.274 -3.170 -5.070 536 HG23 VAL 93 HG23 VAL 93 29.595 -1.441 -4.949 537 H ASP 94 HN ASP 94 25.209 -3.541 -5.513 538 HA ASP 94 HA ASP 94 23.297 -1.532 -6.253 539 HB2 ASP 94 HB2 ASP 94 21.907 -3.294 -7.129 540 HB3 ASP 94 HB1 ASP 94 23.564 -3.534 -7.645 541 H ASP 95 HN ASP 95 23.651 -3.675 -3.517 542 HA ASP 95 HA ASP 95 20.984 -3.227 -2.587 543 HB2 ASP 95 HB2 ASP 95 23.055 -4.871 -1.778 544 HB3 ASP 95 HB1 ASP 95 22.969 -3.668 -0.494 545 H ARG 96 HN ARG 96 23.867 -1.402 -2.676 546 HA ARG 96 HA ARG 96 23.124 0.243 -0.395 547 HB2 ARG 96 HB2 ARG 96 25.492 -0.305 -0.722 548 HB3 ARG 96 HB1 ARG 96 25.466 0.485 -2.292 549 HG2 ARG 96 HG2 ARG 96 25.003 2.626 -1.220 550 HG3 ARG 96 HG1 ARG 96 24.999 1.837 0.359 551 HD2 ARG 96 HD2 ARG 96 27.133 2.927 -0.054 552 HD3 ARG 96 HD1 ARG 96 27.327 1.182 0.035 553 HE ARG 96 HE ARG 96 27.218 2.640 -2.524 554 HH11 ARG 96 HH11 ARG 96 28.620 0.189 -0.451 555 HH12 ARG 96 HH12 ARG 96 29.806 -0.295 -1.619 556 HH21 ARG 96 HH21 ARG 96 28.771 1.998 -4.064 557 HH22 ARG 96 HH22 ARG 96 29.890 0.726 -3.679 558 H ARG 97 HN ARG 97 24.138 1.073 -3.707 559 HA ARG 97 HA ARG 97 22.756 3.584 -3.520 560 HB2 ARG 97 HB2 ARG 97 24.852 3.499 -4.712 561 HB3 ARG 97 HB1 ARG 97 24.243 2.252 -5.789 562 HG2 ARG 97 HG2 ARG 97 22.779 4.830 -5.724 563 HG3 ARG 97 HG1 ARG 97 24.368 4.808 -6.489 564 HD2 ARG 97 HD2 ARG 97 23.671 3.067 -8.000 565 HD3 ARG 97 HD1 ARG 97 22.123 2.906 -7.170 566 HE ARG 97 HE ARG 97 21.913 5.400 -7.908 567 HH11 ARG 97 HH11 ARG 97 23.345 2.794 -9.759 568 HH12 ARG 97 HH12 ARG 97 22.914 3.477 -11.292 569 HH21 ARG 97 HH21 ARG 97 21.361 6.307 -9.921 570 HH22 ARG 97 HH22 ARG 97 21.786 5.475 -11.386 571 H GLU 98 HN GLU 98 22.228 0.518 -5.165 572 HA GLU 98 HA GLU 98 20.092 1.570 -6.760 573 HB2 GLU 98 HB2 GLU 98 21.155 -1.212 -6.326 574 HB3 GLU 98 HB1 GLU 98 19.780 -0.867 -7.381 575 HG2 GLU 98 HG2 GLU 98 21.366 0.757 -8.577 576 HG3 GLU 98 HG1 GLU 98 22.650 -0.078 -7.700 577 H LEU 99 HN LEU 99 20.292 -0.261 -3.713 578 HA LEU 99 HA LEU 99 17.479 -0.836 -3.733 579 HB2 LEU 99 HB2 LEU 99 19.066 -2.300 -2.601 580 HB3 LEU 99 HB1 LEU 99 19.537 -0.999 -1.535 581 HG LEU 99 HG LEU 99 17.997 -2.831 -0.625 582 HD11 LEU 99 HD11 LEU 99 16.781 -1.230 0.783 583 HD12 LEU 99 HD12 LEU 99 17.273 0.073 -0.301 584 HD13 LEU 99 HD13 LEU 99 18.490 -0.824 0.611 585 HD21 LEU 99 HD21 LEU 99 15.946 -1.205 -2.118 586 HD22 LEU 99 HD22 LEU 99 15.614 -2.495 -0.963 587 HD23 LEU 99 HD23 LEU 99 16.417 -2.863 -2.490 588 H GLN 100 HN GLN 100 19.558 1.538 -2.071 589 HA GLN 100 HA GLN 100 17.543 2.745 -0.536 590 HB2 GLN 100 HB2 GLN 100 19.050 4.594 -0.259 591 HB3 GLN 100 HB1 GLN 100 20.004 3.119 -0.280 592 HG2 GLN 100 HG2 GLN 100 20.599 3.521 -2.604 593 HG3 GLN 100 HG1 GLN 100 19.641 4.996 -2.594 594 HE21 GLN 100 HE21 GLN 100 21.387 6.280 -3.090 595 HE22 GLN 100 HE22 GLN 100 22.642 6.621 -1.950 596 H TYR 101 HN TYR 101 18.513 3.141 -3.859 597 HA TYR 101 HA TYR 101 17.232 5.543 -4.456 598 HB2 TYR 101 HB2 TYR 101 18.842 4.441 -5.967 599 HB3 TYR 101 HB1 TYR 101 17.661 3.178 -6.297 600 HD1 TYR 101 HD1 TYR 101 15.652 3.676 -7.631 601 HD2 TYR 101 HD2 TYR 101 18.656 6.619 -6.983 602 HE1 TYR 101 HE1 TYR 101 14.723 5.019 -9.462 603 HE2 TYR 101 HE2 TYR 101 17.730 7.970 -8.818 604 HH TYR 101 HH TYR 101 16.372 7.711 -10.784 605 H ARG 102 HN ARG 102 15.973 2.203 -4.544 606 HA ARG 102 HA ARG 102 13.457 3.016 -5.625 607 HB2 ARG 102 HB2 ARG 102 12.697 0.797 -5.297 608 HB3 ARG 102 HB1 ARG 102 14.387 0.666 -5.755 609 HG2 ARG 102 HG2 ARG 102 15.040 0.147 -3.545 610 HG3 ARG 102 HG1 ARG 102 13.463 0.601 -2.899 611 HD2 ARG 102 HD2 ARG 102 14.030 -1.721 -4.736 612 HD3 ARG 102 HD1 ARG 102 13.710 -1.823 -3.006 613 HE ARG 102 HE ARG 102 11.733 -0.847 -4.973 614 HH11 ARG 102 HH11 ARG 102 12.549 -2.655 -2.079 615 HH12 ARG 102 HH12 ARG 102 10.919 -3.172 -1.798 616 HH21 ARG 102 HH21 ARG 102 9.590 -1.513 -4.587 617 HH22 ARG 102 HH22 ARG 102 9.231 -2.513 -3.213 618 H VAL 103 HN VAL 103 14.826 3.073 -2.494 619 HA VAL 103 HA VAL 103 12.388 2.887 -1.012 620 HB VAL 103 HB VAL 103 14.971 4.122 -0.059 621 HG11 VAL 103 HG11 VAL 103 12.744 2.694 1.372 622 HG12 VAL 103 HG12 VAL 103 13.076 4.424 1.418 623 HG13 VAL 103 HG13 VAL 103 14.233 3.283 2.115 624 HG21 VAL 103 HG21 VAL 103 15.626 1.907 0.714 625 HG22 VAL 103 HG22 VAL 103 15.469 1.947 -1.041 626 HG23 VAL 103 HG23 VAL 103 14.205 1.208 -0.059 627 H GLU 104 HN GLU 104 14.472 5.601 -2.032 628 HA GLU 104 HA GLU 104 12.862 7.617 -0.920 629 HB2 GLU 104 HB2 GLU 104 13.967 9.038 -2.832 630 HB3 GLU 104 HB1 GLU 104 14.908 8.475 -1.458 631 HG2 GLU 104 HG2 GLU 104 15.919 6.788 -2.701 632 HG3 GLU 104 HG1 GLU 104 14.749 6.921 -4.008 633 H VAL 105 HN VAL 105 12.812 6.195 -4.200 634 HA VAL 105 HA VAL 105 10.729 7.843 -5.127 635 HB VAL 105 HB VAL 105 11.597 6.768 -6.937 636 HG11 VAL 105 HG11 VAL 105 13.060 5.260 -5.746 637 HG12 VAL 105 HG12 VAL 105 12.227 4.402 -7.041 638 HG13 VAL 105 HG13 VAL 105 11.699 4.205 -5.371 639 HG21 VAL 105 HG21 VAL 105 9.217 6.408 -7.082 640 HG22 VAL 105 HG22 VAL 105 9.369 4.897 -6.186 641 HG23 VAL 105 HG23 VAL 105 10.081 5.045 -7.792 642 H GLN 106 HN GLN 106 10.649 4.729 -3.414 643 HA GLN 106 HA GLN 106 7.879 4.369 -3.453 644 HB2 GLN 106 HB2 GLN 106 10.000 3.545 -1.476 645 HB3 GLN 106 HB1 GLN 106 8.309 3.147 -1.221 646 HG2 GLN 106 HG2 GLN 106 9.911 2.385 -3.643 647 HG3 GLN 106 HG1 GLN 106 9.570 1.325 -2.279 648 HE21 GLN 106 HE21 GLN 106 8.202 2.992 -5.028 649 HE22 GLN 106 HE22 GLN 106 6.742 2.071 -5.102 650 H ASN 107 HN ASN 107 9.901 6.133 -1.126 651 HA ASN 107 HA ASN 107 7.918 7.065 0.596 652 HB2 ASN 107 HB2 ASN 107 10.248 7.384 1.109 653 HB3 ASN 107 HB1 ASN 107 10.486 8.372 -0.329 654 HD21 ASN 107 HD21 ASN 107 7.765 8.575 1.918 655 HD22 ASN 107 HD22 ASN 107 8.140 10.161 2.495 656 H ARG 108 HN ARG 108 9.077 8.421 -2.454 657 HA ARG 108 HA ARG 108 7.499 10.788 -2.264 658 HB2 ARG 108 HB2 ARG 108 9.176 9.563 -4.433 659 HB3 ARG 108 HB1 ARG 108 8.293 11.062 -4.665 660 HG2 ARG 108 HG2 ARG 108 9.526 12.147 -2.939 661 HG3 ARG 108 HG1 ARG 108 10.259 10.626 -2.433 662 HD2 ARG 108 HD2 ARG 108 11.413 10.485 -4.594 663 HD3 ARG 108 HD1 ARG 108 10.701 12.029 -5.065 664 HE ARG 108 HE ARG 108 11.906 12.827 -2.909 665 HH11 ARG 108 HH11 ARG 108 13.120 10.463 -5.192 666 HH12 ARG 108 HH12 ARG 108 14.785 10.824 -4.870 667 HH21 ARG 108 HH21 ARG 108 14.092 13.307 -2.490 668 HH22 ARG 108 HH22 ARG 108 15.337 12.450 -3.346 669 H VAL 109 HN VAL 109 7.219 7.822 -4.188 670 HA VAL 109 HA VAL 109 4.966 8.520 -5.680 671 HB VAL 109 HB VAL 109 5.741 5.778 -4.680 672 HG11 VAL 109 HG11 VAL 109 3.920 6.521 -6.967 673 HG12 VAL 109 HG12 VAL 109 3.378 5.923 -5.399 674 HG13 VAL 109 HG13 VAL 109 4.353 4.890 -6.449 675 HG21 VAL 109 HG21 VAL 109 6.359 7.228 -7.249 676 HG22 VAL 109 HG22 VAL 109 6.688 5.520 -6.955 677 HG23 VAL 109 HG23 VAL 109 7.504 6.753 -5.991 678 H TYR 110 HN TYR 110 5.166 6.844 -2.556 679 HA TYR 110 HA TYR 110 2.394 6.545 -2.195 680 HB2 TYR 110 HB2 TYR 110 4.636 6.696 -0.181 681 HB3 TYR 110 HB1 TYR 110 2.976 6.313 0.245 682 HD1 TYR 110 HD1 TYR 110 5.580 4.642 0.577 683 HD2 TYR 110 HD2 TYR 110 2.444 4.616 -2.294 684 HE1 TYR 110 HE1 TYR 110 6.016 2.264 0.125 685 HE2 TYR 110 HE2 TYR 110 2.871 2.243 -2.753 686 HH TYR 110 HH TYR 110 4.822 0.655 -2.551 687 H LYS 111 HN LYS 111 4.545 9.221 -1.636 688 HA LYS 111 HA LYS 111 2.793 10.761 -0.022 689 HB2 LYS 111 HB2 LYS 111 5.386 11.008 -0.644 690 HB3 LYS 111 HB1 LYS 111 4.729 12.117 -1.836 691 HG2 LYS 111 HG2 LYS 111 4.185 12.304 1.119 692 HG3 LYS 111 HG1 LYS 111 5.461 13.187 0.284 693 HD2 LYS 111 HD2 LYS 111 3.805 14.314 -1.093 694 HD3 LYS 111 HD1 LYS 111 2.514 13.387 -0.329 695 HE2 LYS 111 HE2 LYS 111 2.703 15.659 0.593 696 HE3 LYS 111 HE1 LYS 111 3.000 14.416 1.809 697 HZ1 LYS 111 HZ1 LYS 111 5.356 14.782 1.591 698 HZ2 LYS 111 HZ2 LYS 111 4.592 16.251 1.924 699 HZ3 LYS 111 HZ3 LYS 111 5.114 15.909 0.353 700 H LYS 112 HN LYS 112 3.392 10.537 -3.488 701 HA LYS 112 HA LYS 112 1.672 12.538 -4.397 702 HB2 LYS 112 HB2 LYS 112 2.426 9.881 -5.613 703 HB3 LYS 112 HB1 LYS 112 1.483 11.096 -6.464 704 HG2 LYS 112 HG2 LYS 112 3.287 12.611 -6.504 705 HG3 LYS 112 HG1 LYS 112 4.201 11.668 -5.326 706 HD2 LYS 112 HD2 LYS 112 5.037 11.398 -7.638 707 HD3 LYS 112 HD1 LYS 112 4.497 9.884 -6.915 708 HE2 LYS 112 HE2 LYS 112 3.745 10.042 -9.217 709 HE3 LYS 112 HE1 LYS 112 2.371 10.073 -8.116 710 HZ1 LYS 112 HZ1 LYS 112 3.597 12.467 -9.375 711 HZ2 LYS 112 HZ2 LYS 112 2.228 12.453 -8.382 712 HZ3 LYS 112 HZ3 LYS 112 2.178 11.713 -9.898 713 H GLU 113 HN GLU 113 1.035 9.173 -3.520 714 HA GLU 113 HA GLU 113 -1.631 9.057 -4.369 715 HB2 GLU 113 HB2 GLU 113 -0.484 7.591 -1.989 716 HB3 GLU 113 HB1 GLU 113 -1.889 7.130 -2.941 717 HG2 GLU 113 HG2 GLU 113 -0.183 7.024 -4.908 718 HG3 GLU 113 HG1 GLU 113 1.010 6.936 -3.610 719 H ILE 114 HN ILE 114 -0.288 9.824 -1.152 720 HA ILE 114 HA ILE 114 -2.715 10.137 0.170 721 HB ILE 114 HB ILE 114 -0.097 11.524 0.734 722 HG12 ILE 114 HG12 ILE 114 -1.296 8.993 1.867 723 HG13 ILE 114 HG11 ILE 114 -0.026 9.046 0.650 724 HG21 ILE 114 HG21 ILE 114 -1.901 12.658 1.885 725 HG22 ILE 114 HG22 ILE 114 -0.964 11.709 3.047 726 HG23 ILE 114 HG23 ILE 114 -2.525 11.118 2.481 727 HD11 ILE 114 HD11 ILE 114 0.199 10.168 3.426 728 HD12 ILE 114 HD12 ILE 114 1.469 10.106 2.203 729 HD13 ILE 114 HD13 ILE 114 0.833 8.613 2.891 730 H GLN 115 HN GLN 115 -0.917 12.489 -1.764 731 HA GLN 115 HA GLN 115 -2.504 14.720 -0.990 732 HB2 GLN 115 HB2 GLN 115 -0.984 14.364 -3.572 733 HB3 GLN 115 HB1 GLN 115 -1.451 15.879 -2.812 734 HG2 GLN 115 HG2 GLN 115 -0.013 15.246 -0.869 735 HG3 GLN 115 HG1 GLN 115 0.552 13.882 -1.831 736 HE21 GLN 115 HE21 GLN 115 0.578 17.337 -1.475 737 HE22 GLN 115 HE22 GLN 115 1.887 17.638 -2.566 738 H ALA 116 HN ALA 116 -2.624 12.416 -3.639 739 HA ALA 116 HA ALA 116 -4.920 13.428 -4.936 740 HB1 ALA 116 HB1 ALA 116 -3.989 10.561 -4.743 741 HB2 ALA 116 HB2 ALA 116 -3.412 11.741 -5.923 742 HB3 ALA 116 HB3 ALA 116 -5.098 11.225 -5.945 743 H LEU 117 HN LEU 117 -4.453 11.055 -2.381 744 HA LEU 117 HA LEU 117 -7.165 10.378 -2.001 745 HB2 LEU 117 HB2 LEU 117 -4.884 10.262 -0.021 746 HB3 LEU 117 HB1 LEU 117 -6.413 9.412 0.119 747 HG LEU 117 HG LEU 117 -4.409 8.955 -2.089 748 HD11 LEU 117 HD11 LEU 117 -3.523 8.284 0.090 749 HD12 LEU 117 HD12 LEU 117 -3.845 6.904 -0.955 750 HD13 LEU 117 HD13 LEU 117 -4.955 7.291 0.360 751 HD21 LEU 117 HD21 LEU 117 -6.724 8.432 -2.690 752 HD22 LEU 117 HD22 LEU 117 -6.849 7.386 -1.275 753 HD23 LEU 117 HD23 LEU 117 -5.726 6.983 -2.575 754 H ASP 118 HN ASP 118 -5.216 13.034 -0.909 755 HA ASP 118 HA ASP 118 -6.756 13.864 1.283 756 HB2 ASP 118 HB2 ASP 118 -4.541 14.784 0.853 757 HB3 ASP 118 HB1 ASP 118 -5.115 15.526 -0.639 758 H ALA 119 HN ALA 119 -7.136 14.376 -2.175 759 HA ALA 119 HA ALA 119 -9.316 16.172 -2.064 760 HB1 ALA 119 HB1 ALA 119 -8.733 14.042 -4.124 761 HB2 ALA 119 HB2 ALA 119 -8.107 15.690 -4.140 762 HB3 ALA 119 HB3 ALA 119 -9.836 15.404 -4.327 763 H GLU 120 HN GLU 120 -9.102 12.652 -1.984 764 HA GLU 120 HA GLU 120 -11.895 12.217 -1.764 765 HB2 GLU 120 HB2 GLU 120 -9.460 10.547 -1.290 766 HB3 GLU 120 HB1 GLU 120 -11.030 9.975 -0.770 767 HG2 GLU 120 HG2 GLU 120 -10.419 9.071 -2.928 768 HG3 GLU 120 HG1 GLU 120 -11.866 10.067 -3.032 769 H ILE 121 HN ILE 121 -9.352 12.892 0.554 770 HA ILE 121 HA ILE 121 -10.691 12.282 2.904 771 HB ILE 121 HB ILE 121 -8.502 14.101 2.169 772 HG12 ILE 121 HG12 ILE 121 -7.468 13.090 4.164 773 HG13 ILE 121 HG11 ILE 121 -8.995 12.306 4.555 774 HG21 ILE 121 HG21 ILE 121 -10.054 14.630 4.696 775 HG22 ILE 121 HG22 ILE 121 -9.902 15.714 3.313 776 HG23 ILE 121 HG23 ILE 121 -8.484 15.321 4.282 777 HD11 ILE 121 HD11 ILE 121 -7.481 10.737 3.531 778 HD12 ILE 121 HD12 ILE 121 -7.292 11.792 2.130 779 HD13 ILE 121 HD13 ILE 121 -8.850 11.034 2.461 780 H ARG 122 HN ARG 122 -11.129 14.971 0.701 781 HA ARG 122 HA ARG 122 -12.869 16.518 2.279 782 HB2 ARG 122 HB2 ARG 122 -11.858 17.343 0.201 783 HB3 ARG 122 HB1 ARG 122 -12.806 16.190 -0.725 784 HG2 ARG 122 HG2 ARG 122 -14.865 17.309 0.029 785 HG3 ARG 122 HG1 ARG 122 -13.880 18.493 0.893 786 HD2 ARG 122 HD2 ARG 122 -12.852 19.190 -1.194 787 HD3 ARG 122 HD1 ARG 122 -13.768 17.968 -2.073 788 HE ARG 122 HE ARG 122 -15.314 19.935 -0.586 789 HH11 ARG 122 HH11 ARG 122 -13.992 18.918 -3.669 790 HH12 ARG 122 HH12 ARG 122 -15.097 19.872 -4.602 791 HH21 ARG 122 HH21 ARG 122 -16.759 21.213 -1.818 792 HH22 ARG 122 HH22 ARG 122 -16.662 21.187 -3.549 793 H LYS 123 HN LYS 123 -13.519 13.869 -0.022 794 HA LYS 123 HA LYS 123 -16.338 13.929 0.272 795 HB2 LYS 123 HB2 LYS 123 -16.406 11.945 -0.965 796 HB3 LYS 123 HB1 LYS 123 -14.933 12.716 -1.521 797 HG2 LYS 123 HG2 LYS 123 -13.845 11.250 0.368 798 HG3 LYS 123 HG1 LYS 123 -15.280 10.266 0.118 799 HD2 LYS 123 HD2 LYS 123 -13.352 11.114 -2.035 800 HD3 LYS 123 HD1 LYS 123 -13.362 9.539 -1.251 801 HE2 LYS 123 HE2 LYS 123 -15.363 8.930 -2.234 802 HE3 LYS 123 HE1 LYS 123 -15.801 10.598 -2.610 803 HZ1 LYS 123 HZ1 LYS 123 -15.118 9.411 -4.597 804 HZ2 LYS 123 HZ2 LYS 123 -13.626 9.037 -3.901 805 HZ3 LYS 123 HZ3 LYS 123 -14.012 10.644 -4.252 806 H LEU 124 HN LEU 124 -13.787 12.266 2.011 807 HA LEU 124 HA LEU 124 -15.382 10.762 3.751 808 HB2 LEU 124 HB2 LEU 124 -12.651 11.990 4.073 809 HB3 LEU 124 HB1 LEU 124 -13.370 10.946 5.284 810 HG LEU 124 HG LEU 124 -12.784 10.118 2.433 811 HD11 LEU 124 HD11 LEU 124 -10.960 8.810 3.415 812 HD12 LEU 124 HD12 LEU 124 -11.304 9.508 4.996 813 HD13 LEU 124 HD13 LEU 124 -10.723 10.534 3.686 814 HD21 LEU 124 HD21 LEU 124 -13.241 7.881 3.247 815 HD22 LEU 124 HD22 LEU 124 -14.639 8.930 3.477 816 HD23 LEU 124 HD23 LEU 124 -13.610 8.522 4.848 817 H GLU 125 HN GLU 125 -13.888 13.966 4.235 818 HA GLU 125 HA GLU 125 -14.863 14.310 6.836 819 HB2 GLU 125 HB2 GLU 125 -14.024 16.426 4.861 820 HB3 GLU 125 HB1 GLU 125 -14.241 16.672 6.589 821 HG2 GLU 125 HG2 GLU 125 -12.474 14.952 6.974 822 HG3 GLU 125 HG1 GLU 125 -12.193 14.940 5.236 823 H ARG 126 HN ARG 126 -16.288 15.267 3.738 824 HA ARG 126 HA ARG 126 -18.305 16.902 4.813 825 HB2 ARG 126 HB2 ARG 126 -19.527 16.531 2.711 826 HB3 ARG 126 HB1 ARG 126 -17.838 16.915 2.432 827 HG2 ARG 126 HG2 ARG 126 -17.362 14.552 2.059 828 HG3 ARG 126 HG1 ARG 126 -19.062 14.173 2.330 829 HD2 ARG 126 HD2 ARG 126 -17.996 15.976 0.160 830 HD3 ARG 126 HD1 ARG 126 -18.479 14.295 -0.064 831 HE ARG 126 HE ARG 126 -20.646 15.628 1.057 832 HH11 ARG 126 HH11 ARG 126 -18.761 15.754 -1.890 833 HH12 ARG 126 HH12 ARG 126 -20.078 16.324 -2.863 834 HH21 ARG 126 HH21 ARG 126 -22.395 16.369 -0.226 835 HH22 ARG 126 HH22 ARG 126 -22.145 16.672 -1.916 836 H LEU 127 HN LEU 127 -18.138 13.407 4.378 837 HA LEU 127 HA LEU 127 -20.822 13.038 5.378 838 HB2 LEU 127 HB2 LEU 127 -18.679 11.264 4.372 839 HB3 LEU 127 HB1 LEU 127 -19.780 10.566 5.544 840 HG LEU 127 HG LEU 127 -21.685 11.211 4.083 841 HD11 LEU 127 HD11 LEU 127 -19.508 11.977 2.153 842 HD12 LEU 127 HD12 LEU 127 -20.678 13.060 2.907 843 HD13 LEU 127 HD13 LEU 127 -21.222 11.833 1.762 844 HD21 LEU 127 HD21 LEU 127 -19.571 9.455 2.860 845 HD22 LEU 127 HD22 LEU 127 -21.258 9.503 2.357 846 HD23 LEU 127 HD23 LEU 127 -20.838 8.965 3.983 847 H LEU 128 HN LEU 128 -17.549 12.962 6.626 848 HA LEU 128 HA LEU 128 -18.000 11.869 9.152 849 HB2 LEU 128 HB2 LEU 128 -16.152 14.137 8.411 850 HB3 LEU 128 HB1 LEU 128 -16.082 13.230 9.908 851 HG LEU 128 HG LEU 128 -15.500 12.211 7.142 852 HD11 LEU 128 HD11 LEU 128 -13.740 13.555 8.224 853 HD12 LEU 128 HD12 LEU 128 -13.261 11.876 7.988 854 HD13 LEU 128 HD13 LEU 128 -13.753 12.436 9.586 855 HD21 LEU 128 HD21 LEU 128 -16.641 10.472 8.287 856 HD22 LEU 128 HD22 LEU 128 -15.680 10.722 9.744 857 HD23 LEU 128 HD23 LEU 128 -14.922 10.086 8.284 858 H GLU 129 HN GLU 129 -17.940 15.275 8.213 859 HA GLU 129 HA GLU 129 -18.835 16.361 10.618 860 HB2 GLU 129 HB2 GLU 129 -19.138 17.379 7.796 861 HB3 GLU 129 HB1 GLU 129 -19.450 18.342 9.233 862 HG2 GLU 129 HG2 GLU 129 -17.113 18.049 9.912 863 HG3 GLU 129 HG1 GLU 129 -16.816 17.127 8.439 864 H SER 130 HN SER 130 -20.672 15.233 7.811 865 HA SER 130 HA SER 130 -23.176 16.191 8.708 866 HB2 SER 130 HB2 SER 130 -22.742 15.629 6.352 867 HB3 SER 130 HB1 SER 130 -22.587 13.928 6.791 868 HG SER 130 HG SER 130 -24.851 15.527 6.581 869 H GLY 131 HN GLY 131 -21.512 13.112 9.073 870 HA2 GLY 131 HA2 GLY 131 -21.807 11.976 11.209 871 HA3 GLY 131 HA1 GLY 131 -23.500 12.428 11.142 872 H LEU 132 HN LEU 132 -21.841 11.235 8.305 873 HA LEU 132 HA LEU 132 -23.619 8.926 8.278 874 HB2 LEU 132 HB2 LEU 132 -21.729 10.099 6.255 875 HB3 LEU 132 HB1 LEU 132 -22.417 8.504 6.034 876 HG LEU 132 HG LEU 132 -23.694 10.060 4.751 877 HD11 LEU 132 HD11 LEU 132 -25.910 9.723 5.635 878 HD12 LEU 132 HD12 LEU 132 -25.255 9.383 7.234 879 HD13 LEU 132 HD13 LEU 132 -24.935 8.278 5.897 880 HD21 LEU 132 HD21 LEU 132 -23.125 12.117 5.841 881 HD22 LEU 132 HD22 LEU 132 -23.985 11.630 7.301 882 HD23 LEU 132 HD23 LEU 132 -24.881 11.949 5.814 883 H THR 133 HN THR 133 -20.346 9.692 8.965 884 HA THR 133 HA THR 133 -19.598 6.855 8.852 885 HB THR 133 HB THR 133 -17.712 9.189 9.124 886 HG1 THR 133 HG1 THR 133 -17.578 9.247 6.916 887 HG21 THR 133 HG21 THR 133 -16.820 6.980 9.716 888 HG22 THR 133 HG22 THR 133 -16.068 7.605 8.248 889 HG23 THR 133 HG23 THR 133 -17.314 6.363 8.140 Start of MODEL 16 1 H1 MET 1 HT1 MET 1 33.819 -7.859 6.770 2 H2 MET 1 HT2 MET 1 34.178 -6.215 6.930 3 H3 MET 1 HT3 MET 1 33.477 -6.792 5.505 4 HA MET 1 HA MET 1 31.461 -7.356 6.655 5 HB2 MET 1 HB2 MET 1 32.915 -6.233 9.058 6 HB3 MET 1 HB1 MET 1 31.194 -6.585 9.019 7 HG2 MET 1 HG2 MET 1 31.657 -8.935 8.663 8 HG3 MET 1 HG1 MET 1 33.387 -8.604 8.616 9 HE1 MET 1 HE1 MET 1 30.755 -8.140 12.383 10 HE2 MET 1 HE2 MET 1 30.157 -8.716 10.827 11 HE3 MET 1 HE3 MET 1 30.655 -7.036 11.013 12 H ASP 2 HN ASP 2 32.201 -5.509 4.869 13 HA ASP 2 HA ASP 2 31.705 -3.517 3.960 14 HB2 ASP 2 HB2 ASP 2 29.420 -3.903 4.598 15 HB3 ASP 2 HB1 ASP 2 29.736 -3.359 6.244 16 H SER 3 HN SER 3 33.595 -2.499 4.140 17 HA SER 3 HA SER 3 33.996 -0.770 6.475 18 HB2 SER 3 HB2 SER 3 35.944 -1.502 4.273 19 HB3 SER 3 HB1 SER 3 36.315 -0.564 5.720 20 HG SER 3 HG SER 3 35.131 -2.999 6.220 21 H ALA 4 HN ALA 4 32.267 -0.546 3.903 22 HA ALA 4 HA ALA 4 33.342 1.952 2.822 23 HB1 ALA 4 HB1 ALA 4 31.752 1.668 1.015 24 HB2 ALA 4 HB2 ALA 4 31.034 0.281 1.834 25 HB3 ALA 4 HB3 ALA 4 32.689 0.191 1.234 26 H ILE 5 HN ILE 5 30.187 0.657 3.895 27 HA ILE 5 HA ILE 5 29.137 3.357 4.116 28 HB ILE 5 HB ILE 5 27.769 0.777 4.883 29 HG12 ILE 5 HG12 ILE 5 27.684 2.196 2.211 30 HG13 ILE 5 HG11 ILE 5 28.613 0.736 2.529 31 HG21 ILE 5 HG21 ILE 5 26.707 3.496 4.121 32 HG22 ILE 5 HG22 ILE 5 26.691 2.778 5.732 33 HG23 ILE 5 HG23 ILE 5 25.719 2.070 4.441 34 HD11 ILE 5 HD11 ILE 5 26.526 0.226 1.408 35 HD12 ILE 5 HD12 ILE 5 25.622 0.998 2.708 36 HD13 ILE 5 HD13 ILE 5 26.551 -0.465 3.029 37 H SER 6 HN SER 6 29.097 4.528 5.951 38 HA SER 6 HA SER 6 29.674 3.169 8.483 39 HB2 SER 6 HB2 SER 6 29.623 6.129 7.823 40 HB3 SER 6 HB1 SER 6 30.113 5.426 9.363 41 HG SER 6 HG SER 6 31.665 4.194 7.896 42 H LYS 7 HN LYS 7 28.426 4.637 10.368 43 HA LYS 7 HA LYS 7 25.722 3.900 10.147 44 HB2 LYS 7 HB2 LYS 7 26.995 4.303 12.292 45 HB3 LYS 7 HB1 LYS 7 26.813 6.028 11.996 46 HG2 LYS 7 HG2 LYS 7 24.382 5.774 12.026 47 HG3 LYS 7 HG1 LYS 7 24.573 4.051 12.335 48 HD2 LYS 7 HD2 LYS 7 25.507 6.280 14.136 49 HD3 LYS 7 HD1 LYS 7 24.071 5.290 14.385 50 HE2 LYS 7 HE2 LYS 7 25.607 3.284 14.406 51 HE3 LYS 7 HE1 LYS 7 26.952 4.421 14.457 52 HZ1 LYS 7 HZ1 LYS 7 26.356 3.670 16.665 53 HZ2 LYS 7 HZ2 LYS 7 24.774 4.228 16.462 54 HZ3 LYS 7 HZ3 LYS 7 26.058 5.328 16.513 55 H GLU 8 HN GLU 8 27.452 6.714 9.192 56 HA GLU 8 HA GLU 8 25.610 8.716 9.020 57 HB2 GLU 8 HB2 GLU 8 27.817 7.923 7.129 58 HB3 GLU 8 HB1 GLU 8 26.887 9.406 6.934 59 HG2 GLU 8 HG2 GLU 8 28.589 8.661 9.296 60 HG3 GLU 8 HG1 GLU 8 28.966 9.860 8.059 61 H ASP 9 HN ASP 9 26.377 6.624 6.233 62 HA ASP 9 HA ASP 9 24.056 7.565 4.842 63 HB2 ASP 9 HB2 ASP 9 26.326 6.867 3.848 64 HB3 ASP 9 HB1 ASP 9 25.732 5.220 3.992 65 H GLU 10 HN GLU 10 24.763 4.887 6.896 66 HA GLU 10 HA GLU 10 22.750 3.123 5.993 67 HB2 GLU 10 HB2 GLU 10 24.522 2.329 7.459 68 HB3 GLU 10 HB1 GLU 10 23.970 3.397 8.744 69 HG2 GLU 10 HG2 GLU 10 21.928 2.182 8.970 70 HG3 GLU 10 HG1 GLU 10 22.299 1.197 7.557 71 H GLU 11 HN GLU 11 22.727 5.180 8.925 72 HA GLU 11 HA GLU 11 20.021 4.979 9.462 73 HB2 GLU 11 HB2 GLU 11 21.907 7.277 9.992 74 HB3 GLU 11 HB1 GLU 11 20.302 7.130 10.698 75 HG2 GLU 11 HG2 GLU 11 22.470 5.079 11.048 76 HG3 GLU 11 HG1 GLU 11 22.191 6.408 12.168 77 H ARG 12 HN ARG 12 21.738 7.105 7.277 78 HA ARG 12 HA ARG 12 19.694 8.839 6.519 79 HB2 ARG 12 HB2 ARG 12 22.035 9.115 5.863 80 HB3 ARG 12 HB1 ARG 12 21.942 7.670 4.871 81 HG2 ARG 12 HG2 ARG 12 20.383 8.758 3.376 82 HG3 ARG 12 HG1 ARG 12 20.375 10.197 4.399 83 HD2 ARG 12 HD2 ARG 12 22.791 9.059 2.995 84 HD3 ARG 12 HD1 ARG 12 21.854 10.448 2.447 85 HE ARG 12 HE ARG 12 22.513 11.422 4.720 86 HH11 ARG 12 HH11 ARG 12 24.552 9.210 2.900 87 HH12 ARG 12 HH12 ARG 12 26.030 9.896 3.505 88 HH21 ARG 12 HH21 ARG 12 24.466 12.297 5.514 89 HH22 ARG 12 HH22 ARG 12 25.981 11.636 4.991 90 H TYR 13 HN TYR 13 20.656 5.742 5.052 91 HA TYR 13 HA TYR 13 18.516 5.551 3.233 92 HB2 TYR 13 HB2 TYR 13 20.315 4.123 2.791 93 HB3 TYR 13 HB1 TYR 13 20.423 3.578 4.458 94 HD1 TYR 13 HD1 TYR 13 19.643 1.476 4.969 95 HD2 TYR 13 HD2 TYR 13 18.037 3.475 1.572 96 HE1 TYR 13 HE1 TYR 13 18.307 -0.517 4.439 97 HE2 TYR 13 HE2 TYR 13 16.692 1.487 1.038 98 HH TYR 13 HH TYR 13 16.756 -0.965 1.479 99 H GLN 14 HN GLN 14 18.952 4.283 6.498 100 HA GLN 14 HA GLN 14 16.646 2.768 6.743 101 HB2 GLN 14 HB2 GLN 14 18.087 4.393 8.837 102 HB3 GLN 14 HB1 GLN 14 16.860 3.194 9.193 103 HG2 GLN 14 HG2 GLN 14 19.296 2.479 7.618 104 HG3 GLN 14 HG1 GLN 14 19.342 2.555 9.372 105 HE21 GLN 14 HE21 GLN 14 16.459 1.500 7.719 106 HE22 GLN 14 HE22 GLN 14 16.600 -0.169 8.130 107 H LYS 15 HN LYS 15 17.083 6.141 7.771 108 HA LYS 15 HA LYS 15 14.483 6.653 8.526 109 HB2 LYS 15 HB2 LYS 15 16.562 8.491 7.364 110 HB3 LYS 15 HB1 LYS 15 15.008 9.069 7.954 111 HG2 LYS 15 HG2 LYS 15 17.008 7.538 9.600 112 HG3 LYS 15 HG1 LYS 15 16.816 9.293 9.609 113 HD2 LYS 15 HD2 LYS 15 14.683 9.166 10.579 114 HD3 LYS 15 HD1 LYS 15 14.509 7.457 10.188 115 HE2 LYS 15 HE2 LYS 15 16.263 6.904 11.771 116 HE3 LYS 15 HE1 LYS 15 16.465 8.612 12.163 117 HZ1 LYS 15 HZ1 LYS 15 15.106 7.480 13.804 118 HZ2 LYS 15 HZ2 LYS 15 14.003 7.009 12.611 119 HZ3 LYS 15 HZ3 LYS 15 14.192 8.646 12.990 120 H LEU 16 HN LEU 16 15.830 6.523 5.311 121 HA LEU 16 HA LEU 16 13.674 7.806 3.981 122 HB2 LEU 16 HB2 LEU 16 15.978 7.516 3.066 123 HB3 LEU 16 HB1 LEU 16 15.637 5.808 2.868 124 HG LEU 16 HG LEU 16 14.050 6.219 1.142 125 HD11 LEU 16 HD11 LEU 16 13.505 8.585 0.487 126 HD12 LEU 16 HD12 LEU 16 14.229 9.097 2.009 127 HD13 LEU 16 HD13 LEU 16 12.808 8.045 2.015 128 HD21 LEU 16 HD21 LEU 16 16.415 6.390 0.529 129 HD22 LEU 16 HD22 LEU 16 16.341 8.135 0.780 130 HD23 LEU 16 HD23 LEU 16 15.379 7.384 -0.497 131 H VAL 17 HN VAL 17 14.513 4.394 4.502 132 HA VAL 17 HA VAL 17 12.168 3.345 3.298 133 HB VAL 17 HB VAL 17 12.796 1.267 4.059 134 HG11 VAL 17 HG11 VAL 17 14.637 2.179 2.817 135 HG12 VAL 17 HG12 VAL 17 15.257 1.150 4.110 136 HG13 VAL 17 HG13 VAL 17 15.302 2.907 4.279 137 HG21 VAL 17 HG21 VAL 17 14.026 2.524 6.516 138 HG22 VAL 17 HG22 VAL 17 13.993 0.797 6.154 139 HG23 VAL 17 HG23 VAL 17 12.485 1.668 6.445 140 H THR 18 HN THR 18 12.933 4.605 6.428 141 HA THR 18 HA THR 18 10.708 3.800 7.884 142 HB THR 18 HB THR 18 12.699 6.014 8.023 143 HG1 THR 18 HG1 THR 18 13.186 3.909 8.837 144 HG21 THR 18 HG21 THR 18 10.251 5.803 9.736 145 HG22 THR 18 HG22 THR 18 10.741 7.146 8.701 146 HG23 THR 18 HG23 THR 18 11.675 6.760 10.147 147 H GLU 19 HN GLU 19 11.310 6.792 6.034 148 HA GLU 19 HA GLU 19 8.860 8.024 6.322 149 HB2 GLU 19 HB2 GLU 19 10.626 7.922 3.858 150 HB3 GLU 19 HB1 GLU 19 9.304 9.061 4.102 151 HG2 GLU 19 HG2 GLU 19 10.460 9.908 6.119 152 HG3 GLU 19 HG1 GLU 19 11.812 8.831 5.756 153 H ASN 20 HN ASN 20 9.854 5.591 3.997 154 HA ASN 20 HA ASN 20 7.511 5.428 2.499 155 HB2 ASN 20 HB2 ASN 20 9.813 3.607 3.017 156 HB3 ASN 20 HB1 ASN 20 8.396 2.960 2.188 157 HD21 ASN 20 HD21 ASN 20 10.991 5.287 2.052 158 HD22 ASN 20 HD22 ASN 20 10.883 5.581 0.349 159 H GLU 21 HN GLU 21 8.511 3.485 5.323 160 HA GLU 21 HA GLU 21 6.251 1.884 5.513 161 HB2 GLU 21 HB2 GLU 21 7.962 2.995 7.737 162 HB3 GLU 21 HB1 GLU 21 6.895 1.599 7.860 163 HG2 GLU 21 HG2 GLU 21 9.050 1.696 5.812 164 HG3 GLU 21 HG1 GLU 21 9.409 1.229 7.467 165 H GLN 22 HN GLN 22 6.818 5.153 6.698 166 HA GLN 22 HA GLN 22 4.579 5.357 8.390 167 HB2 GLN 22 HB2 GLN 22 5.804 7.630 6.827 168 HB3 GLN 22 HB1 GLN 22 4.904 7.731 8.333 169 HG2 GLN 22 HG2 GLN 22 6.694 6.542 9.498 170 HG3 GLN 22 HG1 GLN 22 7.610 6.456 7.993 171 HE21 GLN 22 HE21 GLN 22 6.529 8.481 10.578 172 HE22 GLN 22 HE22 GLN 22 7.532 9.838 10.210 173 H LEU 23 HN LEU 23 5.010 6.650 5.087 174 HA LEU 23 HA LEU 23 2.279 7.526 5.148 175 HB2 LEU 23 HB2 LEU 23 2.737 8.879 3.357 176 HB3 LEU 23 HB1 LEU 23 4.251 8.821 4.211 177 HG LEU 23 HG LEU 23 3.582 7.417 1.646 178 HD11 LEU 23 HD11 LEU 23 5.337 8.855 0.745 179 HD12 LEU 23 HD12 LEU 23 5.521 9.608 2.330 180 HD13 LEU 23 HD13 LEU 23 4.012 9.791 1.437 181 HD21 LEU 23 HD21 LEU 23 6.130 7.311 3.234 182 HD22 LEU 23 HD22 LEU 23 5.897 6.666 1.610 183 HD23 LEU 23 HD23 LEU 23 5.013 5.972 2.969 184 H GLN 24 HN GLN 24 3.900 4.766 3.843 185 HA GLN 24 HA GLN 24 1.929 4.116 1.906 186 HB2 GLN 24 HB2 GLN 24 2.837 1.902 1.885 187 HB3 GLN 24 HB1 GLN 24 4.181 3.018 2.072 188 HG2 GLN 24 HG2 GLN 24 4.204 2.556 4.484 189 HG3 GLN 24 HG1 GLN 24 2.893 1.402 4.259 190 HE21 GLN 24 HE21 GLN 24 5.489 1.823 1.976 191 HE22 GLN 24 HE22 GLN 24 6.244 0.296 2.256 192 H ARG 25 HN ARG 25 2.200 3.708 5.345 193 HA ARG 25 HA ARG 25 -0.087 2.067 5.729 194 HB2 ARG 25 HB2 ARG 25 1.186 1.984 7.620 195 HB3 ARG 25 HB1 ARG 25 1.855 3.588 7.358 196 HG2 ARG 25 HG2 ARG 25 -0.495 4.399 8.053 197 HG3 ARG 25 HG1 ARG 25 -0.649 2.794 8.770 198 HD2 ARG 25 HD2 ARG 25 1.424 4.900 9.378 199 HD3 ARG 25 HD1 ARG 25 0.158 4.292 10.450 200 HE ARG 25 HE ARG 25 1.999 2.272 9.519 201 HH11 ARG 25 HH11 ARG 25 1.272 4.603 12.037 202 HH12 ARG 25 HH12 ARG 25 2.319 3.852 13.203 203 HH21 ARG 25 HH21 ARG 25 3.355 1.279 11.052 204 HH22 ARG 25 HH22 ARG 25 3.500 1.961 12.639 205 H LEU 26 HN LEU 26 0.590 5.524 5.806 206 HA LEU 26 HA LEU 26 -1.946 6.423 6.581 207 HB2 LEU 26 HB2 LEU 26 0.122 7.780 4.844 208 HB3 LEU 26 HB1 LEU 26 -1.218 8.588 5.649 209 HG LEU 26 HG LEU 26 0.986 7.098 7.087 210 HD11 LEU 26 HD11 LEU 26 1.767 9.159 5.922 211 HD12 LEU 26 HD12 LEU 26 1.942 9.178 7.674 212 HD13 LEU 26 HD13 LEU 26 0.627 10.076 6.910 213 HD21 LEU 26 HD21 LEU 26 -1.079 7.132 8.339 214 HD22 LEU 26 HD22 LEU 26 -1.234 8.871 8.093 215 HD23 LEU 26 HD23 LEU 26 0.083 8.232 9.077 216 H ILE 27 HN ILE 27 -0.597 5.580 3.454 217 HA ILE 27 HA ILE 27 -2.810 6.293 1.868 218 HB ILE 27 HB ILE 27 -0.822 4.058 1.483 219 HG12 ILE 27 HG12 ILE 27 -0.948 6.791 0.207 220 HG13 ILE 27 HG11 ILE 27 0.090 6.384 1.581 221 HG21 ILE 27 HG21 ILE 27 -2.814 3.599 0.196 222 HG22 ILE 27 HG22 ILE 27 -1.508 4.100 -0.878 223 HG23 ILE 27 HG23 ILE 27 -2.793 5.232 -0.465 224 HD11 ILE 27 HD11 ILE 27 0.196 5.155 -1.163 225 HD12 ILE 27 HD12 ILE 27 1.214 4.710 0.205 226 HD13 ILE 27 HD13 ILE 27 1.330 6.327 -0.491 227 H THR 28 HN THR 28 -1.901 3.121 3.259 228 HA THR 28 HA THR 28 -4.142 1.743 2.349 229 HB THR 28 HB THR 28 -1.952 0.857 3.539 230 HG1 THR 28 HG1 THR 28 -3.001 -0.867 2.906 231 HG21 THR 28 HG21 THR 28 -3.951 0.886 5.807 232 HG22 THR 28 HG22 THR 28 -2.414 1.754 5.759 233 HG23 THR 28 HG23 THR 28 -2.429 -0.010 5.795 234 H GLN 29 HN GLN 29 -3.741 3.641 5.302 235 HA GLN 29 HA GLN 29 -6.110 2.915 6.619 236 HB2 GLN 29 HB2 GLN 29 -4.600 5.531 6.610 237 HB3 GLN 29 HB1 GLN 29 -5.901 5.145 7.728 238 HG2 GLN 29 HG2 GLN 29 -3.363 3.564 7.479 239 HG3 GLN 29 HG1 GLN 29 -3.636 4.855 8.643 240 HE21 GLN 29 HE21 GLN 29 -3.100 1.992 9.055 241 HE22 GLN 29 HE22 GLN 29 -4.421 1.402 10.005 242 H LYS 30 HN LYS 30 -5.451 5.766 4.645 243 HA LYS 30 HA LYS 30 -8.109 6.645 4.421 244 HB2 LYS 30 HB2 LYS 30 -5.845 7.037 2.450 245 HB3 LYS 30 HB1 LYS 30 -7.309 8.008 2.551 246 HG2 LYS 30 HG2 LYS 30 -6.672 8.857 4.702 247 HG3 LYS 30 HG1 LYS 30 -5.294 7.759 4.774 248 HD2 LYS 30 HD2 LYS 30 -4.341 8.890 2.790 249 HD3 LYS 30 HD1 LYS 30 -5.685 10.033 2.831 250 HE2 LYS 30 HE2 LYS 30 -3.706 9.598 5.064 251 HE3 LYS 30 HE1 LYS 30 -3.639 10.914 3.897 252 HZ1 LYS 30 HZ1 LYS 30 -5.758 11.712 4.708 253 HZ2 LYS 30 HZ2 LYS 30 -4.652 11.600 5.980 254 HZ3 LYS 30 HZ3 LYS 30 -5.859 10.431 5.811 255 H GLU 31 HN GLU 31 -6.152 4.695 2.187 256 HA GLU 31 HA GLU 31 -7.887 4.232 0.141 257 HB2 GLU 31 HB2 GLU 31 -5.652 2.768 1.370 258 HB3 GLU 31 HB1 GLU 31 -6.732 1.788 0.390 259 HG2 GLU 31 HG2 GLU 31 -5.465 4.330 -0.586 260 HG3 GLU 31 HG1 GLU 31 -4.749 2.735 -0.793 261 H GLU 32 HN GLU 32 -7.597 2.123 3.029 262 HA GLU 32 HA GLU 32 -9.581 0.342 2.204 263 HB2 GLU 32 HB2 GLU 32 -9.666 -0.426 4.551 264 HB3 GLU 32 HB1 GLU 32 -8.031 -0.305 3.927 265 HG2 GLU 32 HG2 GLU 32 -7.618 1.680 5.166 266 HG3 GLU 32 HG1 GLU 32 -9.318 1.810 5.631 267 H LYS 33 HN LYS 33 -9.860 3.391 3.915 268 HA LYS 33 HA LYS 33 -12.644 3.009 4.540 269 HB2 LYS 33 HB2 LYS 33 -10.989 5.540 4.506 270 HB3 LYS 33 HB1 LYS 33 -12.602 5.385 5.187 271 HG2 LYS 33 HG2 LYS 33 -10.135 3.950 6.152 272 HG3 LYS 33 HG1 LYS 33 -10.891 5.348 6.917 273 HD2 LYS 33 HD2 LYS 33 -12.938 4.026 7.267 274 HD3 LYS 33 HD1 LYS 33 -12.145 2.628 6.538 275 HE2 LYS 33 HE2 LYS 33 -12.045 2.444 8.941 276 HE3 LYS 33 HE1 LYS 33 -10.426 2.721 8.304 277 HZ1 LYS 33 HZ1 LYS 33 -10.823 4.069 10.256 278 HZ2 LYS 33 HZ2 LYS 33 -12.181 4.775 9.537 279 HZ3 LYS 33 HZ3 LYS 33 -10.643 5.063 8.900 280 H ILE 34 HN ILE 34 -10.790 4.733 2.068 281 HA ILE 34 HA ILE 34 -12.963 5.956 0.761 282 HB ILE 34 HB ILE 34 -10.285 5.119 -0.371 283 HG12 ILE 34 HG12 ILE 34 -11.198 7.890 0.378 284 HG13 ILE 34 HG11 ILE 34 -10.419 6.824 1.546 285 HG21 ILE 34 HG21 ILE 34 -11.772 5.361 -2.200 286 HG22 ILE 34 HG22 ILE 34 -10.820 6.843 -2.115 287 HG23 ILE 34 HG23 ILE 34 -12.481 6.824 -1.518 288 HD11 ILE 34 HD11 ILE 34 -9.212 7.740 -1.056 289 HD12 ILE 34 HD12 ILE 34 -8.432 6.717 0.152 290 HD13 ILE 34 HD13 ILE 34 -8.840 8.390 0.540 291 H ARG 35 HN ARG 35 -11.537 2.761 0.472 292 HA ARG 35 HA ARG 35 -12.806 1.944 -1.899 293 HB2 ARG 35 HB2 ARG 35 -11.940 0.312 0.487 294 HB3 ARG 35 HB1 ARG 35 -12.374 -0.356 -1.085 295 HG2 ARG 35 HG2 ARG 35 -10.535 0.825 -2.134 296 HG3 ARG 35 HG1 ARG 35 -10.115 1.572 -0.594 297 HD2 ARG 35 HD2 ARG 35 -9.723 -0.704 0.325 298 HD3 ARG 35 HD1 ARG 35 -9.982 -1.352 -1.294 299 HE ARG 35 HE ARG 35 -8.041 0.591 -1.575 300 HH11 ARG 35 HH11 ARG 35 -8.396 -2.382 0.245 301 HH12 ARG 35 HH12 ARG 35 -6.697 -2.723 0.259 302 HH21 ARG 35 HH21 ARG 35 -5.828 0.157 -1.567 303 HH22 ARG 35 HH22 ARG 35 -5.219 -1.267 -0.776 304 H VAL 36 HN VAL 36 -13.809 1.894 1.451 305 HA VAL 36 HA VAL 36 -16.268 0.542 1.073 306 HB VAL 36 HB VAL 36 -15.605 2.579 3.201 307 HG11 VAL 36 HG11 VAL 36 -17.165 1.265 4.571 308 HG12 VAL 36 HG12 VAL 36 -17.511 0.245 3.174 309 HG13 VAL 36 HG13 VAL 36 -17.945 1.954 3.148 310 HG21 VAL 36 HG21 VAL 36 -14.650 0.816 4.505 311 HG22 VAL 36 HG22 VAL 36 -13.852 0.826 2.926 312 HG23 VAL 36 HG23 VAL 36 -15.086 -0.385 3.290 313 H LEU 37 HN LEU 37 -15.271 3.909 0.986 314 HA LEU 37 HA LEU 37 -17.813 5.063 0.546 315 HB2 LEU 37 HB2 LEU 37 -15.004 5.915 0.263 316 HB3 LEU 37 HB1 LEU 37 -16.152 6.772 -0.751 317 HG LEU 37 HG LEU 37 -15.683 7.875 1.439 318 HD11 LEU 37 HD11 LEU 37 -18.513 6.960 0.940 319 HD12 LEU 37 HD12 LEU 37 -17.720 8.371 0.226 320 HD13 LEU 37 HD13 LEU 37 -18.047 8.322 1.960 321 HD21 LEU 37 HD21 LEU 37 -17.203 5.533 2.565 322 HD22 LEU 37 HD22 LEU 37 -16.601 6.929 3.460 323 HD23 LEU 37 HD23 LEU 37 -15.468 5.787 2.735 324 H ARG 38 HN ARG 38 -15.411 3.692 -1.599 325 HA ARG 38 HA ARG 38 -16.553 4.468 -4.037 326 HB2 ARG 38 HB2 ARG 38 -14.955 1.993 -3.354 327 HB3 ARG 38 HB1 ARG 38 -15.365 2.478 -4.995 328 HG2 ARG 38 HG2 ARG 38 -14.118 4.544 -4.721 329 HG3 ARG 38 HG1 ARG 38 -13.752 4.119 -3.051 330 HD2 ARG 38 HD2 ARG 38 -12.547 2.115 -3.875 331 HD3 ARG 38 HD1 ARG 38 -12.835 2.661 -5.528 332 HE ARG 38 HE ARG 38 -11.630 4.794 -4.577 333 HH11 ARG 38 HH11 ARG 38 -10.786 1.424 -4.122 334 HH12 ARG 38 HH12 ARG 38 -9.106 1.757 -3.843 335 HH21 ARG 38 HH21 ARG 38 -9.418 5.230 -4.187 336 HH22 ARG 38 HH22 ARG 38 -8.335 3.922 -3.821 337 H GLN 39 HN GLN 39 -17.273 1.774 -1.882 338 HA GLN 39 HA GLN 39 -19.214 0.528 -3.489 339 HB2 GLN 39 HB2 GLN 39 -19.101 0.659 -0.478 340 HB3 GLN 39 HB1 GLN 39 -19.949 -0.542 -1.446 341 HG2 GLN 39 HG2 GLN 39 -16.976 -0.112 -1.387 342 HG3 GLN 39 HG1 GLN 39 -17.850 -1.396 -0.568 343 HE21 GLN 39 HE21 GLN 39 -18.817 -3.044 -1.820 344 HE22 GLN 39 HE22 GLN 39 -18.314 -3.350 -3.449 345 H ARG 40 HN ARG 40 -19.483 3.111 -1.046 346 HA ARG 40 HA ARG 40 -22.236 3.538 -1.217 347 HB2 ARG 40 HB2 ARG 40 -19.911 5.313 -0.585 348 HB3 ARG 40 HB1 ARG 40 -21.477 6.043 -0.860 349 HG2 ARG 40 HG2 ARG 40 -21.448 5.803 1.424 350 HG3 ARG 40 HG1 ARG 40 -22.304 4.348 0.918 351 HD2 ARG 40 HD2 ARG 40 -20.158 3.116 1.025 352 HD3 ARG 40 HD1 ARG 40 -19.395 4.569 1.655 353 HE ARG 40 HE ARG 40 -21.017 4.377 3.553 354 HH11 ARG 40 HH11 ARG 40 -20.102 1.557 1.694 355 HH12 ARG 40 HH12 ARG 40 -20.342 0.456 3.012 356 HH21 ARG 40 HH21 ARG 40 -21.349 2.942 5.282 357 HH22 ARG 40 HH22 ARG 40 -21.061 1.239 5.050 358 H LEU 41 HN LEU 41 -19.579 4.688 -3.217 359 HA LEU 41 HA LEU 41 -21.168 6.339 -4.892 360 HB2 LEU 41 HB2 LEU 41 -18.573 5.055 -5.693 361 HB3 LEU 41 HB1 LEU 41 -19.267 6.549 -6.285 362 HG LEU 41 HG LEU 41 -18.029 6.064 -3.580 363 HD11 LEU 41 HD11 LEU 41 -17.256 7.832 -5.890 364 HD12 LEU 41 HD12 LEU 41 -16.445 6.351 -5.380 365 HD13 LEU 41 HD13 LEU 41 -16.440 7.764 -4.327 366 HD21 LEU 41 HD21 LEU 41 -18.453 8.409 -3.100 367 HD22 LEU 41 HD22 LEU 41 -19.964 7.529 -3.332 368 HD23 LEU 41 HD23 LEU 41 -19.347 8.573 -4.614 369 H VAL 42 HN VAL 42 -20.479 2.937 -4.833 370 HA VAL 42 HA VAL 42 -21.271 2.291 -7.470 371 HB VAL 42 HB VAL 42 -21.411 0.674 -4.915 372 HG11 VAL 42 HG11 VAL 42 -21.679 -1.306 -6.337 373 HG12 VAL 42 HG12 VAL 42 -21.824 -0.263 -7.751 374 HG13 VAL 42 HG13 VAL 42 -23.048 -0.201 -6.481 375 HG21 VAL 42 HG21 VAL 42 -19.447 -0.470 -5.834 376 HG22 VAL 42 HG22 VAL 42 -19.156 1.254 -5.598 377 HG23 VAL 42 HG23 VAL 42 -19.466 0.622 -7.218 378 H GLU 43 HN GLU 43 -23.051 2.474 -4.420 379 HA GLU 43 HA GLU 43 -25.578 1.853 -5.523 380 HB2 GLU 43 HB2 GLU 43 -24.930 3.403 -3.011 381 HB3 GLU 43 HB1 GLU 43 -26.476 2.659 -3.395 382 HG2 GLU 43 HG2 GLU 43 -25.460 0.458 -3.341 383 HG3 GLU 43 HG1 GLU 43 -23.883 1.177 -3.024 384 H ARG 44 HN ARG 44 -23.921 4.895 -4.846 385 HA ARG 44 HA ARG 44 -25.908 6.664 -5.740 386 HB2 ARG 44 HB2 ARG 44 -22.895 6.884 -5.757 387 HB3 ARG 44 HB1 ARG 44 -23.970 8.218 -6.147 388 HG2 ARG 44 HG2 ARG 44 -24.882 8.211 -3.944 389 HG3 ARG 44 HG1 ARG 44 -24.020 6.732 -3.539 390 HD2 ARG 44 HD2 ARG 44 -23.048 8.930 -2.683 391 HD3 ARG 44 HD1 ARG 44 -21.950 7.808 -3.481 392 HE ARG 44 HE ARG 44 -22.688 9.410 -5.512 393 HH11 ARG 44 HH11 ARG 44 -21.537 10.128 -2.277 394 HH12 ARG 44 HH12 ARG 44 -20.752 11.600 -2.754 395 HH21 ARG 44 HH21 ARG 44 -21.655 11.342 -6.128 396 HH22 ARG 44 HH22 ARG 44 -20.828 12.296 -4.937 397 H GLY 45 HN GLY 45 -23.364 4.948 -7.437 398 HA2 GLY 45 HA2 GLY 45 -23.684 4.218 -9.696 399 HA3 GLY 45 HA1 GLY 45 -24.615 5.677 -10.001 400 H ASP 46 HN ASP 46 -22.240 6.744 -8.164 401 HA ASP 46 HA ASP 46 -20.847 8.039 -10.249 402 HB2 ASP 46 HB2 ASP 46 -20.375 7.805 -7.286 403 HB3 ASP 46 HB1 ASP 46 -19.304 8.716 -8.334 404 H ALA 47 HN ALA 47 -20.291 5.100 -8.475 405 HA ALA 47 HA ALA 47 -17.719 4.763 -9.875 406 HB1 ALA 47 HB1 ALA 47 -18.762 3.331 -7.432 407 HB2 ALA 47 HB2 ALA 47 -17.523 4.587 -7.458 408 HB3 ALA 47 HB3 ALA 47 -17.212 3.025 -8.215 409 H LYS 48 HN LYS 48 -20.861 4.076 -10.252 410 HA LYS 48 HA LYS 48 -20.497 1.303 -11.123 411 HB2 LYS 48 HB2 LYS 48 -22.430 1.977 -9.621 412 HB3 LYS 48 HB1 LYS 48 -23.079 2.862 -10.994 413 HG2 LYS 48 HG2 LYS 48 -24.141 0.702 -10.793 414 HG3 LYS 48 HG1 LYS 48 -23.192 0.786 -12.278 415 HD2 LYS 48 HD2 LYS 48 -21.341 -0.377 -11.059 416 HD3 LYS 48 HD1 LYS 48 -22.453 -0.605 -9.709 417 HE2 LYS 48 HE2 LYS 48 -23.958 -1.844 -11.165 418 HE3 LYS 48 HE1 LYS 48 -22.856 -1.595 -12.516 419 HZ1 LYS 48 HZ1 LYS 48 -21.201 -2.902 -11.438 420 HZ2 LYS 48 HZ2 LYS 48 -22.640 -3.795 -11.448 421 HZ3 LYS 48 HZ3 LYS 48 -22.130 -3.034 -10.028 422 H GLY 49 HN GLY 49 -20.070 4.259 -12.363 423 HA2 GLY 49 HA2 GLY 49 -21.366 3.992 -14.906 424 HA3 GLY 49 HA1 GLY 49 -20.129 5.168 -14.482 425 H THR 50 HN THR 50 -18.385 2.923 -13.521 426 HA THR 50 HA THR 50 -17.680 1.761 -16.100 427 HB THR 50 HB THR 50 -16.174 3.659 -15.721 428 HG1 THR 50 HG1 THR 50 -15.480 1.405 -16.523 429 HG21 THR 50 HG21 THR 50 -14.546 3.637 -13.890 430 HG22 THR 50 HG22 THR 50 -15.324 2.206 -13.214 431 HG23 THR 50 HG23 THR 50 -16.198 3.736 -13.279 432 H GLU 51 HN GLU 51 -17.748 -0.316 -15.967 433 HA GLU 51 HA GLU 51 -17.668 -1.676 -13.422 434 HB2 GLU 51 HB2 GLU 51 -18.197 -2.578 -16.243 435 HB3 GLU 51 HB1 GLU 51 -18.040 -3.721 -14.919 436 HG2 GLU 51 HG2 GLU 51 -20.033 -1.476 -14.985 437 HG3 GLU 51 HG1 GLU 51 -20.369 -3.137 -15.474 438 H LEU 52 HN LEU 52 -15.592 -1.545 -12.688 439 HA LEU 52 HA LEU 52 -13.444 -2.592 -14.354 440 HB2 LEU 52 HB2 LEU 52 -13.317 -1.544 -11.528 441 HB3 LEU 52 HB1 LEU 52 -11.956 -1.867 -12.582 442 HG LEU 52 HG LEU 52 -14.018 0.307 -12.927 443 HD11 LEU 52 HD11 LEU 52 -12.376 0.758 -11.190 444 HD12 LEU 52 HD12 LEU 52 -12.124 1.806 -12.586 445 HD13 LEU 52 HD13 LEU 52 -11.069 0.418 -12.325 446 HD21 LEU 52 HD21 LEU 52 -13.399 -0.551 -15.099 447 HD22 LEU 52 HD22 LEU 52 -11.688 -0.449 -14.684 448 HD23 LEU 52 HD23 LEU 52 -12.646 1.024 -14.843 449 H ASN 53 HN ASN 53 -15.692 -3.629 -12.128 450 HA ASN 53 HA ASN 53 -16.139 -5.579 -11.084 451 HB2 ASN 53 HB2 ASN 53 -13.921 -6.618 -12.854 452 HB3 ASN 53 HB1 ASN 53 -14.962 -7.639 -11.868 453 HD21 ASN 53 HD21 ASN 53 -14.588 -7.513 -14.779 454 HD22 ASN 53 HD22 ASN 53 -16.163 -7.241 -15.438 455 H GLY 84 HN GLY 84 27.761 5.967 -22.273 456 HA2 GLY 84 HA2 GLY 84 25.524 5.825 -24.141 457 HA3 GLY 84 HA1 GLY 84 26.270 4.471 -23.311 458 HA PRO 85 HA PRO 85 22.328 5.061 -21.186 459 HB2 PRO 85 HB2 PRO 85 21.878 2.496 -20.594 460 HB3 PRO 85 HB1 PRO 85 21.694 3.102 -22.245 461 HG2 PRO 85 HG2 PRO 85 23.972 1.592 -21.025 462 HG3 PRO 85 HG1 PRO 85 23.212 1.379 -22.614 463 HD2 PRO 85 HD2 PRO 85 25.547 2.769 -22.199 464 HD3 PRO 85 HD1 PRO 85 24.448 3.057 -23.562 465 H LEU 86 HN LEU 86 21.527 3.832 -19.058 466 HA LEU 86 HA LEU 86 22.774 4.806 -16.863 467 HB2 LEU 86 HB2 LEU 86 21.700 2.687 -15.705 468 HB3 LEU 86 HB1 LEU 86 20.730 4.008 -16.321 469 HG LEU 86 HG LEU 86 20.257 2.706 -18.361 470 HD11 LEU 86 HD11 LEU 86 20.813 0.322 -18.445 471 HD12 LEU 86 HD12 LEU 86 21.794 0.511 -16.992 472 HD13 LEU 86 HD13 LEU 86 22.253 1.341 -18.480 473 HD21 LEU 86 HD21 LEU 86 18.730 2.602 -16.470 474 HD22 LEU 86 HD22 LEU 86 19.638 1.250 -15.799 475 HD23 LEU 86 HD23 LEU 86 18.781 1.063 -17.328 476 H GLY 87 HN GLY 87 23.963 3.882 -15.126 477 HA2 GLY 87 HA2 GLY 87 26.357 2.643 -16.102 478 HA3 GLY 87 HA1 GLY 87 26.064 3.206 -14.467 479 H SER 88 HN SER 88 23.729 1.051 -15.743 480 HA SER 88 HA SER 88 24.106 -0.803 -13.660 481 HB2 SER 88 HB2 SER 88 22.512 -1.093 -16.210 482 HB3 SER 88 HB1 SER 88 22.345 -2.095 -14.771 483 HG SER 88 HG SER 88 21.963 0.010 -13.654 484 H ARG 89 HN ARG 89 26.007 -0.453 -16.327 485 HA ARG 89 HA ARG 89 26.581 -3.194 -16.882 486 HB2 ARG 89 HB2 ARG 89 27.162 -1.301 -18.407 487 HB3 ARG 89 HB1 ARG 89 28.362 -0.775 -17.237 488 HG2 ARG 89 HG2 ARG 89 29.623 -2.801 -17.545 489 HG3 ARG 89 HG1 ARG 89 28.380 -3.450 -18.617 490 HD2 ARG 89 HD2 ARG 89 30.054 -0.992 -19.114 491 HD3 ARG 89 HD1 ARG 89 30.262 -2.563 -19.889 492 HE ARG 89 HE ARG 89 27.700 -1.942 -20.469 493 HH11 ARG 89 HH11 ARG 89 30.690 -0.159 -20.808 494 HH12 ARG 89 HH12 ARG 89 30.159 0.710 -22.210 495 HH21 ARG 89 HH21 ARG 89 26.992 -0.786 -22.308 496 HH22 ARG 89 HH22 ARG 89 28.060 0.348 -23.071 497 H ARG 90 HN ARG 90 27.443 -0.887 -14.469 498 HA ARG 90 HA ARG 90 29.235 -2.851 -13.202 499 HB2 ARG 90 HB2 ARG 90 28.970 0.072 -12.470 500 HB3 ARG 90 HB1 ARG 90 30.227 -1.050 -11.966 501 HG2 ARG 90 HG2 ARG 90 30.907 -1.208 -14.380 502 HG3 ARG 90 HG1 ARG 90 29.793 0.122 -14.699 503 HD2 ARG 90 HD2 ARG 90 31.906 1.119 -14.432 504 HD3 ARG 90 HD1 ARG 90 31.053 1.411 -12.919 505 HE ARG 90 HE ARG 90 32.547 -0.960 -12.692 506 HH11 ARG 90 HH11 ARG 90 32.990 2.506 -12.869 507 HH12 ARG 90 HH12 ARG 90 34.515 2.483 -12.044 508 HH21 ARG 90 HH21 ARG 90 34.557 -0.994 -11.600 509 HH22 ARG 90 HH22 ARG 90 35.404 0.496 -11.324 510 H PHE 91 HN PHE 91 27.648 -4.112 -12.316 511 HA PHE 91 HA PHE 91 25.189 -3.238 -11.353 512 HB2 PHE 91 HB2 PHE 91 26.709 -5.764 -10.701 513 HB3 PHE 91 HB1 PHE 91 25.004 -5.498 -10.356 514 HD1 PHE 91 HD1 PHE 91 27.488 -5.961 -13.031 515 HD2 PHE 91 HD2 PHE 91 23.358 -5.652 -12.066 516 HE1 PHE 91 HE1 PHE 91 26.906 -6.781 -15.278 517 HE2 PHE 91 HE2 PHE 91 22.768 -6.472 -14.307 518 HZ PHE 91 HZ PHE 91 24.544 -7.038 -15.918 519 H VAL 92 HN VAL 92 28.243 -3.157 -9.798 520 HA VAL 92 HA VAL 92 27.397 -3.266 -7.108 521 HB VAL 92 HB VAL 92 29.746 -3.531 -7.726 522 HG11 VAL 92 HG11 VAL 92 31.108 -1.563 -8.326 523 HG12 VAL 92 HG12 VAL 92 29.631 -0.613 -8.473 524 HG13 VAL 92 HG13 VAL 92 29.916 -1.973 -9.557 525 HG21 VAL 92 HG21 VAL 92 29.266 -1.153 -5.934 526 HG22 VAL 92 HG22 VAL 92 30.747 -2.108 -5.992 527 HG23 VAL 92 HG23 VAL 92 29.240 -2.850 -5.454 528 H VAL 93 HN VAL 93 27.542 -0.629 -9.457 529 HA VAL 93 HA VAL 93 27.082 1.382 -7.445 530 HB VAL 93 HB VAL 93 28.381 1.799 -9.577 531 HG11 VAL 93 HG11 VAL 93 26.885 0.741 -11.167 532 HG12 VAL 93 HG12 VAL 93 27.111 2.443 -11.572 533 HG13 VAL 93 HG13 VAL 93 25.623 1.914 -10.787 534 HG21 VAL 93 HG21 VAL 93 26.101 3.662 -8.930 535 HG22 VAL 93 HG22 VAL 93 27.560 4.095 -9.821 536 HG23 VAL 93 HG23 VAL 93 27.673 3.612 -8.131 537 H ASP 94 HN ASP 94 25.161 -0.599 -9.557 538 HA ASP 94 HA ASP 94 22.782 0.844 -9.581 539 HB2 ASP 94 HB2 ASP 94 23.324 -2.120 -9.630 540 HB3 ASP 94 HB1 ASP 94 21.719 -1.441 -9.765 541 H ASP 95 HN ASP 95 23.471 -1.982 -7.503 542 HA ASP 95 HA ASP 95 21.242 -1.600 -5.871 543 HB2 ASP 95 HB2 ASP 95 23.838 -3.021 -5.296 544 HB3 ASP 95 HB1 ASP 95 22.455 -3.047 -4.203 545 H ARG 96 HN ARG 96 24.224 0.091 -5.874 546 HA ARG 96 HA ARG 96 24.013 0.906 -3.106 547 HB2 ARG 96 HB2 ARG 96 26.238 0.693 -4.064 548 HB3 ARG 96 HB1 ARG 96 25.846 1.868 -5.311 549 HG2 ARG 96 HG2 ARG 96 25.785 3.647 -3.758 550 HG3 ARG 96 HG1 ARG 96 25.789 2.541 -2.383 551 HD2 ARG 96 HD2 ARG 96 28.051 2.833 -4.354 552 HD3 ARG 96 HD1 ARG 96 27.977 3.642 -2.789 553 HE ARG 96 HE ARG 96 27.623 0.878 -2.413 554 HH11 ARG 96 HH11 ARG 96 30.102 3.183 -3.297 555 HH12 ARG 96 HH12 ARG 96 31.404 2.214 -2.688 556 HH21 ARG 96 HH21 ARG 96 29.346 -0.413 -1.610 557 HH22 ARG 96 HH22 ARG 96 30.977 0.168 -1.734 558 H ARG 97 HN ARG 97 24.113 2.793 -6.129 559 HA ARG 97 HA ARG 97 22.929 5.057 -4.861 560 HB2 ARG 97 HB2 ARG 97 24.463 5.417 -6.673 561 HB3 ARG 97 HB1 ARG 97 23.509 4.412 -7.754 562 HG2 ARG 97 HG2 ARG 97 21.903 6.555 -6.711 563 HG3 ARG 97 HG1 ARG 97 23.381 7.185 -7.444 564 HD2 ARG 97 HD2 ARG 97 21.500 5.235 -8.773 565 HD3 ARG 97 HD1 ARG 97 21.485 6.979 -9.038 566 HE ARG 97 HE ARG 97 24.074 6.123 -9.529 567 HH11 ARG 97 HH11 ARG 97 20.893 5.438 -10.827 568 HH12 ARG 97 HH12 ARG 97 21.470 5.258 -12.460 569 HH21 ARG 97 HH21 ARG 97 24.832 5.835 -11.662 570 HH22 ARG 97 HH22 ARG 97 23.704 5.480 -12.932 571 H GLU 98 HN GLU 98 21.773 2.563 -7.061 572 HA GLU 98 HA GLU 98 19.316 3.853 -7.626 573 HB2 GLU 98 HB2 GLU 98 20.442 1.136 -8.145 574 HB3 GLU 98 HB1 GLU 98 18.755 1.502 -8.527 575 HG2 GLU 98 HG2 GLU 98 21.138 3.007 -9.557 576 HG3 GLU 98 HG1 GLU 98 20.234 1.786 -10.455 577 H LEU 99 HN LEU 99 20.221 1.269 -5.334 578 HA LEU 99 HA LEU 99 17.575 0.535 -4.709 579 HB2 LEU 99 HB2 LEU 99 19.606 -0.777 -4.135 580 HB3 LEU 99 HB1 LEU 99 19.980 0.409 -2.904 581 HG LEU 99 HG LEU 99 18.827 -1.841 -2.255 582 HD11 LEU 99 HD11 LEU 99 17.720 -0.731 -0.370 583 HD12 LEU 99 HD12 LEU 99 17.915 0.821 -1.187 584 HD13 LEU 99 HD13 LEU 99 19.335 -0.093 -0.677 585 HD21 LEU 99 HD21 LEU 99 16.972 -1.625 -3.860 586 HD22 LEU 99 HD22 LEU 99 16.422 -0.184 -3.002 587 HD23 LEU 99 HD23 LEU 99 16.413 -1.750 -2.193 588 H GLN 100 HN GLN 100 19.805 2.699 -2.922 589 HA GLN 100 HA GLN 100 17.821 3.545 -1.094 590 HB2 GLN 100 HB2 GLN 100 19.377 5.455 -0.652 591 HB3 GLN 100 HB1 GLN 100 20.120 3.868 -0.520 592 HG2 GLN 100 HG2 GLN 100 21.089 4.136 -2.738 593 HG3 GLN 100 HG1 GLN 100 20.334 5.722 -2.878 594 HE21 GLN 100 HE21 GLN 100 23.154 4.878 -2.906 595 HE22 GLN 100 HE22 GLN 100 23.926 5.817 -1.676 596 H TYR 101 HN TYR 101 18.671 4.578 -4.312 597 HA TYR 101 HA TYR 101 17.275 7.038 -4.312 598 HB2 TYR 101 HB2 TYR 101 18.895 6.684 -6.026 599 HB3 TYR 101 HB1 TYR 101 18.116 5.193 -6.547 600 HD1 TYR 101 HD1 TYR 101 17.428 8.857 -6.241 601 HD2 TYR 101 HD2 TYR 101 16.697 5.245 -8.362 602 HE1 TYR 101 HE1 TYR 101 16.129 10.108 -7.915 603 HE2 TYR 101 HE2 TYR 101 15.401 6.483 -10.038 604 HH TYR 101 HH TYR 101 14.139 8.575 -10.204 605 H ARG 102 HN ARG 102 16.295 3.729 -5.246 606 HA ARG 102 HA ARG 102 13.768 4.495 -6.244 607 HB2 ARG 102 HB2 ARG 102 13.154 2.211 -6.247 608 HB3 ARG 102 HB1 ARG 102 14.873 2.242 -6.599 609 HG2 ARG 102 HG2 ARG 102 15.426 1.480 -4.436 610 HG3 ARG 102 HG1 ARG 102 13.790 1.764 -3.840 611 HD2 ARG 102 HD2 ARG 102 14.194 -0.609 -4.212 612 HD3 ARG 102 HD1 ARG 102 12.944 -0.001 -5.296 613 HE ARG 102 HE ARG 102 15.057 0.192 -6.872 614 HH11 ARG 102 HH11 ARG 102 14.152 -2.407 -4.707 615 HH12 ARG 102 HH12 ARG 102 14.886 -3.641 -5.679 616 HH21 ARG 102 HH21 ARG 102 16.010 -1.433 -8.157 617 HH22 ARG 102 HH22 ARG 102 15.942 -3.086 -7.639 618 H VAL 103 HN VAL 103 14.954 4.059 -3.035 619 HA VAL 103 HA VAL 103 12.444 3.635 -1.767 620 HB VAL 103 HB VAL 103 14.875 4.829 -0.442 621 HG11 VAL 103 HG11 VAL 103 12.688 3.020 0.565 622 HG12 VAL 103 HG12 VAL 103 12.842 4.744 0.898 623 HG13 VAL 103 HG13 VAL 103 14.055 3.612 1.509 624 HG21 VAL 103 HG21 VAL 103 15.676 2.579 -0.012 625 HG22 VAL 103 HG22 VAL 103 15.595 2.876 -1.746 626 HG23 VAL 103 HG23 VAL 103 14.353 1.903 -0.956 627 H GLU 104 HN GLU 104 14.448 6.542 -2.302 628 HA GLU 104 HA GLU 104 12.608 8.278 -1.044 629 HB2 GLU 104 HB2 GLU 104 13.860 10.080 -2.427 630 HB3 GLU 104 HB1 GLU 104 14.687 9.243 -1.124 631 HG2 GLU 104 HG2 GLU 104 15.849 7.863 -2.637 632 HG3 GLU 104 HG1 GLU 104 14.872 8.411 -3.996 633 H VAL 105 HN VAL 105 12.882 7.246 -4.446 634 HA VAL 105 HA VAL 105 10.817 9.026 -5.275 635 HB VAL 105 HB VAL 105 11.755 8.310 -7.198 636 HG11 VAL 105 HG11 VAL 105 12.624 6.070 -7.647 637 HG12 VAL 105 HG12 VAL 105 12.058 5.545 -6.062 638 HG13 VAL 105 HG13 VAL 105 13.325 6.764 -6.186 639 HG21 VAL 105 HG21 VAL 105 9.417 7.782 -7.464 640 HG22 VAL 105 HG22 VAL 105 9.694 6.159 -6.831 641 HG23 VAL 105 HG23 VAL 105 10.413 6.639 -8.367 642 H GLN 106 HN GLN 106 10.785 5.670 -4.092 643 HA GLN 106 HA GLN 106 8.021 5.286 -4.242 644 HB2 GLN 106 HB2 GLN 106 10.068 4.227 -2.295 645 HB3 GLN 106 HB1 GLN 106 8.384 3.731 -2.257 646 HG2 GLN 106 HG2 GLN 106 10.284 3.374 -4.556 647 HG3 GLN 106 HG1 GLN 106 9.734 2.118 -3.452 648 HE21 GLN 106 HE21 GLN 106 8.881 4.163 -6.128 649 HE22 GLN 106 HE22 GLN 106 7.421 3.341 -6.553 650 H ASN 107 HN ASN 107 9.982 6.753 -1.677 651 HA ASN 107 HA ASN 107 8.056 7.525 0.152 652 HB2 ASN 107 HB2 ASN 107 10.318 7.977 0.670 653 HB3 ASN 107 HB1 ASN 107 10.559 8.904 -0.811 654 HD21 ASN 107 HD21 ASN 107 9.060 8.910 2.345 655 HD22 ASN 107 HD22 ASN 107 8.925 10.625 2.487 656 H ARG 108 HN ARG 108 9.130 9.317 -2.732 657 HA ARG 108 HA ARG 108 7.319 11.453 -2.486 658 HB2 ARG 108 HB2 ARG 108 8.781 10.337 -4.875 659 HB3 ARG 108 HB1 ARG 108 7.842 11.817 -4.918 660 HG2 ARG 108 HG2 ARG 108 9.299 12.806 -3.235 661 HG3 ARG 108 HG1 ARG 108 10.231 11.310 -3.162 662 HD2 ARG 108 HD2 ARG 108 11.340 12.970 -4.558 663 HD3 ARG 108 HD1 ARG 108 10.842 11.570 -5.508 664 HE ARG 108 HE ARG 108 8.783 13.403 -5.699 665 HH11 ARG 108 HH11 ARG 108 12.179 13.283 -6.526 666 HH12 ARG 108 HH12 ARG 108 12.022 14.380 -7.858 667 HH21 ARG 108 HH21 ARG 108 8.572 14.850 -7.447 668 HH22 ARG 108 HH22 ARG 108 9.971 15.284 -8.378 669 H VAL 109 HN VAL 109 7.199 8.528 -4.471 670 HA VAL 109 HA VAL 109 4.836 9.054 -5.839 671 HB VAL 109 HB VAL 109 5.934 6.356 -5.041 672 HG11 VAL 109 HG11 VAL 109 3.994 7.094 -7.231 673 HG12 VAL 109 HG12 VAL 109 3.597 6.225 -5.749 674 HG13 VAL 109 HG13 VAL 109 4.667 5.490 -6.945 675 HG21 VAL 109 HG21 VAL 109 6.384 8.026 -7.514 676 HG22 VAL 109 HG22 VAL 109 6.937 6.367 -7.299 677 HG23 VAL 109 HG23 VAL 109 7.582 7.651 -6.270 678 H TYR 110 HN TYR 110 5.317 7.281 -2.791 679 HA TYR 110 HA TYR 110 2.593 6.691 -2.383 680 HB2 TYR 110 HB2 TYR 110 4.886 6.964 -0.441 681 HB3 TYR 110 HB1 TYR 110 3.270 6.487 0.054 682 HD1 TYR 110 HD1 TYR 110 2.558 4.698 -2.252 683 HD2 TYR 110 HD2 TYR 110 6.125 5.042 0.035 684 HE1 TYR 110 HE1 TYR 110 3.077 2.345 -2.728 685 HE2 TYR 110 HE2 TYR 110 6.662 2.687 -0.442 686 HH TYR 110 HH TYR 110 5.593 0.647 -1.105 687 H LYS 111 HN LYS 111 4.559 9.487 -1.522 688 HA LYS 111 HA LYS 111 2.608 10.805 0.045 689 HB2 LYS 111 HB2 LYS 111 4.975 11.442 0.100 690 HB3 LYS 111 HB1 LYS 111 4.888 11.960 -1.575 691 HG2 LYS 111 HG2 LYS 111 4.834 13.877 -0.115 692 HG3 LYS 111 HG1 LYS 111 3.285 13.710 -0.939 693 HD2 LYS 111 HD2 LYS 111 2.845 14.261 1.345 694 HD3 LYS 111 HD1 LYS 111 2.405 12.573 1.107 695 HE2 LYS 111 HE2 LYS 111 3.580 12.831 3.205 696 HE3 LYS 111 HE1 LYS 111 4.561 11.893 2.082 697 HZ1 LYS 111 HZ1 LYS 111 5.836 13.582 3.311 698 HZ2 LYS 111 HZ2 LYS 111 4.905 14.799 2.592 699 HZ3 LYS 111 HZ3 LYS 111 5.897 13.821 1.636 700 H LYS 112 HN LYS 112 3.397 10.864 -3.382 701 HA LYS 112 HA LYS 112 1.607 12.847 -4.210 702 HB2 LYS 112 HB2 LYS 112 2.687 10.420 -5.643 703 HB3 LYS 112 HB1 LYS 112 1.731 11.664 -6.434 704 HG2 LYS 112 HG2 LYS 112 3.398 13.299 -6.110 705 HG3 LYS 112 HG1 LYS 112 4.270 12.289 -4.955 706 HD2 LYS 112 HD2 LYS 112 5.421 12.306 -7.092 707 HD3 LYS 112 HD1 LYS 112 4.780 10.700 -6.756 708 HE2 LYS 112 HE2 LYS 112 4.374 11.220 -9.062 709 HE3 LYS 112 HE1 LYS 112 2.836 11.229 -8.202 710 HZ1 LYS 112 HZ1 LYS 112 3.019 13.099 -9.709 711 HZ2 LYS 112 HZ2 LYS 112 4.420 13.631 -8.928 712 HZ3 LYS 112 HZ3 LYS 112 2.943 13.637 -8.108 713 H GLU 113 HN GLU 113 1.149 9.377 -3.690 714 HA GLU 113 HA GLU 113 -1.467 9.195 -4.697 715 HB2 GLU 113 HB2 GLU 113 -0.336 7.614 -2.381 716 HB3 GLU 113 HB1 GLU 113 -1.711 7.168 -3.385 717 HG2 GLU 113 HG2 GLU 113 0.023 7.259 -5.325 718 HG3 GLU 113 HG1 GLU 113 1.204 7.118 -4.020 719 H ILE 114 HN ILE 114 -0.268 9.884 -1.426 720 HA ILE 114 HA ILE 114 -2.739 10.018 -0.137 721 HB ILE 114 HB ILE 114 -0.206 11.526 0.509 722 HG12 ILE 114 HG12 ILE 114 -1.260 8.893 1.554 723 HG13 ILE 114 HG11 ILE 114 0.010 9.056 0.349 724 HG21 ILE 114 HG21 ILE 114 -2.074 12.522 1.668 725 HG22 ILE 114 HG22 ILE 114 -1.122 11.573 2.818 726 HG23 ILE 114 HG23 ILE 114 -2.641 10.933 2.187 727 HD11 ILE 114 HD11 ILE 114 0.149 10.096 3.163 728 HD12 ILE 114 HD12 ILE 114 1.430 10.153 1.951 729 HD13 ILE 114 HD13 ILE 114 0.879 8.600 2.580 730 H GLN 115 HN GLN 115 -1.016 12.468 -1.998 731 HA GLN 115 HA GLN 115 -2.621 14.680 -1.340 732 HB2 GLN 115 HB2 GLN 115 -1.351 14.120 -4.015 733 HB3 GLN 115 HB1 GLN 115 -1.786 15.689 -3.352 734 HG2 GLN 115 HG2 GLN 115 -0.135 14.626 -1.430 735 HG3 GLN 115 HG1 GLN 115 0.584 14.086 -2.948 736 HE21 GLN 115 HE21 GLN 115 1.334 15.625 -4.417 737 HE22 GLN 115 HE22 GLN 115 1.633 17.258 -3.948 738 H ALA 116 HN ALA 116 -2.814 12.401 -4.038 739 HA ALA 116 HA ALA 116 -5.259 13.199 -5.119 740 HB1 ALA 116 HB1 ALA 116 -5.386 10.972 -6.084 741 HB2 ALA 116 HB2 ALA 116 -4.164 10.390 -4.951 742 HB3 ALA 116 HB3 ALA 116 -3.733 11.581 -6.181 743 H LEU 117 HN LEU 117 -4.548 10.849 -2.577 744 HA LEU 117 HA LEU 117 -7.212 9.997 -2.180 745 HB2 LEU 117 HB2 LEU 117 -4.893 9.897 -0.255 746 HB3 LEU 117 HB1 LEU 117 -6.361 8.949 -0.147 747 HG LEU 117 HG LEU 117 -4.353 8.747 -2.392 748 HD11 LEU 117 HD11 LEU 117 -3.710 6.634 -1.391 749 HD12 LEU 117 HD12 LEU 117 -4.810 6.922 -0.042 750 HD13 LEU 117 HD13 LEU 117 -3.414 7.973 -0.285 751 HD21 LEU 117 HD21 LEU 117 -6.616 8.134 -3.064 752 HD22 LEU 117 HD22 LEU 117 -6.725 7.021 -1.698 753 HD23 LEU 117 HD23 LEU 117 -5.562 6.721 -2.991 754 H ASP 118 HN ASP 118 -5.523 12.811 -1.124 755 HA ASP 118 HA ASP 118 -7.054 13.344 1.210 756 HB2 ASP 118 HB2 ASP 118 -4.879 14.439 0.732 757 HB3 ASP 118 HB1 ASP 118 -5.641 15.331 -0.584 758 H ALA 119 HN ALA 119 -7.500 13.966 -2.200 759 HA ALA 119 HA ALA 119 -9.839 15.565 -1.963 760 HB1 ALA 119 HB1 ALA 119 -10.284 14.944 -4.280 761 HB2 ALA 119 HB2 ALA 119 -9.065 13.674 -4.185 762 HB3 ALA 119 HB3 ALA 119 -8.586 15.366 -4.065 763 H GLU 120 HN GLU 120 -9.242 12.094 -2.006 764 HA GLU 120 HA GLU 120 -11.973 11.347 -1.877 765 HB2 GLU 120 HB2 GLU 120 -9.381 9.948 -1.343 766 HB3 GLU 120 HB1 GLU 120 -10.906 9.191 -0.925 767 HG2 GLU 120 HG2 GLU 120 -10.208 8.393 -3.042 768 HG3 GLU 120 HG1 GLU 120 -11.628 9.405 -3.269 769 H ILE 121 HN ILE 121 -9.575 12.263 0.515 770 HA ILE 121 HA ILE 121 -10.899 11.534 2.834 771 HB ILE 121 HB ILE 121 -8.917 13.569 2.128 772 HG12 ILE 121 HG12 ILE 121 -7.923 12.815 4.261 773 HG13 ILE 121 HG11 ILE 121 -9.373 11.870 4.588 774 HG21 ILE 121 HG21 ILE 121 -10.666 14.080 4.526 775 HG22 ILE 121 HG22 ILE 121 -10.553 15.086 3.081 776 HG23 ILE 121 HG23 ILE 121 -9.160 14.916 4.146 777 HD11 ILE 121 HD11 ILE 121 -8.924 10.534 2.581 778 HD12 ILE 121 HD12 ILE 121 -7.618 10.450 3.762 779 HD13 ILE 121 HD13 ILE 121 -7.443 11.455 2.323 780 H ARG 122 HN ARG 122 -11.638 14.084 0.554 781 HA ARG 122 HA ARG 122 -13.557 15.467 2.069 782 HB2 ARG 122 HB2 ARG 122 -12.580 16.267 -0.069 783 HB3 ARG 122 HB1 ARG 122 -13.512 15.047 -0.922 784 HG2 ARG 122 HG2 ARG 122 -15.582 16.104 -0.064 785 HG3 ARG 122 HG1 ARG 122 -14.589 17.382 0.636 786 HD2 ARG 122 HD2 ARG 122 -15.457 18.104 -1.500 787 HD3 ARG 122 HD1 ARG 122 -13.710 17.890 -1.608 788 HE ARG 122 HE ARG 122 -15.461 15.706 -2.474 789 HH11 ARG 122 HH11 ARG 122 -13.128 18.197 -3.269 790 HH12 ARG 122 HH12 ARG 122 -12.899 17.636 -4.895 791 HH21 ARG 122 HH21 ARG 122 -15.152 14.959 -4.598 792 HH22 ARG 122 HH22 ARG 122 -14.058 15.795 -5.652 793 H LYS 123 HN LYS 123 -13.923 12.737 -0.212 794 HA LYS 123 HA LYS 123 -16.723 12.443 0.160 795 HB2 LYS 123 HB2 LYS 123 -16.564 10.400 -1.016 796 HB3 LYS 123 HB1 LYS 123 -15.295 11.404 -1.683 797 HG2 LYS 123 HG2 LYS 123 -13.877 10.177 0.195 798 HG3 LYS 123 HG1 LYS 123 -15.098 8.942 -0.073 799 HD2 LYS 123 HD2 LYS 123 -13.449 10.208 -2.253 800 HD3 LYS 123 HD1 LYS 123 -13.045 8.686 -1.464 801 HE2 LYS 123 HE2 LYS 123 -15.086 7.690 -2.277 802 HE3 LYS 123 HE1 LYS 123 -15.590 9.234 -2.969 803 HZ1 LYS 123 HZ1 LYS 123 -13.191 7.685 -3.793 804 HZ2 LYS 123 HZ2 LYS 123 -13.699 9.151 -4.463 805 HZ3 LYS 123 HZ3 LYS 123 -14.644 7.766 -4.653 806 H LEU 124 HN LEU 124 -13.944 11.216 1.867 807 HA LEU 124 HA LEU 124 -15.285 9.418 3.576 808 HB2 LEU 124 HB2 LEU 124 -12.726 10.965 3.912 809 HB3 LEU 124 HB1 LEU 124 -13.281 9.769 5.067 810 HG LEU 124 HG LEU 124 -12.576 9.236 2.174 811 HD11 LEU 124 HD11 LEU 124 -10.670 8.030 3.102 812 HD12 LEU 124 HD12 LEU 124 -11.155 8.488 4.732 813 HD13 LEU 124 HD13 LEU 124 -10.629 9.722 3.590 814 HD21 LEU 124 HD21 LEU 124 -14.336 7.767 2.935 815 HD22 LEU 124 HD22 LEU 124 -13.422 7.380 4.391 816 HD23 LEU 124 HD23 LEU 124 -12.820 6.877 2.812 817 H GLU 125 HN GLU 125 -14.371 12.837 4.003 818 HA GLU 125 HA GLU 125 -15.353 12.970 6.653 819 HB2 GLU 125 HB2 GLU 125 -14.859 15.237 4.729 820 HB3 GLU 125 HB1 GLU 125 -15.110 15.386 6.463 821 HG2 GLU 125 HG2 GLU 125 -13.080 13.977 6.800 822 HG3 GLU 125 HG1 GLU 125 -12.796 14.078 5.065 823 H ARG 126 HN ARG 126 -16.879 13.602 3.528 824 HA ARG 126 HA ARG 126 -19.186 14.846 4.590 825 HB2 ARG 126 HB2 ARG 126 -20.259 14.451 2.499 826 HB3 ARG 126 HB1 ARG 126 -18.574 14.803 2.149 827 HG2 ARG 126 HG2 ARG 126 -18.132 12.438 1.823 828 HG3 ARG 126 HG1 ARG 126 -19.808 12.059 2.227 829 HD2 ARG 126 HD2 ARG 126 -18.901 13.762 -0.088 830 HD3 ARG 126 HD1 ARG 126 -19.423 12.084 -0.199 831 HE ARG 126 HE ARG 126 -21.597 13.040 0.812 832 HH11 ARG 126 HH11 ARG 126 -19.513 14.679 -1.465 833 HH12 ARG 126 HH12 ARG 126 -20.792 15.618 -2.164 834 HH21 ARG 126 HH21 ARG 126 -23.300 14.270 -0.118 835 HH22 ARG 126 HH22 ARG 126 -22.941 15.382 -1.401 836 H LEU 127 HN LEU 127 -18.214 11.512 4.238 837 HA LEU 127 HA LEU 127 -20.666 10.341 5.064 838 HB2 LEU 127 HB2 LEU 127 -19.017 8.982 3.968 839 HB3 LEU 127 HB1 LEU 127 -17.803 9.396 5.159 840 HG LEU 127 HG LEU 127 -19.155 8.179 6.872 841 HD11 LEU 127 HD11 LEU 127 -20.746 7.366 4.455 842 HD12 LEU 127 HD12 LEU 127 -21.316 8.271 5.858 843 HD13 LEU 127 HD13 LEU 127 -20.839 6.584 6.032 844 HD21 LEU 127 HD21 LEU 127 -18.459 5.978 6.173 845 HD22 LEU 127 HD22 LEU 127 -17.226 7.158 5.730 846 HD23 LEU 127 HD23 LEU 127 -18.319 6.519 4.502 847 H LEU 128 HN LEU 128 -17.630 10.938 6.752 848 HA LEU 128 HA LEU 128 -18.278 10.222 9.313 849 HB2 LEU 128 HB2 LEU 128 -16.570 12.551 8.450 850 HB3 LEU 128 HB1 LEU 128 -16.511 11.781 10.021 851 HG LEU 128 HG LEU 128 -15.795 10.479 7.399 852 HD11 LEU 128 HD11 LEU 128 -14.043 11.372 9.681 853 HD12 LEU 128 HD12 LEU 128 -14.178 12.167 8.113 854 HD13 LEU 128 HD13 LEU 128 -13.509 10.538 8.221 855 HD21 LEU 128 HD21 LEU 128 -15.673 9.440 10.222 856 HD22 LEU 128 HD22 LEU 128 -14.964 8.643 8.818 857 HD23 LEU 128 HD23 LEU 128 -16.712 8.858 8.920 858 H GLU 129 HN GLU 129 -18.494 13.523 7.990 859 HA GLU 129 HA GLU 129 -19.494 14.580 10.431 860 HB2 GLU 129 HB2 GLU 129 -19.219 16.639 9.455 861 HB3 GLU 129 HB1 GLU 129 -18.094 15.640 8.552 862 HG2 GLU 129 HG2 GLU 129 -19.452 15.532 6.695 863 HG3 GLU 129 HG1 GLU 129 -20.849 16.075 7.618 864 H SER 130 HN SER 130 -20.972 13.729 7.370 865 HA SER 130 HA SER 130 -23.511 14.858 8.169 866 HB2 SER 130 HB2 SER 130 -22.700 14.821 5.791 867 HB3 SER 130 HB1 SER 130 -22.986 13.084 5.780 868 HG SER 130 HG SER 130 -24.845 15.196 5.972 869 H GLY 131 HN GLY 131 -21.992 11.765 8.396 870 HA2 GLY 131 HA2 GLY 131 -22.644 9.981 9.714 871 HA3 GLY 131 HA1 GLY 131 -24.119 10.852 10.101 872 H LEU 132 HN LEU 132 -23.069 10.143 6.830 873 HA LEU 132 HA LEU 132 -25.570 9.345 5.955 874 HB2 LEU 132 HB2 LEU 132 -23.711 10.113 4.534 875 HB3 LEU 132 HB1 LEU 132 -22.884 8.596 4.813 876 HG LEU 132 HG LEU 132 -24.871 7.452 3.742 877 HD11 LEU 132 HD11 LEU 132 -25.483 10.275 2.886 878 HD12 LEU 132 HD12 LEU 132 -26.464 9.285 3.965 879 HD13 LEU 132 HD13 LEU 132 -26.262 8.814 2.279 880 HD21 LEU 132 HD21 LEU 132 -24.081 7.980 1.477 881 HD22 LEU 132 HD22 LEU 132 -22.754 7.733 2.614 882 HD23 LEU 132 HD23 LEU 132 -23.206 9.366 2.127 883 H THR 133 HN THR 133 -22.791 7.096 6.167 884 HA THR 133 HA THR 133 -24.249 5.125 7.577 885 HB THR 133 HB THR 133 -25.450 4.752 5.540 886 HG1 THR 133 HG1 THR 133 -24.483 2.880 6.741 887 HG21 THR 133 HG21 THR 133 -22.800 4.416 4.130 888 HG22 THR 133 HG22 THR 133 -23.868 5.808 3.975 889 HG23 THR 133 HG23 THR 133 -24.401 4.225 3.411 Start of MODEL 17 1 H1 MET 1 HT1 MET 1 29.579 -9.352 8.265 2 H2 MET 1 HT2 MET 1 29.079 -7.933 9.037 3 H3 MET 1 HT3 MET 1 30.683 -8.101 8.538 4 HA MET 1 HA MET 1 30.021 -8.134 6.241 5 HB2 MET 1 HB2 MET 1 27.258 -7.808 7.423 6 HB3 MET 1 HB1 MET 1 27.630 -7.489 5.735 7 HG2 MET 1 HG2 MET 1 26.681 -9.665 5.899 8 HG3 MET 1 HG1 MET 1 28.391 -9.836 5.512 9 HE1 MET 1 HE1 MET 1 28.415 -12.379 6.175 10 HE2 MET 1 HE2 MET 1 26.684 -12.284 6.499 11 HE3 MET 1 HE3 MET 1 27.766 -13.003 7.691 12 H ASP 2 HN ASP 2 28.924 -6.074 5.127 13 HA ASP 2 HA ASP 2 28.912 -3.833 4.820 14 HB2 ASP 2 HB2 ASP 2 28.682 -3.699 7.833 15 HB3 ASP 2 HB1 ASP 2 28.396 -2.363 6.725 16 H SER 3 HN SER 3 31.144 -4.173 4.116 17 HA SER 3 HA SER 3 33.130 -3.061 5.963 18 HB2 SER 3 HB2 SER 3 34.770 -3.877 4.194 19 HB3 SER 3 HB1 SER 3 33.877 -5.132 5.053 20 HG SER 3 HG SER 3 33.928 -4.592 2.417 21 H ALA 4 HN ALA 4 32.017 -2.754 2.598 22 HA ALA 4 HA ALA 4 33.477 -0.299 2.207 23 HB1 ALA 4 HB1 ALA 4 32.457 -0.278 -0.002 24 HB2 ALA 4 HB2 ALA 4 31.375 -1.588 0.469 25 HB3 ALA 4 HB3 ALA 4 33.111 -1.875 0.361 26 H ILE 5 HN ILE 5 30.343 -1.233 3.258 27 HA ILE 5 HA ILE 5 29.119 1.348 2.822 28 HB ILE 5 HB ILE 5 28.084 -0.979 4.448 29 HG12 ILE 5 HG12 ILE 5 27.570 -0.338 1.535 30 HG13 ILE 5 HG11 ILE 5 28.626 -1.625 2.108 31 HG21 ILE 5 HG21 ILE 5 26.624 1.304 3.125 32 HG22 ILE 5 HG22 ILE 5 26.977 1.186 4.848 33 HG23 ILE 5 HG23 ILE 5 25.899 0.016 4.086 34 HD11 ILE 5 HD11 ILE 5 26.464 -2.487 1.435 35 HD12 ILE 5 HD12 ILE 5 25.665 -1.422 2.592 36 HD13 ILE 5 HD13 ILE 5 26.721 -2.714 3.165 37 H SER 6 HN SER 6 29.282 3.021 4.206 38 HA SER 6 HA SER 6 30.279 2.504 6.909 39 HB2 SER 6 HB2 SER 6 31.333 4.284 5.442 40 HB3 SER 6 HB1 SER 6 29.823 5.188 5.570 41 HG SER 6 HG SER 6 31.844 4.832 7.415 42 H LYS 7 HN LYS 7 29.179 4.321 8.506 43 HA LYS 7 HA LYS 7 26.498 3.500 8.875 44 HB2 LYS 7 HB2 LYS 7 28.175 4.623 10.548 45 HB3 LYS 7 HB1 LYS 7 27.510 6.126 9.923 46 HG2 LYS 7 HG2 LYS 7 25.226 5.067 10.479 47 HG3 LYS 7 HG1 LYS 7 26.164 3.977 11.498 48 HD2 LYS 7 HD2 LYS 7 27.162 6.004 12.575 49 HD3 LYS 7 HD1 LYS 7 26.005 6.976 11.675 50 HE2 LYS 7 HE2 LYS 7 25.175 6.590 13.906 51 HE3 LYS 7 HE1 LYS 7 24.170 5.731 12.742 52 HZ1 LYS 7 HZ1 LYS 7 25.352 3.693 13.283 53 HZ2 LYS 7 HZ2 LYS 7 24.655 4.364 14.665 54 HZ3 LYS 7 HZ3 LYS 7 26.315 4.523 14.398 55 H GLU 8 HN GLU 8 28.010 5.993 7.078 56 HA GLU 8 HA GLU 8 26.138 7.895 6.613 57 HB2 GLU 8 HB2 GLU 8 28.454 7.939 5.881 58 HB3 GLU 8 HB1 GLU 8 28.150 6.617 4.759 59 HG2 GLU 8 HG2 GLU 8 28.263 8.680 3.591 60 HG3 GLU 8 HG1 GLU 8 26.623 8.047 3.524 61 H ASP 9 HN ASP 9 26.737 5.165 4.393 62 HA ASP 9 HA ASP 9 24.440 5.658 2.825 63 HB2 ASP 9 HB2 ASP 9 26.449 4.493 1.992 64 HB3 ASP 9 HB1 ASP 9 26.102 3.142 3.059 65 H GLU 10 HN GLU 10 25.032 3.670 5.614 66 HA GLU 10 HA GLU 10 22.759 1.990 5.372 67 HB2 GLU 10 HB2 GLU 10 24.704 1.330 6.681 68 HB3 GLU 10 HB1 GLU 10 24.465 2.694 7.764 69 HG2 GLU 10 HG2 GLU 10 23.657 0.772 8.868 70 HG3 GLU 10 HG1 GLU 10 22.254 1.717 8.371 71 H GLU 11 HN GLU 11 23.419 4.583 7.728 72 HA GLU 11 HA GLU 11 20.890 4.645 8.844 73 HB2 GLU 11 HB2 GLU 11 23.003 6.778 8.632 74 HB3 GLU 11 HB1 GLU 11 21.542 6.962 9.596 75 HG2 GLU 11 HG2 GLU 11 23.456 4.682 9.956 76 HG3 GLU 11 HG1 GLU 11 23.610 6.201 10.833 77 H ARG 12 HN ARG 12 22.135 6.352 6.024 78 HA ARG 12 HA ARG 12 19.889 8.038 5.666 79 HB2 ARG 12 HB2 ARG 12 21.968 8.535 4.531 80 HB3 ARG 12 HB1 ARG 12 21.911 7.003 3.672 81 HG2 ARG 12 HG2 ARG 12 21.279 8.864 2.232 82 HG3 ARG 12 HG1 ARG 12 19.941 7.737 2.450 83 HD2 ARG 12 HD2 ARG 12 18.995 9.233 4.166 84 HD3 ARG 12 HD1 ARG 12 20.307 10.373 3.873 85 HE ARG 12 HE ARG 12 18.851 9.701 1.497 86 HH11 ARG 12 HH11 ARG 12 18.849 11.759 4.325 87 HH12 ARG 12 HH12 ARG 12 17.894 12.999 3.578 88 HH21 ARG 12 HH21 ARG 12 17.582 11.320 0.511 89 HH22 ARG 12 HH22 ARG 12 17.176 12.754 1.404 90 H TYR 13 HN TYR 13 20.642 4.757 4.621 91 HA TYR 13 HA TYR 13 18.335 4.436 2.994 92 HB2 TYR 13 HB2 TYR 13 20.113 2.919 2.609 93 HB3 TYR 13 HB1 TYR 13 20.240 2.511 4.315 94 HD1 TYR 13 HD1 TYR 13 19.581 0.373 4.805 95 HD2 TYR 13 HD2 TYR 13 17.521 2.486 1.746 96 HE1 TYR 13 HE1 TYR 13 18.091 -1.559 4.483 97 HE2 TYR 13 HE2 TYR 13 16.023 0.570 1.419 98 HH TYR 13 HH TYR 13 15.833 -2.016 3.607 99 H GLN 14 HN GLN 14 19.115 3.620 6.340 100 HA GLN 14 HA GLN 14 16.794 2.313 7.107 101 HB2 GLN 14 HB2 GLN 14 18.509 4.222 8.702 102 HB3 GLN 14 HB1 GLN 14 17.311 3.144 9.397 103 HG2 GLN 14 HG2 GLN 14 19.733 2.272 7.842 104 HG3 GLN 14 HG1 GLN 14 19.602 2.304 9.598 105 HE21 GLN 14 HE21 GLN 14 18.631 0.710 6.680 106 HE22 GLN 14 HE22 GLN 14 17.927 -0.681 7.421 107 H LYS 15 HN LYS 15 17.473 5.783 7.534 108 HA LYS 15 HA LYS 15 14.939 6.527 8.377 109 HB2 LYS 15 HB2 LYS 15 16.971 8.116 6.819 110 HB3 LYS 15 HB1 LYS 15 15.509 8.808 7.512 111 HG2 LYS 15 HG2 LYS 15 17.668 7.432 9.087 112 HG3 LYS 15 HG1 LYS 15 17.519 9.176 8.887 113 HD2 LYS 15 HD2 LYS 15 15.494 7.350 10.184 114 HD3 LYS 15 HD1 LYS 15 16.585 8.455 11.020 115 HE2 LYS 15 HE2 LYS 15 15.528 10.341 9.825 116 HE3 LYS 15 HE1 LYS 15 14.396 9.206 9.091 117 HZ1 LYS 15 HZ1 LYS 15 14.676 9.725 12.000 118 HZ2 LYS 15 HZ2 LYS 15 13.588 8.641 11.293 119 HZ3 LYS 15 HZ3 LYS 15 13.430 10.299 11.011 120 H LEU 16 HN LEU 16 16.144 5.999 5.132 121 HA LEU 16 HA LEU 16 14.027 7.276 3.767 122 HB2 LEU 16 HB2 LEU 16 16.283 6.635 2.827 123 HB3 LEU 16 HB1 LEU 16 15.686 4.988 2.731 124 HG LEU 16 HG LEU 16 14.004 5.620 1.126 125 HD11 LEU 16 HD11 LEU 16 13.875 7.954 0.305 126 HD12 LEU 16 HD12 LEU 16 14.975 8.437 1.592 127 HD13 LEU 16 HD13 LEU 16 13.382 7.787 1.987 128 HD21 LEU 16 HD21 LEU 16 16.276 5.148 0.335 129 HD22 LEU 16 HD22 LEU 16 16.648 6.870 0.420 130 HD23 LEU 16 HD23 LEU 16 15.425 6.287 -0.711 131 H VAL 17 HN VAL 17 14.592 3.884 4.652 132 HA VAL 17 HA VAL 17 12.186 2.894 3.569 133 HB VAL 17 HB VAL 17 12.564 0.895 4.683 134 HG11 VAL 17 HG11 VAL 17 14.960 0.484 4.616 135 HG12 VAL 17 HG12 VAL 17 15.248 2.226 4.592 136 HG13 VAL 17 HG13 VAL 17 14.422 1.450 3.240 137 HG21 VAL 17 HG21 VAL 17 13.812 0.627 6.771 138 HG22 VAL 17 HG22 VAL 17 12.429 1.705 6.975 139 HG23 VAL 17 HG23 VAL 17 14.056 2.373 6.847 140 H THR 18 HN THR 18 13.017 4.312 6.653 141 HA THR 18 HA THR 18 10.669 3.944 8.055 142 HB THR 18 HB THR 18 12.897 5.921 8.063 143 HG1 THR 18 HG1 THR 18 13.507 4.714 9.680 144 HG21 THR 18 HG21 THR 18 11.909 7.073 9.989 145 HG22 THR 18 HG22 THR 18 10.393 6.215 9.696 146 HG23 THR 18 HG23 THR 18 11.028 7.334 8.487 147 H GLU 19 HN GLU 19 11.619 6.577 5.871 148 HA GLU 19 HA GLU 19 9.384 8.185 6.153 149 HB2 GLU 19 HB2 GLU 19 11.135 7.747 3.726 150 HB3 GLU 19 HB1 GLU 19 9.947 9.039 3.869 151 HG2 GLU 19 HG2 GLU 19 11.164 9.809 5.918 152 HG3 GLU 19 HG1 GLU 19 12.417 8.627 5.537 153 H ASN 20 HN ASN 20 9.883 5.480 3.893 154 HA ASN 20 HA ASN 20 7.341 6.009 2.665 155 HB2 ASN 20 HB2 ASN 20 7.845 4.406 1.062 156 HB3 ASN 20 HB1 ASN 20 9.422 5.049 1.491 157 HD21 ASN 20 HD21 ASN 20 10.893 3.747 2.500 158 HD22 ASN 20 HD22 ASN 20 10.662 2.043 2.699 159 H GLU 21 HN GLU 21 8.513 3.804 5.163 160 HA GLU 21 HA GLU 21 6.311 2.081 5.234 161 HB2 GLU 21 HB2 GLU 21 8.056 3.085 7.477 162 HB3 GLU 21 HB1 GLU 21 6.951 1.719 7.597 163 HG2 GLU 21 HG2 GLU 21 9.078 1.845 5.519 164 HG3 GLU 21 HG1 GLU 21 9.408 1.252 7.135 165 H GLN 22 HN GLN 22 6.786 5.270 6.624 166 HA GLN 22 HA GLN 22 4.606 5.326 8.375 167 HB2 GLN 22 HB2 GLN 22 5.519 7.736 6.818 168 HB3 GLN 22 HB1 GLN 22 4.826 7.681 8.430 169 HG2 GLN 22 HG2 GLN 22 6.826 6.663 9.320 170 HG3 GLN 22 HG1 GLN 22 7.536 6.581 7.710 171 HE21 GLN 22 HE21 GLN 22 6.680 8.630 10.367 172 HE22 GLN 22 HE22 GLN 22 7.579 10.015 9.854 173 H LEU 23 HN LEU 23 4.809 6.742 5.120 174 HA LEU 23 HA LEU 23 2.021 7.395 5.286 175 HB2 LEU 23 HB2 LEU 23 2.307 8.779 3.440 176 HB3 LEU 23 HB1 LEU 23 3.780 8.919 4.362 177 HG LEU 23 HG LEU 23 3.387 7.487 1.762 178 HD11 LEU 23 HD11 LEU 23 5.119 9.798 2.581 179 HD12 LEU 23 HD12 LEU 23 3.640 9.894 1.628 180 HD13 LEU 23 HD13 LEU 23 5.059 9.074 0.975 181 HD21 LEU 23 HD21 LEU 23 5.785 6.963 1.853 182 HD22 LEU 23 HD22 LEU 23 4.845 6.103 3.073 183 HD23 LEU 23 HD23 LEU 23 5.814 7.505 3.531 184 H GLN 24 HN GLN 24 3.795 4.776 3.896 185 HA GLN 24 HA GLN 24 1.855 4.040 1.975 186 HB2 GLN 24 HB2 GLN 24 2.827 1.844 1.947 187 HB3 GLN 24 HB1 GLN 24 4.124 3.023 2.058 188 HG2 GLN 24 HG2 GLN 24 4.446 2.554 4.374 189 HG3 GLN 24 HG1 GLN 24 3.007 1.537 4.419 190 HE21 GLN 24 HE21 GLN 24 6.299 1.794 3.302 191 HE22 GLN 24 HE22 GLN 24 6.530 0.109 2.988 192 H ARG 25 HN ARG 25 2.073 3.658 5.425 193 HA ARG 25 HA ARG 25 -0.072 1.835 5.745 194 HB2 ARG 25 HB2 ARG 25 1.230 1.937 7.649 195 HB3 ARG 25 HB1 ARG 25 1.540 3.660 7.465 196 HG2 ARG 25 HG2 ARG 25 -0.972 3.889 7.983 197 HG3 ARG 25 HG1 ARG 25 -0.799 2.281 8.689 198 HD2 ARG 25 HD2 ARG 25 1.052 3.160 10.094 199 HD3 ARG 25 HD1 ARG 25 0.750 4.770 9.428 200 HE ARG 25 HE ARG 25 -1.380 3.324 10.859 201 HH11 ARG 25 HH11 ARG 25 0.769 6.074 10.591 202 HH12 ARG 25 HH12 ARG 25 -0.078 7.010 11.776 203 HH21 ARG 25 HH21 ARG 25 -2.496 4.563 12.429 204 HH22 ARG 25 HH22 ARG 25 -1.932 6.157 12.814 205 H LEU 26 HN LEU 26 0.301 5.330 5.848 206 HA LEU 26 HA LEU 26 -2.315 6.056 6.501 207 HB2 LEU 26 HB2 LEU 26 -0.281 7.531 4.821 208 HB3 LEU 26 HB1 LEU 26 -1.678 8.262 5.602 209 HG LEU 26 HG LEU 26 0.555 6.857 7.086 210 HD11 LEU 26 HD11 LEU 26 1.241 8.982 5.905 211 HD12 LEU 26 HD12 LEU 26 1.488 8.928 7.648 212 HD13 LEU 26 HD13 LEU 26 0.122 9.824 6.979 213 HD21 LEU 26 HD21 LEU 26 -1.707 8.588 8.062 214 HD22 LEU 26 HD22 LEU 26 -0.426 7.901 9.059 215 HD23 LEU 26 HD23 LEU 26 -1.580 6.839 8.251 216 H ILE 27 HN ILE 27 -0.764 5.521 3.383 217 HA ILE 27 HA ILE 27 -2.928 5.905 1.670 218 HB ILE 27 HB ILE 27 -0.690 3.885 1.584 219 HG12 ILE 27 HG12 ILE 27 -1.071 6.465 0.070 220 HG13 ILE 27 HG11 ILE 27 -0.066 6.279 1.515 221 HG21 ILE 27 HG21 ILE 27 -2.762 4.526 -0.486 222 HG22 ILE 27 HG22 ILE 27 -2.347 2.956 0.196 223 HG23 ILE 27 HG23 ILE 27 -1.218 3.778 -0.881 224 HD11 ILE 27 HD11 ILE 27 1.282 4.620 0.309 225 HD12 ILE 27 HD12 ILE 27 1.305 6.211 -0.448 226 HD13 ILE 27 HD13 ILE 27 0.319 4.918 -1.135 227 H THR 28 HN THR 28 -1.836 2.960 3.285 228 HA THR 28 HA THR 28 -3.769 1.232 2.339 229 HB THR 28 HB THR 28 -1.621 1.207 4.214 230 HG1 THR 28 HG1 THR 28 -1.781 -0.083 2.346 231 HG21 THR 28 HG21 THR 28 -3.137 0.995 6.026 232 HG22 THR 28 HG22 THR 28 -2.479 -0.610 5.702 233 HG23 THR 28 HG23 THR 28 -4.107 -0.199 5.162 234 H GLN 29 HN GLN 29 -3.906 3.405 5.132 235 HA GLN 29 HA GLN 29 -6.232 2.465 6.365 236 HB2 GLN 29 HB2 GLN 29 -5.503 5.375 5.999 237 HB3 GLN 29 HB1 GLN 29 -6.515 4.692 7.262 238 HG2 GLN 29 HG2 GLN 29 -4.502 3.420 8.012 239 HG3 GLN 29 HG1 GLN 29 -3.559 4.401 6.905 240 HE21 GLN 29 HE21 GLN 29 -3.484 4.231 9.837 241 HE22 GLN 29 HE22 GLN 29 -3.745 5.845 10.404 242 H LYS 30 HN LYS 30 -5.821 4.888 3.880 243 HA LYS 30 HA LYS 30 -8.626 5.342 3.543 244 HB2 LYS 30 HB2 LYS 30 -6.651 6.119 1.437 245 HB3 LYS 30 HB1 LYS 30 -8.056 6.992 2.022 246 HG2 LYS 30 HG2 LYS 30 -5.367 6.733 3.343 247 HG3 LYS 30 HG1 LYS 30 -6.127 8.188 2.710 248 HD2 LYS 30 HD2 LYS 30 -7.190 6.590 5.037 249 HD3 LYS 30 HD1 LYS 30 -6.156 8.008 5.199 250 HE2 LYS 30 HE2 LYS 30 -7.859 9.343 4.019 251 HE3 LYS 30 HE1 LYS 30 -8.898 7.918 3.950 252 HZ1 LYS 30 HZ1 LYS 30 -9.477 9.375 5.793 253 HZ2 LYS 30 HZ2 LYS 30 -7.924 9.211 6.437 254 HZ3 LYS 30 HZ3 LYS 30 -8.947 7.870 6.354 255 H GLU 31 HN GLU 31 -6.162 3.511 1.809 256 HA GLU 31 HA GLU 31 -7.582 2.831 -0.476 257 HB2 GLU 31 HB2 GLU 31 -5.369 1.479 1.023 258 HB3 GLU 31 HB1 GLU 31 -6.086 0.713 -0.388 259 HG2 GLU 31 HG2 GLU 31 -4.976 3.501 -0.433 260 HG3 GLU 31 HG1 GLU 31 -4.010 2.072 -0.792 261 H GLU 32 HN GLU 32 -7.451 1.057 2.623 262 HA GLU 32 HA GLU 32 -9.063 -1.083 1.751 263 HB2 GLU 32 HB2 GLU 32 -9.450 -1.513 4.183 264 HB3 GLU 32 HB1 GLU 32 -7.757 -1.368 3.736 265 HG2 GLU 32 HG2 GLU 32 -7.676 0.872 4.609 266 HG3 GLU 32 HG1 GLU 32 -9.405 0.830 4.956 267 H LYS 33 HN LYS 33 -9.860 2.084 3.031 268 HA LYS 33 HA LYS 33 -12.649 1.540 3.359 269 HB2 LYS 33 HB2 LYS 33 -11.343 4.229 2.903 270 HB3 LYS 33 HB1 LYS 33 -12.919 3.928 3.618 271 HG2 LYS 33 HG2 LYS 33 -10.238 3.251 4.807 272 HG3 LYS 33 HG1 LYS 33 -11.346 4.516 5.334 273 HD2 LYS 33 HD2 LYS 33 -13.020 2.732 5.843 274 HD3 LYS 33 HD1 LYS 33 -11.774 1.534 5.482 275 HE2 LYS 33 HE2 LYS 33 -11.683 3.639 7.642 276 HE3 LYS 33 HE1 LYS 33 -11.896 1.906 7.873 277 HZ1 LYS 33 HZ1 LYS 33 -9.477 3.155 6.680 278 HZ2 LYS 33 HZ2 LYS 33 -9.681 1.515 7.075 279 HZ3 LYS 33 HZ3 LYS 33 -9.614 2.680 8.299 280 H ILE 34 HN ILE 34 -10.700 3.111 0.847 281 HA ILE 34 HA ILE 34 -12.834 3.661 -0.921 282 HB ILE 34 HB ILE 34 -9.880 3.319 -1.489 283 HG12 ILE 34 HG12 ILE 34 -11.401 5.895 -1.443 284 HG13 ILE 34 HG11 ILE 34 -10.852 5.174 0.069 285 HG21 ILE 34 HG21 ILE 34 -11.081 2.990 -3.536 286 HG22 ILE 34 HG22 ILE 34 -10.358 4.604 -3.556 287 HG23 ILE 34 HG23 ILE 34 -12.082 4.411 -3.227 288 HD11 ILE 34 HD11 ILE 34 -8.549 5.240 -0.709 289 HD12 ILE 34 HD12 ILE 34 -9.278 6.847 -0.762 290 HD13 ILE 34 HD13 ILE 34 -9.080 5.919 -2.249 291 H ARG 35 HN ARG 35 -10.880 0.815 -0.375 292 HA ARG 35 HA ARG 35 -11.433 -0.680 -2.612 293 HB2 ARG 35 HB2 ARG 35 -10.007 -1.062 -0.388 294 HB3 ARG 35 HB1 ARG 35 -11.432 -2.017 0.035 295 HG2 ARG 35 HG2 ARG 35 -11.193 -3.232 -2.065 296 HG3 ARG 35 HG1 ARG 35 -9.742 -2.308 -2.422 297 HD2 ARG 35 HD2 ARG 35 -8.649 -3.231 -0.457 298 HD3 ARG 35 HD1 ARG 35 -10.109 -4.128 -0.045 299 HE ARG 35 HE ARG 35 -9.704 -5.142 -2.402 300 HH11 ARG 35 HH11 ARG 35 -7.246 -4.316 -0.042 301 HH12 ARG 35 HH12 ARG 35 -6.129 -5.522 -0.599 302 HH21 ARG 35 HH21 ARG 35 -8.235 -6.732 -3.125 303 HH22 ARG 35 HH22 ARG 35 -6.694 -6.896 -2.348 304 H VAL 36 HN VAL 36 -13.359 -0.109 0.274 305 HA VAL 36 HA VAL 36 -15.434 -1.945 -0.377 306 HB VAL 36 HB VAL 36 -15.687 0.568 1.275 307 HG11 VAL 36 HG11 VAL 36 -17.409 -0.723 2.468 308 HG12 VAL 36 HG12 VAL 36 -17.184 -2.050 1.327 309 HG13 VAL 36 HG13 VAL 36 -17.804 -0.498 0.763 310 HG21 VAL 36 HG21 VAL 36 -13.721 -0.843 1.901 311 HG22 VAL 36 HG22 VAL 36 -14.851 -2.158 2.240 312 HG23 VAL 36 HG23 VAL 36 -14.933 -0.664 3.174 313 H LEU 37 HN LEU 37 -14.801 1.427 -1.052 314 HA LEU 37 HA LEU 37 -17.216 1.983 -2.426 315 HB2 LEU 37 HB2 LEU 37 -14.528 3.263 -2.256 316 HB3 LEU 37 HB1 LEU 37 -15.606 3.762 -3.545 317 HG LEU 37 HG LEU 37 -15.640 5.181 -1.455 318 HD11 LEU 37 HD11 LEU 37 -18.080 5.431 -1.461 319 HD12 LEU 37 HD12 LEU 37 -18.226 3.911 -2.344 320 HD13 LEU 37 HD13 LEU 37 -17.424 5.298 -3.093 321 HD21 LEU 37 HD21 LEU 37 -16.923 4.381 0.441 322 HD22 LEU 37 HD22 LEU 37 -15.511 3.358 0.168 323 HD23 LEU 37 HD23 LEU 37 -17.109 2.807 -0.333 324 H ARG 38 HN ARG 38 -14.217 0.459 -3.336 325 HA ARG 38 HA ARG 38 -14.449 0.477 -6.117 326 HB2 ARG 38 HB2 ARG 38 -13.410 -1.714 -4.309 327 HB3 ARG 38 HB1 ARG 38 -13.203 -1.691 -6.054 328 HG2 ARG 38 HG2 ARG 38 -12.156 0.412 -4.174 329 HG3 ARG 38 HG1 ARG 38 -11.211 -0.929 -4.828 330 HD2 ARG 38 HD2 ARG 38 -11.632 -0.115 -7.090 331 HD3 ARG 38 HD1 ARG 38 -12.580 1.218 -6.437 332 HE ARG 38 HE ARG 38 -10.035 1.285 -5.271 333 HH11 ARG 38 HH11 ARG 38 -11.573 1.733 -8.372 334 HH12 ARG 38 HH12 ARG 38 -10.378 2.848 -8.956 335 HH21 ARG 38 HH21 ARG 38 -8.459 2.778 -6.025 336 HH22 ARG 38 HH22 ARG 38 -8.617 3.453 -7.615 337 H GLN 39 HN GLN 39 -15.786 -1.781 -3.742 338 HA GLN 39 HA GLN 39 -17.210 -3.437 -5.459 339 HB2 GLN 39 HB2 GLN 39 -17.904 -2.539 -2.662 340 HB3 GLN 39 HB1 GLN 39 -18.628 -3.910 -3.494 341 HG2 GLN 39 HG2 GLN 39 -15.686 -3.670 -2.958 342 HG3 GLN 39 HG1 GLN 39 -16.812 -4.462 -1.869 343 HE21 GLN 39 HE21 GLN 39 -15.130 -4.644 -4.865 344 HE22 GLN 39 HE22 GLN 39 -15.531 -6.281 -5.224 345 H ARG 40 HN ARG 40 -18.184 -0.375 -3.947 346 HA ARG 40 HA ARG 40 -20.775 -0.208 -4.966 347 HB2 ARG 40 HB2 ARG 40 -18.752 1.717 -3.984 348 HB3 ARG 40 HB1 ARG 40 -20.035 2.380 -4.975 349 HG2 ARG 40 HG2 ARG 40 -20.544 2.563 -2.614 350 HG3 ARG 40 HG1 ARG 40 -21.701 1.518 -3.431 351 HD2 ARG 40 HD2 ARG 40 -19.308 0.380 -2.037 352 HD3 ARG 40 HD1 ARG 40 -20.757 0.812 -1.133 353 HE ARG 40 HE ARG 40 -21.201 -0.908 -3.425 354 HH11 ARG 40 HH11 ARG 40 -20.725 -0.671 0.033 355 HH12 ARG 40 HH12 ARG 40 -21.248 -2.297 0.344 356 HH21 ARG 40 HH21 ARG 40 -21.948 -3.007 -3.030 357 HH22 ARG 40 HH22 ARG 40 -21.958 -3.633 -1.407 358 H LEU 41 HN LEU 41 -17.666 0.623 -6.422 359 HA LEU 41 HA LEU 41 -18.934 1.720 -8.763 360 HB2 LEU 41 HB2 LEU 41 -16.038 0.986 -8.662 361 HB3 LEU 41 HB1 LEU 41 -16.843 2.260 -9.562 362 HG LEU 41 HG LEU 41 -16.415 2.267 -6.574 363 HD11 LEU 41 HD11 LEU 41 -14.765 4.008 -7.027 364 HD12 LEU 41 HD12 LEU 41 -15.002 3.784 -8.760 365 HD13 LEU 41 HD13 LEU 41 -14.317 2.482 -7.788 366 HD21 LEU 41 HD21 LEU 41 -18.415 3.499 -7.298 367 HD22 LEU 41 HD22 LEU 41 -17.420 4.436 -8.413 368 HD23 LEU 41 HD23 LEU 41 -17.161 4.570 -6.674 369 H VAL 42 HN VAL 42 -17.866 -1.387 -7.729 370 HA VAL 42 HA VAL 42 -17.732 -2.685 -10.232 371 HB VAL 42 HB VAL 42 -18.751 -3.703 -7.564 372 HG11 VAL 42 HG11 VAL 42 -19.696 -5.022 -9.357 373 HG12 VAL 42 HG12 VAL 42 -18.478 -5.955 -8.484 374 HG13 VAL 42 HG13 VAL 42 -18.095 -5.259 -10.060 375 HG21 VAL 42 HG21 VAL 42 -16.414 -3.084 -7.498 376 HG22 VAL 42 HG22 VAL 42 -16.093 -4.040 -8.945 377 HG23 VAL 42 HG23 VAL 42 -16.571 -4.839 -7.446 378 H GLU 43 HN GLU 43 -20.345 -1.794 -8.120 379 HA GLU 43 HA GLU 43 -22.427 -2.918 -9.716 380 HB2 GLU 43 HB2 GLU 43 -22.553 -0.870 -7.492 381 HB3 GLU 43 HB1 GLU 43 -23.919 -1.768 -8.143 382 HG2 GLU 43 HG2 GLU 43 -23.073 -3.823 -7.302 383 HG3 GLU 43 HG1 GLU 43 -21.535 -3.080 -6.873 384 H ARG 44 HN ARG 44 -20.607 -0.018 -9.805 385 HA ARG 44 HA ARG 44 -22.562 1.415 -11.392 386 HB2 ARG 44 HB2 ARG 44 -21.325 3.272 -11.009 387 HB3 ARG 44 HB1 ARG 44 -20.693 2.325 -9.674 388 HG2 ARG 44 HG2 ARG 44 -18.746 1.810 -10.814 389 HG3 ARG 44 HG1 ARG 44 -19.438 2.316 -12.352 390 HD2 ARG 44 HD2 ARG 44 -18.738 4.111 -10.030 391 HD3 ARG 44 HD1 ARG 44 -17.846 3.983 -11.543 392 HE ARG 44 HE ARG 44 -20.624 4.738 -11.820 393 HH11 ARG 44 HH11 ARG 44 -17.326 5.862 -11.472 394 HH12 ARG 44 HH12 ARG 44 -17.664 7.434 -12.121 395 HH21 ARG 44 HH21 ARG 44 -21.070 6.796 -12.664 396 HH22 ARG 44 HH22 ARG 44 -19.798 7.970 -12.796 397 H GLY 45 HN GLY 45 -19.617 -0.366 -11.700 398 HA2 GLY 45 HA2 GLY 45 -19.309 -1.760 -13.641 399 HA3 GLY 45 HA1 GLY 45 -20.012 -0.473 -14.614 400 H ASP 46 HN ASP 46 -17.784 0.393 -12.135 401 HA ASP 46 HA ASP 46 -15.945 1.479 -14.074 402 HB2 ASP 46 HB2 ASP 46 -16.455 2.685 -11.996 403 HB3 ASP 46 HB1 ASP 46 -15.802 1.354 -11.052 404 H ALA 47 HN ALA 47 -16.146 -1.286 -11.991 405 HA ALA 47 HA ALA 47 -13.404 -2.035 -12.092 406 HB1 ALA 47 HB1 ALA 47 -14.150 -4.138 -11.113 407 HB2 ALA 47 HB2 ALA 47 -15.829 -3.708 -11.446 408 HB3 ALA 47 HB3 ALA 47 -14.886 -2.761 -10.294 409 H LYS 48 HN LYS 48 -15.662 -1.976 -14.493 410 HA LYS 48 HA LYS 48 -15.054 -4.455 -15.798 411 HB2 LYS 48 HB2 LYS 48 -16.372 -1.939 -16.841 412 HB3 LYS 48 HB1 LYS 48 -16.290 -3.468 -17.709 413 HG2 LYS 48 HG2 LYS 48 -17.630 -3.078 -15.040 414 HG3 LYS 48 HG1 LYS 48 -18.459 -3.092 -16.597 415 HD2 LYS 48 HD2 LYS 48 -17.888 -5.367 -16.975 416 HD3 LYS 48 HD1 LYS 48 -16.759 -5.375 -15.621 417 HE2 LYS 48 HE2 LYS 48 -18.564 -5.118 -14.058 418 HE3 LYS 48 HE1 LYS 48 -19.728 -4.975 -15.374 419 HZ1 LYS 48 HZ1 LYS 48 -19.228 -7.240 -16.023 420 HZ2 LYS 48 HZ2 LYS 48 -19.729 -7.193 -14.410 421 HZ3 LYS 48 HZ3 LYS 48 -18.091 -7.378 -14.779 422 H GLY 49 HN GLY 49 -13.733 -1.252 -15.713 423 HA2 GLY 49 HA2 GLY 49 -12.147 -1.470 -18.087 424 HA3 GLY 49 HA1 GLY 49 -11.947 -0.285 -16.803 425 H THR 50 HN THR 50 -10.427 -2.726 -18.342 426 HA THR 50 HA THR 50 -8.963 -3.576 -15.936 427 HB THR 50 HB THR 50 -9.210 -5.094 -18.540 428 HG1 THR 50 HG1 THR 50 -10.733 -5.119 -16.159 429 HG21 THR 50 HG21 THR 50 -7.196 -5.632 -17.261 430 HG22 THR 50 HG22 THR 50 -8.337 -6.977 -17.223 431 HG23 THR 50 HG23 THR 50 -8.172 -5.918 -15.822 432 H GLU 51 HN GLU 51 -7.338 -2.091 -15.921 433 HA GLU 51 HA GLU 51 -5.842 -1.405 -18.260 434 HB2 GLU 51 HB2 GLU 51 -5.421 -0.914 -15.321 435 HB3 GLU 51 HB1 GLU 51 -4.191 -0.492 -16.500 436 HG2 GLU 51 HG2 GLU 51 -5.506 1.435 -15.948 437 HG3 GLU 51 HG1 GLU 51 -5.797 0.981 -17.623 438 H LEU 52 HN LEU 52 -4.011 -2.270 -19.034 439 HA LEU 52 HA LEU 52 -3.314 -4.901 -18.049 440 HB2 LEU 52 HB2 LEU 52 -2.303 -3.360 -20.440 441 HB3 LEU 52 HB1 LEU 52 -1.952 -5.039 -20.092 442 HG LEU 52 HG LEU 52 -4.679 -3.907 -20.718 443 HD11 LEU 52 HD11 LEU 52 -4.478 -5.242 -22.769 444 HD12 LEU 52 HD12 LEU 52 -2.819 -5.642 -22.329 445 HD13 LEU 52 HD13 LEU 52 -3.262 -3.970 -22.669 446 HD21 LEU 52 HD21 LEU 52 -4.850 -5.766 -19.167 447 HD22 LEU 52 HD22 LEU 52 -3.805 -6.746 -20.196 448 HD23 LEU 52 HD23 LEU 52 -5.398 -6.255 -20.770 449 H ASN 53 HN ASN 53 -2.534 -3.740 -16.042 450 HA ASN 53 HA ASN 53 -0.047 -2.358 -16.082 451 HB2 ASN 53 HB2 ASN 53 -1.558 -2.082 -14.208 452 HB3 ASN 53 HB1 ASN 53 -1.513 -3.806 -13.864 453 HD21 ASN 53 HD21 ASN 53 1.258 -1.773 -14.684 454 HD22 ASN 53 HD22 ASN 53 2.051 -1.949 -13.158 455 H GLY 84 HN GLY 84 29.204 -12.213 -9.985 456 HA2 GLY 84 HA2 GLY 84 30.225 -14.801 -10.579 457 HA3 GLY 84 HA1 GLY 84 29.632 -14.257 -9.013 458 HA PRO 85 HA PRO 85 25.732 -16.352 -9.941 459 HB2 PRO 85 HB2 PRO 85 23.827 -14.654 -9.110 460 HB3 PRO 85 HB1 PRO 85 24.906 -15.458 -7.961 461 HG2 PRO 85 HG2 PRO 85 25.059 -12.680 -9.074 462 HG3 PRO 85 HG1 PRO 85 25.268 -13.222 -7.397 463 HD2 PRO 85 HD2 PRO 85 27.361 -12.698 -9.064 464 HD3 PRO 85 HD1 PRO 85 27.442 -13.893 -7.755 465 H LEU 86 HN LEU 86 23.397 -15.632 -10.938 466 HA LEU 86 HA LEU 86 23.596 -15.148 -13.590 467 HB2 LEU 86 HB2 LEU 86 21.225 -13.897 -13.089 468 HB3 LEU 86 HB1 LEU 86 21.443 -15.623 -13.273 469 HG LEU 86 HG LEU 86 21.644 -15.815 -10.794 470 HD11 LEU 86 HD11 LEU 86 20.899 -13.958 -9.398 471 HD12 LEU 86 HD12 LEU 86 20.814 -12.923 -10.820 472 HD13 LEU 86 HD13 LEU 86 22.370 -13.547 -10.279 473 HD21 LEU 86 HD21 LEU 86 19.119 -14.561 -11.854 474 HD22 LEU 86 HD22 LEU 86 19.254 -15.477 -10.353 475 HD23 LEU 86 HD23 LEU 86 19.542 -16.272 -11.900 476 H GLY 87 HN GLY 87 24.564 -13.623 -14.683 477 HA2 GLY 87 HA2 GLY 87 25.102 -11.045 -13.512 478 HA3 GLY 87 HA1 GLY 87 25.669 -11.625 -15.068 479 H SER 88 HN SER 88 22.464 -12.189 -15.124 480 HA SER 88 HA SER 88 21.912 -9.788 -16.639 481 HB2 SER 88 HB2 SER 88 20.195 -12.204 -16.020 482 HB3 SER 88 HB1 SER 88 19.739 -10.897 -17.112 483 HG SER 88 HG SER 88 21.661 -12.905 -17.429 484 H ARG 89 HN ARG 89 21.249 -11.084 -13.495 485 HA ARG 89 HA ARG 89 19.326 -8.941 -12.958 486 HB2 ARG 89 HB2 ARG 89 18.699 -11.275 -12.384 487 HB3 ARG 89 HB1 ARG 89 20.042 -11.324 -11.257 488 HG2 ARG 89 HG2 ARG 89 19.042 -9.662 -9.870 489 HG3 ARG 89 HG1 ARG 89 17.774 -9.362 -11.062 490 HD2 ARG 89 HD2 ARG 89 18.221 -11.938 -9.554 491 HD3 ARG 89 HD1 ARG 89 16.952 -10.756 -9.229 492 HE ARG 89 HE ARG 89 16.552 -11.373 -11.827 493 HH11 ARG 89 HH11 ARG 89 16.868 -13.338 -8.942 494 HH12 ARG 89 HH12 ARG 89 15.877 -14.620 -9.565 495 HH21 ARG 89 HH21 ARG 89 15.252 -13.050 -12.633 496 HH22 ARG 89 HH22 ARG 89 14.955 -14.453 -11.657 497 H ARG 90 HN ARG 90 22.357 -10.336 -11.733 498 HA ARG 90 HA ARG 90 23.935 -9.544 -10.273 499 HB2 ARG 90 HB2 ARG 90 23.174 -6.809 -11.300 500 HB3 ARG 90 HB1 ARG 90 24.732 -7.327 -10.680 501 HG2 ARG 90 HG2 ARG 90 25.068 -8.730 -12.631 502 HG3 ARG 90 HG1 ARG 90 23.475 -8.276 -13.246 503 HD2 ARG 90 HD2 ARG 90 25.900 -6.529 -12.892 504 HD3 ARG 90 HD1 ARG 90 25.042 -6.910 -14.385 505 HE ARG 90 HE ARG 90 23.288 -5.635 -12.567 506 HH11 ARG 90 HH11 ARG 90 25.982 -4.922 -14.697 507 HH12 ARG 90 HH12 ARG 90 25.547 -3.256 -14.883 508 HH21 ARG 90 HH21 ARG 90 22.718 -3.474 -12.811 509 HH22 ARG 90 HH22 ARG 90 23.683 -2.423 -13.806 510 H PHE 91 HN PHE 91 21.959 -10.113 -8.740 511 HA PHE 91 HA PHE 91 20.388 -7.990 -7.745 512 HB2 PHE 91 HB2 PHE 91 19.537 -9.593 -6.124 513 HB3 PHE 91 HB1 PHE 91 19.620 -10.317 -7.724 514 HD1 PHE 91 HD1 PHE 91 20.798 -10.435 -4.313 515 HD2 PHE 91 HD2 PHE 91 21.372 -11.976 -8.235 516 HE1 PHE 91 HE1 PHE 91 22.095 -12.303 -3.385 517 HE2 PHE 91 HE2 PHE 91 22.671 -13.847 -7.314 518 HZ PHE 91 HZ PHE 91 23.033 -14.011 -4.888 519 H VAL 92 HN VAL 92 23.594 -8.852 -6.986 520 HA VAL 92 HA VAL 92 23.461 -7.711 -4.319 521 HB VAL 92 HB VAL 92 25.852 -8.584 -5.955 522 HG11 VAL 92 HG11 VAL 92 27.132 -8.379 -3.873 523 HG12 VAL 92 HG12 VAL 92 25.714 -7.699 -3.074 524 HG13 VAL 92 HG13 VAL 92 26.485 -6.823 -4.396 525 HG21 VAL 92 HG21 VAL 92 24.453 -9.872 -3.611 526 HG22 VAL 92 HG22 VAL 92 25.929 -10.463 -4.374 527 HG23 VAL 92 HG23 VAL 92 24.419 -10.432 -5.283 528 H VAL 93 HN VAL 93 24.972 -6.896 -7.422 529 HA VAL 93 HA VAL 93 25.901 -4.348 -6.625 530 HB VAL 93 HB VAL 93 25.311 -5.340 -9.406 531 HG11 VAL 93 HG11 VAL 93 26.911 -3.650 -10.144 532 HG12 VAL 93 HG12 VAL 93 27.092 -3.093 -8.480 533 HG13 VAL 93 HG13 VAL 93 25.545 -2.912 -9.307 534 HG21 VAL 93 HG21 VAL 93 26.854 -6.802 -8.202 535 HG22 VAL 93 HG22 VAL 93 27.877 -5.416 -7.830 536 HG23 VAL 93 HG23 VAL 93 27.671 -5.936 -9.501 537 H ASP 94 HN ASP 94 23.067 -5.348 -8.542 538 HA ASP 94 HA ASP 94 22.145 -2.726 -8.971 539 HB2 ASP 94 HB2 ASP 94 21.082 -5.462 -9.384 540 HB3 ASP 94 HB1 ASP 94 19.919 -4.152 -9.332 541 H ASP 95 HN ASP 95 20.999 -5.257 -6.700 542 HA ASP 95 HA ASP 95 19.009 -3.601 -5.579 543 HB2 ASP 95 HB2 ASP 95 20.265 -6.165 -4.689 544 HB3 ASP 95 HB1 ASP 95 19.181 -5.291 -3.612 545 H ARG 96 HN ARG 96 22.309 -3.285 -5.269 546 HA ARG 96 HA ARG 96 22.284 -2.297 -2.563 547 HB2 ARG 96 HB2 ARG 96 24.383 -3.113 -3.490 548 HB3 ARG 96 HB1 ARG 96 24.308 -1.923 -4.781 549 HG2 ARG 96 HG2 ARG 96 25.894 -1.355 -2.955 550 HG3 ARG 96 HG1 ARG 96 24.665 -0.127 -3.252 551 HD2 ARG 96 HD2 ARG 96 25.082 -0.557 -0.841 552 HD3 ARG 96 HD1 ARG 96 23.411 -0.834 -1.328 553 HE ARG 96 HE ARG 96 25.005 -3.215 -1.398 554 HH11 ARG 96 HH11 ARG 96 23.179 -1.104 0.726 555 HH12 ARG 96 HH12 ARG 96 22.787 -2.364 1.851 556 HH21 ARG 96 HH21 ARG 96 24.490 -4.869 0.080 557 HH22 ARG 96 HH22 ARG 96 23.528 -4.507 1.478 558 H ARG 97 HN ARG 97 22.844 -0.647 -5.673 559 HA ARG 97 HA ARG 97 22.174 1.905 -4.542 560 HB2 ARG 97 HB2 ARG 97 23.839 1.614 -6.365 561 HB3 ARG 97 HB1 ARG 97 22.545 1.118 -7.443 562 HG2 ARG 97 HG2 ARG 97 22.399 3.775 -6.091 563 HG3 ARG 97 HG1 ARG 97 23.444 3.559 -7.494 564 HD2 ARG 97 HD2 ARG 97 21.555 2.861 -8.839 565 HD3 ARG 97 HD1 ARG 97 20.488 2.932 -7.434 566 HE ARG 97 HE ARG 97 21.611 5.439 -7.656 567 HH11 ARG 97 HH11 ARG 97 19.547 3.390 -9.630 568 HH12 ARG 97 HH12 ARG 97 18.838 4.738 -10.470 569 HH21 ARG 97 HH21 ARG 97 20.664 7.180 -8.747 570 HH22 ARG 97 HH22 ARG 97 19.467 6.883 -9.971 571 H GLU 98 HN GLU 98 20.580 -0.421 -6.650 572 HA GLU 98 HA GLU 98 18.489 1.309 -7.441 573 HB2 GLU 98 HB2 GLU 98 18.816 -1.675 -7.564 574 HB3 GLU 98 HB1 GLU 98 17.448 -0.806 -8.273 575 HG2 GLU 98 HG2 GLU 98 20.293 -0.168 -8.946 576 HG3 GLU 98 HG1 GLU 98 19.363 -1.379 -9.826 577 H LEU 99 HN LEU 99 18.744 -1.149 -4.891 578 HA LEU 99 HA LEU 99 16.014 -1.164 -4.209 579 HB2 LEU 99 HB2 LEU 99 17.501 -2.901 -3.457 580 HB3 LEU 99 HB1 LEU 99 18.478 -1.753 -2.577 581 HG LEU 99 HG LEU 99 16.859 -3.331 -1.304 582 HD11 LEU 99 HD11 LEU 99 16.996 -0.387 -0.713 583 HD12 LEU 99 HD12 LEU 99 18.180 -1.609 -0.247 584 HD13 LEU 99 HD13 LEU 99 16.556 -1.648 0.439 585 HD21 LEU 99 HD21 LEU 99 14.959 -1.135 -2.103 586 HD22 LEU 99 HD22 LEU 99 14.654 -2.373 -0.885 587 HD23 LEU 99 HD23 LEU 99 14.851 -2.831 -2.577 588 H GLN 100 HN GLN 100 18.726 0.621 -2.666 589 HA GLN 100 HA GLN 100 17.035 2.120 -0.975 590 HB2 GLN 100 HB2 GLN 100 18.966 3.646 -0.705 591 HB3 GLN 100 HB1 GLN 100 19.384 1.957 -0.467 592 HG2 GLN 100 HG2 GLN 100 20.348 1.877 -2.701 593 HG3 GLN 100 HG1 GLN 100 19.902 3.562 -2.959 594 HE21 GLN 100 HE21 GLN 100 21.068 2.353 0.098 595 HE22 GLN 100 HE22 GLN 100 22.595 3.173 0.068 596 H TYR 101 HN TYR 101 18.047 2.575 -4.287 597 HA TYR 101 HA TYR 101 17.168 5.220 -4.652 598 HB2 TYR 101 HB2 TYR 101 18.532 4.221 -6.352 599 HB3 TYR 101 HB1 TYR 101 17.388 2.898 -6.580 600 HD1 TYR 101 HD1 TYR 101 15.691 3.067 -8.186 601 HD2 TYR 101 HD2 TYR 101 17.762 6.580 -6.976 602 HE1 TYR 101 HE1 TYR 101 14.575 4.333 -9.970 603 HE2 TYR 101 HE2 TYR 101 16.650 7.853 -8.761 604 HH TYR 101 HH TYR 101 14.017 6.547 -10.571 605 H ARG 102 HN ARG 102 15.469 2.123 -5.142 606 HA ARG 102 HA ARG 102 13.115 3.405 -6.063 607 HB2 ARG 102 HB2 ARG 102 12.069 1.266 -6.087 608 HB3 ARG 102 HB1 ARG 102 13.724 1.058 -6.630 609 HG2 ARG 102 HG2 ARG 102 14.302 0.259 -4.348 610 HG3 ARG 102 HG1 ARG 102 12.584 0.329 -3.945 611 HD2 ARG 102 HD2 ARG 102 12.164 -1.181 -5.910 612 HD3 ARG 102 HD1 ARG 102 13.910 -1.375 -6.047 613 HE ARG 102 HE ARG 102 12.554 -2.059 -3.533 614 HH11 ARG 102 HH11 ARG 102 14.455 -3.032 -6.315 615 HH12 ARG 102 HH12 ARG 102 14.780 -4.620 -5.699 616 HH21 ARG 102 HH21 ARG 102 12.967 -4.159 -2.729 617 HH22 ARG 102 HH22 ARG 102 13.938 -5.262 -3.655 618 H VAL 103 HN VAL 103 14.354 2.807 -2.921 619 HA VAL 103 HA VAL 103 11.894 2.839 -1.501 620 HB VAL 103 HB VAL 103 14.600 3.716 -0.471 621 HG11 VAL 103 HG11 VAL 103 12.197 2.627 0.981 622 HG12 VAL 103 HG12 VAL 103 12.694 4.317 0.959 623 HG13 VAL 103 HG13 VAL 103 13.736 3.099 1.705 624 HG21 VAL 103 HG21 VAL 103 14.836 1.424 0.342 625 HG22 VAL 103 HG22 VAL 103 14.770 1.491 -1.417 626 HG23 VAL 103 HG23 VAL 103 13.355 0.974 -0.499 627 H GLU 104 HN GLU 104 14.233 5.446 -2.293 628 HA GLU 104 HA GLU 104 12.706 7.440 -1.010 629 HB2 GLU 104 HB2 GLU 104 14.055 9.047 -2.513 630 HB3 GLU 104 HB1 GLU 104 14.886 8.127 -1.273 631 HG2 GLU 104 HG2 GLU 104 15.663 6.553 -2.919 632 HG3 GLU 104 HG1 GLU 104 14.771 7.398 -4.179 633 H VAL 105 HN VAL 105 12.683 6.318 -4.388 634 HA VAL 105 HA VAL 105 10.788 8.269 -5.190 635 HB VAL 105 HB VAL 105 11.584 7.340 -7.099 636 HG11 VAL 105 HG11 VAL 105 12.093 4.970 -7.455 637 HG12 VAL 105 HG12 VAL 105 11.517 4.617 -5.825 638 HG13 VAL 105 HG13 VAL 105 12.942 5.630 -6.057 639 HG21 VAL 105 HG21 VAL 105 9.228 5.554 -6.566 640 HG22 VAL 105 HG22 VAL 105 9.974 5.811 -8.143 641 HG23 VAL 105 HG23 VAL 105 9.196 7.154 -7.307 642 H GLN 106 HN GLN 106 10.436 5.044 -3.756 643 HA GLN 106 HA GLN 106 7.635 4.953 -3.804 644 HB2 GLN 106 HB2 GLN 106 9.675 3.736 -1.957 645 HB3 GLN 106 HB1 GLN 106 7.956 3.500 -1.695 646 HG2 GLN 106 HG2 GLN 106 9.475 2.750 -4.178 647 HG3 GLN 106 HG1 GLN 106 8.940 1.642 -2.918 648 HE21 GLN 106 HE21 GLN 106 7.942 3.658 -5.577 649 HE22 GLN 106 HE22 GLN 106 6.351 2.999 -5.741 650 H ASN 107 HN ASN 107 9.848 6.347 -1.408 651 HA ASN 107 HA ASN 107 8.057 7.271 0.496 652 HB2 ASN 107 HB2 ASN 107 10.461 7.450 0.788 653 HB3 ASN 107 HB1 ASN 107 10.576 8.595 -0.543 654 HD21 ASN 107 HD21 ASN 107 11.479 10.194 0.704 655 HD22 ASN 107 HD22 ASN 107 10.600 11.054 1.917 656 H ARG 108 HN ARG 108 8.930 8.708 -2.605 657 HA ARG 108 HA ARG 108 7.365 11.085 -2.224 658 HB2 ARG 108 HB2 ARG 108 8.619 9.905 -4.709 659 HB3 ARG 108 HB1 ARG 108 7.965 11.528 -4.567 660 HG2 ARG 108 HG2 ARG 108 9.665 12.185 -3.064 661 HG3 ARG 108 HG1 ARG 108 10.192 10.518 -2.831 662 HD2 ARG 108 HD2 ARG 108 10.741 10.510 -5.311 663 HD3 ARG 108 HD1 ARG 108 10.522 12.259 -5.259 664 HE ARG 108 HE ARG 108 12.275 12.137 -3.407 665 HH11 ARG 108 HH11 ARG 108 12.202 10.063 -6.222 666 HH12 ARG 108 HH12 ARG 108 13.888 9.669 -6.138 667 HH21 ARG 108 HH21 ARG 108 14.485 11.614 -3.270 668 HH22 ARG 108 HH22 ARG 108 15.190 10.523 -4.429 669 H VAL 109 HN VAL 109 7.114 8.243 -4.315 670 HA VAL 109 HA VAL 109 4.730 8.867 -5.597 671 HB VAL 109 HB VAL 109 5.834 6.137 -4.937 672 HG11 VAL 109 HG11 VAL 109 4.486 5.366 -6.853 673 HG12 VAL 109 HG12 VAL 109 3.751 6.966 -6.952 674 HG13 VAL 109 HG13 VAL 109 3.493 5.964 -5.525 675 HG21 VAL 109 HG21 VAL 109 6.163 7.921 -7.343 676 HG22 VAL 109 HG22 VAL 109 6.691 6.240 -7.260 677 HG23 VAL 109 HG23 VAL 109 7.416 7.444 -6.191 678 H TYR 110 HN TYR 110 5.247 7.035 -2.596 679 HA TYR 110 HA TYR 110 2.585 6.320 -2.147 680 HB2 TYR 110 HB2 TYR 110 4.843 6.860 -0.230 681 HB3 TYR 110 HB1 TYR 110 3.251 6.374 0.322 682 HD1 TYR 110 HD1 TYR 110 5.974 4.977 0.684 683 HD2 TYR 110 HD2 TYR 110 2.780 4.403 -2.065 684 HE1 TYR 110 HE1 TYR 110 6.603 2.611 0.459 685 HE2 TYR 110 HE2 TYR 110 3.402 2.036 -2.299 686 HH TYR 110 HH TYR 110 5.566 0.491 -0.175 687 H LYS 111 HN LYS 111 4.326 9.292 -1.304 688 HA LYS 111 HA LYS 111 2.232 10.523 0.126 689 HB2 LYS 111 HB2 LYS 111 4.617 11.310 0.056 690 HB3 LYS 111 HB1 LYS 111 4.317 11.904 -1.571 691 HG2 LYS 111 HG2 LYS 111 2.592 13.410 -0.698 692 HG3 LYS 111 HG1 LYS 111 2.924 12.827 0.935 693 HD2 LYS 111 HD2 LYS 111 4.116 14.857 0.702 694 HD3 LYS 111 HD1 LYS 111 5.312 13.570 0.579 695 HE2 LYS 111 HE2 LYS 111 5.785 15.195 -1.112 696 HE3 LYS 111 HE1 LYS 111 5.156 13.750 -1.899 697 HZ1 LYS 111 HZ1 LYS 111 3.587 16.196 -1.289 698 HZ2 LYS 111 HZ2 LYS 111 2.999 14.820 -2.076 699 HZ3 LYS 111 HZ3 LYS 111 4.186 15.772 -2.810 700 H LYS 112 HN LYS 112 3.112 10.524 -3.273 701 HA LYS 112 HA LYS 112 1.123 12.294 -4.186 702 HB2 LYS 112 HB2 LYS 112 2.615 10.067 -5.573 703 HB3 LYS 112 HB1 LYS 112 1.544 11.186 -6.408 704 HG2 LYS 112 HG2 LYS 112 2.942 13.020 -5.979 705 HG3 LYS 112 HG1 LYS 112 3.854 12.140 -4.751 706 HD2 LYS 112 HD2 LYS 112 5.102 12.387 -6.859 707 HD3 LYS 112 HD1 LYS 112 4.806 10.699 -6.441 708 HE2 LYS 112 HE2 LYS 112 2.987 10.590 -8.027 709 HE3 LYS 112 HE1 LYS 112 3.162 12.307 -8.390 710 HZ1 LYS 112 HZ1 LYS 112 5.361 11.861 -9.268 711 HZ2 LYS 112 HZ2 LYS 112 4.208 10.923 -10.072 712 HZ3 LYS 112 HZ3 LYS 112 5.209 10.218 -8.907 713 H GLU 113 HN GLU 113 1.105 8.809 -3.599 714 HA GLU 113 HA GLU 113 -1.392 8.232 -4.731 715 HB2 GLU 113 HB2 GLU 113 -0.137 6.995 -2.271 716 HB3 GLU 113 HB1 GLU 113 -1.542 6.357 -3.114 717 HG2 GLU 113 HG2 GLU 113 0.049 6.351 -5.179 718 HG3 GLU 113 HG1 GLU 113 1.316 6.388 -3.951 719 H ILE 114 HN ILE 114 -0.573 9.230 -1.411 720 HA ILE 114 HA ILE 114 -3.137 9.185 -0.342 721 HB ILE 114 HB ILE 114 -0.868 11.053 0.344 722 HG12 ILE 114 HG12 ILE 114 -1.688 8.376 1.480 723 HG13 ILE 114 HG11 ILE 114 -0.310 8.658 0.423 724 HG21 ILE 114 HG21 ILE 114 -3.020 11.838 1.239 725 HG22 ILE 114 HG22 ILE 114 -1.937 11.279 2.525 726 HG23 ILE 114 HG23 ILE 114 -3.270 10.256 1.992 727 HD11 ILE 114 HD11 ILE 114 0.733 10.043 2.103 728 HD12 ILE 114 HD12 ILE 114 0.362 8.444 2.747 729 HD13 ILE 114 HD13 ILE 114 -0.654 9.822 3.171 730 H GLN 115 HN GLN 115 -1.547 11.708 -2.210 731 HA GLN 115 HA GLN 115 -3.518 13.701 -1.826 732 HB2 GLN 115 HB2 GLN 115 -1.755 13.395 -4.251 733 HB3 GLN 115 HB1 GLN 115 -2.428 14.877 -3.584 734 HG2 GLN 115 HG2 GLN 115 -1.057 14.485 -1.538 735 HG3 GLN 115 HG1 GLN 115 -0.285 13.149 -2.386 736 HE21 GLN 115 HE21 GLN 115 -1.274 16.155 -3.870 737 HE22 GLN 115 HE22 GLN 115 0.315 16.716 -4.222 738 H ALA 116 HN ALA 116 -2.983 11.295 -4.364 739 HA ALA 116 HA ALA 116 -5.267 11.887 -5.909 740 HB1 ALA 116 HB1 ALA 116 -4.924 9.709 -6.914 741 HB2 ALA 116 HB2 ALA 116 -3.867 9.236 -5.583 742 HB3 ALA 116 HB3 ALA 116 -3.371 10.514 -6.694 743 H LEU 117 HN LEU 117 -4.684 9.670 -3.248 744 HA LEU 117 HA LEU 117 -7.226 8.452 -3.210 745 HB2 LEU 117 HB2 LEU 117 -5.191 8.792 -0.997 746 HB3 LEU 117 HB1 LEU 117 -6.569 7.703 -0.947 747 HG LEU 117 HG LEU 117 -4.364 7.524 -2.993 748 HD11 LEU 117 HD11 LEU 117 -3.512 5.667 -1.722 749 HD12 LEU 117 HD12 LEU 117 -4.748 5.906 -0.487 750 HD13 LEU 117 HD13 LEU 117 -3.503 7.131 -0.742 751 HD21 LEU 117 HD21 LEU 117 -5.273 5.303 -3.401 752 HD22 LEU 117 HD22 LEU 117 -6.477 6.554 -3.706 753 HD23 LEU 117 HD23 LEU 117 -6.550 5.602 -2.223 754 H ASP 118 HN ASP 118 -6.008 11.434 -1.954 755 HA ASP 118 HA ASP 118 -8.008 12.021 -0.069 756 HB2 ASP 118 HB2 ASP 118 -6.022 13.359 -0.122 757 HB3 ASP 118 HB1 ASP 118 -6.284 13.788 -1.811 758 H ALA 119 HN ALA 119 -7.925 12.270 -3.571 759 HA ALA 119 HA ALA 119 -10.432 13.573 -3.877 760 HB1 ALA 119 HB1 ALA 119 -9.074 11.653 -5.764 761 HB2 ALA 119 HB2 ALA 119 -8.787 13.391 -5.695 762 HB3 ALA 119 HB3 ALA 119 -10.370 12.776 -6.171 763 H GLU 120 HN GLU 120 -9.477 10.153 -3.699 764 HA GLU 120 HA GLU 120 -12.073 9.102 -3.948 765 HB2 GLU 120 HB2 GLU 120 -9.482 8.081 -2.865 766 HB3 GLU 120 HB1 GLU 120 -10.954 7.169 -2.617 767 HG2 GLU 120 HG2 GLU 120 -9.818 6.298 -4.501 768 HG3 GLU 120 HG1 GLU 120 -11.291 7.089 -5.050 769 H ILE 121 HN ILE 121 -10.296 10.428 -1.221 770 HA ILE 121 HA ILE 121 -11.928 9.596 0.854 771 HB ILE 121 HB ILE 121 -10.143 11.892 0.414 772 HG12 ILE 121 HG12 ILE 121 -9.328 11.230 2.638 773 HG13 ILE 121 HG11 ILE 121 -10.663 10.093 2.789 774 HG21 ILE 121 HG21 ILE 121 -10.875 13.092 2.430 775 HG22 ILE 121 HG22 ILE 121 -12.302 12.056 2.510 776 HG23 ILE 121 HG23 ILE 121 -12.072 13.138 1.137 777 HD11 ILE 121 HD11 ILE 121 -8.618 8.953 2.197 778 HD12 ILE 121 HD12 ILE 121 -8.442 9.966 0.766 779 HD13 ILE 121 HD13 ILE 121 -9.788 8.835 0.886 780 H ARG 122 HN ARG 122 -12.483 12.050 -1.589 781 HA ARG 122 HA ARG 122 -14.812 13.192 -0.525 782 HB2 ARG 122 HB2 ARG 122 -13.602 14.154 -2.420 783 HB3 ARG 122 HB1 ARG 122 -14.042 12.776 -3.418 784 HG2 ARG 122 HG2 ARG 122 -16.378 13.393 -3.298 785 HG3 ARG 122 HG1 ARG 122 -15.989 14.731 -2.213 786 HD2 ARG 122 HD2 ARG 122 -14.993 14.424 -5.044 787 HD3 ARG 122 HD1 ARG 122 -16.314 15.473 -4.534 788 HE ARG 122 HE ARG 122 -14.253 16.285 -2.982 789 HH11 ARG 122 HH11 ARG 122 -14.594 15.831 -6.440 790 HH12 ARG 122 HH12 ARG 122 -13.465 17.084 -6.841 791 HH21 ARG 122 HH21 ARG 122 -12.764 17.938 -3.522 792 HH22 ARG 122 HH22 ARG 122 -12.428 18.273 -5.191 793 H LYS 123 HN LYS 123 -14.418 10.392 -2.719 794 HA LYS 123 HA LYS 123 -17.192 9.798 -2.875 795 HB2 LYS 123 HB2 LYS 123 -16.596 7.764 -3.913 796 HB3 LYS 123 HB1 LYS 123 -15.339 8.889 -4.376 797 HG2 LYS 123 HG2 LYS 123 -14.132 7.880 -2.267 798 HG3 LYS 123 HG1 LYS 123 -15.190 6.522 -2.605 799 HD2 LYS 123 HD2 LYS 123 -13.256 7.787 -4.537 800 HD3 LYS 123 HD1 LYS 123 -13.023 6.256 -3.692 801 HE2 LYS 123 HE2 LYS 123 -14.708 5.208 -4.907 802 HE3 LYS 123 HE1 LYS 123 -15.388 6.740 -5.457 803 HZ1 LYS 123 HZ1 LYS 123 -14.219 5.755 -7.265 804 HZ2 LYS 123 HZ2 LYS 123 -12.836 5.505 -6.327 805 HZ3 LYS 123 HZ3 LYS 123 -13.304 7.073 -6.736 806 H LEU 124 HN LEU 124 -14.650 8.853 -0.662 807 HA LEU 124 HA LEU 124 -16.065 6.980 0.852 808 HB2 LEU 124 HB2 LEU 124 -13.885 8.911 1.610 809 HB3 LEU 124 HB1 LEU 124 -14.522 7.718 2.725 810 HG LEU 124 HG LEU 124 -13.144 7.111 0.102 811 HD11 LEU 124 HD11 LEU 124 -11.360 6.234 1.547 812 HD12 LEU 124 HD12 LEU 124 -12.238 6.786 2.970 813 HD13 LEU 124 HD13 LEU 124 -11.612 7.956 1.812 814 HD21 LEU 124 HD21 LEU 124 -13.209 4.787 0.926 815 HD22 LEU 124 HD22 LEU 124 -14.808 5.451 0.595 816 HD23 LEU 124 HD23 LEU 124 -14.239 5.313 2.258 817 H GLU 125 HN GLU 125 -15.891 10.506 1.126 818 HA GLU 125 HA GLU 125 -17.198 10.807 3.553 819 HB2 GLU 125 HB2 GLU 125 -17.248 12.658 1.172 820 HB3 GLU 125 HB1 GLU 125 -17.735 13.092 2.805 821 HG2 GLU 125 HG2 GLU 125 -15.492 12.694 3.611 822 HG3 GLU 125 HG1 GLU 125 -14.985 12.173 2.014 823 H ARG 126 HN ARG 126 -18.605 10.270 0.359 824 HA ARG 126 HA ARG 126 -21.269 10.864 1.194 825 HB2 ARG 126 HB2 ARG 126 -22.021 10.030 -0.879 826 HB3 ARG 126 HB1 ARG 126 -20.468 10.778 -1.211 827 HG2 ARG 126 HG2 ARG 126 -19.434 8.525 -1.125 828 HG3 ARG 126 HG1 ARG 126 -21.051 7.842 -0.956 829 HD2 ARG 126 HD2 ARG 126 -20.255 7.779 -3.286 830 HD3 ARG 126 HD1 ARG 126 -21.707 8.763 -3.101 831 HE ARG 126 HE ARG 126 -19.883 10.649 -2.937 832 HH11 ARG 126 HH11 ARG 126 -20.016 7.935 -5.149 833 HH12 ARG 126 HH12 ARG 126 -19.122 8.746 -6.395 834 HH21 ARG 126 HH21 ARG 126 -18.740 11.724 -4.559 835 HH22 ARG 126 HH22 ARG 126 -18.398 10.921 -6.058 836 H LEU 127 HN LEU 127 -19.232 8.049 1.439 837 HA LEU 127 HA LEU 127 -21.411 6.377 2.357 838 HB2 LEU 127 HB2 LEU 127 -19.075 5.693 1.313 839 HB3 LEU 127 HB1 LEU 127 -18.545 5.784 2.980 840 HG LEU 127 HG LEU 127 -20.717 3.977 1.906 841 HD11 LEU 127 HD11 LEU 127 -19.159 2.178 2.487 842 HD12 LEU 127 HD12 LEU 127 -17.943 3.382 2.915 843 HD13 LEU 127 HD13 LEU 127 -18.509 3.250 1.249 844 HD21 LEU 127 HD21 LEU 127 -19.592 4.163 4.695 845 HD22 LEU 127 HD22 LEU 127 -20.788 3.000 4.122 846 HD23 LEU 127 HD23 LEU 127 -21.190 4.717 4.191 847 H LEU 128 HN LEU 128 -18.514 7.754 3.921 848 HA LEU 128 HA LEU 128 -19.026 7.400 6.539 849 HB2 LEU 128 HB2 LEU 128 -17.859 9.707 5.028 850 HB3 LEU 128 HB1 LEU 128 -17.973 9.756 6.775 851 HG LEU 128 HG LEU 128 -16.562 7.791 6.939 852 HD11 LEU 128 HD11 LEU 128 -15.385 6.871 5.027 853 HD12 LEU 128 HD12 LEU 128 -16.354 7.882 3.956 854 HD13 LEU 128 HD13 LEU 128 -17.128 6.620 4.915 855 HD21 LEU 128 HD21 LEU 128 -15.530 9.989 6.945 856 HD22 LEU 128 HD22 LEU 128 -15.402 9.942 5.184 857 HD23 LEU 128 HD23 LEU 128 -14.472 8.811 6.172 858 H GLU 129 HN GLU 129 -19.996 10.393 4.855 859 HA GLU 129 HA GLU 129 -21.525 11.169 7.182 860 HB2 GLU 129 HB2 GLU 129 -21.106 12.632 4.577 861 HB3 GLU 129 HB1 GLU 129 -21.760 13.313 6.062 862 HG2 GLU 129 HG2 GLU 129 -19.622 12.868 7.182 863 HG3 GLU 129 HG1 GLU 129 -18.972 12.253 5.664 864 H SER 130 HN SER 130 -22.236 10.162 3.859 865 HA SER 130 HA SER 130 -25.004 10.987 4.236 866 HB2 SER 130 HB2 SER 130 -23.880 11.536 2.104 867 HB3 SER 130 HB1 SER 130 -23.697 9.815 1.774 868 HG SER 130 HG SER 130 -26.156 11.198 2.116 869 H GLY 131 HN GLY 131 -23.088 8.096 4.189 870 HA2 GLY 131 HA2 GLY 131 -23.747 6.082 5.187 871 HA3 GLY 131 HA1 GLY 131 -25.416 6.623 5.124 872 H LEU 132 HN LEU 132 -23.290 6.686 2.342 873 HA LEU 132 HA LEU 132 -25.012 5.592 0.534 874 HB2 LEU 132 HB2 LEU 132 -22.888 6.714 0.013 875 HB3 LEU 132 HB1 LEU 132 -22.012 5.306 0.579 876 HG LEU 132 HG LEU 132 -23.188 3.992 -1.232 877 HD11 LEU 132 HD11 LEU 132 -24.024 5.308 -3.135 878 HD12 LEU 132 HD12 LEU 132 -23.879 6.772 -2.164 879 HD13 LEU 132 HD13 LEU 132 -25.011 5.507 -1.689 880 HD21 LEU 132 HD21 LEU 132 -21.373 6.239 -2.067 881 HD22 LEU 132 HD22 LEU 132 -21.625 4.723 -2.934 882 HD23 LEU 132 HD23 LEU 132 -20.858 4.718 -1.345 883 H THR 133 HN THR 133 -22.604 3.835 2.458 884 HA THR 133 HA THR 133 -22.383 1.665 3.047 885 HB THR 133 HB THR 133 -25.189 1.258 1.997 886 HG1 THR 133 HG1 THR 133 -25.078 2.916 3.607 887 HG21 THR 133 HG21 THR 133 -25.240 -0.612 3.581 888 HG22 THR 133 HG22 THR 133 -23.570 -0.276 4.037 889 HG23 THR 133 HG23 THR 133 -23.946 -0.819 2.402 Start of MODEL 18 1 H1 MET 1 HT1 MET 1 38.538 0.653 5.728 2 H2 MET 1 HT2 MET 1 38.633 1.829 4.522 3 H3 MET 1 HT3 MET 1 39.988 0.894 4.898 4 HA MET 1 HA MET 1 38.991 0.143 2.852 5 HB2 MET 1 HB2 MET 1 38.655 -1.727 5.203 6 HB3 MET 1 HB1 MET 1 38.573 -2.239 3.525 7 HG2 MET 1 HG2 MET 1 40.953 -0.983 4.865 8 HG3 MET 1 HG1 MET 1 40.753 -2.696 4.506 9 HE1 MET 1 HE1 MET 1 43.026 -2.856 3.159 10 HE2 MET 1 HE2 MET 1 43.324 -1.186 3.634 11 HE3 MET 1 HE3 MET 1 43.515 -1.669 1.951 12 H ASP 2 HN ASP 2 37.216 0.671 1.802 13 HA ASP 2 HA ASP 2 35.050 0.931 1.208 14 HB2 ASP 2 HB2 ASP 2 34.672 -1.494 2.977 15 HB3 ASP 2 HB1 ASP 2 33.473 -0.875 1.846 16 H SER 3 HN SER 3 35.767 2.712 3.033 17 HA SER 3 HA SER 3 33.767 2.699 5.161 18 HB2 SER 3 HB2 SER 3 36.077 4.592 4.677 19 HB3 SER 3 HB1 SER 3 35.030 4.584 6.095 20 HG SER 3 HG SER 3 37.191 3.367 6.054 21 H ALA 4 HN ALA 4 33.726 3.514 2.050 22 HA ALA 4 HA ALA 4 32.589 6.079 1.974 23 HB1 ALA 4 HB1 ALA 4 31.548 5.371 -0.131 24 HB2 ALA 4 HB2 ALA 4 31.967 3.696 0.225 25 HB3 ALA 4 HB3 ALA 4 33.239 4.884 -0.053 26 H ILE 5 HN ILE 5 31.156 2.888 2.523 27 HA ILE 5 HA ILE 5 28.629 4.090 3.314 28 HB ILE 5 HB ILE 5 29.460 1.198 3.560 29 HG12 ILE 5 HG12 ILE 5 27.996 2.524 1.271 30 HG13 ILE 5 HG11 ILE 5 29.683 2.024 1.225 31 HG21 ILE 5 HG21 ILE 5 27.506 1.876 4.881 32 HG22 ILE 5 HG22 ILE 5 27.061 0.768 3.582 33 HG23 ILE 5 HG23 ILE 5 26.739 2.494 3.418 34 HD11 ILE 5 HD11 ILE 5 27.313 0.212 1.588 35 HD12 ILE 5 HD12 ILE 5 29.003 -0.289 1.560 36 HD13 ILE 5 HD13 ILE 5 28.268 0.408 0.118 37 H SER 6 HN SER 6 28.987 5.224 5.184 38 HA SER 6 HA SER 6 30.146 3.754 7.444 39 HB2 SER 6 HB2 SER 6 31.088 6.007 6.928 40 HB3 SER 6 HB1 SER 6 29.495 6.710 7.193 41 HG SER 6 HG SER 6 30.723 6.913 9.063 42 H LYS 7 HN LYS 7 28.890 4.787 9.586 43 HA LYS 7 HA LYS 7 26.354 3.663 9.664 44 HB2 LYS 7 HB2 LYS 7 27.648 4.158 11.656 45 HB3 LYS 7 HB1 LYS 7 27.574 5.878 11.316 46 HG2 LYS 7 HG2 LYS 7 26.057 5.300 13.071 47 HG3 LYS 7 HG1 LYS 7 25.159 5.837 11.655 48 HD2 LYS 7 HD2 LYS 7 24.047 3.927 12.603 49 HD3 LYS 7 HD1 LYS 7 24.767 3.461 11.063 50 HE2 LYS 7 HE2 LYS 7 26.613 2.399 12.212 51 HE3 LYS 7 HE1 LYS 7 25.994 2.948 13.770 52 HZ1 LYS 7 HZ1 LYS 7 24.596 1.083 11.921 53 HZ2 LYS 7 HZ2 LYS 7 24.032 1.588 13.438 54 HZ3 LYS 7 HZ3 LYS 7 25.420 0.633 13.333 55 H GLU 8 HN GLU 8 27.454 6.816 8.690 56 HA GLU 8 HA GLU 8 25.120 8.298 8.652 57 HB2 GLU 8 HB2 GLU 8 27.486 8.318 6.775 58 HB3 GLU 8 HB1 GLU 8 26.231 9.552 6.781 59 HG2 GLU 8 HG2 GLU 8 27.988 8.870 9.125 60 HG3 GLU 8 HG1 GLU 8 28.242 10.224 8.024 61 H ASP 9 HN ASP 9 26.415 6.159 6.120 62 HA ASP 9 HA ASP 9 24.340 6.620 4.250 63 HB2 ASP 9 HB2 ASP 9 26.554 5.628 3.678 64 HB3 ASP 9 HB1 ASP 9 26.091 4.164 4.534 65 H GLU 10 HN GLU 10 24.841 4.211 6.760 66 HA GLU 10 HA GLU 10 22.574 2.633 6.229 67 HB2 GLU 10 HB2 GLU 10 24.326 1.750 7.610 68 HB3 GLU 10 HB1 GLU 10 24.148 3.065 8.769 69 HG2 GLU 10 HG2 GLU 10 22.107 2.240 9.559 70 HG3 GLU 10 HG1 GLU 10 21.918 1.149 8.187 71 H GLU 11 HN GLU 11 23.047 5.120 8.746 72 HA GLU 11 HA GLU 11 20.493 5.298 9.729 73 HB2 GLU 11 HB2 GLU 11 22.459 7.537 9.236 74 HB3 GLU 11 HB1 GLU 11 21.026 7.679 10.242 75 HG2 GLU 11 HG2 GLU 11 23.206 5.684 10.760 76 HG3 GLU 11 HG1 GLU 11 23.192 7.304 11.451 77 H ARG 12 HN ARG 12 21.840 6.865 6.866 78 HA ARG 12 HA ARG 12 19.596 8.427 6.188 79 HB2 ARG 12 HB2 ARG 12 21.844 8.738 5.205 80 HB3 ARG 12 HB1 ARG 12 21.667 7.213 4.348 81 HG2 ARG 12 HG2 ARG 12 19.661 8.191 3.211 82 HG3 ARG 12 HG1 ARG 12 20.091 9.740 3.939 83 HD2 ARG 12 HD2 ARG 12 21.774 8.098 2.057 84 HD3 ARG 12 HD1 ARG 12 20.964 9.618 1.686 85 HE ARG 12 HE ARG 12 22.502 10.467 3.609 86 HH11 ARG 12 HH11 ARG 12 23.314 8.161 1.099 87 HH12 ARG 12 HH12 ARG 12 25.007 8.533 1.128 88 HH21 ARG 12 HH21 ARG 12 24.732 10.973 3.628 89 HH22 ARG 12 HH22 ARG 12 25.815 10.131 2.568 90 H TYR 13 HN TYR 13 20.596 5.185 5.183 91 HA TYR 13 HA TYR 13 18.433 4.703 3.444 92 HB2 TYR 13 HB2 TYR 13 20.328 3.325 3.175 93 HB3 TYR 13 HB1 TYR 13 20.379 2.914 4.886 94 HD1 TYR 13 HD1 TYR 13 19.859 0.731 5.330 95 HD2 TYR 13 HD2 TYR 13 17.845 2.689 2.137 96 HE1 TYR 13 HE1 TYR 13 18.557 -1.312 4.906 97 HE2 TYR 13 HE2 TYR 13 16.533 0.656 1.713 98 HH TYR 13 HH TYR 13 16.386 -1.928 3.880 99 H GLN 14 HN GLN 14 18.981 3.660 6.811 100 HA GLN 14 HA GLN 14 16.602 2.337 7.257 101 HB2 GLN 14 HB2 GLN 14 18.217 4.038 9.153 102 HB3 GLN 14 HB1 GLN 14 16.963 2.915 9.645 103 HG2 GLN 14 HG2 GLN 14 18.348 1.169 8.346 104 HG3 GLN 14 HG1 GLN 14 19.641 2.354 8.454 105 HE21 GLN 14 HE21 GLN 14 17.585 0.199 10.248 106 HE22 GLN 14 HE22 GLN 14 18.506 0.226 11.710 107 H LYS 15 HN LYS 15 17.268 5.763 7.962 108 HA LYS 15 HA LYS 15 14.645 6.400 8.642 109 HB2 LYS 15 HB2 LYS 15 16.815 8.163 7.526 110 HB3 LYS 15 HB1 LYS 15 15.275 8.764 8.122 111 HG2 LYS 15 HG2 LYS 15 17.377 7.328 9.714 112 HG3 LYS 15 HG1 LYS 15 16.952 9.030 9.818 113 HD2 LYS 15 HD2 LYS 15 15.145 6.716 10.500 114 HD3 LYS 15 HD1 LYS 15 16.001 7.729 11.661 115 HE2 LYS 15 HE2 LYS 15 14.051 8.787 9.649 116 HE3 LYS 15 HE1 LYS 15 13.593 8.322 11.283 117 HZ1 LYS 15 HZ1 LYS 15 15.526 10.443 10.525 118 HZ2 LYS 15 HZ2 LYS 15 15.193 9.969 12.111 119 HZ3 LYS 15 HZ3 LYS 15 13.980 10.679 11.168 120 H LEU 16 HN LEU 16 16.184 6.161 5.494 121 HA LEU 16 HA LEU 16 14.168 7.437 4.003 122 HB2 LEU 16 HB2 LEU 16 16.402 6.826 3.092 123 HB3 LEU 16 HB1 LEU 16 15.913 5.141 3.102 124 HG LEU 16 HG LEU 16 14.276 5.513 1.385 125 HD11 LEU 16 HD11 LEU 16 14.042 7.832 0.407 126 HD12 LEU 16 HD12 LEU 16 14.851 8.431 1.851 127 HD13 LEU 16 HD13 LEU 16 13.309 7.583 1.989 128 HD21 LEU 16 HD21 LEU 16 16.788 7.029 0.692 129 HD22 LEU 16 HD22 LEU 16 15.663 6.287 -0.449 130 HD23 LEU 16 HD23 LEU 16 16.603 5.276 0.650 131 H VAL 17 HN VAL 17 14.645 3.982 4.756 132 HA VAL 17 HA VAL 17 12.286 3.083 3.529 133 HB VAL 17 HB VAL 17 12.605 1.021 4.524 134 HG11 VAL 17 HG11 VAL 17 15.039 0.635 4.712 135 HG12 VAL 17 HG12 VAL 17 15.273 2.386 4.679 136 HG13 VAL 17 HG13 VAL 17 14.575 1.561 3.283 137 HG21 VAL 17 HG21 VAL 17 12.276 1.649 6.846 138 HG22 VAL 17 HG22 VAL 17 13.889 2.358 6.907 139 HG23 VAL 17 HG23 VAL 17 13.698 0.618 6.690 140 H THR 18 HN THR 18 12.951 4.368 6.698 141 HA THR 18 HA THR 18 10.561 3.905 7.994 142 HB THR 18 HB THR 18 12.702 5.986 8.148 143 HG1 THR 18 HG1 THR 18 13.191 4.007 9.065 144 HG21 THR 18 HG21 THR 18 10.804 7.247 8.723 145 HG22 THR 18 HG22 THR 18 11.616 6.815 10.229 146 HG23 THR 18 HG23 THR 18 10.157 5.953 9.730 147 H GLU 19 HN GLU 19 11.537 6.506 5.808 148 HA GLU 19 HA GLU 19 9.314 8.154 6.122 149 HB2 GLU 19 HB2 GLU 19 11.153 7.767 3.760 150 HB3 GLU 19 HB1 GLU 19 9.961 9.060 3.880 151 HG2 GLU 19 HG2 GLU 19 11.055 9.860 5.927 152 HG3 GLU 19 HG1 GLU 19 12.264 8.587 5.771 153 H ASN 20 HN ASN 20 9.876 5.505 3.808 154 HA ASN 20 HA ASN 20 7.271 5.912 2.672 155 HB2 ASN 20 HB2 ASN 20 7.954 3.550 1.589 156 HB3 ASN 20 HB1 ASN 20 8.475 5.105 0.957 157 HD21 ASN 20 HD21 ASN 20 9.454 2.151 2.394 158 HD22 ASN 20 HD22 ASN 20 11.144 2.477 2.401 159 H GLU 21 HN GLU 21 8.560 3.809 5.179 160 HA GLU 21 HA GLU 21 6.429 1.989 5.300 161 HB2 GLU 21 HB2 GLU 21 8.108 3.128 7.532 162 HB3 GLU 21 HB1 GLU 21 7.083 1.704 7.664 163 HG2 GLU 21 HG2 GLU 21 9.174 1.849 5.563 164 HG3 GLU 21 HG1 GLU 21 9.617 1.453 7.215 165 H GLN 22 HN GLN 22 6.791 5.212 6.676 166 HA GLN 22 HA GLN 22 4.543 5.165 8.369 167 HB2 GLN 22 HB2 GLN 22 5.632 7.605 6.964 168 HB3 GLN 22 HB1 GLN 22 4.696 7.564 8.451 169 HG2 GLN 22 HG2 GLN 22 6.536 6.401 9.585 170 HG3 GLN 22 HG1 GLN 22 7.481 6.483 8.101 171 HE21 GLN 22 HE21 GLN 22 8.328 8.431 7.446 172 HE22 GLN 22 HE22 GLN 22 8.434 9.801 8.493 173 H LEU 23 HN LEU 23 4.886 6.644 5.149 174 HA LEU 23 HA LEU 23 2.125 7.400 5.262 175 HB2 LEU 23 HB2 LEU 23 2.512 8.837 3.505 176 HB3 LEU 23 HB1 LEU 23 4.019 8.828 4.380 177 HG LEU 23 HG LEU 23 3.447 7.480 1.767 178 HD11 LEU 23 HD11 LEU 23 3.775 9.884 1.645 179 HD12 LEU 23 HD12 LEU 23 5.134 9.021 0.922 180 HD13 LEU 23 HD13 LEU 23 5.293 9.727 2.530 181 HD21 LEU 23 HD21 LEU 23 5.939 7.405 3.436 182 HD22 LEU 23 HD22 LEU 23 5.822 6.874 1.758 183 HD23 LEU 23 HD23 LEU 23 4.903 6.039 3.012 184 H GLN 24 HN GLN 24 3.821 4.735 3.879 185 HA GLN 24 HA GLN 24 1.863 4.063 1.955 186 HB2 GLN 24 HB2 GLN 24 2.760 1.855 1.930 187 HB3 GLN 24 HB1 GLN 24 4.111 2.958 2.123 188 HG2 GLN 24 HG2 GLN 24 4.157 2.472 4.518 189 HG3 GLN 24 HG1 GLN 24 2.809 1.360 4.316 190 HE21 GLN 24 HE21 GLN 24 3.867 0.414 1.730 191 HE22 GLN 24 HE22 GLN 24 5.171 -0.641 2.127 192 H ARG 25 HN ARG 25 2.131 3.587 5.402 193 HA ARG 25 HA ARG 25 -0.148 1.980 5.797 194 HB2 ARG 25 HB2 ARG 25 0.969 2.032 7.766 195 HB3 ARG 25 HB1 ARG 25 1.731 3.568 7.391 196 HG2 ARG 25 HG2 ARG 25 -0.566 4.579 7.937 197 HG3 ARG 25 HG1 ARG 25 -0.879 3.040 8.743 198 HD2 ARG 25 HD2 ARG 25 1.400 4.943 9.306 199 HD3 ARG 25 HD1 ARG 25 -0.015 4.674 10.327 200 HE ARG 25 HE ARG 25 1.132 2.197 10.015 201 HH11 ARG 25 HH11 ARG 25 2.192 5.285 11.284 202 HH12 ARG 25 HH12 ARG 25 3.274 4.578 12.436 203 HH21 ARG 25 HH21 ARG 25 2.548 1.272 11.526 204 HH22 ARG 25 HH22 ARG 25 3.478 2.292 12.575 205 H LEU 26 HN LEU 26 0.396 5.463 5.787 206 HA LEU 26 HA LEU 26 -2.190 6.303 6.419 207 HB2 LEU 26 HB2 LEU 26 -0.110 7.655 4.694 208 HB3 LEU 26 HB1 LEU 26 -1.500 8.454 5.417 209 HG LEU 26 HG LEU 26 0.644 7.066 7.032 210 HD11 LEU 26 HD11 LEU 26 1.772 9.051 7.352 211 HD12 LEU 26 HD12 LEU 26 0.421 10.032 6.776 212 HD13 LEU 26 HD13 LEU 26 1.383 9.101 5.630 213 HD21 LEU 26 HD21 LEU 26 -0.299 8.382 8.872 214 HD22 LEU 26 HD22 LEU 26 -1.482 7.282 8.167 215 HD23 LEU 26 HD23 LEU 26 -1.538 9.002 7.783 216 H ILE 27 HN ILE 27 -0.687 5.526 3.330 217 HA ILE 27 HA ILE 27 -2.836 6.082 1.628 218 HB ILE 27 HB ILE 27 -0.738 3.919 1.445 219 HG12 ILE 27 HG12 ILE 27 -0.924 6.578 0.027 220 HG13 ILE 27 HG11 ILE 27 0.049 6.286 1.473 221 HG21 ILE 27 HG21 ILE 27 -1.285 3.801 -0.945 222 HG22 ILE 27 HG22 ILE 27 -2.638 4.899 -0.680 223 HG23 ILE 27 HG23 ILE 27 -2.638 3.305 0.071 224 HD11 ILE 27 HD11 ILE 27 1.316 4.592 0.245 225 HD12 ILE 27 HD12 ILE 27 1.421 6.187 -0.498 226 HD13 ILE 27 HD13 ILE 27 0.376 4.952 -1.201 227 H THR 28 HN THR 28 -1.911 2.990 3.141 228 HA THR 28 HA THR 28 -3.996 1.473 2.118 229 HB THR 28 HB THR 28 -1.844 0.784 3.501 230 HG1 THR 28 HG1 THR 28 -3.366 -0.603 2.365 231 HG21 THR 28 HG21 THR 28 -2.529 1.657 5.660 232 HG22 THR 28 HG22 THR 28 -2.483 -0.106 5.729 233 HG23 THR 28 HG23 THR 28 -4.031 0.732 5.589 234 H GLN 29 HN GLN 29 -3.958 3.547 4.957 235 HA GLN 29 HA GLN 29 -6.392 2.665 6.103 236 HB2 GLN 29 HB2 GLN 29 -5.124 5.404 6.236 237 HB3 GLN 29 HB1 GLN 29 -6.363 4.788 7.321 238 HG2 GLN 29 HG2 GLN 29 -3.617 3.617 7.008 239 HG3 GLN 29 HG1 GLN 29 -4.103 4.749 8.262 240 HE21 GLN 29 HE21 GLN 29 -6.731 3.603 8.621 241 HE22 GLN 29 HE22 GLN 29 -6.511 2.092 9.433 242 H LYS 30 HN LYS 30 -5.638 5.476 4.103 243 HA LYS 30 HA LYS 30 -8.285 6.321 3.696 244 HB2 LYS 30 HB2 LYS 30 -6.107 6.639 1.637 245 HB3 LYS 30 HB1 LYS 30 -7.467 7.706 1.951 246 HG2 LYS 30 HG2 LYS 30 -5.022 7.300 3.648 247 HG3 LYS 30 HG1 LYS 30 -5.509 8.755 2.782 248 HD2 LYS 30 HD2 LYS 30 -7.381 9.073 4.262 249 HD3 LYS 30 HD1 LYS 30 -7.076 7.523 5.044 250 HE2 LYS 30 HE2 LYS 30 -6.250 9.346 6.417 251 HE3 LYS 30 HE1 LYS 30 -4.917 8.350 5.837 252 HZ1 LYS 30 HZ1 LYS 30 -4.310 10.625 5.625 253 HZ2 LYS 30 HZ2 LYS 30 -5.739 11.006 4.811 254 HZ3 LYS 30 HZ3 LYS 30 -4.580 10.030 4.064 255 H GLU 31 HN GLU 31 -6.223 4.168 1.776 256 HA GLU 31 HA GLU 31 -7.918 3.782 -0.385 257 HB2 GLU 31 HB2 GLU 31 -5.706 2.172 0.808 258 HB3 GLU 31 HB1 GLU 31 -6.670 1.485 -0.493 259 HG2 GLU 31 HG2 GLU 31 -5.281 4.145 -0.674 260 HG3 GLU 31 HG1 GLU 31 -4.570 2.625 -1.216 261 H GLU 32 HN GLU 32 -7.776 1.881 2.646 262 HA GLU 32 HA GLU 32 -9.700 0.000 1.741 263 HB2 GLU 32 HB2 GLU 32 -9.919 -0.625 4.156 264 HB3 GLU 32 HB1 GLU 32 -8.283 -0.684 3.522 265 HG2 GLU 32 HG2 GLU 32 -7.659 1.277 4.663 266 HG3 GLU 32 HG1 GLU 32 -9.336 1.675 5.045 267 H LYS 33 HN LYS 33 -9.970 3.087 3.385 268 HA LYS 33 HA LYS 33 -12.772 2.830 3.899 269 HB2 LYS 33 HB2 LYS 33 -10.772 5.022 4.086 270 HB3 LYS 33 HB1 LYS 33 -12.460 5.489 3.939 271 HG2 LYS 33 HG2 LYS 33 -11.840 5.409 6.260 272 HG3 LYS 33 HG1 LYS 33 -12.988 4.117 5.915 273 HD2 LYS 33 HD2 LYS 33 -11.104 2.530 5.757 274 HD3 LYS 33 HD1 LYS 33 -9.995 3.836 6.183 275 HE2 LYS 33 HE2 LYS 33 -11.246 4.129 8.306 276 HE3 LYS 33 HE1 LYS 33 -12.225 2.727 7.882 277 HZ1 LYS 33 HZ1 LYS 33 -10.490 2.038 9.340 278 HZ2 LYS 33 HZ2 LYS 33 -9.304 2.771 8.391 279 HZ3 LYS 33 HZ3 LYS 33 -10.136 1.417 7.802 280 H ILE 34 HN ILE 34 -10.847 4.464 1.398 281 HA ILE 34 HA ILE 34 -13.020 5.444 -0.109 282 HB ILE 34 HB ILE 34 -10.235 4.703 -1.036 283 HG12 ILE 34 HG12 ILE 34 -11.308 7.471 -0.619 284 HG13 ILE 34 HG11 ILE 34 -10.684 6.547 0.744 285 HG21 ILE 34 HG21 ILE 34 -11.614 4.732 -2.961 286 HG22 ILE 34 HG22 ILE 34 -10.769 6.284 -2.923 287 HG23 ILE 34 HG23 ILE 34 -12.459 6.181 -2.419 288 HD11 ILE 34 HD11 ILE 34 -8.521 6.353 -0.340 289 HD12 ILE 34 HD12 ILE 34 -8.996 8.047 -0.196 290 HD13 ILE 34 HD13 ILE 34 -9.135 7.222 -1.747 291 H ARG 35 HN ARG 35 -11.409 2.331 -0.044 292 HA ARG 35 HA ARG 35 -12.332 1.073 -2.239 293 HB2 ARG 35 HB2 ARG 35 -10.823 0.291 -0.354 294 HB3 ARG 35 HB1 ARG 35 -12.298 -0.115 0.517 295 HG2 ARG 35 HG2 ARG 35 -12.915 -1.689 -1.086 296 HG3 ARG 35 HG1 ARG 35 -11.677 -1.123 -2.200 297 HD2 ARG 35 HD2 ARG 35 -11.089 -2.358 0.481 298 HD3 ARG 35 HD1 ARG 35 -11.100 -3.263 -1.033 299 HE ARG 35 HE ARG 35 -9.352 -1.520 -1.735 300 HH11 ARG 35 HH11 ARG 35 -9.692 -2.787 1.518 301 HH12 ARG 35 HH12 ARG 35 -8.017 -2.551 1.910 302 HH21 ARG 35 HH21 ARG 35 -7.160 -1.198 -1.202 303 HH22 ARG 35 HH22 ARG 35 -6.585 -1.650 0.375 304 H VAL 36 HN VAL 36 -14.009 1.558 0.848 305 HA VAL 36 HA VAL 36 -16.364 0.153 0.194 306 HB VAL 36 HB VAL 36 -16.210 2.544 2.027 307 HG11 VAL 36 HG11 VAL 36 -17.982 0.105 2.029 308 HG12 VAL 36 HG12 VAL 36 -18.459 1.739 1.573 309 HG13 VAL 36 HG13 VAL 36 -18.000 1.387 3.239 310 HG21 VAL 36 HG21 VAL 36 -15.574 -0.328 2.689 311 HG22 VAL 36 HG22 VAL 36 -15.578 1.031 3.814 312 HG23 VAL 36 HG23 VAL 36 -14.384 0.964 2.514 313 H LEU 37 HN LEU 37 -15.496 3.571 -0.099 314 HA LEU 37 HA LEU 37 -17.895 4.485 -1.258 315 HB2 LEU 37 HB2 LEU 37 -15.089 5.467 -1.119 316 HB3 LEU 37 HB1 LEU 37 -16.142 6.203 -2.314 317 HG LEU 37 HG LEU 37 -16.005 7.455 -0.159 318 HD11 LEU 37 HD11 LEU 37 -18.423 7.811 0.068 319 HD12 LEU 37 HD12 LEU 37 -18.717 6.361 -0.896 320 HD13 LEU 37 HD13 LEU 37 -17.908 7.758 -1.620 321 HD21 LEU 37 HD21 LEU 37 -17.179 6.585 1.795 322 HD22 LEU 37 HD22 LEU 37 -15.818 5.552 1.355 323 HD23 LEU 37 HD23 LEU 37 -17.462 5.063 0.950 324 H ARG 38 HN ARG 38 -15.050 2.973 -2.574 325 HA ARG 38 HA ARG 38 -15.580 3.501 -5.292 326 HB2 ARG 38 HB2 ARG 38 -13.383 3.011 -4.984 327 HB3 ARG 38 HB1 ARG 38 -13.705 1.874 -3.687 328 HG2 ARG 38 HG2 ARG 38 -14.339 0.197 -5.268 329 HG3 ARG 38 HG1 ARG 38 -14.114 1.322 -6.613 330 HD2 ARG 38 HD2 ARG 38 -11.751 1.556 -6.001 331 HD3 ARG 38 HD1 ARG 38 -11.981 0.417 -4.681 332 HE ARG 38 HE ARG 38 -12.782 -0.946 -6.911 333 HH11 ARG 38 HH11 ARG 38 -9.879 0.761 -5.976 334 HH12 ARG 38 HH12 ARG 38 -8.814 -0.305 -6.839 335 HH21 ARG 38 HH21 ARG 38 -11.372 -2.358 -8.063 336 HH22 ARG 38 HH22 ARG 38 -9.662 -2.062 -8.037 337 H GLN 39 HN GLN 39 -16.424 0.867 -3.086 338 HA GLN 39 HA GLN 39 -17.596 -0.879 -4.920 339 HB2 GLN 39 HB2 GLN 39 -18.617 -0.302 -2.135 340 HB3 GLN 39 HB1 GLN 39 -18.851 -1.776 -3.062 341 HG2 GLN 39 HG2 GLN 39 -16.198 -0.756 -2.085 342 HG3 GLN 39 HG1 GLN 39 -17.164 -1.984 -1.287 343 HE21 GLN 39 HE21 GLN 39 -18.003 -3.179 -3.840 344 HE22 GLN 39 HE22 GLN 39 -16.628 -4.048 -4.422 345 H ARG 40 HN ARG 40 -18.927 1.967 -3.275 346 HA ARG 40 HA ARG 40 -21.521 1.882 -4.331 347 HB2 ARG 40 HB2 ARG 40 -19.741 4.025 -3.285 348 HB3 ARG 40 HB1 ARG 40 -21.120 4.527 -4.238 349 HG2 ARG 40 HG2 ARG 40 -21.822 4.641 -2.012 350 HG3 ARG 40 HG1 ARG 40 -22.545 3.167 -2.650 351 HD2 ARG 40 HD2 ARG 40 -19.906 3.028 -1.270 352 HD3 ARG 40 HD1 ARG 40 -21.373 3.186 -0.310 353 HE ARG 40 HE ARG 40 -21.147 1.024 -2.287 354 HH11 ARG 40 HH11 ARG 40 -21.537 2.089 1.032 355 HH12 ARG 40 HH12 ARG 40 -21.810 0.483 1.640 356 HH21 ARG 40 HH21 ARG 40 -21.511 -1.081 -1.493 357 HH22 ARG 40 HH22 ARG 40 -21.793 -1.321 0.205 358 H LEU 41 HN LEU 41 -18.519 3.237 -5.595 359 HA LEU 41 HA LEU 41 -19.703 4.382 -7.912 360 HB2 LEU 41 HB2 LEU 41 -16.822 3.574 -7.783 361 HB3 LEU 41 HB1 LEU 41 -17.548 4.941 -8.604 362 HG LEU 41 HG LEU 41 -17.165 4.668 -5.622 363 HD11 LEU 41 HD11 LEU 41 -15.783 6.391 -7.667 364 HD12 LEU 41 HD12 LEU 41 -15.086 5.019 -6.807 365 HD13 LEU 41 HD13 LEU 41 -15.543 6.472 -5.921 366 HD21 LEU 41 HD21 LEU 41 -18.199 7.019 -7.201 367 HD22 LEU 41 HD22 LEU 41 -17.904 6.962 -5.459 368 HD23 LEU 41 HD23 LEU 41 -19.175 5.966 -6.175 369 H VAL 42 HN VAL 42 -18.583 1.204 -7.099 370 HA VAL 42 HA VAL 42 -18.082 0.166 -9.657 371 HB VAL 42 HB VAL 42 -19.165 -1.217 -7.192 372 HG11 VAL 42 HG11 VAL 42 -18.458 -3.317 -8.248 373 HG12 VAL 42 HG12 VAL 42 -18.080 -2.435 -9.728 374 HG13 VAL 42 HG13 VAL 42 -19.745 -2.520 -9.153 375 HG21 VAL 42 HG21 VAL 42 -16.386 -1.051 -8.349 376 HG22 VAL 42 HG22 VAL 42 -16.856 -2.037 -6.964 377 HG23 VAL 42 HG23 VAL 42 -16.957 -0.278 -6.868 378 H GLU 43 HN GLU 43 -21.090 0.227 -7.770 379 HA GLU 43 HA GLU 43 -22.660 -1.018 -9.775 380 HB2 GLU 43 HB2 GLU 43 -23.462 0.718 -7.437 381 HB3 GLU 43 HB1 GLU 43 -24.594 -0.176 -8.443 382 HG2 GLU 43 HG2 GLU 43 -23.498 -2.270 -7.787 383 HG3 GLU 43 HG1 GLU 43 -22.412 -1.356 -6.741 384 H ARG 44 HN ARG 44 -21.709 2.261 -9.167 385 HA ARG 44 HA ARG 44 -23.556 3.442 -11.024 386 HB2 ARG 44 HB2 ARG 44 -21.019 4.543 -9.790 387 HB3 ARG 44 HB1 ARG 44 -22.200 5.481 -10.697 388 HG2 ARG 44 HG2 ARG 44 -23.887 5.006 -9.010 389 HG3 ARG 44 HG1 ARG 44 -22.724 4.036 -8.109 390 HD2 ARG 44 HD2 ARG 44 -22.946 6.273 -7.153 391 HD3 ARG 44 HD1 ARG 44 -21.321 5.996 -7.775 392 HE ARG 44 HE ARG 44 -22.757 7.211 -9.814 393 HH11 ARG 44 HH11 ARG 44 -21.715 8.000 -6.564 394 HH12 ARG 44 HH12 ARG 44 -21.631 9.704 -6.868 395 HH21 ARG 44 HH21 ARG 44 -22.638 9.460 -10.216 396 HH22 ARG 44 HH22 ARG 44 -22.165 10.533 -8.940 397 H GLY 45 HN GLY 45 -20.425 2.011 -11.155 398 HA2 GLY 45 HA2 GLY 45 -19.263 1.351 -13.074 399 HA3 GLY 45 HA1 GLY 45 -20.271 2.425 -14.039 400 H ASP 46 HN ASP 46 -19.388 4.127 -11.417 401 HA ASP 46 HA ASP 46 -17.468 5.681 -12.897 402 HB2 ASP 46 HB2 ASP 46 -18.885 6.026 -10.267 403 HB3 ASP 46 HB1 ASP 46 -17.579 7.094 -10.750 404 H ALA 47 HN ALA 47 -17.224 2.986 -11.053 405 HA ALA 47 HA ALA 47 -14.904 3.541 -9.509 406 HB1 ALA 47 HB1 ALA 47 -15.876 0.900 -10.594 407 HB2 ALA 47 HB2 ALA 47 -16.350 1.615 -9.054 408 HB3 ALA 47 HB3 ALA 47 -14.678 1.121 -9.320 409 H LYS 48 HN LYS 48 -15.493 2.828 -12.831 410 HA LYS 48 HA LYS 48 -12.633 2.577 -13.384 411 HB2 LYS 48 HB2 LYS 48 -14.190 1.054 -14.552 412 HB3 LYS 48 HB1 LYS 48 -15.013 2.439 -15.252 413 HG2 LYS 48 HG2 LYS 48 -13.526 1.469 -16.876 414 HG3 LYS 48 HG1 LYS 48 -12.933 3.063 -16.408 415 HD2 LYS 48 HD2 LYS 48 -11.427 1.879 -14.759 416 HD3 LYS 48 HD1 LYS 48 -11.886 0.372 -15.554 417 HE2 LYS 48 HE2 LYS 48 -10.580 2.747 -16.874 418 HE3 LYS 48 HE1 LYS 48 -9.770 1.250 -16.416 419 HZ1 LYS 48 HZ1 LYS 48 -11.140 0.048 -17.975 420 HZ2 LYS 48 HZ2 LYS 48 -10.352 1.312 -18.772 421 HZ3 LYS 48 HZ3 LYS 48 -11.989 1.453 -18.379 422 H GLY 49 HN GLY 49 -15.429 4.588 -14.321 423 HA2 GLY 49 HA2 GLY 49 -15.543 6.777 -15.012 424 HA3 GLY 49 HA1 GLY 49 -14.004 7.017 -14.195 425 H THR 50 HN THR 50 -14.945 5.028 -16.976 426 HA THR 50 HA THR 50 -13.211 6.620 -18.703 427 HB THR 50 HB THR 50 -12.916 3.617 -18.463 428 HG1 THR 50 HG1 THR 50 -11.712 5.681 -17.131 429 HG21 THR 50 HG21 THR 50 -11.386 5.644 -20.095 430 HG22 THR 50 HG22 THR 50 -12.516 4.447 -20.724 431 HG23 THR 50 HG23 THR 50 -11.006 3.927 -19.975 432 H GLU 51 HN GLU 51 -14.610 7.206 -20.216 433 HA GLU 51 HA GLU 51 -15.933 5.133 -21.752 434 HB2 GLU 51 HB2 GLU 51 -18.073 6.445 -21.753 435 HB3 GLU 51 HB1 GLU 51 -17.667 5.700 -20.216 436 HG2 GLU 51 HG2 GLU 51 -16.778 7.868 -19.452 437 HG3 GLU 51 HG1 GLU 51 -17.364 8.589 -20.950 438 H LEU 52 HN LEU 52 -15.490 5.470 -23.809 439 HA LEU 52 HA LEU 52 -15.375 8.173 -24.855 440 HB2 LEU 52 HB2 LEU 52 -13.213 7.821 -25.961 441 HB3 LEU 52 HB1 LEU 52 -13.074 7.829 -24.218 442 HG LEU 52 HG LEU 52 -13.185 5.253 -25.776 443 HD11 LEU 52 HD11 LEU 52 -11.343 6.579 -26.673 444 HD12 LEU 52 HD12 LEU 52 -10.743 5.225 -25.718 445 HD13 LEU 52 HD13 LEU 52 -10.736 6.852 -25.040 446 HD21 LEU 52 HD21 LEU 52 -13.566 5.168 -23.342 447 HD22 LEU 52 HD22 LEU 52 -12.004 5.945 -23.089 448 HD23 LEU 52 HD23 LEU 52 -12.084 4.344 -23.823 449 H ASN 53 HN ASN 53 -16.992 7.925 -26.204 450 HA ASN 53 HA ASN 53 -18.158 7.358 -28.057 451 HB2 ASN 53 HB2 ASN 53 -15.571 5.997 -28.837 452 HB3 ASN 53 HB1 ASN 53 -16.966 6.137 -29.898 453 HD21 ASN 53 HD21 ASN 53 -15.895 7.332 -31.413 454 HD22 ASN 53 HD22 ASN 53 -15.419 8.975 -31.154 455 H GLY 84 HN GLY 84 15.050 -2.651 -21.320 456 HA2 GLY 84 HA2 GLY 84 14.875 -3.471 -19.138 457 HA3 GLY 84 HA1 GLY 84 13.311 -4.162 -19.546 458 HA PRO 85 HA PRO 85 16.610 -7.333 -20.947 459 HB2 PRO 85 HB2 PRO 85 19.165 -6.968 -20.250 460 HB3 PRO 85 HB1 PRO 85 18.478 -6.156 -21.663 461 HG2 PRO 85 HG2 PRO 85 18.989 -5.082 -18.920 462 HG3 PRO 85 HG1 PRO 85 19.264 -4.311 -20.493 463 HD2 PRO 85 HD2 PRO 85 17.069 -3.845 -18.891 464 HD3 PRO 85 HD1 PRO 85 17.100 -3.593 -20.646 465 H LEU 86 HN LEU 86 18.316 -8.831 -19.672 466 HA LEU 86 HA LEU 86 17.212 -9.952 -17.469 467 HB2 LEU 86 HB2 LEU 86 19.863 -10.325 -16.915 468 HB3 LEU 86 HB1 LEU 86 18.910 -11.297 -18.014 469 HG LEU 86 HG LEU 86 19.695 -9.827 -19.888 470 HD11 LEU 86 HD11 LEU 86 21.547 -8.737 -17.778 471 HD12 LEU 86 HD12 LEU 86 20.290 -7.841 -18.629 472 HD13 LEU 86 HD13 LEU 86 21.688 -8.455 -19.512 473 HD21 LEU 86 HD21 LEU 86 21.922 -10.829 -20.000 474 HD22 LEU 86 HD22 LEU 86 20.712 -11.988 -19.450 475 HD23 LEU 86 HD23 LEU 86 21.816 -11.249 -18.291 476 H GLY 87 HN GLY 87 16.499 -8.957 -15.705 477 HA2 GLY 87 HA2 GLY 87 18.169 -6.831 -14.531 478 HA3 GLY 87 HA1 GLY 87 16.418 -6.902 -14.422 479 H SER 88 HN SER 88 17.852 -9.934 -14.023 480 HA SER 88 HA SER 88 17.429 -9.763 -11.131 481 HB2 SER 88 HB2 SER 88 17.846 -12.206 -12.871 482 HB3 SER 88 HB1 SER 88 17.393 -12.206 -11.167 483 HG SER 88 HG SER 88 15.686 -10.639 -12.456 484 H ARG 89 HN ARG 89 19.816 -8.973 -12.957 485 HA ARG 89 HA ARG 89 22.045 -10.458 -12.007 486 HB2 ARG 89 HB2 ARG 89 21.853 -7.644 -13.104 487 HB3 ARG 89 HB1 ARG 89 23.364 -8.487 -12.794 488 HG2 ARG 89 HG2 ARG 89 22.824 -10.145 -14.463 489 HG3 ARG 89 HG1 ARG 89 21.243 -9.405 -14.722 490 HD2 ARG 89 HD2 ARG 89 23.873 -8.004 -15.161 491 HD3 ARG 89 HD1 ARG 89 22.945 -8.791 -16.435 492 HE ARG 89 HE ARG 89 21.105 -7.151 -15.547 493 HH11 ARG 89 HH11 ARG 89 24.514 -6.510 -16.042 494 HH12 ARG 89 HH12 ARG 89 24.286 -4.814 -16.316 495 HH21 ARG 89 HH21 ARG 89 20.804 -4.910 -15.894 496 HH22 ARG 89 HH22 ARG 89 22.177 -3.902 -16.229 497 H ARG 90 HN ARG 90 21.193 -7.092 -11.329 498 HA ARG 90 HA ARG 90 21.422 -5.770 -9.522 499 HB2 ARG 90 HB2 ARG 90 20.564 -8.307 -8.145 500 HB3 ARG 90 HB1 ARG 90 20.592 -6.726 -7.380 501 HG2 ARG 90 HG2 ARG 90 18.912 -7.549 -9.737 502 HG3 ARG 90 HG1 ARG 90 18.354 -7.275 -8.085 503 HD2 ARG 90 HD2 ARG 90 19.183 -4.923 -8.292 504 HD3 ARG 90 HD1 ARG 90 19.488 -5.245 -9.997 505 HE ARG 90 HE ARG 90 16.808 -5.874 -9.245 506 HH11 ARG 90 HH11 ARG 90 18.962 -3.305 -10.250 507 HH12 ARG 90 HH12 ARG 90 17.671 -2.220 -10.688 508 HH21 ARG 90 HH21 ARG 90 15.108 -4.472 -9.862 509 HH22 ARG 90 HH22 ARG 90 15.480 -2.892 -10.470 510 H PHE 91 HN PHE 91 22.187 -8.218 -7.278 511 HA PHE 91 HA PHE 91 24.010 -8.729 -6.051 512 HB2 PHE 91 HB2 PHE 91 25.011 -9.100 -8.372 513 HB3 PHE 91 HB1 PHE 91 25.732 -7.507 -8.207 514 HD1 PHE 91 HD1 PHE 91 25.328 -10.300 -5.779 515 HD2 PHE 91 HD2 PHE 91 27.997 -7.790 -7.941 516 HE1 PHE 91 HE1 PHE 91 27.228 -11.305 -4.589 517 HE2 PHE 91 HE2 PHE 91 29.901 -8.791 -6.753 518 HZ PHE 91 HZ PHE 91 29.519 -10.547 -5.075 519 H VAL 92 HN VAL 92 26.131 -7.535 -5.121 520 HA VAL 92 HA VAL 92 25.139 -5.526 -3.525 521 HB VAL 92 HB VAL 92 27.114 -6.834 -2.940 522 HG11 VAL 92 HG11 VAL 92 29.315 -6.298 -3.856 523 HG12 VAL 92 HG12 VAL 92 28.567 -5.181 -4.997 524 HG13 VAL 92 HG13 VAL 92 28.223 -6.908 -5.098 525 HG21 VAL 92 HG21 VAL 92 26.734 -4.774 -1.737 526 HG22 VAL 92 HG22 VAL 92 27.609 -3.861 -2.966 527 HG23 VAL 92 HG23 VAL 92 28.466 -5.026 -1.956 528 H VAL 93 HN VAL 93 26.816 -5.169 -6.611 529 HA VAL 93 HA VAL 93 27.352 -2.408 -6.365 530 HB VAL 93 HB VAL 93 28.600 -3.711 -7.955 531 HG11 VAL 93 HG11 VAL 93 26.001 -4.140 -9.420 532 HG12 VAL 93 HG12 VAL 93 26.934 -5.365 -8.561 533 HG13 VAL 93 HG13 VAL 93 27.596 -4.604 -10.007 534 HG21 VAL 93 HG21 VAL 93 28.341 -1.355 -8.466 535 HG22 VAL 93 HG22 VAL 93 26.859 -1.692 -9.360 536 HG23 VAL 93 HG23 VAL 93 28.403 -2.302 -9.953 537 H ASP 94 HN ASP 94 24.680 -4.141 -7.980 538 HA ASP 94 HA ASP 94 23.429 -1.695 -8.812 539 HB2 ASP 94 HB2 ASP 94 23.186 -4.287 -9.632 540 HB3 ASP 94 HB1 ASP 94 21.747 -4.103 -8.634 541 H ASP 95 HN ASP 95 22.832 -4.123 -6.282 542 HA ASP 95 HA ASP 95 20.549 -2.850 -5.198 543 HB2 ASP 95 HB2 ASP 95 22.477 -4.863 -4.070 544 HB3 ASP 95 HB1 ASP 95 21.158 -4.211 -3.106 545 H ARG 96 HN ARG 96 23.743 -1.873 -5.155 546 HA ARG 96 HA ARG 96 23.728 -0.526 -2.631 547 HB2 ARG 96 HB2 ARG 96 25.835 -1.017 -3.802 548 HB3 ARG 96 HB1 ARG 96 25.341 0.012 -5.135 549 HG2 ARG 96 HG2 ARG 96 26.857 1.293 -3.904 550 HG3 ARG 96 HG1 ARG 96 25.272 1.910 -3.446 551 HD2 ARG 96 HD2 ARG 96 26.733 -0.172 -1.843 552 HD3 ARG 96 HD1 ARG 96 26.954 1.552 -1.580 553 HE ARG 96 HE ARG 96 24.449 0.059 -1.142 554 HH11 ARG 96 HH11 ARG 96 26.454 2.888 -0.614 555 HH12 ARG 96 HH12 ARG 96 25.469 3.504 0.683 556 HH21 ARG 96 HH21 ARG 96 23.158 0.872 0.571 557 HH22 ARG 96 HH22 ARG 96 23.624 2.348 1.373 558 H ARG 97 HN ARG 97 23.611 0.724 -5.948 559 HA ARG 97 HA ARG 97 22.437 3.201 -5.139 560 HB2 ARG 97 HB2 ARG 97 23.891 3.054 -7.096 561 HB3 ARG 97 HB1 ARG 97 22.771 1.949 -7.872 562 HG2 ARG 97 HG2 ARG 97 21.726 4.602 -7.075 563 HG3 ARG 97 HG1 ARG 97 22.853 4.541 -8.429 564 HD2 ARG 97 HD2 ARG 97 21.408 2.883 -9.533 565 HD3 ARG 97 HD1 ARG 97 20.264 2.993 -8.193 566 HE ARG 97 HE ARG 97 20.578 5.571 -9.067 567 HH11 ARG 97 HH11 ARG 97 19.542 2.565 -10.532 568 HH12 ARG 97 HH12 ARG 97 18.575 3.339 -11.743 569 HH21 ARG 97 HH21 ARG 97 19.307 6.593 -10.666 570 HH22 ARG 97 HH22 ARG 97 18.434 5.630 -11.815 571 H GLU 98 HN GLU 98 21.227 0.364 -6.882 572 HA GLU 98 HA GLU 98 18.701 1.377 -7.504 573 HB2 GLU 98 HB2 GLU 98 19.883 -1.359 -7.344 574 HB3 GLU 98 HB1 GLU 98 18.155 -1.160 -7.647 575 HG2 GLU 98 HG2 GLU 98 20.275 0.180 -9.297 576 HG3 GLU 98 HG1 GLU 98 19.609 -1.410 -9.679 577 H LEU 99 HN LEU 99 19.698 -0.627 -4.729 578 HA LEU 99 HA LEU 99 17.076 -1.122 -3.838 579 HB2 LEU 99 HB2 LEU 99 19.098 -2.399 -3.143 580 HB3 LEU 99 HB1 LEU 99 19.577 -1.033 -2.161 581 HG LEU 99 HG LEU 99 18.427 -3.051 -1.031 582 HD11 LEU 99 HD11 LEU 99 17.485 -0.236 -0.521 583 HD12 LEU 99 HD12 LEU 99 18.943 -0.992 0.126 584 HD13 LEU 99 HD13 LEU 99 17.354 -1.585 0.609 585 HD21 LEU 99 HD21 LEU 99 16.544 -3.175 -2.615 586 HD22 LEU 99 HD22 LEU 99 15.987 -1.600 -2.044 587 HD23 LEU 99 HD23 LEU 99 16.018 -2.979 -0.944 588 H GLN 100 HN GLN 100 19.475 1.275 -2.604 589 HA GLN 100 HA GLN 100 17.563 2.465 -0.879 590 HB2 GLN 100 HB2 GLN 100 19.153 4.378 -0.766 591 HB3 GLN 100 HB1 GLN 100 19.888 2.823 -0.416 592 HG2 GLN 100 HG2 GLN 100 20.815 2.764 -2.677 593 HG3 GLN 100 HG1 GLN 100 20.079 4.331 -3.012 594 HE21 GLN 100 HE21 GLN 100 22.895 3.464 -2.980 595 HE22 GLN 100 HE22 GLN 100 23.697 4.544 -1.894 596 H TYR 101 HN TYR 101 18.369 2.933 -4.240 597 HA TYR 101 HA TYR 101 17.076 5.393 -4.676 598 HB2 TYR 101 HB2 TYR 101 18.650 4.290 -6.273 599 HB3 TYR 101 HB1 TYR 101 17.390 3.119 -6.652 600 HD1 TYR 101 HD1 TYR 101 18.299 6.695 -6.839 601 HD2 TYR 101 HD2 TYR 101 15.661 3.655 -8.210 602 HE1 TYR 101 HE1 TYR 101 17.443 8.224 -8.560 603 HE2 TYR 101 HE2 TYR 101 14.795 5.178 -9.936 604 HH TYR 101 HH TYR 101 14.631 7.527 -10.406 605 H ARG 102 HN ARG 102 15.877 2.060 -4.719 606 HA ARG 102 HA ARG 102 13.311 2.794 -5.768 607 HB2 ARG 102 HB2 ARG 102 12.680 0.528 -5.514 608 HB3 ARG 102 HB1 ARG 102 14.373 0.502 -5.977 609 HG2 ARG 102 HG2 ARG 102 14.947 0.203 -3.569 610 HG3 ARG 102 HG1 ARG 102 13.221 0.033 -3.242 611 HD2 ARG 102 HD2 ARG 102 14.877 -1.709 -5.060 612 HD3 ARG 102 HD1 ARG 102 14.276 -2.145 -3.462 613 HE ARG 102 HE ARG 102 12.006 -1.549 -4.771 614 HH11 ARG 102 HH11 ARG 102 14.732 -3.584 -5.621 615 HH12 ARG 102 HH12 ARG 102 13.779 -4.677 -6.577 616 HH21 ARG 102 HH21 ARG 102 10.755 -2.980 -6.019 617 HH22 ARG 102 HH22 ARG 102 11.514 -4.326 -6.812 618 H VAL 103 HN VAL 103 14.725 2.804 -2.634 619 HA VAL 103 HA VAL 103 12.242 2.667 -1.190 620 HB VAL 103 HB VAL 103 14.814 3.836 -0.140 621 HG11 VAL 103 HG11 VAL 103 13.995 2.889 1.984 622 HG12 VAL 103 HG12 VAL 103 12.508 2.397 1.165 623 HG13 VAL 103 HG13 VAL 103 12.913 4.108 1.308 624 HG21 VAL 103 HG21 VAL 103 14.075 0.914 -0.241 625 HG22 VAL 103 HG22 VAL 103 15.470 1.609 0.580 626 HG23 VAL 103 HG23 VAL 103 15.356 1.684 -1.175 627 H GLU 104 HN GLU 104 14.513 5.303 -2.018 628 HA GLU 104 HA GLU 104 12.961 7.381 -0.986 629 HB2 GLU 104 HB2 GLU 104 14.213 8.757 -2.843 630 HB3 GLU 104 HB1 GLU 104 15.072 8.124 -1.446 631 HG2 GLU 104 HG2 GLU 104 15.943 6.320 -2.699 632 HG3 GLU 104 HG1 GLU 104 14.912 6.689 -4.071 633 H VAL 105 HN VAL 105 12.855 5.932 -4.249 634 HA VAL 105 HA VAL 105 10.922 7.747 -5.218 635 HB VAL 105 HB VAL 105 11.886 6.532 -6.942 636 HG11 VAL 105 HG11 VAL 105 12.013 4.099 -7.064 637 HG12 VAL 105 HG12 VAL 105 11.258 3.988 -5.473 638 HG13 VAL 105 HG13 VAL 105 12.850 4.729 -5.645 639 HG21 VAL 105 HG21 VAL 105 10.141 5.190 -7.983 640 HG22 VAL 105 HG22 VAL 105 9.522 6.706 -7.324 641 HG23 VAL 105 HG23 VAL 105 9.255 5.190 -6.462 642 H GLN 106 HN GLN 106 10.611 4.639 -3.518 643 HA GLN 106 HA GLN 106 7.818 4.506 -3.572 644 HB2 GLN 106 HB2 GLN 106 9.829 3.490 -1.567 645 HB3 GLN 106 HB1 GLN 106 8.111 3.185 -1.398 646 HG2 GLN 106 HG2 GLN 106 9.867 2.329 -3.677 647 HG3 GLN 106 HG1 GLN 106 9.191 1.294 -2.422 648 HE21 GLN 106 HE21 GLN 106 8.518 3.123 -5.306 649 HE22 GLN 106 HE22 GLN 106 6.966 2.431 -5.625 650 H ASN 107 HN ASN 107 9.985 6.076 -1.233 651 HA ASN 107 HA ASN 107 8.132 7.152 0.531 652 HB2 ASN 107 HB2 ASN 107 10.526 7.334 0.896 653 HB3 ASN 107 HB1 ASN 107 10.696 8.375 -0.513 654 HD21 ASN 107 HD21 ASN 107 8.100 8.569 1.856 655 HD22 ASN 107 HD22 ASN 107 8.555 10.110 2.490 656 H ARG 108 HN ARG 108 9.283 8.498 -2.546 657 HA ARG 108 HA ARG 108 7.732 10.872 -2.434 658 HB2 ARG 108 HB2 ARG 108 9.023 9.447 -4.764 659 HB3 ARG 108 HB1 ARG 108 8.329 11.057 -4.843 660 HG2 ARG 108 HG2 ARG 108 9.947 11.882 -3.267 661 HG3 ARG 108 HG1 ARG 108 10.593 10.257 -3.034 662 HD2 ARG 108 HD2 ARG 108 11.271 10.198 -5.385 663 HD3 ARG 108 HD1 ARG 108 10.630 11.826 -5.609 664 HE ARG 108 HE ARG 108 12.390 12.079 -3.549 665 HH11 ARG 108 HH11 ARG 108 12.626 10.841 -6.813 666 HH12 ARG 108 HH12 ARG 108 14.294 11.274 -6.989 667 HH21 ARG 108 HH21 ARG 108 14.574 12.659 -3.776 668 HH22 ARG 108 HH22 ARG 108 15.399 12.332 -5.267 669 H VAL 109 HN VAL 109 7.357 7.882 -4.297 670 HA VAL 109 HA VAL 109 5.059 8.548 -5.702 671 HB VAL 109 HB VAL 109 5.975 5.823 -4.788 672 HG11 VAL 109 HG11 VAL 109 3.624 5.770 -5.429 673 HG12 VAL 109 HG12 VAL 109 4.622 4.936 -6.620 674 HG13 VAL 109 HG13 VAL 109 4.016 6.555 -6.957 675 HG21 VAL 109 HG21 VAL 109 7.666 6.873 -6.098 676 HG22 VAL 109 HG22 VAL 109 6.480 7.410 -7.293 677 HG23 VAL 109 HG23 VAL 109 6.847 5.692 -7.125 678 H TYR 110 HN TYR 110 5.380 6.953 -2.562 679 HA TYR 110 HA TYR 110 2.643 6.447 -2.167 680 HB2 TYR 110 HB2 TYR 110 4.877 6.867 -0.182 681 HB3 TYR 110 HB1 TYR 110 3.256 6.375 0.275 682 HD1 TYR 110 HD1 TYR 110 5.563 4.781 1.041 683 HD2 TYR 110 HD2 TYR 110 3.276 4.667 -2.541 684 HE1 TYR 110 HE1 TYR 110 6.186 2.427 0.725 685 HE2 TYR 110 HE2 TYR 110 3.890 2.313 -2.864 686 HH TYR 110 HH TYR 110 5.840 0.809 -2.141 687 H LYS 111 HN LYS 111 4.629 9.273 -1.477 688 HA LYS 111 HA LYS 111 2.713 10.747 -0.027 689 HB2 LYS 111 HB2 LYS 111 5.066 11.420 -0.091 690 HB3 LYS 111 HB1 LYS 111 4.951 11.723 -1.820 691 HG2 LYS 111 HG2 LYS 111 3.225 13.465 -1.310 692 HG3 LYS 111 HG1 LYS 111 3.604 13.239 0.396 693 HD2 LYS 111 HD2 LYS 111 5.600 14.040 -1.714 694 HD3 LYS 111 HD1 LYS 111 4.781 15.162 -0.628 695 HE2 LYS 111 HE2 LYS 111 5.763 13.918 1.291 696 HE3 LYS 111 HE1 LYS 111 6.675 12.943 0.138 697 HZ1 LYS 111 HZ1 LYS 111 8.050 14.714 0.935 698 HZ2 LYS 111 HZ2 LYS 111 6.890 15.876 0.537 699 HZ3 LYS 111 HZ3 LYS 111 7.684 15.020 -0.687 700 H LYS 112 HN LYS 112 3.483 10.562 -3.453 701 HA LYS 112 HA LYS 112 1.680 12.500 -4.377 702 HB2 LYS 112 HB2 LYS 112 2.710 10.036 -5.791 703 HB3 LYS 112 HB1 LYS 112 1.989 11.439 -6.569 704 HG2 LYS 112 HG2 LYS 112 3.815 12.822 -5.964 705 HG3 LYS 112 HG1 LYS 112 4.464 11.600 -4.872 706 HD2 LYS 112 HD2 LYS 112 5.760 11.663 -6.917 707 HD3 LYS 112 HD1 LYS 112 4.890 10.135 -6.795 708 HE2 LYS 112 HE2 LYS 112 4.776 11.010 -9.057 709 HE3 LYS 112 HE1 LYS 112 3.178 10.988 -8.315 710 HZ1 LYS 112 HZ1 LYS 112 3.398 13.353 -7.858 711 HZ2 LYS 112 HZ2 LYS 112 3.567 13.045 -9.512 712 HZ3 LYS 112 HZ3 LYS 112 4.931 13.371 -8.575 713 H GLU 113 HN GLU 113 1.279 9.075 -3.655 714 HA GLU 113 HA GLU 113 -1.296 8.761 -4.758 715 HB2 GLU 113 HB2 GLU 113 -0.137 7.345 -2.349 716 HB3 GLU 113 HB1 GLU 113 -1.532 6.822 -3.286 717 HG2 GLU 113 HG2 GLU 113 0.052 6.737 -5.280 718 HG3 GLU 113 HG1 GLU 113 1.352 6.866 -4.092 719 H ILE 114 HN ILE 114 -0.240 9.558 -1.457 720 HA ILE 114 HA ILE 114 -2.741 9.748 -0.264 721 HB ILE 114 HB ILE 114 -0.217 11.280 0.347 722 HG12 ILE 114 HG12 ILE 114 -1.377 8.741 1.507 723 HG13 ILE 114 HG11 ILE 114 -0.025 8.827 0.388 724 HG21 ILE 114 HG21 ILE 114 -2.630 10.835 2.101 725 HG22 ILE 114 HG22 ILE 114 -2.200 12.364 1.329 726 HG23 ILE 114 HG23 ILE 114 -1.143 11.663 2.561 727 HD11 ILE 114 HD11 ILE 114 -0.064 10.008 3.147 728 HD12 ILE 114 HD12 ILE 114 1.294 10.005 2.020 729 HD13 ILE 114 HD13 ILE 114 0.695 8.485 2.685 730 H GLN 115 HN GLN 115 -0.959 12.160 -2.119 731 HA GLN 115 HA GLN 115 -2.648 14.351 -1.614 732 HB2 GLN 115 HB2 GLN 115 -1.098 13.773 -4.134 733 HB3 GLN 115 HB1 GLN 115 -1.654 15.346 -3.572 734 HG2 GLN 115 HG2 GLN 115 -0.256 14.917 -1.494 735 HG3 GLN 115 HG1 GLN 115 0.466 13.593 -2.409 736 HE21 GLN 115 HE21 GLN 115 1.589 16.099 -1.367 737 HE22 GLN 115 HE22 GLN 115 2.294 16.886 -2.725 738 H ALA 116 HN ALA 116 -2.591 12.001 -4.261 739 HA ALA 116 HA ALA 116 -4.933 12.763 -5.588 740 HB1 ALA 116 HB1 ALA 116 -3.835 9.971 -5.248 741 HB2 ALA 116 HB2 ALA 116 -3.298 11.134 -6.461 742 HB3 ALA 116 HB3 ALA 116 -4.946 10.512 -6.507 743 H LEU 117 HN LEU 117 -4.420 10.465 -2.970 744 HA LEU 117 HA LEU 117 -7.074 9.580 -2.729 745 HB2 LEU 117 HB2 LEU 117 -4.901 9.657 -0.634 746 HB3 LEU 117 HB1 LEU 117 -6.364 8.696 -0.551 747 HG LEU 117 HG LEU 117 -4.206 8.371 -2.635 748 HD11 LEU 117 HD11 LEU 117 -3.416 7.737 -0.427 749 HD12 LEU 117 HD12 LEU 117 -3.636 6.327 -1.461 750 HD13 LEU 117 HD13 LEU 117 -4.824 6.697 -0.213 751 HD21 LEU 117 HD21 LEU 117 -5.365 6.298 -3.186 752 HD22 LEU 117 HD22 LEU 117 -6.402 7.702 -3.439 753 HD23 LEU 117 HD23 LEU 117 -6.625 6.685 -2.015 754 H ASP 118 HN ASP 118 -5.495 12.443 -1.571 755 HA ASP 118 HA ASP 118 -7.287 13.068 0.527 756 HB2 ASP 118 HB2 ASP 118 -5.094 14.180 0.242 757 HB3 ASP 118 HB1 ASP 118 -5.704 14.981 -1.208 758 H ALA 119 HN ALA 119 -7.403 13.508 -2.941 759 HA ALA 119 HA ALA 119 -9.787 15.049 -3.029 760 HB1 ALA 119 HB1 ALA 119 -8.744 13.052 -5.041 761 HB2 ALA 119 HB2 ALA 119 -8.341 14.768 -4.988 762 HB3 ALA 119 HB3 ALA 119 -9.993 14.261 -5.336 763 H GLU 120 HN GLU 120 -9.134 11.569 -2.951 764 HA GLU 120 HA GLU 120 -11.834 10.763 -3.007 765 HB2 GLU 120 HB2 GLU 120 -9.270 9.469 -2.180 766 HB3 GLU 120 HB1 GLU 120 -10.798 8.698 -1.821 767 HG2 GLU 120 HG2 GLU 120 -9.799 7.826 -3.844 768 HG3 GLU 120 HG1 GLU 120 -11.354 8.591 -4.156 769 H ILE 121 HN ILE 121 -9.710 11.853 -0.434 770 HA ILE 121 HA ILE 121 -11.226 11.107 1.766 771 HB ILE 121 HB ILE 121 -9.251 13.223 1.226 772 HG12 ILE 121 HG12 ILE 121 -8.318 12.415 3.346 773 HG13 ILE 121 HG11 ILE 121 -9.758 11.437 3.614 774 HG21 ILE 121 HG21 ILE 121 -11.163 13.546 3.534 775 HG22 ILE 121 HG22 ILE 121 -11.009 14.620 2.145 776 HG23 ILE 121 HG23 ILE 121 -9.675 14.463 3.286 777 HD11 ILE 121 HD11 ILE 121 -7.886 10.106 2.816 778 HD12 ILE 121 HD12 ILE 121 -7.800 11.091 1.359 779 HD13 ILE 121 HD13 ILE 121 -9.219 10.093 1.666 780 H ARG 122 HN ARG 122 -11.775 13.637 -0.601 781 HA ARG 122 HA ARG 122 -13.861 14.995 0.697 782 HB2 ARG 122 HB2 ARG 122 -12.860 15.938 -1.276 783 HB3 ARG 122 HB1 ARG 122 -13.332 14.548 -2.241 784 HG2 ARG 122 HG2 ARG 122 -15.677 15.143 -1.984 785 HG3 ARG 122 HG1 ARG 122 -15.223 16.521 -0.979 786 HD2 ARG 122 HD2 ARG 122 -15.696 17.179 -3.298 787 HD3 ARG 122 HD1 ARG 122 -14.030 17.519 -2.835 788 HE ARG 122 HE ARG 122 -14.250 14.976 -4.084 789 HH11 ARG 122 HH11 ARG 122 -14.206 18.407 -4.771 790 HH12 ARG 122 HH12 ARG 122 -13.572 18.208 -6.375 791 HH21 ARG 122 HH21 ARG 122 -13.417 14.706 -6.197 792 HH22 ARG 122 HH22 ARG 122 -13.119 16.104 -7.181 793 H LYS 123 HN LYS 123 -13.980 12.216 -1.556 794 HA LYS 123 HA LYS 123 -16.796 11.888 -1.402 795 HB2 LYS 123 HB2 LYS 123 -16.516 9.801 -2.493 796 HB3 LYS 123 HB1 LYS 123 -15.251 10.838 -3.116 797 HG2 LYS 123 HG2 LYS 123 -13.894 9.705 -1.137 798 HG3 LYS 123 HG1 LYS 123 -15.046 8.416 -1.446 799 HD2 LYS 123 HD2 LYS 123 -13.223 9.698 -3.471 800 HD3 LYS 123 HD1 LYS 123 -13.004 8.111 -2.740 801 HE2 LYS 123 HE2 LYS 123 -14.825 7.216 -3.879 802 HE3 LYS 123 HE1 LYS 123 -15.482 8.806 -4.272 803 HZ1 LYS 123 HZ1 LYS 123 -13.532 9.158 -5.717 804 HZ2 LYS 123 HZ2 LYS 123 -14.483 7.862 -6.222 805 HZ3 LYS 123 HZ3 LYS 123 -13.032 7.573 -5.410 806 H LEU 124 HN LEU 124 -14.142 10.691 0.526 807 HA LEU 124 HA LEU 124 -15.602 8.959 2.197 808 HB2 LEU 124 HB2 LEU 124 -13.106 10.565 2.687 809 HB3 LEU 124 HB1 LEU 124 -13.754 9.429 3.855 810 HG LEU 124 HG LEU 124 -12.757 8.762 1.082 811 HD11 LEU 124 HD11 LEU 124 -11.650 8.175 3.831 812 HD12 LEU 124 HD12 LEU 124 -10.965 9.282 2.644 813 HD13 LEU 124 HD13 LEU 124 -11.001 7.553 2.316 814 HD21 LEU 124 HD21 LEU 124 -13.082 6.419 1.810 815 HD22 LEU 124 HD22 LEU 124 -14.592 7.316 1.652 816 HD23 LEU 124 HD23 LEU 124 -13.911 7.013 3.251 817 H GLU 125 HN GLU 125 -14.877 12.422 2.462 818 HA GLU 125 HA GLU 125 -16.112 12.827 4.949 819 HB2 GLU 125 HB2 GLU 125 -15.732 14.753 2.650 820 HB3 GLU 125 HB1 GLU 125 -16.197 15.215 4.284 821 HG2 GLU 125 HG2 GLU 125 -14.099 14.327 5.139 822 HG3 GLU 125 HG1 GLU 125 -13.634 13.838 3.521 823 H ARG 126 HN ARG 126 -17.434 12.365 1.798 824 HA ARG 126 HA ARG 126 -20.054 13.341 2.344 825 HB2 ARG 126 HB2 ARG 126 -19.147 11.223 0.384 826 HB3 ARG 126 HB1 ARG 126 -20.751 11.938 0.421 827 HG2 ARG 126 HG2 ARG 126 -18.177 13.400 -0.131 828 HG3 ARG 126 HG1 ARG 126 -19.378 12.921 -1.329 829 HD2 ARG 126 HD2 ARG 126 -19.787 14.864 0.942 830 HD3 ARG 126 HD1 ARG 126 -19.622 15.271 -0.763 831 HE ARG 126 HE ARG 126 -21.795 13.466 -0.163 832 HH11 ARG 126 HH11 ARG 126 -20.816 16.800 -0.549 833 HH12 ARG 126 HH12 ARG 126 -22.429 17.376 -0.805 834 HH21 ARG 126 HH21 ARG 126 -23.923 14.222 -0.495 835 HH22 ARG 126 HH22 ARG 126 -24.198 15.914 -0.762 836 H LEU 127 HN LEU 127 -18.341 10.406 3.064 837 HA LEU 127 HA LEU 127 -20.683 9.023 4.035 838 HB2 LEU 127 HB2 LEU 127 -18.883 7.673 3.198 839 HB3 LEU 127 HB1 LEU 127 -17.724 8.470 4.240 840 HG LEU 127 HG LEU 127 -18.826 7.458 6.211 841 HD11 LEU 127 HD11 LEU 127 -20.424 5.630 5.867 842 HD12 LEU 127 HD12 LEU 127 -20.479 6.012 4.149 843 HD13 LEU 127 HD13 LEU 127 -21.063 7.182 5.331 844 HD21 LEU 127 HD21 LEU 127 -18.020 5.179 5.824 845 HD22 LEU 127 HD22 LEU 127 -16.891 6.384 5.203 846 HD23 LEU 127 HD23 LEU 127 -17.940 5.503 4.092 847 H LEU 128 HN LEU 128 -17.690 10.083 5.643 848 HA LEU 128 HA LEU 128 -18.306 10.007 8.240 849 HB2 LEU 128 HB2 LEU 128 -16.832 12.079 6.654 850 HB3 LEU 128 HB1 LEU 128 -16.947 12.191 8.396 851 HG LEU 128 HG LEU 128 -15.798 10.047 8.610 852 HD11 LEU 128 HD11 LEU 128 -16.467 8.958 6.561 853 HD12 LEU 128 HD12 LEU 128 -14.711 8.989 6.714 854 HD13 LEU 128 HD13 LEU 128 -15.521 10.117 5.627 855 HD21 LEU 128 HD21 LEU 128 -14.381 12.051 6.874 856 HD22 LEU 128 HD22 LEU 128 -13.592 10.815 7.861 857 HD23 LEU 128 HD23 LEU 128 -14.519 12.103 8.633 858 H GLU 129 HN GLU 129 -18.917 12.931 6.288 859 HA GLU 129 HA GLU 129 -20.462 14.038 8.473 860 HB2 GLU 129 HB2 GLU 129 -19.781 15.235 5.792 861 HB3 GLU 129 HB1 GLU 129 -20.464 16.091 7.167 862 HG2 GLU 129 HG2 GLU 129 -18.428 15.556 8.457 863 HG3 GLU 129 HG1 GLU 129 -17.743 14.823 7.007 864 H SER 130 HN SER 130 -21.091 12.968 5.134 865 HA SER 130 HA SER 130 -23.790 14.066 5.362 866 HB2 SER 130 HB2 SER 130 -22.403 14.668 3.389 867 HB3 SER 130 HB1 SER 130 -22.402 12.973 2.906 868 HG SER 130 HG SER 130 -24.634 13.081 2.652 869 H GLY 131 HN GLY 131 -22.250 11.116 5.757 870 HA2 GLY 131 HA2 GLY 131 -23.115 9.065 6.301 871 HA3 GLY 131 HA1 GLY 131 -24.702 9.811 6.299 872 H LEU 132 HN LEU 132 -22.589 9.770 3.495 873 HA LEU 132 HA LEU 132 -24.515 9.039 1.687 874 HB2 LEU 132 HB2 LEU 132 -22.300 10.010 1.165 875 HB3 LEU 132 HB1 LEU 132 -21.553 8.471 1.522 876 HG LEU 132 HG LEU 132 -21.921 9.133 -0.940 877 HD11 LEU 132 HD11 LEU 132 -22.381 6.788 -1.559 878 HD12 LEU 132 HD12 LEU 132 -22.788 6.460 0.127 879 HD13 LEU 132 HD13 LEU 132 -21.152 6.956 -0.305 880 HD21 LEU 132 HD21 LEU 132 -24.069 8.519 -1.883 881 HD22 LEU 132 HD22 LEU 132 -24.261 9.811 -0.700 882 HD23 LEU 132 HD23 LEU 132 -24.693 8.156 -0.275 883 H THR 133 HN THR 133 -22.221 6.895 3.347 884 HA THR 133 HA THR 133 -22.316 4.695 3.882 885 HB THR 133 HB THR 133 -25.153 4.685 2.837 886 HG1 THR 133 HG1 THR 133 -24.763 6.290 4.507 887 HG21 THR 133 HG21 THR 133 -24.183 2.465 3.194 888 HG22 THR 133 HG22 THR 133 -25.436 2.808 4.387 889 HG23 THR 133 HG23 THR 133 -23.734 2.921 4.837 Start of MODEL 19 1 H1 MET 1 HT1 MET 1 37.528 4.327 1.534 2 H2 MET 1 HT2 MET 1 37.623 4.949 3.103 3 H3 MET 1 HT3 MET 1 36.124 4.514 2.452 4 HA MET 1 HA MET 1 36.775 2.212 2.370 5 HB2 MET 1 HB2 MET 1 39.298 3.245 3.676 6 HB3 MET 1 HB1 MET 1 38.866 1.546 3.550 7 HG2 MET 1 HG2 MET 1 38.928 1.697 1.125 8 HG3 MET 1 HG1 MET 1 39.328 3.409 1.235 9 HE1 MET 1 HE1 MET 1 41.377 2.956 -0.374 10 HE2 MET 1 HE2 MET 1 41.015 1.231 -0.424 11 HE3 MET 1 HE3 MET 1 42.646 1.779 -0.046 12 H ASP 2 HN ASP 2 35.055 1.923 3.651 13 HA ASP 2 HA ASP 2 33.912 1.342 5.506 14 HB2 ASP 2 HB2 ASP 2 36.575 1.613 6.910 15 HB3 ASP 2 HB1 ASP 2 35.122 0.933 7.633 16 H SER 3 HN SER 3 36.206 3.583 7.050 17 HA SER 3 HA SER 3 33.995 4.874 8.377 18 HB2 SER 3 HB2 SER 3 36.953 5.496 8.504 19 HB3 SER 3 HB1 SER 3 35.715 6.105 9.602 20 HG SER 3 HG SER 3 36.865 3.571 9.426 21 H ALA 4 HN ALA 4 35.117 5.247 5.359 22 HA ALA 4 HA ALA 4 35.138 8.129 5.214 23 HB1 ALA 4 HB1 ALA 4 35.228 7.799 2.788 24 HB2 ALA 4 HB2 ALA 4 34.964 6.072 3.015 25 HB3 ALA 4 HB3 ALA 4 36.440 6.823 3.616 26 H ILE 5 HN ILE 5 32.829 5.657 5.309 27 HA ILE 5 HA ILE 5 30.678 7.258 4.188 28 HB ILE 5 HB ILE 5 30.499 4.613 5.642 29 HG12 ILE 5 HG12 ILE 5 30.735 5.086 2.665 30 HG13 ILE 5 HG11 ILE 5 32.046 4.517 3.689 31 HG21 ILE 5 HG21 ILE 5 28.390 4.376 4.425 32 HG22 ILE 5 HG22 ILE 5 28.634 5.962 3.692 33 HG23 ILE 5 HG23 ILE 5 28.392 5.822 5.434 34 HD11 ILE 5 HD11 ILE 5 30.992 2.693 2.472 35 HD12 ILE 5 HD12 ILE 5 29.444 3.081 3.222 36 HD13 ILE 5 HD13 ILE 5 30.786 2.511 4.212 37 H SER 6 HN SER 6 29.761 8.803 5.445 38 HA SER 6 HA SER 6 30.109 8.675 8.327 39 HB2 SER 6 HB2 SER 6 28.765 10.819 6.661 40 HB3 SER 6 HB1 SER 6 29.277 10.956 8.343 41 HG SER 6 HG SER 6 31.464 10.425 7.414 42 H LYS 7 HN LYS 7 27.942 9.695 9.476 43 HA LYS 7 HA LYS 7 25.989 7.647 9.278 44 HB2 LYS 7 HB2 LYS 7 26.521 9.124 11.308 45 HB3 LYS 7 HB1 LYS 7 25.507 10.339 10.539 46 HG2 LYS 7 HG2 LYS 7 23.663 8.691 10.494 47 HG3 LYS 7 HG1 LYS 7 24.682 7.581 11.405 48 HD2 LYS 7 HD2 LYS 7 24.857 9.382 13.156 49 HD3 LYS 7 HD1 LYS 7 23.609 10.253 12.278 50 HE2 LYS 7 HE2 LYS 7 22.715 8.924 14.157 51 HE3 LYS 7 HE1 LYS 7 22.055 8.440 12.597 52 HZ1 LYS 7 HZ1 LYS 7 22.655 6.545 14.004 53 HZ2 LYS 7 HZ2 LYS 7 24.269 7.049 14.006 54 HZ3 LYS 7 HZ3 LYS 7 23.540 6.558 12.560 55 H GLU 8 HN GLU 8 26.544 10.479 7.510 56 HA GLU 8 HA GLU 8 24.075 11.332 6.653 57 HB2 GLU 8 HB2 GLU 8 26.772 11.193 5.389 58 HB3 GLU 8 HB1 GLU 8 25.393 11.612 4.375 59 HG2 GLU 8 HG2 GLU 8 26.278 13.048 6.861 60 HG3 GLU 8 HG1 GLU 8 26.470 13.604 5.199 61 H ASP 9 HN ASP 9 26.084 8.936 4.952 62 HA ASP 9 HA ASP 9 24.156 8.170 3.087 63 HB2 ASP 9 HB2 ASP 9 26.463 7.624 2.734 64 HB3 ASP 9 HB1 ASP 9 26.526 6.682 4.218 65 H GLU 10 HN GLU 10 24.882 6.883 6.282 66 HA GLU 10 HA GLU 10 23.197 4.640 6.191 67 HB2 GLU 10 HB2 GLU 10 24.910 4.832 7.888 68 HB3 GLU 10 HB1 GLU 10 24.172 6.294 8.525 69 HG2 GLU 10 HG2 GLU 10 22.218 5.001 9.225 70 HG3 GLU 10 HG1 GLU 10 22.970 3.536 8.595 71 H GLU 11 HN GLU 11 22.621 7.702 7.912 72 HA GLU 11 HA GLU 11 19.945 7.157 8.486 73 HB2 GLU 11 HB2 GLU 11 21.524 9.716 8.415 74 HB3 GLU 11 HB1 GLU 11 19.852 9.637 8.965 75 HG2 GLU 11 HG2 GLU 11 22.009 7.915 10.127 76 HG3 GLU 11 HG1 GLU 11 21.657 9.527 10.755 77 H ARG 12 HN ARG 12 21.442 8.269 5.615 78 HA ARG 12 HA ARG 12 19.209 9.643 4.520 79 HB2 ARG 12 HB2 ARG 12 21.649 9.731 3.737 80 HB3 ARG 12 HB1 ARG 12 21.318 8.216 2.909 81 HG2 ARG 12 HG2 ARG 12 19.753 9.218 1.475 82 HG3 ARG 12 HG1 ARG 12 19.656 10.674 2.470 83 HD2 ARG 12 HD2 ARG 12 22.066 9.752 0.908 84 HD3 ARG 12 HD1 ARG 12 20.976 11.060 0.447 85 HE ARG 12 HE ARG 12 21.939 11.626 3.002 86 HH11 ARG 12 HH11 ARG 12 23.136 11.345 -0.267 87 HH12 ARG 12 HH12 ARG 12 24.451 12.447 -0.021 88 HH21 ARG 12 HH21 ARG 12 23.682 13.085 3.349 89 HH22 ARG 12 HH22 ARG 12 24.762 13.438 2.031 90 H TYR 13 HN TYR 13 20.399 6.296 4.299 91 HA TYR 13 HA TYR 13 18.104 5.501 2.746 92 HB2 TYR 13 HB2 TYR 13 20.038 4.237 2.269 93 HB3 TYR 13 HB1 TYR 13 20.394 3.977 3.975 94 HD1 TYR 13 HD1 TYR 13 20.153 1.776 4.588 95 HD2 TYR 13 HD2 TYR 13 17.414 3.424 1.786 96 HE1 TYR 13 HE1 TYR 13 18.922 -0.353 4.550 97 HE2 TYR 13 HE2 TYR 13 16.158 1.314 1.744 98 HH TYR 13 HH TYR 13 16.742 -1.185 2.227 99 H GLN 14 HN GLN 14 19.247 4.930 6.064 100 HA GLN 14 HA GLN 14 17.251 3.202 6.912 101 HB2 GLN 14 HB2 GLN 14 18.710 5.322 8.497 102 HB3 GLN 14 HB1 GLN 14 17.767 4.021 9.205 103 HG2 GLN 14 HG2 GLN 14 20.176 3.639 7.448 104 HG3 GLN 14 HG1 GLN 14 20.189 3.603 9.208 105 HE21 GLN 14 HE21 GLN 14 17.636 2.243 9.418 106 HE22 GLN 14 HE22 GLN 14 17.920 0.604 8.950 107 H LYS 15 HN LYS 15 17.313 6.714 7.541 108 HA LYS 15 HA LYS 15 14.714 6.838 8.516 109 HB2 LYS 15 HB2 LYS 15 16.466 8.940 7.271 110 HB3 LYS 15 HB1 LYS 15 14.877 9.302 7.932 111 HG2 LYS 15 HG2 LYS 15 17.120 8.040 9.490 112 HG3 LYS 15 HG1 LYS 15 16.731 9.761 9.495 113 HD2 LYS 15 HD2 LYS 15 14.612 9.370 10.484 114 HD3 LYS 15 HD1 LYS 15 14.733 7.632 10.220 115 HE2 LYS 15 HE2 LYS 15 15.130 8.228 12.556 116 HE3 LYS 15 HE1 LYS 15 16.541 7.486 11.811 117 HZ1 LYS 15 HZ1 LYS 15 16.215 10.423 12.056 118 HZ2 LYS 15 HZ2 LYS 15 17.622 9.565 11.664 119 HZ3 LYS 15 HZ3 LYS 15 16.990 9.485 13.228 120 H LEU 16 HN LEU 16 15.914 6.831 5.236 121 HA LEU 16 HA LEU 16 13.629 7.824 3.924 122 HB2 LEU 16 HB2 LEU 16 15.918 7.432 2.934 123 HB3 LEU 16 HB1 LEU 16 15.517 5.726 2.870 124 HG LEU 16 HG LEU 16 13.723 6.160 1.286 125 HD11 LEU 16 HD11 LEU 16 14.484 9.045 1.704 126 HD12 LEU 16 HD12 LEU 16 12.917 8.289 2.009 127 HD13 LEU 16 HD13 LEU 16 13.506 8.475 0.356 128 HD21 LEU 16 HD21 LEU 16 15.067 6.844 -0.589 129 HD22 LEU 16 HD22 LEU 16 16.029 5.834 0.493 130 HD23 LEU 16 HD23 LEU 16 16.251 7.584 0.489 131 H VAL 17 HN VAL 17 14.584 4.528 4.835 132 HA VAL 17 HA VAL 17 12.399 3.206 3.679 133 HB VAL 17 HB VAL 17 13.034 1.296 4.777 134 HG11 VAL 17 HG11 VAL 17 15.441 1.254 5.053 135 HG12 VAL 17 HG12 VAL 17 15.463 3.018 5.109 136 HG13 VAL 17 HG13 VAL 17 14.967 2.189 3.630 137 HG21 VAL 17 HG21 VAL 17 12.436 1.966 7.036 138 HG22 VAL 17 HG22 VAL 17 13.924 2.906 7.165 139 HG23 VAL 17 HG23 VAL 17 14.001 1.149 7.021 140 H THR 18 HN THR 18 12.808 4.759 6.803 141 HA THR 18 HA THR 18 10.407 3.949 7.969 142 HB THR 18 HB THR 18 12.545 5.759 8.574 143 HG1 THR 18 HG1 THR 18 11.156 3.911 9.739 144 HG21 THR 18 HG21 THR 18 11.317 7.457 9.850 145 HG22 THR 18 HG22 THR 18 9.795 6.845 9.194 146 HG23 THR 18 HG23 THR 18 10.997 7.576 8.113 147 H GLU 19 HN GLU 19 11.198 6.766 5.982 148 HA GLU 19 HA GLU 19 8.728 8.063 6.088 149 HB2 GLU 19 HB2 GLU 19 10.770 7.964 3.849 150 HB3 GLU 19 HB1 GLU 19 9.470 9.151 3.992 151 HG2 GLU 19 HG2 GLU 19 11.539 8.739 6.130 152 HG3 GLU 19 HG1 GLU 19 11.757 9.868 4.808 153 H ASN 20 HN ASN 20 9.970 5.582 3.981 154 HA ASN 20 HA ASN 20 7.795 5.458 2.182 155 HB2 ASN 20 HB2 ASN 20 10.125 4.673 1.775 156 HB3 ASN 20 HB1 ASN 20 9.836 3.342 2.884 157 HD21 ASN 20 HD21 ASN 20 10.461 2.045 1.087 158 HD22 ASN 20 HD22 ASN 20 9.325 1.658 -0.147 159 H GLU 21 HN GLU 21 8.587 3.665 5.142 160 HA GLU 21 HA GLU 21 6.397 1.856 4.909 161 HB2 GLU 21 HB2 GLU 21 7.957 2.560 7.391 162 HB3 GLU 21 HB1 GLU 21 7.046 1.085 7.090 163 HG2 GLU 21 HG2 GLU 21 9.229 1.810 5.228 164 HG3 GLU 21 HG1 GLU 21 9.658 1.184 6.812 165 H GLN 22 HN GLN 22 6.898 4.941 6.570 166 HA GLN 22 HA GLN 22 4.606 4.818 8.223 167 HB2 GLN 22 HB2 GLN 22 5.997 7.274 7.147 168 HB3 GLN 22 HB1 GLN 22 4.823 7.256 8.451 169 HG2 GLN 22 HG2 GLN 22 6.427 5.728 9.689 170 HG3 GLN 22 HG1 GLN 22 7.607 6.150 8.454 171 HE21 GLN 22 HE21 GLN 22 8.401 8.252 8.357 172 HE22 GLN 22 HE22 GLN 22 8.217 9.362 9.668 173 H LEU 23 HN LEU 23 5.123 6.461 5.091 174 HA LEU 23 HA LEU 23 2.522 7.614 5.270 175 HB2 LEU 23 HB2 LEU 23 3.102 8.965 3.546 176 HB3 LEU 23 HB1 LEU 23 4.675 8.545 4.163 177 HG LEU 23 HG LEU 23 3.373 7.424 1.699 178 HD11 LEU 23 HD11 LEU 23 4.145 9.697 1.450 179 HD12 LEU 23 HD12 LEU 23 5.198 8.597 0.561 180 HD13 LEU 23 HD13 LEU 23 5.719 9.258 2.110 181 HD21 LEU 23 HD21 LEU 23 4.750 5.715 2.764 182 HD22 LEU 23 HD22 LEU 23 6.098 6.848 2.845 183 HD23 LEU 23 HD23 LEU 23 5.498 6.301 1.280 184 H GLN 24 HN GLN 24 3.739 4.709 3.824 185 HA GLN 24 HA GLN 24 1.536 4.282 2.077 186 HB2 GLN 24 HB2 GLN 24 2.249 1.965 1.979 187 HB3 GLN 24 HB1 GLN 24 3.651 3.019 1.880 188 HG2 GLN 24 HG2 GLN 24 4.137 2.599 4.232 189 HG3 GLN 24 HG1 GLN 24 2.724 1.550 4.335 190 HE21 GLN 24 HE21 GLN 24 4.827 1.668 1.546 191 HE22 GLN 24 HE22 GLN 24 5.502 0.092 1.751 192 H ARG 25 HN ARG 25 2.102 3.748 5.478 193 HA ARG 25 HA ARG 25 -0.265 2.261 6.000 194 HB2 ARG 25 HB2 ARG 25 1.172 2.001 7.751 195 HB3 ARG 25 HB1 ARG 25 1.888 3.591 7.531 196 HG2 ARG 25 HG2 ARG 25 -0.422 4.405 8.413 197 HG3 ARG 25 HG1 ARG 25 -0.492 2.787 9.117 198 HD2 ARG 25 HD2 ARG 25 1.611 4.911 9.551 199 HD3 ARG 25 HD1 ARG 25 0.479 4.257 10.742 200 HE ARG 25 HE ARG 25 1.780 2.050 10.060 201 HH11 ARG 25 HH11 ARG 25 3.026 5.237 10.823 202 HH12 ARG 25 HH12 ARG 25 4.544 4.634 11.409 203 HH21 ARG 25 HH21 ARG 25 3.779 1.267 10.803 204 HH22 ARG 25 HH22 ARG 25 4.975 2.382 11.389 205 H LEU 26 HN LEU 26 0.667 5.653 6.087 206 HA LEU 26 HA LEU 26 -1.684 6.696 7.195 207 HB2 LEU 26 HB2 LEU 26 0.285 7.964 5.290 208 HB3 LEU 26 HB1 LEU 26 -0.915 8.844 6.226 209 HG LEU 26 HG LEU 26 1.300 7.169 7.424 210 HD11 LEU 26 HD11 LEU 26 2.432 9.179 7.967 211 HD12 LEU 26 HD12 LEU 26 1.117 10.167 7.331 212 HD13 LEU 26 HD13 LEU 26 2.106 9.204 6.236 213 HD21 LEU 26 HD21 LEU 26 0.663 8.269 9.517 214 HD22 LEU 26 HD22 LEU 26 -0.658 7.313 8.850 215 HD23 LEU 26 HD23 LEU 26 -0.670 9.068 8.686 216 H ILE 27 HN ILE 27 -0.741 6.094 3.839 217 HA ILE 27 HA ILE 27 -3.108 6.933 2.595 218 HB ILE 27 HB ILE 27 -1.307 4.619 1.864 219 HG12 ILE 27 HG12 ILE 27 -1.382 7.415 0.730 220 HG13 ILE 27 HG11 ILE 27 -0.248 6.890 1.979 221 HG21 ILE 27 HG21 ILE 27 -3.447 4.352 0.786 222 HG22 ILE 27 HG22 ILE 27 -2.246 4.857 -0.404 223 HG23 ILE 27 HG23 ILE 27 -3.409 6.024 0.226 224 HD11 ILE 27 HD11 ILE 27 -0.477 5.764 -0.798 225 HD12 ILE 27 HD12 ILE 27 0.644 5.217 0.448 226 HD13 ILE 27 HD13 ILE 27 0.782 6.849 -0.209 227 H THR 28 HN THR 28 -2.142 3.767 3.847 228 HA THR 28 HA THR 28 -4.356 2.288 3.163 229 HB THR 28 HB THR 28 -2.019 1.974 4.772 230 HG1 THR 28 HG1 THR 28 -2.057 0.071 3.817 231 HG21 THR 28 HG21 THR 28 -2.942 0.223 6.335 232 HG22 THR 28 HG22 THR 28 -4.539 0.918 6.027 233 HG23 THR 28 HG23 THR 28 -3.269 1.903 6.761 234 H GLN 29 HN GLN 29 -3.871 4.235 6.113 235 HA GLN 29 HA GLN 29 -6.300 3.283 7.290 236 HB2 GLN 29 HB2 GLN 29 -5.826 4.738 9.128 237 HB3 GLN 29 HB1 GLN 29 -4.348 3.909 8.652 238 HG2 GLN 29 HG2 GLN 29 -3.559 5.844 7.514 239 HG3 GLN 29 HG1 GLN 29 -5.105 6.645 7.768 240 HE21 GLN 29 HE21 GLN 29 -5.613 7.441 9.820 241 HE22 GLN 29 HE22 GLN 29 -4.406 7.664 11.037 242 H LYS 30 HN LYS 30 -5.366 6.113 5.466 243 HA LYS 30 HA LYS 30 -7.836 7.488 5.988 244 HB2 LYS 30 HB2 LYS 30 -5.716 8.005 3.899 245 HB3 LYS 30 HB1 LYS 30 -7.061 9.076 4.271 246 HG2 LYS 30 HG2 LYS 30 -4.808 8.310 6.117 247 HG3 LYS 30 HG1 LYS 30 -5.056 9.877 5.349 248 HD2 LYS 30 HD2 LYS 30 -7.123 10.182 6.615 249 HD3 LYS 30 HD1 LYS 30 -6.923 8.590 7.346 250 HE2 LYS 30 HE2 LYS 30 -6.207 10.306 8.893 251 HE3 LYS 30 HE1 LYS 30 -4.825 9.342 8.377 252 HZ1 LYS 30 HZ1 LYS 30 -4.263 11.105 6.799 253 HZ2 LYS 30 HZ2 LYS 30 -4.266 11.669 8.392 254 HZ3 LYS 30 HZ3 LYS 30 -5.557 12.035 7.367 255 H GLU 31 HN GLU 31 -6.502 5.551 3.359 256 HA GLU 31 HA GLU 31 -8.463 5.824 1.442 257 HB2 GLU 31 HB2 GLU 31 -6.513 3.707 2.157 258 HB3 GLU 31 HB1 GLU 31 -7.812 3.254 1.063 259 HG2 GLU 31 HG2 GLU 31 -6.089 5.660 0.577 260 HG3 GLU 31 HG1 GLU 31 -5.634 4.049 0.030 261 H GLU 32 HN GLU 32 -8.415 3.473 4.135 262 HA GLU 32 HA GLU 32 -10.749 2.133 3.304 263 HB2 GLU 32 HB2 GLU 32 -10.811 1.292 5.706 264 HB3 GLU 32 HB1 GLU 32 -9.381 0.914 4.760 265 HG2 GLU 32 HG2 GLU 32 -8.066 2.466 5.914 266 HG3 GLU 32 HG1 GLU 32 -9.479 3.275 6.596 267 H LYS 33 HN LYS 33 -10.296 4.816 5.604 268 HA LYS 33 HA LYS 33 -13.036 4.887 6.366 269 HB2 LYS 33 HB2 LYS 33 -10.755 6.802 6.675 270 HB3 LYS 33 HB1 LYS 33 -12.392 7.348 7.003 271 HG2 LYS 33 HG2 LYS 33 -11.584 6.711 9.084 272 HG3 LYS 33 HG1 LYS 33 -12.552 5.329 8.571 273 HD2 LYS 33 HD2 LYS 33 -10.514 4.202 7.817 274 HD3 LYS 33 HD1 LYS 33 -9.552 5.575 8.361 275 HE2 LYS 33 HE2 LYS 33 -9.381 4.018 10.096 276 HE3 LYS 33 HE1 LYS 33 -10.604 5.157 10.655 277 HZ1 LYS 33 HZ1 LYS 33 -12.318 3.607 9.929 278 HZ2 LYS 33 HZ2 LYS 33 -11.280 2.883 11.053 279 HZ3 LYS 33 HZ3 LYS 33 -11.130 2.516 9.408 280 H ILE 34 HN ILE 34 -11.144 6.760 3.996 281 HA ILE 34 HA ILE 34 -13.190 8.513 3.241 282 HB ILE 34 HB ILE 34 -10.866 7.500 1.603 283 HG12 ILE 34 HG12 ILE 34 -11.212 10.231 2.808 284 HG13 ILE 34 HG11 ILE 34 -10.550 8.905 3.760 285 HG21 ILE 34 HG21 ILE 34 -12.570 8.243 0.098 286 HG22 ILE 34 HG22 ILE 34 -11.323 9.484 0.182 287 HG23 ILE 34 HG23 ILE 34 -12.844 9.698 1.053 288 HD11 ILE 34 HD11 ILE 34 -8.724 8.642 2.200 289 HD12 ILE 34 HD12 ILE 34 -8.805 10.309 2.769 290 HD13 ILE 34 HD13 ILE 34 -9.403 9.897 1.163 291 H ARG 35 HN ARG 35 -12.416 5.262 2.097 292 HA ARG 35 HA ARG 35 -13.986 5.175 -0.156 293 HB2 ARG 35 HB2 ARG 35 -12.227 3.553 0.911 294 HB3 ARG 35 HB1 ARG 35 -13.652 2.822 1.646 295 HG2 ARG 35 HG2 ARG 35 -14.579 2.318 -0.424 296 HG3 ARG 35 HG1 ARG 35 -13.432 3.351 -1.269 297 HD2 ARG 35 HD2 ARG 35 -12.657 0.888 0.277 298 HD3 ARG 35 HD1 ARG 35 -12.948 0.901 -1.462 299 HE ARG 35 HE ARG 35 -11.123 2.677 -1.478 300 HH11 ARG 35 HH11 ARG 35 -11.233 0.037 0.810 301 HH12 ARG 35 HH12 ARG 35 -9.516 -0.013 1.029 302 HH21 ARG 35 HH21 ARG 35 -8.868 2.639 -1.180 303 HH22 ARG 35 HH22 ARG 35 -8.167 1.473 -0.104 304 H VAL 36 HN VAL 36 -14.757 4.729 3.234 305 HA VAL 36 HA VAL 36 -17.476 3.937 2.716 306 HB VAL 36 HB VAL 36 -16.369 4.982 5.314 307 HG11 VAL 36 HG11 VAL 36 -18.734 4.833 5.351 308 HG12 VAL 36 HG12 VAL 36 -18.126 3.420 6.219 309 HG13 VAL 36 HG13 VAL 36 -18.711 3.255 4.560 310 HG21 VAL 36 HG21 VAL 36 -15.795 2.695 5.896 311 HG22 VAL 36 HG22 VAL 36 -14.920 3.194 4.443 312 HG23 VAL 36 HG23 VAL 36 -16.328 2.138 4.310 313 H LEU 37 HN LEU 37 -15.765 6.861 3.659 314 HA LEU 37 HA LEU 37 -17.861 8.601 4.126 315 HB2 LEU 37 HB2 LEU 37 -15.076 8.864 3.200 316 HB3 LEU 37 HB1 LEU 37 -16.113 10.229 2.847 317 HG LEU 37 HG LEU 37 -14.788 10.392 4.978 318 HD11 LEU 37 HD11 LEU 37 -16.626 11.325 6.268 319 HD12 LEU 37 HD12 LEU 37 -17.791 10.478 5.250 320 HD13 LEU 37 HD13 LEU 37 -16.781 11.754 4.564 321 HD21 LEU 37 HD21 LEU 37 -15.041 8.023 5.621 322 HD22 LEU 37 HD22 LEU 37 -16.751 8.316 5.935 323 HD23 LEU 37 HD23 LEU 37 -15.525 9.136 6.904 324 H ARG 38 HN ARG 38 -16.357 7.758 1.046 325 HA ARG 38 HA ARG 38 -17.823 9.560 -0.535 326 HB2 ARG 38 HB2 ARG 38 -16.826 8.561 -2.358 327 HB3 ARG 38 HB1 ARG 38 -15.738 8.074 -1.072 328 HG2 ARG 38 HG2 ARG 38 -16.939 5.902 -0.957 329 HG3 ARG 38 HG1 ARG 38 -17.858 6.400 -2.380 330 HD2 ARG 38 HD2 ARG 38 -14.876 6.025 -2.186 331 HD3 ARG 38 HD1 ARG 38 -16.016 5.011 -3.066 332 HE ARG 38 HE ARG 38 -16.282 7.581 -4.079 333 HH11 ARG 38 HH11 ARG 38 -13.821 5.112 -3.875 334 HH12 ARG 38 HH12 ARG 38 -12.997 5.632 -5.308 335 HH21 ARG 38 HH21 ARG 38 -15.202 8.259 -5.987 336 HH22 ARG 38 HH22 ARG 38 -13.777 7.415 -6.509 337 H GLN 39 HN GLN 39 -18.482 6.238 0.436 338 HA GLN 39 HA GLN 39 -20.914 5.948 -1.003 339 HB2 GLN 39 HB2 GLN 39 -20.170 4.560 1.574 340 HB3 GLN 39 HB1 GLN 39 -21.268 3.983 0.330 341 HG2 GLN 39 HG2 GLN 39 -18.332 4.414 -0.088 342 HG3 GLN 39 HG1 GLN 39 -19.045 2.875 0.372 343 HE21 GLN 39 HE21 GLN 39 -21.412 3.277 -1.283 344 HE22 GLN 39 HE22 GLN 39 -20.902 3.041 -2.917 345 H ARG 40 HN ARG 40 -20.112 7.062 2.228 346 HA ARG 40 HA ARG 40 -22.710 7.325 3.223 347 HB2 ARG 40 HB2 ARG 40 -20.093 8.644 3.856 348 HB3 ARG 40 HB1 ARG 40 -21.566 9.143 4.661 349 HG2 ARG 40 HG2 ARG 40 -21.903 6.826 5.433 350 HG3 ARG 40 HG1 ARG 40 -20.375 6.381 4.671 351 HD2 ARG 40 HD2 ARG 40 -19.153 7.830 6.139 352 HD3 ARG 40 HD1 ARG 40 -20.645 8.490 6.800 353 HE ARG 40 HE ARG 40 -20.068 5.631 7.119 354 HH11 ARG 40 HH11 ARG 40 -20.557 8.801 8.547 355 HH12 ARG 40 HH12 ARG 40 -20.679 8.187 10.163 356 HH21 ARG 40 HH21 ARG 40 -20.216 4.840 9.263 357 HH22 ARG 40 HH22 ARG 40 -20.477 5.953 10.568 358 H LEU 41 HN LEU 41 -20.659 9.595 1.422 359 HA LEU 41 HA LEU 41 -22.520 11.723 1.461 360 HB2 LEU 41 HB2 LEU 41 -20.705 11.302 -0.875 361 HB3 LEU 41 HB1 LEU 41 -21.265 12.798 -0.161 362 HG LEU 41 HG LEU 41 -19.163 10.951 0.965 363 HD11 LEU 41 HD11 LEU 41 -18.358 12.215 -0.899 364 HD12 LEU 41 HD12 LEU 41 -17.716 12.922 0.580 365 HD13 LEU 41 HD13 LEU 41 -19.057 13.699 -0.255 366 HD21 LEU 41 HD21 LEU 41 -20.436 11.955 2.784 367 HD22 LEU 41 HD22 LEU 41 -20.212 13.554 2.070 368 HD23 LEU 41 HD23 LEU 41 -18.818 12.654 2.677 369 H VAL 42 HN VAL 42 -22.283 8.828 -0.478 370 HA VAL 42 HA VAL 42 -23.961 9.538 -2.612 371 HB VAL 42 HB VAL 42 -23.637 6.865 -1.225 372 HG11 VAL 42 HG11 VAL 42 -24.960 7.517 -3.847 373 HG12 VAL 42 HG12 VAL 42 -25.720 6.852 -2.399 374 HG13 VAL 42 HG13 VAL 42 -24.549 5.892 -3.303 375 HG21 VAL 42 HG21 VAL 42 -22.352 8.011 -3.701 376 HG22 VAL 42 HG22 VAL 42 -22.201 6.333 -3.174 377 HG23 VAL 42 HG23 VAL 42 -21.560 7.632 -2.169 378 H GLU 43 HN GLU 43 -24.697 8.244 0.581 379 HA GLU 43 HA GLU 43 -27.508 8.142 0.222 380 HB2 GLU 43 HB2 GLU 43 -25.881 8.257 2.766 381 HB3 GLU 43 HB1 GLU 43 -27.580 7.817 2.661 382 HG2 GLU 43 HG2 GLU 43 -27.014 5.867 1.336 383 HG3 GLU 43 HG1 GLU 43 -25.310 6.316 1.374 384 H ARG 44 HN ARG 44 -25.378 10.731 0.756 385 HA ARG 44 HA ARG 44 -27.465 12.362 2.021 386 HB2 ARG 44 HB2 ARG 44 -24.547 13.060 1.630 387 HB3 ARG 44 HB1 ARG 44 -25.719 13.889 2.651 388 HG2 ARG 44 HG2 ARG 44 -25.928 11.688 3.905 389 HG3 ARG 44 HG1 ARG 44 -24.456 11.208 3.063 390 HD2 ARG 44 HD2 ARG 44 -24.857 13.409 5.059 391 HD3 ARG 44 HD1 ARG 44 -23.736 12.056 5.121 392 HE ARG 44 HE ARG 44 -23.184 13.773 2.915 393 HH11 ARG 44 HH11 ARG 44 -22.754 13.376 6.366 394 HH12 ARG 44 HH12 ARG 44 -21.415 14.478 6.457 395 HH21 ARG 44 HH21 ARG 44 -21.405 15.219 3.030 396 HH22 ARG 44 HH22 ARG 44 -20.646 15.518 4.564 397 H GLY 45 HN GLY 45 -25.549 12.012 -0.831 398 HA2 GLY 45 HA2 GLY 45 -25.958 12.876 -2.946 399 HA3 GLY 45 HA1 GLY 45 -27.152 13.975 -2.252 400 H ASP 46 HN ASP 46 -23.711 13.385 -2.667 401 HA ASP 46 HA ASP 46 -22.739 15.611 -1.280 402 HB2 ASP 46 HB2 ASP 46 -21.363 13.669 -1.929 403 HB3 ASP 46 HB1 ASP 46 -21.460 14.173 -3.610 404 H ALA 47 HN ALA 47 -24.089 15.403 -4.465 405 HA ALA 47 HA ALA 47 -22.939 17.740 -5.560 406 HB1 ALA 47 HB1 ALA 47 -25.603 16.485 -6.215 407 HB2 ALA 47 HB2 ALA 47 -24.054 16.030 -6.923 408 HB3 ALA 47 HB3 ALA 47 -24.717 17.638 -7.213 409 H LYS 48 HN LYS 48 -25.953 17.190 -3.768 410 HA LYS 48 HA LYS 48 -26.514 20.054 -3.809 411 HB2 LYS 48 HB2 LYS 48 -28.110 17.632 -3.053 412 HB3 LYS 48 HB1 LYS 48 -28.610 19.224 -2.505 413 HG2 LYS 48 HG2 LYS 48 -28.215 18.423 -5.382 414 HG3 LYS 48 HG1 LYS 48 -29.768 18.513 -4.548 415 HD2 LYS 48 HD2 LYS 48 -27.865 20.810 -5.009 416 HD3 LYS 48 HD1 LYS 48 -29.363 20.518 -5.886 417 HE2 LYS 48 HE2 LYS 48 -30.624 20.772 -3.806 418 HE3 LYS 48 HE1 LYS 48 -29.121 21.072 -2.936 419 HZ1 LYS 48 HZ1 LYS 48 -28.770 23.035 -4.308 420 HZ2 LYS 48 HZ2 LYS 48 -30.228 23.137 -3.461 421 HZ3 LYS 48 HZ3 LYS 48 -30.234 22.761 -5.110 422 H GLY 49 HN GLY 49 -25.335 17.603 -1.697 423 HA2 GLY 49 HA2 GLY 49 -24.217 18.007 0.329 424 HA3 GLY 49 HA1 GLY 49 -24.972 19.594 0.409 425 H THR 50 HN THR 50 -25.470 19.042 2.636 426 HA THR 50 HA THR 50 -28.120 18.157 2.916 427 HB THR 50 HB THR 50 -27.096 15.924 2.670 428 HG1 THR 50 HG1 THR 50 -28.917 16.122 4.023 429 HG21 THR 50 HG21 THR 50 -24.877 16.361 3.540 430 HG22 THR 50 HG22 THR 50 -25.633 15.065 4.464 431 HG23 THR 50 HG23 THR 50 -25.541 16.688 5.139 432 H GLU 51 HN GLU 51 -28.952 19.021 4.710 433 HA GLU 51 HA GLU 51 -27.294 20.653 6.370 434 HB2 GLU 51 HB2 GLU 51 -30.237 19.987 6.539 435 HB3 GLU 51 HB1 GLU 51 -29.429 21.178 7.549 436 HG2 GLU 51 HG2 GLU 51 -29.691 21.274 4.557 437 HG3 GLU 51 HG1 GLU 51 -30.595 22.241 5.721 438 H LEU 52 HN LEU 52 -26.299 20.107 8.161 439 HA LEU 52 HA LEU 52 -27.360 17.950 9.821 440 HB2 LEU 52 HB2 LEU 52 -24.967 17.090 10.033 441 HB3 LEU 52 HB1 LEU 52 -25.832 16.717 8.555 442 HG LEU 52 HG LEU 52 -24.616 18.897 7.687 443 HD11 LEU 52 HD11 LEU 52 -23.579 19.478 9.808 444 HD12 LEU 52 HD12 LEU 52 -22.361 19.103 8.590 445 HD13 LEU 52 HD13 LEU 52 -22.750 17.921 9.840 446 HD21 LEU 52 HD21 LEU 52 -24.417 16.677 6.733 447 HD22 LEU 52 HD22 LEU 52 -23.248 16.234 7.974 448 HD23 LEU 52 HD23 LEU 52 -22.852 17.485 6.795 449 H ASN 53 HN ASN 53 -27.191 20.880 10.023 450 HA ASN 53 HA ASN 53 -25.182 21.434 12.017 451 HB2 ASN 53 HB2 ASN 53 -27.487 23.049 10.926 452 HB3 ASN 53 HB1 ASN 53 -26.471 23.626 12.241 453 HD21 ASN 53 HD21 ASN 53 -24.289 24.090 11.825 454 HD22 ASN 53 HD22 ASN 53 -23.728 24.393 10.216 455 H GLY 84 HN GLY 84 12.188 -6.266 5.029 456 HA2 GLY 84 HA2 GLY 84 10.413 -6.817 2.864 457 HA3 GLY 84 HA1 GLY 84 11.948 -5.967 2.759 458 HA PRO 85 HA PRO 85 12.349 -10.221 0.884 459 HB2 PRO 85 HB2 PRO 85 12.648 -9.604 -1.693 460 HB3 PRO 85 HB1 PRO 85 11.045 -9.654 -0.951 461 HG2 PRO 85 HG2 PRO 85 12.785 -7.291 -1.540 462 HG3 PRO 85 HG1 PRO 85 11.044 -7.490 -1.815 463 HD2 PRO 85 HD2 PRO 85 12.104 -6.181 0.355 464 HD3 PRO 85 HD1 PRO 85 10.517 -6.975 0.361 465 H LEU 86 HN LEU 86 14.149 -10.782 -0.912 466 HA LEU 86 HA LEU 86 16.607 -10.560 0.275 467 HB2 LEU 86 HB2 LEU 86 17.419 -10.921 -2.256 468 HB3 LEU 86 HB1 LEU 86 16.800 -12.197 -1.240 469 HG LEU 86 HG LEU 86 15.996 -12.121 -3.645 470 HD11 LEU 86 HD11 LEU 86 14.908 -13.552 -2.108 471 HD12 LEU 86 HD12 LEU 86 13.659 -12.722 -3.036 472 HD13 LEU 86 HD13 LEU 86 14.016 -12.218 -1.387 473 HD21 LEU 86 HD21 LEU 86 14.373 -9.800 -2.610 474 HD22 LEU 86 HD22 LEU 86 14.055 -10.670 -4.112 475 HD23 LEU 86 HD23 LEU 86 15.560 -9.775 -3.916 476 H GLY 87 HN GLY 87 18.156 -9.091 0.437 477 HA2 GLY 87 HA2 GLY 87 17.831 -6.601 -1.084 478 HA3 GLY 87 HA1 GLY 87 18.706 -6.769 0.427 479 H SER 88 HN SER 88 19.763 -9.365 -1.011 480 HA SER 88 HA SER 88 21.979 -7.967 -2.345 481 HB2 SER 88 HB2 SER 88 21.966 -10.702 -1.045 482 HB3 SER 88 HB1 SER 88 23.367 -9.895 -1.748 483 HG SER 88 HG SER 88 23.622 -9.106 0.180 484 H ARG 89 HN ARG 89 19.341 -8.945 -3.408 485 HA ARG 89 HA ARG 89 19.484 -11.256 -4.906 486 HB2 ARG 89 HB2 ARG 89 17.430 -9.977 -4.613 487 HB3 ARG 89 HB1 ARG 89 18.086 -8.663 -5.576 488 HG2 ARG 89 HG2 ARG 89 18.177 -10.191 -7.521 489 HG3 ARG 89 HG1 ARG 89 17.395 -11.430 -6.537 490 HD2 ARG 89 HD2 ARG 89 15.478 -9.933 -6.203 491 HD3 ARG 89 HD1 ARG 89 16.260 -8.719 -7.213 492 HE ARG 89 HE ARG 89 16.119 -11.036 -8.726 493 HH11 ARG 89 HH11 ARG 89 13.889 -8.799 -7.214 494 HH12 ARG 89 HH12 ARG 89 12.612 -9.110 -8.345 495 HH21 ARG 89 HH21 ARG 89 14.436 -11.437 -10.226 496 HH22 ARG 89 HH22 ARG 89 12.921 -10.604 -10.056 497 H ARG 90 HN ARG 90 20.025 -7.971 -6.180 498 HA ARG 90 HA ARG 90 21.498 -9.137 -8.427 499 HB2 ARG 90 HB2 ARG 90 20.528 -6.320 -7.924 500 HB3 ARG 90 HB1 ARG 90 21.320 -6.871 -9.394 501 HG2 ARG 90 HG2 ARG 90 19.491 -8.180 -10.026 502 HG3 ARG 90 HG1 ARG 90 18.788 -8.135 -8.408 503 HD2 ARG 90 HD2 ARG 90 19.100 -5.742 -10.212 504 HD3 ARG 90 HD1 ARG 90 17.616 -6.680 -10.040 505 HE ARG 90 HE ARG 90 18.348 -5.930 -7.480 506 HH11 ARG 90 HH11 ARG 90 17.570 -4.288 -10.473 507 HH12 ARG 90 HH12 ARG 90 16.867 -2.905 -9.692 508 HH21 ARG 90 HH21 ARG 90 17.377 -4.158 -6.434 509 HH22 ARG 90 HH22 ARG 90 16.723 -2.849 -7.380 510 H PHE 91 HN PHE 91 22.739 -9.323 -5.985 511 HA PHE 91 HA PHE 91 24.728 -9.027 -4.962 512 HB2 PHE 91 HB2 PHE 91 25.464 -7.504 -7.469 513 HB3 PHE 91 HB1 PHE 91 26.595 -8.029 -6.230 514 HD1 PHE 91 HD1 PHE 91 26.852 -10.507 -5.806 515 HD2 PHE 91 HD2 PHE 91 24.838 -8.937 -9.210 516 HE1 PHE 91 HE1 PHE 91 27.125 -12.664 -6.956 517 HE2 PHE 91 HE2 PHE 91 25.106 -11.090 -10.365 518 HZ PHE 91 HZ PHE 91 26.248 -12.955 -9.239 519 H VAL 92 HN VAL 92 26.466 -6.952 -4.666 520 HA VAL 92 HA VAL 92 24.897 -5.182 -3.053 521 HB VAL 92 HB VAL 92 27.835 -4.954 -3.723 522 HG11 VAL 92 HG11 VAL 92 26.889 -2.923 -2.768 523 HG12 VAL 92 HG12 VAL 92 27.977 -3.706 -1.622 524 HG13 VAL 92 HG13 VAL 92 26.232 -3.851 -1.420 525 HG21 VAL 92 HG21 VAL 92 26.490 -6.416 -1.457 526 HG22 VAL 92 HG22 VAL 92 28.227 -6.150 -1.611 527 HG23 VAL 92 HG23 VAL 92 27.377 -7.145 -2.794 528 H VAL 93 HN VAL 93 26.683 -4.916 -6.080 529 HA VAL 93 HA VAL 93 26.798 -2.191 -6.413 530 HB VAL 93 HB VAL 93 26.256 -4.166 -8.617 531 HG11 VAL 93 HG11 VAL 93 27.588 -1.465 -8.659 532 HG12 VAL 93 HG12 VAL 93 26.001 -1.852 -9.320 533 HG13 VAL 93 HG13 VAL 93 27.449 -2.563 -10.032 534 HG21 VAL 93 HG21 VAL 93 28.876 -3.307 -7.404 535 HG22 VAL 93 HG22 VAL 93 28.698 -4.304 -8.846 536 HG23 VAL 93 HG23 VAL 93 28.142 -4.906 -7.286 537 H ASP 94 HN ASP 94 24.230 -4.271 -7.775 538 HA ASP 94 HA ASP 94 22.694 -2.092 -8.700 539 HB2 ASP 94 HB2 ASP 94 22.367 -5.029 -8.498 540 HB3 ASP 94 HB1 ASP 94 20.907 -4.074 -8.655 541 H ASP 95 HN ASP 95 21.949 -4.448 -6.111 542 HA ASP 95 HA ASP 95 19.599 -3.017 -5.415 543 HB2 ASP 95 HB2 ASP 95 20.940 -5.449 -4.361 544 HB3 ASP 95 HB1 ASP 95 19.759 -4.635 -3.331 545 H ARG 96 HN ARG 96 22.768 -2.299 -4.588 546 HA ARG 96 HA ARG 96 22.104 -1.175 -2.017 547 HB2 ARG 96 HB2 ARG 96 24.492 -1.722 -3.089 548 HB3 ARG 96 HB1 ARG 96 24.355 -0.051 -3.622 549 HG2 ARG 96 HG2 ARG 96 24.171 -1.002 -0.771 550 HG3 ARG 96 HG1 ARG 96 25.578 -0.247 -1.517 551 HD2 ARG 96 HD2 ARG 96 24.530 1.831 -1.672 552 HD3 ARG 96 HD1 ARG 96 22.919 1.138 -1.485 553 HE ARG 96 HE ARG 96 23.877 0.549 0.864 554 HH11 ARG 96 HH11 ARG 96 24.349 3.527 -0.924 555 HH12 ARG 96 HH12 ARG 96 24.594 4.489 0.506 556 HH21 ARG 96 HH21 ARG 96 24.148 1.809 2.723 557 HH22 ARG 96 HH22 ARG 96 24.493 3.509 2.581 558 H ARG 97 HN ARG 97 22.859 0.215 -5.200 559 HA ARG 97 HA ARG 97 21.845 2.789 -4.502 560 HB2 ARG 97 HB2 ARG 97 23.590 2.640 -6.142 561 HB3 ARG 97 HB1 ARG 97 22.645 1.544 -7.135 562 HG2 ARG 97 HG2 ARG 97 21.523 4.237 -6.599 563 HG3 ARG 97 HG1 ARG 97 22.889 4.108 -7.709 564 HD2 ARG 97 HD2 ARG 97 21.687 2.602 -9.121 565 HD3 ARG 97 HD1 ARG 97 20.371 2.461 -7.955 566 HE ARG 97 HE ARG 97 20.551 5.140 -8.587 567 HH11 ARG 97 HH11 ARG 97 19.977 2.169 -10.333 568 HH12 ARG 97 HH12 ARG 97 18.983 2.918 -11.539 569 HH21 ARG 97 HH21 ARG 97 19.255 6.142 -10.174 570 HH22 ARG 97 HH22 ARG 97 18.576 5.188 -11.454 571 H GLU 98 HN GLU 98 20.650 0.147 -6.530 572 HA GLU 98 HA GLU 98 18.344 1.341 -7.516 573 HB2 GLU 98 HB2 GLU 98 19.273 -1.439 -7.064 574 HB3 GLU 98 HB1 GLU 98 17.566 -1.203 -7.410 575 HG2 GLU 98 HG2 GLU 98 19.680 -0.015 -9.158 576 HG3 GLU 98 HG1 GLU 98 19.158 -1.688 -9.352 577 H LEU 99 HN LEU 99 18.812 -0.492 -4.530 578 HA LEU 99 HA LEU 99 16.065 -0.603 -3.873 579 HB2 LEU 99 HB2 LEU 99 17.794 -2.163 -3.045 580 HB3 LEU 99 HB1 LEU 99 18.467 -0.874 -2.073 581 HG LEU 99 HG LEU 99 16.954 -2.635 -0.947 582 HD11 LEU 99 HD11 LEU 99 16.082 -0.955 0.609 583 HD12 LEU 99 HD12 LEU 99 16.512 0.311 -0.539 584 HD13 LEU 99 HD13 LEU 99 17.772 -0.682 0.191 585 HD21 LEU 99 HD21 LEU 99 14.843 -0.836 -2.122 586 HD22 LEU 99 HD22 LEU 99 14.583 -2.120 -0.941 587 HD23 LEU 99 HD23 LEU 99 15.127 -2.518 -2.571 588 H GLN 100 HN GLN 100 18.710 1.436 -2.513 589 HA GLN 100 HA GLN 100 16.975 2.924 -0.867 590 HB2 GLN 100 HB2 GLN 100 18.775 4.598 -0.747 591 HB3 GLN 100 HB1 GLN 100 19.360 2.967 -0.467 592 HG2 GLN 100 HG2 GLN 100 20.290 2.874 -2.680 593 HG3 GLN 100 HG1 GLN 100 19.580 4.436 -3.084 594 HE21 GLN 100 HE21 GLN 100 20.171 5.632 -0.521 595 HE22 GLN 100 HE22 GLN 100 21.875 5.922 -0.490 596 H TYR 101 HN TYR 101 17.841 3.230 -4.225 597 HA TYR 101 HA TYR 101 16.826 5.832 -4.647 598 HB2 TYR 101 HB2 TYR 101 18.367 4.643 -6.208 599 HB3 TYR 101 HB1 TYR 101 17.036 3.585 -6.665 600 HD1 TYR 101 HD1 TYR 101 18.121 7.136 -6.643 601 HD2 TYR 101 HD2 TYR 101 15.528 4.229 -8.356 602 HE1 TYR 101 HE1 TYR 101 17.454 8.756 -8.366 603 HE2 TYR 101 HE2 TYR 101 14.853 5.844 -10.084 604 HH TYR 101 HH TYR 101 14.798 8.212 -10.475 605 H ARG 102 HN ARG 102 15.314 2.629 -4.727 606 HA ARG 102 HA ARG 102 12.879 3.649 -5.875 607 HB2 ARG 102 HB2 ARG 102 11.978 1.439 -5.643 608 HB3 ARG 102 HB1 ARG 102 13.629 1.298 -6.221 609 HG2 ARG 102 HG2 ARG 102 14.343 0.780 -3.909 610 HG3 ARG 102 HG1 ARG 102 12.650 0.809 -3.419 611 HD2 ARG 102 HD2 ARG 102 13.789 -1.002 -5.540 612 HD3 ARG 102 HD1 ARG 102 13.537 -1.470 -3.863 613 HE ARG 102 HE ARG 102 11.101 -0.538 -4.753 614 HH11 ARG 102 HH11 ARG 102 13.325 -3.092 -5.642 615 HH12 ARG 102 HH12 ARG 102 12.081 -4.146 -6.235 616 HH21 ARG 102 HH21 ARG 102 9.459 -1.933 -5.518 617 HH22 ARG 102 HH22 ARG 102 9.882 -3.484 -6.169 618 H VAL 103 HN VAL 103 14.139 3.293 -2.671 619 HA VAL 103 HA VAL 103 11.643 3.288 -1.299 620 HB VAL 103 HB VAL 103 14.239 4.337 -0.200 621 HG11 VAL 103 HG11 VAL 103 11.854 3.077 1.101 622 HG12 VAL 103 HG12 VAL 103 12.402 4.745 1.266 623 HG13 VAL 103 HG13 VAL 103 13.380 3.422 1.920 624 HG21 VAL 103 HG21 VAL 103 14.714 2.068 0.584 625 HG22 VAL 103 HG22 VAL 103 14.719 2.187 -1.176 626 HG23 VAL 103 HG23 VAL 103 13.334 1.479 -0.345 627 H GLU 104 HN GLU 104 13.931 5.900 -2.154 628 HA GLU 104 HA GLU 104 12.382 7.961 -1.043 629 HB2 GLU 104 HB2 GLU 104 13.673 9.437 -2.731 630 HB3 GLU 104 HB1 GLU 104 14.538 8.658 -1.417 631 HG2 GLU 104 HG2 GLU 104 15.449 7.050 -2.824 632 HG3 GLU 104 HG1 GLU 104 14.327 7.420 -4.127 633 H VAL 105 HN VAL 105 12.353 6.639 -4.379 634 HA VAL 105 HA VAL 105 10.466 8.530 -5.307 635 HB VAL 105 HB VAL 105 11.260 7.453 -7.143 636 HG11 VAL 105 HG11 VAL 105 11.688 5.043 -7.330 637 HG12 VAL 105 HG12 VAL 105 11.124 4.836 -5.672 638 HG13 VAL 105 HG13 VAL 105 12.575 5.784 -5.999 639 HG21 VAL 105 HG21 VAL 105 8.865 7.306 -7.343 640 HG22 VAL 105 HG22 VAL 105 8.871 5.754 -6.506 641 HG23 VAL 105 HG23 VAL 105 9.625 5.899 -8.092 642 H GLN 106 HN GLN 106 10.100 5.404 -3.708 643 HA GLN 106 HA GLN 106 7.300 5.309 -3.738 644 HB2 GLN 106 HB2 GLN 106 9.348 4.237 -1.801 645 HB3 GLN 106 HB1 GLN 106 7.634 3.912 -1.628 646 HG2 GLN 106 HG2 GLN 106 9.274 3.216 -4.043 647 HG3 GLN 106 HG1 GLN 106 8.871 2.100 -2.743 648 HE21 GLN 106 HE21 GLN 106 7.641 3.910 -5.453 649 HE22 GLN 106 HE22 GLN 106 6.151 3.051 -5.596 650 H ASN 107 HN ASN 107 9.541 6.760 -1.398 651 HA ASN 107 HA ASN 107 7.690 7.807 0.421 652 HB2 ASN 107 HB2 ASN 107 10.129 7.742 0.793 653 HB3 ASN 107 HB1 ASN 107 10.341 8.995 -0.428 654 HD21 ASN 107 HD21 ASN 107 11.280 10.412 1.025 655 HD22 ASN 107 HD22 ASN 107 10.371 11.207 2.262 656 H ARG 108 HN ARG 108 8.748 9.000 -2.711 657 HA ARG 108 HA ARG 108 7.481 11.566 -2.405 658 HB2 ARG 108 HB2 ARG 108 8.775 10.185 -4.755 659 HB3 ARG 108 HB1 ARG 108 8.082 11.794 -4.843 660 HG2 ARG 108 HG2 ARG 108 9.642 12.547 -3.103 661 HG3 ARG 108 HG1 ARG 108 10.355 10.934 -3.068 662 HD2 ARG 108 HD2 ARG 108 10.242 12.687 -5.514 663 HD3 ARG 108 HD1 ARG 108 11.621 12.601 -4.426 664 HE ARG 108 HE ARG 108 11.638 10.142 -5.036 665 HH11 ARG 108 HH11 ARG 108 10.418 12.595 -7.215 666 HH12 ARG 108 HH12 ARG 108 10.879 11.734 -8.648 667 HH21 ARG 108 HH21 ARG 108 12.268 9.012 -6.948 668 HH22 ARG 108 HH22 ARG 108 11.910 9.704 -8.497 669 H VAL 109 HN VAL 109 6.881 8.682 -4.383 670 HA VAL 109 HA VAL 109 4.586 9.587 -5.699 671 HB VAL 109 HB VAL 109 5.323 6.750 -4.973 672 HG11 VAL 109 HG11 VAL 109 2.949 7.019 -5.604 673 HG12 VAL 109 HG12 VAL 109 3.865 6.056 -6.769 674 HG13 VAL 109 HG13 VAL 109 3.464 7.735 -7.134 675 HG21 VAL 109 HG21 VAL 109 6.170 6.698 -7.330 676 HG22 VAL 109 HG22 VAL 109 7.103 7.710 -6.227 677 HG23 VAL 109 HG23 VAL 109 5.975 8.450 -7.369 678 H TYR 110 HN TYR 110 4.883 7.592 -2.774 679 HA TYR 110 HA TYR 110 2.102 7.318 -2.377 680 HB2 TYR 110 HB2 TYR 110 4.473 6.945 -0.565 681 HB3 TYR 110 HB1 TYR 110 2.825 6.691 -0.007 682 HD1 TYR 110 HD1 TYR 110 2.754 4.390 0.383 683 HD2 TYR 110 HD2 TYR 110 4.271 5.809 -3.326 684 HE1 TYR 110 HE1 TYR 110 2.793 2.088 -0.478 685 HE2 TYR 110 HE2 TYR 110 4.315 3.516 -4.193 686 HH TYR 110 HH TYR 110 2.765 0.930 -2.632 687 H LYS 111 HN LYS 111 4.398 9.767 -1.514 688 HA LYS 111 HA LYS 111 2.825 11.174 0.363 689 HB2 LYS 111 HB2 LYS 111 5.292 11.469 -0.054 690 HB3 LYS 111 HB1 LYS 111 4.884 12.306 -1.540 691 HG2 LYS 111 HG2 LYS 111 3.832 13.259 1.094 692 HG3 LYS 111 HG1 LYS 111 5.456 13.679 0.555 693 HD2 LYS 111 HD2 LYS 111 4.455 14.601 -1.529 694 HD3 LYS 111 HD1 LYS 111 2.858 14.300 -0.844 695 HE2 LYS 111 HE2 LYS 111 3.428 16.599 -0.472 696 HE3 LYS 111 HE1 LYS 111 3.471 15.754 1.074 697 HZ1 LYS 111 HZ1 LYS 111 5.882 15.603 0.868 698 HZ2 LYS 111 HZ2 LYS 111 5.366 17.210 0.841 699 HZ3 LYS 111 HZ3 LYS 111 5.825 16.445 -0.597 700 H LYS 112 HN LYS 112 3.148 11.322 -3.147 701 HA LYS 112 HA LYS 112 1.472 13.506 -3.653 702 HB2 LYS 112 HB2 LYS 112 1.995 11.038 -5.316 703 HB3 LYS 112 HB1 LYS 112 1.207 12.494 -5.910 704 HG2 LYS 112 HG2 LYS 112 3.199 13.745 -5.684 705 HG3 LYS 112 HG1 LYS 112 3.978 12.453 -4.762 706 HD2 LYS 112 HD2 LYS 112 3.616 10.995 -6.809 707 HD3 LYS 112 HD1 LYS 112 3.249 12.491 -7.676 708 HE2 LYS 112 HE2 LYS 112 5.443 13.375 -7.010 709 HE3 LYS 112 HE1 LYS 112 5.781 11.845 -6.203 710 HZ1 LYS 112 HZ1 LYS 112 5.591 10.728 -8.347 711 HZ2 LYS 112 HZ2 LYS 112 6.797 11.908 -8.381 712 HZ3 LYS 112 HZ3 LYS 112 5.302 12.209 -9.110 713 H GLU 113 HN GLU 113 0.762 10.072 -3.201 714 HA GLU 113 HA GLU 113 -1.965 10.140 -3.857 715 HB2 GLU 113 HB2 GLU 113 -0.789 8.407 -1.688 716 HB3 GLU 113 HB1 GLU 113 -2.183 8.065 -2.706 717 HG2 GLU 113 HG2 GLU 113 -0.471 8.159 -4.647 718 HG3 GLU 113 HG1 GLU 113 0.727 7.947 -3.371 719 H ILE 114 HN ILE 114 -0.334 10.457 -0.725 720 HA ILE 114 HA ILE 114 -2.561 10.850 0.865 721 HB ILE 114 HB ILE 114 0.250 11.872 1.182 722 HG12 ILE 114 HG12 ILE 114 -1.198 9.481 2.323 723 HG13 ILE 114 HG11 ILE 114 -0.034 9.436 1.008 724 HG21 ILE 114 HG21 ILE 114 -2.010 11.800 3.173 725 HG22 ILE 114 HG22 ILE 114 -1.133 13.221 2.594 726 HG23 ILE 114 HG23 ILE 114 -0.315 12.025 3.605 727 HD11 ILE 114 HD11 ILE 114 0.934 8.727 3.116 728 HD12 ILE 114 HD12 ILE 114 0.552 10.298 3.821 729 HD13 ILE 114 HD13 ILE 114 1.708 10.184 2.493 730 H GLN 115 HN GLN 115 -0.916 13.165 -1.205 731 HA GLN 115 HA GLN 115 -2.140 15.476 -0.088 732 HB2 GLN 115 HB2 GLN 115 -1.194 15.113 -2.929 733 HB3 GLN 115 HB1 GLN 115 -1.387 16.626 -2.055 734 HG2 GLN 115 HG2 GLN 115 0.350 15.804 -0.447 735 HG3 GLN 115 HG1 GLN 115 0.623 14.468 -1.567 736 HE21 GLN 115 HE21 GLN 115 0.932 17.897 -1.082 737 HE22 GLN 115 HE22 GLN 115 2.026 18.183 -2.388 738 H ALA 116 HN ALA 116 -2.946 13.365 -2.808 739 HA ALA 116 HA ALA 116 -5.374 14.595 -3.540 740 HB1 ALA 116 HB1 ALA 116 -4.309 12.908 -4.940 741 HB2 ALA 116 HB2 ALA 116 -5.953 12.417 -4.535 742 HB3 ALA 116 HB3 ALA 116 -4.582 11.683 -3.700 743 H LEU 117 HN LEU 117 -4.633 11.951 -1.334 744 HA LEU 117 HA LEU 117 -7.244 11.452 -0.432 745 HB2 LEU 117 HB2 LEU 117 -4.681 11.057 1.114 746 HB3 LEU 117 HB1 LEU 117 -6.199 10.217 1.364 747 HG LEU 117 HG LEU 117 -4.512 9.983 -1.131 748 HD11 LEU 117 HD11 LEU 117 -3.416 9.053 0.882 749 HD12 LEU 117 HD12 LEU 117 -3.811 7.847 -0.340 750 HD13 LEU 117 HD13 LEU 117 -4.810 7.996 1.108 751 HD21 LEU 117 HD21 LEU 117 -6.868 8.356 -0.193 752 HD22 LEU 117 HD22 LEU 117 -5.931 8.102 -1.668 753 HD23 LEU 117 HD23 LEU 117 -6.901 9.563 -1.479 754 H ASP 118 HN ASP 118 -4.898 13.860 0.432 755 HA ASP 118 HA ASP 118 -5.824 14.631 2.949 756 HB2 ASP 118 HB2 ASP 118 -3.719 15.435 2.221 757 HB3 ASP 118 HB1 ASP 118 -4.407 16.150 0.769 758 H ALA 119 HN ALA 119 -6.915 15.553 -0.270 759 HA ALA 119 HA ALA 119 -8.789 17.514 0.532 760 HB1 ALA 119 HB1 ALA 119 -9.826 17.158 -1.642 761 HB2 ALA 119 HB2 ALA 119 -8.910 15.665 -1.850 762 HB3 ALA 119 HB3 ALA 119 -8.070 17.214 -1.799 763 H GLU 120 HN GLU 120 -8.955 14.027 0.157 764 HA GLU 120 HA GLU 120 -11.693 13.823 0.933 765 HB2 GLU 120 HB2 GLU 120 -9.456 11.844 0.634 766 HB3 GLU 120 HB1 GLU 120 -10.995 11.381 1.330 767 HG2 GLU 120 HG2 GLU 120 -10.849 10.826 -1.033 768 HG3 GLU 120 HG1 GLU 120 -12.156 11.953 -0.692 769 H ILE 121 HN ILE 121 -8.629 13.889 2.646 770 HA ILE 121 HA ILE 121 -9.534 13.105 5.161 771 HB ILE 121 HB ILE 121 -7.281 14.710 4.167 772 HG12 ILE 121 HG12 ILE 121 -6.056 13.317 5.817 773 HG13 ILE 121 HG11 ILE 121 -7.592 12.653 6.360 774 HG21 ILE 121 HG21 ILE 121 -8.155 16.312 5.769 775 HG22 ILE 121 HG22 ILE 121 -6.641 15.613 6.339 776 HG23 ILE 121 HG23 ILE 121 -8.176 15.070 7.020 777 HD11 ILE 121 HD11 ILE 121 -6.574 11.080 4.903 778 HD12 ILE 121 HD12 ILE 121 -6.302 12.314 3.668 779 HD13 ILE 121 HD13 ILE 121 -7.944 11.792 4.050 780 H ARG 122 HN ARG 122 -10.098 16.019 3.347 781 HA ARG 122 HA ARG 122 -11.066 17.636 5.438 782 HB2 ARG 122 HB2 ARG 122 -10.508 18.368 3.075 783 HB3 ARG 122 HB1 ARG 122 -12.055 17.687 2.587 784 HG2 ARG 122 HG2 ARG 122 -12.262 20.064 2.912 785 HG3 ARG 122 HG1 ARG 122 -13.192 19.212 4.144 786 HD2 ARG 122 HD2 ARG 122 -11.447 19.563 5.769 787 HD3 ARG 122 HD1 ARG 122 -10.406 20.286 4.546 788 HE ARG 122 HE ARG 122 -12.606 21.863 4.504 789 HH11 ARG 122 HH11 ARG 122 -10.485 20.746 7.058 790 HH12 ARG 122 HH12 ARG 122 -10.689 22.173 8.028 791 HH21 ARG 122 HH21 ARG 122 -12.866 23.744 5.754 792 HH22 ARG 122 HH22 ARG 122 -12.042 23.893 7.275 793 H LYS 123 HN LYS 123 -12.747 15.389 3.227 794 HA LYS 123 HA LYS 123 -15.319 15.770 4.366 795 HB2 LYS 123 HB2 LYS 123 -16.028 13.844 3.157 796 HB3 LYS 123 HB1 LYS 123 -14.824 14.633 2.161 797 HG2 LYS 123 HG2 LYS 123 -13.249 12.909 3.459 798 HG3 LYS 123 HG1 LYS 123 -14.752 11.998 3.470 799 HD2 LYS 123 HD2 LYS 123 -13.467 13.189 1.015 800 HD3 LYS 123 HD1 LYS 123 -13.305 11.509 1.516 801 HE2 LYS 123 HE2 LYS 123 -15.605 11.103 1.177 802 HE3 LYS 123 HE1 LYS 123 -15.943 12.823 0.992 803 HZ1 LYS 123 HZ1 LYS 123 -14.694 12.826 -1.066 804 HZ2 LYS 123 HZ2 LYS 123 -15.909 11.659 -1.141 805 HZ3 LYS 123 HZ3 LYS 123 -14.309 11.191 -0.876 806 H LEU 124 HN LEU 124 -12.677 13.582 5.101 807 HA LEU 124 HA LEU 124 -13.868 12.104 7.146 808 HB2 LEU 124 HB2 LEU 124 -11.019 12.972 6.710 809 HB3 LEU 124 HB1 LEU 124 -11.490 11.917 8.027 810 HG LEU 124 HG LEU 124 -11.828 11.301 5.084 811 HD11 LEU 124 HD11 LEU 124 -10.087 9.600 5.534 812 HD12 LEU 124 HD12 LEU 124 -9.878 10.272 7.151 813 HD13 LEU 124 HD13 LEU 124 -9.495 11.247 5.734 814 HD21 LEU 124 HD21 LEU 124 -12.457 9.086 5.839 815 HD22 LEU 124 HD22 LEU 124 -13.556 10.300 6.490 816 HD23 LEU 124 HD23 LEU 124 -12.312 9.596 7.521 817 H GLU 125 HN GLU 125 -12.037 15.152 7.302 818 HA GLU 125 HA GLU 125 -12.080 15.584 10.026 819 HB2 GLU 125 HB2 GLU 125 -12.266 17.590 7.783 820 HB3 GLU 125 HB1 GLU 125 -12.001 18.028 9.464 821 HG2 GLU 125 HG2 GLU 125 -9.944 16.683 9.461 822 HG3 GLU 125 HG1 GLU 125 -10.197 16.335 7.755 823 H ARG 126 HN ARG 126 -14.652 16.052 7.709 824 HA ARG 126 HA ARG 126 -16.387 17.533 9.372 825 HB2 ARG 126 HB2 ARG 126 -16.640 15.994 6.854 826 HB3 ARG 126 HB1 ARG 126 -18.120 16.261 7.764 827 HG2 ARG 126 HG2 ARG 126 -17.639 17.962 6.007 828 HG3 ARG 126 HG1 ARG 126 -17.887 18.620 7.624 829 HD2 ARG 126 HD2 ARG 126 -15.391 18.645 7.884 830 HD3 ARG 126 HD1 ARG 126 -15.274 18.222 6.176 831 HE ARG 126 HE ARG 126 -16.667 20.360 5.872 832 HH11 ARG 126 HH11 ARG 126 -14.235 19.887 8.348 833 HH12 ARG 126 HH12 ARG 126 -13.840 21.570 8.466 834 HH21 ARG 126 HH21 ARG 126 -16.156 22.583 6.029 835 HH22 ARG 126 HH22 ARG 126 -14.941 23.109 7.153 836 H LEU 127 HN LEU 127 -15.654 14.129 9.170 837 HA LEU 127 HA LEU 127 -17.778 13.471 11.049 838 HB2 LEU 127 HB2 LEU 127 -15.775 11.915 9.506 839 HB3 LEU 127 HB1 LEU 127 -16.367 11.213 10.999 840 HG LEU 127 HG LEU 127 -18.665 11.318 10.168 841 HD11 LEU 127 HD11 LEU 127 -18.561 13.271 8.769 842 HD12 LEU 127 HD12 LEU 127 -19.082 11.893 7.800 843 HD13 LEU 127 HD13 LEU 127 -17.423 12.479 7.681 844 HD21 LEU 127 HD21 LEU 127 -16.763 10.014 8.229 845 HD22 LEU 127 HD22 LEU 127 -18.473 9.629 8.415 846 HD23 LEU 127 HD23 LEU 127 -17.349 9.317 9.737 847 H LEU 128 HN LEU 128 -14.185 13.460 11.081 848 HA LEU 128 HA LEU 128 -13.637 12.945 13.681 849 HB2 LEU 128 HB2 LEU 128 -12.473 14.928 11.764 850 HB3 LEU 128 HB1 LEU 128 -11.847 14.803 13.391 851 HG LEU 128 HG LEU 128 -11.353 12.414 12.954 852 HD11 LEU 128 HD11 LEU 128 -11.251 11.603 10.670 853 HD12 LEU 128 HD12 LEU 128 -12.050 13.078 10.120 854 HD13 LEU 128 HD13 LEU 128 -12.905 11.950 11.175 855 HD21 LEU 128 HD21 LEU 128 -9.640 14.129 12.772 856 HD22 LEU 128 HD22 LEU 128 -10.083 14.397 11.085 857 HD23 LEU 128 HD23 LEU 128 -9.379 12.855 11.582 858 H GLU 129 HN GLU 129 -14.138 16.255 12.470 859 HA GLU 129 HA GLU 129 -14.258 17.407 15.049 860 HB2 GLU 129 HB2 GLU 129 -15.228 18.495 12.403 861 HB3 GLU 129 HB1 GLU 129 -15.016 19.440 13.872 862 HG2 GLU 129 HG2 GLU 129 -12.616 18.821 13.851 863 HG3 GLU 129 HG1 GLU 129 -12.874 18.037 12.296 864 H SER 130 HN SER 130 -16.585 15.694 13.289 865 HA SER 130 HA SER 130 -18.886 16.965 14.486 866 HB2 SER 130 HB2 SER 130 -18.940 15.869 12.224 867 HB3 SER 130 HB1 SER 130 -18.763 14.314 13.034 868 HG SER 130 HG SER 130 -20.722 15.091 14.273 869 H GLY 131 HN GLY 131 -16.578 14.713 15.468 870 HA2 GLY 131 HA2 GLY 131 -16.446 13.758 17.601 871 HA3 GLY 131 HA1 GLY 131 -18.165 14.050 17.818 872 H LEU 132 HN LEU 132 -17.115 12.568 14.888 873 HA LEU 132 HA LEU 132 -18.492 10.124 15.685 874 HB2 LEU 132 HB2 LEU 132 -19.116 11.310 13.587 875 HB3 LEU 132 HB1 LEU 132 -17.511 11.002 12.962 876 HG LEU 132 HG LEU 132 -19.414 9.502 12.146 877 HD11 LEU 132 HD11 LEU 132 -17.997 7.524 12.071 878 HD12 LEU 132 HD12 LEU 132 -16.971 8.202 13.336 879 HD13 LEU 132 HD13 LEU 132 -17.062 8.987 11.760 880 HD21 LEU 132 HD21 LEU 132 -20.466 9.102 14.304 881 HD22 LEU 132 HD22 LEU 132 -19.009 8.288 14.874 882 HD23 LEU 132 HD23 LEU 132 -19.953 7.587 13.561 883 H THR 133 HN THR 133 -15.448 11.100 14.122 884 HA THR 133 HA THR 133 -14.386 8.432 14.308 885 HB THR 133 HB THR 133 -12.896 10.945 13.546 886 HG1 THR 133 HG1 THR 133 -14.624 9.269 12.028 887 HG21 THR 133 HG21 THR 133 -11.514 9.402 12.240 888 HG22 THR 133 HG22 THR 133 -12.497 8.045 12.790 889 HG23 THR 133 HG23 THR 133 -11.516 8.948 13.945 Start of MODEL 20 1 H1 MET 1 HT1 MET 1 29.590 -6.036 1.809 2 H2 MET 1 HT2 MET 1 28.694 -5.087 2.881 3 H3 MET 1 HT3 MET 1 28.338 -6.729 2.710 4 HA MET 1 HA MET 1 29.534 -6.329 4.754 5 HB2 MET 1 HB2 MET 1 31.160 -7.759 2.637 6 HB3 MET 1 HB1 MET 1 31.409 -7.915 4.369 7 HG2 MET 1 HG2 MET 1 29.168 -8.858 4.606 8 HG3 MET 1 HG1 MET 1 28.923 -8.705 2.868 9 HE1 MET 1 HE1 MET 1 31.560 -11.237 1.451 10 HE2 MET 1 HE2 MET 1 31.809 -9.515 1.739 11 HE3 MET 1 HE3 MET 1 30.288 -10.084 1.053 12 H ASP 2 HN ASP 2 29.986 -4.013 4.816 13 HA ASP 2 HA ASP 2 32.826 -3.482 4.338 14 HB2 ASP 2 HB2 ASP 2 31.504 -2.603 2.397 15 HB3 ASP 2 HB1 ASP 2 30.652 -1.546 3.518 16 H SER 3 HN SER 3 33.772 -2.346 5.952 17 HA SER 3 HA SER 3 32.043 -1.698 8.221 18 HB2 SER 3 HB2 SER 3 35.044 -2.061 8.122 19 HB3 SER 3 HB1 SER 3 34.077 -1.831 9.578 20 HG SER 3 HG SER 3 33.777 -3.982 7.743 21 H ALA 4 HN ALA 4 33.483 -0.063 5.708 22 HA ALA 4 HA ALA 4 34.351 2.253 7.207 23 HB1 ALA 4 HB1 ALA 4 34.738 3.273 5.021 24 HB2 ALA 4 HB2 ALA 4 33.949 1.905 4.238 25 HB3 ALA 4 HB3 ALA 4 35.461 1.668 5.110 26 H ILE 5 HN ILE 5 31.452 1.032 5.942 27 HA ILE 5 HA ILE 5 29.925 3.298 5.467 28 HB ILE 5 HB ILE 5 29.099 0.660 6.611 29 HG12 ILE 5 HG12 ILE 5 30.231 0.489 4.476 30 HG13 ILE 5 HG11 ILE 5 28.525 0.133 4.313 31 HG21 ILE 5 HG21 ILE 5 26.856 1.165 5.872 32 HG22 ILE 5 HG22 ILE 5 27.393 2.735 5.285 33 HG23 ILE 5 HG23 ILE 5 27.405 2.393 7.013 34 HD11 ILE 5 HD11 ILE 5 29.228 1.482 2.480 35 HD12 ILE 5 HD12 ILE 5 29.888 2.681 3.590 36 HD13 ILE 5 HD13 ILE 5 28.150 2.411 3.520 37 H SER 6 HN SER 6 29.388 4.942 6.774 38 HA SER 6 HA SER 6 29.405 4.495 9.682 39 HB2 SER 6 HB2 SER 6 29.677 7.096 8.149 40 HB3 SER 6 HB1 SER 6 29.833 6.893 9.893 41 HG SER 6 HG SER 6 31.496 5.171 8.850 42 H LYS 7 HN LYS 7 27.919 6.580 10.608 43 HA LYS 7 HA LYS 7 25.286 5.743 10.245 44 HB2 LYS 7 HB2 LYS 7 26.525 8.165 11.454 45 HB3 LYS 7 HB1 LYS 7 24.788 8.144 11.198 46 HG2 LYS 7 HG2 LYS 7 24.766 5.953 12.463 47 HG3 LYS 7 HG1 LYS 7 26.430 6.317 12.920 48 HD2 LYS 7 HD2 LYS 7 25.722 8.376 13.976 49 HD3 LYS 7 HD1 LYS 7 24.066 8.113 13.433 50 HE2 LYS 7 HE2 LYS 7 23.953 6.070 14.782 51 HE3 LYS 7 HE1 LYS 7 25.603 6.352 15.338 52 HZ1 LYS 7 HZ1 LYS 7 24.862 8.424 16.347 53 HZ2 LYS 7 HZ2 LYS 7 23.996 7.109 16.964 54 HZ3 LYS 7 HZ3 LYS 7 23.279 8.134 15.827 55 H GLU 8 HN GLU 8 27.158 8.070 8.486 56 HA GLU 8 HA GLU 8 25.288 9.596 7.206 57 HB2 GLU 8 HB2 GLU 8 27.872 8.406 6.229 58 HB3 GLU 8 HB1 GLU 8 26.924 9.518 5.246 59 HG2 GLU 8 HG2 GLU 8 27.921 10.156 8.007 60 HG3 GLU 8 HG1 GLU 8 28.781 10.573 6.527 61 H ASP 9 HN ASP 9 26.461 6.419 6.102 62 HA ASP 9 HA ASP 9 24.510 6.375 3.974 63 HB2 ASP 9 HB2 ASP 9 26.841 5.413 3.816 64 HB3 ASP 9 HB1 ASP 9 26.301 4.132 4.891 65 H GLU 10 HN GLU 10 24.971 4.897 7.106 66 HA GLU 10 HA GLU 10 22.963 2.911 6.863 67 HB2 GLU 10 HB2 GLU 10 24.732 2.597 8.442 68 HB3 GLU 10 HB1 GLU 10 24.395 4.131 9.220 69 HG2 GLU 10 HG2 GLU 10 23.631 2.427 10.663 70 HG3 GLU 10 HG1 GLU 10 22.209 3.188 9.959 71 H GLU 11 HN GLU 11 22.973 5.846 8.882 72 HA GLU 11 HA GLU 11 20.305 5.575 9.647 73 HB2 GLU 11 HB2 GLU 11 22.035 8.047 9.610 74 HB3 GLU 11 HB1 GLU 11 20.539 7.856 10.517 75 HG2 GLU 11 HG2 GLU 11 22.957 6.114 10.896 76 HG3 GLU 11 HG1 GLU 11 22.633 7.556 11.851 77 H ARG 12 HN ARG 12 21.818 7.280 6.961 78 HA ARG 12 HA ARG 12 19.517 8.711 6.142 79 HB2 ARG 12 HB2 ARG 12 21.734 9.300 5.339 80 HB3 ARG 12 HB1 ARG 12 21.890 7.745 4.542 81 HG2 ARG 12 HG2 ARG 12 21.427 9.515 2.950 82 HG3 ARG 12 HG1 ARG 12 20.114 8.343 2.990 83 HD2 ARG 12 HD2 ARG 12 19.947 10.793 4.689 84 HD3 ARG 12 HD1 ARG 12 19.615 10.915 2.961 85 HE ARG 12 HE ARG 12 18.181 8.790 4.266 86 HH11 ARG 12 HH11 ARG 12 18.140 12.203 3.488 87 HH12 ARG 12 HH12 ARG 12 16.410 12.327 3.567 88 HH21 ARG 12 HH21 ARG 12 15.920 8.943 4.349 89 HH22 ARG 12 HH22 ARG 12 15.134 10.456 4.035 90 H TYR 13 HN TYR 13 20.718 5.454 5.389 91 HA TYR 13 HA TYR 13 18.716 4.899 3.453 92 HB2 TYR 13 HB2 TYR 13 20.640 3.508 3.433 93 HB3 TYR 13 HB1 TYR 13 20.485 3.143 5.149 94 HD1 TYR 13 HD1 TYR 13 18.290 2.884 2.119 95 HD2 TYR 13 HD2 TYR 13 19.849 0.997 5.598 96 HE1 TYR 13 HE1 TYR 13 16.991 0.866 1.596 97 HE2 TYR 13 HE2 TYR 13 18.574 -1.037 5.076 98 HH TYR 13 HH TYR 13 17.215 -1.653 2.124 99 H GLN 14 HN GLN 14 19.043 4.072 6.878 100 HA GLN 14 HA GLN 14 16.708 2.617 7.208 101 HB2 GLN 14 HB2 GLN 14 18.153 4.405 9.156 102 HB3 GLN 14 HB1 GLN 14 16.923 3.234 9.603 103 HG2 GLN 14 HG2 GLN 14 19.457 2.520 8.161 104 HG3 GLN 14 HG1 GLN 14 19.285 2.494 9.911 105 HE21 GLN 14 HE21 GLN 14 19.796 0.275 9.849 106 HE22 GLN 14 HE22 GLN 14 18.606 -0.901 9.396 107 H LYS 15 HN LYS 15 17.205 6.052 7.957 108 HA LYS 15 HA LYS 15 14.590 6.671 8.589 109 HB2 LYS 15 HB2 LYS 15 16.645 8.439 7.266 110 HB3 LYS 15 HB1 LYS 15 15.135 9.016 7.956 111 HG2 LYS 15 HG2 LYS 15 17.350 7.649 9.470 112 HG3 LYS 15 HG1 LYS 15 17.019 9.377 9.461 113 HD2 LYS 15 HD2 LYS 15 15.147 7.234 10.458 114 HD3 LYS 15 HD1 LYS 15 16.142 8.277 11.473 115 HE2 LYS 15 HE2 LYS 15 14.965 10.239 10.556 116 HE3 LYS 15 HE1 LYS 15 13.937 9.159 9.616 117 HZ1 LYS 15 HZ1 LYS 15 14.093 9.327 12.573 118 HZ2 LYS 15 HZ2 LYS 15 13.209 8.157 11.736 119 HZ3 LYS 15 HZ3 LYS 15 12.792 9.788 11.598 120 H LEU 16 HN LEU 16 16.058 6.333 5.418 121 HA LEU 16 HA LEU 16 13.946 7.558 3.972 122 HB2 LEU 16 HB2 LEU 16 16.263 7.193 3.107 123 HB3 LEU 16 HB1 LEU 16 15.889 5.486 2.970 124 HG LEU 16 HG LEU 16 14.203 5.940 1.274 125 HD11 LEU 16 HD11 LEU 16 14.881 8.835 1.780 126 HD12 LEU 16 HD12 LEU 16 13.333 8.040 2.077 127 HD13 LEU 16 HD13 LEU 16 13.914 8.252 0.427 128 HD21 LEU 16 HD21 LEU 16 16.545 5.688 0.597 129 HD22 LEU 16 HD22 LEU 16 16.754 7.436 0.706 130 HD23 LEU 16 HD23 LEU 16 15.648 6.753 -0.491 131 H VAL 17 HN VAL 17 14.689 4.198 4.795 132 HA VAL 17 HA VAL 17 12.435 3.086 3.501 133 HB VAL 17 HB VAL 17 12.961 1.068 4.449 134 HG11 VAL 17 HG11 VAL 17 15.460 2.694 4.814 135 HG12 VAL 17 HG12 VAL 17 14.943 1.842 3.356 136 HG13 VAL 17 HG13 VAL 17 15.408 0.929 4.792 137 HG21 VAL 17 HG21 VAL 17 13.927 0.712 6.678 138 HG22 VAL 17 HG22 VAL 17 12.411 1.613 6.755 139 HG23 VAL 17 HG23 VAL 17 13.947 2.458 6.940 140 H THR 18 HN THR 18 12.961 4.478 6.662 141 HA THR 18 HA THR 18 10.521 3.792 7.838 142 HB THR 18 HB THR 18 12.738 5.671 8.330 143 HG1 THR 18 HG1 THR 18 12.512 3.545 9.269 144 HG21 THR 18 HG21 THR 18 10.031 6.102 9.559 145 HG22 THR 18 HG22 THR 18 10.949 7.227 8.556 146 HG23 THR 18 HG23 THR 18 11.535 6.799 10.163 147 H GLU 19 HN GLU 19 11.521 6.532 5.836 148 HA GLU 19 HA GLU 19 9.261 8.124 6.140 149 HB2 GLU 19 HB2 GLU 19 11.134 7.820 3.793 150 HB3 GLU 19 HB1 GLU 19 9.860 9.033 3.858 151 HG2 GLU 19 HG2 GLU 19 10.884 9.869 5.983 152 HG3 GLU 19 HG1 GLU 19 12.229 8.765 5.698 153 H ASN 20 HN ASN 20 9.825 5.404 3.919 154 HA ASN 20 HA ASN 20 7.266 5.884 2.677 155 HB2 ASN 20 HB2 ASN 20 7.727 4.109 1.164 156 HB3 ASN 20 HB1 ASN 20 9.214 5.023 1.358 157 HD21 ASN 20 HD21 ASN 20 10.992 4.028 2.143 158 HD22 ASN 20 HD22 ASN 20 11.057 2.345 2.541 159 H GLU 21 HN GLU 21 8.518 3.820 5.205 160 HA GLU 21 HA GLU 21 6.422 1.970 5.401 161 HB2 GLU 21 HB2 GLU 21 8.044 3.262 7.602 162 HB3 GLU 21 HB1 GLU 21 7.030 1.841 7.805 163 HG2 GLU 21 HG2 GLU 21 9.029 1.700 5.668 164 HG3 GLU 21 HG1 GLU 21 9.660 1.760 7.307 165 H GLN 22 HN GLN 22 6.792 5.187 6.781 166 HA GLN 22 HA GLN 22 4.517 5.231 8.399 167 HB2 GLN 22 HB2 GLN 22 5.648 7.615 6.937 168 HB3 GLN 22 HB1 GLN 22 4.716 7.622 8.424 169 HG2 GLN 22 HG2 GLN 22 6.529 6.529 9.607 170 HG3 GLN 22 HG1 GLN 22 7.469 6.441 8.117 171 HE21 GLN 22 HE21 GLN 22 8.122 7.746 10.634 172 HE22 GLN 22 HE22 GLN 22 8.378 9.416 10.261 173 H LEU 23 HN LEU 23 4.876 6.686 5.155 174 HA LEU 23 HA LEU 23 2.119 7.429 5.242 175 HB2 LEU 23 HB2 LEU 23 2.531 8.845 3.496 176 HB3 LEU 23 HB1 LEU 23 4.064 8.799 4.324 177 HG LEU 23 HG LEU 23 3.377 7.382 1.752 178 HD11 LEU 23 HD11 LEU 23 5.208 9.696 2.369 179 HD12 LEU 23 HD12 LEU 23 3.668 9.784 1.515 180 HD13 LEU 23 HD13 LEU 23 5.026 8.919 0.797 181 HD21 LEU 23 HD21 LEU 23 4.915 6.029 3.028 182 HD22 LEU 23 HD22 LEU 23 5.947 7.432 3.314 183 HD23 LEU 23 HD23 LEU 23 5.755 6.795 1.680 184 H GLN 24 HN GLN 24 3.807 4.723 3.920 185 HA GLN 24 HA GLN 24 1.869 4.070 1.956 186 HB2 GLN 24 HB2 GLN 24 2.816 1.881 1.891 187 HB3 GLN 24 HB1 GLN 24 4.142 3.010 2.124 188 HG2 GLN 24 HG2 GLN 24 4.133 2.480 4.527 189 HG3 GLN 24 HG1 GLN 24 2.854 1.304 4.241 190 HE21 GLN 24 HE21 GLN 24 5.523 1.884 2.061 191 HE22 GLN 24 HE22 GLN 24 6.291 0.355 2.282 192 H ARG 25 HN ARG 25 2.079 3.721 5.377 193 HA ARG 25 HA ARG 25 -0.179 2.018 5.726 194 HB2 ARG 25 HB2 ARG 25 1.100 1.909 7.595 195 HB3 ARG 25 HB1 ARG 25 1.763 3.515 7.353 196 HG2 ARG 25 HG2 ARG 25 -0.611 4.276 8.099 197 HG3 ARG 25 HG1 ARG 25 -0.670 2.670 8.837 198 HD2 ARG 25 HD2 ARG 25 1.313 4.887 9.336 199 HD3 ARG 25 HD1 ARG 25 0.194 4.152 10.488 200 HE ARG 25 HE ARG 25 1.620 2.036 9.950 201 HH11 ARG 25 HH11 ARG 25 2.787 5.316 10.339 202 HH12 ARG 25 HH12 ARG 25 4.368 4.825 10.855 203 HH21 ARG 25 HH21 ARG 25 3.700 1.389 10.621 204 HH22 ARG 25 HH22 ARG 25 4.888 2.592 11.012 205 H LEU 26 HN LEU 26 0.459 5.468 5.728 206 HA LEU 26 HA LEU 26 -2.094 6.359 6.524 207 HB2 LEU 26 HB2 LEU 26 0.001 7.714 4.815 208 HB3 LEU 26 HB1 LEU 26 -1.351 8.530 5.597 209 HG LEU 26 HG LEU 26 0.838 7.037 7.061 210 HD11 LEU 26 HD11 LEU 26 0.463 10.013 6.857 211 HD12 LEU 26 HD12 LEU 26 1.645 9.092 5.930 212 HD13 LEU 26 HD13 LEU 26 1.754 9.142 7.689 213 HD21 LEU 26 HD21 LEU 26 -1.412 8.778 8.049 214 HD22 LEU 26 HD22 LEU 26 -0.090 8.173 9.045 215 HD23 LEU 26 HD23 LEU 26 -1.222 7.043 8.304 216 H ILE 27 HN ILE 27 -0.736 5.398 3.469 217 HA ILE 27 HA ILE 27 -2.889 6.125 1.791 218 HB ILE 27 HB ILE 27 -0.933 3.833 1.565 219 HG12 ILE 27 HG12 ILE 27 -0.919 6.533 0.217 220 HG13 ILE 27 HG11 ILE 27 0.053 6.115 1.635 221 HG21 ILE 27 HG21 ILE 27 -2.954 3.474 0.205 222 HG22 ILE 27 HG22 ILE 27 -1.511 3.716 -0.778 223 HG23 ILE 27 HG23 ILE 27 -2.675 5.024 -0.587 224 HD11 ILE 27 HD11 ILE 27 1.117 4.332 0.309 225 HD12 ILE 27 HD12 ILE 27 1.391 5.947 -0.340 226 HD13 ILE 27 HD13 ILE 27 0.213 4.878 -1.100 227 H THR 28 HN THR 28 -2.039 3.085 3.394 228 HA THR 28 HA THR 28 -4.150 1.517 2.583 229 HB THR 28 HB THR 28 -1.998 1.242 4.327 230 HG1 THR 28 HG1 THR 28 -2.714 -0.317 2.839 231 HG21 THR 28 HG21 THR 28 -3.338 1.788 6.271 232 HG22 THR 28 HG22 THR 28 -2.948 0.068 6.284 233 HG23 THR 28 HG23 THR 28 -4.558 0.603 5.798 234 H GLN 29 HN GLN 29 -4.073 3.875 5.194 235 HA GLN 29 HA GLN 29 -6.523 3.201 6.422 236 HB2 GLN 29 HB2 GLN 29 -5.304 5.957 6.221 237 HB3 GLN 29 HB1 GLN 29 -6.428 5.387 7.444 238 HG2 GLN 29 HG2 GLN 29 -3.627 4.372 7.050 239 HG3 GLN 29 HG1 GLN 29 -4.131 5.553 8.251 240 HE21 GLN 29 HE21 GLN 29 -6.664 4.176 8.769 241 HE22 GLN 29 HE22 GLN 29 -6.263 2.776 9.699 242 H LYS 30 HN LYS 30 -5.732 5.781 4.142 243 HA LYS 30 HA LYS 30 -8.399 6.612 3.764 244 HB2 LYS 30 HB2 LYS 30 -5.956 7.042 2.044 245 HB3 LYS 30 HB1 LYS 30 -7.484 7.891 1.844 246 HG2 LYS 30 HG2 LYS 30 -7.265 8.853 4.065 247 HG3 LYS 30 HG1 LYS 30 -5.761 7.968 4.313 248 HD2 LYS 30 HD2 LYS 30 -4.684 9.205 2.550 249 HD3 LYS 30 HD1 LYS 30 -6.202 10.001 2.130 250 HE2 LYS 30 HE2 LYS 30 -4.766 11.475 3.445 251 HE3 LYS 30 HE1 LYS 30 -6.250 11.087 4.313 252 HZ1 LYS 30 HZ1 LYS 30 -3.588 9.854 4.766 253 HZ2 LYS 30 HZ2 LYS 30 -5.008 9.422 5.575 254 HZ3 LYS 30 HZ3 LYS 30 -4.358 10.968 5.778 255 H GLU 31 HN GLU 31 -6.322 4.434 1.884 256 HA GLU 31 HA GLU 31 -7.980 4.060 -0.310 257 HB2 GLU 31 HB2 GLU 31 -5.891 2.356 0.983 258 HB3 GLU 31 HB1 GLU 31 -6.827 1.728 -0.366 259 HG2 GLU 31 HG2 GLU 31 -5.302 4.312 -0.473 260 HG3 GLU 31 HG1 GLU 31 -4.620 2.761 -0.953 261 H GLU 32 HN GLU 32 -8.016 2.260 2.786 262 HA GLU 32 HA GLU 32 -9.993 0.420 1.885 263 HB2 GLU 32 HB2 GLU 32 -10.279 -0.180 4.267 264 HB3 GLU 32 HB1 GLU 32 -8.599 -0.202 3.757 265 HG2 GLU 32 HG2 GLU 32 -8.067 1.687 4.973 266 HG3 GLU 32 HG1 GLU 32 -9.744 2.222 5.066 267 H LYS 33 HN LYS 33 -10.117 3.591 3.302 268 HA LYS 33 HA LYS 33 -12.909 3.459 3.963 269 HB2 LYS 33 HB2 LYS 33 -11.208 4.945 5.090 270 HB3 LYS 33 HB1 LYS 33 -11.183 5.918 3.629 271 HG2 LYS 33 HG2 LYS 33 -13.487 6.513 3.916 272 HG3 LYS 33 HG1 LYS 33 -13.644 5.410 5.283 273 HD2 LYS 33 HD2 LYS 33 -12.027 6.732 6.546 274 HD3 LYS 33 HD1 LYS 33 -11.832 7.823 5.174 275 HE2 LYS 33 HE2 LYS 33 -14.157 8.493 5.345 276 HE3 LYS 33 HE1 LYS 33 -14.411 7.349 6.662 277 HZ1 LYS 33 HZ1 LYS 33 -14.098 9.514 7.579 278 HZ2 LYS 33 HZ2 LYS 33 -12.673 9.750 6.706 279 HZ3 LYS 33 HZ3 LYS 33 -12.725 8.598 7.937 280 H ILE 34 HN ILE 34 -10.956 4.856 1.360 281 HA ILE 34 HA ILE 34 -13.144 5.845 -0.157 282 HB ILE 34 HB ILE 34 -10.337 5.105 -1.017 283 HG12 ILE 34 HG12 ILE 34 -11.483 7.856 -0.776 284 HG13 ILE 34 HG11 ILE 34 -10.880 7.022 0.661 285 HG21 ILE 34 HG21 ILE 34 -11.872 5.009 -2.912 286 HG22 ILE 34 HG22 ILE 34 -10.764 6.375 -3.040 287 HG23 ILE 34 HG23 ILE 34 -12.434 6.637 -2.537 288 HD11 ILE 34 HD11 ILE 34 -8.689 6.793 -0.391 289 HD12 ILE 34 HD12 ILE 34 -9.186 8.482 -0.282 290 HD13 ILE 34 HD13 ILE 34 -9.291 7.630 -1.822 291 H ARG 35 HN ARG 35 -11.572 2.724 0.080 292 HA ARG 35 HA ARG 35 -12.476 1.387 -2.109 293 HB2 ARG 35 HB2 ARG 35 -11.082 0.710 0.030 294 HB3 ARG 35 HB1 ARG 35 -12.641 0.095 0.570 295 HG2 ARG 35 HG2 ARG 35 -12.785 -1.178 -1.533 296 HG3 ARG 35 HG1 ARG 35 -11.147 -0.656 -1.902 297 HD2 ARG 35 HD2 ARG 35 -10.304 -1.754 0.077 298 HD3 ARG 35 HD1 ARG 35 -11.940 -2.199 0.560 299 HE ARG 35 HE ARG 35 -11.292 -3.199 -2.030 300 HH11 ARG 35 HH11 ARG 35 -10.811 -3.763 1.381 301 HH12 ARG 35 HH12 ARG 35 -10.634 -5.477 1.212 302 HH21 ARG 35 HH21 ARG 35 -11.034 -5.457 -2.280 303 HH22 ARG 35 HH22 ARG 35 -10.756 -6.443 -0.883 304 H VAL 36 HN VAL 36 -14.172 2.038 0.916 305 HA VAL 36 HA VAL 36 -16.536 0.619 0.353 306 HB VAL 36 HB VAL 36 -16.361 3.137 2.008 307 HG11 VAL 36 HG11 VAL 36 -18.609 2.292 1.641 308 HG12 VAL 36 HG12 VAL 36 -18.131 2.056 3.322 309 HG13 VAL 36 HG13 VAL 36 -18.117 0.694 2.201 310 HG21 VAL 36 HG21 VAL 36 -15.698 1.769 3.895 311 HG22 VAL 36 HG22 VAL 36 -14.518 1.605 2.589 312 HG23 VAL 36 HG23 VAL 36 -15.700 0.327 2.879 313 H LEU 37 HN LEU 37 -15.478 3.885 -0.360 314 HA LEU 37 HA LEU 37 -17.935 4.690 -1.598 315 HB2 LEU 37 HB2 LEU 37 -15.250 5.848 -1.195 316 HB3 LEU 37 HB1 LEU 37 -16.130 6.425 -2.601 317 HG LEU 37 HG LEU 37 -16.352 7.746 -0.409 318 HD11 LEU 37 HD11 LEU 37 -17.730 8.151 -2.350 319 HD12 LEU 37 HD12 LEU 37 -18.706 8.246 -0.879 320 HD13 LEU 37 HD13 LEU 37 -18.792 6.807 -1.904 321 HD21 LEU 37 HD21 LEU 37 -18.279 5.513 0.202 322 HD22 LEU 37 HD22 LEU 37 -18.009 6.970 1.161 323 HD23 LEU 37 HD23 LEU 37 -16.734 5.758 1.011 324 H ARG 38 HN ARG 38 -15.031 3.113 -2.627 325 HA ARG 38 HA ARG 38 -15.317 3.409 -5.413 326 HB2 ARG 38 HB2 ARG 38 -14.145 1.125 -3.810 327 HB3 ARG 38 HB1 ARG 38 -14.049 1.238 -5.561 328 HG2 ARG 38 HG2 ARG 38 -12.916 3.264 -3.643 329 HG3 ARG 38 HG1 ARG 38 -11.993 1.974 -4.415 330 HD2 ARG 38 HD2 ARG 38 -12.484 2.899 -6.604 331 HD3 ARG 38 HD1 ARG 38 -13.499 4.139 -5.873 332 HE ARG 38 HE ARG 38 -10.959 4.343 -4.736 333 HH11 ARG 38 HH11 ARG 38 -12.443 4.723 -7.889 334 HH12 ARG 38 HH12 ARG 38 -11.348 5.965 -8.397 335 HH21 ARG 38 HH21 ARG 38 -9.509 5.994 -5.421 336 HH22 ARG 38 HH22 ARG 38 -9.685 6.682 -7.003 337 H GLN 39 HN GLN 39 -16.670 1.116 -3.115 338 HA GLN 39 HA GLN 39 -18.117 -0.477 -4.887 339 HB2 GLN 39 HB2 GLN 39 -18.927 0.340 -2.097 340 HB3 GLN 39 HB1 GLN 39 -19.442 -1.100 -2.969 341 HG2 GLN 39 HG2 GLN 39 -16.645 -0.476 -2.063 342 HG3 GLN 39 HG1 GLN 39 -17.748 -1.633 -1.332 343 HE21 GLN 39 HE21 GLN 39 -18.206 -3.568 -2.434 344 HE22 GLN 39 HE22 GLN 39 -17.206 -4.138 -3.724 345 H ARG 40 HN ARG 40 -18.996 2.577 -3.298 346 HA ARG 40 HA ARG 40 -21.561 2.847 -4.396 347 HB2 ARG 40 HB2 ARG 40 -19.518 4.779 -3.380 348 HB3 ARG 40 HB1 ARG 40 -20.887 5.400 -4.277 349 HG2 ARG 40 HG2 ARG 40 -21.574 5.560 -2.071 350 HG3 ARG 40 HG1 ARG 40 -22.321 4.059 -2.616 351 HD2 ARG 40 HD2 ARG 40 -20.322 2.862 -1.660 352 HD3 ARG 40 HD1 ARG 40 -19.855 4.390 -0.930 353 HE ARG 40 HE ARG 40 -22.282 4.213 0.029 354 HH11 ARG 40 HH11 ARG 40 -19.946 1.627 -0.338 355 HH12 ARG 40 HH12 ARG 40 -20.553 0.717 1.009 356 HH21 ARG 40 HH21 ARG 40 -23.069 3.043 1.803 357 HH22 ARG 40 HH22 ARG 40 -22.335 1.532 2.239 358 H LEU 41 HN LEU 41 -18.371 3.703 -5.635 359 HA LEU 41 HA LEU 41 -19.312 4.918 -8.027 360 HB2 LEU 41 HB2 LEU 41 -16.633 3.598 -7.711 361 HB3 LEU 41 HB1 LEU 41 -17.067 4.913 -8.780 362 HG LEU 41 HG LEU 41 -16.744 5.041 -5.786 363 HD11 LEU 41 HD11 LEU 41 -14.887 6.475 -6.249 364 HD12 LEU 41 HD12 LEU 41 -15.233 6.445 -7.977 365 HD13 LEU 41 HD13 LEU 41 -14.682 4.981 -7.164 366 HD21 LEU 41 HD21 LEU 41 -18.584 6.471 -6.414 367 HD22 LEU 41 HD22 LEU 41 -17.621 7.188 -7.707 368 HD23 LEU 41 HD23 LEU 41 -17.165 7.442 -6.021 369 H VAL 42 HN VAL 42 -18.682 1.639 -7.059 370 HA VAL 42 HA VAL 42 -18.668 0.395 -9.583 371 HB VAL 42 HB VAL 42 -19.643 -0.595 -6.894 372 HG11 VAL 42 HG11 VAL 42 -19.504 -2.868 -7.851 373 HG12 VAL 42 HG12 VAL 42 -19.267 -2.149 -9.446 374 HG13 VAL 42 HG13 VAL 42 -20.778 -1.883 -8.573 375 HG21 VAL 42 HG21 VAL 42 -17.091 -1.088 -8.419 376 HG22 VAL 42 HG22 VAL 42 -17.542 -1.880 -6.908 377 HG23 VAL 42 HG23 VAL 42 -17.273 -0.137 -6.943 378 H GLU 43 HN GLU 43 -21.288 1.226 -7.373 379 HA GLU 43 HA GLU 43 -23.400 0.250 -8.973 380 HB2 GLU 43 HB2 GLU 43 -23.474 2.463 -6.917 381 HB3 GLU 43 HB1 GLU 43 -24.842 1.513 -7.481 382 HG2 GLU 43 HG2 GLU 43 -23.883 -0.487 -6.499 383 HG3 GLU 43 HG1 GLU 43 -22.473 0.430 -5.973 384 H ARG 44 HN ARG 44 -21.779 3.349 -8.737 385 HA ARG 44 HA ARG 44 -23.484 4.741 -10.545 386 HB2 ARG 44 HB2 ARG 44 -20.638 5.309 -9.685 387 HB3 ARG 44 HB1 ARG 44 -21.660 6.421 -10.585 388 HG2 ARG 44 HG2 ARG 44 -23.222 6.513 -8.714 389 HG3 ARG 44 HG1 ARG 44 -22.208 5.386 -7.811 390 HD2 ARG 44 HD2 ARG 44 -20.366 6.993 -7.879 391 HD3 ARG 44 HD1 ARG 44 -21.378 8.117 -8.782 392 HE ARG 44 HE ARG 44 -22.554 7.320 -6.296 393 HH11 ARG 44 HH11 ARG 44 -20.232 9.508 -7.750 394 HH12 ARG 44 HH12 ARG 44 -20.395 10.703 -6.506 395 HH21 ARG 44 HH21 ARG 44 -22.767 8.880 -4.662 396 HH22 ARG 44 HH22 ARG 44 -21.850 10.352 -4.743 397 H GLY 45 HN GLY 45 -20.599 2.810 -10.859 398 HA2 GLY 45 HA2 GLY 45 -20.091 1.640 -12.866 399 HA3 GLY 45 HA1 GLY 45 -20.853 2.931 -13.785 400 H ASP 46 HN ASP 46 -19.197 4.493 -11.515 401 HA ASP 46 HA ASP 46 -17.193 5.396 -13.305 402 HB2 ASP 46 HB2 ASP 46 -17.776 5.913 -10.399 403 HB3 ASP 46 HB1 ASP 46 -16.368 6.597 -11.191 404 H ALA 47 HN ALA 47 -17.259 3.076 -10.681 405 HA ALA 47 HA ALA 47 -14.364 2.680 -10.905 406 HB1 ALA 47 HB1 ALA 47 -16.377 1.537 -8.974 407 HB2 ALA 47 HB2 ALA 47 -15.162 2.774 -8.646 408 HB3 ALA 47 HB3 ALA 47 -14.665 1.119 -8.992 409 H LYS 48 HN LYS 48 -16.901 1.785 -12.596 410 HA LYS 48 HA LYS 48 -16.105 -1.004 -12.980 411 HB2 LYS 48 HB2 LYS 48 -18.507 -0.573 -12.803 412 HB3 LYS 48 HB1 LYS 48 -18.416 0.589 -14.116 413 HG2 LYS 48 HG2 LYS 48 -19.339 -1.438 -14.964 414 HG3 LYS 48 HG1 LYS 48 -17.715 -1.253 -15.626 415 HD2 LYS 48 HD2 LYS 48 -18.031 -3.540 -14.970 416 HD3 LYS 48 HD1 LYS 48 -16.882 -2.790 -13.865 417 HE2 LYS 48 HE2 LYS 48 -18.542 -2.586 -12.169 418 HE3 LYS 48 HE1 LYS 48 -19.818 -3.075 -13.282 419 HZ1 LYS 48 HZ1 LYS 48 -17.572 -4.790 -12.375 420 HZ2 LYS 48 HZ2 LYS 48 -18.804 -5.256 -13.431 421 HZ3 LYS 48 HZ3 LYS 48 -19.168 -4.886 -11.823 422 H GLY 49 HN GLY 49 -16.241 2.121 -14.549 423 HA2 GLY 49 HA2 GLY 49 -14.894 2.965 -16.220 424 HA3 GLY 49 HA1 GLY 49 -14.085 1.406 -16.311 425 H THR 50 HN THR 50 -14.907 -0.195 -17.639 426 HA THR 50 HA THR 50 -17.282 0.326 -19.207 427 HB THR 50 HB THR 50 -14.608 -0.053 -20.581 428 HG1 THR 50 HG1 THR 50 -16.111 2.190 -19.898 429 HG21 THR 50 HG21 THR 50 -17.366 0.408 -21.731 430 HG22 THR 50 HG22 THR 50 -16.478 -1.115 -21.773 431 HG23 THR 50 HG23 THR 50 -15.867 0.288 -22.652 432 H GLU 51 HN GLU 51 -18.295 -1.510 -18.692 433 HA GLU 51 HA GLU 51 -16.951 -4.032 -19.354 434 HB2 GLU 51 HB2 GLU 51 -17.096 -3.525 -16.831 435 HB3 GLU 51 HB1 GLU 51 -18.820 -3.794 -17.014 436 HG2 GLU 51 HG2 GLU 51 -16.696 -5.807 -17.684 437 HG3 GLU 51 HG1 GLU 51 -17.603 -5.753 -16.178 438 H LEU 52 HN LEU 52 -17.999 -4.812 -20.975 439 HA LEU 52 HA LEU 52 -20.816 -5.302 -20.862 440 HB2 LEU 52 HB2 LEU 52 -20.999 -4.226 -23.267 441 HB3 LEU 52 HB1 LEU 52 -21.276 -3.281 -21.819 442 HG LEU 52 HG LEU 52 -18.834 -2.558 -22.001 443 HD11 LEU 52 HD11 LEU 52 -17.816 -2.664 -24.199 444 HD12 LEU 52 HD12 LEU 52 -19.172 -3.617 -24.800 445 HD13 LEU 52 HD13 LEU 52 -18.102 -4.286 -23.569 446 HD21 LEU 52 HD21 LEU 52 -20.787 -1.747 -24.144 447 HD22 LEU 52 HD22 LEU 52 -19.369 -0.826 -23.645 448 HD23 LEU 52 HD23 LEU 52 -20.692 -1.088 -22.510 449 H ASN 53 HN ASN 53 -18.755 -7.025 -20.776 450 HA ASN 53 HA ASN 53 -17.861 -7.921 -23.312 451 HB2 ASN 53 HB2 ASN 53 -16.754 -9.639 -22.196 452 HB3 ASN 53 HB1 ASN 53 -16.835 -8.382 -20.973 453 HD21 ASN 53 HD21 ASN 53 -18.266 -8.634 -19.223 454 HD22 ASN 53 HD22 ASN 53 -18.893 -10.197 -18.798 455 H GLY 84 HN GLY 84 20.182 -5.517 -21.219 456 HA2 GLY 84 HA2 GLY 84 20.868 -7.027 -23.474 457 HA3 GLY 84 HA1 GLY 84 21.415 -5.392 -23.143 458 HA PRO 85 HA PRO 85 25.378 -7.187 -22.046 459 HB2 PRO 85 HB2 PRO 85 26.332 -5.687 -20.083 460 HB3 PRO 85 HB1 PRO 85 25.959 -4.956 -21.651 461 HG2 PRO 85 HG2 PRO 85 24.354 -4.947 -19.125 462 HG3 PRO 85 HG1 PRO 85 24.687 -3.606 -20.238 463 HD2 PRO 85 HD2 PRO 85 22.369 -5.111 -20.264 464 HD3 PRO 85 HD1 PRO 85 22.994 -4.209 -21.659 465 H LEU 86 HN LEU 86 26.742 -7.732 -19.890 466 HA LEU 86 HA LEU 86 25.612 -9.938 -18.692 467 HB2 LEU 86 HB2 LEU 86 27.397 -9.378 -16.806 468 HB3 LEU 86 HB1 LEU 86 27.834 -10.057 -18.351 469 HG LEU 86 HG LEU 86 29.302 -8.203 -17.408 470 HD11 LEU 86 HD11 LEU 86 28.225 -7.896 -20.200 471 HD12 LEU 86 HD12 LEU 86 29.523 -8.966 -19.683 472 HD13 LEU 86 HD13 LEU 86 29.733 -7.218 -19.597 473 HD21 LEU 86 HD21 LEU 86 26.985 -6.492 -18.297 474 HD22 LEU 86 HD22 LEU 86 28.610 -5.895 -17.953 475 HD23 LEU 86 HD23 LEU 86 27.653 -6.632 -16.669 476 H GLY 87 HN GLY 87 24.318 -10.332 -17.030 477 HA2 GLY 87 HA2 GLY 87 22.955 -8.121 -15.768 478 HA3 GLY 87 HA1 GLY 87 22.611 -9.832 -15.543 479 H SER 88 HN SER 88 25.709 -9.910 -15.101 480 HA SER 88 HA SER 88 25.587 -9.740 -12.227 481 HB2 SER 88 HB2 SER 88 26.780 -11.572 -13.415 482 HB3 SER 88 HB1 SER 88 27.928 -10.392 -14.039 483 HG SER 88 HG SER 88 28.009 -9.933 -11.545 484 H ARG 89 HN ARG 89 25.477 -7.330 -14.069 485 HA ARG 89 HA ARG 89 27.878 -5.838 -13.607 486 HB2 ARG 89 HB2 ARG 89 26.478 -5.474 -15.589 487 HB3 ARG 89 HB1 ARG 89 25.145 -4.973 -14.569 488 HG2 ARG 89 HG2 ARG 89 26.170 -3.045 -15.571 489 HG3 ARG 89 HG1 ARG 89 26.464 -3.028 -13.834 490 HD2 ARG 89 HD2 ARG 89 28.478 -4.174 -15.740 491 HD3 ARG 89 HD1 ARG 89 28.406 -2.441 -15.425 492 HE ARG 89 HE ARG 89 28.488 -3.685 -12.951 493 HH11 ARG 89 HH11 ARG 89 30.535 -3.474 -15.785 494 HH12 ARG 89 HH12 ARG 89 32.012 -3.626 -14.887 495 HH21 ARG 89 HH21 ARG 89 30.443 -3.879 -11.765 496 HH22 ARG 89 HH22 ARG 89 31.960 -3.856 -12.610 497 H ARG 90 HN ARG 90 25.170 -6.554 -11.694 498 HA ARG 90 HA ARG 90 24.959 -4.003 -10.417 499 HB2 ARG 90 HB2 ARG 90 23.686 -6.663 -9.916 500 HB3 ARG 90 HB1 ARG 90 23.529 -5.362 -8.746 501 HG2 ARG 90 HG2 ARG 90 22.632 -3.944 -10.622 502 HG3 ARG 90 HG1 ARG 90 22.557 -5.423 -11.584 503 HD2 ARG 90 HD2 ARG 90 21.090 -6.444 -9.950 504 HD3 ARG 90 HD1 ARG 90 21.222 -5.027 -8.910 505 HE ARG 90 HE ARG 90 20.111 -4.735 -11.611 506 HH11 ARG 90 HH11 ARG 90 19.691 -4.639 -8.124 507 HH12 ARG 90 HH12 ARG 90 18.129 -3.889 -8.214 508 HH21 ARG 90 HH21 ARG 90 18.059 -3.742 -11.729 509 HH22 ARG 90 HH22 ARG 90 17.199 -3.372 -10.266 510 H PHE 91 HN PHE 91 25.124 -6.891 -8.470 511 HA PHE 91 HA PHE 91 26.172 -7.351 -6.532 512 HB2 PHE 91 HB2 PHE 91 28.383 -5.935 -7.985 513 HB3 PHE 91 HB1 PHE 91 28.602 -6.506 -6.335 514 HD1 PHE 91 HD1 PHE 91 27.856 -9.010 -5.953 515 HD2 PHE 91 HD2 PHE 91 28.980 -7.335 -9.694 516 HE1 PHE 91 HE1 PHE 91 28.401 -11.256 -6.788 517 HE2 PHE 91 HE2 PHE 91 29.529 -9.577 -10.539 518 HZ PHE 91 HZ PHE 91 29.240 -11.544 -9.086 519 H VAL 92 HN VAL 92 27.907 -5.907 -4.921 520 HA VAL 92 HA VAL 92 26.096 -4.552 -3.346 521 HB VAL 92 HB VAL 92 29.089 -4.148 -3.349 522 HG11 VAL 92 HG11 VAL 92 28.794 -3.602 -0.979 523 HG12 VAL 92 HG12 VAL 92 27.047 -3.757 -1.163 524 HG13 VAL 92 HG13 VAL 92 27.913 -2.481 -2.018 525 HG21 VAL 92 HG21 VAL 92 27.406 -6.189 -1.901 526 HG22 VAL 92 HG22 VAL 92 29.135 -5.935 -1.672 527 HG23 VAL 92 HG23 VAL 92 28.527 -6.509 -3.224 528 H VAL 93 HN VAL 93 28.451 -3.160 -5.625 529 HA VAL 93 HA VAL 93 28.101 -0.488 -4.919 530 HB VAL 93 HB VAL 93 28.866 0.044 -7.275 531 HG11 VAL 93 HG11 VAL 93 30.505 -1.877 -5.626 532 HG12 VAL 93 HG12 VAL 93 30.413 -0.130 -5.412 533 HG13 VAL 93 HG13 VAL 93 31.135 -0.803 -6.873 534 HG21 VAL 93 HG21 VAL 93 29.053 -2.964 -7.443 535 HG22 VAL 93 HG22 VAL 93 29.744 -1.827 -8.599 536 HG23 VAL 93 HG23 VAL 93 27.995 -1.930 -8.403 537 H ASP 94 HN ASP 94 26.334 -2.368 -7.386 538 HA ASP 94 HA ASP 94 24.752 -0.092 -8.119 539 HB2 ASP 94 HB2 ASP 94 25.078 -2.844 -9.036 540 HB3 ASP 94 HB1 ASP 94 23.425 -2.252 -9.132 541 H ASP 95 HN ASP 95 24.117 -3.144 -6.371 542 HA ASP 95 HA ASP 95 21.403 -2.495 -5.860 543 HB2 ASP 95 HB2 ASP 95 23.258 -4.476 -4.556 544 HB3 ASP 95 HB1 ASP 95 21.599 -4.235 -4.002 545 H ARG 96 HN ARG 96 24.154 -1.084 -4.669 546 HA ARG 96 HA ARG 96 23.046 -0.398 -2.087 547 HB2 ARG 96 HB2 ARG 96 25.498 -0.541 -2.413 548 HB3 ARG 96 HB1 ARG 96 25.409 0.771 -3.580 549 HG2 ARG 96 HG2 ARG 96 24.576 2.258 -1.808 550 HG3 ARG 96 HG1 ARG 96 24.754 0.940 -0.649 551 HD2 ARG 96 HD2 ARG 96 27.136 0.862 -1.043 552 HD3 ARG 96 HD1 ARG 96 26.997 2.083 -2.307 553 HE ARG 96 HE ARG 96 25.993 2.969 0.230 554 HH11 ARG 96 HH11 ARG 96 28.889 2.582 -1.702 555 HH12 ARG 96 HH12 ARG 96 29.747 3.851 -0.892 556 HH21 ARG 96 HH21 ARG 96 27.101 4.651 1.273 557 HH22 ARG 96 HH22 ARG 96 28.731 5.036 0.799 558 H ARG 97 HN ARG 97 24.097 1.571 -4.853 559 HA ARG 97 HA ARG 97 22.622 3.812 -4.124 560 HB2 ARG 97 HB2 ARG 97 23.318 4.609 -6.329 561 HB3 ARG 97 HB1 ARG 97 24.625 3.884 -5.444 562 HG2 ARG 97 HG2 ARG 97 25.079 2.834 -7.346 563 HG3 ARG 97 HG1 ARG 97 23.743 1.776 -6.895 564 HD2 ARG 97 HD2 ARG 97 22.208 3.108 -8.217 565 HD3 ARG 97 HD1 ARG 97 23.499 4.242 -8.613 566 HE ARG 97 HE ARG 97 24.181 1.588 -9.384 567 HH11 ARG 97 HH11 ARG 97 22.222 4.330 -10.339 568 HH12 ARG 97 HH12 ARG 97 22.279 3.934 -12.026 569 HH21 ARG 97 HH21 ARG 97 24.241 1.056 -11.571 570 HH22 ARG 97 HH22 ARG 97 23.413 2.058 -12.731 571 H GLU 98 HN GLU 98 21.975 1.201 -6.386 572 HA GLU 98 HA GLU 98 19.640 2.320 -7.508 573 HB2 GLU 98 HB2 GLU 98 20.827 -0.418 -7.450 574 HB3 GLU 98 HB1 GLU 98 19.167 -0.213 -8.019 575 HG2 GLU 98 HG2 GLU 98 21.608 1.165 -9.102 576 HG3 GLU 98 HG1 GLU 98 20.728 -0.157 -9.871 577 H LEU 99 HN LEU 99 20.085 -0.017 -4.862 578 HA LEU 99 HA LEU 99 17.349 -0.331 -4.289 579 HB2 LEU 99 HB2 LEU 99 19.024 -1.883 -3.499 580 HB3 LEU 99 HB1 LEU 99 19.809 -0.628 -2.571 581 HG LEU 99 HG LEU 99 18.366 -2.414 -1.377 582 HD11 LEU 99 HD11 LEU 99 17.760 -0.773 0.346 583 HD12 LEU 99 HD12 LEU 99 18.139 0.527 -0.789 584 HD13 LEU 99 HD13 LEU 99 19.408 -0.580 -0.255 585 HD21 LEU 99 HD21 LEU 99 16.033 -1.767 -1.050 586 HD22 LEU 99 HD22 LEU 99 16.362 -2.176 -2.733 587 HD23 LEU 99 HD23 LEU 99 16.218 -0.487 -2.248 588 H GLN 100 HN GLN 100 19.806 1.806 -2.790 589 HA GLN 100 HA GLN 100 18.283 3.265 -1.066 590 HB2 GLN 100 HB2 GLN 100 20.444 4.189 -2.960 591 HB3 GLN 100 HB1 GLN 100 19.776 5.214 -1.704 592 HG2 GLN 100 HG2 GLN 100 21.022 2.549 -1.151 593 HG3 GLN 100 HG1 GLN 100 21.931 4.053 -1.173 594 HE21 GLN 100 HE21 GLN 100 19.741 5.608 -0.037 595 HE22 GLN 100 HE22 GLN 100 19.669 5.179 1.634 596 H TYR 101 HN TYR 101 18.497 3.714 -4.581 597 HA TYR 101 HA TYR 101 17.016 6.098 -4.693 598 HB2 TYR 101 HB2 TYR 101 18.414 5.442 -6.555 599 HB3 TYR 101 HB1 TYR 101 17.453 3.989 -6.813 600 HD1 TYR 101 HD1 TYR 101 15.615 4.033 -8.261 601 HD2 TYR 101 HD2 TYR 101 17.233 7.707 -6.857 602 HE1 TYR 101 HE1 TYR 101 14.150 5.261 -9.805 603 HE2 TYR 101 HE2 TYR 101 15.771 8.947 -8.399 604 HH TYR 101 HH TYR 101 13.169 7.458 -10.056 605 H ARG 102 HN ARG 102 15.976 2.697 -4.981 606 HA ARG 102 HA ARG 102 13.334 3.334 -5.782 607 HB2 ARG 102 HB2 ARG 102 12.765 1.069 -5.461 608 HB3 ARG 102 HB1 ARG 102 14.446 1.050 -5.969 609 HG2 ARG 102 HG2 ARG 102 15.205 0.539 -3.807 610 HG3 ARG 102 HG1 ARG 102 13.654 0.953 -3.077 611 HD2 ARG 102 HD2 ARG 102 13.927 -1.450 -3.151 612 HD3 ARG 102 HD1 ARG 102 12.620 -0.952 -4.224 613 HE ARG 102 HE ARG 102 15.046 -1.128 -5.662 614 HH11 ARG 102 HH11 ARG 102 12.599 -3.133 -4.166 615 HH12 ARG 102 HH12 ARG 102 12.855 -4.467 -5.243 616 HH21 ARG 102 HH21 ARG 102 15.404 -2.887 -7.066 617 HH22 ARG 102 HH22 ARG 102 14.462 -4.332 -6.890 618 H VAL 103 HN VAL 103 14.886 3.227 -2.681 619 HA VAL 103 HA VAL 103 12.513 2.981 -1.129 620 HB VAL 103 HB VAL 103 15.068 4.245 -0.154 621 HG11 VAL 103 HG11 VAL 103 13.214 4.294 1.391 622 HG12 VAL 103 HG12 VAL 103 14.428 3.134 1.945 623 HG13 VAL 103 HG13 VAL 103 12.950 2.566 1.168 624 HG21 VAL 103 HG21 VAL 103 14.503 1.294 -0.415 625 HG22 VAL 103 HG22 VAL 103 15.895 2.016 0.391 626 HG23 VAL 103 HG23 VAL 103 15.688 2.207 -1.349 627 H GLU 104 HN GLU 104 14.480 5.759 -2.171 628 HA GLU 104 HA GLU 104 12.795 7.650 -0.902 629 HB2 GLU 104 HB2 GLU 104 13.946 9.291 -2.535 630 HB3 GLU 104 HB1 GLU 104 14.885 8.540 -1.256 631 HG2 GLU 104 HG2 GLU 104 15.871 7.020 -2.759 632 HG3 GLU 104 HG1 GLU 104 14.776 7.483 -4.054 633 H VAL 105 HN VAL 105 12.799 6.315 -4.215 634 HA VAL 105 HA VAL 105 10.722 8.058 -5.067 635 HB VAL 105 HB VAL 105 11.719 7.091 -6.904 636 HG11 VAL 105 HG11 VAL 105 12.124 4.704 -7.223 637 HG12 VAL 105 HG12 VAL 105 11.463 4.390 -5.618 638 HG13 VAL 105 HG13 VAL 105 12.946 5.328 -5.794 639 HG21 VAL 105 HG21 VAL 105 9.294 5.392 -6.471 640 HG22 VAL 105 HG22 VAL 105 10.105 5.657 -8.013 641 HG23 VAL 105 HG23 VAL 105 9.328 7.005 -7.182 642 H GLN 106 HN GLN 106 10.716 4.927 -3.415 643 HA GLN 106 HA GLN 106 7.936 4.552 -3.445 644 HB2 GLN 106 HB2 GLN 106 10.020 3.752 -1.408 645 HB3 GLN 106 HB1 GLN 106 8.329 3.302 -1.258 646 HG2 GLN 106 HG2 GLN 106 10.192 2.550 -3.489 647 HG3 GLN 106 HG1 GLN 106 9.579 1.490 -2.224 648 HE21 GLN 106 HE21 GLN 106 8.788 3.233 -5.138 649 HE22 GLN 106 HE22 GLN 106 7.324 2.386 -5.479 650 H ASN 107 HN ASN 107 10.003 6.431 -1.273 651 HA ASN 107 HA ASN 107 8.040 7.389 0.481 652 HB2 ASN 107 HB2 ASN 107 10.408 7.721 0.904 653 HB3 ASN 107 HB1 ASN 107 10.563 8.735 -0.525 654 HD21 ASN 107 HD21 ASN 107 7.921 8.806 1.821 655 HD22 ASN 107 HD22 ASN 107 8.252 10.398 2.403 656 H ARG 108 HN ARG 108 9.157 8.672 -2.643 657 HA ARG 108 HA ARG 108 7.504 10.966 -2.693 658 HB2 ARG 108 HB2 ARG 108 8.566 9.406 -5.049 659 HB3 ARG 108 HB1 ARG 108 8.030 11.070 -5.057 660 HG2 ARG 108 HG2 ARG 108 9.907 11.653 -3.570 661 HG3 ARG 108 HG1 ARG 108 10.463 9.979 -3.668 662 HD2 ARG 108 HD2 ARG 108 10.296 10.410 -6.249 663 HD3 ARG 108 HD1 ARG 108 10.425 12.098 -5.766 664 HE ARG 108 HE ARG 108 12.499 10.867 -4.483 665 HH11 ARG 108 HH11 ARG 108 11.420 11.157 -7.792 666 HH12 ARG 108 HH12 ARG 108 13.000 10.974 -8.476 667 HH21 ARG 108 HH21 ARG 108 14.618 10.576 -5.380 668 HH22 ARG 108 HH22 ARG 108 14.815 10.652 -7.104 669 H VAL 109 HN VAL 109 7.210 7.853 -4.335 670 HA VAL 109 HA VAL 109 4.849 8.278 -5.711 671 HB VAL 109 HB VAL 109 5.973 5.705 -4.608 672 HG11 VAL 109 HG11 VAL 109 4.569 4.525 -6.189 673 HG12 VAL 109 HG12 VAL 109 3.869 6.046 -6.744 674 HG13 VAL 109 HG13 VAL 109 3.562 5.483 -5.097 675 HG21 VAL 109 HG21 VAL 109 7.493 6.771 -6.123 676 HG22 VAL 109 HG22 VAL 109 6.193 7.058 -7.290 677 HG23 VAL 109 HG23 VAL 109 6.734 5.411 -6.960 678 H TYR 110 HN TYR 110 5.283 6.802 -2.514 679 HA TYR 110 HA TYR 110 2.548 6.267 -2.111 680 HB2 TYR 110 HB2 TYR 110 4.792 6.644 -0.134 681 HB3 TYR 110 HB1 TYR 110 3.174 6.134 0.324 682 HD1 TYR 110 HD1 TYR 110 5.769 4.624 0.781 683 HD2 TYR 110 HD2 TYR 110 2.880 4.421 -2.334 684 HE1 TYR 110 HE1 TYR 110 6.403 2.288 0.349 685 HE2 TYR 110 HE2 TYR 110 3.503 2.088 -2.771 686 HH TYR 110 HH TYR 110 5.542 0.638 -2.423 687 H LYS 111 HN LYS 111 4.410 9.171 -1.749 688 HA LYS 111 HA LYS 111 2.501 10.578 -0.174 689 HB2 LYS 111 HB2 LYS 111 4.839 11.312 -0.322 690 HB3 LYS 111 HB1 LYS 111 4.637 11.631 -2.039 691 HG2 LYS 111 HG2 LYS 111 2.971 13.352 -1.512 692 HG3 LYS 111 HG1 LYS 111 3.217 13.046 0.207 693 HD2 LYS 111 HD2 LYS 111 5.551 13.720 0.007 694 HD3 LYS 111 HD1 LYS 111 5.338 13.981 -1.726 695 HE2 LYS 111 HE2 LYS 111 5.236 16.095 -0.546 696 HE3 LYS 111 HE1 LYS 111 3.664 15.711 -1.246 697 HZ1 LYS 111 HZ1 LYS 111 2.973 14.895 0.956 698 HZ2 LYS 111 HZ2 LYS 111 3.382 16.533 0.974 699 HZ3 LYS 111 HZ3 LYS 111 4.458 15.388 1.597 700 H LYS 112 HN LYS 112 3.011 10.081 -3.620 701 HA LYS 112 HA LYS 112 1.172 12.016 -4.549 702 HB2 LYS 112 HB2 LYS 112 1.878 11.331 -6.576 703 HB3 LYS 112 HB1 LYS 112 3.057 10.394 -5.667 704 HG2 LYS 112 HG2 LYS 112 1.233 8.591 -5.617 705 HG3 LYS 112 HG1 LYS 112 0.533 9.507 -6.936 706 HD2 LYS 112 HD2 LYS 112 3.277 8.290 -6.847 707 HD3 LYS 112 HD1 LYS 112 1.917 7.727 -7.819 708 HE2 LYS 112 HE2 LYS 112 1.959 10.011 -8.925 709 HE3 LYS 112 HE1 LYS 112 3.508 10.260 -8.119 710 HZ1 LYS 112 HZ1 LYS 112 4.356 8.289 -9.238 711 HZ2 LYS 112 HZ2 LYS 112 3.823 9.437 -10.353 712 HZ3 LYS 112 HZ3 LYS 112 2.877 8.076 -10.028 713 H GLU 113 HN GLU 113 0.951 8.685 -3.566 714 HA GLU 113 HA GLU 113 -1.657 8.077 -4.379 715 HB2 GLU 113 HB2 GLU 113 -0.150 7.135 -1.930 716 HB3 GLU 113 HB1 GLU 113 -1.588 6.371 -2.591 717 HG2 GLU 113 HG2 GLU 113 0.783 6.740 -4.332 718 HG3 GLU 113 HG1 GLU 113 0.802 5.446 -3.140 719 H ILE 114 HN ILE 114 -0.454 9.358 -1.290 720 HA ILE 114 HA ILE 114 -2.922 9.599 -0.013 721 HB ILE 114 HB ILE 114 -0.384 11.172 0.392 722 HG12 ILE 114 HG12 ILE 114 -1.481 8.725 1.781 723 HG13 ILE 114 HG11 ILE 114 -0.186 8.722 0.592 724 HG21 ILE 114 HG21 ILE 114 -1.263 11.575 2.679 725 HG22 ILE 114 HG22 ILE 114 -2.810 10.901 2.165 726 HG23 ILE 114 HG23 ILE 114 -2.199 12.380 1.413 727 HD11 ILE 114 HD11 ILE 114 0.655 8.548 2.860 728 HD12 ILE 114 HD12 ILE 114 -0.097 10.093 3.261 729 HD13 ILE 114 HD13 ILE 114 1.203 10.026 2.070 730 H GLN 115 HN GLN 115 -1.281 11.788 -2.230 731 HA GLN 115 HA GLN 115 -2.948 14.037 -1.734 732 HB2 GLN 115 HB2 GLN 115 -1.445 13.390 -4.268 733 HB3 GLN 115 HB1 GLN 115 -1.978 14.976 -3.723 734 HG2 GLN 115 HG2 GLN 115 -0.489 14.703 -1.739 735 HG3 GLN 115 HG1 GLN 115 0.128 13.236 -2.498 736 HE21 GLN 115 HE21 GLN 115 0.010 16.703 -2.659 737 HE22 GLN 115 HE22 GLN 115 1.292 16.894 -3.803 738 H ALA 116 HN ALA 116 -2.976 11.445 -4.130 739 HA ALA 116 HA ALA 116 -5.342 12.231 -5.470 740 HB1 ALA 116 HB1 ALA 116 -3.767 10.594 -6.389 741 HB2 ALA 116 HB2 ALA 116 -5.403 9.942 -6.310 742 HB3 ALA 116 HB3 ALA 116 -4.202 9.462 -5.110 743 H LEU 117 HN LEU 117 -4.736 9.989 -2.818 744 HA LEU 117 HA LEU 117 -7.323 9.162 -2.238 745 HB2 LEU 117 HB2 LEU 117 -4.806 9.481 -0.686 746 HB3 LEU 117 HB1 LEU 117 -6.282 9.226 0.217 747 HG LEU 117 HG LEU 117 -6.456 7.036 -0.410 748 HD11 LEU 117 HD11 LEU 117 -6.658 7.415 -2.803 749 HD12 LEU 117 HD12 LEU 117 -5.566 6.072 -2.470 750 HD13 LEU 117 HD13 LEU 117 -4.914 7.647 -2.927 751 HD21 LEU 117 HD21 LEU 117 -3.513 7.446 -0.899 752 HD22 LEU 117 HD22 LEU 117 -4.315 5.992 -0.302 753 HD23 LEU 117 HD23 LEU 117 -4.263 7.442 0.698 754 H ASP 118 HN ASP 118 -5.628 12.098 -1.358 755 HA ASP 118 HA ASP 118 -7.431 13.036 0.590 756 HB2 ASP 118 HB2 ASP 118 -5.239 13.977 0.478 757 HB3 ASP 118 HB1 ASP 118 -5.475 14.483 -1.193 758 H ALA 119 HN ALA 119 -7.359 13.401 -2.909 759 HA ALA 119 HA ALA 119 -9.488 15.259 -3.095 760 HB1 ALA 119 HB1 ALA 119 -7.937 14.792 -4.954 761 HB2 ALA 119 HB2 ALA 119 -9.622 14.601 -5.430 762 HB3 ALA 119 HB3 ALA 119 -8.633 13.178 -5.110 763 H GLU 120 HN GLU 120 -9.307 11.743 -3.166 764 HA GLU 120 HA GLU 120 -12.060 11.233 -3.362 765 HB2 GLU 120 HB2 GLU 120 -9.659 9.705 -2.523 766 HB3 GLU 120 HB1 GLU 120 -11.229 9.072 -2.071 767 HG2 GLU 120 HG2 GLU 120 -10.426 8.070 -4.106 768 HG3 GLU 120 HG1 GLU 120 -11.900 8.989 -4.396 769 H ILE 121 HN ILE 121 -10.016 12.040 -0.612 770 HA ILE 121 HA ILE 121 -11.709 11.352 1.470 771 HB ILE 121 HB ILE 121 -9.504 13.235 1.150 772 HG12 ILE 121 HG12 ILE 121 -8.986 12.427 3.448 773 HG13 ILE 121 HG11 ILE 121 -10.514 11.552 3.447 774 HG21 ILE 121 HG21 ILE 121 -9.988 14.578 3.155 775 HG22 ILE 121 HG22 ILE 121 -11.619 13.902 3.194 776 HG23 ILE 121 HG23 ILE 121 -11.109 14.902 1.833 777 HD11 ILE 121 HD11 ILE 121 -8.187 11.079 1.601 778 HD12 ILE 121 HD12 ILE 121 -9.728 10.220 1.548 779 HD13 ILE 121 HD13 ILE 121 -8.681 10.066 2.959 780 H ARG 122 HN ARG 122 -11.889 14.081 -0.732 781 HA ARG 122 HA ARG 122 -13.966 15.457 0.580 782 HB2 ARG 122 HB2 ARG 122 -12.615 16.450 -1.220 783 HB3 ARG 122 HB1 ARG 122 -13.358 15.355 -2.377 784 HG2 ARG 122 HG2 ARG 122 -15.416 16.433 -2.265 785 HG3 ARG 122 HG1 ARG 122 -15.026 17.221 -0.733 786 HD2 ARG 122 HD2 ARG 122 -13.742 17.805 -3.398 787 HD3 ARG 122 HD1 ARG 122 -14.951 18.807 -2.593 788 HE ARG 122 HE ARG 122 -13.062 18.674 -0.721 789 HH11 ARG 122 HH11 ARG 122 -12.822 19.348 -4.146 790 HH12 ARG 122 HH12 ARG 122 -11.399 20.326 -3.979 791 HH21 ARG 122 HH21 ARG 122 -11.200 19.959 -0.496 792 HH22 ARG 122 HH22 ARG 122 -10.479 20.675 -1.901 793 H LYS 123 HN LYS 123 -14.011 12.874 -1.859 794 HA LYS 123 HA LYS 123 -16.798 12.694 -2.185 795 HB2 LYS 123 HB2 LYS 123 -16.372 10.804 -3.385 796 HB3 LYS 123 HB1 LYS 123 -14.712 11.334 -3.255 797 HG2 LYS 123 HG2 LYS 123 -14.622 9.915 -1.122 798 HG3 LYS 123 HG1 LYS 123 -16.103 9.194 -1.720 799 HD2 LYS 123 HD2 LYS 123 -13.383 9.141 -2.961 800 HD3 LYS 123 HD1 LYS 123 -14.371 7.779 -2.431 801 HE2 LYS 123 HE2 LYS 123 -14.833 9.583 -4.768 802 HE3 LYS 123 HE1 LYS 123 -14.465 7.867 -4.794 803 HZ1 LYS 123 HZ1 LYS 123 -16.604 7.351 -4.105 804 HZ2 LYS 123 HZ2 LYS 123 -16.857 8.652 -5.161 805 HZ3 LYS 123 HZ3 LYS 123 -16.894 8.902 -3.497 806 H LEU 124 HN LEU 124 -14.628 11.352 0.217 807 HA LEU 124 HA LEU 124 -16.500 9.751 1.578 808 HB2 LEU 124 HB2 LEU 124 -13.923 11.033 2.464 809 HB3 LEU 124 HB1 LEU 124 -14.825 9.891 3.443 810 HG LEU 124 HG LEU 124 -13.683 9.266 0.714 811 HD11 LEU 124 HD11 LEU 124 -12.023 7.937 1.969 812 HD12 LEU 124 HD12 LEU 124 -12.644 8.614 3.472 813 HD13 LEU 124 HD13 LEU 124 -11.877 9.664 2.285 814 HD21 LEU 124 HD21 LEU 124 -15.629 7.948 1.322 815 HD22 LEU 124 HD22 LEU 124 -14.875 7.514 2.853 816 HD23 LEU 124 HD23 LEU 124 -14.170 6.962 1.334 817 H GLU 125 HN GLU 125 -15.363 13.072 2.080 818 HA GLU 125 HA GLU 125 -16.806 13.534 4.440 819 HB2 GLU 125 HB2 GLU 125 -15.972 15.549 2.351 820 HB3 GLU 125 HB1 GLU 125 -16.460 15.916 4.001 821 HG2 GLU 125 HG2 GLU 125 -14.536 14.491 4.773 822 HG3 GLU 125 HG1 GLU 125 -14.012 14.432 3.096 823 H ARG 126 HN ARG 126 -17.747 13.781 1.063 824 HA ARG 126 HA ARG 126 -20.248 15.015 1.434 825 HB2 ARG 126 HB2 ARG 126 -19.536 12.885 -0.594 826 HB3 ARG 126 HB1 ARG 126 -20.897 13.989 -0.689 827 HG2 ARG 126 HG2 ARG 126 -18.008 14.821 -0.737 828 HG3 ARG 126 HG1 ARG 126 -19.020 14.599 -2.160 829 HD2 ARG 126 HD2 ARG 126 -19.071 16.899 -1.768 830 HD3 ARG 126 HD1 ARG 126 -20.588 16.310 -1.097 831 HE ARG 126 HE ARG 126 -19.638 16.558 1.103 832 HH11 ARG 126 HH11 ARG 126 -17.807 18.016 -1.498 833 HH12 ARG 126 HH12 ARG 126 -16.986 19.132 -0.456 834 HH21 ARG 126 HH21 ARG 126 -18.576 18.033 2.471 835 HH22 ARG 126 HH22 ARG 126 -17.403 19.134 1.794 836 H LEU 127 HN LEU 127 -19.284 11.617 1.440 837 HA LEU 127 HA LEU 127 -21.841 10.585 2.067 838 HB2 LEU 127 HB2 LEU 127 -19.178 9.584 1.628 839 HB3 LEU 127 HB1 LEU 127 -19.890 8.792 3.017 840 HG LEU 127 HG LEU 127 -20.247 7.538 0.924 841 HD11 LEU 127 HD11 LEU 127 -22.663 7.204 1.171 842 HD12 LEU 127 HD12 LEU 127 -22.759 8.670 2.146 843 HD13 LEU 127 HD13 LEU 127 -21.844 7.281 2.731 844 HD21 LEU 127 HD21 LEU 127 -20.355 9.480 -0.587 845 HD22 LEU 127 HD22 LEU 127 -21.927 9.901 0.091 846 HD23 LEU 127 HD23 LEU 127 -21.723 8.390 -0.795 847 H LEU 128 HN LEU 128 -19.073 11.553 4.041 848 HA LEU 128 HA LEU 128 -19.918 10.729 6.548 849 HB2 LEU 128 HB2 LEU 128 -18.522 13.306 5.841 850 HB3 LEU 128 HB1 LEU 128 -18.587 12.588 7.440 851 HG LEU 128 HG LEU 128 -17.191 11.462 5.024 852 HD11 LEU 128 HD11 LEU 128 -16.109 13.383 6.189 853 HD12 LEU 128 HD12 LEU 128 -15.161 11.895 6.207 854 HD13 LEU 128 HD13 LEU 128 -16.050 12.394 7.647 855 HD21 LEU 128 HD21 LEU 128 -16.399 9.693 6.511 856 HD22 LEU 128 HD22 LEU 128 -18.152 9.663 6.330 857 HD23 LEU 128 HD23 LEU 128 -17.428 10.319 7.797 858 H GLU 129 HN GLU 129 -20.439 13.858 4.998 859 HA GLU 129 HA GLU 129 -22.221 14.918 6.889 860 HB2 GLU 129 HB2 GLU 129 -21.852 15.508 3.953 861 HB3 GLU 129 HB1 GLU 129 -22.817 16.501 5.041 862 HG2 GLU 129 HG2 GLU 129 -20.826 16.928 6.388 863 HG3 GLU 129 HG1 GLU 129 -19.869 15.950 5.282 864 H SER 130 HN SER 130 -22.684 12.652 4.341 865 HA SER 130 HA SER 130 -25.554 12.953 4.256 866 HB2 SER 130 HB2 SER 130 -24.207 12.270 2.257 867 HB3 SER 130 HB1 SER 130 -23.858 10.745 3.066 868 HG SER 130 HG SER 130 -26.533 11.432 2.958 869 H GLY 131 HN GLY 131 -23.433 11.550 6.397 870 HA2 GLY 131 HA2 GLY 131 -24.342 10.670 8.433 871 HA3 GLY 131 HA1 GLY 131 -25.639 9.946 7.499 872 H LEU 132 HN LEU 132 -22.304 9.678 6.444 873 HA LEU 132 HA LEU 132 -22.424 6.825 6.613 874 HB2 LEU 132 HB2 LEU 132 -21.226 7.899 4.811 875 HB3 LEU 132 HB1 LEU 132 -20.172 8.711 5.948 876 HG LEU 132 HG LEU 132 -19.319 6.453 6.644 877 HD11 LEU 132 HD11 LEU 132 -21.183 5.097 5.869 878 HD12 LEU 132 HD12 LEU 132 -19.681 4.588 5.098 879 HD13 LEU 132 HD13 LEU 132 -20.846 5.563 4.202 880 HD21 LEU 132 HD21 LEU 132 -18.955 7.163 3.743 881 HD22 LEU 132 HD22 LEU 132 -17.827 6.272 4.766 882 HD23 LEU 132 HD23 LEU 132 -18.160 7.975 5.088 883 H THR 133 HN THR 133 -20.619 9.347 8.346 884 HA THR 133 HA THR 133 -19.582 7.315 10.167 885 HB THR 133 HB THR 133 -17.933 8.877 9.265 886 HG1 THR 133 HG1 THR 133 -18.153 8.185 11.714 887 HG21 THR 133 HG21 THR 133 -17.929 11.240 9.890 888 HG22 THR 133 HG22 THR 133 -19.486 11.036 10.693 889 HG23 THR 133 HG23 THR 133 -19.363 10.839 8.945
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