NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
640379 | 6e98 | 30504 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 HT1 GLY 1 -21.654 2.833 -5.953 2 H2 GLY 1 HT2 GLY 1 -21.861 1.422 -5.046 3 H3 GLY 1 HT3 GLY 1 -21.856 1.347 -6.734 4 HA2 GLY 1 HA1 GLY 1 -19.763 0.552 -5.868 5 HA3 GLY 1 HA2 GLY 1 -19.549 2.031 -6.796 6 H SER 2 HN SER 2 -18.261 0.618 -4.311 7 HA SER 2 HA SER 2 -17.767 3.127 -2.895 8 HB2 SER 2 HB2 SER 2 -18.524 0.544 -1.502 9 HB3 SER 2 HB1 SER 2 -18.018 2.031 -0.702 10 HG SER 2 HG SER 2 -19.874 2.998 -1.909 11 H TRP 3 HN TRP 3 -15.653 3.415 -3.016 12 HA TRP 3 HA TRP 3 -13.788 1.217 -3.177 13 HB2 TRP 3 HB2 TRP 3 -13.532 4.213 -3.183 14 HB3 TRP 3 HB1 TRP 3 -12.112 3.197 -2.980 15 HD1 TRP 3 HD1 TRP 3 -15.037 3.445 -5.543 16 HE1 TRP 3 HE1 TRP 3 -14.041 3.054 -7.887 17 HE3 TRP 3 HE3 TRP 3 -10.180 2.589 -4.222 18 HZ2 TRP 3 HZ2 TRP 3 -11.521 2.461 -9.019 19 HZ3 TRP 3 HZ3 TRP 3 -8.541 2.119 -5.988 20 HH2 TRP 3 HH2 TRP 3 -9.198 2.056 -8.338 21 H GLY 4 HN GLY 4 -14.317 3.925 -0.946 22 HA2 GLY 4 HA2 GLY 4 -14.309 2.658 1.448 23 HA3 GLY 4 HA1 GLY 4 -12.597 2.779 1.056 24 H GLN 5 HN GLN 5 -13.639 4.052 3.289 25 HA GLN 5 HA GLN 5 -14.113 6.814 2.553 26 HB2 GLN 5 HB2 GLN 5 -15.489 5.920 4.314 27 HB3 GLN 5 HB1 GLN 5 -14.076 5.357 5.199 28 HG2 GLN 5 HG2 GLN 5 -14.953 7.334 6.238 29 HG3 GLN 5 HG1 GLN 5 -13.378 7.667 5.522 30 HE21 GLN 5 HE21 GLN 5 -13.746 9.867 5.380 31 HE22 GLN 5 HE22 GLN 5 -14.853 10.552 4.241 32 H CYS 6 HN CYS 6 -12.346 7.872 1.963 33 HA CYS 6 HA CYS 6 -10.438 8.722 3.782 34 HB2 CYS 6 HB2 CYS 6 -9.475 6.490 3.725 35 HB3 CYS 6 HB1 CYS 6 -9.408 6.526 1.965 36 H SER 7 HN SER 7 -10.148 10.688 3.001 37 HA SER 7 HA SER 7 -10.032 11.075 0.098 38 HB2 SER 7 HB2 SER 7 -10.316 13.121 2.315 39 HB3 SER 7 HB1 SER 7 -10.426 13.443 0.584 40 HG SER 7 HG SER 7 -12.110 11.482 1.097 41 H THR 8 HN THR 8 -7.894 10.150 2.142 42 HA THR 8 HA THR 8 -5.839 12.161 1.844 43 HB THR 8 HB THR 8 -5.488 9.333 2.850 44 HG1 THR 8 HG1 THR 8 -6.669 11.595 4.051 45 HG21 THR 8 HG21 THR 8 -3.420 10.583 2.460 46 HG22 THR 8 HG22 THR 8 -3.686 10.340 4.185 47 HG23 THR 8 HG23 THR 8 -4.025 11.908 3.455 48 H GLY 9 HN GLY 9 -7.115 9.737 -0.078 49 HA2 GLY 9 HA2 GLY 9 -5.565 10.143 -2.275 50 HA3 GLY 9 HA1 GLY 9 -4.691 8.906 -1.382 51 H SER 10 HN SER 10 -5.060 6.989 -2.224 52 HA SER 10 HA SER 10 -7.777 6.356 -3.160 53 HB2 SER 10 HB2 SER 10 -6.056 6.314 -4.947 54 HB3 SER 10 HB1 SER 10 -5.138 5.130 -4.020 55 HG SER 10 HG SER 10 -7.822 4.664 -4.781 56 H ILE 11 HN ILE 11 -8.678 4.344 -2.506 57 HA ILE 11 HA ILE 11 -7.355 3.163 -0.202 58 HB ILE 11 HB ILE 11 -10.164 2.783 -1.234 59 HG12 ILE 11 HG12 ILE 11 -10.584 3.977 0.998 60 HG13 ILE 11 HG11 ILE 11 -8.929 4.515 0.878 61 HG21 ILE 11 HG21 ILE 11 -10.601 1.664 0.883 62 HG22 ILE 11 HG22 ILE 11 -8.911 1.856 1.347 63 HG23 ILE 11 HG23 ILE 11 -9.338 0.821 -0.015 64 HD11 ILE 11 HD11 ILE 11 -10.461 6.195 0.046 65 HD12 ILE 11 HD12 ILE 11 -11.115 5.040 -1.116 66 HD13 ILE 11 HD13 ILE 11 -9.440 5.573 -1.250 67 H GLN 12 HN GLN 12 -6.739 1.156 -0.059 68 HA GLN 12 HA GLN 12 -7.374 -0.793 -2.097 69 HB2 GLN 12 HB2 GLN 12 -4.810 -1.406 -2.176 70 HB3 GLN 12 HB1 GLN 12 -5.517 -0.278 -3.307 71 HG2 GLN 12 HG2 GLN 12 -4.215 0.673 -0.794 72 HG3 GLN 12 HG1 GLN 12 -3.260 0.257 -2.207 73 HE21 GLN 12 HE21 GLN 12 -5.240 1.208 -4.120 74 HE22 GLN 12 HE22 GLN 12 -5.217 2.924 -4.039 75 H CYS 13 HN CYS 13 -6.351 -2.935 -1.604 76 HA CYS 13 HA CYS 13 -6.263 -3.318 1.314 77 HB2 CYS 13 HB2 CYS 13 -8.300 -4.268 0.430 78 HB3 CYS 13 HB1 CYS 13 -7.428 -5.101 -0.846 79 H CYS 14 HN CYS 14 -4.234 -3.662 1.879 80 HA CYS 14 HA CYS 14 -2.354 -4.749 -0.061 81 HB2 CYS 14 HB2 CYS 14 -1.982 -3.394 2.598 82 HB3 CYS 14 HB1 CYS 14 -0.653 -4.106 1.693 83 H GLN 15 HN GLN 15 -1.539 -6.681 0.005 84 HA GLN 15 HA GLN 15 -2.222 -8.564 2.012 85 HB2 GLN 15 HB2 GLN 15 -1.783 -9.921 0.294 86 HB3 GLN 15 HB1 GLN 15 -1.147 -8.569 -0.619 87 HG2 GLN 15 HG2 GLN 15 0.504 -10.236 -0.638 88 HG3 GLN 15 HG1 GLN 15 1.059 -8.993 0.474 89 HE21 GLN 15 HE21 GLN 15 -1.423 -11.340 1.227 90 HE22 GLN 15 HE22 GLN 15 -0.518 -12.214 2.411 91 H ASN 16 HN ASN 16 0.580 -6.580 1.290 92 HA ASN 16 HA ASN 16 1.698 -7.284 3.922 93 HB2 ASN 16 HB2 ASN 16 2.988 -7.168 1.256 94 HB3 ASN 16 HB1 ASN 16 3.894 -6.505 2.605 95 HD21 ASN 16 HD21 ASN 16 4.454 -8.801 0.950 96 HD22 ASN 16 HD22 ASN 16 4.579 -10.145 2.028 97 H VAL 17 HN VAL 17 1.005 -5.476 5.030 98 HA VAL 17 HA VAL 17 1.714 -2.853 3.960 99 HB VAL 17 HB VAL 17 0.355 -3.532 6.580 100 HG11 VAL 17 HG11 VAL 17 -0.151 -1.144 6.695 101 HG12 VAL 17 HG12 VAL 17 0.745 -0.875 5.199 102 HG13 VAL 17 HG13 VAL 17 1.592 -1.416 6.647 103 HG21 VAL 17 HG21 VAL 17 -0.789 -2.474 3.998 104 HG22 VAL 17 HG22 VAL 17 -1.678 -2.712 5.503 105 HG23 VAL 17 HG23 VAL 17 -1.016 -4.100 4.639 106 H VAL 18 HN VAL 18 3.835 -2.528 4.086 107 HA VAL 18 HA VAL 18 5.163 -3.019 6.664 108 HB VAL 18 HB VAL 18 7.214 -3.681 5.393 109 HG11 VAL 18 HG11 VAL 18 5.823 -5.387 6.409 110 HG12 VAL 18 HG12 VAL 18 6.454 -5.964 4.866 111 HG13 VAL 18 HG13 VAL 18 4.781 -5.419 4.986 112 HG21 VAL 18 HG21 VAL 18 6.681 -2.690 3.241 113 HG22 VAL 18 HG22 VAL 18 5.312 -3.785 3.052 114 HG23 VAL 18 HG23 VAL 18 6.956 -4.422 3.062 115 HA PRO 19 HA PRO 19 6.647 1.185 6.270 116 HB2 PRO 19 HB2 PRO 19 8.976 0.133 7.758 117 HB3 PRO 19 HB1 PRO 19 7.928 1.502 8.136 118 HG2 PRO 19 HG2 PRO 19 7.750 -0.786 9.502 119 HG3 PRO 19 HG1 PRO 19 6.308 0.169 9.111 120 HD2 PRO 19 HD2 PRO 19 7.317 -2.346 7.855 121 HD3 PRO 19 HD1 PRO 19 5.648 -1.832 8.176 122 H GLY 20 HN GLY 20 7.960 2.217 4.848 123 HA2 GLY 20 HA2 GLY 20 9.299 0.690 2.877 124 HA3 GLY 20 HA1 GLY 20 9.358 2.436 3.039 125 H ASP 21 HN ASP 21 10.359 1.972 5.893 126 HA ASP 21 HA ASP 21 13.169 1.490 5.171 127 HB2 ASP 21 HB2 ASP 21 13.790 2.801 7.043 128 HB3 ASP 21 HB1 ASP 21 12.435 3.658 6.319 129 H SER 22 HN SER 22 10.707 -0.267 6.105 130 HA SER 22 HA SER 22 11.707 -1.711 8.357 131 HB2 SER 22 HB2 SER 22 9.351 -1.792 7.977 132 HB3 SER 22 HB1 SER 22 9.564 -2.257 6.296 133 HG SER 22 HG SER 22 9.291 -3.823 8.429 134 H ASP 23 HN ASP 23 12.505 -3.914 8.304 135 HA ASP 23 HA ASP 23 14.523 -4.405 6.422 136 HB2 ASP 23 HB2 ASP 23 13.015 -6.251 8.279 137 HB3 ASP 23 HB1 ASP 23 14.277 -6.850 7.214 138 H LEU 24 HN LEU 24 11.184 -5.506 6.586 139 HA LEU 24 HA LEU 24 11.265 -7.031 4.193 140 HB2 LEU 24 HB2 LEU 24 9.302 -6.229 6.167 141 HB3 LEU 24 HB1 LEU 24 8.645 -6.149 4.545 142 HG LEU 24 HG LEU 24 8.201 -8.298 5.643 143 HD11 LEU 24 HD11 LEU 24 8.915 -9.724 3.802 144 HD12 LEU 24 HD12 LEU 24 10.069 -8.494 3.288 145 HD13 LEU 24 HD13 LEU 24 8.339 -8.167 3.210 146 HD21 LEU 24 HD21 LEU 24 10.184 -8.469 7.024 147 HD22 LEU 24 HD22 LEU 24 11.196 -8.618 5.588 148 HD23 LEU 24 HD23 LEU 24 10.037 -9.887 5.986 149 H GLY 25 HN GLY 25 9.811 -3.853 4.895 150 HA2 GLY 25 HA2 GLY 25 8.945 -3.305 2.308 151 HA3 GLY 25 HA1 GLY 25 9.275 -2.093 3.533 152 H THR 26 HN THR 26 12.048 -2.541 3.811 153 HA THR 26 HA THR 26 12.977 -0.911 1.688 154 HB THR 26 HB THR 26 14.500 -2.371 3.854 155 HG1 THR 26 HG1 THR 26 13.090 0.006 3.706 156 HG21 THR 26 HG21 THR 26 16.333 -0.831 3.379 157 HG22 THR 26 HG22 THR 26 15.427 -0.151 2.029 158 HG23 THR 26 HG23 THR 26 15.974 -1.829 1.971 159 H LEU 27 HN LEU 27 13.318 -4.324 2.477 160 HA LEU 27 HA LEU 27 15.074 -5.012 0.374 161 HB2 LEU 27 HB2 LEU 27 14.415 -6.362 2.452 162 HB3 LEU 27 HB1 LEU 27 12.949 -6.781 1.598 163 HG LEU 27 HG LEU 27 14.738 -8.534 1.585 164 HD11 LEU 27 HD11 LEU 27 14.491 -9.115 -0.775 165 HD12 LEU 27 HD12 LEU 27 13.873 -7.496 -1.105 166 HD13 LEU 27 HD13 LEU 27 12.965 -8.592 -0.063 167 HD21 LEU 27 HD21 LEU 27 16.666 -7.068 1.364 168 HD22 LEU 27 HD22 LEU 27 16.134 -6.601 -0.252 169 HD23 LEU 27 HD23 LEU 27 16.622 -8.264 0.070 170 H LEU 28 HN LEU 28 11.582 -4.735 0.644 171 HA LEU 28 HA LEU 28 10.960 -5.976 -1.824 172 HB2 LEU 28 HB2 LEU 28 9.299 -3.966 -0.314 173 HB3 LEU 28 HB1 LEU 28 8.730 -5.090 -1.528 174 HG LEU 28 HG LEU 28 9.595 -5.667 1.289 175 HD11 LEU 28 HD11 LEU 28 7.276 -5.045 0.932 176 HD12 LEU 28 HD12 LEU 28 7.412 -6.736 1.415 177 HD13 LEU 28 HD13 LEU 28 7.108 -6.323 -0.273 178 HD21 LEU 28 HD21 LEU 28 10.719 -7.309 -0.082 179 HD22 LEU 28 HD22 LEU 28 9.212 -7.674 -0.926 180 HD23 LEU 28 HD23 LEU 28 9.378 -8.054 0.789 181 H LEU 29 HN LEU 29 11.189 -2.540 -0.867 182 HA LEU 29 HA LEU 29 10.558 -1.680 -3.515 183 HB2 LEU 29 HB2 LEU 29 11.065 0.572 -2.727 184 HB3 LEU 29 HB1 LEU 29 9.955 -0.262 -1.675 185 HG LEU 29 HG LEU 29 11.952 -0.693 -0.147 186 HD11 LEU 29 HD11 LEU 29 13.742 -0.195 -1.740 187 HD12 LEU 29 HD12 LEU 29 13.818 0.875 -0.341 188 HD13 LEU 29 HD13 LEU 29 13.169 1.468 -1.870 189 HD21 LEU 29 HD21 LEU 29 10.960 2.095 -0.690 190 HD22 LEU 29 HD22 LEU 29 11.823 1.608 0.773 191 HD23 LEU 29 HD23 LEU 29 10.250 0.903 0.401 192 H ASP 30 HN ASP 30 13.491 -2.503 -1.892 193 HA ASP 30 HA ASP 30 15.269 -1.236 -3.710 194 HB2 ASP 30 HB2 ASP 30 15.858 -2.251 -1.432 195 HB3 ASP 30 HB1 ASP 30 15.834 -3.811 -2.241 196 H GLU 31 HN GLU 31 13.494 -4.213 -3.667 197 HA GLU 31 HA GLU 31 14.715 -5.424 -5.928 198 HB2 GLU 31 HB2 GLU 31 13.379 -6.482 -3.994 199 HB3 GLU 31 HB1 GLU 31 11.947 -5.941 -4.861 200 HG2 GLU 31 HG2 GLU 31 12.647 -7.243 -6.802 201 HG3 GLU 31 HG1 GLU 31 14.058 -7.774 -5.889 202 H LEU 32 HN LEU 32 12.570 -2.891 -5.450 203 HA LEU 32 HA LEU 32 11.315 -3.194 -8.089 204 HB2 LEU 32 HB2 LEU 32 10.426 -1.802 -5.575 205 HB3 LEU 32 HB1 LEU 32 9.599 -1.618 -7.108 206 HG LEU 32 HG LEU 32 9.956 -4.232 -5.639 207 HD11 LEU 32 HD11 LEU 32 7.540 -2.449 -5.887 208 HD12 LEU 32 HD12 LEU 32 8.490 -2.717 -4.426 209 HD13 LEU 32 HD13 LEU 32 7.574 -4.046 -5.137 210 HD21 LEU 32 HD21 LEU 32 9.773 -4.544 -8.038 211 HD22 LEU 32 HD22 LEU 32 8.340 -3.516 -8.084 212 HD23 LEU 32 HD23 LEU 32 8.289 -5.064 -7.242 213 H GLY 33 HN GLY 33 13.765 -1.603 -6.628 214 HA2 GLY 33 HA2 GLY 33 15.038 0.215 -7.181 215 HA3 GLY 33 HA1 GLY 33 14.222 0.180 -8.735 216 H ILE 34 HN ILE 34 12.677 0.708 -5.603 217 HA ILE 34 HA ILE 34 11.459 3.110 -6.680 218 HB ILE 34 HB ILE 34 11.104 1.917 -3.926 219 HG12 ILE 34 HG12 ILE 34 9.395 1.533 -6.408 220 HG13 ILE 34 HG11 ILE 34 10.491 0.326 -5.738 221 HG21 ILE 34 HG21 ILE 34 9.048 3.218 -3.871 222 HG22 ILE 34 HG22 ILE 34 9.397 3.859 -5.475 223 HG23 ILE 34 HG23 ILE 34 10.448 4.265 -4.118 224 HD11 ILE 34 HD11 ILE 34 8.075 1.471 -4.363 225 HD12 ILE 34 HD12 ILE 34 9.167 0.257 -3.697 226 HD13 ILE 34 HD13 ILE 34 8.193 -0.118 -5.118 227 H VAL 35 HN VAL 35 12.187 5.095 -6.365 228 HA VAL 35 HA VAL 35 14.293 5.575 -4.425 229 HB VAL 35 HB VAL 35 13.007 7.514 -6.360 230 HG11 VAL 35 HG11 VAL 35 14.067 8.617 -4.460 231 HG12 VAL 35 HG12 VAL 35 14.975 8.903 -5.944 232 HG13 VAL 35 HG13 VAL 35 15.559 7.728 -4.766 233 HG21 VAL 35 HG21 VAL 35 15.575 5.952 -6.609 234 HG22 VAL 35 HG22 VAL 35 15.020 7.197 -7.728 235 HG23 VAL 35 HG23 VAL 35 14.106 5.699 -7.550 236 H LEU 36 HN LEU 36 13.870 6.269 -2.434 237 HA LEU 36 HA LEU 36 11.139 7.094 -1.830 238 HB2 LEU 36 HB2 LEU 36 11.969 6.815 0.576 239 HB3 LEU 36 HB1 LEU 36 11.752 5.373 -0.387 240 HG LEU 36 HG LEU 36 14.345 5.781 -0.873 241 HD11 LEU 36 HD11 LEU 36 14.480 7.820 0.430 242 HD12 LEU 36 HD12 LEU 36 15.479 6.550 1.141 243 HD13 LEU 36 HD13 LEU 36 13.920 6.956 1.859 244 HD21 LEU 36 HD21 LEU 36 13.455 3.732 -0.023 245 HD22 LEU 36 HD22 LEU 36 13.156 4.460 1.553 246 HD23 LEU 36 HD23 LEU 36 14.811 4.220 0.992 247 H GLU 37 HN GLU 37 10.595 9.095 -1.389 248 HA GLU 37 HA GLU 37 12.623 11.115 -0.836 249 HB2 GLU 37 HB2 GLU 37 9.633 11.264 -1.240 250 HB3 GLU 37 HB1 GLU 37 10.587 12.647 -0.735 251 HG2 GLU 37 HG2 GLU 37 10.186 12.773 -3.090 252 HG3 GLU 37 HG1 GLU 37 11.897 12.467 -2.811 253 H ASP 38 HN ASP 38 10.200 9.199 0.670 254 HA ASP 38 HA ASP 38 11.050 10.077 3.305 255 HB2 ASP 38 HB2 ASP 38 8.973 11.353 2.708 256 HB3 ASP 38 HB1 ASP 38 8.139 9.820 2.489 257 HA PRO 39 HA PRO 39 11.083 5.549 2.802 258 HB2 PRO 39 HB2 PRO 39 12.876 5.078 4.793 259 HB3 PRO 39 HB1 PRO 39 13.356 5.586 3.171 260 HG2 PRO 39 HG2 PRO 39 13.073 7.217 5.662 261 HG3 PRO 39 HG1 PRO 39 14.339 7.276 4.420 262 HD2 PRO 39 HD2 PRO 39 12.301 9.058 4.531 263 HD3 PRO 39 HD1 PRO 39 13.061 8.566 3.004 264 H THR 40 HN THR 40 9.951 7.566 5.199 265 HA THR 40 HA THR 40 9.364 5.418 7.092 266 HB THR 40 HB THR 40 8.460 7.406 8.484 267 HG1 THR 40 HG1 THR 40 8.732 8.800 6.443 268 HG21 THR 40 HG21 THR 40 10.521 6.183 8.986 269 HG22 THR 40 HG22 THR 40 10.717 7.908 9.293 270 HG23 THR 40 HG23 THR 40 11.398 7.189 7.833 271 H VAL 41 HN VAL 41 8.024 6.060 4.407 272 HA VAL 41 HA VAL 41 5.263 6.258 5.310 273 HB VAL 41 HB VAL 41 4.632 6.155 2.965 274 HG11 VAL 41 HG11 VAL 41 5.692 8.221 2.172 275 HG12 VAL 41 HG12 VAL 41 6.886 8.083 3.463 276 HG13 VAL 41 HG13 VAL 41 5.183 8.325 3.857 277 HG21 VAL 41 HG21 VAL 41 6.269 6.051 1.175 278 HG22 VAL 41 HG22 VAL 41 6.350 4.604 2.180 279 HG23 VAL 41 HG23 VAL 41 7.568 5.868 2.355 280 H LEU 42 HN LEU 42 3.723 4.608 4.801 281 HA LEU 42 HA LEU 42 4.840 1.936 5.033 282 HB2 LEU 42 HB2 LEU 42 2.010 2.972 5.143 283 HB3 LEU 42 HB1 LEU 42 2.423 1.273 5.270 284 HG LEU 42 HG LEU 42 3.305 3.428 7.196 285 HD11 LEU 42 HD11 LEU 42 0.911 2.999 7.333 286 HD12 LEU 42 HD12 LEU 42 1.749 2.380 8.755 287 HD13 LEU 42 HD13 LEU 42 1.222 1.270 7.489 288 HD21 LEU 42 HD21 LEU 42 4.919 1.628 7.066 289 HD22 LEU 42 HD22 LEU 42 3.639 0.433 7.263 290 HD23 LEU 42 HD23 LEU 42 4.030 1.532 8.585 291 H ILE 43 HN ILE 43 5.195 0.709 3.328 292 HA ILE 43 HA ILE 43 3.731 1.335 0.871 293 HB ILE 43 HB ILE 43 5.446 -0.193 -0.236 294 HG12 ILE 43 HG12 ILE 43 7.019 0.399 2.276 295 HG13 ILE 43 HG11 ILE 43 6.295 -1.162 1.918 296 HG21 ILE 43 HG21 ILE 43 7.112 1.626 -0.370 297 HG22 ILE 43 HG22 ILE 43 6.296 2.434 0.969 298 HG23 ILE 43 HG23 ILE 43 5.453 2.188 -0.559 299 HD11 ILE 43 HD11 ILE 43 8.370 0.215 0.234 300 HD12 ILE 43 HD12 ILE 43 7.680 -1.382 -0.056 301 HD13 ILE 43 HD13 ILE 43 8.676 -1.098 1.371 302 H GLY 44 HN GLY 44 2.427 -0.089 -0.064 303 HA2 GLY 44 HA2 GLY 44 1.823 -2.462 1.558 304 HA3 GLY 44 HA1 GLY 44 0.667 -1.598 0.571 305 H ASP 45 HN ASP 45 3.126 -3.974 0.655 306 HA ASP 45 HA ASP 45 3.130 -4.471 -2.182 307 HB2 ASP 45 HB2 ASP 45 5.120 -5.062 -0.968 308 HB3 ASP 45 HB1 ASP 45 4.203 -6.033 0.176 309 H GLY 46 HN GLY 46 2.007 -6.100 -3.269 310 HA2 GLY 46 HA2 GLY 46 0.312 -7.647 -3.601 311 HA3 GLY 46 HA1 GLY 46 0.376 -7.977 -1.896 312 H CYS 47 HN CYS 47 -0.305 -4.891 -3.492 313 HA CYS 47 HA CYS 47 -2.750 -4.787 -1.861 314 HB2 CYS 47 HB2 CYS 47 -0.668 -3.061 -1.808 315 HB3 CYS 47 HB1 CYS 47 -1.689 -2.295 -3.024 316 H ASP 48 HN ASP 48 -4.531 -5.097 -2.933 317 HA ASP 48 HA ASP 48 -4.716 -4.195 -5.719 318 HB2 ASP 48 HB2 ASP 48 -6.612 -5.976 -4.179 319 HB3 ASP 48 HB1 ASP 48 -6.699 -5.605 -5.893 320 HA PRO 49 HA PRO 49 -7.064 -0.678 -4.345 321 HB2 PRO 49 HB2 PRO 49 -8.314 -0.686 -6.993 322 HB3 PRO 49 HB1 PRO 49 -7.280 0.525 -6.253 323 HG2 PRO 49 HG2 PRO 49 -6.468 -1.053 -8.297 324 HG3 PRO 49 HG1 PRO 49 -5.366 -0.402 -7.073 325 HD2 PRO 49 HD2 PRO 49 -6.463 -3.155 -7.360 326 HD3 PRO 49 HD1 PRO 49 -4.889 -2.611 -6.750 327 H ILE 50 HN ILE 50 -8.919 -0.660 -3.212 328 HA ILE 50 HA ILE 50 -10.728 -2.889 -3.522 329 HB ILE 50 HB ILE 50 -10.975 -0.576 -1.593 330 HG12 ILE 50 HG12 ILE 50 -9.698 -3.290 -1.187 331 HG13 ILE 50 HG11 ILE 50 -8.833 -1.764 -1.302 332 HG21 ILE 50 HG21 ILE 50 -12.400 -2.079 -0.338 333 HG22 ILE 50 HG22 ILE 50 -12.131 -3.357 -1.523 334 HG23 ILE 50 HG23 ILE 50 -13.017 -1.901 -1.982 335 HD11 ILE 50 HD11 ILE 50 -10.770 -2.566 0.855 336 HD12 ILE 50 HD12 ILE 50 -9.995 -0.988 0.727 337 HD13 ILE 50 HD13 ILE 50 -9.018 -2.429 1.002 338 H THR 51 HN THR 51 -12.042 -2.726 -5.211 339 HA THR 51 HA THR 51 -13.881 -0.451 -5.274 340 HB THR 51 HB THR 51 -12.229 0.070 -6.961 341 HG1 THR 51 HG1 THR 51 -14.764 -0.786 -7.871 342 HG21 THR 51 HG21 THR 51 -12.813 -2.660 -8.098 343 HG22 THR 51 HG22 THR 51 -11.295 -2.114 -7.382 344 HG23 THR 51 HG23 THR 51 -11.856 -1.415 -8.901 345 H VAL 52 HN VAL 52 -13.805 -3.366 -4.493 346 HA VAL 52 HA VAL 52 -16.221 -4.166 -5.951 347 HB VAL 52 HB VAL 52 -14.155 -5.508 -6.548 348 HG11 VAL 52 HG11 VAL 52 -13.120 -5.553 -4.339 349 HG12 VAL 52 HG12 VAL 52 -13.374 -7.184 -4.960 350 HG13 VAL 52 HG13 VAL 52 -14.453 -6.532 -3.728 351 HG21 VAL 52 HG21 VAL 52 -15.300 -7.675 -6.404 352 HG22 VAL 52 HG22 VAL 52 -16.365 -6.379 -6.949 353 HG23 VAL 52 HG23 VAL 52 -16.466 -6.962 -5.290 354 H ALA 53 HN ALA 53 -17.659 -5.557 -4.675 355 HA ALA 53 HA ALA 53 -18.709 -6.358 -2.836 356 HB1 ALA 53 HB1 ALA 53 -16.530 -7.191 -2.087 357 HB2 ALA 53 HB2 ALA 53 -17.543 -6.674 -0.739 358 HB3 ALA 53 HB3 ALA 53 -16.222 -5.646 -1.294 359 H GLY 54 HN GLY 54 -16.834 -3.518 -1.681 360 HA2 GLY 54 HA2 GLY 54 -17.567 -1.610 -0.608 361 HA3 GLY 54 HA1 GLY 54 -19.122 -1.877 -1.385 362 H SER 55 HN SER 55 -17.407 -3.973 0.850 363 HA SER 55 HA SER 55 -19.268 -3.410 3.003 364 HB2 SER 55 HB2 SER 55 -19.004 -6.193 1.821 365 HB3 SER 55 HB1 SER 55 -19.970 -5.750 3.226 366 HG SER 55 HG SER 55 -20.651 -4.168 1.184 367 H SER 56 HN SER 56 -18.600 -5.520 4.688 368 HA SER 56 HA SER 56 -16.044 -4.805 5.593 369 HB2 SER 56 HB2 SER 56 -16.288 -6.890 7.041 370 HB3 SER 56 HB1 SER 56 -17.570 -5.690 7.186 371 HG SER 56 HG SER 56 -17.751 -8.261 6.463 372 H ASP 57 HN ASP 57 -17.124 -7.372 3.466 373 HA ASP 57 HA ASP 57 -14.570 -8.700 3.420 374 HB2 ASP 57 HB2 ASP 57 -17.151 -9.073 1.922 375 HB3 ASP 57 HB1 ASP 57 -15.702 -9.965 1.494 376 H ALA 58 HN ALA 58 -14.790 -5.839 2.537 377 HA ALA 58 HA ALA 58 -14.246 -5.915 -0.291 378 HB1 ALA 58 HB1 ALA 58 -13.858 -3.645 1.651 379 HB2 ALA 58 HB2 ALA 58 -15.352 -3.983 0.776 380 HB3 ALA 58 HB3 ALA 58 -13.895 -3.532 -0.109 381 H CYS 59 HN CYS 59 -12.509 -6.542 2.482 382 HA CYS 59 HA CYS 59 -10.035 -6.637 0.962 383 HB2 CYS 59 HB2 CYS 59 -9.872 -4.468 2.029 384 HB3 CYS 59 HB1 CYS 59 -10.302 -5.161 3.589 385 H SER 60 HN SER 60 -8.824 -8.372 1.464 386 HA SER 60 HA SER 60 -9.899 -10.159 3.512 387 HB2 SER 60 HB2 SER 60 -8.361 -11.815 2.210 388 HB3 SER 60 HB1 SER 60 -9.872 -11.282 1.471 389 HG SER 60 HG SER 60 -7.695 -11.171 0.266 390 H ALA 61 HN ALA 61 -7.062 -8.314 2.717 391 HA ALA 61 HA ALA 61 -5.542 -9.732 4.791 392 HB1 ALA 61 HB1 ALA 61 -4.488 -9.676 2.577 393 HB2 ALA 61 HB2 ALA 61 -3.524 -8.829 3.787 394 HB3 ALA 61 HB3 ALA 61 -4.488 -7.913 2.628 395 H THR 62 HN THR 62 -5.159 -6.396 3.606 396 HA THR 62 HA THR 62 -5.926 -5.351 6.221 397 HB THR 62 HB THR 62 -3.227 -4.674 5.038 398 HG1 THR 62 HG1 THR 62 -4.013 -6.684 6.854 399 HG21 THR 62 HG21 THR 62 -4.428 -4.148 7.760 400 HG22 THR 62 HG22 THR 62 -4.216 -2.954 6.480 401 HG23 THR 62 HG23 THR 62 -2.805 -3.690 7.242 402 H ALA 63 HN ALA 63 -6.976 -3.454 6.008 403 HA ALA 63 HA ALA 63 -7.232 -2.330 3.349 404 HB1 ALA 63 HB1 ALA 63 -8.634 -1.578 5.913 405 HB2 ALA 63 HB2 ALA 63 -9.242 -2.706 4.700 406 HB3 ALA 63 HB3 ALA 63 -9.043 -1.000 4.297 407 H VAL 64 HN VAL 64 -6.379 -0.458 2.678 408 HA VAL 64 HA VAL 64 -5.176 1.367 4.616 409 HB VAL 64 HB VAL 64 -3.109 1.466 3.110 410 HG11 VAL 64 HG11 VAL 64 -3.628 -0.961 4.823 411 HG12 VAL 64 HG12 VAL 64 -2.965 0.587 5.350 412 HG13 VAL 64 HG13 VAL 64 -2.036 -0.448 4.267 413 HG21 VAL 64 HG21 VAL 64 -2.586 -0.601 1.909 414 HG22 VAL 64 HG22 VAL 64 -4.028 0.184 1.260 415 HG23 VAL 64 HG23 VAL 64 -4.185 -1.230 2.306 416 H CYS 65 HN CYS 65 -4.212 3.277 3.435 417 HA CYS 65 HA CYS 65 -5.663 3.959 0.986 418 HB2 CYS 65 HB2 CYS 65 -6.967 4.786 2.925 419 HB3 CYS 65 HB1 CYS 65 -5.557 5.678 3.476 420 H CYS 66 HN CYS 66 -4.000 4.277 -0.384 421 HA CYS 66 HA CYS 66 -1.513 5.404 0.608 422 HB2 CYS 66 HB2 CYS 66 -2.334 3.913 -1.803 423 HB3 CYS 66 HB1 CYS 66 -1.006 5.048 -1.999 424 H SER 67 HN SER 67 -0.715 7.313 0.237 425 HA SER 67 HA SER 67 -2.424 9.336 -0.915 426 HB2 SER 67 HB2 SER 67 0.314 9.597 0.326 427 HB3 SER 67 HB1 SER 67 -0.822 10.911 0.012 428 HG SER 67 HG SER 67 -1.940 8.906 1.475 429 H ASP 68 HN ASP 68 0.190 7.408 -1.903 430 HA ASP 68 HA ASP 68 0.900 9.244 -4.079 431 HB2 ASP 68 HB2 ASP 68 2.651 8.073 -2.553 432 HB3 ASP 68 HB1 ASP 68 2.290 6.636 -3.503 433 H ASN 69 HN ASN 69 1.167 8.258 -6.253 434 HA ASN 69 HA ASN 69 -1.003 6.315 -6.717 435 HB2 ASN 69 HB2 ASN 69 -1.314 8.677 -7.580 436 HB3 ASN 69 HB1 ASN 69 0.027 8.372 -8.678 437 HD21 ASN 69 HD21 ASN 69 -1.212 8.596 -10.510 438 HD22 ASN 69 HD22 ASN 69 -2.406 7.434 -10.982 439 H ASN 70 HN ASN 70 2.299 6.683 -6.775 440 HA ASN 70 HA ASN 70 2.920 5.256 -9.188 441 HB2 ASN 70 HB2 ASN 70 4.519 6.850 -8.279 442 HB3 ASN 70 HB1 ASN 70 4.610 5.946 -6.773 443 HD21 ASN 70 HD21 ASN 70 6.812 5.645 -6.939 444 HD22 ASN 70 HD22 ASN 70 7.518 4.565 -8.091 445 H VAL 71 HN VAL 71 2.299 3.195 -9.360 446 HA VAL 71 HA VAL 71 2.947 1.383 -7.146 447 HB VAL 71 HB VAL 71 1.185 -0.103 -8.096 448 HG11 VAL 71 HG11 VAL 71 0.731 1.251 -6.140 449 HG12 VAL 71 HG12 VAL 71 -0.706 1.163 -7.159 450 HG13 VAL 71 HG13 VAL 71 0.292 2.617 -7.167 451 HG21 VAL 71 HG21 VAL 71 0.445 2.326 -9.710 452 HG22 VAL 71 HG22 VAL 71 -0.498 0.842 -9.589 453 HG23 VAL 71 HG23 VAL 71 1.092 0.818 -10.354 454 H SER 72 HN SER 72 4.023 -0.512 -7.642 455 HA SER 72 HA SER 72 5.496 -0.497 -10.128 456 HB2 SER 72 HB2 SER 72 6.760 -2.345 -9.116 457 HB3 SER 72 HB1 SER 72 6.618 -0.998 -7.980 458 HG SER 72 HG SER 72 5.709 -3.549 -7.767 459 H GLY 73 HN GLY 73 2.535 -1.561 -9.290 460 HA2 GLY 73 HA2 GLY 73 1.400 -2.785 -11.166 461 HA3 GLY 73 HA1 GLY 73 2.678 -3.971 -10.981 462 H VAL 74 HN VAL 74 2.700 -3.838 -8.070 463 HA VAL 74 HA VAL 74 -0.006 -4.761 -7.439 464 HB VAL 74 HB VAL 74 0.773 -6.700 -6.257 465 HG11 VAL 74 HG11 VAL 74 1.788 -7.988 -8.166 466 HG12 VAL 74 HG12 VAL 74 1.858 -6.461 -9.057 467 HG13 VAL 74 HG13 VAL 74 0.302 -7.115 -8.544 468 HG21 VAL 74 HG21 VAL 74 3.525 -5.741 -6.987 469 HG22 VAL 74 HG22 VAL 74 3.181 -7.372 -6.417 470 HG23 VAL 74 HG23 VAL 74 2.851 -5.987 -5.376 471 H ILE 75 HN ILE 75 2.753 -2.981 -6.489 472 HA ILE 75 HA ILE 75 2.125 -3.140 -3.659 473 HB ILE 75 HB ILE 75 3.990 -1.652 -3.278 474 HG12 ILE 75 HG12 ILE 75 4.509 -1.579 -6.234 475 HG13 ILE 75 HG11 ILE 75 3.500 -0.373 -5.455 476 HG21 ILE 75 HG21 ILE 75 4.466 -4.008 -3.566 477 HG22 ILE 75 HG22 ILE 75 5.787 -3.016 -4.182 478 HG23 ILE 75 HG23 ILE 75 4.652 -3.764 -5.302 479 HD11 ILE 75 HD11 ILE 75 5.341 0.292 -4.038 480 HD12 ILE 75 HD12 ILE 75 5.804 0.379 -5.738 481 HD13 ILE 75 HD13 ILE 75 6.352 -0.969 -4.742 482 H ALA 76 HN ALA 76 2.434 -0.875 -2.587 483 HA ALA 76 HA ALA 76 1.052 1.291 -3.944 484 HB1 ALA 76 HB1 ALA 76 -0.778 0.037 -2.945 485 HB2 ALA 76 HB2 ALA 76 -0.550 1.558 -2.078 486 HB3 ALA 76 HB3 ALA 76 0.044 0.045 -1.382 487 H ILE 77 HN ILE 77 1.681 3.329 -3.067 488 HA ILE 77 HA ILE 77 3.763 3.116 -0.989 489 HB ILE 77 HB ILE 77 3.696 5.072 -3.292 490 HG12 ILE 77 HG12 ILE 77 5.526 2.716 -2.767 491 HG13 ILE 77 HG11 ILE 77 4.256 2.771 -3.986 492 HG21 ILE 77 HG21 ILE 77 5.944 5.710 -2.513 493 HG22 ILE 77 HG22 ILE 77 5.741 4.656 -1.113 494 HG23 ILE 77 HG23 ILE 77 4.695 6.062 -1.320 495 HD11 ILE 77 HD11 ILE 77 6.697 4.529 -3.912 496 HD12 ILE 77 HD12 ILE 77 5.434 4.558 -5.142 497 HD13 ILE 77 HD13 ILE 77 6.454 3.132 -4.959 498 H GLY 78 HN GLY 78 3.535 4.300 0.786 499 HA2 GLY 78 HA2 GLY 78 2.946 6.060 2.166 500 HA3 GLY 78 HA1 GLY 78 2.283 6.891 0.767 501 H CYS 79 HN CYS 79 1.569 3.816 2.404 502 HA CYS 79 HA CYS 79 -1.273 4.437 2.171 503 HB2 CYS 79 HB2 CYS 79 0.355 1.988 2.204 504 HB3 CYS 79 HB1 CYS 79 -1.171 1.879 3.065 505 H LEU 80 HN LEU 80 -2.465 4.976 3.828 506 HA LEU 80 HA LEU 80 -1.447 4.539 6.538 507 HB2 LEU 80 HB2 LEU 80 -3.818 6.142 5.579 508 HB3 LEU 80 HB1 LEU 80 -3.281 6.002 7.245 509 HG LEU 80 HG LEU 80 -1.689 7.260 5.010 510 HD11 LEU 80 HD11 LEU 80 -2.141 9.361 6.149 511 HD12 LEU 80 HD12 LEU 80 -3.139 8.518 7.333 512 HD13 LEU 80 HD13 LEU 80 -3.643 8.585 5.645 513 HD21 LEU 80 HD21 LEU 80 -1.148 7.026 7.968 514 HD22 LEU 80 HD22 LEU 80 -0.215 8.009 6.840 515 HD23 LEU 80 HD23 LEU 80 -0.240 6.254 6.668 516 HA PRO 81 HA PRO 81 -4.065 0.993 6.899 517 HB2 PRO 81 HB2 PRO 81 -3.808 1.309 9.793 518 HB3 PRO 81 HB1 PRO 81 -3.214 0.014 8.758 519 HG2 PRO 81 HG2 PRO 81 -1.568 1.788 9.942 520 HG3 PRO 81 HG1 PRO 81 -1.212 1.063 8.365 521 HD2 PRO 81 HD2 PRO 81 -2.282 3.789 8.995 522 HD3 PRO 81 HD1 PRO 81 -1.106 3.295 7.770 523 H VAL 82 HN VAL 82 -6.199 1.009 6.723 524 HA VAL 82 HA VAL 82 -7.757 2.660 8.573 525 HB VAL 82 HB VAL 82 -9.446 2.807 6.687 526 HG11 VAL 82 HG11 VAL 82 -8.153 4.734 7.388 527 HG12 VAL 82 HG12 VAL 82 -8.317 4.730 5.632 528 HG13 VAL 82 HG13 VAL 82 -6.803 4.218 6.377 529 HG21 VAL 82 HG21 VAL 82 -7.061 2.060 5.017 530 HG22 VAL 82 HG22 VAL 82 -8.614 2.629 4.406 531 HG23 VAL 82 HG23 VAL 82 -8.509 1.081 5.246 532 H THR 83 HN THR 83 -9.863 1.859 9.027 533 HA THR 83 HA THR 83 -10.630 -0.775 8.133 534 HB THR 83 HB THR 83 -10.202 -0.324 11.098 535 HG1 THR 83 HG1 THR 83 -8.472 -1.171 9.140 536 HG21 THR 83 HG21 THR 83 -10.644 -2.735 11.259 537 HG22 THR 83 HG22 THR 83 -10.928 -2.795 9.520 538 HG23 THR 83 HG23 THR 83 -12.013 -1.872 10.559 539 H LEU 84 HN LEU 84 -12.823 -1.041 8.252 540 HA LEU 84 HA LEU 84 -15.006 -0.487 8.391 541 HB2 LEU 84 HB2 LEU 84 -14.037 0.705 10.971 542 HB3 LEU 84 HB1 LEU 84 -15.735 0.617 10.534 543 HG LEU 84 HG LEU 84 -13.910 -1.761 10.823 544 HD11 LEU 84 HD11 LEU 84 -15.999 -0.676 12.707 545 HD12 LEU 84 HD12 LEU 84 -14.255 -0.674 12.973 546 HD13 LEU 84 HD13 LEU 84 -15.134 -2.201 12.902 547 HD21 LEU 84 HD21 LEU 84 -15.717 -2.171 9.281 548 HD22 LEU 84 HD22 LEU 84 -16.888 -1.557 10.446 549 HD23 LEU 84 HD23 LEU 84 -16.001 -3.042 10.785 Start of MODEL 2 1 H1 GLY 1 HT1 GLY 1 -14.839 10.573 -4.173 2 H2 GLY 1 HT2 GLY 1 -15.288 9.121 -3.428 3 H3 GLY 1 HT3 GLY 1 -16.019 9.591 -4.880 4 HA2 GLY 1 HA1 GLY 1 -13.918 9.383 -6.041 5 HA3 GLY 1 HA2 GLY 1 -13.165 8.883 -4.534 6 H SER 2 HN SER 2 -13.580 7.502 -7.170 7 HA SER 2 HA SER 2 -15.464 5.398 -6.575 8 HB2 SER 2 HB2 SER 2 -14.521 4.467 -8.777 9 HB3 SER 2 HB1 SER 2 -15.393 5.998 -8.853 10 HG SER 2 HG SER 2 -12.807 5.450 -9.468 11 H TRP 3 HN TRP 3 -12.214 6.018 -5.890 12 HA TRP 3 HA TRP 3 -11.569 3.161 -5.652 13 HB2 TRP 3 HB2 TRP 3 -9.693 5.524 -5.407 14 HB3 TRP 3 HB1 TRP 3 -9.247 3.829 -5.537 15 HD1 TRP 3 HD1 TRP 3 -10.512 6.761 -7.648 16 HE1 TRP 3 HE1 TRP 3 -10.160 6.201 -10.134 17 HE3 TRP 3 HE3 TRP 3 -9.017 1.903 -7.179 18 HZ2 TRP 3 HZ2 TRP 3 -9.350 3.993 -11.691 19 HZ3 TRP 3 HZ3 TRP 3 -8.470 0.633 -9.216 20 HH2 TRP 3 HH2 TRP 3 -8.633 1.659 -11.425 21 H GLY 4 HN GLY 4 -13.382 4.315 -3.835 22 HA2 GLY 4 HA2 GLY 4 -13.672 3.882 -1.546 23 HA3 GLY 4 HA1 GLY 4 -11.925 3.854 -1.352 24 H GLN 5 HN GLN 5 -13.979 5.275 0.197 25 HA GLN 5 HA GLN 5 -13.522 8.075 -0.413 26 HB2 GLN 5 HB2 GLN 5 -15.042 6.684 1.797 27 HB3 GLN 5 HB1 GLN 5 -14.899 8.428 1.664 28 HG2 GLN 5 HG2 GLN 5 -16.167 6.604 -0.361 29 HG3 GLN 5 HG1 GLN 5 -17.019 7.637 0.785 30 HE21 GLN 5 HE21 GLN 5 -16.965 9.880 0.498 31 HE22 GLN 5 HE22 GLN 5 -16.560 10.584 -1.028 32 H CYS 6 HN CYS 6 -11.584 8.886 0.132 33 HA CYS 6 HA CYS 6 -10.666 8.644 2.853 34 HB2 CYS 6 HB2 CYS 6 -9.751 6.594 1.802 35 HB3 CYS 6 HB1 CYS 6 -8.947 7.593 0.594 36 H SER 7 HN SER 7 -9.528 10.393 3.467 37 HA SER 7 HA SER 7 -9.243 12.547 1.568 38 HB2 SER 7 HB2 SER 7 -8.442 13.776 3.669 39 HB3 SER 7 HB1 SER 7 -10.108 13.196 3.673 40 HG SER 7 HG SER 7 -9.642 11.835 5.219 41 H THR 8 HN THR 8 -7.263 10.101 2.878 42 HA THR 8 HA THR 8 -4.766 11.488 2.498 43 HB THR 8 HB THR 8 -5.385 8.593 3.118 44 HG1 THR 8 HG1 THR 8 -4.280 10.594 4.812 45 HG21 THR 8 HG21 THR 8 -3.206 8.760 2.027 46 HG22 THR 8 HG22 THR 8 -3.022 8.387 3.741 47 HG23 THR 8 HG23 THR 8 -2.726 10.024 3.159 48 H GLY 9 HN GLY 9 -6.873 9.487 0.622 49 HA2 GLY 9 HA2 GLY 9 -6.048 10.081 -1.844 50 HA3 GLY 9 HA1 GLY 9 -4.844 8.895 -1.367 51 H SER 10 HN SER 10 -5.365 7.215 -2.656 52 HA SER 10 HA SER 10 -8.120 6.356 -2.894 53 HB2 SER 10 HB2 SER 10 -5.605 5.279 -4.168 54 HB3 SER 10 HB1 SER 10 -7.256 4.916 -4.631 55 HG SER 10 HG SER 10 -5.873 7.362 -4.879 56 H ILE 11 HN ILE 11 -8.898 4.441 -2.073 57 HA ILE 11 HA ILE 11 -7.231 3.217 -0.015 58 HB ILE 11 HB ILE 11 -10.174 2.872 -0.607 59 HG12 ILE 11 HG12 ILE 11 -8.670 4.346 1.556 60 HG13 ILE 11 HG11 ILE 11 -9.658 5.054 0.285 61 HG21 ILE 11 HG21 ILE 11 -10.304 1.651 1.492 62 HG22 ILE 11 HG22 ILE 11 -8.560 1.799 1.700 63 HG23 ILE 11 HG23 ILE 11 -9.209 0.839 0.371 64 HD11 ILE 11 HD11 ILE 11 -10.657 3.279 2.490 65 HD12 ILE 11 HD12 ILE 11 -11.643 4.049 1.247 66 HD13 ILE 11 HD13 ILE 11 -10.800 5.036 2.442 67 H GLN 12 HN GLN 12 -6.626 1.194 0.047 68 HA GLN 12 HA GLN 12 -7.288 -0.619 -2.123 69 HB2 GLN 12 HB2 GLN 12 -4.576 -0.909 -2.125 70 HB3 GLN 12 HB1 GLN 12 -5.479 0.016 -3.311 71 HG2 GLN 12 HG2 GLN 12 -5.176 1.956 -1.598 72 HG3 GLN 12 HG1 GLN 12 -3.842 0.964 -1.023 73 HE21 GLN 12 HE21 GLN 12 -5.067 2.889 -3.607 74 HE22 GLN 12 HE22 GLN 12 -3.608 2.987 -4.521 75 H CYS 13 HN CYS 13 -6.459 -2.788 -1.732 76 HA CYS 13 HA CYS 13 -6.227 -3.258 1.160 77 HB2 CYS 13 HB2 CYS 13 -8.304 -4.144 0.333 78 HB3 CYS 13 HB1 CYS 13 -7.498 -4.970 -0.992 79 H CYS 14 HN CYS 14 -4.183 -3.546 1.609 80 HA CYS 14 HA CYS 14 -2.366 -4.727 -0.311 81 HB2 CYS 14 HB2 CYS 14 -1.988 -3.414 2.368 82 HB3 CYS 14 HB1 CYS 14 -0.670 -4.213 1.523 83 H GLN 15 HN GLN 15 -1.524 -6.677 -0.224 84 HA GLN 15 HA GLN 15 -2.408 -8.591 1.688 85 HB2 GLN 15 HB2 GLN 15 -1.709 -10.058 0.132 86 HB3 GLN 15 HB1 GLN 15 -1.367 -8.670 -0.880 87 HG2 GLN 15 HG2 GLN 15 0.540 -10.016 -0.974 88 HG3 GLN 15 HG1 GLN 15 0.963 -8.687 0.100 89 HE21 GLN 15 HE21 GLN 15 -1.101 -11.321 1.078 90 HE22 GLN 15 HE22 GLN 15 0.004 -12.036 2.195 91 H ASN 16 HN ASN 16 0.376 -6.561 1.236 92 HA ASN 16 HA ASN 16 1.396 -7.398 3.875 93 HB2 ASN 16 HB2 ASN 16 2.735 -7.842 1.512 94 HB3 ASN 16 HB1 ASN 16 3.350 -6.272 1.996 95 HD21 ASN 16 HD21 ASN 16 4.532 -8.991 1.866 96 HD22 ASN 16 HD22 ASN 16 5.255 -9.227 3.421 97 H VAL 17 HN VAL 17 1.737 -5.716 5.270 98 HA VAL 17 HA VAL 17 1.918 -3.017 4.103 99 HB VAL 17 HB VAL 17 0.480 -3.755 6.661 100 HG11 VAL 17 HG11 VAL 17 -0.072 -1.373 6.821 101 HG12 VAL 17 HG12 VAL 17 0.927 -1.045 5.405 102 HG13 VAL 17 HG13 VAL 17 1.671 -1.632 6.893 103 HG21 VAL 17 HG21 VAL 17 -0.509 -2.690 4.019 104 HG22 VAL 17 HG22 VAL 17 -1.492 -2.823 5.478 105 HG23 VAL 17 HG23 VAL 17 -0.844 -4.276 4.717 106 H VAL 18 HN VAL 18 3.950 -2.433 4.331 107 HA VAL 18 HA VAL 18 5.300 -2.937 6.889 108 HB VAL 18 HB VAL 18 7.386 -3.499 5.602 109 HG11 VAL 18 HG11 VAL 18 6.750 -5.824 5.165 110 HG12 VAL 18 HG12 VAL 18 5.048 -5.372 5.253 111 HG13 VAL 18 HG13 VAL 18 6.071 -5.238 6.683 112 HG21 VAL 18 HG21 VAL 18 5.448 -3.761 3.300 113 HG22 VAL 18 HG22 VAL 18 7.131 -4.290 3.290 114 HG23 VAL 18 HG23 VAL 18 6.745 -2.575 3.439 115 HA PRO 19 HA PRO 19 6.724 1.297 6.456 116 HB2 PRO 19 HB2 PRO 19 9.084 0.257 7.908 117 HB3 PRO 19 HB1 PRO 19 8.046 1.632 8.293 118 HG2 PRO 19 HG2 PRO 19 7.890 -0.642 9.685 119 HG3 PRO 19 HG1 PRO 19 6.443 0.313 9.312 120 HD2 PRO 19 HD2 PRO 19 7.420 -2.221 8.065 121 HD3 PRO 19 HD1 PRO 19 5.759 -1.694 8.406 122 H GLY 20 HN GLY 20 7.983 2.296 4.955 123 HA2 GLY 20 HA2 GLY 20 9.309 0.741 3.001 124 HA3 GLY 20 HA1 GLY 20 9.371 2.491 3.133 125 H ASP 21 HN ASP 21 10.411 2.201 5.939 126 HA ASP 21 HA ASP 21 13.219 1.752 5.244 127 HB2 ASP 21 HB2 ASP 21 13.771 3.007 7.174 128 HB3 ASP 21 HB1 ASP 21 12.355 3.823 6.520 129 H SER 22 HN SER 22 10.702 -0.028 6.352 130 HA SER 22 HA SER 22 11.889 -1.535 8.445 131 HB2 SER 22 HB2 SER 22 9.504 -1.628 8.193 132 HB3 SER 22 HB1 SER 22 9.638 -2.129 6.513 133 HG SER 22 HG SER 22 9.906 -3.613 8.851 134 H ASP 23 HN ASP 23 12.812 -3.615 8.324 135 HA ASP 23 HA ASP 23 14.669 -3.993 6.252 136 HB2 ASP 23 HB2 ASP 23 13.648 -5.740 8.458 137 HB3 ASP 23 HB1 ASP 23 14.673 -6.432 7.209 138 H LEU 24 HN LEU 24 11.440 -5.217 6.749 139 HA LEU 24 HA LEU 24 11.348 -6.866 4.452 140 HB2 LEU 24 HB2 LEU 24 9.441 -5.767 6.385 141 HB3 LEU 24 HB1 LEU 24 8.776 -5.996 4.781 142 HG LEU 24 HG LEU 24 8.339 -7.930 6.178 143 HD11 LEU 24 HD11 LEU 24 10.433 -8.634 4.135 144 HD12 LEU 24 HD12 LEU 24 8.788 -8.158 3.724 145 HD13 LEU 24 HD13 LEU 24 9.074 -9.622 4.671 146 HD21 LEU 24 HD21 LEU 24 10.186 -9.347 6.961 147 HD22 LEU 24 HD22 LEU 24 10.201 -7.752 7.712 148 HD23 LEU 24 HD23 LEU 24 11.336 -8.127 6.415 149 H GLY 25 HN GLY 25 9.902 -3.654 4.994 150 HA2 GLY 25 HA2 GLY 25 9.008 -3.254 2.395 151 HA3 GLY 25 HA1 GLY 25 9.343 -1.972 3.545 152 H THR 26 HN THR 26 12.129 -2.398 3.807 153 HA THR 26 HA THR 26 13.000 -0.863 1.593 154 HB THR 26 HB THR 26 14.725 -2.269 3.638 155 HG1 THR 26 HG1 THR 26 13.113 0.000 3.777 156 HG21 THR 26 HG21 THR 26 15.261 0.197 1.991 157 HG22 THR 26 HG22 THR 26 15.925 -1.405 1.660 158 HG23 THR 26 HG23 THR 26 16.361 -0.557 3.144 159 H LEU 27 HN LEU 27 13.419 -4.232 2.542 160 HA LEU 27 HA LEU 27 15.091 -4.983 0.393 161 HB2 LEU 27 HB2 LEU 27 14.636 -6.265 2.534 162 HB3 LEU 27 HB1 LEU 27 13.099 -6.731 1.844 163 HG LEU 27 HG LEU 27 14.946 -8.450 1.727 164 HD11 LEU 27 HD11 LEU 27 14.402 -9.171 -0.542 165 HD12 LEU 27 HD12 LEU 27 13.701 -7.586 -0.873 166 HD13 LEU 27 HD13 LEU 27 12.969 -8.641 0.336 167 HD21 LEU 27 HD21 LEU 27 16.604 -8.223 -0.030 168 HD22 LEU 27 HD22 LEU 27 16.767 -6.928 1.155 169 HD23 LEU 27 HD23 LEU 27 16.008 -6.606 -0.403 170 H LEU 28 HN LEU 28 11.601 -4.787 0.806 171 HA LEU 28 HA LEU 28 10.948 -6.224 -1.560 172 HB2 LEU 28 HB2 LEU 28 9.252 -4.196 -0.093 173 HB3 LEU 28 HB1 LEU 28 8.686 -5.394 -1.233 174 HG LEU 28 HG LEU 28 9.626 -5.794 1.591 175 HD11 LEU 28 HD11 LEU 28 7.512 -6.975 1.800 176 HD12 LEU 28 HD12 LEU 28 7.171 -6.691 0.094 177 HD13 LEU 28 HD13 LEU 28 7.266 -5.330 1.211 178 HD21 LEU 28 HD21 LEU 28 10.846 -7.433 0.318 179 HD22 LEU 28 HD22 LEU 28 9.375 -7.925 -0.524 180 HD23 LEU 28 HD23 LEU 28 9.542 -8.217 1.207 181 H LEU 29 HN LEU 29 11.203 -2.733 -0.840 182 HA LEU 29 HA LEU 29 10.497 -2.085 -3.547 183 HB2 LEU 29 HB2 LEU 29 10.911 0.225 -2.939 184 HB3 LEU 29 HB1 LEU 29 9.887 -0.561 -1.774 185 HG LEU 29 HG LEU 29 11.953 -0.780 -0.303 186 HD11 LEU 29 HD11 LEU 29 13.754 0.818 -0.702 187 HD12 LEU 29 HD12 LEU 29 13.023 1.271 -2.243 188 HD13 LEU 29 HD13 LEU 29 13.659 -0.358 -2.013 189 HD21 LEU 29 HD21 LEU 29 10.193 0.797 0.140 190 HD22 LEU 29 HD22 LEU 29 10.861 1.922 -1.044 191 HD23 LEU 29 HD23 LEU 29 11.752 1.563 0.440 192 H ASP 30 HN ASP 30 13.440 -2.664 -1.816 193 HA ASP 30 HA ASP 30 15.269 -1.705 -3.747 194 HB2 ASP 30 HB2 ASP 30 16.006 -2.411 -1.523 195 HB3 ASP 30 HB1 ASP 30 15.492 -4.058 -1.851 196 H GLU 31 HN GLU 31 13.429 -4.609 -3.369 197 HA GLU 31 HA GLU 31 14.596 -6.065 -5.520 198 HB2 GLU 31 HB2 GLU 31 12.350 -6.371 -3.621 199 HB3 GLU 31 HB1 GLU 31 12.289 -7.327 -5.077 200 HG2 GLU 31 HG2 GLU 31 14.480 -7.321 -3.023 201 HG3 GLU 31 HG1 GLU 31 13.288 -8.594 -3.287 202 H LEU 32 HN LEU 32 12.463 -3.515 -5.300 203 HA LEU 32 HA LEU 32 11.188 -4.120 -7.871 204 HB2 LEU 32 HB2 LEU 32 10.424 -2.337 -5.581 205 HB3 LEU 32 HB1 LEU 32 9.627 -2.243 -7.139 206 HG LEU 32 HG LEU 32 9.717 -4.700 -5.388 207 HD11 LEU 32 HD11 LEU 32 7.488 -2.734 -5.870 208 HD12 LEU 32 HD12 LEU 32 8.401 -2.924 -4.372 209 HD13 LEU 32 HD13 LEU 32 7.366 -4.231 -4.946 210 HD21 LEU 32 HD21 LEU 32 9.511 -5.269 -7.734 211 HD22 LEU 32 HD22 LEU 32 8.201 -4.107 -7.927 212 HD23 LEU 32 HD23 LEU 32 7.972 -5.534 -6.916 213 H GLY 33 HN GLY 33 13.627 -2.306 -6.480 214 HA2 GLY 33 HA2 GLY 33 15.041 -0.730 -7.371 215 HA3 GLY 33 HA1 GLY 33 14.170 -0.890 -8.890 216 H ILE 34 HN ILE 34 12.755 0.036 -5.790 217 HA ILE 34 HA ILE 34 11.751 2.464 -7.061 218 HB ILE 34 HB ILE 34 11.113 1.439 -4.290 219 HG12 ILE 34 HG12 ILE 34 9.541 1.019 -6.854 220 HG13 ILE 34 HG11 ILE 34 10.521 -0.214 -6.065 221 HG21 ILE 34 HG21 ILE 34 10.610 3.782 -4.602 222 HG22 ILE 34 HG22 ILE 34 9.111 2.855 -4.536 223 HG23 ILE 34 HG23 ILE 34 9.728 3.425 -6.086 224 HD11 ILE 34 HD11 ILE 34 9.087 -0.094 -4.101 225 HD12 ILE 34 HD12 ILE 34 8.169 -0.485 -5.554 226 HD13 ILE 34 HD13 ILE 34 8.113 1.147 -4.889 227 H VAL 35 HN VAL 35 12.548 4.436 -6.665 228 HA VAL 35 HA VAL 35 14.525 4.757 -4.554 229 HB VAL 35 HB VAL 35 15.162 5.718 -6.672 230 HG11 VAL 35 HG11 VAL 35 13.020 6.082 -7.701 231 HG12 VAL 35 HG12 VAL 35 13.915 7.602 -7.680 232 HG13 VAL 35 HG13 VAL 35 12.618 7.324 -6.517 233 HG21 VAL 35 HG21 VAL 35 15.913 6.908 -4.705 234 HG22 VAL 35 HG22 VAL 35 14.434 7.868 -4.690 235 HG23 VAL 35 HG23 VAL 35 15.589 8.046 -6.011 236 H LEU 36 HN LEU 36 13.834 5.232 -2.606 237 HA LEU 36 HA LEU 36 11.232 6.407 -2.185 238 HB2 LEU 36 HB2 LEU 36 12.026 6.287 0.283 239 HB3 LEU 36 HB1 LEU 36 11.609 4.813 -0.550 240 HG LEU 36 HG LEU 36 14.221 4.792 -1.052 241 HD11 LEU 36 HD11 LEU 36 14.642 6.936 0.009 242 HD12 LEU 36 HD12 LEU 36 15.493 5.629 0.832 243 HD13 LEU 36 HD13 LEU 36 14.023 6.305 1.533 244 HD21 LEU 36 HD21 LEU 36 13.146 2.980 0.005 245 HD22 LEU 36 HD22 LEU 36 12.834 3.921 1.460 246 HD23 LEU 36 HD23 LEU 36 14.484 3.455 1.051 247 H GLU 37 HN GLU 37 10.773 8.430 -1.715 248 HA GLU 37 HA GLU 37 12.891 10.411 -1.551 249 HB2 GLU 37 HB2 GLU 37 9.873 10.666 -1.503 250 HB3 GLU 37 HB1 GLU 37 10.988 12.025 -1.468 251 HG2 GLU 37 HG2 GLU 37 10.845 10.008 -3.694 252 HG3 GLU 37 HG1 GLU 37 10.013 11.562 -3.699 253 H ASP 38 HN ASP 38 10.438 8.895 0.399 254 HA ASP 38 HA ASP 38 11.828 9.707 2.814 255 HB2 ASP 38 HB2 ASP 38 8.885 10.166 2.280 256 HB3 ASP 38 HB1 ASP 38 9.550 10.090 3.905 257 HA PRO 39 HA PRO 39 11.075 5.260 2.688 258 HB2 PRO 39 HB2 PRO 39 12.845 4.613 4.652 259 HB3 PRO 39 HB1 PRO 39 13.342 4.964 2.996 260 HG2 PRO 39 HG2 PRO 39 13.396 6.734 5.404 261 HG3 PRO 39 HG1 PRO 39 14.612 6.538 4.130 262 HD2 PRO 39 HD2 PRO 39 12.879 8.619 4.194 263 HD3 PRO 39 HD1 PRO 39 13.502 7.940 2.678 264 H THR 40 HN THR 40 10.284 7.544 4.945 265 HA THR 40 HA THR 40 9.653 5.765 7.142 266 HB THR 40 HB THR 40 8.675 8.012 8.058 267 HG1 THR 40 HG1 THR 40 8.785 9.505 6.539 268 HG21 THR 40 HG21 THR 40 10.712 6.906 8.880 269 HG22 THR 40 HG22 THR 40 10.900 8.657 8.831 270 HG23 THR 40 HG23 THR 40 11.638 7.657 7.581 271 H VAL 41 HN VAL 41 8.181 6.156 4.334 272 HA VAL 41 HA VAL 41 5.463 6.428 5.355 273 HB VAL 41 HB VAL 41 4.725 6.346 3.048 274 HG11 VAL 41 HG11 VAL 41 7.116 8.151 3.360 275 HG12 VAL 41 HG12 VAL 41 5.481 8.487 3.929 276 HG13 VAL 41 HG13 VAL 41 5.803 8.360 2.200 277 HG21 VAL 41 HG21 VAL 41 7.612 5.902 2.300 278 HG22 VAL 41 HG22 VAL 41 6.266 6.130 1.182 279 HG23 VAL 41 HG23 VAL 41 6.328 4.695 2.206 280 H LEU 42 HN LEU 42 3.852 4.812 4.849 281 HA LEU 42 HA LEU 42 4.906 2.123 5.204 282 HB2 LEU 42 HB2 LEU 42 2.098 3.228 5.284 283 HB3 LEU 42 HB1 LEU 42 2.477 1.531 5.495 284 HG LEU 42 HG LEU 42 3.438 3.755 7.300 285 HD11 LEU 42 HD11 LEU 42 1.036 3.435 7.489 286 HD12 LEU 42 HD12 LEU 42 1.859 2.827 8.925 287 HD13 LEU 42 HD13 LEU 42 1.269 1.700 7.704 288 HD21 LEU 42 HD21 LEU 42 4.986 1.894 7.255 289 HD22 LEU 42 HD22 LEU 42 3.667 0.755 7.518 290 HD23 LEU 42 HD23 LEU 42 4.107 1.905 8.783 291 H ILE 43 HN ILE 43 5.202 0.790 3.569 292 HA ILE 43 HA ILE 43 3.697 1.310 1.104 293 HB ILE 43 HB ILE 43 5.453 -0.074 -0.048 294 HG12 ILE 43 HG12 ILE 43 7.074 0.437 2.449 295 HG13 ILE 43 HG11 ILE 43 6.346 -1.116 2.058 296 HG21 ILE 43 HG21 ILE 43 6.287 2.511 1.257 297 HG22 ILE 43 HG22 ILE 43 5.425 2.322 -0.269 298 HG23 ILE 43 HG23 ILE 43 7.093 1.774 -0.127 299 HD11 ILE 43 HD11 ILE 43 8.332 0.316 0.313 300 HD12 ILE 43 HD12 ILE 43 7.694 -1.311 0.083 301 HD13 ILE 43 HD13 ILE 43 8.737 -0.960 1.461 302 H GLY 44 HN GLY 44 2.735 -0.383 0.013 303 HA2 GLY 44 HA2 GLY 44 2.286 -2.756 1.712 304 HA3 GLY 44 HA1 GLY 44 1.036 -2.005 0.734 305 H ASP 45 HN ASP 45 2.399 -4.744 0.806 306 HA ASP 45 HA ASP 45 2.962 -4.896 -2.083 307 HB2 ASP 45 HB2 ASP 45 4.514 -6.026 -0.321 308 HB3 ASP 45 HB1 ASP 45 3.218 -7.189 -0.154 309 H GLY 46 HN GLY 46 1.736 -6.376 -3.353 310 HA2 GLY 46 HA2 GLY 46 -0.125 -7.611 -3.939 311 HA3 GLY 46 HA1 GLY 46 -0.161 -8.143 -2.287 312 H CYS 47 HN CYS 47 -0.603 -4.940 -3.705 313 HA CYS 47 HA CYS 47 -2.988 -4.663 -2.017 314 HB2 CYS 47 HB2 CYS 47 -0.756 -3.120 -2.089 315 HB3 CYS 47 HB1 CYS 47 -1.790 -2.269 -3.235 316 H ASP 48 HN ASP 48 -4.811 -4.872 -3.045 317 HA ASP 48 HA ASP 48 -5.008 -3.978 -5.832 318 HB2 ASP 48 HB2 ASP 48 -7.061 -5.534 -4.265 319 HB3 ASP 48 HB1 ASP 48 -7.050 -5.245 -5.995 320 HA PRO 49 HA PRO 49 -7.002 -0.273 -4.386 321 HB2 PRO 49 HB2 PRO 49 -8.125 -0.129 -7.095 322 HB3 PRO 49 HB1 PRO 49 -7.044 0.990 -6.270 323 HG2 PRO 49 HG2 PRO 49 -6.237 -0.595 -8.305 324 HG3 PRO 49 HG1 PRO 49 -5.161 -0.068 -7.000 325 HD2 PRO 49 HD2 PRO 49 -6.454 -2.715 -7.435 326 HD3 PRO 49 HD1 PRO 49 -4.882 -2.318 -6.719 327 H ILE 50 HN ILE 50 -8.848 -0.258 -3.239 328 HA ILE 50 HA ILE 50 -10.875 -2.226 -3.876 329 HB ILE 50 HB ILE 50 -11.084 -0.199 -1.657 330 HG12 ILE 50 HG12 ILE 50 -9.661 -2.871 -1.607 331 HG13 ILE 50 HG11 ILE 50 -8.900 -1.294 -1.455 332 HG21 ILE 50 HG21 ILE 50 -12.104 -3.021 -1.957 333 HG22 ILE 50 HG22 ILE 50 -13.059 -1.560 -2.236 334 HG23 ILE 50 HG23 ILE 50 -12.446 -1.922 -0.620 335 HD11 ILE 50 HD11 ILE 50 -9.081 -2.297 0.710 336 HD12 ILE 50 HD12 ILE 50 -10.807 -2.570 0.481 337 HD13 ILE 50 HD13 ILE 50 -10.186 -0.927 0.623 338 H THR 51 HN THR 51 -11.708 -1.487 -5.767 339 HA THR 51 HA THR 51 -13.319 0.967 -5.595 340 HB THR 51 HB THR 51 -11.361 1.269 -7.085 341 HG1 THR 51 HG1 THR 51 -13.586 2.154 -7.542 342 HG21 THR 51 HG21 THR 51 -11.074 -1.040 -7.816 343 HG22 THR 51 HG22 THR 51 -11.235 0.036 -9.204 344 HG23 THR 51 HG23 THR 51 -12.599 -0.963 -8.700 345 H VAL 52 HN VAL 52 -13.652 -2.120 -5.379 346 HA VAL 52 HA VAL 52 -15.595 -2.607 -7.477 347 HB VAL 52 HB VAL 52 -14.035 -4.400 -7.003 348 HG11 VAL 52 HG11 VAL 52 -13.539 -3.926 -4.676 349 HG12 VAL 52 HG12 VAL 52 -14.062 -5.601 -4.859 350 HG13 VAL 52 HG13 VAL 52 -15.175 -4.395 -4.212 351 HG21 VAL 52 HG21 VAL 52 -15.606 -6.236 -6.655 352 HG22 VAL 52 HG22 VAL 52 -16.269 -5.015 -7.743 353 HG23 VAL 52 HG23 VAL 52 -16.812 -5.091 -6.067 354 H ALA 53 HN ALA 53 -17.735 -2.550 -7.206 355 HA ALA 53 HA ALA 53 -18.737 -1.839 -4.548 356 HB1 ALA 53 HB1 ALA 53 -19.280 -0.318 -6.397 357 HB2 ALA 53 HB2 ALA 53 -20.728 -1.034 -5.691 358 HB3 ALA 53 HB3 ALA 53 -20.108 -1.635 -7.227 359 H GLY 54 HN GLY 54 -20.069 -3.122 -3.420 360 HA2 GLY 54 HA2 GLY 54 -21.767 -4.777 -3.199 361 HA3 GLY 54 HA1 GLY 54 -21.293 -5.429 -4.762 362 H SER 55 HN SER 55 -19.112 -4.578 -2.145 363 HA SER 55 HA SER 55 -18.607 -7.417 -1.649 364 HB2 SER 55 HB2 SER 55 -17.009 -6.470 -3.391 365 HB3 SER 55 HB1 SER 55 -16.370 -5.439 -2.113 366 HG SER 55 HG SER 55 -15.478 -7.732 -2.635 367 H SER 56 HN SER 56 -19.174 -7.526 0.444 368 HA SER 56 HA SER 56 -18.653 -5.418 2.306 369 HB2 SER 56 HB2 SER 56 -19.438 -8.281 2.870 370 HB3 SER 56 HB1 SER 56 -19.605 -6.908 3.962 371 HG SER 56 HG SER 56 -21.579 -7.231 3.004 372 H ASP 57 HN ASP 57 -17.203 -8.536 1.518 373 HA ASP 57 HA ASP 57 -14.942 -7.941 3.271 374 HB2 ASP 57 HB2 ASP 57 -15.869 -10.404 1.825 375 HB3 ASP 57 HB1 ASP 57 -14.195 -10.260 2.332 376 H ALA 58 HN ALA 58 -14.875 -6.075 1.585 377 HA ALA 58 HA ALA 58 -13.888 -6.640 -1.015 378 HB1 ALA 58 HB1 ALA 58 -15.134 -4.589 -0.424 379 HB2 ALA 58 HB2 ALA 58 -13.606 -4.260 -1.240 380 HB3 ALA 58 HB3 ALA 58 -13.737 -4.047 0.506 381 H CYS 59 HN CYS 59 -12.455 -6.545 2.024 382 HA CYS 59 HA CYS 59 -9.815 -6.764 0.765 383 HB2 CYS 59 HB2 CYS 59 -9.994 -4.561 1.870 384 HB3 CYS 59 HB1 CYS 59 -10.381 -5.368 3.388 385 H SER 60 HN SER 60 -8.686 -8.522 1.369 386 HA SER 60 HA SER 60 -9.875 -10.172 3.488 387 HB2 SER 60 HB2 SER 60 -9.916 -11.095 1.162 388 HB3 SER 60 HB1 SER 60 -8.157 -11.095 1.191 389 HG SER 60 HG SER 60 -8.152 -12.665 2.703 390 H ALA 61 HN ALA 61 -6.998 -8.525 2.498 391 HA ALA 61 HA ALA 61 -5.456 -9.953 4.546 392 HB1 ALA 61 HB1 ALA 61 -4.447 -9.867 2.309 393 HB2 ALA 61 HB2 ALA 61 -3.451 -9.056 3.517 394 HB3 ALA 61 HB3 ALA 61 -4.426 -8.106 2.397 395 H THR 62 HN THR 62 -5.024 -6.597 3.427 396 HA THR 62 HA THR 62 -5.833 -5.583 6.038 397 HB THR 62 HB THR 62 -3.064 -5.010 4.959 398 HG1 THR 62 HG1 THR 62 -4.015 -6.916 6.817 399 HG21 THR 62 HG21 THR 62 -2.694 -4.010 7.171 400 HG22 THR 62 HG22 THR 62 -4.365 -4.362 7.609 401 HG23 THR 62 HG23 THR 62 -4.016 -3.211 6.319 402 H ALA 63 HN ALA 63 -6.851 -3.669 5.817 403 HA ALA 63 HA ALA 63 -6.945 -2.491 3.164 404 HB1 ALA 63 HB1 ALA 63 -9.034 -2.954 4.409 405 HB2 ALA 63 HB2 ALA 63 -8.862 -1.259 3.951 406 HB3 ALA 63 HB3 ALA 63 -8.546 -1.758 5.612 407 H VAL 64 HN VAL 64 -6.105 -0.585 2.602 408 HA VAL 64 HA VAL 64 -5.113 1.240 4.658 409 HB VAL 64 HB VAL 64 -2.966 1.468 3.272 410 HG11 VAL 64 HG11 VAL 64 -3.467 -1.012 4.918 411 HG12 VAL 64 HG12 VAL 64 -2.912 0.556 5.506 412 HG13 VAL 64 HG13 VAL 64 -1.872 -0.412 4.464 413 HG21 VAL 64 HG21 VAL 64 -3.720 0.174 1.356 414 HG22 VAL 64 HG22 VAL 64 -3.859 -1.265 2.372 415 HG23 VAL 64 HG23 VAL 64 -2.275 -0.545 2.070 416 H CYS 65 HN CYS 65 -4.234 3.266 3.593 417 HA CYS 65 HA CYS 65 -5.647 3.878 1.089 418 HB2 CYS 65 HB2 CYS 65 -6.928 4.823 2.954 419 HB3 CYS 65 HB1 CYS 65 -5.485 5.620 3.559 420 H CYS 66 HN CYS 66 -4.180 4.460 -0.406 421 HA CYS 66 HA CYS 66 -1.600 5.495 0.535 422 HB2 CYS 66 HB2 CYS 66 -2.420 3.945 -1.857 423 HB3 CYS 66 HB1 CYS 66 -1.035 5.003 -1.995 424 H SER 67 HN SER 67 -0.547 7.115 -0.597 425 HA SER 67 HA SER 67 -2.382 9.168 -1.594 426 HB2 SER 67 HB2 SER 67 0.400 9.442 -0.456 427 HB3 SER 67 HB1 SER 67 -0.643 10.779 -0.941 428 HG SER 67 HG SER 67 -2.156 10.018 0.645 429 H ASP 68 HN ASP 68 0.171 7.127 -2.498 430 HA ASP 68 HA ASP 68 0.687 8.690 -4.933 431 HB2 ASP 68 HB2 ASP 68 2.642 8.044 -3.480 432 HB3 ASP 68 HB1 ASP 68 2.284 6.361 -3.849 433 H ASN 69 HN ASN 69 0.411 7.734 -6.958 434 HA ASN 69 HA ASN 69 -1.116 5.215 -6.899 435 HB2 ASN 69 HB2 ASN 69 -2.374 7.352 -7.507 436 HB3 ASN 69 HB1 ASN 69 -1.414 7.384 -8.979 437 HD21 ASN 69 HD21 ASN 69 -2.901 4.637 -7.279 438 HD22 ASN 69 HD22 ASN 69 -3.889 4.144 -8.608 439 H ASN 70 HN ASN 70 1.816 6.329 -7.629 440 HA ASN 70 HA ASN 70 2.081 5.007 -10.223 441 HB2 ASN 70 HB2 ASN 70 3.991 6.694 -8.602 442 HB3 ASN 70 HB1 ASN 70 4.473 5.847 -10.066 443 HD21 ASN 70 HD21 ASN 70 1.890 6.285 -11.369 444 HD22 ASN 70 HD22 ASN 70 1.869 7.948 -11.833 445 H VAL 71 HN VAL 71 1.390 3.126 -8.727 446 HA VAL 71 HA VAL 71 3.478 1.919 -7.167 447 HB VAL 71 HB VAL 71 1.870 0.100 -6.854 448 HG11 VAL 71 HG11 VAL 71 0.116 1.392 -5.723 449 HG12 VAL 71 HG12 VAL 71 0.645 2.842 -6.577 450 HG13 VAL 71 HG13 VAL 71 1.720 2.060 -5.418 451 HG21 VAL 71 HG21 VAL 71 0.868 0.056 -9.069 452 HG22 VAL 71 HG22 VAL 71 0.137 1.635 -8.785 453 HG23 VAL 71 HG23 VAL 71 -0.377 0.242 -7.834 454 H SER 72 HN SER 72 4.117 -0.379 -7.606 455 HA SER 72 HA SER 72 5.297 -0.503 -10.198 456 HB2 SER 72 HB2 SER 72 6.388 -2.523 -9.381 457 HB3 SER 72 HB1 SER 72 6.433 -1.283 -8.123 458 HG SER 72 HG SER 72 5.309 -3.737 -8.062 459 H GLY 73 HN GLY 73 2.294 -1.376 -9.104 460 HA2 GLY 73 HA2 GLY 73 0.867 -2.270 -10.971 461 HA3 GLY 73 HA1 GLY 73 2.052 -3.555 -11.069 462 H VAL 74 HN VAL 74 2.378 -3.800 -8.183 463 HA VAL 74 HA VAL 74 -0.323 -4.627 -7.404 464 HB VAL 74 HB VAL 74 0.391 -6.724 -6.549 465 HG11 VAL 74 HG11 VAL 74 1.291 -7.813 -8.649 466 HG12 VAL 74 HG12 VAL 74 1.347 -6.187 -9.347 467 HG13 VAL 74 HG13 VAL 74 -0.192 -6.874 -8.824 468 HG21 VAL 74 HG21 VAL 74 2.736 -7.519 -6.854 469 HG22 VAL 74 HG22 VAL 74 2.541 -6.217 -5.680 470 HG23 VAL 74 HG23 VAL 74 3.175 -5.866 -7.290 471 H ILE 75 HN ILE 75 2.408 -2.901 -6.564 472 HA ILE 75 HA ILE 75 2.037 -3.350 -3.705 473 HB ILE 75 HB ILE 75 3.923 -1.847 -3.354 474 HG12 ILE 75 HG12 ILE 75 4.251 -1.716 -6.339 475 HG13 ILE 75 HG11 ILE 75 3.379 -0.489 -5.441 476 HG21 ILE 75 HG21 ILE 75 4.445 -3.933 -5.445 477 HG22 ILE 75 HG22 ILE 75 4.337 -4.204 -3.705 478 HG23 ILE 75 HG23 ILE 75 5.646 -3.228 -4.368 479 HD11 ILE 75 HD11 ILE 75 5.362 0.017 -4.152 480 HD12 ILE 75 HD12 ILE 75 5.683 0.163 -5.881 481 HD13 ILE 75 HD13 ILE 75 6.242 -1.256 -4.995 482 H ALA 76 HN ALA 76 2.407 -1.160 -2.475 483 HA ALA 76 HA ALA 76 0.836 1.034 -3.609 484 HB1 ALA 76 HB1 ALA 76 0.242 -0.245 -0.937 485 HB2 ALA 76 HB2 ALA 76 -0.781 -0.319 -2.377 486 HB3 ALA 76 HB3 ALA 76 -0.509 1.224 -1.566 487 H ILE 77 HN ILE 77 1.447 3.067 -2.778 488 HA ILE 77 HA ILE 77 3.724 3.021 -0.912 489 HB ILE 77 HB ILE 77 3.485 4.781 -3.356 490 HG12 ILE 77 HG12 ILE 77 5.374 2.484 -2.799 491 HG13 ILE 77 HG11 ILE 77 3.982 2.406 -3.873 492 HG21 ILE 77 HG21 ILE 77 4.632 5.889 -1.511 493 HG22 ILE 77 HG22 ILE 77 5.765 5.494 -2.802 494 HG23 ILE 77 HG23 ILE 77 5.716 4.509 -1.340 495 HD11 ILE 77 HD11 ILE 77 4.990 4.080 -5.316 496 HD12 ILE 77 HD12 ILE 77 6.056 2.691 -5.106 497 HD13 ILE 77 HD13 ILE 77 6.376 4.189 -4.233 498 H GLY 78 HN GLY 78 3.558 4.323 0.773 499 HA2 GLY 78 HA2 GLY 78 2.977 6.132 2.078 500 HA3 GLY 78 HA1 GLY 78 2.299 6.896 0.646 501 H CYS 79 HN CYS 79 1.604 3.947 2.505 502 HA CYS 79 HA CYS 79 -1.245 4.585 2.262 503 HB2 CYS 79 HB2 CYS 79 0.329 2.134 2.159 504 HB3 CYS 79 HB1 CYS 79 -1.089 2.002 3.187 505 H LEU 80 HN LEU 80 -2.570 4.763 3.954 506 HA LEU 80 HA LEU 80 -1.454 4.363 6.650 507 HB2 LEU 80 HB2 LEU 80 -3.818 6.028 5.777 508 HB3 LEU 80 HB1 LEU 80 -3.260 5.831 7.432 509 HG LEU 80 HG LEU 80 -1.741 7.181 5.197 510 HD11 LEU 80 HD11 LEU 80 -3.049 8.277 7.683 511 HD12 LEU 80 HD12 LEU 80 -3.596 8.514 6.024 512 HD13 LEU 80 HD13 LEU 80 -2.059 9.201 6.553 513 HD21 LEU 80 HD21 LEU 80 -0.204 6.042 6.674 514 HD22 LEU 80 HD22 LEU 80 -1.005 6.727 8.086 515 HD23 LEU 80 HD23 LEU 80 -0.133 7.778 6.969 516 HA PRO 81 HA PRO 81 -4.083 0.814 6.992 517 HB2 PRO 81 HB2 PRO 81 -3.968 1.251 9.895 518 HB3 PRO 81 HB1 PRO 81 -3.379 -0.110 8.944 519 HG2 PRO 81 HG2 PRO 81 -1.708 1.643 10.095 520 HG3 PRO 81 HG1 PRO 81 -1.341 0.876 8.540 521 HD2 PRO 81 HD2 PRO 81 -2.347 3.639 9.096 522 HD3 PRO 81 HD1 PRO 81 -1.159 3.091 7.905 523 H VAL 82 HN VAL 82 -6.207 0.795 6.689 524 HA VAL 82 HA VAL 82 -7.905 2.377 8.473 525 HB VAL 82 HB VAL 82 -9.524 2.457 6.517 526 HG11 VAL 82 HG11 VAL 82 -6.946 4.009 6.356 527 HG12 VAL 82 HG12 VAL 82 -8.383 4.444 7.281 528 HG13 VAL 82 HG13 VAL 82 -8.437 4.442 5.520 529 HG21 VAL 82 HG21 VAL 82 -8.586 2.349 4.275 530 HG22 VAL 82 HG22 VAL 82 -8.435 0.799 5.102 531 HG23 VAL 82 HG23 VAL 82 -7.032 1.856 4.945 532 H THR 83 HN THR 83 -10.042 1.482 8.768 533 HA THR 83 HA THR 83 -10.028 -1.454 8.574 534 HB THR 83 HB THR 83 -11.547 0.285 10.520 535 HG1 THR 83 HG1 THR 83 -8.987 -0.359 10.506 536 HG21 THR 83 HG21 THR 83 -12.688 -1.809 10.167 537 HG22 THR 83 HG22 THR 83 -11.885 -1.858 11.738 538 HG23 THR 83 HG23 THR 83 -11.180 -2.706 10.361 539 H LEU 84 HN LEU 84 -11.634 -2.450 7.520 540 HA LEU 84 HA LEU 84 -13.259 -2.726 5.972 541 HB2 LEU 84 HB2 LEU 84 -14.483 -1.209 8.214 542 HB3 LEU 84 HB1 LEU 84 -15.451 -1.500 6.781 543 HG LEU 84 HG LEU 84 -15.137 -3.917 7.058 544 HD11 LEU 84 HD11 LEU 84 -13.765 -3.280 9.652 545 HD12 LEU 84 HD12 LEU 84 -12.932 -3.799 8.190 546 HD13 LEU 84 HD13 LEU 84 -14.088 -4.874 8.974 547 HD21 LEU 84 HD21 LEU 84 -16.100 -2.562 9.568 548 HD22 LEU 84 HD22 LEU 84 -16.531 -4.185 9.028 549 HD23 LEU 84 HD23 LEU 84 -17.050 -2.781 8.097 Start of MODEL 3 1 H1 GLY 1 HT1 GLY 1 -18.344 6.826 -8.738 2 H2 GLY 1 HT2 GLY 1 -16.864 6.813 -7.925 3 H3 GLY 1 HT3 GLY 1 -17.913 8.122 -7.741 4 HA2 GLY 1 HA1 GLY 1 -18.025 6.743 -5.792 5 HA3 GLY 1 HA2 GLY 1 -19.547 6.683 -6.672 6 H SER 2 HN SER 2 -19.326 4.684 -5.049 7 HA SER 2 HA SER 2 -19.130 2.444 -4.738 8 HB2 SER 2 HB2 SER 2 -19.306 2.411 -7.761 9 HB3 SER 2 HB1 SER 2 -19.571 1.022 -6.706 10 HG SER 2 HG SER 2 -21.079 3.436 -6.693 11 H TRP 3 HN TRP 3 -16.802 3.528 -4.355 12 HA TRP 3 HA TRP 3 -14.888 1.700 -5.606 13 HB2 TRP 3 HB2 TRP 3 -14.798 3.866 -6.827 14 HB3 TRP 3 HB1 TRP 3 -14.441 4.683 -5.316 15 HD1 TRP 3 HD1 TRP 3 -11.979 4.153 -4.214 16 HE1 TRP 3 HE1 TRP 3 -9.754 3.551 -5.363 17 HE3 TRP 3 HE3 TRP 3 -13.799 2.671 -8.754 18 HZ2 TRP 3 HZ2 TRP 3 -8.894 2.565 -7.867 19 HZ3 TRP 3 HZ3 TRP 3 -12.208 1.916 -10.473 20 HH2 TRP 3 HH2 TRP 3 -9.808 1.866 -10.038 21 H GLY 4 HN GLY 4 -14.616 4.494 -3.431 22 HA2 GLY 4 HA2 GLY 4 -14.425 3.835 -0.966 23 HA3 GLY 4 HA1 GLY 4 -13.174 2.744 -1.550 24 H GLN 5 HN GLN 5 -14.106 6.169 -1.638 25 HA GLN 5 HA GLN 5 -11.328 6.918 -1.999 26 HB2 GLN 5 HB2 GLN 5 -12.902 8.037 -3.425 27 HB3 GLN 5 HB1 GLN 5 -13.907 8.483 -2.054 28 HG2 GLN 5 HG2 GLN 5 -12.201 9.952 -1.234 29 HG3 GLN 5 HG1 GLN 5 -11.110 9.471 -2.532 30 HE21 GLN 5 HE21 GLN 5 -11.515 10.183 -4.632 31 HE22 GLN 5 HE22 GLN 5 -12.572 11.512 -4.959 32 H CYS 6 HN CYS 6 -10.126 7.142 -0.276 33 HA CYS 6 HA CYS 6 -11.291 7.818 2.308 34 HB2 CYS 6 HB2 CYS 6 -8.892 7.387 3.071 35 HB3 CYS 6 HB1 CYS 6 -9.750 6.003 2.392 36 H SER 7 HN SER 7 -8.857 8.979 0.046 37 HA SER 7 HA SER 7 -9.168 11.688 1.051 38 HB2 SER 7 HB2 SER 7 -6.706 11.967 1.222 39 HB3 SER 7 HB1 SER 7 -7.293 10.744 2.341 40 HG SER 7 HG SER 7 -6.244 9.244 1.285 41 H THR 8 HN THR 8 -6.926 12.665 -0.547 42 HA THR 8 HA THR 8 -8.072 12.826 -3.101 43 HB THR 8 HB THR 8 -5.130 13.208 -2.560 44 HG1 THR 8 HG1 THR 8 -5.787 14.561 -1.050 45 HG21 THR 8 HG21 THR 8 -7.079 14.643 -4.370 46 HG22 THR 8 HG22 THR 8 -5.886 13.448 -4.882 47 HG23 THR 8 HG23 THR 8 -5.357 14.995 -4.219 48 H GLY 9 HN GLY 9 -6.032 10.475 -1.618 49 HA2 GLY 9 HA2 GLY 9 -5.168 9.252 -4.093 50 HA3 GLY 9 HA1 GLY 9 -4.869 8.656 -2.469 51 H SER 10 HN SER 10 -5.585 6.627 -2.469 52 HA SER 10 HA SER 10 -8.385 6.098 -3.030 53 HB2 SER 10 HB2 SER 10 -7.289 5.776 -5.214 54 HB3 SER 10 HB1 SER 10 -6.156 4.645 -4.483 55 HG SER 10 HG SER 10 -7.888 3.257 -4.044 56 H ILE 11 HN ILE 11 -9.127 4.162 -2.044 57 HA ILE 11 HA ILE 11 -7.352 3.061 -0.029 58 HB ILE 11 HB ILE 11 -10.269 2.561 -0.622 59 HG12 ILE 11 HG12 ILE 11 -8.798 3.902 1.645 60 HG13 ILE 11 HG11 ILE 11 -9.820 4.677 0.443 61 HG21 ILE 11 HG21 ILE 11 -9.223 0.487 0.178 62 HG22 ILE 11 HG22 ILE 11 -10.347 1.159 1.359 63 HG23 ILE 11 HG23 ILE 11 -8.609 1.352 1.587 64 HD11 ILE 11 HD11 ILE 11 -10.723 2.717 2.531 65 HD12 ILE 11 HD12 ILE 11 -11.756 3.492 1.330 66 HD13 ILE 11 HD13 ILE 11 -10.963 4.463 2.570 67 H GLN 12 HN GLN 12 -6.523 1.067 -0.019 68 HA GLN 12 HA GLN 12 -7.305 -0.824 -2.094 69 HB2 GLN 12 HB2 GLN 12 -4.763 -1.412 -2.265 70 HB3 GLN 12 HB1 GLN 12 -5.455 -0.149 -3.265 71 HG2 GLN 12 HG2 GLN 12 -4.239 0.552 -0.646 72 HG3 GLN 12 HG1 GLN 12 -3.193 0.181 -2.007 73 HE21 GLN 12 HE21 GLN 12 -4.819 1.307 -4.052 74 HE22 GLN 12 HE22 GLN 12 -4.776 3.017 -3.846 75 H CYS 13 HN CYS 13 -6.396 -2.986 -1.710 76 HA CYS 13 HA CYS 13 -6.320 -3.535 1.172 77 HB2 CYS 13 HB2 CYS 13 -8.229 -4.559 0.133 78 HB3 CYS 13 HB1 CYS 13 -7.250 -5.213 -1.175 79 H CYS 14 HN CYS 14 -4.241 -3.628 1.739 80 HA CYS 14 HA CYS 14 -2.264 -4.670 -0.110 81 HB2 CYS 14 HB2 CYS 14 -2.089 -3.295 2.549 82 HB3 CYS 14 HB1 CYS 14 -0.688 -4.060 1.807 83 H GLN 15 HN GLN 15 -1.574 -6.637 -0.120 84 HA GLN 15 HA GLN 15 -2.302 -8.568 1.789 85 HB2 GLN 15 HB2 GLN 15 -1.700 -9.910 0.107 86 HB3 GLN 15 HB1 GLN 15 -1.143 -8.506 -0.776 87 HG2 GLN 15 HG2 GLN 15 0.614 -10.048 -0.814 88 HG3 GLN 15 HG1 GLN 15 1.085 -8.820 0.354 89 HE21 GLN 15 HE21 GLN 15 -1.277 -11.331 0.986 90 HE22 GLN 15 HE22 GLN 15 -0.329 -12.194 2.143 91 H ASN 16 HN ASN 16 0.468 -6.490 1.380 92 HA ASN 16 HA ASN 16 1.393 -7.256 4.060 93 HB2 ASN 16 HB2 ASN 16 2.696 -8.132 1.845 94 HB3 ASN 16 HB1 ASN 16 3.476 -6.580 2.112 95 HD21 ASN 16 HD21 ASN 16 4.488 -9.297 2.334 96 HD22 ASN 16 HD22 ASN 16 5.133 -9.427 3.937 97 H VAL 17 HN VAL 17 1.194 -5.432 5.200 98 HA VAL 17 HA VAL 17 1.825 -2.871 3.911 99 HB VAL 17 HB VAL 17 0.476 -3.338 6.583 100 HG11 VAL 17 HG11 VAL 17 -0.072 -0.954 6.472 101 HG12 VAL 17 HG12 VAL 17 0.837 -0.813 4.967 102 HG13 VAL 17 HG13 VAL 17 1.674 -1.210 6.468 103 HG21 VAL 17 HG21 VAL 17 -1.577 -2.634 5.460 104 HG22 VAL 17 HG22 VAL 17 -0.916 -4.100 4.733 105 HG23 VAL 17 HG23 VAL 17 -0.709 -2.544 3.928 106 H VAL 18 HN VAL 18 3.921 -2.423 4.057 107 HA VAL 18 HA VAL 18 5.266 -2.878 6.635 108 HB VAL 18 HB VAL 18 7.324 -3.514 5.372 109 HG11 VAL 18 HG11 VAL 18 4.901 -5.269 5.008 110 HG12 VAL 18 HG12 VAL 18 6.002 -5.247 6.386 111 HG13 VAL 18 HG13 VAL 18 6.568 -5.806 4.814 112 HG21 VAL 18 HG21 VAL 18 6.773 -2.534 3.217 113 HG22 VAL 18 HG22 VAL 18 5.432 -3.663 3.026 114 HG23 VAL 18 HG23 VAL 18 7.091 -4.260 3.045 115 HA PRO 19 HA PRO 19 6.749 1.322 6.154 116 HB2 PRO 19 HB2 PRO 19 9.036 0.340 7.738 117 HB3 PRO 19 HB1 PRO 19 7.954 1.698 8.055 118 HG2 PRO 19 HG2 PRO 19 7.790 -0.571 9.467 119 HG3 PRO 19 HG1 PRO 19 6.347 0.365 9.042 120 HD2 PRO 19 HD2 PRO 19 7.390 -2.165 7.843 121 HD3 PRO 19 HD1 PRO 19 5.713 -1.658 8.135 122 H GLY 20 HN GLY 20 8.076 2.272 4.707 123 HA2 GLY 20 HA2 GLY 20 9.326 0.676 2.758 124 HA3 GLY 20 HA1 GLY 20 9.485 2.416 2.902 125 H ASP 21 HN ASP 21 10.609 2.129 5.655 126 HA ASP 21 HA ASP 21 13.325 1.341 4.871 127 HB2 ASP 21 HB2 ASP 21 12.993 3.626 5.771 128 HB3 ASP 21 HB1 ASP 21 12.404 2.926 7.269 129 H SER 22 HN SER 22 10.796 -0.173 6.081 130 HA SER 22 HA SER 22 11.863 -1.476 8.387 131 HB2 SER 22 HB2 SER 22 9.476 -1.498 8.086 132 HB3 SER 22 HB1 SER 22 9.621 -2.192 6.479 133 HG SER 22 HG SER 22 9.668 -3.400 8.953 134 H ASP 23 HN ASP 23 12.518 -3.760 8.443 135 HA ASP 23 HA ASP 23 14.500 -4.444 6.614 136 HB2 ASP 23 HB2 ASP 23 12.822 -6.176 8.435 137 HB3 ASP 23 HB1 ASP 23 14.125 -6.831 7.455 138 H LEU 24 HN LEU 24 11.102 -5.378 6.727 139 HA LEU 24 HA LEU 24 11.196 -6.979 4.377 140 HB2 LEU 24 HB2 LEU 24 9.126 -5.974 6.195 141 HB3 LEU 24 HB1 LEU 24 8.593 -6.173 4.537 142 HG LEU 24 HG LEU 24 9.847 -8.346 6.217 143 HD11 LEU 24 HD11 LEU 24 6.974 -7.924 5.411 144 HD12 LEU 24 HD12 LEU 24 7.629 -7.718 7.034 145 HD13 LEU 24 HD13 LEU 24 7.613 -9.314 6.286 146 HD21 LEU 24 HD21 LEU 24 8.615 -8.369 3.466 147 HD22 LEU 24 HD22 LEU 24 9.056 -9.810 4.382 148 HD23 LEU 24 HD23 LEU 24 10.303 -8.674 3.872 149 H GLY 25 HN GLY 25 9.796 -3.756 4.952 150 HA2 GLY 25 HA2 GLY 25 9.041 -3.202 2.348 151 HA3 GLY 25 HA1 GLY 25 9.441 -1.983 3.545 152 H THR 26 HN THR 26 12.188 -2.737 3.852 153 HA THR 26 HA THR 26 13.274 -1.170 1.755 154 HB THR 26 HB THR 26 14.717 -2.855 3.811 155 HG1 THR 26 HG1 THR 26 13.595 -1.312 4.901 156 HG21 THR 26 HG21 THR 26 16.126 -2.221 1.867 157 HG22 THR 26 HG22 THR 26 16.651 -1.480 3.378 158 HG23 THR 26 HG23 THR 26 15.754 -0.528 2.197 159 H LEU 27 HN LEU 27 13.499 -4.610 2.563 160 HA LEU 27 HA LEU 27 15.103 -5.355 0.375 161 HB2 LEU 27 HB2 LEU 27 14.585 -6.686 2.474 162 HB3 LEU 27 HB1 LEU 27 13.035 -7.065 1.759 163 HG LEU 27 HG LEU 27 14.829 -8.844 1.591 164 HD11 LEU 27 HD11 LEU 27 13.597 -7.857 -0.971 165 HD12 LEU 27 HD12 LEU 27 12.828 -8.910 0.218 166 HD13 LEU 27 HD13 LEU 27 14.230 -9.478 -0.687 167 HD21 LEU 27 HD21 LEU 27 16.491 -8.620 -0.154 168 HD22 LEU 27 HD22 LEU 27 16.689 -7.342 1.046 169 HD23 LEU 27 HD23 LEU 27 15.932 -6.986 -0.508 170 H LEU 28 HN LEU 28 11.639 -4.943 0.778 171 HA LEU 28 HA LEU 28 10.910 -6.284 -1.618 172 HB2 LEU 28 HB2 LEU 28 9.335 -4.213 -0.088 173 HB3 LEU 28 HB1 LEU 28 8.700 -5.318 -1.286 174 HG LEU 28 HG LEU 28 9.608 -5.911 1.511 175 HD11 LEU 28 HD11 LEU 28 7.423 -6.967 1.667 176 HD12 LEU 28 HD12 LEU 28 7.097 -6.557 -0.016 177 HD13 LEU 28 HD13 LEU 28 7.289 -5.278 1.181 178 HD21 LEU 28 HD21 LEU 28 9.204 -7.923 -0.694 179 HD22 LEU 28 HD22 LEU 28 9.370 -8.301 1.021 180 HD23 LEU 28 HD23 LEU 28 10.712 -7.565 0.148 181 H LEU 29 HN LEU 29 11.421 -2.854 -0.802 182 HA LEU 29 HA LEU 29 10.762 -2.094 -3.510 183 HB2 LEU 29 HB2 LEU 29 11.215 0.183 -2.815 184 HB3 LEU 29 HB1 LEU 29 10.114 -0.606 -1.720 185 HG LEU 29 HG LEU 29 12.145 -0.943 -0.192 186 HD11 LEU 29 HD11 LEU 29 13.260 1.191 -2.009 187 HD12 LEU 29 HD12 LEU 29 13.895 -0.444 -1.820 188 HD13 LEU 29 HD13 LEU 29 13.947 0.684 -0.466 189 HD21 LEU 29 HD21 LEU 29 11.944 1.379 0.655 190 HD22 LEU 29 HD22 LEU 29 10.393 0.606 0.326 191 HD23 LEU 29 HD23 LEU 29 11.047 1.789 -0.809 192 H ASP 30 HN ASP 30 13.593 -2.907 -1.748 193 HA ASP 30 HA ASP 30 15.530 -1.778 -3.476 194 HB2 ASP 30 HB2 ASP 30 16.027 -2.745 -1.229 195 HB3 ASP 30 HB1 ASP 30 15.721 -4.347 -1.884 196 H GLU 31 HN GLU 31 13.633 -4.681 -3.512 197 HA GLU 31 HA GLU 31 14.936 -5.930 -5.731 198 HB2 GLU 31 HB2 GLU 31 13.149 -6.713 -3.785 199 HB3 GLU 31 HB1 GLU 31 12.124 -6.625 -5.209 200 HG2 GLU 31 HG2 GLU 31 14.647 -8.233 -4.944 201 HG3 GLU 31 HG1 GLU 31 13.004 -8.862 -4.859 202 H LEU 32 HN LEU 32 12.321 -3.720 -5.222 203 HA LEU 32 HA LEU 32 11.353 -3.905 -7.946 204 HB2 LEU 32 HB2 LEU 32 10.488 -2.388 -5.507 205 HB3 LEU 32 HB1 LEU 32 9.733 -2.140 -7.068 206 HG LEU 32 HG LEU 32 9.816 -4.758 -5.565 207 HD11 LEU 32 HD11 LEU 32 7.561 -2.805 -5.981 208 HD12 LEU 32 HD12 LEU 32 8.401 -3.120 -4.461 209 HD13 LEU 32 HD13 LEU 32 7.430 -4.387 -5.210 210 HD21 LEU 32 HD21 LEU 32 9.742 -5.131 -7.952 211 HD22 LEU 32 HD22 LEU 32 8.427 -3.970 -8.123 212 HD23 LEU 32 HD23 LEU 32 8.162 -5.479 -7.250 213 H GLY 33 HN GLY 33 13.682 -2.146 -6.296 214 HA2 GLY 33 HA2 GLY 33 15.069 -0.443 -6.951 215 HA3 GLY 33 HA1 GLY 33 14.381 -0.603 -8.558 216 H ILE 34 HN ILE 34 12.867 0.311 -5.473 217 HA ILE 34 HA ILE 34 11.597 2.543 -6.856 218 HB ILE 34 HB ILE 34 11.150 1.611 -4.017 219 HG12 ILE 34 HG12 ILE 34 9.527 0.965 -6.498 220 HG13 ILE 34 HG11 ILE 34 10.649 -0.149 -5.719 221 HG21 ILE 34 HG21 ILE 34 10.449 3.905 -4.431 222 HG22 ILE 34 HG22 ILE 34 9.050 2.856 -4.202 223 HG23 ILE 34 HG23 ILE 34 9.502 3.379 -5.823 224 HD11 ILE 34 HD11 ILE 34 8.379 -0.639 -5.082 225 HD12 ILE 34 HD12 ILE 34 8.157 1.011 -4.499 226 HD13 ILE 34 HD13 ILE 34 9.289 -0.069 -3.686 227 H VAL 35 HN VAL 35 12.255 4.578 -6.680 228 HA VAL 35 HA VAL 35 14.238 5.313 -4.705 229 HB VAL 35 HB VAL 35 14.520 6.258 -6.914 230 HG11 VAL 35 HG11 VAL 35 12.928 7.832 -7.886 231 HG12 VAL 35 HG12 VAL 35 11.825 7.550 -6.540 232 HG13 VAL 35 HG13 VAL 35 12.202 6.242 -7.659 233 HG21 VAL 35 HG21 VAL 35 14.634 8.655 -6.354 234 HG22 VAL 35 HG22 VAL 35 15.276 7.625 -5.075 235 HG23 VAL 35 HG23 VAL 35 13.672 8.342 -4.911 236 H LEU 36 HN LEU 36 13.790 6.111 -2.778 237 HA LEU 36 HA LEU 36 11.005 6.699 -2.156 238 HB2 LEU 36 HB2 LEU 36 11.928 6.654 0.243 239 HB3 LEU 36 HB1 LEU 36 11.788 5.144 -0.621 240 HG LEU 36 HG LEU 36 14.325 5.718 -1.236 241 HD11 LEU 36 HD11 LEU 36 13.898 7.032 1.432 242 HD12 LEU 36 HD12 LEU 36 14.364 7.831 -0.068 243 HD13 LEU 36 HD13 LEU 36 15.461 6.680 0.697 244 HD21 LEU 36 HD21 LEU 36 13.284 4.427 1.269 245 HD22 LEU 36 HD22 LEU 36 14.963 4.335 0.744 246 HD23 LEU 36 HD23 LEU 36 13.686 3.656 -0.263 247 H GLU 37 HN GLU 37 10.271 8.647 -1.754 248 HA GLU 37 HA GLU 37 12.096 10.904 -1.526 249 HB2 GLU 37 HB2 GLU 37 9.069 10.859 -1.492 250 HB3 GLU 37 HB1 GLU 37 10.086 12.282 -1.651 251 HG2 GLU 37 HG2 GLU 37 9.903 10.031 -3.641 252 HG3 GLU 37 HG1 GLU 37 9.105 11.596 -3.782 253 H ASP 38 HN ASP 38 9.944 8.940 0.342 254 HA ASP 38 HA ASP 38 11.083 9.971 2.794 255 HB2 ASP 38 HB2 ASP 38 8.965 11.247 2.519 256 HB3 ASP 38 HB1 ASP 38 8.086 9.729 2.366 257 HA PRO 39 HA PRO 39 11.080 5.489 2.551 258 HB2 PRO 39 HB2 PRO 39 13.050 5.064 4.354 259 HB3 PRO 39 HB1 PRO 39 13.380 5.634 2.718 260 HG2 PRO 39 HG2 PRO 39 13.237 7.185 5.270 261 HG3 PRO 39 HG1 PRO 39 14.401 7.326 3.939 262 HD2 PRO 39 HD2 PRO 39 12.277 9.009 4.267 263 HD3 PRO 39 HD1 PRO 39 12.993 8.638 2.686 264 H THR 40 HN THR 40 9.914 7.464 4.937 265 HA THR 40 HA THR 40 9.724 5.291 6.910 266 HB THR 40 HB THR 40 9.044 6.995 8.553 267 HG1 THR 40 HG1 THR 40 8.881 8.578 6.309 268 HG21 THR 40 HG21 THR 40 11.387 6.402 8.363 269 HG22 THR 40 HG22 THR 40 11.229 8.120 8.726 270 HG23 THR 40 HG23 THR 40 11.609 7.597 7.087 271 H VAL 41 HN VAL 41 8.028 6.313 4.393 272 HA VAL 41 HA VAL 41 5.377 6.287 5.497 273 HB VAL 41 HB VAL 41 4.584 6.248 3.207 274 HG11 VAL 41 HG11 VAL 41 6.951 8.085 3.505 275 HG12 VAL 41 HG12 VAL 41 5.316 8.388 4.095 276 HG13 VAL 41 HG13 VAL 41 5.624 8.290 2.361 277 HG21 VAL 41 HG21 VAL 41 6.094 6.111 1.300 278 HG22 VAL 41 HG22 VAL 41 6.176 4.645 2.277 279 HG23 VAL 41 HG23 VAL 41 7.462 5.849 2.388 280 H LEU 42 HN LEU 42 3.771 4.657 4.841 281 HA LEU 42 HA LEU 42 4.854 1.964 5.084 282 HB2 LEU 42 HB2 LEU 42 2.046 3.060 5.208 283 HB3 LEU 42 HB1 LEU 42 2.408 1.346 5.263 284 HG LEU 42 HG LEU 42 3.423 3.351 7.280 285 HD11 LEU 42 HD11 LEU 42 1.743 2.399 8.788 286 HD12 LEU 42 HD12 LEU 42 1.102 1.432 7.460 287 HD13 LEU 42 HD13 LEU 42 0.996 3.192 7.401 288 HD21 LEU 42 HD21 LEU 42 4.829 1.389 7.087 289 HD22 LEU 42 HD22 LEU 42 3.422 0.336 7.223 290 HD23 LEU 42 HD23 LEU 42 3.917 1.327 8.594 291 H ILE 43 HN ILE 43 5.247 0.795 3.348 292 HA ILE 43 HA ILE 43 3.747 1.409 0.910 293 HB ILE 43 HB ILE 43 5.469 -0.035 -0.250 294 HG12 ILE 43 HG12 ILE 43 7.066 0.433 2.271 295 HG13 ILE 43 HG11 ILE 43 6.331 -1.107 1.849 296 HG21 ILE 43 HG21 ILE 43 6.371 2.515 1.074 297 HG22 ILE 43 HG22 ILE 43 5.459 2.374 -0.429 298 HG23 ILE 43 HG23 ILE 43 7.118 1.782 -0.345 299 HD11 ILE 43 HD11 ILE 43 7.703 -1.244 -0.142 300 HD12 ILE 43 HD12 ILE 43 8.710 -1.025 1.289 301 HD13 ILE 43 HD13 ILE 43 8.400 0.335 0.211 302 H GLY 44 HN GLY 44 2.485 -0.052 -0.043 303 HA2 GLY 44 HA2 GLY 44 1.954 -2.455 1.566 304 HA3 GLY 44 HA1 GLY 44 0.764 -1.609 0.600 305 H ASP 45 HN ASP 45 3.034 -4.104 0.701 306 HA ASP 45 HA ASP 45 3.135 -4.479 -2.172 307 HB2 ASP 45 HB2 ASP 45 5.076 -5.132 -0.809 308 HB3 ASP 45 HB1 ASP 45 4.072 -6.270 0.086 309 H GLY 46 HN GLY 46 1.929 -5.949 -3.325 310 HA2 GLY 46 HA2 GLY 46 0.288 -7.534 -3.728 311 HA3 GLY 46 HA1 GLY 46 0.337 -7.931 -2.037 312 H CYS 47 HN CYS 47 -0.330 -4.802 -3.506 313 HA CYS 47 HA CYS 47 -2.763 -4.716 -1.869 314 HB2 CYS 47 HB2 CYS 47 -0.667 -2.995 -1.913 315 HB3 CYS 47 HB1 CYS 47 -1.746 -2.233 -3.081 316 H ASP 48 HN ASP 48 -4.583 -5.039 -2.897 317 HA ASP 48 HA ASP 48 -4.781 -4.265 -5.718 318 HB2 ASP 48 HB2 ASP 48 -6.424 -5.873 -6.020 319 HB3 ASP 48 HB1 ASP 48 -5.409 -6.631 -4.808 320 HA PRO 49 HA PRO 49 -7.161 -0.650 -4.687 321 HB2 PRO 49 HB2 PRO 49 -8.495 -1.286 -7.264 322 HB3 PRO 49 HB1 PRO 49 -7.736 0.210 -6.733 323 HG2 PRO 49 HG2 PRO 49 -6.561 -1.399 -8.514 324 HG3 PRO 49 HG1 PRO 49 -5.626 -0.484 -7.319 325 HD2 PRO 49 HD2 PRO 49 -6.275 -3.384 -7.391 326 HD3 PRO 49 HD1 PRO 49 -4.853 -2.553 -6.743 327 H ILE 50 HN ILE 50 -8.774 -0.813 -3.227 328 HA ILE 50 HA ILE 50 -10.804 -2.850 -3.524 329 HB ILE 50 HB ILE 50 -10.763 -0.656 -1.443 330 HG12 ILE 50 HG12 ILE 50 -9.587 -3.441 -1.305 331 HG13 ILE 50 HG11 ILE 50 -8.677 -1.937 -1.314 332 HG21 ILE 50 HG21 ILE 50 -12.195 -2.159 -0.199 333 HG22 ILE 50 HG22 ILE 50 -12.037 -3.385 -1.455 334 HG23 ILE 50 HG23 ILE 50 -12.888 -1.875 -1.799 335 HD11 ILE 50 HD11 ILE 50 -9.764 -1.319 0.821 336 HD12 ILE 50 HD12 ILE 50 -8.795 -2.787 0.929 337 HD13 ILE 50 HD13 ILE 50 -10.553 -2.895 0.834 338 H THR 51 HN THR 51 -12.228 -2.479 -5.036 339 HA THR 51 HA THR 51 -13.401 0.210 -5.230 340 HB THR 51 HB THR 51 -12.117 -0.162 -7.201 341 HG1 THR 51 HG1 THR 51 -14.896 -0.317 -7.413 342 HG21 THR 51 HG21 THR 51 -13.536 -2.812 -7.452 343 HG22 THR 51 HG22 THR 51 -11.824 -2.552 -7.109 344 HG23 THR 51 HG23 THR 51 -12.486 -2.108 -8.683 345 H VAL 52 HN VAL 52 -14.092 -2.342 -3.759 346 HA VAL 52 HA VAL 52 -16.813 -2.694 -4.789 347 HB VAL 52 HB VAL 52 -15.602 -4.790 -4.570 348 HG11 VAL 52 HG11 VAL 52 -14.855 -5.607 -2.372 349 HG12 VAL 52 HG12 VAL 52 -15.249 -4.034 -1.675 350 HG13 VAL 52 HG13 VAL 52 -13.975 -4.168 -2.889 351 HG21 VAL 52 HG21 VAL 52 -17.991 -4.807 -4.110 352 HG22 VAL 52 HG22 VAL 52 -17.673 -4.476 -2.407 353 HG23 VAL 52 HG23 VAL 52 -17.151 -6.002 -3.121 354 H ALA 53 HN ALA 53 -18.502 -1.980 -3.632 355 HA ALA 53 HA ALA 53 -17.954 -0.549 -1.172 356 HB1 ALA 53 HB1 ALA 53 -19.389 0.504 -2.830 357 HB2 ALA 53 HB2 ALA 53 -20.285 0.204 -1.339 358 HB3 ALA 53 HB3 ALA 53 -20.516 -0.850 -2.735 359 H GLY 54 HN GLY 54 -17.369 -2.444 0.007 360 HA2 GLY 54 HA2 GLY 54 -19.543 -3.434 1.583 361 HA3 GLY 54 HA1 GLY 54 -18.846 -4.682 0.554 362 H SER 55 HN SER 55 -17.953 -2.190 2.902 363 HA SER 55 HA SER 55 -15.275 -2.960 3.199 364 HB2 SER 55 HB2 SER 55 -16.294 -0.757 3.860 365 HB3 SER 55 HB1 SER 55 -16.973 -1.563 5.271 366 HG SER 55 HG SER 55 -14.847 -0.431 5.468 367 H SER 56 HN SER 56 -18.140 -4.356 4.482 368 HA SER 56 HA SER 56 -17.302 -5.565 6.819 369 HB2 SER 56 HB2 SER 56 -18.912 -7.460 5.945 370 HB3 SER 56 HB1 SER 56 -19.552 -5.868 6.355 371 HG SER 56 HG SER 56 -20.074 -5.581 4.344 372 H ASP 57 HN ASP 57 -16.835 -6.640 3.479 373 HA ASP 57 HA ASP 57 -14.392 -7.969 4.269 374 HB2 ASP 57 HB2 ASP 57 -16.134 -9.749 4.508 375 HB3 ASP 57 HB1 ASP 57 -16.521 -9.545 2.802 376 H ALA 58 HN ALA 58 -13.891 -5.987 3.040 377 HA ALA 58 HA ALA 58 -14.155 -6.330 0.129 378 HB1 ALA 58 HB1 ALA 58 -13.675 -3.939 -0.032 379 HB2 ALA 58 HB2 ALA 58 -13.480 -3.854 1.718 380 HB3 ALA 58 HB3 ALA 58 -15.055 -4.237 1.025 381 H CYS 59 HN CYS 59 -12.072 -6.970 2.543 382 HA CYS 59 HA CYS 59 -9.765 -6.823 0.758 383 HB2 CYS 59 HB2 CYS 59 -9.613 -4.833 2.158 384 HB3 CYS 59 HB1 CYS 59 -9.806 -5.813 3.609 385 H SER 60 HN SER 60 -8.361 -8.513 0.955 386 HA SER 60 HA SER 60 -9.207 -10.660 2.755 387 HB2 SER 60 HB2 SER 60 -7.381 -10.787 0.361 388 HB3 SER 60 HB1 SER 60 -8.014 -12.161 1.262 389 HG SER 60 HG SER 60 -10.071 -10.646 0.541 390 H ALA 61 HN ALA 61 -7.149 -8.206 3.031 391 HA ALA 61 HA ALA 61 -5.379 -9.754 4.747 392 HB1 ALA 61 HB1 ALA 61 -3.340 -8.784 3.842 393 HB2 ALA 61 HB2 ALA 61 -4.276 -7.942 2.607 394 HB3 ALA 61 HB3 ALA 61 -4.203 -9.705 2.610 395 H THR 62 HN THR 62 -4.901 -6.433 3.576 396 HA THR 62 HA THR 62 -5.845 -5.382 6.146 397 HB THR 62 HB THR 62 -3.109 -4.734 5.019 398 HG1 THR 62 HG1 THR 62 -3.899 -6.350 7.236 399 HG21 THR 62 HG21 THR 62 -4.143 -2.876 6.254 400 HG22 THR 62 HG22 THR 62 -2.757 -3.541 7.122 401 HG23 THR 62 HG23 THR 62 -4.397 -3.942 7.637 402 H ALA 63 HN ALA 63 -6.930 -3.507 5.915 403 HA ALA 63 HA ALA 63 -7.173 -2.372 3.252 404 HB1 ALA 63 HB1 ALA 63 -9.202 -2.810 4.561 405 HB2 ALA 63 HB2 ALA 63 -9.034 -1.094 4.182 406 HB3 ALA 63 HB3 ALA 63 -8.644 -1.682 5.797 407 H VAL 64 HN VAL 64 -6.278 -0.506 2.614 408 HA VAL 64 HA VAL 64 -5.171 1.310 4.629 409 HB VAL 64 HB VAL 64 -3.091 1.490 3.156 410 HG11 VAL 64 HG11 VAL 64 -1.998 -0.411 4.280 411 HG12 VAL 64 HG12 VAL 64 -3.583 -1.035 4.737 412 HG13 VAL 64 HG13 VAL 64 -3.023 0.510 5.381 413 HG21 VAL 64 HG21 VAL 64 -4.000 0.265 1.251 414 HG22 VAL 64 HG22 VAL 64 -4.113 -1.193 2.240 415 HG23 VAL 64 HG23 VAL 64 -2.534 -0.503 1.863 416 H CYS 65 HN CYS 65 -4.258 3.289 3.566 417 HA CYS 65 HA CYS 65 -5.774 4.072 1.175 418 HB2 CYS 65 HB2 CYS 65 -7.009 4.963 3.051 419 HB3 CYS 65 HB1 CYS 65 -5.539 5.568 3.796 420 H CYS 66 HN CYS 66 -4.118 4.307 -0.261 421 HA CYS 66 HA CYS 66 -1.625 5.517 0.629 422 HB2 CYS 66 HB2 CYS 66 -2.452 3.883 -1.689 423 HB3 CYS 66 HB1 CYS 66 -1.184 5.068 -1.984 424 H SER 67 HN SER 67 -0.839 7.388 0.043 425 HA SER 67 HA SER 67 -2.637 9.279 -1.231 426 HB2 SER 67 HB2 SER 67 -1.595 9.900 0.895 427 HB3 SER 67 HB1 SER 67 0.004 9.654 0.192 428 HG SER 67 HG SER 67 -0.102 11.622 -0.503 429 H ASP 68 HN ASP 68 0.061 7.365 -1.996 430 HA ASP 68 HA ASP 68 0.984 9.182 -4.099 431 HB2 ASP 68 HB2 ASP 68 2.539 7.960 -2.416 432 HB3 ASP 68 HB1 ASP 68 2.262 6.548 -3.427 433 H ASN 69 HN ASN 69 1.501 8.220 -6.232 434 HA ASN 69 HA ASN 69 -0.649 6.359 -7.000 435 HB2 ASN 69 HB2 ASN 69 -1.023 8.737 -7.666 436 HB3 ASN 69 HB1 ASN 69 0.451 8.668 -8.620 437 HD21 ASN 69 HD21 ASN 69 0.418 7.716 -10.604 438 HD22 ASN 69 HD22 ASN 69 -1.024 7.107 -11.345 439 H ASN 70 HN ASN 70 2.651 6.709 -6.794 440 HA ASN 70 HA ASN 70 3.350 5.480 -9.317 441 HB2 ASN 70 HB2 ASN 70 4.869 7.103 -8.253 442 HB3 ASN 70 HB1 ASN 70 5.061 6.022 -6.878 443 HD21 ASN 70 HD21 ASN 70 4.907 5.025 -10.250 444 HD22 ASN 70 HD22 ASN 70 6.530 4.441 -10.332 445 H VAL 71 HN VAL 71 2.107 3.554 -9.167 446 HA VAL 71 HA VAL 71 3.014 1.604 -7.191 447 HB VAL 71 HB VAL 71 1.062 0.276 -7.946 448 HG11 VAL 71 HG11 VAL 71 -0.641 1.707 -6.903 449 HG12 VAL 71 HG12 VAL 71 0.450 3.087 -7.050 450 HG13 VAL 71 HG13 VAL 71 0.880 1.728 -6.010 451 HG21 VAL 71 HG21 VAL 71 0.399 2.718 -9.581 452 HG22 VAL 71 HG22 VAL 71 -0.655 1.326 -9.336 453 HG23 VAL 71 HG23 VAL 71 0.860 1.140 -10.218 454 H SER 72 HN SER 72 4.002 -0.279 -7.763 455 HA SER 72 HA SER 72 5.269 -0.364 -10.344 456 HB2 SER 72 HB2 SER 72 6.473 -2.290 -9.438 457 HB3 SER 72 HB1 SER 72 6.455 -0.985 -8.248 458 HG SER 72 HG SER 72 5.564 -3.473 -7.975 459 H GLY 73 HN GLY 73 2.314 -1.319 -9.269 460 HA2 GLY 73 HA2 GLY 73 0.961 -2.428 -11.065 461 HA3 GLY 73 HA1 GLY 73 2.208 -3.658 -11.058 462 H VAL 74 HN VAL 74 2.520 -3.619 -8.157 463 HA VAL 74 HA VAL 74 -0.113 -4.599 -7.324 464 HB VAL 74 HB VAL 74 0.750 -6.584 -6.354 465 HG11 VAL 74 HG11 VAL 74 1.758 -7.722 -8.372 466 HG12 VAL 74 HG12 VAL 74 1.731 -6.141 -9.162 467 HG13 VAL 74 HG13 VAL 74 0.224 -6.892 -8.635 468 HG21 VAL 74 HG21 VAL 74 3.146 -7.212 -6.553 469 HG22 VAL 74 HG22 VAL 74 2.846 -5.832 -5.498 470 HG23 VAL 74 HG23 VAL 74 3.478 -5.576 -7.125 471 H ILE 75 HN ILE 75 2.513 -2.650 -6.611 472 HA ILE 75 HA ILE 75 2.154 -2.923 -3.723 473 HB ILE 75 HB ILE 75 4.045 -1.418 -3.459 474 HG12 ILE 75 HG12 ILE 75 4.339 -1.449 -6.454 475 HG13 ILE 75 HG11 ILE 75 3.514 -0.161 -5.597 476 HG21 ILE 75 HG21 ILE 75 4.477 -3.783 -3.667 477 HG22 ILE 75 HG22 ILE 75 5.775 -2.848 -4.409 478 HG23 ILE 75 HG23 ILE 75 4.561 -3.628 -5.421 479 HD11 ILE 75 HD11 ILE 75 5.817 0.417 -6.127 480 HD12 ILE 75 HD12 ILE 75 6.372 -0.969 -5.187 481 HD13 ILE 75 HD13 ILE 75 5.541 0.364 -4.386 482 H ALA 76 HN ALA 76 2.470 -0.726 -2.604 483 HA ALA 76 HA ALA 76 1.022 1.475 -3.836 484 HB1 ALA 76 HB1 ALA 76 -0.744 0.119 -2.839 485 HB2 ALA 76 HB2 ALA 76 -0.547 1.625 -1.939 486 HB3 ALA 76 HB3 ALA 76 0.111 0.116 -1.294 487 H ILE 77 HN ILE 77 1.678 3.472 -2.953 488 HA ILE 77 HA ILE 77 3.723 3.271 -0.840 489 HB ILE 77 HB ILE 77 3.677 5.196 -3.169 490 HG12 ILE 77 HG12 ILE 77 5.554 2.916 -2.514 491 HG13 ILE 77 HG11 ILE 77 4.341 2.910 -3.789 492 HG21 ILE 77 HG21 ILE 77 5.691 4.908 -0.941 493 HG22 ILE 77 HG22 ILE 77 4.566 6.249 -1.156 494 HG23 ILE 77 HG23 ILE 77 5.844 5.974 -2.340 495 HD11 ILE 77 HD11 ILE 77 6.573 3.316 -4.665 496 HD12 ILE 77 HD12 ILE 77 6.720 4.745 -3.642 497 HD13 ILE 77 HD13 ILE 77 5.517 4.702 -4.930 498 H GLY 78 HN GLY 78 3.519 4.543 0.905 499 HA2 GLY 78 HA2 GLY 78 2.820 6.276 2.261 500 HA3 GLY 78 HA1 GLY 78 2.139 7.060 0.843 501 H CYS 79 HN CYS 79 1.520 3.965 2.482 502 HA CYS 79 HA CYS 79 -1.341 4.497 2.243 503 HB2 CYS 79 HB2 CYS 79 0.349 2.086 2.279 504 HB3 CYS 79 HB1 CYS 79 -1.180 1.944 3.125 505 H LEU 80 HN LEU 80 -2.587 4.888 3.921 506 HA LEU 80 HA LEU 80 -1.529 4.361 6.612 507 HB2 LEU 80 HB2 LEU 80 -3.817 6.142 5.776 508 HB3 LEU 80 HB1 LEU 80 -3.216 5.922 7.413 509 HG LEU 80 HG LEU 80 -1.665 7.157 5.136 510 HD11 LEU 80 HD11 LEU 80 -2.889 8.402 7.590 511 HD12 LEU 80 HD12 LEU 80 -3.474 8.583 5.937 512 HD13 LEU 80 HD13 LEU 80 -1.897 9.231 6.391 513 HD21 LEU 80 HD21 LEU 80 -0.168 6.013 6.618 514 HD22 LEU 80 HD22 LEU 80 -0.969 6.697 8.031 515 HD23 LEU 80 HD23 LEU 80 -0.056 7.744 6.941 516 HA PRO 81 HA PRO 81 -4.322 0.939 6.837 517 HB2 PRO 81 HB2 PRO 81 -4.140 1.272 9.755 518 HB3 PRO 81 HB1 PRO 81 -3.658 -0.096 8.754 519 HG2 PRO 81 HG2 PRO 81 -1.849 1.499 9.918 520 HG3 PRO 81 HG1 PRO 81 -1.568 0.777 8.326 521 HD2 PRO 81 HD2 PRO 81 -2.387 3.575 9.016 522 HD3 PRO 81 HD1 PRO 81 -1.261 3.005 7.776 523 H VAL 82 HN VAL 82 -6.467 1.037 6.590 524 HA VAL 82 HA VAL 82 -7.960 2.981 8.192 525 HB VAL 82 HB VAL 82 -9.664 2.808 6.291 526 HG11 VAL 82 HG11 VAL 82 -7.003 4.133 5.801 527 HG12 VAL 82 HG12 VAL 82 -8.355 4.812 6.708 528 HG13 VAL 82 HG13 VAL 82 -8.507 4.533 4.972 529 HG21 VAL 82 HG21 VAL 82 -8.708 0.869 5.171 530 HG22 VAL 82 HG22 VAL 82 -7.248 1.793 4.818 531 HG23 VAL 82 HG23 VAL 82 -8.785 2.262 4.093 532 H THR 83 HN THR 83 -10.145 2.436 8.667 533 HA THR 83 HA THR 83 -10.880 -0.388 8.531 534 HB THR 83 HB THR 83 -11.036 1.197 11.107 535 HG1 THR 83 HG1 THR 83 -8.946 -0.062 10.015 536 HG21 THR 83 HG21 THR 83 -11.625 -0.943 12.117 537 HG22 THR 83 HG22 THR 83 -11.507 -1.735 10.547 538 HG23 THR 83 HG23 THR 83 -12.765 -0.534 10.837 539 H LEU 84 HN LEU 84 -13.031 -0.676 8.223 540 HA LEU 84 HA LEU 84 -15.194 -0.247 7.758 541 HB2 LEU 84 HB2 LEU 84 -14.699 2.018 9.655 542 HB3 LEU 84 HB1 LEU 84 -16.279 1.670 8.980 543 HG LEU 84 HG LEU 84 -14.665 -0.244 10.654 544 HD11 LEU 84 HD11 LEU 84 -15.368 1.653 11.992 545 HD12 LEU 84 HD12 LEU 84 -16.307 0.223 12.418 546 HD13 LEU 84 HD13 LEU 84 -17.021 1.477 11.406 547 HD21 LEU 84 HD21 LEU 84 -16.779 -1.491 10.785 548 HD22 LEU 84 HD22 LEU 84 -16.138 -1.397 9.146 549 HD23 LEU 84 HD23 LEU 84 -17.488 -0.367 9.626 Start of MODEL 4 1 H1 GLY 1 HT1 GLY 1 -18.946 -2.050 -6.601 2 H2 GLY 1 HT2 GLY 1 -18.729 -1.419 -8.154 3 H3 GLY 1 HT3 GLY 1 -19.628 -0.554 -7.009 4 HA2 GLY 1 HA1 GLY 1 -16.722 -1.121 -6.911 5 HA3 GLY 1 HA2 GLY 1 -17.468 0.438 -7.233 6 H SER 2 HN SER 2 -16.102 -1.484 -4.893 7 HA SER 2 HA SER 2 -17.618 -0.666 -2.632 8 HB2 SER 2 HB2 SER 2 -16.161 -2.681 -2.658 9 HB3 SER 2 HB1 SER 2 -14.751 -1.629 -2.740 10 HG SER 2 HG SER 2 -16.201 -2.387 -0.593 11 H TRP 3 HN TRP 3 -14.784 0.565 -4.292 12 HA TRP 3 HA TRP 3 -13.810 2.599 -4.362 13 HB2 TRP 3 HB2 TRP 3 -16.270 3.334 -2.807 14 HB3 TRP 3 HB1 TRP 3 -14.983 4.507 -3.064 15 HD1 TRP 3 HD1 TRP 3 -17.671 2.549 -4.976 16 HE1 TRP 3 HE1 TRP 3 -18.017 3.673 -7.267 17 HE3 TRP 3 HE3 TRP 3 -13.845 5.926 -4.795 18 HZ2 TRP 3 HZ2 TRP 3 -16.815 5.728 -8.791 19 HZ3 TRP 3 HZ3 TRP 3 -13.508 7.435 -6.707 20 HH2 TRP 3 HH2 TRP 3 -14.963 7.335 -8.664 21 H GLY 4 HN GLY 4 -15.082 2.498 -1.025 22 HA2 GLY 4 HA2 GLY 4 -13.898 2.495 0.971 23 HA3 GLY 4 HA1 GLY 4 -12.413 2.284 0.051 24 H GLN 5 HN GLN 5 -14.725 4.597 1.278 25 HA GLN 5 HA GLN 5 -13.403 6.894 0.231 26 HB2 GLN 5 HB2 GLN 5 -15.415 6.614 2.469 27 HB3 GLN 5 HB1 GLN 5 -14.878 8.144 1.797 28 HG2 GLN 5 HG2 GLN 5 -16.368 5.971 0.347 29 HG3 GLN 5 HG1 GLN 5 -17.014 7.522 0.870 30 HE21 GLN 5 HE21 GLN 5 -14.669 9.047 0.092 31 HE22 GLN 5 HE22 GLN 5 -14.664 9.097 -1.636 32 H CYS 6 HN CYS 6 -11.839 8.105 1.081 33 HA CYS 6 HA CYS 6 -10.832 7.383 3.747 34 HB2 CYS 6 HB2 CYS 6 -9.344 6.344 2.171 35 HB3 CYS 6 HB1 CYS 6 -9.242 7.818 1.213 36 H SER 7 HN SER 7 -9.423 9.721 1.535 37 HA SER 7 HA SER 7 -10.814 11.961 2.649 38 HB2 SER 7 HB2 SER 7 -7.863 11.652 3.273 39 HB3 SER 7 HB1 SER 7 -8.822 13.096 3.576 40 HG SER 7 HG SER 7 -9.997 10.902 4.646 41 H THR 8 HN THR 8 -7.509 11.688 1.345 42 HA THR 8 HA THR 8 -8.479 13.023 -1.093 43 HB THR 8 HB THR 8 -6.144 13.966 -1.276 44 HG1 THR 8 HG1 THR 8 -4.736 13.422 0.199 45 HG21 THR 8 HG21 THR 8 -8.016 15.346 -0.526 46 HG22 THR 8 HG22 THR 8 -6.544 15.774 0.346 47 HG23 THR 8 HG23 THR 8 -7.778 14.789 1.131 48 H GLY 9 HN GLY 9 -6.574 10.507 0.313 49 HA2 GLY 9 HA2 GLY 9 -5.452 9.701 -2.250 50 HA3 GLY 9 HA1 GLY 9 -5.085 8.994 -0.684 51 H SER 10 HN SER 10 -5.377 7.159 -2.396 52 HA SER 10 HA SER 10 -8.180 6.343 -2.627 53 HB2 SER 10 HB2 SER 10 -6.763 6.309 -4.671 54 HB3 SER 10 HB1 SER 10 -5.685 5.159 -3.886 55 HG SER 10 HG SER 10 -8.430 4.576 -4.094 56 H ILE 11 HN ILE 11 -8.864 4.285 -1.847 57 HA ILE 11 HA ILE 11 -7.072 3.123 0.148 58 HB ILE 11 HB ILE 11 -10.057 2.897 -0.173 59 HG12 ILE 11 HG12 ILE 11 -8.205 4.110 1.865 60 HG13 ILE 11 HG11 ILE 11 -9.386 4.927 0.856 61 HG21 ILE 11 HG21 ILE 11 -10.046 1.484 1.824 62 HG22 ILE 11 HG22 ILE 11 -8.284 1.477 1.812 63 HG23 ILE 11 HG23 ILE 11 -9.177 0.715 0.495 64 HD11 ILE 11 HD11 ILE 11 -10.054 2.962 3.026 65 HD12 ILE 11 HD12 ILE 11 -11.195 3.917 2.080 66 HD13 ILE 11 HD13 ILE 11 -10.093 4.715 3.203 67 H GLN 12 HN GLN 12 -6.241 1.232 -0.047 68 HA GLN 12 HA GLN 12 -7.304 -0.629 -2.048 69 HB2 GLN 12 HB2 GLN 12 -4.668 -1.287 -2.108 70 HB3 GLN 12 HB1 GLN 12 -5.475 -0.295 -3.303 71 HG2 GLN 12 HG2 GLN 12 -4.162 0.920 -0.920 72 HG3 GLN 12 HG1 GLN 12 -3.238 0.468 -2.342 73 HE21 GLN 12 HE21 GLN 12 -5.252 1.131 -4.272 74 HE22 GLN 12 HE22 GLN 12 -5.370 2.845 -4.312 75 H CYS 13 HN CYS 13 -6.375 -2.863 -1.714 76 HA CYS 13 HA CYS 13 -6.300 -3.397 1.178 77 HB2 CYS 13 HB2 CYS 13 -8.273 -4.351 0.178 78 HB3 CYS 13 HB1 CYS 13 -7.328 -5.098 -1.104 79 H CYS 14 HN CYS 14 -4.232 -3.577 1.709 80 HA CYS 14 HA CYS 14 -2.318 -4.705 -0.151 81 HB2 CYS 14 HB2 CYS 14 -2.018 -3.415 2.545 82 HB3 CYS 14 HB1 CYS 14 -0.673 -4.121 1.656 83 H GLN 15 HN GLN 15 -1.736 -6.705 -0.175 84 HA GLN 15 HA GLN 15 -2.500 -8.579 1.780 85 HB2 GLN 15 HB2 GLN 15 -2.111 -9.944 0.057 86 HB3 GLN 15 HB1 GLN 15 -1.453 -8.591 -0.844 87 HG2 GLN 15 HG2 GLN 15 0.147 -10.292 -0.947 88 HG3 GLN 15 HG1 GLN 15 0.767 -9.117 0.205 89 HE21 GLN 15 HE21 GLN 15 -1.787 -11.389 0.966 90 HE22 GLN 15 HE22 GLN 15 -0.865 -12.352 2.066 91 H ASN 16 HN ASN 16 0.361 -6.671 1.234 92 HA ASN 16 HA ASN 16 1.359 -7.528 3.862 93 HB2 ASN 16 HB2 ASN 16 2.573 -8.270 1.497 94 HB3 ASN 16 HB1 ASN 16 3.444 -6.818 1.966 95 HD21 ASN 16 HD21 ASN 16 4.278 -9.622 1.863 96 HD22 ASN 16 HD22 ASN 16 4.879 -9.983 3.444 97 H VAL 17 HN VAL 17 1.108 -5.733 5.028 98 HA VAL 17 HA VAL 17 1.805 -3.138 3.857 99 HB VAL 17 HB VAL 17 0.363 -3.765 6.451 100 HG11 VAL 17 HG11 VAL 17 -0.001 -1.344 6.620 101 HG12 VAL 17 HG12 VAL 17 1.018 -1.093 5.202 102 HG13 VAL 17 HG13 VAL 17 1.714 -1.746 6.685 103 HG21 VAL 17 HG21 VAL 17 -0.986 -4.158 4.465 104 HG22 VAL 17 HG22 VAL 17 -0.602 -2.543 3.871 105 HG23 VAL 17 HG23 VAL 17 -1.559 -2.738 5.339 106 H VAL 18 HN VAL 18 3.898 -2.726 4.020 107 HA VAL 18 HA VAL 18 5.215 -3.196 6.606 108 HB VAL 18 HB VAL 18 7.301 -3.794 5.373 109 HG11 VAL 18 HG11 VAL 18 6.644 -6.092 4.856 110 HG12 VAL 18 HG12 VAL 18 4.947 -5.611 4.873 111 HG13 VAL 18 HG13 VAL 18 5.900 -5.532 6.354 112 HG21 VAL 18 HG21 VAL 18 5.460 -3.969 2.988 113 HG22 VAL 18 HG22 VAL 18 7.140 -4.501 3.039 114 HG23 VAL 18 HG23 VAL 18 6.751 -2.791 3.218 115 HA PRO 19 HA PRO 19 6.618 1.024 6.157 116 HB2 PRO 19 HB2 PRO 19 8.970 0.134 7.688 117 HB3 PRO 19 HB1 PRO 19 7.815 1.418 8.051 118 HG2 PRO 19 HG2 PRO 19 7.815 -0.891 9.418 119 HG3 PRO 19 HG1 PRO 19 6.316 -0.021 9.048 120 HD2 PRO 19 HD2 PRO 19 7.459 -2.462 7.757 121 HD3 PRO 19 HD1 PRO 19 5.767 -2.056 8.110 122 H GLY 20 HN GLY 20 7.829 2.012 4.632 123 HA2 GLY 20 HA2 GLY 20 9.362 0.441 2.821 124 HA3 GLY 20 HA1 GLY 20 9.238 2.193 2.816 125 H ASP 21 HN ASP 21 10.133 1.956 5.756 126 HA ASP 21 HA ASP 21 13.016 1.850 5.211 127 HB2 ASP 21 HB2 ASP 21 12.014 3.925 6.206 128 HB3 ASP 21 HB1 ASP 21 11.569 2.972 7.609 129 H SER 22 HN SER 22 10.691 -0.155 6.129 130 HA SER 22 HA SER 22 11.829 -1.416 8.433 131 HB2 SER 22 HB2 SER 22 9.473 -1.700 8.071 132 HB3 SER 22 HB1 SER 22 9.725 -2.267 6.430 133 HG SER 22 HG SER 22 9.680 -3.666 8.733 134 H ASP 23 HN ASP 23 12.806 -3.536 8.443 135 HA ASP 23 HA ASP 23 14.851 -3.965 6.591 136 HB2 ASP 23 HB2 ASP 23 14.569 -5.068 8.861 137 HB3 ASP 23 HB1 ASP 23 13.408 -6.147 8.115 138 H LEU 24 HN LEU 24 11.629 -5.307 6.814 139 HA LEU 24 HA LEU 24 11.757 -6.882 4.462 140 HB2 LEU 24 HB2 LEU 24 9.714 -6.070 6.388 141 HB3 LEU 24 HB1 LEU 24 9.096 -6.264 4.760 142 HG LEU 24 HG LEU 24 8.839 -8.307 6.070 143 HD11 LEU 24 HD11 LEU 24 10.907 -8.626 3.902 144 HD12 LEU 24 HD12 LEU 24 9.182 -8.401 3.623 145 HD13 LEU 24 HD13 LEU 24 9.761 -9.846 4.455 146 HD21 LEU 24 HD21 LEU 24 10.762 -8.028 7.555 147 HD22 LEU 24 HD22 LEU 24 11.850 -8.323 6.198 148 HD23 LEU 24 HD23 LEU 24 10.777 -9.604 6.765 149 H GLY 25 HN GLY 25 10.011 -3.826 5.041 150 HA2 GLY 25 HA2 GLY 25 9.143 -3.441 2.430 151 HA3 GLY 25 HA1 GLY 25 9.350 -2.161 3.613 152 H THR 26 HN THR 26 12.172 -2.416 3.916 153 HA THR 26 HA THR 26 12.981 -0.751 1.770 154 HB THR 26 HB THR 26 14.626 -2.090 3.931 155 HG1 THR 26 HG1 THR 26 13.080 0.215 3.774 156 HG21 THR 26 HG21 THR 26 15.996 -1.420 1.974 157 HG22 THR 26 HG22 THR 26 16.365 -0.493 3.430 158 HG23 THR 26 HG23 THR 26 15.384 0.228 2.154 159 H LEU 27 HN LEU 27 13.512 -4.151 2.561 160 HA LEU 27 HA LEU 27 15.285 -4.594 0.364 161 HB2 LEU 27 HB2 LEU 27 14.416 -6.003 2.645 162 HB3 LEU 27 HB1 LEU 27 13.958 -6.974 1.267 163 HG LEU 27 HG LEU 27 16.107 -7.707 2.027 164 HD11 LEU 27 HD11 LEU 27 17.493 -7.350 0.047 165 HD12 LEU 27 HD12 LEU 27 16.428 -6.041 -0.463 166 HD13 LEU 27 HD13 LEU 27 15.819 -7.693 -0.384 167 HD21 LEU 27 HD21 LEU 27 18.033 -6.215 2.161 168 HD22 LEU 27 HD22 LEU 27 16.749 -5.707 3.257 169 HD23 LEU 27 HD23 LEU 27 17.006 -4.846 1.739 170 H LEU 28 HN LEU 28 11.843 -4.661 0.887 171 HA LEU 28 HA LEU 28 11.170 -6.157 -1.429 172 HB2 LEU 28 HB2 LEU 28 9.515 -4.129 0.078 173 HB3 LEU 28 HB1 LEU 28 8.906 -5.224 -1.139 174 HG LEU 28 HG LEU 28 9.774 -5.826 1.663 175 HD11 LEU 28 HD11 LEU 28 7.635 -6.957 1.759 176 HD12 LEU 28 HD12 LEU 28 7.355 -6.622 0.050 177 HD13 LEU 28 HD13 LEU 28 7.428 -5.296 1.209 178 HD21 LEU 28 HD21 LEU 28 9.560 -7.817 -0.586 179 HD22 LEU 28 HD22 LEU 28 9.650 -8.222 1.128 180 HD23 LEU 28 HD23 LEU 28 11.005 -7.412 0.343 181 H LEU 29 HN LEU 29 11.340 -2.656 -0.753 182 HA LEU 29 HA LEU 29 10.543 -2.049 -3.442 183 HB2 LEU 29 HB2 LEU 29 10.901 0.288 -2.837 184 HB3 LEU 29 HB1 LEU 29 9.875 -0.541 -1.699 185 HG LEU 29 HG LEU 29 11.944 -0.721 -0.206 186 HD11 LEU 29 HD11 LEU 29 13.649 -0.183 -1.868 187 HD12 LEU 29 HD12 LEU 29 13.656 0.998 -0.558 188 HD13 LEU 29 HD13 LEU 29 12.923 1.407 -2.110 189 HD21 LEU 29 HD21 LEU 29 10.121 0.757 0.292 190 HD22 LEU 29 HD22 LEU 29 10.704 1.935 -0.885 191 HD23 LEU 29 HD23 LEU 29 11.637 1.611 0.580 192 H ASP 30 HN ASP 30 13.562 -2.528 -1.835 193 HA ASP 30 HA ASP 30 15.217 -1.287 -3.778 194 HB2 ASP 30 HB2 ASP 30 15.942 -2.067 -1.479 195 HB3 ASP 30 HB1 ASP 30 15.933 -3.708 -2.114 196 H GLU 31 HN GLU 31 13.656 -4.367 -3.494 197 HA GLU 31 HA GLU 31 14.949 -5.629 -5.704 198 HB2 GLU 31 HB2 GLU 31 13.532 -6.525 -3.604 199 HB3 GLU 31 HB1 GLU 31 12.244 -6.467 -4.800 200 HG2 GLU 31 HG2 GLU 31 13.588 -7.889 -6.279 201 HG3 GLU 31 HG1 GLU 31 14.822 -7.971 -5.023 202 H LEU 32 HN LEU 32 12.477 -3.357 -5.289 203 HA LEU 32 HA LEU 32 11.212 -3.955 -7.858 204 HB2 LEU 32 HB2 LEU 32 10.355 -2.341 -5.473 205 HB3 LEU 32 HB1 LEU 32 9.462 -2.349 -6.980 206 HG LEU 32 HG LEU 32 9.976 -4.743 -5.212 207 HD11 LEU 32 HD11 LEU 32 7.576 -4.656 -4.780 208 HD12 LEU 32 HD12 LEU 32 7.452 -3.186 -5.747 209 HD13 LEU 32 HD13 LEU 32 8.381 -3.179 -4.248 210 HD21 LEU 32 HD21 LEU 32 9.883 -5.400 -7.539 211 HD22 LEU 32 HD22 LEU 32 8.396 -4.481 -7.765 212 HD23 LEU 32 HD23 LEU 32 8.406 -5.897 -6.714 213 H GLY 33 HN GLY 33 13.520 -1.942 -6.548 214 HA2 GLY 33 HA2 GLY 33 14.689 -0.182 -7.442 215 HA3 GLY 33 HA1 GLY 33 13.781 -0.422 -8.927 216 H ILE 34 HN ILE 34 12.418 0.300 -5.755 217 HA ILE 34 HA ILE 34 11.026 2.565 -6.937 218 HB ILE 34 HB ILE 34 10.761 1.538 -4.110 219 HG12 ILE 34 HG12 ILE 34 9.110 0.784 -6.537 220 HG13 ILE 34 HG11 ILE 34 10.317 -0.253 -5.782 221 HG21 ILE 34 HG21 ILE 34 8.575 2.625 -4.191 222 HG22 ILE 34 HG22 ILE 34 8.903 3.172 -5.836 223 HG23 ILE 34 HG23 ILE 34 9.876 3.778 -4.494 224 HD11 ILE 34 HD11 ILE 34 8.999 -0.257 -3.720 225 HD12 ILE 34 HD12 ILE 34 8.094 -0.887 -5.095 226 HD13 ILE 34 HD13 ILE 34 7.784 0.747 -4.508 227 H VAL 35 HN VAL 35 11.368 4.675 -6.424 228 HA VAL 35 HA VAL 35 13.590 5.244 -4.606 229 HB VAL 35 HB VAL 35 13.877 6.261 -6.766 230 HG11 VAL 35 HG11 VAL 35 12.317 7.905 -7.685 231 HG12 VAL 35 HG12 VAL 35 11.207 7.595 -6.351 232 HG13 VAL 35 HG13 VAL 35 11.563 6.319 -7.515 233 HG21 VAL 35 HG21 VAL 35 14.054 8.635 -6.135 234 HG22 VAL 35 HG22 VAL 35 14.668 7.552 -4.888 235 HG23 VAL 35 HG23 VAL 35 13.086 8.305 -4.698 236 H LEU 36 HN LEU 36 13.019 5.571 -2.585 237 HA LEU 36 HA LEU 36 10.376 6.483 -1.891 238 HB2 LEU 36 HB2 LEU 36 11.373 6.381 0.481 239 HB3 LEU 36 HB1 LEU 36 11.126 4.883 -0.379 240 HG LEU 36 HG LEU 36 13.661 5.253 -1.059 241 HD11 LEU 36 HD11 LEU 36 14.945 6.250 0.739 242 HD12 LEU 36 HD12 LEU 36 13.455 6.695 1.570 243 HD13 LEU 36 HD13 LEU 36 13.850 7.431 0.018 244 HD21 LEU 36 HD21 LEU 36 12.704 4.211 1.595 245 HD22 LEU 36 HD22 LEU 36 14.295 3.899 0.902 246 HD23 LEU 36 HD23 LEU 36 12.847 3.310 0.086 247 H GLU 37 HN GLU 37 9.772 8.481 -1.461 248 HA GLU 37 HA GLU 37 11.762 10.606 -1.339 249 HB2 GLU 37 HB2 GLU 37 8.740 10.749 -1.240 250 HB3 GLU 37 HB1 GLU 37 9.829 12.122 -1.367 251 HG2 GLU 37 HG2 GLU 37 10.598 11.310 -3.539 252 HG3 GLU 37 HG1 GLU 37 9.495 9.940 -3.411 253 H ASP 38 HN ASP 38 9.566 8.806 0.621 254 HA ASP 38 HA ASP 38 10.774 9.894 3.032 255 HB2 ASP 38 HB2 ASP 38 7.790 9.630 2.559 256 HB3 ASP 38 HB1 ASP 38 8.519 9.868 4.139 257 HA PRO 39 HA PRO 39 10.908 5.361 2.835 258 HB2 PRO 39 HB2 PRO 39 12.770 5.069 4.824 259 HB3 PRO 39 HB1 PRO 39 13.181 5.426 3.145 260 HG2 PRO 39 HG2 PRO 39 12.974 7.281 5.482 261 HG3 PRO 39 HG1 PRO 39 14.185 7.240 4.188 262 HD2 PRO 39 HD2 PRO 39 12.151 9.014 4.206 263 HD3 PRO 39 HD1 PRO 39 12.812 8.349 2.698 264 H THR 40 HN THR 40 9.873 7.487 5.209 265 HA THR 40 HA THR 40 9.458 5.582 7.339 266 HB THR 40 HB THR 40 8.158 7.566 8.333 267 HG1 THR 40 HG1 THR 40 7.774 8.883 6.628 268 HG21 THR 40 HG21 THR 40 10.235 8.729 8.941 269 HG22 THR 40 HG22 THR 40 11.086 7.878 7.651 270 HG23 THR 40 HG23 THR 40 10.430 6.978 9.018 271 H VAL 41 HN VAL 41 7.858 6.296 4.496 272 HA VAL 41 HA VAL 41 5.164 6.079 5.443 273 HB VAL 41 HB VAL 41 4.493 6.023 3.135 274 HG11 VAL 41 HG11 VAL 41 6.754 7.959 3.573 275 HG12 VAL 41 HG12 VAL 41 5.068 8.188 4.041 276 HG13 VAL 41 HG13 VAL 41 5.509 8.109 2.335 277 HG21 VAL 41 HG21 VAL 41 7.413 5.755 2.428 278 HG22 VAL 41 HG22 VAL 41 6.080 5.945 1.288 279 HG23 VAL 41 HG23 VAL 41 6.197 4.488 2.276 280 H LEU 42 HN LEU 42 3.701 4.386 4.831 281 HA LEU 42 HA LEU 42 4.922 1.748 5.001 282 HB2 LEU 42 HB2 LEU 42 2.025 2.599 5.130 283 HB3 LEU 42 HB1 LEU 42 2.602 0.958 5.344 284 HG LEU 42 HG LEU 42 3.234 3.287 7.157 285 HD11 LEU 42 HD11 LEU 42 1.823 2.130 8.774 286 HD12 LEU 42 HD12 LEU 42 1.444 0.897 7.572 287 HD13 LEU 42 HD13 LEU 42 0.912 2.561 7.328 288 HD21 LEU 42 HD21 LEU 42 5.067 1.732 7.109 289 HD22 LEU 42 HD22 LEU 42 3.969 0.370 7.313 290 HD23 LEU 42 HD23 LEU 42 4.184 1.534 8.621 291 H ILE 43 HN ILE 43 5.120 0.452 3.318 292 HA ILE 43 HA ILE 43 3.699 1.199 0.863 293 HB ILE 43 HB ILE 43 5.382 -0.306 -0.296 294 HG12 ILE 43 HG12 ILE 43 6.967 0.102 2.243 295 HG13 ILE 43 HG11 ILE 43 6.166 -1.406 1.825 296 HG21 ILE 43 HG21 ILE 43 6.342 2.214 1.052 297 HG22 ILE 43 HG22 ILE 43 5.467 2.103 -0.475 298 HG23 ILE 43 HG23 ILE 43 7.102 1.457 -0.348 299 HD11 ILE 43 HD11 ILE 43 8.312 -0.066 0.202 300 HD12 ILE 43 HD12 ILE 43 7.546 -1.613 -0.156 301 HD13 ILE 43 HD13 ILE 43 8.547 -1.438 1.285 302 H GLY 44 HN GLY 44 2.479 -0.264 -0.211 303 HA2 GLY 44 HA2 GLY 44 1.798 -2.635 1.387 304 HA3 GLY 44 HA1 GLY 44 0.686 -1.773 0.350 305 H ASP 45 HN ASP 45 3.075 -4.198 0.558 306 HA ASP 45 HA ASP 45 3.169 -4.726 -2.277 307 HB2 ASP 45 HB2 ASP 45 5.096 -5.418 -1.032 308 HB3 ASP 45 HB1 ASP 45 4.110 -6.274 0.142 309 H GLY 46 HN GLY 46 1.920 -6.180 -3.390 310 HA2 GLY 46 HA2 GLY 46 0.146 -7.619 -3.785 311 HA3 GLY 46 HA1 GLY 46 0.210 -8.038 -2.105 312 H CYS 47 HN CYS 47 -0.338 -4.847 -3.514 313 HA CYS 47 HA CYS 47 -2.780 -4.725 -1.890 314 HB2 CYS 47 HB2 CYS 47 -0.672 -3.036 -1.852 315 HB3 CYS 47 HB1 CYS 47 -1.691 -2.246 -3.056 316 H ASP 48 HN ASP 48 -4.525 -5.111 -2.969 317 HA ASP 48 HA ASP 48 -4.740 -4.374 -5.786 318 HB2 ASP 48 HB2 ASP 48 -6.696 -5.891 -4.045 319 HB3 ASP 48 HB1 ASP 48 -6.810 -5.678 -5.784 320 HA PRO 49 HA PRO 49 -7.030 -0.709 -4.703 321 HB2 PRO 49 HB2 PRO 49 -8.241 -0.819 -7.351 322 HB3 PRO 49 HB1 PRO 49 -7.115 0.362 -6.695 323 HG2 PRO 49 HG2 PRO 49 -6.461 -1.441 -8.636 324 HG3 PRO 49 HG1 PRO 49 -5.294 -0.716 -7.518 325 HD2 PRO 49 HD2 PRO 49 -6.489 -3.438 -7.506 326 HD3 PRO 49 HD1 PRO 49 -4.888 -2.895 -6.972 327 H ILE 50 HN ILE 50 -8.826 -0.825 -3.467 328 HA ILE 50 HA ILE 50 -10.703 -2.960 -3.892 329 HB ILE 50 HB ILE 50 -11.028 -0.689 -1.932 330 HG12 ILE 50 HG12 ILE 50 -9.554 -3.308 -1.585 331 HG13 ILE 50 HG11 ILE 50 -8.830 -1.705 -1.591 332 HG21 ILE 50 HG21 ILE 50 -11.998 -3.540 -1.873 333 HG22 ILE 50 HG22 ILE 50 -12.971 -2.157 -2.369 334 HG23 ILE 50 HG23 ILE 50 -12.383 -2.271 -0.710 335 HD11 ILE 50 HD11 ILE 50 -10.133 -1.156 0.429 336 HD12 ILE 50 HD12 ILE 50 -9.019 -2.501 0.665 337 HD13 ILE 50 HD13 ILE 50 -10.742 -2.811 0.446 338 H THR 51 HN THR 51 -11.571 -2.513 -5.880 339 HA THR 51 HA THR 51 -13.593 -0.391 -5.858 340 HB THR 51 HB THR 51 -11.667 0.360 -7.223 341 HG1 THR 51 HG1 THR 51 -13.456 1.253 -8.024 342 HG21 THR 51 HG21 THR 51 -12.308 -2.038 -8.941 343 HG22 THR 51 HG22 THR 51 -10.858 -1.823 -7.960 344 HG23 THR 51 HG23 THR 51 -11.156 -0.764 -9.338 345 H VAL 52 HN VAL 52 -13.168 -3.494 -5.735 346 HA VAL 52 HA VAL 52 -15.166 -4.260 -7.725 347 HB VAL 52 HB VAL 52 -12.995 -5.565 -7.431 348 HG11 VAL 52 HG11 VAL 52 -14.384 -6.490 -4.921 349 HG12 VAL 52 HG12 VAL 52 -12.892 -5.550 -5.006 350 HG13 VAL 52 HG13 VAL 52 -12.927 -7.207 -5.613 351 HG21 VAL 52 HG21 VAL 52 -15.602 -7.042 -7.140 352 HG22 VAL 52 HG22 VAL 52 -14.087 -7.742 -7.707 353 HG23 VAL 52 HG23 VAL 52 -14.879 -6.477 -8.645 354 H ALA 53 HN ALA 53 -16.963 -5.627 -6.996 355 HA ALA 53 HA ALA 53 -18.725 -6.163 -5.676 356 HB1 ALA 53 HB1 ALA 53 -17.042 -7.267 -4.280 357 HB2 ALA 53 HB2 ALA 53 -18.352 -6.594 -3.310 358 HB3 ALA 53 HB3 ALA 53 -16.798 -5.763 -3.391 359 H GLY 54 HN GLY 54 -19.820 -5.253 -3.423 360 HA2 GLY 54 HA2 GLY 54 -19.751 -2.305 -3.618 361 HA3 GLY 54 HA1 GLY 54 -21.259 -3.199 -3.476 362 H SER 55 HN SER 55 -19.142 -4.887 -1.699 363 HA SER 55 HA SER 55 -20.022 -3.631 0.784 364 HB2 SER 55 HB2 SER 55 -18.740 -6.331 0.294 365 HB3 SER 55 HB1 SER 55 -19.387 -5.762 1.831 366 HG SER 55 HG SER 55 -21.359 -5.421 0.256 367 H SER 56 HN SER 56 -18.567 -3.125 2.445 368 HA SER 56 HA SER 56 -16.095 -2.021 1.621 369 HB2 SER 56 HB2 SER 56 -17.001 -2.596 4.446 370 HB3 SER 56 HB1 SER 56 -15.802 -1.408 3.940 371 HG SER 56 HG SER 56 -17.904 -0.779 2.576 372 H ASP 57 HN ASP 57 -17.025 -5.087 2.935 373 HA ASP 57 HA ASP 57 -14.325 -5.871 3.606 374 HB2 ASP 57 HB2 ASP 57 -16.270 -6.698 4.911 375 HB3 ASP 57 HB1 ASP 57 -16.838 -7.555 3.483 376 H ALA 58 HN ALA 58 -14.075 -5.077 1.206 377 HA ALA 58 HA ALA 58 -14.157 -7.412 -0.581 378 HB1 ALA 58 HB1 ALA 58 -13.591 -4.510 -1.189 379 HB2 ALA 58 HB2 ALA 58 -15.112 -5.354 -1.490 380 HB3 ALA 58 HB3 ALA 58 -13.658 -5.814 -2.376 381 H CYS 59 HN CYS 59 -12.338 -6.758 1.729 382 HA CYS 59 HA CYS 59 -9.763 -6.739 0.317 383 HB2 CYS 59 HB2 CYS 59 -10.082 -4.834 1.819 384 HB3 CYS 59 HB1 CYS 59 -10.431 -5.924 3.153 385 H SER 60 HN SER 60 -8.105 -8.152 1.133 386 HA SER 60 HA SER 60 -9.171 -10.500 2.550 387 HB2 SER 60 HB2 SER 60 -7.153 -10.631 0.326 388 HB3 SER 60 HB1 SER 60 -8.061 -11.959 1.040 389 HG SER 60 HG SER 60 -9.967 -11.009 0.162 390 H ALA 61 HN ALA 61 -7.413 -8.078 3.291 391 HA ALA 61 HA ALA 61 -5.568 -9.539 4.910 392 HB1 ALA 61 HB1 ALA 61 -4.341 -9.580 2.794 393 HB2 ALA 61 HB2 ALA 61 -3.497 -8.632 4.018 394 HB3 ALA 61 HB3 ALA 61 -4.390 -7.819 2.733 395 H THR 62 HN THR 62 -5.266 -6.252 3.540 396 HA THR 62 HA THR 62 -6.043 -5.105 6.107 397 HB THR 62 HB THR 62 -3.314 -4.612 4.892 398 HG1 THR 62 HG1 THR 62 -4.250 -6.330 6.863 399 HG21 THR 62 HG21 THR 62 -2.879 -3.242 6.857 400 HG22 THR 62 HG22 THR 62 -4.519 -3.536 7.445 401 HG23 THR 62 HG23 THR 62 -4.265 -2.612 5.964 402 H ALA 63 HN ALA 63 -7.099 -3.247 5.846 403 HA ALA 63 HA ALA 63 -7.259 -2.038 3.211 404 HB1 ALA 63 HB1 ALA 63 -9.336 -2.398 4.464 405 HB2 ALA 63 HB2 ALA 63 -9.060 -0.677 4.178 406 HB3 ALA 63 HB3 ALA 63 -8.730 -1.370 5.764 407 H VAL 64 HN VAL 64 -6.155 -0.315 2.634 408 HA VAL 64 HA VAL 64 -5.110 1.490 4.697 409 HB VAL 64 HB VAL 64 -2.959 1.603 3.369 410 HG11 VAL 64 HG11 VAL 64 -3.069 0.508 5.549 411 HG12 VAL 64 HG12 VAL 64 -1.968 -0.342 4.464 412 HG13 VAL 64 HG13 VAL 64 -3.579 -0.992 4.772 413 HG21 VAL 64 HG21 VAL 64 -2.397 -0.356 2.016 414 HG22 VAL 64 HG22 VAL 64 -3.790 0.509 1.358 415 HG23 VAL 64 HG23 VAL 64 -4.030 -0.988 2.267 416 H CYS 65 HN CYS 65 -4.403 3.527 3.840 417 HA CYS 65 HA CYS 65 -5.748 4.236 1.321 418 HB2 CYS 65 HB2 CYS 65 -6.847 5.180 3.307 419 HB3 CYS 65 HB1 CYS 65 -5.327 5.886 3.826 420 H CYS 66 HN CYS 66 -4.139 4.334 -0.173 421 HA CYS 66 HA CYS 66 -1.521 5.329 0.655 422 HB2 CYS 66 HB2 CYS 66 -2.311 4.236 -2.039 423 HB3 CYS 66 HB1 CYS 66 -0.684 4.410 -1.385 424 H SER 67 HN SER 67 -0.658 7.189 0.110 425 HA SER 67 HA SER 67 -2.355 9.113 -1.267 426 HB2 SER 67 HB2 SER 67 0.221 9.593 0.223 427 HB3 SER 67 HB1 SER 67 -0.995 10.793 -0.215 428 HG SER 67 HG SER 67 -2.155 8.817 1.171 429 H ASP 68 HN ASP 68 0.333 7.166 -1.888 430 HA ASP 68 HA ASP 68 1.225 8.903 -4.094 431 HB2 ASP 68 HB2 ASP 68 2.940 8.338 -2.368 432 HB3 ASP 68 HB1 ASP 68 2.732 6.638 -2.763 433 H ASN 69 HN ASN 69 1.086 8.150 -6.162 434 HA ASN 69 HA ASN 69 -0.323 5.584 -6.448 435 HB2 ASN 69 HB2 ASN 69 -0.483 8.144 -8.017 436 HB3 ASN 69 HB1 ASN 69 -1.077 6.625 -8.674 437 HD21 ASN 69 HD21 ASN 69 -2.506 9.070 -7.993 438 HD22 ASN 69 HD22 ASN 69 -3.725 8.610 -6.858 439 H ASN 70 HN ASN 70 2.695 6.191 -6.557 440 HA ASN 70 HA ASN 70 3.317 5.437 -9.289 441 HB2 ASN 70 HB2 ASN 70 5.068 5.773 -6.849 442 HB3 ASN 70 HB1 ASN 70 5.681 5.289 -8.427 443 HD21 ASN 70 HD21 ASN 70 4.392 7.855 -6.514 444 HD22 ASN 70 HD22 ASN 70 4.732 9.137 -7.636 445 H VAL 71 HN VAL 71 1.741 3.578 -8.823 446 HA VAL 71 HA VAL 71 2.694 1.372 -7.297 447 HB VAL 71 HB VAL 71 0.833 0.134 -8.375 448 HG11 VAL 71 HG11 VAL 71 -0.973 1.465 -7.378 449 HG12 VAL 71 HG12 VAL 71 0.120 2.845 -7.270 450 HG13 VAL 71 HG13 VAL 71 0.445 1.386 -6.332 451 HG21 VAL 71 HG21 VAL 71 -0.741 1.361 -9.811 452 HG22 VAL 71 HG22 VAL 71 0.847 1.198 -10.560 453 HG23 VAL 71 HG23 VAL 71 0.367 2.732 -9.834 454 H SER 72 HN SER 72 3.489 -0.598 -8.029 455 HA SER 72 HA SER 72 4.942 -0.473 -10.553 456 HB2 SER 72 HB2 SER 72 6.159 -2.430 -9.668 457 HB3 SER 72 HB1 SER 72 6.178 -1.094 -8.515 458 HG SER 72 HG SER 72 5.535 -3.432 -7.886 459 H GLY 73 HN GLY 73 2.014 -1.522 -9.487 460 HA2 GLY 73 HA2 GLY 73 0.689 -2.675 -11.287 461 HA3 GLY 73 HA1 GLY 73 1.974 -3.866 -11.272 462 H VAL 74 HN VAL 74 2.279 -3.840 -8.367 463 HA VAL 74 HA VAL 74 -0.365 -4.776 -7.516 464 HB VAL 74 HB VAL 74 0.484 -6.752 -6.493 465 HG11 VAL 74 HG11 VAL 74 1.435 -7.954 -8.509 466 HG12 VAL 74 HG12 VAL 74 1.394 -6.394 -9.338 467 HG13 VAL 74 HG13 VAL 74 -0.101 -7.121 -8.750 468 HG21 VAL 74 HG21 VAL 74 2.876 -7.411 -6.777 469 HG22 VAL 74 HG22 VAL 74 2.597 -6.050 -5.694 470 HG23 VAL 74 HG23 VAL 74 3.195 -5.766 -7.329 471 H ILE 75 HN ILE 75 2.306 -2.865 -6.823 472 HA ILE 75 HA ILE 75 1.966 -3.126 -3.936 473 HB ILE 75 HB ILE 75 3.829 -1.608 -3.673 474 HG12 ILE 75 HG12 ILE 75 4.146 -1.526 -6.660 475 HG13 ILE 75 HG11 ILE 75 3.191 -0.329 -5.807 476 HG21 ILE 75 HG21 ILE 75 4.379 -3.722 -5.729 477 HG22 ILE 75 HG22 ILE 75 4.316 -3.955 -3.981 478 HG23 ILE 75 HG23 ILE 75 5.580 -2.954 -4.695 479 HD11 ILE 75 HD11 ILE 75 5.430 0.481 -6.221 480 HD12 ILE 75 HD12 ILE 75 6.100 -0.907 -5.366 481 HD13 ILE 75 HD13 ILE 75 5.150 0.292 -4.490 482 H ALA 76 HN ALA 76 2.250 -0.948 -2.806 483 HA ALA 76 HA ALA 76 0.818 1.275 -4.008 484 HB1 ALA 76 HB1 ALA 76 -0.978 -0.037 -3.033 485 HB2 ALA 76 HB2 ALA 76 -0.727 1.424 -2.077 486 HB3 ALA 76 HB3 ALA 76 -0.110 -0.128 -1.497 487 H ILE 77 HN ILE 77 1.377 3.273 -2.949 488 HA ILE 77 HA ILE 77 3.525 2.969 -0.952 489 HB ILE 77 HB ILE 77 3.525 4.953 -3.233 490 HG12 ILE 77 HG12 ILE 77 5.244 2.498 -2.820 491 HG13 ILE 77 HG11 ILE 77 3.913 2.615 -3.967 492 HG21 ILE 77 HG21 ILE 77 5.838 5.403 -2.498 493 HG22 ILE 77 HG22 ILE 77 5.584 4.342 -1.114 494 HG23 ILE 77 HG23 ILE 77 4.644 5.826 -1.272 495 HD11 ILE 77 HD11 ILE 77 6.433 4.261 -4.014 496 HD12 ILE 77 HD12 ILE 77 5.100 4.375 -5.164 497 HD13 ILE 77 HD13 ILE 77 6.056 2.897 -5.067 498 H GLY 78 HN GLY 78 3.615 4.454 0.687 499 HA2 GLY 78 HA2 GLY 78 2.989 6.195 2.053 500 HA3 GLY 78 HA1 GLY 78 2.245 6.948 0.652 501 H CYS 79 HN CYS 79 1.642 3.942 2.466 502 HA CYS 79 HA CYS 79 -1.212 4.583 2.282 503 HB2 CYS 79 HB2 CYS 79 -0.034 1.888 2.925 504 HB3 CYS 79 HB1 CYS 79 -1.650 2.267 2.352 505 H LEU 80 HN LEU 80 -2.380 5.003 4.004 506 HA LEU 80 HA LEU 80 -1.268 4.409 6.660 507 HB2 LEU 80 HB2 LEU 80 -3.524 6.254 5.875 508 HB3 LEU 80 HB1 LEU 80 -2.928 5.995 7.506 509 HG LEU 80 HG LEU 80 -1.326 7.212 5.252 510 HD11 LEU 80 HD11 LEU 80 -3.124 8.679 5.987 511 HD12 LEU 80 HD12 LEU 80 -1.555 9.295 6.509 512 HD13 LEU 80 HD13 LEU 80 -2.612 8.484 7.663 513 HD21 LEU 80 HD21 LEU 80 -0.701 6.851 8.181 514 HD22 LEU 80 HD22 LEU 80 0.280 7.757 7.029 515 HD23 LEU 80 HD23 LEU 80 0.077 6.016 6.836 516 HA PRO 81 HA PRO 81 -4.218 1.114 7.024 517 HB2 PRO 81 HB2 PRO 81 -3.918 1.433 9.922 518 HB3 PRO 81 HB1 PRO 81 -3.504 0.059 8.904 519 HG2 PRO 81 HG2 PRO 81 -1.624 1.609 10.032 520 HG3 PRO 81 HG1 PRO 81 -1.397 0.859 8.444 521 HD2 PRO 81 HD2 PRO 81 -2.113 3.688 9.113 522 HD3 PRO 81 HD1 PRO 81 -1.030 3.068 7.859 523 H VAL 82 HN VAL 82 -6.352 1.340 6.853 524 HA VAL 82 HA VAL 82 -7.667 3.411 8.454 525 HB VAL 82 HB VAL 82 -9.481 3.143 6.605 526 HG11 VAL 82 HG11 VAL 82 -8.383 4.890 5.264 527 HG12 VAL 82 HG12 VAL 82 -6.857 4.534 6.073 528 HG13 VAL 82 HG13 VAL 82 -8.213 5.188 6.993 529 HG21 VAL 82 HG21 VAL 82 -7.042 2.173 5.143 530 HG22 VAL 82 HG22 VAL 82 -8.586 2.603 4.409 531 HG23 VAL 82 HG23 VAL 82 -8.485 1.225 5.504 532 H THR 83 HN THR 83 -9.721 3.019 9.227 533 HA THR 83 HA THR 83 -10.915 0.396 9.136 534 HB THR 83 HB THR 83 -9.956 1.488 11.782 535 HG1 THR 83 HG1 THR 83 -8.664 -0.002 9.979 536 HG21 THR 83 HG21 THR 83 -11.456 -1.022 11.071 537 HG22 THR 83 HG22 THR 83 -12.019 0.317 12.074 538 HG23 THR 83 HG23 THR 83 -10.716 -0.726 12.642 539 H LEU 84 HN LEU 84 -13.046 0.651 9.220 540 HA LEU 84 HA LEU 84 -15.071 1.679 9.215 541 HB2 LEU 84 HB2 LEU 84 -13.948 2.005 11.951 542 HB3 LEU 84 HB1 LEU 84 -15.498 2.734 11.581 543 HG LEU 84 HG LEU 84 -16.391 0.527 10.978 544 HD11 LEU 84 HD11 LEU 84 -14.268 -0.495 10.248 545 HD12 LEU 84 HD12 LEU 84 -15.170 -1.498 11.381 546 HD13 LEU 84 HD13 LEU 84 -13.768 -0.586 11.937 547 HD21 LEU 84 HD21 LEU 84 -16.451 -0.400 13.235 548 HD22 LEU 84 HD22 LEU 84 -16.623 1.355 13.259 549 HD23 LEU 84 HD23 LEU 84 -15.081 0.614 13.688 Start of MODEL 5 1 H1 GLY 1 HT1 GLY 1 -18.882 2.141 -1.864 2 H2 GLY 1 HT2 GLY 1 -19.188 2.340 -3.513 3 H3 GLY 1 HT3 GLY 1 -18.082 3.349 -2.732 4 HA2 GLY 1 HA1 GLY 1 -16.603 1.495 -2.331 5 HA3 GLY 1 HA2 GLY 1 -17.762 0.425 -3.103 6 H SER 2 HN SER 2 -16.722 3.679 -4.091 7 HA SER 2 HA SER 2 -16.356 2.731 -6.786 8 HB2 SER 2 HB2 SER 2 -15.792 5.474 -5.638 9 HB3 SER 2 HB1 SER 2 -15.953 5.062 -7.345 10 HG SER 2 HG SER 2 -18.133 4.174 -6.271 11 H TRP 3 HN TRP 3 -14.174 4.665 -4.705 12 HA TRP 3 HA TRP 3 -11.960 2.941 -5.572 13 HB2 TRP 3 HB2 TRP 3 -11.861 5.966 -5.566 14 HB3 TRP 3 HB1 TRP 3 -10.523 4.894 -5.947 15 HD1 TRP 3 HD1 TRP 3 -13.428 6.641 -7.517 16 HE1 TRP 3 HE1 TRP 3 -13.612 5.979 -10.000 17 HE3 TRP 3 HE3 TRP 3 -10.128 2.761 -7.545 18 HZ2 TRP 3 HZ2 TRP 3 -12.492 4.051 -11.740 19 HZ3 TRP 3 HZ3 TRP 3 -9.733 1.549 -9.654 20 HH2 TRP 3 HH2 TRP 3 -10.893 2.184 -11.708 21 H GLY 4 HN GLY 4 -13.650 3.600 -3.090 22 HA2 GLY 4 HA2 GLY 4 -13.082 3.143 -0.867 23 HA3 GLY 4 HA1 GLY 4 -11.401 3.463 -1.260 24 H GLN 5 HN GLN 5 -14.169 4.656 0.213 25 HA GLN 5 HA GLN 5 -13.580 7.450 -0.018 26 HB2 GLN 5 HB2 GLN 5 -15.299 6.017 2.019 27 HB3 GLN 5 HB1 GLN 5 -15.306 7.740 1.681 28 HG2 GLN 5 HG2 GLN 5 -16.073 5.604 -0.290 29 HG3 GLN 5 HG1 GLN 5 -17.209 6.524 0.690 30 HE21 GLN 5 HE21 GLN 5 -18.219 7.320 -1.135 31 HE22 GLN 5 HE22 GLN 5 -17.508 8.543 -2.129 32 H CYS 6 HN CYS 6 -11.789 8.261 0.855 33 HA CYS 6 HA CYS 6 -11.018 7.344 3.533 34 HB2 CYS 6 HB2 CYS 6 -9.521 6.181 2.092 35 HB3 CYS 6 HB1 CYS 6 -9.249 7.612 1.105 36 H SER 7 HN SER 7 -9.773 9.693 1.158 37 HA SER 7 HA SER 7 -10.575 11.956 2.660 38 HB2 SER 7 HB2 SER 7 -8.210 12.676 3.265 39 HB3 SER 7 HB1 SER 7 -8.882 11.366 4.234 40 HG SER 7 HG SER 7 -7.531 9.963 3.329 41 H THR 8 HN THR 8 -7.463 11.540 1.047 42 HA THR 8 HA THR 8 -8.512 13.135 -1.198 43 HB THR 8 HB THR 8 -5.652 13.145 -0.228 44 HG1 THR 8 HG1 THR 8 -7.902 14.528 0.663 45 HG21 THR 8 HG21 THR 8 -5.999 13.829 -2.564 46 HG22 THR 8 HG22 THR 8 -5.483 15.186 -1.563 47 HG23 THR 8 HG23 THR 8 -7.175 15.031 -2.033 48 H GLY 9 HN GLY 9 -6.572 10.428 -0.176 49 HA2 GLY 9 HA2 GLY 9 -5.629 9.883 -2.868 50 HA3 GLY 9 HA1 GLY 9 -5.217 8.987 -1.416 51 H SER 10 HN SER 10 -5.760 6.953 -1.734 52 HA SER 10 HA SER 10 -8.475 6.288 -2.574 53 HB2 SER 10 HB2 SER 10 -7.002 6.391 -4.630 54 HB3 SER 10 HB1 SER 10 -6.041 5.093 -3.930 55 HG SER 10 HG SER 10 -8.762 4.601 -4.024 56 H ILE 11 HN ILE 11 -9.080 4.131 -1.918 57 HA ILE 11 HA ILE 11 -7.261 3.045 0.104 58 HB ILE 11 HB ILE 11 -10.193 2.477 -0.317 59 HG12 ILE 11 HG12 ILE 11 -8.680 4.041 1.772 60 HG13 ILE 11 HG11 ILE 11 -9.801 4.681 0.580 61 HG21 ILE 11 HG21 ILE 11 -8.962 0.527 0.554 62 HG22 ILE 11 HG22 ILE 11 -10.102 1.191 1.725 63 HG23 ILE 11 HG23 ILE 11 -8.377 1.523 1.888 64 HD11 ILE 11 HD11 ILE 11 -11.626 3.476 1.643 65 HD12 ILE 11 HD12 ILE 11 -10.814 4.545 2.786 66 HD13 ILE 11 HD13 ILE 11 -10.498 2.810 2.822 67 H GLN 12 HN GLN 12 -6.396 1.145 -0.020 68 HA GLN 12 HA GLN 12 -7.252 -0.712 -2.118 69 HB2 GLN 12 HB2 GLN 12 -4.641 -1.306 -2.137 70 HB3 GLN 12 HB1 GLN 12 -5.370 -0.185 -3.266 71 HG2 GLN 12 HG2 GLN 12 -4.180 0.766 -0.697 72 HG3 GLN 12 HG1 GLN 12 -3.175 0.444 -2.101 73 HE21 GLN 12 HE21 GLN 12 -5.105 1.331 -4.049 74 HE22 GLN 12 HE22 GLN 12 -5.186 3.042 -3.925 75 H CYS 13 HN CYS 13 -6.342 -2.913 -1.747 76 HA CYS 13 HA CYS 13 -6.266 -3.436 1.144 77 HB2 CYS 13 HB2 CYS 13 -8.271 -4.370 0.243 78 HB3 CYS 13 HB1 CYS 13 -7.419 -5.084 -1.117 79 H CYS 14 HN CYS 14 -4.209 -3.608 1.640 80 HA CYS 14 HA CYS 14 -2.283 -4.718 -0.209 81 HB2 CYS 14 HB2 CYS 14 -2.042 -3.501 2.533 82 HB3 CYS 14 HB1 CYS 14 -0.676 -4.220 1.692 83 H GLN 15 HN GLN 15 -1.597 -6.707 -0.228 84 HA GLN 15 HA GLN 15 -2.398 -8.643 1.662 85 HB2 GLN 15 HB2 GLN 15 -1.776 -10.000 -0.003 86 HB3 GLN 15 HB1 GLN 15 -1.222 -8.596 -0.891 87 HG2 GLN 15 HG2 GLN 15 0.548 -10.130 -0.910 88 HG3 GLN 15 HG1 GLN 15 0.997 -8.883 0.248 89 HE21 GLN 15 HE21 GLN 15 -1.350 -11.377 0.953 90 HE22 GLN 15 HE22 GLN 15 -0.385 -12.229 2.104 91 H ASN 16 HN ASN 16 0.345 -6.532 1.325 92 HA ASN 16 HA ASN 16 1.242 -7.325 4.000 93 HB2 ASN 16 HB2 ASN 16 2.587 -8.198 1.809 94 HB3 ASN 16 HB1 ASN 16 3.367 -6.649 2.090 95 HD21 ASN 16 HD21 ASN 16 4.309 -9.409 2.361 96 HD22 ASN 16 HD22 ASN 16 4.920 -9.531 3.977 97 H VAL 17 HN VAL 17 1.277 -5.549 5.223 98 HA VAL 17 HA VAL 17 1.850 -2.966 3.927 99 HB VAL 17 HB VAL 17 0.466 -3.452 6.573 100 HG11 VAL 17 HG11 VAL 17 -0.032 -1.054 6.516 101 HG12 VAL 17 HG12 VAL 17 0.914 -0.894 5.035 102 HG13 VAL 17 HG13 VAL 17 1.707 -1.350 6.543 103 HG21 VAL 17 HG21 VAL 17 -1.552 -2.661 5.430 104 HG22 VAL 17 HG22 VAL 17 -0.918 -4.134 4.694 105 HG23 VAL 17 HG23 VAL 17 -0.652 -2.574 3.916 106 H VAL 18 HN VAL 18 3.924 -2.468 4.123 107 HA VAL 18 HA VAL 18 5.230 -2.863 6.731 108 HB VAL 18 HB VAL 18 7.325 -3.498 5.524 109 HG11 VAL 18 HG11 VAL 18 5.953 -5.213 6.564 110 HG12 VAL 18 HG12 VAL 18 6.666 -5.819 5.070 111 HG13 VAL 18 HG13 VAL 18 4.971 -5.337 5.104 112 HG21 VAL 18 HG21 VAL 18 5.477 -3.722 3.147 113 HG22 VAL 18 HG22 VAL 18 7.138 -4.310 3.207 114 HG23 VAL 18 HG23 VAL 18 6.810 -2.582 3.337 115 HA PRO 19 HA PRO 19 6.717 1.316 6.025 116 HB2 PRO 19 HB2 PRO 19 9.061 0.543 7.611 117 HB3 PRO 19 HB1 PRO 19 7.877 1.812 7.911 118 HG2 PRO 19 HG2 PRO 19 7.952 -0.441 9.385 119 HG3 PRO 19 HG1 PRO 19 6.437 0.405 9.022 120 HD2 PRO 19 HD2 PRO 19 7.560 -2.083 7.805 121 HD3 PRO 19 HD1 PRO 19 5.874 -1.670 8.183 122 H GLY 20 HN GLY 20 7.983 2.189 4.475 123 HA2 GLY 20 HA2 GLY 20 9.298 0.476 2.653 124 HA3 GLY 20 HA1 GLY 20 9.362 2.232 2.640 125 H ASP 21 HN ASP 21 10.444 2.287 5.388 126 HA ASP 21 HA ASP 21 13.230 1.676 4.722 127 HB2 ASP 21 HB2 ASP 21 13.821 3.195 6.512 128 HB3 ASP 21 HB1 ASP 21 12.612 3.974 5.497 129 H SER 22 HN SER 22 10.843 -0.014 5.931 130 HA SER 22 HA SER 22 12.028 -1.077 8.327 131 HB2 SER 22 HB2 SER 22 9.618 -1.189 8.108 132 HB3 SER 22 HB1 SER 22 9.745 -2.047 6.585 133 HG SER 22 HG SER 22 10.126 -2.953 9.205 134 H ASP 23 HN ASP 23 12.820 -3.271 8.511 135 HA ASP 23 HA ASP 23 14.722 -3.984 6.599 136 HB2 ASP 23 HB2 ASP 23 13.369 -5.545 8.791 137 HB3 ASP 23 HB1 ASP 23 14.521 -6.321 7.713 138 H LEU 24 HN LEU 24 11.402 -5.085 7.050 139 HA LEU 24 HA LEU 24 11.442 -6.942 4.903 140 HB2 LEU 24 HB2 LEU 24 9.470 -5.845 6.755 141 HB3 LEU 24 HB1 LEU 24 8.812 -6.175 5.166 142 HG LEU 24 HG LEU 24 8.507 -8.055 6.711 143 HD11 LEU 24 HD11 LEU 24 10.420 -8.629 4.453 144 HD12 LEU 24 HD12 LEU 24 8.672 -8.459 4.308 145 HD13 LEU 24 HD13 LEU 24 9.354 -9.798 5.230 146 HD21 LEU 24 HD21 LEU 24 10.470 -7.778 8.098 147 HD22 LEU 24 HD22 LEU 24 11.520 -8.140 6.729 148 HD23 LEU 24 HD23 LEU 24 10.463 -9.390 7.384 149 H GLY 25 HN GLY 25 9.913 -3.733 5.169 150 HA2 GLY 25 HA2 GLY 25 8.997 -3.556 2.554 151 HA3 GLY 25 HA1 GLY 25 9.361 -2.178 3.580 152 H THR 26 HN THR 26 12.149 -2.681 3.849 153 HA THR 26 HA THR 26 13.017 -1.326 1.505 154 HB THR 26 HB THR 26 14.675 -2.507 3.737 155 HG1 THR 26 HG1 THR 26 13.146 -0.184 3.501 156 HG21 THR 26 HG21 THR 26 16.389 -0.948 3.071 157 HG22 THR 26 HG22 THR 26 15.351 -0.293 1.806 158 HG23 THR 26 HG23 THR 26 15.952 -1.948 1.686 159 H LEU 27 HN LEU 27 13.448 -4.578 2.792 160 HA LEU 27 HA LEU 27 15.165 -5.543 0.779 161 HB2 LEU 27 HB2 LEU 27 14.430 -6.546 3.088 162 HB3 LEU 27 HB1 LEU 27 13.124 -7.257 2.164 163 HG LEU 27 HG LEU 27 15.044 -8.786 2.563 164 HD11 LEU 27 HD11 LEU 27 14.500 -8.121 -0.322 165 HD12 LEU 27 HD12 LEU 27 13.564 -9.214 0.698 166 HD13 LEU 27 HD13 LEU 27 15.226 -9.616 0.268 167 HD21 LEU 27 HD21 LEU 27 17.108 -8.457 1.332 168 HD22 LEU 27 HD22 LEU 27 16.819 -7.116 2.441 169 HD23 LEU 27 HD23 LEU 27 16.512 -6.917 0.717 170 H LEU 28 HN LEU 28 11.676 -5.329 1.089 171 HA LEU 28 HA LEU 28 11.054 -6.955 -1.153 172 HB2 LEU 28 HB2 LEU 28 9.350 -4.801 0.104 173 HB3 LEU 28 HB1 LEU 28 8.791 -6.080 -0.949 174 HG LEU 28 HG LEU 28 9.680 -6.264 1.910 175 HD11 LEU 28 HD11 LEU 28 7.339 -5.801 1.485 176 HD12 LEU 28 HD12 LEU 28 7.543 -7.416 2.163 177 HD13 LEU 28 HD13 LEU 28 7.230 -7.215 0.438 178 HD21 LEU 28 HD21 LEU 28 10.890 -8.018 0.784 179 HD22 LEU 28 HD22 LEU 28 9.418 -8.551 -0.033 180 HD23 LEU 28 HD23 LEU 28 9.563 -8.708 1.718 181 H LEU 29 HN LEU 29 11.356 -3.446 -0.713 182 HA LEU 29 HA LEU 29 10.592 -2.927 -3.430 183 HB2 LEU 29 HB2 LEU 29 11.087 -0.605 -2.944 184 HB3 LEU 29 HB1 LEU 29 10.096 -1.303 -1.698 185 HG LEU 29 HG LEU 29 12.261 -1.544 -0.343 186 HD11 LEU 29 HD11 LEU 29 13.849 -1.147 -2.165 187 HD12 LEU 29 HD12 LEU 29 14.030 0.045 -0.877 188 HD13 LEU 29 HD13 LEU 29 13.202 0.481 -2.373 189 HD21 LEU 29 HD21 LEU 29 10.539 0.040 0.206 190 HD22 LEU 29 HD22 LEU 29 11.121 1.150 -1.038 191 HD23 LEU 29 HD23 LEU 29 12.118 0.809 0.380 192 H ASP 30 HN ASP 30 13.563 -3.543 -1.775 193 HA ASP 30 HA ASP 30 15.338 -2.584 -3.762 194 HB2 ASP 30 HB2 ASP 30 15.989 -3.254 -1.434 195 HB3 ASP 30 HB1 ASP 30 15.772 -4.932 -1.908 196 H GLU 31 HN GLU 31 13.476 -5.471 -3.363 197 HA GLU 31 HA GLU 31 14.685 -6.978 -5.455 198 HB2 GLU 31 HB2 GLU 31 13.586 -8.204 -3.760 199 HB3 GLU 31 HB1 GLU 31 12.169 -7.182 -3.847 200 HG2 GLU 31 HG2 GLU 31 11.619 -8.073 -6.007 201 HG3 GLU 31 HG1 GLU 31 13.050 -9.101 -5.979 202 H LEU 32 HN LEU 32 11.965 -4.855 -5.059 203 HA LEU 32 HA LEU 32 10.883 -5.287 -7.675 204 HB2 LEU 32 HB2 LEU 32 10.284 -3.392 -5.429 205 HB3 LEU 32 HB1 LEU 32 9.435 -3.302 -6.957 206 HG LEU 32 HG LEU 32 9.492 -5.732 -5.170 207 HD11 LEU 32 HD11 LEU 32 7.342 -3.660 -5.557 208 HD12 LEU 32 HD12 LEU 32 8.307 -3.898 -4.100 209 HD13 LEU 32 HD13 LEU 32 7.181 -5.148 -4.627 210 HD21 LEU 32 HD21 LEU 32 7.880 -5.085 -7.634 211 HD22 LEU 32 HD22 LEU 32 7.640 -6.493 -6.601 212 HD23 LEU 32 HD23 LEU 32 9.146 -6.306 -7.497 213 H GLY 33 HN GLY 33 13.255 -3.213 -6.329 214 HA2 GLY 33 HA2 GLY 33 14.725 -1.817 -7.457 215 HA3 GLY 33 HA1 GLY 33 13.777 -2.043 -8.919 216 H ILE 34 HN ILE 34 12.934 -0.798 -5.696 217 HA ILE 34 HA ILE 34 11.837 1.600 -7.021 218 HB ILE 34 HB ILE 34 11.107 0.649 -4.254 219 HG12 ILE 34 HG12 ILE 34 9.621 0.029 -6.819 220 HG13 ILE 34 HG11 ILE 34 10.624 -1.130 -5.953 221 HG21 ILE 34 HG21 ILE 34 10.582 2.964 -4.799 222 HG22 ILE 34 HG22 ILE 34 9.111 2.007 -4.628 223 HG23 ILE 34 HG23 ILE 34 9.702 2.438 -6.232 224 HD11 ILE 34 HD11 ILE 34 8.154 0.211 -4.882 225 HD12 ILE 34 HD12 ILE 34 9.153 -0.959 -4.020 226 HD13 ILE 34 HD13 ILE 34 8.269 -1.449 -5.465 227 H VAL 35 HN VAL 35 12.438 3.612 -6.304 228 HA VAL 35 HA VAL 35 14.163 3.723 -3.934 229 HB VAL 35 HB VAL 35 15.595 4.047 -5.842 230 HG11 VAL 35 HG11 VAL 35 13.962 4.730 -7.502 231 HG12 VAL 35 HG12 VAL 35 15.294 5.884 -7.431 232 HG13 VAL 35 HG13 VAL 35 13.748 6.275 -6.679 233 HG21 VAL 35 HG21 VAL 35 15.023 6.650 -4.436 234 HG22 VAL 35 HG22 VAL 35 16.492 6.285 -5.344 235 HG23 VAL 35 HG23 VAL 35 16.104 5.371 -3.885 236 H LEU 36 HN LEU 36 12.854 4.525 -2.430 237 HA LEU 36 HA LEU 36 10.881 6.546 -3.087 238 HB2 LEU 36 HB2 LEU 36 11.580 5.283 -0.442 239 HB3 LEU 36 HB1 LEU 36 10.159 6.247 -0.784 240 HG LEU 36 HG LEU 36 10.704 3.681 -2.244 241 HD11 LEU 36 HD11 LEU 36 10.728 3.191 0.131 242 HD12 LEU 36 HD12 LEU 36 9.259 2.568 -0.624 243 HD13 LEU 36 HD13 LEU 36 9.199 4.045 0.338 244 HD21 LEU 36 HD21 LEU 36 8.221 5.288 -1.682 245 HD22 LEU 36 HD22 LEU 36 8.259 3.739 -2.522 246 HD23 LEU 36 HD23 LEU 36 9.054 5.145 -3.228 247 H GLU 37 HN GLU 37 10.989 8.648 -2.590 248 HA GLU 37 HA GLU 37 13.428 9.847 -1.770 249 HB2 GLU 37 HB2 GLU 37 11.935 11.080 -3.203 250 HB3 GLU 37 HB1 GLU 37 10.622 10.939 -2.042 251 HG2 GLU 37 HG2 GLU 37 11.826 12.360 -0.482 252 HG3 GLU 37 HG1 GLU 37 13.173 12.475 -1.612 253 H ASP 38 HN ASP 38 10.416 9.012 -0.180 254 HA ASP 38 HA ASP 38 11.773 9.327 2.390 255 HB2 ASP 38 HB2 ASP 38 8.990 10.244 1.659 256 HB3 ASP 38 HB1 ASP 38 9.463 9.932 3.325 257 HA PRO 39 HA PRO 39 10.189 5.068 1.882 258 HB2 PRO 39 HB2 PRO 39 12.186 3.876 3.269 259 HB3 PRO 39 HB1 PRO 39 12.347 4.322 1.567 260 HG2 PRO 39 HG2 PRO 39 13.338 5.747 4.002 261 HG3 PRO 39 HG1 PRO 39 14.156 5.479 2.452 262 HD2 PRO 39 HD2 PRO 39 12.950 7.828 3.115 263 HD3 PRO 39 HD1 PRO 39 13.085 7.246 1.443 264 H THR 40 HN THR 40 10.291 7.260 4.270 265 HA THR 40 HA THR 40 9.935 5.585 6.573 266 HB THR 40 HB THR 40 9.053 7.884 7.507 267 HG1 THR 40 HG1 THR 40 10.366 9.510 6.151 268 HG21 THR 40 HG21 THR 40 11.932 7.473 6.690 269 HG22 THR 40 HG22 THR 40 11.167 6.788 8.124 270 HG23 THR 40 HG23 THR 40 11.356 8.535 7.976 271 H VAL 41 HN VAL 41 7.979 6.403 3.997 272 HA VAL 41 HA VAL 41 5.463 6.360 5.412 273 HB VAL 41 HB VAL 41 4.419 6.386 3.210 274 HG11 VAL 41 HG11 VAL 41 6.744 8.295 3.393 275 HG12 VAL 41 HG12 VAL 41 5.158 8.506 4.137 276 HG13 VAL 41 HG13 VAL 41 5.315 8.510 2.381 277 HG21 VAL 41 HG21 VAL 41 5.954 4.898 2.035 278 HG22 VAL 41 HG22 VAL 41 7.215 6.130 2.105 279 HG23 VAL 41 HG23 VAL 41 5.754 6.416 1.160 280 H LEU 42 HN LEU 42 3.807 4.729 4.905 281 HA LEU 42 HA LEU 42 4.901 2.056 5.043 282 HB2 LEU 42 HB2 LEU 42 2.062 3.078 5.113 283 HB3 LEU 42 HB1 LEU 42 2.500 1.391 5.285 284 HG LEU 42 HG LEU 42 3.314 3.602 7.176 285 HD11 LEU 42 HD11 LEU 42 0.927 3.131 7.290 286 HD12 LEU 42 HD12 LEU 42 1.755 2.549 8.734 287 HD13 LEU 42 HD13 LEU 42 1.266 1.410 7.479 288 HD21 LEU 42 HD21 LEU 42 4.962 1.818 7.082 289 HD22 LEU 42 HD22 LEU 42 3.698 0.616 7.330 290 HD23 LEU 42 HD23 LEU 42 4.082 1.768 8.608 291 H ILE 43 HN ILE 43 5.161 0.739 3.385 292 HA ILE 43 HA ILE 43 3.717 1.358 0.908 293 HB ILE 43 HB ILE 43 5.396 -0.112 -0.238 294 HG12 ILE 43 HG12 ILE 43 6.971 0.218 2.322 295 HG13 ILE 43 HG11 ILE 43 6.204 -1.280 1.804 296 HG21 ILE 43 HG21 ILE 43 5.503 2.293 -0.395 297 HG22 ILE 43 HG22 ILE 43 7.134 1.629 -0.300 298 HG23 ILE 43 HG23 ILE 43 6.404 2.383 1.118 299 HD11 ILE 43 HD11 ILE 43 7.621 -1.321 -0.183 300 HD12 ILE 43 HD12 ILE 43 8.580 -1.282 1.298 301 HD13 ILE 43 HD13 ILE 43 8.386 0.182 0.332 302 H GLY 44 HN GLY 44 2.549 -0.180 -0.117 303 HA2 GLY 44 HA2 GLY 44 1.985 -2.560 1.525 304 HA3 GLY 44 HA1 GLY 44 0.798 -1.736 0.540 305 H ASP 45 HN ASP 45 3.098 -4.203 0.674 306 HA ASP 45 HA ASP 45 3.241 -4.582 -2.196 307 HB2 ASP 45 HB2 ASP 45 5.173 -5.253 -0.844 308 HB3 ASP 45 HB1 ASP 45 4.160 -6.363 0.078 309 H GLY 46 HN GLY 46 1.927 -5.871 -3.364 310 HA2 GLY 46 HA2 GLY 46 0.280 -7.468 -3.787 311 HA3 GLY 46 HA1 GLY 46 0.314 -7.876 -2.099 312 H CYS 47 HN CYS 47 -0.244 -4.700 -3.514 313 HA CYS 47 HA CYS 47 -2.739 -4.604 -1.965 314 HB2 CYS 47 HB2 CYS 47 -0.595 -2.922 -1.856 315 HB3 CYS 47 HB1 CYS 47 -1.640 -2.095 -3.011 316 H ASP 48 HN ASP 48 -4.434 -4.975 -3.165 317 HA ASP 48 HA ASP 48 -4.557 -3.854 -5.870 318 HB2 ASP 48 HB2 ASP 48 -6.377 -5.846 -4.508 319 HB3 ASP 48 HB1 ASP 48 -6.603 -5.238 -6.138 320 HA PRO 49 HA PRO 49 -6.952 -0.442 -4.373 321 HB2 PRO 49 HB2 PRO 49 -8.233 -0.443 -7.023 322 HB3 PRO 49 HB1 PRO 49 -7.275 0.808 -6.246 323 HG2 PRO 49 HG2 PRO 49 -6.349 -0.645 -8.316 324 HG3 PRO 49 HG1 PRO 49 -5.296 -0.014 -7.038 325 HD2 PRO 49 HD2 PRO 49 -6.287 -2.789 -7.477 326 HD3 PRO 49 HD1 PRO 49 -4.748 -2.221 -6.809 327 H ILE 50 HN ILE 50 -8.816 -0.410 -3.241 328 HA ILE 50 HA ILE 50 -10.698 -2.572 -3.679 329 HB ILE 50 HB ILE 50 -10.917 -0.372 -1.618 330 HG12 ILE 50 HG12 ILE 50 -9.596 -3.090 -1.431 331 HG13 ILE 50 HG11 ILE 50 -8.796 -1.530 -1.313 332 HG21 ILE 50 HG21 ILE 50 -12.077 -3.155 -1.694 333 HG22 ILE 50 HG22 ILE 50 -12.960 -1.686 -2.120 334 HG23 ILE 50 HG23 ILE 50 -12.378 -1.920 -0.471 335 HD11 ILE 50 HD11 ILE 50 -9.032 -2.466 0.877 336 HD12 ILE 50 HD12 ILE 50 -10.761 -2.703 0.633 337 HD13 ILE 50 HD13 ILE 50 -10.103 -1.072 0.738 338 H THR 51 HN THR 51 -11.581 -2.075 -5.605 339 HA THR 51 HA THR 51 -13.237 0.354 -5.735 340 HB THR 51 HB THR 51 -11.462 0.328 -7.415 341 HG1 THR 51 HG1 THR 51 -13.615 1.148 -7.938 342 HG21 THR 51 HG21 THR 51 -12.695 -2.257 -8.354 343 HG22 THR 51 HG22 THR 51 -11.095 -2.050 -7.637 344 HG23 THR 51 HG23 THR 51 -11.452 -1.351 -9.216 345 H VAL 52 HN VAL 52 -13.825 -2.177 -4.495 346 HA VAL 52 HA VAL 52 -15.983 -3.224 -6.180 347 HB VAL 52 HB VAL 52 -14.281 -4.852 -5.405 348 HG11 VAL 52 HG11 VAL 52 -15.269 -4.124 -2.654 349 HG12 VAL 52 HG12 VAL 52 -13.652 -3.852 -3.302 350 HG13 VAL 52 HG13 VAL 52 -14.228 -5.496 -3.028 351 HG21 VAL 52 HG21 VAL 52 -15.833 -6.519 -4.532 352 HG22 VAL 52 HG22 VAL 52 -16.533 -5.608 -5.869 353 HG23 VAL 52 HG23 VAL 52 -17.010 -5.249 -4.211 354 H ALA 53 HN ALA 53 -18.085 -3.319 -5.366 355 HA ALA 53 HA ALA 53 -18.636 -1.364 -3.295 356 HB1 ALA 53 HB1 ALA 53 -20.531 -2.903 -5.063 357 HB2 ALA 53 HB2 ALA 53 -19.903 -1.286 -5.378 358 HB3 ALA 53 HB3 ALA 53 -20.963 -1.566 -3.998 359 H GLY 54 HN GLY 54 -18.645 -4.802 -3.680 360 HA2 GLY 54 HA2 GLY 54 -20.329 -5.387 -1.440 361 HA3 GLY 54 HA1 GLY 54 -19.271 -6.517 -2.273 362 H SER 55 HN SER 55 -19.785 -4.827 0.562 363 HA SER 55 HA SER 55 -17.110 -4.288 1.348 364 HB2 SER 55 HB2 SER 55 -19.558 -4.642 3.089 365 HB3 SER 55 HB1 SER 55 -18.060 -3.825 3.538 366 HG SER 55 HG SER 55 -19.651 -2.334 2.886 367 H SER 56 HN SER 56 -18.959 -7.152 1.242 368 HA SER 56 HA SER 56 -17.767 -8.526 3.427 369 HB2 SER 56 HB2 SER 56 -19.949 -9.152 2.400 370 HB3 SER 56 HB1 SER 56 -19.080 -9.692 0.966 371 HG SER 56 HG SER 56 -18.585 -10.700 3.569 372 H ASP 57 HN ASP 57 -16.850 -7.969 0.120 373 HA ASP 57 HA ASP 57 -14.472 -9.654 0.538 374 HB2 ASP 57 HB2 ASP 57 -14.472 -10.104 -1.913 375 HB3 ASP 57 HB1 ASP 57 -15.872 -10.773 -1.085 376 H ALA 58 HN ALA 58 -14.891 -6.815 1.049 377 HA ALA 58 HA ALA 58 -13.805 -5.266 -1.049 378 HB1 ALA 58 HB1 ALA 58 -13.635 -3.473 0.590 379 HB2 ALA 58 HB2 ALA 58 -13.945 -4.627 1.887 380 HB3 ALA 58 HB3 ALA 58 -15.197 -4.282 0.695 381 H CYS 59 HN CYS 59 -12.407 -7.066 1.535 382 HA CYS 59 HA CYS 59 -9.784 -6.707 0.379 383 HB2 CYS 59 HB2 CYS 59 -9.934 -4.781 1.893 384 HB3 CYS 59 HB1 CYS 59 -10.327 -5.854 3.230 385 H SER 60 HN SER 60 -8.335 -8.327 0.930 386 HA SER 60 HA SER 60 -9.482 -10.532 2.505 387 HB2 SER 60 HB2 SER 60 -8.062 -12.008 1.024 388 HB3 SER 60 HB1 SER 60 -9.387 -11.184 0.202 389 HG SER 60 HG SER 60 -6.743 -11.038 -0.273 390 H ALA 61 HN ALA 61 -7.294 -8.177 2.846 391 HA ALA 61 HA ALA 61 -5.641 -9.815 4.595 392 HB1 ALA 61 HB1 ALA 61 -3.532 -8.975 3.718 393 HB2 ALA 61 HB2 ALA 61 -4.395 -8.073 2.471 394 HB3 ALA 61 HB3 ALA 61 -4.430 -9.834 2.468 395 H THR 62 HN THR 62 -5.062 -6.520 3.381 396 HA THR 62 HA THR 62 -5.875 -5.439 5.978 397 HB THR 62 HB THR 62 -3.173 -4.853 4.749 398 HG1 THR 62 HG1 THR 62 -4.033 -6.747 6.616 399 HG21 THR 62 HG21 THR 62 -4.384 -4.062 7.400 400 HG22 THR 62 HG22 THR 62 -4.091 -2.988 6.035 401 HG23 THR 62 HG23 THR 62 -2.732 -3.722 6.888 402 H ALA 63 HN ALA 63 -7.011 -3.622 5.733 403 HA ALA 63 HA ALA 63 -7.167 -2.377 3.117 404 HB1 ALA 63 HB1 ALA 63 -9.036 -1.115 4.043 405 HB2 ALA 63 HB2 ALA 63 -8.691 -1.756 5.648 406 HB3 ALA 63 HB3 ALA 63 -9.231 -2.840 4.365 407 H VAL 64 HN VAL 64 -6.215 -0.525 2.569 408 HA VAL 64 HA VAL 64 -5.175 1.250 4.652 409 HB VAL 64 HB VAL 64 -3.024 1.422 3.294 410 HG11 VAL 64 HG11 VAL 64 -2.010 -0.542 4.402 411 HG12 VAL 64 HG12 VAL 64 -3.627 -1.120 4.803 412 HG13 VAL 64 HG13 VAL 64 -3.037 0.395 5.484 413 HG21 VAL 64 HG21 VAL 64 -2.428 -0.554 1.986 414 HG22 VAL 64 HG22 VAL 64 -3.841 0.268 1.318 415 HG23 VAL 64 HG23 VAL 64 -4.043 -1.215 2.257 416 H CYS 65 HN CYS 65 -4.311 3.273 3.693 417 HA CYS 65 HA CYS 65 -5.744 4.005 1.235 418 HB2 CYS 65 HB2 CYS 65 -6.979 4.861 3.157 419 HB3 CYS 65 HB1 CYS 65 -5.520 5.588 3.806 420 H CYS 66 HN CYS 66 -4.195 4.393 -0.237 421 HA CYS 66 HA CYS 66 -1.683 5.598 0.655 422 HB2 CYS 66 HB2 CYS 66 -2.477 3.901 -1.637 423 HB3 CYS 66 HB1 CYS 66 -1.206 5.084 -1.932 424 H SER 67 HN SER 67 -0.910 7.478 -0.038 425 HA SER 67 HA SER 67 -2.786 9.240 -1.413 426 HB2 SER 67 HB2 SER 67 -0.316 9.826 0.216 427 HB3 SER 67 HB1 SER 67 -1.354 11.056 -0.511 428 HG SER 67 HG SER 67 -1.719 9.550 1.757 429 H ASP 68 HN ASP 68 -0.004 7.450 -2.045 430 HA ASP 68 HA ASP 68 0.758 9.227 -4.265 431 HB2 ASP 68 HB2 ASP 68 2.529 8.729 -2.560 432 HB3 ASP 68 HB1 ASP 68 2.424 7.033 -3.018 433 H ASN 69 HN ASN 69 1.204 8.245 -6.336 434 HA ASN 69 HA ASN 69 -0.318 5.743 -6.678 435 HB2 ASN 69 HB2 ASN 69 -0.336 8.223 -8.390 436 HB3 ASN 69 HB1 ASN 69 -1.012 6.684 -8.912 437 HD21 ASN 69 HD21 ASN 69 -1.338 9.374 -6.749 438 HD22 ASN 69 HD22 ASN 69 -2.959 9.038 -6.254 439 H ASN 70 HN ASN 70 2.723 6.622 -6.694 440 HA ASN 70 HA ASN 70 3.511 5.658 -9.313 441 HB2 ASN 70 HB2 ASN 70 4.837 7.380 -8.077 442 HB3 ASN 70 HB1 ASN 70 5.234 6.158 -6.876 443 HD21 ASN 70 HD21 ASN 70 5.764 7.257 -10.132 444 HD22 ASN 70 HD22 ASN 70 7.143 6.264 -10.453 445 H VAL 71 HN VAL 71 2.246 3.679 -9.025 446 HA VAL 71 HA VAL 71 3.320 1.730 -7.154 447 HB VAL 71 HB VAL 71 1.382 0.374 -7.787 448 HG11 VAL 71 HG11 VAL 71 0.702 3.227 -7.102 449 HG12 VAL 71 HG12 VAL 71 1.137 1.952 -5.965 450 HG13 VAL 71 HG13 VAL 71 -0.370 1.846 -6.875 451 HG21 VAL 71 HG21 VAL 71 0.696 2.656 -9.631 452 HG22 VAL 71 HG22 VAL 71 -0.363 1.297 -9.252 453 HG23 VAL 71 HG23 VAL 71 1.151 1.020 -10.113 454 H SER 72 HN SER 72 4.001 -0.331 -7.797 455 HA SER 72 HA SER 72 5.339 -0.429 -10.361 456 HB2 SER 72 HB2 SER 72 6.362 -2.477 -9.464 457 HB3 SER 72 HB1 SER 72 6.469 -1.170 -8.285 458 HG SER 72 HG SER 72 5.385 -3.552 -7.959 459 H GLY 73 HN GLY 73 2.350 -1.220 -9.198 460 HA2 GLY 73 HA2 GLY 73 0.841 -2.193 -10.947 461 HA3 GLY 73 HA1 GLY 73 2.022 -3.484 -11.051 462 H VAL 74 HN VAL 74 2.501 -3.533 -8.168 463 HA VAL 74 HA VAL 74 -0.105 -4.522 -7.259 464 HB VAL 74 HB VAL 74 0.806 -6.523 -6.381 465 HG11 VAL 74 HG11 VAL 74 1.798 -7.585 -8.457 466 HG12 VAL 74 HG12 VAL 74 1.706 -5.981 -9.199 467 HG13 VAL 74 HG13 VAL 74 0.237 -6.791 -8.654 468 HG21 VAL 74 HG21 VAL 74 3.489 -5.415 -7.154 469 HG22 VAL 74 HG22 VAL 74 3.218 -7.098 -6.699 470 HG23 VAL 74 HG23 VAL 74 2.900 -5.811 -5.535 471 H ILE 75 HN ILE 75 2.402 -2.477 -6.609 472 HA ILE 75 HA ILE 75 2.179 -2.832 -3.711 473 HB ILE 75 HB ILE 75 4.020 -1.237 -3.484 474 HG12 ILE 75 HG12 ILE 75 4.346 -1.325 -6.468 475 HG13 ILE 75 HG11 ILE 75 3.396 -0.078 -5.686 476 HG21 ILE 75 HG21 ILE 75 5.776 -2.636 -4.414 477 HG22 ILE 75 HG22 ILE 75 4.587 -3.457 -5.422 478 HG23 ILE 75 HG23 ILE 75 4.505 -3.601 -3.666 479 HD11 ILE 75 HD11 ILE 75 5.647 0.690 -6.147 480 HD12 ILE 75 HD12 ILE 75 6.301 -0.643 -5.194 481 HD13 ILE 75 HD13 ILE 75 5.351 0.619 -4.409 482 H ALA 76 HN ALA 76 2.428 -0.657 -2.542 483 HA ALA 76 HA ALA 76 0.889 1.516 -3.720 484 HB1 ALA 76 HB1 ALA 76 -0.623 1.617 -1.777 485 HB2 ALA 76 HB2 ALA 76 0.090 0.120 -1.163 486 HB3 ALA 76 HB3 ALA 76 -0.810 0.113 -2.682 487 H ILE 77 HN ILE 77 1.499 3.519 -2.867 488 HA ILE 77 HA ILE 77 3.592 3.426 -0.793 489 HB ILE 77 HB ILE 77 3.494 5.255 -3.200 490 HG12 ILE 77 HG12 ILE 77 5.406 3.011 -2.508 491 HG13 ILE 77 HG11 ILE 77 4.140 2.927 -3.727 492 HG21 ILE 77 HG21 ILE 77 5.548 5.044 -0.998 493 HG22 ILE 77 HG22 ILE 77 4.428 6.382 -1.253 494 HG23 ILE 77 HG23 ILE 77 5.687 6.048 -2.442 495 HD11 ILE 77 HD11 ILE 77 6.504 4.785 -3.777 496 HD12 ILE 77 HD12 ILE 77 5.245 4.671 -5.007 497 HD13 ILE 77 HD13 ILE 77 6.325 3.306 -4.721 498 H GLY 78 HN GLY 78 3.300 4.701 0.929 499 HA2 GLY 78 HA2 GLY 78 2.645 6.562 2.165 500 HA3 GLY 78 HA1 GLY 78 1.847 7.204 0.733 501 H CYS 79 HN CYS 79 1.449 4.135 2.494 502 HA CYS 79 HA CYS 79 -1.432 4.575 2.384 503 HB2 CYS 79 HB2 CYS 79 0.335 2.221 2.364 504 HB3 CYS 79 HB1 CYS 79 -1.167 2.030 3.245 505 H LEU 80 HN LEU 80 -2.737 4.572 4.108 506 HA LEU 80 HA LEU 80 -1.538 4.144 6.764 507 HB2 LEU 80 HB2 LEU 80 -3.886 5.887 6.020 508 HB3 LEU 80 HB1 LEU 80 -3.277 5.620 7.647 509 HG LEU 80 HG LEU 80 -1.701 6.932 5.432 510 HD11 LEU 80 HD11 LEU 80 -2.092 9.011 6.623 511 HD12 LEU 80 HD12 LEU 80 -3.093 8.168 7.801 512 HD13 LEU 80 HD13 LEU 80 -3.620 8.289 6.123 513 HD21 LEU 80 HD21 LEU 80 -0.301 5.808 7.068 514 HD22 LEU 80 HD22 LEU 80 -1.160 6.610 8.382 515 HD23 LEU 80 HD23 LEU 80 -0.183 7.556 7.260 516 HA PRO 81 HA PRO 81 -4.245 0.642 6.999 517 HB2 PRO 81 HB2 PRO 81 -4.022 0.942 9.916 518 HB3 PRO 81 HB1 PRO 81 -3.522 -0.397 8.887 519 HG2 PRO 81 HG2 PRO 81 -1.736 1.229 10.044 520 HG3 PRO 81 HG1 PRO 81 -1.465 0.538 8.434 521 HD2 PRO 81 HD2 PRO 81 -2.353 3.299 9.183 522 HD3 PRO 81 HD1 PRO 81 -1.226 2.784 7.920 523 H VAL 82 HN VAL 82 -6.367 0.741 6.730 524 HA VAL 82 HA VAL 82 -7.957 2.380 8.566 525 HB VAL 82 HB VAL 82 -9.576 2.594 6.630 526 HG11 VAL 82 HG11 VAL 82 -8.385 4.504 5.649 527 HG12 VAL 82 HG12 VAL 82 -6.887 3.933 6.383 528 HG13 VAL 82 HG13 VAL 82 -8.223 4.466 7.404 529 HG21 VAL 82 HG21 VAL 82 -8.671 0.870 5.192 530 HG22 VAL 82 HG22 VAL 82 -7.161 1.769 5.043 531 HG23 VAL 82 HG23 VAL 82 -8.650 2.434 4.375 532 H THR 83 HN THR 83 -9.977 1.573 9.126 533 HA THR 83 HA THR 83 -10.964 -0.894 8.082 534 HB THR 83 HB THR 83 -9.143 -1.516 9.779 535 HG1 THR 83 HG1 THR 83 -10.672 -3.034 9.069 536 HG21 THR 83 HG21 THR 83 -11.336 -0.636 11.645 537 HG22 THR 83 HG22 THR 83 -9.738 0.093 11.492 538 HG23 THR 83 HG23 THR 83 -9.901 -1.547 12.118 539 H LEU 84 HN LEU 84 -13.058 -1.469 9.059 540 HA LEU 84 HA LEU 84 -15.189 -0.897 9.534 541 HB2 LEU 84 HB2 LEU 84 -13.592 0.363 11.706 542 HB3 LEU 84 HB1 LEU 84 -15.322 0.635 11.651 543 HG LEU 84 HG LEU 84 -15.675 -1.816 11.763 544 HD11 LEU 84 HD11 LEU 84 -13.529 -2.513 10.794 545 HD12 LEU 84 HD12 LEU 84 -13.863 -3.297 12.338 546 HD13 LEU 84 HD13 LEU 84 -12.712 -1.963 12.257 547 HD21 LEU 84 HD21 LEU 84 -15.082 -2.051 14.115 548 HD22 LEU 84 HD22 LEU 84 -15.720 -0.440 13.782 549 HD23 LEU 84 HD23 LEU 84 -13.982 -0.677 13.976 Start of MODEL 6 1 H1 GLY 1 HT1 GLY 1 -9.448 3.335 -9.739 2 H2 GLY 1 HT2 GLY 1 -8.592 2.966 -8.332 3 H3 GLY 1 HT3 GLY 1 -9.679 4.256 -8.342 4 HA2 GLY 1 HA1 GLY 1 -11.528 2.747 -8.673 5 HA3 GLY 1 HA2 GLY 1 -10.397 1.401 -8.678 6 H SER 2 HN SER 2 -11.916 3.870 -6.720 7 HA SER 2 HA SER 2 -11.284 2.275 -4.338 8 HB2 SER 2 HB2 SER 2 -9.768 4.236 -4.407 9 HB3 SER 2 HB1 SER 2 -11.168 5.301 -4.503 10 HG SER 2 HG SER 2 -11.807 4.489 -2.438 11 H TRP 3 HN TRP 3 -13.247 1.474 -3.834 12 HA TRP 3 HA TRP 3 -15.632 3.009 -4.327 13 HB2 TRP 3 HB2 TRP 3 -15.595 0.541 -4.613 14 HB3 TRP 3 HB1 TRP 3 -15.368 0.364 -2.878 15 HD1 TRP 3 HD1 TRP 3 -17.533 0.494 -1.376 16 HE1 TRP 3 HE1 TRP 3 -20.046 0.725 -1.904 17 HE3 TRP 3 HE3 TRP 3 -17.197 1.689 -6.320 18 HZ2 TRP 3 HZ2 TRP 3 -21.664 1.331 -4.143 19 HZ3 TRP 3 HZ3 TRP 3 -19.269 2.080 -7.592 20 HH2 TRP 3 HH2 TRP 3 -21.456 1.903 -6.522 21 H GLY 4 HN GLY 4 -15.243 4.810 -3.022 22 HA2 GLY 4 HA2 GLY 4 -16.302 5.516 -0.840 23 HA3 GLY 4 HA1 GLY 4 -15.218 4.334 -0.114 24 H GLN 5 HN GLN 5 -15.567 7.478 -0.336 25 HA GLN 5 HA GLN 5 -12.995 8.286 -1.328 26 HB2 GLN 5 HB2 GLN 5 -15.067 9.847 0.225 27 HB3 GLN 5 HB1 GLN 5 -13.670 10.528 -0.593 28 HG2 GLN 5 HG2 GLN 5 -14.589 9.623 -2.735 29 HG3 GLN 5 HG1 GLN 5 -16.050 9.193 -1.848 30 HE21 GLN 5 HE21 GLN 5 -14.138 11.760 -3.151 31 HE22 GLN 5 HE22 GLN 5 -15.306 13.017 -2.938 32 H CYS 6 HN CYS 6 -11.187 8.119 -0.238 33 HA CYS 6 HA CYS 6 -11.160 7.639 2.600 34 HB2 CYS 6 HB2 CYS 6 -9.549 6.471 1.237 35 HB3 CYS 6 HB1 CYS 6 -8.956 7.982 0.556 36 H SER 7 HN SER 7 -9.432 10.035 0.618 37 HA SER 7 HA SER 7 -10.317 12.305 1.981 38 HB2 SER 7 HB2 SER 7 -8.061 12.811 3.137 39 HB3 SER 7 HB1 SER 7 -9.157 11.685 3.936 40 HG SER 7 HG SER 7 -7.709 10.188 3.737 41 H THR 8 HN THR 8 -6.982 11.475 1.086 42 HA THR 8 HA THR 8 -7.230 13.363 -1.162 43 HB THR 8 HB THR 8 -4.672 12.735 0.313 44 HG1 THR 8 HG1 THR 8 -5.201 14.189 1.767 45 HG21 THR 8 HG21 THR 8 -3.905 14.833 -0.702 46 HG22 THR 8 HG22 THR 8 -5.464 15.013 -1.506 47 HG23 THR 8 HG23 THR 8 -4.403 13.672 -1.933 48 H GLY 9 HN GLY 9 -6.173 10.225 -0.108 49 HA2 GLY 9 HA2 GLY 9 -4.916 9.723 -2.716 50 HA3 GLY 9 HA1 GLY 9 -4.665 8.772 -1.262 51 H SER 10 HN SER 10 -5.139 6.836 -2.121 52 HA SER 10 HA SER 10 -7.922 6.370 -2.959 53 HB2 SER 10 HB2 SER 10 -6.321 6.302 -4.898 54 HB3 SER 10 HB1 SER 10 -5.471 4.991 -4.091 55 HG SER 10 HG SER 10 -6.853 3.746 -5.045 56 H ILE 11 HN ILE 11 -8.729 4.254 -2.377 57 HA ILE 11 HA ILE 11 -7.265 3.121 -0.111 58 HB ILE 11 HB ILE 11 -10.144 2.753 -0.926 59 HG12 ILE 11 HG12 ILE 11 -8.813 4.257 1.327 60 HG13 ILE 11 HG11 ILE 11 -9.657 4.954 -0.049 61 HG21 ILE 11 HG21 ILE 11 -8.681 1.714 1.501 62 HG22 ILE 11 HG22 ILE 11 -9.262 0.739 0.151 63 HG23 ILE 11 HG23 ILE 11 -10.413 1.569 1.197 64 HD11 ILE 11 HD11 ILE 11 -11.005 5.004 1.974 65 HD12 ILE 11 HD12 ILE 11 -10.891 3.247 2.083 66 HD13 ILE 11 HD13 ILE 11 -11.742 3.994 0.730 67 H GLN 12 HN GLN 12 -6.523 1.146 -0.061 68 HA GLN 12 HA GLN 12 -7.272 -0.771 -2.117 69 HB2 GLN 12 HB2 GLN 12 -4.665 -1.324 -2.190 70 HB3 GLN 12 HB1 GLN 12 -5.443 -0.256 -3.337 71 HG2 GLN 12 HG2 GLN 12 -4.281 0.911 -0.868 72 HG3 GLN 12 HG1 GLN 12 -3.191 0.361 -2.128 73 HE21 GLN 12 HE21 GLN 12 -4.951 1.054 -4.323 74 HE22 GLN 12 HE22 GLN 12 -4.939 2.767 -4.442 75 H CYS 13 HN CYS 13 -6.442 -2.937 -1.690 76 HA CYS 13 HA CYS 13 -6.261 -3.434 1.199 77 HB2 CYS 13 HB2 CYS 13 -8.208 -4.483 0.267 78 HB3 CYS 13 HB1 CYS 13 -7.289 -5.147 -1.083 79 H CYS 14 HN CYS 14 -4.173 -3.553 1.711 80 HA CYS 14 HA CYS 14 -2.253 -4.601 -0.191 81 HB2 CYS 14 HB2 CYS 14 -2.003 -3.252 2.484 82 HB3 CYS 14 HB1 CYS 14 -0.621 -3.994 1.688 83 H GLN 15 HN GLN 15 -1.320 -6.498 -0.118 84 HA GLN 15 HA GLN 15 -2.173 -8.443 1.794 85 HB2 GLN 15 HB2 GLN 15 -1.680 -9.856 0.135 86 HB3 GLN 15 HB1 GLN 15 -1.242 -8.465 -0.836 87 HG2 GLN 15 HG2 GLN 15 0.554 -9.911 -1.041 88 HG3 GLN 15 HG1 GLN 15 1.089 -8.718 0.141 89 HE21 GLN 15 HE21 GLN 15 -1.187 -11.266 0.890 90 HE22 GLN 15 HE22 GLN 15 -0.144 -12.164 1.927 91 H ASN 16 HN ASN 16 0.654 -6.451 1.253 92 HA ASN 16 HA ASN 16 1.620 -7.258 3.909 93 HB2 ASN 16 HB2 ASN 16 3.107 -7.201 1.345 94 HB3 ASN 16 HB1 ASN 16 3.928 -6.548 2.742 95 HD21 ASN 16 HD21 ASN 16 4.688 -8.836 1.275 96 HD22 ASN 16 HD22 ASN 16 4.609 -10.190 2.349 97 H VAL 17 HN VAL 17 1.023 -5.450 5.044 98 HA VAL 17 HA VAL 17 1.759 -2.836 3.968 99 HB VAL 17 HB VAL 17 0.359 -3.501 6.568 100 HG11 VAL 17 HG11 VAL 17 0.785 -0.855 5.179 101 HG12 VAL 17 HG12 VAL 17 1.573 -1.382 6.666 102 HG13 VAL 17 HG13 VAL 17 -0.171 -1.109 6.641 103 HG21 VAL 17 HG21 VAL 17 -0.992 -4.097 4.638 104 HG22 VAL 17 HG22 VAL 17 -0.727 -2.497 3.941 105 HG23 VAL 17 HG23 VAL 17 -1.654 -2.668 5.433 106 H VAL 18 HN VAL 18 3.857 -2.463 4.132 107 HA VAL 18 HA VAL 18 5.175 -2.926 6.721 108 HB VAL 18 HB VAL 18 7.234 -3.619 5.481 109 HG11 VAL 18 HG11 VAL 18 4.798 -5.355 5.090 110 HG12 VAL 18 HG12 VAL 18 5.844 -5.313 6.509 111 HG13 VAL 18 HG13 VAL 18 6.467 -5.910 4.969 112 HG21 VAL 18 HG21 VAL 18 6.697 -2.650 3.304 113 HG22 VAL 18 HG22 VAL 18 5.361 -3.786 3.118 114 HG23 VAL 18 HG23 VAL 18 7.021 -4.378 3.159 115 HA PRO 19 HA PRO 19 6.653 1.272 6.191 116 HB2 PRO 19 HB2 PRO 19 8.980 0.280 7.724 117 HB3 PRO 19 HB1 PRO 19 7.930 1.660 8.049 118 HG2 PRO 19 HG2 PRO 19 7.756 -0.578 9.499 119 HG3 PRO 19 HG1 PRO 19 6.315 0.364 9.077 120 HD2 PRO 19 HD2 PRO 19 7.313 -2.198 7.912 121 HD3 PRO 19 HD1 PRO 19 5.646 -1.665 8.212 122 H GLY 20 HN GLY 20 7.929 2.216 4.685 123 HA2 GLY 20 HA2 GLY 20 9.261 0.605 2.786 124 HA3 GLY 20 HA1 GLY 20 9.325 2.358 2.868 125 H ASP 21 HN ASP 21 10.359 2.109 5.698 126 HA ASP 21 HA ASP 21 13.157 1.556 4.995 127 HB2 ASP 21 HB2 ASP 21 13.788 2.962 6.803 128 HB3 ASP 21 HB1 ASP 21 12.447 3.790 6.022 129 H SER 22 HN SER 22 10.652 -0.104 6.125 130 HA SER 22 HA SER 22 11.711 -1.422 8.408 131 HB2 SER 22 HB2 SER 22 9.351 -1.589 8.049 132 HB3 SER 22 HB1 SER 22 9.571 -2.181 6.409 133 HG SER 22 HG SER 22 9.193 -3.644 8.482 134 H ASP 23 HN ASP 23 12.570 -3.559 8.493 135 HA ASP 23 HA ASP 23 14.610 -4.092 6.662 136 HB2 ASP 23 HB2 ASP 23 13.206 -5.844 8.679 137 HB3 ASP 23 HB1 ASP 23 14.547 -6.426 7.705 138 H LEU 24 HN LEU 24 11.325 -5.319 6.889 139 HA LEU 24 HA LEU 24 11.491 -7.002 4.603 140 HB2 LEU 24 HB2 LEU 24 9.399 -6.053 6.409 141 HB3 LEU 24 HB1 LEU 24 8.846 -6.259 4.759 142 HG LEU 24 HG LEU 24 10.163 -8.396 6.435 143 HD11 LEU 24 HD11 LEU 24 7.294 -8.027 5.587 144 HD12 LEU 24 HD12 LEU 24 7.927 -7.859 7.225 145 HD13 LEU 24 HD13 LEU 24 7.945 -9.432 6.429 146 HD21 LEU 24 HD21 LEU 24 8.994 -8.455 3.654 147 HD22 LEU 24 HD22 LEU 24 9.437 -9.885 4.585 148 HD23 LEU 24 HD23 LEU 24 10.677 -8.730 4.106 149 H GLY 25 HN GLY 25 9.852 -3.865 5.020 150 HA2 GLY 25 HA2 GLY 25 9.067 -3.494 2.396 151 HA3 GLY 25 HA1 GLY 25 9.360 -2.192 3.534 152 H THR 26 HN THR 26 12.138 -2.591 3.882 153 HA THR 26 HA THR 26 13.076 -1.097 1.660 154 HB THR 26 HB THR 26 14.620 -2.386 3.918 155 HG1 THR 26 HG1 THR 26 13.093 -0.106 3.695 156 HG21 THR 26 HG21 THR 26 16.045 -1.855 1.970 157 HG22 THR 26 HG22 THR 26 16.414 -0.855 3.375 158 HG23 THR 26 HG23 THR 26 15.476 -0.186 2.040 159 H LEU 27 HN LEU 27 13.597 -4.416 2.758 160 HA LEU 27 HA LEU 27 15.364 -5.208 0.716 161 HB2 LEU 27 HB2 LEU 27 14.874 -6.406 2.863 162 HB3 LEU 27 HB1 LEU 27 13.385 -6.961 2.125 163 HG LEU 27 HG LEU 27 15.711 -7.465 0.459 164 HD11 LEU 27 HD11 LEU 27 16.624 -9.242 1.845 165 HD12 LEU 27 HD12 LEU 27 15.548 -8.774 3.162 166 HD13 LEU 27 HD13 LEU 27 16.803 -7.663 2.608 167 HD21 LEU 27 HD21 LEU 27 14.685 -9.672 0.366 168 HD22 LEU 27 HD22 LEU 27 13.514 -8.387 0.068 169 HD23 LEU 27 HD23 LEU 27 13.556 -9.196 1.636 170 H LEU 28 HN LEU 28 11.862 -5.051 0.896 171 HA LEU 28 HA LEU 28 11.409 -6.605 -1.458 172 HB2 LEU 28 HB2 LEU 28 9.539 -4.601 -0.191 173 HB3 LEU 28 HB1 LEU 28 9.108 -5.899 -1.282 174 HG LEU 28 HG LEU 28 9.935 -6.089 1.601 175 HD11 LEU 28 HD11 LEU 28 7.540 -7.073 0.068 176 HD12 LEU 28 HD12 LEU 28 7.589 -5.685 1.156 177 HD13 LEU 28 HD13 LEU 28 7.829 -7.313 1.791 178 HD21 LEU 28 HD21 LEU 28 9.755 -8.344 -0.389 179 HD22 LEU 28 HD22 LEU 28 9.898 -8.527 1.359 180 HD23 LEU 28 HD23 LEU 28 11.208 -7.783 0.442 181 H LEU 29 HN LEU 29 11.454 -3.119 -0.753 182 HA LEU 29 HA LEU 29 10.836 -2.456 -3.470 183 HB2 LEU 29 HB2 LEU 29 11.095 -0.182 -2.823 184 HB3 LEU 29 HB1 LEU 29 10.192 -1.012 -1.591 185 HG LEU 29 HG LEU 29 12.475 -1.117 -0.347 186 HD11 LEU 29 HD11 LEU 29 13.893 0.848 -0.846 187 HD12 LEU 29 HD12 LEU 29 12.939 1.133 -2.305 188 HD13 LEU 29 HD13 LEU 29 13.894 -0.343 -2.148 189 HD21 LEU 29 HD21 LEU 29 12.014 1.132 0.589 190 HD22 LEU 29 HD22 LEU 29 10.574 0.123 0.446 191 HD23 LEU 29 HD23 LEU 29 10.874 1.404 -0.733 192 H ASP 30 HN ASP 30 13.717 -3.077 -1.700 193 HA ASP 30 HA ASP 30 15.603 -1.968 -3.489 194 HB2 ASP 30 HB2 ASP 30 16.131 -2.820 -1.208 195 HB3 ASP 30 HB1 ASP 30 15.875 -4.457 -1.786 196 H GLU 31 HN GLU 31 13.747 -4.891 -3.445 197 HA GLU 31 HA GLU 31 15.053 -6.155 -5.659 198 HB2 GLU 31 HB2 GLU 31 14.007 -7.608 -4.101 199 HB3 GLU 31 HB1 GLU 31 12.560 -6.623 -4.037 200 HG2 GLU 31 HG2 GLU 31 12.086 -8.656 -5.199 201 HG3 GLU 31 HG1 GLU 31 12.010 -7.291 -6.307 202 H LEU 32 HN LEU 32 12.073 -4.396 -5.057 203 HA LEU 32 HA LEU 32 11.126 -4.622 -7.747 204 HB2 LEU 32 HB2 LEU 32 10.194 -3.156 -5.306 205 HB3 LEU 32 HB1 LEU 32 9.346 -3.045 -6.834 206 HG LEU 32 HG LEU 32 9.805 -5.570 -5.239 207 HD11 LEU 32 HD11 LEU 32 7.379 -5.510 -4.900 208 HD12 LEU 32 HD12 LEU 32 7.309 -3.950 -5.719 209 HD13 LEU 32 HD13 LEU 32 8.180 -4.108 -4.194 210 HD21 LEU 32 HD21 LEU 32 8.331 -5.111 -7.829 211 HD22 LEU 32 HD22 LEU 32 8.253 -6.592 -6.873 212 HD23 LEU 32 HD23 LEU 32 9.783 -6.085 -7.591 213 H GLY 33 HN GLY 33 13.249 -2.479 -6.203 214 HA2 GLY 33 HA2 GLY 33 14.390 -0.647 -6.986 215 HA3 GLY 33 HA1 GLY 33 13.676 -0.958 -8.561 216 H ILE 34 HN ILE 34 12.025 -0.244 -5.518 217 HA ILE 34 HA ILE 34 10.258 1.544 -6.900 218 HB ILE 34 HB ILE 34 10.431 1.015 -3.930 219 HG12 ILE 34 HG12 ILE 34 8.701 -0.293 -6.051 220 HG13 ILE 34 HG11 ILE 34 10.078 -1.048 -5.254 221 HG21 ILE 34 HG21 ILE 34 8.211 2.152 -5.626 222 HG22 ILE 34 HG22 ILE 34 9.204 3.041 -4.471 223 HG23 ILE 34 HG23 ILE 34 8.104 1.784 -3.904 224 HD11 ILE 34 HD11 ILE 34 7.883 -1.757 -4.369 225 HD12 ILE 34 HD12 ILE 34 7.607 -0.100 -3.829 226 HD13 ILE 34 HD13 ILE 34 8.936 -1.038 -3.152 227 H VAL 35 HN VAL 35 10.194 3.699 -6.906 228 HA VAL 35 HA VAL 35 12.379 5.165 -5.694 229 HB VAL 35 HB VAL 35 11.882 5.787 -7.948 230 HG11 VAL 35 HG11 VAL 35 9.711 6.685 -8.649 231 HG12 VAL 35 HG12 VAL 35 9.055 6.334 -7.050 232 HG13 VAL 35 HG13 VAL 35 9.580 5.014 -8.096 233 HG21 VAL 35 HG21 VAL 35 10.888 7.882 -6.025 234 HG22 VAL 35 HG22 VAL 35 11.356 8.188 -7.696 235 HG23 VAL 35 HG23 VAL 35 12.555 7.615 -6.537 236 H LEU 36 HN LEU 36 12.203 5.783 -3.657 237 HA LEU 36 HA LEU 36 9.565 6.512 -2.604 238 HB2 LEU 36 HB2 LEU 36 10.839 6.463 -0.378 239 HB3 LEU 36 HB1 LEU 36 10.493 4.936 -1.152 240 HG LEU 36 HG LEU 36 12.940 5.395 -2.167 241 HD11 LEU 36 HD11 LEU 36 13.255 7.486 -0.996 242 HD12 LEU 36 HD12 LEU 36 14.389 6.270 -0.406 243 HD13 LEU 36 HD13 LEU 36 12.966 6.686 0.547 244 HD21 LEU 36 HD21 LEU 36 12.289 3.362 -1.094 245 HD22 LEU 36 HD22 LEU 36 12.270 4.147 0.484 246 HD23 LEU 36 HD23 LEU 36 13.796 3.928 -0.373 247 H GLU 37 HN GLU 37 9.081 8.535 -2.094 248 HA GLU 37 HA GLU 37 11.120 10.608 -2.259 249 HB2 GLU 37 HB2 GLU 37 8.885 10.979 -3.283 250 HB3 GLU 37 HB1 GLU 37 8.148 10.813 -1.695 251 HG2 GLU 37 HG2 GLU 37 9.348 12.785 -0.923 252 HG3 GLU 37 HG1 GLU 37 10.108 12.947 -2.505 253 H ASP 38 HN ASP 38 9.110 8.892 -0.017 254 HA ASP 38 HA ASP 38 10.802 9.780 2.181 255 HB2 ASP 38 HB2 ASP 38 7.806 9.970 2.058 256 HB3 ASP 38 HB1 ASP 38 8.589 9.622 3.594 257 HA PRO 39 HA PRO 39 10.641 5.278 2.100 258 HB2 PRO 39 HB2 PRO 39 12.777 4.879 3.729 259 HB3 PRO 39 HB1 PRO 39 12.947 5.300 2.021 260 HG2 PRO 39 HG2 PRO 39 13.164 7.049 4.437 261 HG3 PRO 39 HG1 PRO 39 14.165 7.029 2.974 262 HD2 PRO 39 HD2 PRO 39 12.184 8.848 3.398 263 HD3 PRO 39 HD1 PRO 39 12.666 8.300 1.780 264 H THR 40 HN THR 40 9.915 7.475 4.444 265 HA THR 40 HA THR 40 9.717 5.576 6.658 266 HB THR 40 HB THR 40 8.972 7.689 7.910 267 HG1 THR 40 HG1 THR 40 10.291 9.372 6.284 268 HG21 THR 40 HG21 THR 40 11.287 8.463 8.172 269 HG22 THR 40 HG22 THR 40 11.747 7.563 6.726 270 HG23 THR 40 HG23 THR 40 11.192 6.701 8.161 271 H VAL 41 HN VAL 41 7.952 5.734 4.185 272 HA VAL 41 HA VAL 41 5.365 6.091 5.527 273 HB VAL 41 HB VAL 41 4.344 6.175 3.330 274 HG11 VAL 41 HG11 VAL 41 5.317 8.254 2.504 275 HG12 VAL 41 HG12 VAL 41 6.757 7.971 3.481 276 HG13 VAL 41 HG13 VAL 41 5.202 8.253 4.263 277 HG21 VAL 41 HG21 VAL 41 5.782 4.615 2.144 278 HG22 VAL 41 HG22 VAL 41 7.125 5.754 2.237 279 HG23 VAL 41 HG23 VAL 41 5.698 6.149 1.278 280 H LEU 42 HN LEU 42 3.702 4.497 5.071 281 HA LEU 42 HA LEU 42 4.732 1.805 5.129 282 HB2 LEU 42 HB2 LEU 42 1.923 2.901 5.208 283 HB3 LEU 42 HB1 LEU 42 2.300 1.192 5.290 284 HG LEU 42 HG LEU 42 3.221 3.244 7.301 285 HD11 LEU 42 HD11 LEU 42 1.562 2.244 8.788 286 HD12 LEU 42 HD12 LEU 42 1.002 1.210 7.474 287 HD13 LEU 42 HD13 LEU 42 0.797 2.959 7.370 288 HD21 LEU 42 HD21 LEU 42 3.349 0.233 7.294 289 HD22 LEU 42 HD22 LEU 42 3.819 1.279 8.635 290 HD23 LEU 42 HD23 LEU 42 4.714 1.333 7.117 291 H ILE 43 HN ILE 43 5.158 0.675 3.392 292 HA ILE 43 HA ILE 43 3.662 1.264 0.942 293 HB ILE 43 HB ILE 43 5.412 -0.146 -0.212 294 HG12 ILE 43 HG12 ILE 43 6.970 0.301 2.341 295 HG13 ILE 43 HG11 ILE 43 6.266 -1.241 1.868 296 HG21 ILE 43 HG21 ILE 43 5.373 2.277 -0.345 297 HG22 ILE 43 HG22 ILE 43 7.031 1.682 -0.308 298 HG23 ILE 43 HG23 ILE 43 6.315 2.391 1.140 299 HD11 ILE 43 HD11 ILE 43 7.671 -1.282 -0.118 300 HD12 ILE 43 HD12 ILE 43 8.639 -1.146 1.349 301 HD13 ILE 43 HD13 ILE 43 8.368 0.272 0.336 302 H GLY 44 HN GLY 44 2.485 -0.273 -0.055 303 HA2 GLY 44 HA2 GLY 44 2.026 -2.685 1.580 304 HA3 GLY 44 HA1 GLY 44 0.769 -1.830 0.713 305 H ASP 45 HN ASP 45 3.046 -4.320 0.597 306 HA ASP 45 HA ASP 45 3.038 -4.627 -2.270 307 HB2 ASP 45 HB2 ASP 45 4.820 -5.575 -0.687 308 HB3 ASP 45 HB1 ASP 45 3.641 -6.787 -0.259 309 H GLY 46 HN GLY 46 1.766 -6.046 -3.457 310 HA2 GLY 46 HA2 GLY 46 0.001 -7.493 -3.890 311 HA3 GLY 46 HA1 GLY 46 0.031 -7.918 -2.205 312 H CYS 47 HN CYS 47 -0.474 -4.712 -3.587 313 HA CYS 47 HA CYS 47 -2.890 -4.562 -1.933 314 HB2 CYS 47 HB2 CYS 47 -0.737 -2.911 -1.991 315 HB3 CYS 47 HB1 CYS 47 -1.819 -2.094 -3.120 316 H ASP 48 HN ASP 48 -4.705 -4.845 -2.936 317 HA ASP 48 HA ASP 48 -4.954 -3.990 -5.730 318 HB2 ASP 48 HB2 ASP 48 -6.629 -5.564 -6.033 319 HB3 ASP 48 HB1 ASP 48 -5.582 -6.367 -4.881 320 HA PRO 49 HA PRO 49 -7.189 -0.380 -4.427 321 HB2 PRO 49 HB2 PRO 49 -8.511 -0.615 -7.053 322 HB3 PRO 49 HB1 PRO 49 -7.561 0.709 -6.390 323 HG2 PRO 49 HG2 PRO 49 -6.642 -0.921 -8.340 324 HG3 PRO 49 HG1 PRO 49 -5.588 -0.135 -7.154 325 HD2 PRO 49 HD2 PRO 49 -6.450 -2.967 -7.333 326 HD3 PRO 49 HD1 PRO 49 -4.965 -2.268 -6.665 327 H ILE 50 HN ILE 50 -8.914 -0.481 -3.100 328 HA ILE 50 HA ILE 50 -10.737 -2.704 -3.355 329 HB ILE 50 HB ILE 50 -10.825 -0.477 -1.314 330 HG12 ILE 50 HG12 ILE 50 -9.555 -3.218 -1.157 331 HG13 ILE 50 HG11 ILE 50 -8.692 -1.687 -1.212 332 HG21 ILE 50 HG21 ILE 50 -12.213 -1.966 -0.042 333 HG22 ILE 50 HG22 ILE 50 -11.989 -3.252 -1.228 334 HG23 ILE 50 HG23 ILE 50 -12.908 -1.804 -1.657 335 HD11 ILE 50 HD11 ILE 50 -9.708 -1.063 0.938 336 HD12 ILE 50 HD12 ILE 50 -8.752 -2.540 1.044 337 HD13 ILE 50 HD13 ILE 50 -10.511 -2.631 0.990 338 H THR 51 HN THR 51 -12.122 -2.466 -4.981 339 HA THR 51 HA THR 51 -14.051 -0.300 -4.710 340 HB THR 51 HB THR 51 -12.646 0.526 -6.437 341 HG1 THR 51 HG1 THR 51 -14.712 0.929 -7.041 342 HG21 THR 51 HG21 THR 51 -12.942 -2.170 -7.764 343 HG22 THR 51 HG22 THR 51 -11.475 -1.506 -7.044 344 HG23 THR 51 HG23 THR 51 -12.160 -0.766 -8.492 345 H VAL 52 HN VAL 52 -13.734 -3.281 -4.265 346 HA VAL 52 HA VAL 52 -15.927 -4.321 -5.859 347 HB VAL 52 HB VAL 52 -13.969 -5.761 -5.431 348 HG11 VAL 52 HG11 VAL 52 -13.330 -4.942 -3.242 349 HG12 VAL 52 HG12 VAL 52 -13.590 -6.687 -3.189 350 HG13 VAL 52 HG13 VAL 52 -14.812 -5.593 -2.543 351 HG21 VAL 52 HG21 VAL 52 -16.506 -6.733 -4.130 352 HG22 VAL 52 HG22 VAL 52 -15.187 -7.758 -4.695 353 HG23 VAL 52 HG23 VAL 52 -16.119 -6.803 -5.848 354 H ALA 53 HN ALA 53 -17.928 -4.855 -5.009 355 HA ALA 53 HA ALA 53 -18.498 -3.703 -2.366 356 HB1 ALA 53 HB1 ALA 53 -20.799 -3.452 -3.116 357 HB2 ALA 53 HB2 ALA 53 -20.394 -4.215 -4.654 358 HB3 ALA 53 HB3 ALA 53 -19.687 -2.656 -4.229 359 H GLY 54 HN GLY 54 -18.833 -5.083 -0.777 360 HA2 GLY 54 HA2 GLY 54 -20.506 -7.398 -1.110 361 HA3 GLY 54 HA1 GLY 54 -18.816 -7.802 -0.844 362 H SER 55 HN SER 55 -19.378 -8.806 1.146 363 HA SER 55 HA SER 55 -20.360 -7.026 3.250 364 HB2 SER 55 HB2 SER 55 -21.320 -9.322 3.031 365 HB3 SER 55 HB1 SER 55 -19.732 -9.986 3.408 366 HG SER 55 HG SER 55 -20.546 -9.893 5.371 367 H SER 56 HN SER 56 -17.720 -9.403 2.897 368 HA SER 56 HA SER 56 -15.926 -7.440 4.146 369 HB2 SER 56 HB2 SER 56 -16.552 -9.318 5.725 370 HB3 SER 56 HB1 SER 56 -15.762 -10.426 4.606 371 HG SER 56 HG SER 56 -13.839 -9.638 5.138 372 H ASP 57 HN ASP 57 -16.653 -8.249 1.397 373 HA ASP 57 HA ASP 57 -14.543 -9.795 0.269 374 HB2 ASP 57 HB2 ASP 57 -16.558 -7.937 -1.020 375 HB3 ASP 57 HB1 ASP 57 -15.520 -9.060 -1.882 376 H ALA 58 HN ALA 58 -14.802 -6.592 1.300 377 HA ALA 58 HA ALA 58 -13.457 -5.186 -0.696 378 HB1 ALA 58 HB1 ALA 58 -14.784 -4.094 1.021 379 HB2 ALA 58 HB2 ALA 58 -13.151 -3.435 0.976 380 HB3 ALA 58 HB3 ALA 58 -13.608 -4.572 2.242 381 H CYS 59 HN CYS 59 -12.227 -7.100 1.912 382 HA CYS 59 HA CYS 59 -9.597 -7.070 0.810 383 HB2 CYS 59 HB2 CYS 59 -9.649 -4.873 1.983 384 HB3 CYS 59 HB1 CYS 59 -9.950 -5.726 3.492 385 H SER 60 HN SER 60 -8.276 -8.661 1.651 386 HA SER 60 HA SER 60 -9.514 -10.376 3.693 387 HB2 SER 60 HB2 SER 60 -9.462 -11.286 1.333 388 HB3 SER 60 HB1 SER 60 -7.709 -11.315 1.475 389 HG SER 60 HG SER 60 -8.309 -12.562 3.550 390 H ALA 61 HN ALA 61 -6.834 -8.464 2.895 391 HA ALA 61 HA ALA 61 -5.172 -9.855 4.883 392 HB1 ALA 61 HB1 ALA 61 -4.133 -9.772 2.672 393 HB2 ALA 61 HB2 ALA 61 -3.217 -8.823 3.841 394 HB3 ALA 61 HB3 ALA 61 -4.260 -8.013 2.672 395 H THR 62 HN THR 62 -4.851 -6.532 3.689 396 HA THR 62 HA THR 62 -5.847 -5.450 6.195 397 HB THR 62 HB THR 62 -3.001 -4.922 5.301 398 HG1 THR 62 HG1 THR 62 -4.155 -6.686 7.136 399 HG21 THR 62 HG21 THR 62 -4.078 -2.978 6.360 400 HG22 THR 62 HG22 THR 62 -2.801 -3.649 7.374 401 HG23 THR 62 HG23 THR 62 -4.493 -3.977 7.755 402 H ALA 63 HN ALA 63 -6.911 -3.595 5.814 403 HA ALA 63 HA ALA 63 -6.853 -2.518 3.123 404 HB1 ALA 63 HB1 ALA 63 -8.594 -1.767 5.469 405 HB2 ALA 63 HB2 ALA 63 -9.008 -2.936 4.214 406 HB3 ALA 63 HB3 ALA 63 -8.804 -1.232 3.802 407 H VAL 64 HN VAL 64 -6.227 -0.474 2.564 408 HA VAL 64 HA VAL 64 -5.163 1.307 4.617 409 HB VAL 64 HB VAL 64 -3.050 1.547 3.166 410 HG11 VAL 64 HG11 VAL 64 -1.917 -0.302 4.362 411 HG12 VAL 64 HG12 VAL 64 -3.496 -0.919 4.850 412 HG13 VAL 64 HG13 VAL 64 -2.953 0.661 5.417 413 HG21 VAL 64 HG21 VAL 64 -2.400 -0.482 1.962 414 HG22 VAL 64 HG22 VAL 64 -3.866 0.234 1.286 415 HG23 VAL 64 HG23 VAL 64 -3.975 -1.193 2.320 416 H CYS 65 HN CYS 65 -4.295 3.321 3.590 417 HA CYS 65 HA CYS 65 -5.733 4.007 1.119 418 HB2 CYS 65 HB2 CYS 65 -6.941 4.924 3.051 419 HB3 CYS 65 HB1 CYS 65 -5.469 5.683 3.629 420 H CYS 66 HN CYS 66 -4.137 4.319 -0.350 421 HA CYS 66 HA CYS 66 -1.611 5.505 0.554 422 HB2 CYS 66 HB2 CYS 66 -2.369 3.677 -1.643 423 HB3 CYS 66 HB1 CYS 66 -1.078 4.823 -1.987 424 H SER 67 HN SER 67 -0.798 7.351 -0.211 425 HA SER 67 HA SER 67 -2.610 9.022 -1.779 426 HB2 SER 67 HB2 SER 67 -0.206 9.735 -0.109 427 HB3 SER 67 HB1 SER 67 -1.270 10.897 -0.910 428 HG SER 67 HG SER 67 -2.481 9.015 0.740 429 H ASP 68 HN ASP 68 0.320 7.324 -2.064 430 HA ASP 68 HA ASP 68 1.230 8.997 -4.299 431 HB2 ASP 68 HB2 ASP 68 2.832 8.457 -2.447 432 HB3 ASP 68 HB1 ASP 68 2.705 6.761 -2.892 433 H ASN 69 HN ASN 69 1.769 8.004 -6.343 434 HA ASN 69 HA ASN 69 0.242 5.516 -6.758 435 HB2 ASN 69 HB2 ASN 69 -0.563 6.346 -8.874 436 HB3 ASN 69 HB1 ASN 69 -0.937 7.521 -7.621 437 HD21 ASN 69 HD21 ASN 69 0.139 9.493 -7.605 438 HD22 ASN 69 HD22 ASN 69 1.019 10.071 -8.975 439 H ASN 70 HN ASN 70 3.263 6.179 -6.506 440 HA ASN 70 HA ASN 70 4.279 5.319 -9.074 441 HB2 ASN 70 HB2 ASN 70 5.614 5.661 -6.382 442 HB3 ASN 70 HB1 ASN 70 6.467 5.101 -7.815 443 HD21 ASN 70 HD21 ASN 70 4.933 7.781 -6.246 444 HD22 ASN 70 HD22 ASN 70 5.539 9.009 -7.313 445 H VAL 71 HN VAL 71 2.678 3.488 -8.955 446 HA VAL 71 HA VAL 71 3.406 1.310 -7.173 447 HB VAL 71 HB VAL 71 1.110 1.651 -9.091 448 HG11 VAL 71 HG11 VAL 71 1.308 -0.648 -9.027 449 HG12 VAL 71 HG12 VAL 71 0.162 -0.314 -7.732 450 HG13 VAL 71 HG13 VAL 71 1.850 -0.654 -7.352 451 HG21 VAL 71 HG21 VAL 71 1.229 1.735 -6.091 452 HG22 VAL 71 HG22 VAL 71 -0.238 1.863 -7.061 453 HG23 VAL 71 HG23 VAL 71 1.000 3.114 -7.166 454 H SER 72 HN SER 72 4.305 -0.546 -7.765 455 HA SER 72 HA SER 72 5.679 -0.716 -10.276 456 HB2 SER 72 HB2 SER 72 6.647 -2.769 -9.307 457 HB3 SER 72 HB1 SER 72 6.722 -1.433 -8.158 458 HG SER 72 HG SER 72 5.670 -3.780 -7.739 459 H GLY 73 HN GLY 73 2.621 -1.400 -9.414 460 HA2 GLY 73 HA2 GLY 73 1.283 -2.421 -11.275 461 HA3 GLY 73 HA1 GLY 73 2.394 -3.772 -11.140 462 H VAL 74 HN VAL 74 2.501 -3.634 -8.204 463 HA VAL 74 HA VAL 74 -0.271 -4.280 -7.530 464 HB VAL 74 HB VAL 74 0.315 -6.339 -6.436 465 HG11 VAL 74 HG11 VAL 74 1.308 -6.125 -9.269 466 HG12 VAL 74 HG12 VAL 74 -0.297 -6.606 -8.715 467 HG13 VAL 74 HG13 VAL 74 1.086 -7.663 -8.430 468 HG21 VAL 74 HG21 VAL 74 2.534 -5.799 -5.677 469 HG22 VAL 74 HG22 VAL 74 3.126 -5.767 -7.336 470 HG23 VAL 74 HG23 VAL 74 2.579 -7.284 -6.624 471 H ILE 75 HN ILE 75 2.548 -2.692 -6.647 472 HA ILE 75 HA ILE 75 2.179 -2.993 -3.792 473 HB ILE 75 HB ILE 75 3.979 -1.323 -3.558 474 HG12 ILE 75 HG12 ILE 75 4.484 -1.471 -6.486 475 HG13 ILE 75 HG11 ILE 75 3.274 -0.333 -5.915 476 HG21 ILE 75 HG21 ILE 75 5.759 -2.716 -4.455 477 HG22 ILE 75 HG22 ILE 75 4.589 -3.561 -5.466 478 HG23 ILE 75 HG23 ILE 75 4.495 -3.695 -3.710 479 HD11 ILE 75 HD11 ILE 75 6.176 -0.438 -5.149 480 HD12 ILE 75 HD12 ILE 75 4.991 0.645 -4.420 481 HD13 ILE 75 HD13 ILE 75 5.379 0.787 -6.136 482 H ALA 76 HN ALA 76 2.428 -0.819 -2.572 483 HA ALA 76 HA ALA 76 0.861 1.368 -3.686 484 HB1 ALA 76 HB1 ALA 76 0.113 -0.068 -1.136 485 HB2 ALA 76 HB2 ALA 76 -0.814 -0.060 -2.639 486 HB3 ALA 76 HB3 ALA 76 -0.617 1.430 -1.716 487 H ILE 77 HN ILE 77 1.508 3.360 -2.828 488 HA ILE 77 HA ILE 77 3.553 3.244 -0.708 489 HB ILE 77 HB ILE 77 3.590 5.069 -3.116 490 HG12 ILE 77 HG12 ILE 77 5.400 2.752 -2.411 491 HG13 ILE 77 HG11 ILE 77 4.149 2.720 -3.649 492 HG21 ILE 77 HG21 ILE 77 4.529 6.140 -1.145 493 HG22 ILE 77 HG22 ILE 77 5.807 5.742 -2.293 494 HG23 ILE 77 HG23 ILE 77 5.567 4.743 -0.860 495 HD11 ILE 77 HD11 ILE 77 5.322 4.452 -4.883 496 HD12 ILE 77 HD12 ILE 77 6.345 3.042 -4.616 497 HD13 ILE 77 HD13 ILE 77 6.574 4.496 -3.643 498 H GLY 78 HN GLY 78 3.361 4.664 0.928 499 HA2 GLY 78 HA2 GLY 78 2.678 6.537 2.114 500 HA3 GLY 78 HA1 GLY 78 1.894 7.138 0.655 501 H CYS 79 HN CYS 79 1.476 4.155 2.558 502 HA CYS 79 HA CYS 79 -1.406 4.597 2.391 503 HB2 CYS 79 HB2 CYS 79 0.355 2.237 2.497 504 HB3 CYS 79 HB1 CYS 79 -1.157 2.097 3.375 505 H LEU 80 HN LEU 80 -2.641 4.971 4.094 506 HA LEU 80 HA LEU 80 -1.535 4.481 6.773 507 HB2 LEU 80 HB2 LEU 80 -3.879 6.172 5.900 508 HB3 LEU 80 HB1 LEU 80 -3.436 5.861 7.573 509 HG LEU 80 HG LEU 80 -1.698 7.296 5.563 510 HD11 LEU 80 HD11 LEU 80 -2.181 9.292 6.884 511 HD12 LEU 80 HD12 LEU 80 -3.293 8.361 7.888 512 HD13 LEU 80 HD13 LEU 80 -3.649 8.614 6.181 513 HD21 LEU 80 HD21 LEU 80 -1.344 6.793 8.516 514 HD22 LEU 80 HD22 LEU 80 -0.329 7.849 7.535 515 HD23 LEU 80 HD23 LEU 80 -0.370 6.117 7.209 516 HA PRO 81 HA PRO 81 -4.053 0.863 6.981 517 HB2 PRO 81 HB2 PRO 81 -3.979 1.208 9.895 518 HB3 PRO 81 HB1 PRO 81 -3.346 -0.107 8.911 519 HG2 PRO 81 HG2 PRO 81 -1.732 1.655 10.131 520 HG3 PRO 81 HG1 PRO 81 -1.331 0.945 8.558 521 HD2 PRO 81 HD2 PRO 81 -2.406 3.663 9.186 522 HD3 PRO 81 HD1 PRO 81 -1.206 3.180 7.982 523 H VAL 82 HN VAL 82 -6.167 0.687 6.740 524 HA VAL 82 HA VAL 82 -7.944 2.110 8.567 525 HB VAL 82 HB VAL 82 -9.529 2.350 6.618 526 HG11 VAL 82 HG11 VAL 82 -6.961 3.920 6.590 527 HG12 VAL 82 HG12 VAL 82 -8.404 4.275 7.540 528 HG13 VAL 82 HG13 VAL 82 -8.447 4.412 5.782 529 HG21 VAL 82 HG21 VAL 82 -8.589 2.431 4.373 530 HG22 VAL 82 HG22 VAL 82 -8.434 0.819 5.071 531 HG23 VAL 82 HG23 VAL 82 -7.035 1.889 5.005 532 H THR 83 HN THR 83 -10.091 1.095 8.665 533 HA THR 83 HA THR 83 -10.199 -1.662 7.728 534 HB THR 83 HB THR 83 -10.539 -0.942 10.649 535 HG1 THR 83 HG1 THR 83 -8.388 -1.826 9.129 536 HG21 THR 83 HG21 THR 83 -11.997 -2.781 9.970 537 HG22 THR 83 HG22 THR 83 -10.691 -3.370 10.997 538 HG23 THR 83 HG23 THR 83 -10.624 -3.619 9.253 539 H LEU 84 HN LEU 84 -12.294 -2.509 7.625 540 HA LEU 84 HA LEU 84 -14.505 -2.477 7.208 541 HB2 LEU 84 HB2 LEU 84 -14.404 -0.518 9.478 542 HB3 LEU 84 HB1 LEU 84 -15.913 -1.038 8.749 543 HG LEU 84 HG LEU 84 -13.913 -2.904 10.016 544 HD11 LEU 84 HD11 LEU 84 -15.483 -3.037 11.887 545 HD12 LEU 84 HD12 LEU 84 -16.473 -1.783 11.141 546 HD13 LEU 84 HD13 LEU 84 -14.841 -1.407 11.693 547 HD21 LEU 84 HD21 LEU 84 -16.742 -3.313 9.070 548 HD22 LEU 84 HD22 LEU 84 -15.788 -4.496 9.962 549 HD23 LEU 84 HD23 LEU 84 -15.281 -3.990 8.352 Start of MODEL 7 1 H1 GLY 1 HT1 GLY 1 -13.830 0.461 -9.895 2 H2 GLY 1 HT2 GLY 1 -14.086 0.537 -11.565 3 H3 GLY 1 HT3 GLY 1 -15.147 -0.346 -10.585 4 HA2 GLY 1 HA1 GLY 1 -14.773 2.598 -10.559 5 HA3 GLY 1 HA2 GLY 1 -16.160 1.740 -11.217 6 H SER 2 HN SER 2 -15.992 3.745 -9.059 7 HA SER 2 HA SER 2 -16.788 4.176 -6.982 8 HB2 SER 2 HB2 SER 2 -18.238 1.536 -7.333 9 HB3 SER 2 HB1 SER 2 -18.635 2.786 -6.153 10 HG SER 2 HG SER 2 -18.526 3.416 -8.894 11 H TRP 3 HN TRP 3 -14.665 3.973 -6.162 12 HA TRP 3 HA TRP 3 -14.102 1.459 -4.754 13 HB2 TRP 3 HB2 TRP 3 -11.699 2.216 -4.833 14 HB3 TRP 3 HB1 TRP 3 -12.412 1.831 -6.395 15 HD1 TRP 3 HD1 TRP 3 -11.248 4.843 -4.311 16 HE1 TRP 3 HE1 TRP 3 -10.866 6.828 -5.909 17 HE3 TRP 3 HE3 TRP 3 -13.060 2.770 -8.610 18 HZ2 TRP 3 HZ2 TRP 3 -11.278 7.426 -8.638 19 HZ3 TRP 3 HZ3 TRP 3 -13.028 4.111 -10.675 20 HH2 TRP 3 HH2 TRP 3 -12.155 6.392 -10.686 21 H GLY 4 HN GLY 4 -12.380 1.990 -2.914 22 HA2 GLY 4 HA2 GLY 4 -13.784 3.369 -0.905 23 HA3 GLY 4 HA1 GLY 4 -12.120 2.818 -0.796 24 H GLN 5 HN GLN 5 -14.174 5.473 -1.080 25 HA GLN 5 HA GLN 5 -12.189 7.326 -2.057 26 HB2 GLN 5 HB2 GLN 5 -14.918 7.798 -0.840 27 HB3 GLN 5 HB1 GLN 5 -13.910 9.041 -1.569 28 HG2 GLN 5 HG2 GLN 5 -14.049 7.914 -3.719 29 HG3 GLN 5 HG1 GLN 5 -15.025 6.635 -2.996 30 HE21 GLN 5 HE21 GLN 5 -16.752 7.026 -4.361 31 HE22 GLN 5 HE22 GLN 5 -17.759 8.424 -4.204 32 H CYS 6 HN CYS 6 -10.562 7.892 -0.808 33 HA CYS 6 HA CYS 6 -10.860 7.825 2.097 34 HB2 CYS 6 HB2 CYS 6 -8.971 6.618 1.129 35 HB3 CYS 6 HB1 CYS 6 -8.407 8.089 0.348 36 H SER 7 HN SER 7 -9.193 9.972 -0.223 37 HA SER 7 HA SER 7 -10.501 12.310 0.638 38 HB2 SER 7 HB2 SER 7 -9.026 11.759 2.660 39 HB3 SER 7 HB1 SER 7 -7.650 12.154 1.632 40 HG SER 7 HG SER 7 -9.485 13.798 2.843 41 H THR 8 HN THR 8 -7.076 11.658 -0.187 42 HA THR 8 HA THR 8 -7.539 13.098 -2.717 43 HB THR 8 HB THR 8 -4.924 13.052 -1.208 44 HG1 THR 8 HG1 THR 8 -5.639 14.671 -0.053 45 HG21 THR 8 HG21 THR 8 -4.349 14.928 -2.660 46 HG22 THR 8 HG22 THR 8 -5.931 14.834 -3.432 47 HG23 THR 8 HG23 THR 8 -4.779 13.514 -3.623 48 H GLY 9 HN GLY 9 -6.032 10.413 -1.097 49 HA2 GLY 9 HA2 GLY 9 -4.712 9.505 -3.529 50 HA3 GLY 9 HA1 GLY 9 -4.592 8.767 -1.939 51 H SER 10 HN SER 10 -5.158 6.710 -2.312 52 HA SER 10 HA SER 10 -7.913 6.226 -3.142 53 HB2 SER 10 HB2 SER 10 -6.526 6.059 -5.205 54 HB3 SER 10 HB1 SER 10 -5.558 4.811 -4.424 55 HG SER 10 HG SER 10 -7.971 4.617 -5.649 56 H ILE 11 HN ILE 11 -8.796 4.373 -2.205 57 HA ILE 11 HA ILE 11 -7.161 3.191 -0.099 58 HB ILE 11 HB ILE 11 -10.116 2.912 -0.651 59 HG12 ILE 11 HG12 ILE 11 -8.534 4.423 1.426 60 HG13 ILE 11 HG11 ILE 11 -9.531 5.096 0.144 61 HG21 ILE 11 HG21 ILE 11 -8.506 1.863 1.674 62 HG22 ILE 11 HG22 ILE 11 -9.200 0.884 0.383 63 HG23 ILE 11 HG23 ILE 11 -10.257 1.759 1.491 64 HD11 ILE 11 HD11 ILE 11 -10.636 5.225 2.304 65 HD12 ILE 11 HD12 ILE 11 -10.521 3.471 2.463 66 HD13 ILE 11 HD13 ILE 11 -11.520 4.179 1.192 67 H GLN 12 HN GLN 12 -6.525 1.198 -0.022 68 HA GLN 12 HA GLN 12 -7.307 -0.673 -2.105 69 HB2 GLN 12 HB2 GLN 12 -4.568 -0.973 -2.141 70 HB3 GLN 12 HB1 GLN 12 -5.535 -0.184 -3.372 71 HG2 GLN 12 HG2 GLN 12 -5.225 1.914 -1.857 72 HG3 GLN 12 HG1 GLN 12 -3.833 1.012 -1.259 73 HE21 GLN 12 HE21 GLN 12 -5.251 2.623 -3.973 74 HE22 GLN 12 HE22 GLN 12 -3.835 2.667 -4.956 75 H CYS 13 HN CYS 13 -6.340 -2.833 -1.752 76 HA CYS 13 HA CYS 13 -6.189 -3.335 1.142 77 HB2 CYS 13 HB2 CYS 13 -8.218 -4.265 0.279 78 HB3 CYS 13 HB1 CYS 13 -7.385 -5.006 -1.078 79 H CYS 14 HN CYS 14 -4.135 -3.541 1.604 80 HA CYS 14 HA CYS 14 -2.274 -4.702 -0.288 81 HB2 CYS 14 HB2 CYS 14 -1.895 -3.410 2.403 82 HB3 CYS 14 HB1 CYS 14 -0.581 -4.074 1.441 83 H GLN 15 HN GLN 15 -1.379 -6.624 -0.156 84 HA GLN 15 HA GLN 15 -2.375 -8.506 1.735 85 HB2 GLN 15 HB2 GLN 15 -1.822 -9.973 0.138 86 HB3 GLN 15 HB1 GLN 15 -1.319 -8.608 -0.836 87 HG2 GLN 15 HG2 GLN 15 0.457 -10.093 -0.945 88 HG3 GLN 15 HG1 GLN 15 0.975 -8.896 0.238 89 HE21 GLN 15 HE21 GLN 15 -1.391 -11.348 0.987 90 HE22 GLN 15 HE22 GLN 15 -0.390 -12.258 2.062 91 H ASN 16 HN ASN 16 0.432 -6.529 1.407 92 HA ASN 16 HA ASN 16 1.347 -7.416 4.042 93 HB2 ASN 16 HB2 ASN 16 2.594 -8.363 1.834 94 HB3 ASN 16 HB1 ASN 16 3.453 -6.851 2.093 95 HD21 ASN 16 HD21 ASN 16 4.287 -9.640 2.334 96 HD22 ASN 16 HD22 ASN 16 4.940 -9.788 3.931 97 H VAL 17 HN VAL 17 0.997 -5.554 5.076 98 HA VAL 17 HA VAL 17 1.823 -3.019 3.882 99 HB VAL 17 HB VAL 17 0.379 -3.527 6.496 100 HG11 VAL 17 HG11 VAL 17 0.936 -0.945 5.040 101 HG12 VAL 17 HG12 VAL 17 1.669 -1.460 6.558 102 HG13 VAL 17 HG13 VAL 17 -0.059 -1.115 6.486 103 HG21 VAL 17 HG21 VAL 17 -1.598 -2.692 5.350 104 HG22 VAL 17 HG22 VAL 17 -0.957 -4.115 4.527 105 HG23 VAL 17 HG23 VAL 17 -0.671 -2.506 3.862 106 H VAL 18 HN VAL 18 3.894 -2.551 4.113 107 HA VAL 18 HA VAL 18 5.173 -3.052 6.715 108 HB VAL 18 HB VAL 18 7.270 -3.655 5.500 109 HG11 VAL 18 HG11 VAL 18 4.899 -5.448 4.992 110 HG12 VAL 18 HG12 VAL 18 5.880 -5.398 6.456 111 HG13 VAL 18 HG13 VAL 18 6.588 -5.947 4.938 112 HG21 VAL 18 HG21 VAL 18 7.102 -4.362 3.152 113 HG22 VAL 18 HG22 VAL 18 6.772 -2.641 3.350 114 HG23 VAL 18 HG23 VAL 18 5.441 -3.771 3.101 115 HA PRO 19 HA PRO 19 6.663 1.137 6.264 116 HB2 PRO 19 HB2 PRO 19 9.023 0.264 7.774 117 HB3 PRO 19 HB1 PRO 19 7.834 1.503 8.173 118 HG2 PRO 19 HG2 PRO 19 7.931 -0.850 9.478 119 HG3 PRO 19 HG1 PRO 19 6.410 0.012 9.187 120 HD2 PRO 19 HD2 PRO 19 7.537 -2.376 7.790 121 HD3 PRO 19 HD1 PRO 19 5.853 -1.997 8.206 122 H GLY 20 HN GLY 20 7.913 2.137 4.769 123 HA2 GLY 20 HA2 GLY 20 9.218 0.532 2.829 124 HA3 GLY 20 HA1 GLY 20 9.218 2.286 2.884 125 H ASP 21 HN ASP 21 10.352 2.160 5.659 126 HA ASP 21 HA ASP 21 13.143 1.680 4.892 127 HB2 ASP 21 HB2 ASP 21 12.445 3.917 5.802 128 HB3 ASP 21 HB1 ASP 21 12.073 3.119 7.317 129 H SER 22 HN SER 22 10.811 -0.116 6.018 130 HA SER 22 HA SER 22 12.036 -1.329 8.322 131 HB2 SER 22 HB2 SER 22 9.635 -1.475 8.142 132 HB3 SER 22 HB1 SER 22 9.742 -2.165 6.531 133 HG SER 22 HG SER 22 9.937 -3.373 8.981 134 H ASP 23 HN ASP 23 12.872 -3.511 8.351 135 HA ASP 23 HA ASP 23 14.714 -4.144 6.357 136 HB2 ASP 23 HB2 ASP 23 13.371 -5.809 8.472 137 HB3 ASP 23 HB1 ASP 23 14.479 -6.544 7.322 138 H LEU 24 HN LEU 24 11.390 -5.209 6.815 139 HA LEU 24 HA LEU 24 11.276 -6.922 4.569 140 HB2 LEU 24 HB2 LEU 24 9.481 -5.894 6.583 141 HB3 LEU 24 HB1 LEU 24 8.714 -5.879 5.008 142 HG LEU 24 HG LEU 24 8.254 -7.931 6.280 143 HD11 LEU 24 HD11 LEU 24 8.142 -8.007 3.872 144 HD12 LEU 24 HD12 LEU 24 8.833 -9.516 4.473 145 HD13 LEU 24 HD13 LEU 24 9.879 -8.284 3.768 146 HD21 LEU 24 HD21 LEU 24 10.334 -8.119 7.508 147 HD22 LEU 24 HD22 LEU 24 11.217 -8.403 6.009 148 HD23 LEU 24 HD23 LEU 24 10.041 -9.586 6.578 149 H GLY 25 HN GLY 25 9.861 -3.680 5.024 150 HA2 GLY 25 HA2 GLY 25 8.948 -3.371 2.410 151 HA3 GLY 25 HA1 GLY 25 9.275 -2.053 3.522 152 H THR 26 HN THR 26 12.080 -2.530 3.788 153 HA THR 26 HA THR 26 12.954 -1.034 1.538 154 HB THR 26 HB THR 26 14.582 -2.357 3.711 155 HG1 THR 26 HG1 THR 26 13.013 -0.119 3.625 156 HG21 THR 26 HG21 THR 26 15.346 -0.120 1.840 157 HG22 THR 26 HG22 THR 26 15.907 -1.788 1.699 158 HG23 THR 26 HG23 THR 26 16.350 -0.822 3.107 159 H LEU 27 HN LEU 27 13.360 -4.390 2.572 160 HA LEU 27 HA LEU 27 15.044 -5.210 0.469 161 HB2 LEU 27 HB2 LEU 27 14.470 -6.442 2.627 162 HB3 LEU 27 HB1 LEU 27 12.971 -6.910 1.856 163 HG LEU 27 HG LEU 27 14.814 -8.639 1.867 164 HD11 LEU 27 HD11 LEU 27 14.398 -9.372 -0.438 165 HD12 LEU 27 HD12 LEU 27 13.685 -7.798 -0.793 166 HD13 LEU 27 HD13 LEU 27 12.923 -8.866 0.386 167 HD21 LEU 27 HD21 LEU 27 16.003 -6.829 -0.227 168 HD22 LEU 27 HD22 LEU 27 16.568 -8.443 0.200 169 HD23 LEU 27 HD23 LEU 27 16.673 -7.133 1.374 170 H LEU 28 HN LEU 28 11.559 -4.913 0.784 171 HA LEU 28 HA LEU 28 10.891 -6.271 -1.611 172 HB2 LEU 28 HB2 LEU 28 9.283 -4.153 -0.190 173 HB3 LEU 28 HB1 LEU 28 8.679 -5.324 -1.340 174 HG LEU 28 HG LEU 28 9.554 -5.777 1.498 175 HD11 LEU 28 HD11 LEU 28 7.239 -5.141 1.119 176 HD12 LEU 28 HD12 LEU 28 7.357 -6.806 1.686 177 HD13 LEU 28 HD13 LEU 28 7.048 -6.477 -0.018 178 HD21 LEU 28 HD21 LEU 28 9.167 -7.866 -0.636 179 HD22 LEU 28 HD22 LEU 28 9.268 -8.189 1.095 180 HD23 LEU 28 HD23 LEU 28 10.652 -7.505 0.245 181 H LEU 29 HN LEU 29 11.068 -2.786 -0.835 182 HA LEU 29 HA LEU 29 10.476 -2.045 -3.520 183 HB2 LEU 29 HB2 LEU 29 10.982 0.234 -2.816 184 HB3 LEU 29 HB1 LEU 29 9.886 -0.561 -1.720 185 HG LEU 29 HG LEU 29 11.953 -0.973 -0.245 186 HD11 LEU 29 HD11 LEU 29 13.030 1.222 -2.010 187 HD12 LEU 29 HD12 LEU 29 13.676 -0.413 -1.871 188 HD13 LEU 29 HD13 LEU 29 13.743 0.682 -0.491 189 HD21 LEU 29 HD21 LEU 29 10.196 0.561 0.352 190 HD22 LEU 29 HD22 LEU 29 10.869 1.795 -0.713 191 HD23 LEU 29 HD23 LEU 29 11.760 1.285 0.722 192 H ASP 30 HN ASP 30 13.371 -2.860 -1.880 193 HA ASP 30 HA ASP 30 15.271 -1.739 -3.622 194 HB2 ASP 30 HB2 ASP 30 15.950 -2.758 -1.539 195 HB3 ASP 30 HB1 ASP 30 15.309 -4.313 -2.039 196 H GLU 31 HN GLU 31 13.365 -4.650 -3.741 197 HA GLU 31 HA GLU 31 14.609 -5.766 -6.046 198 HB2 GLU 31 HB2 GLU 31 13.137 -6.834 -4.126 199 HB3 GLU 31 HB1 GLU 31 11.813 -6.426 -5.210 200 HG2 GLU 31 HG2 GLU 31 12.826 -7.742 -6.972 201 HG3 GLU 31 HG1 GLU 31 14.187 -8.095 -5.909 202 H LEU 32 HN LEU 32 12.415 -3.298 -5.466 203 HA LEU 32 HA LEU 32 11.137 -3.506 -8.095 204 HB2 LEU 32 HB2 LEU 32 10.401 -2.003 -5.594 205 HB3 LEU 32 HB1 LEU 32 9.484 -1.930 -7.087 206 HG LEU 32 HG LEU 32 9.946 -4.426 -5.451 207 HD11 LEU 32 HD11 LEU 32 8.524 -2.853 -4.277 208 HD12 LEU 32 HD12 LEU 32 7.579 -4.220 -4.867 209 HD13 LEU 32 HD13 LEU 32 7.512 -2.672 -5.710 210 HD21 LEU 32 HD21 LEU 32 8.200 -3.921 -7.858 211 HD22 LEU 32 HD22 LEU 32 8.220 -5.400 -6.899 212 HD23 LEU 32 HD23 LEU 32 9.652 -4.920 -7.809 213 H GLY 33 HN GLY 33 13.464 -1.742 -6.372 214 HA2 GLY 33 HA2 GLY 33 14.858 -0.046 -7.053 215 HA3 GLY 33 HA1 GLY 33 14.050 -0.074 -8.611 216 H ILE 34 HN ILE 34 12.725 0.578 -5.374 217 HA ILE 34 HA ILE 34 11.575 3.042 -6.484 218 HB ILE 34 HB ILE 34 10.827 1.698 -3.889 219 HG12 ILE 34 HG12 ILE 34 9.432 1.445 -6.565 220 HG13 ILE 34 HG11 ILE 34 10.471 0.206 -5.867 221 HG21 ILE 34 HG21 ILE 34 9.403 3.738 -5.590 222 HG22 ILE 34 HG22 ILE 34 10.205 4.042 -4.049 223 HG23 ILE 34 HG23 ILE 34 8.773 3.014 -4.110 224 HD11 ILE 34 HD11 ILE 34 8.133 -0.303 -5.507 225 HD12 ILE 34 HD12 ILE 34 7.908 1.239 -4.682 226 HD13 ILE 34 HD13 ILE 34 8.947 0.004 -3.973 227 H VAL 35 HN VAL 35 12.392 4.945 -5.916 228 HA VAL 35 HA VAL 35 13.927 5.100 -3.413 229 HB VAL 35 HB VAL 35 15.364 5.626 -5.250 230 HG11 VAL 35 HG11 VAL 35 13.287 7.625 -6.129 231 HG12 VAL 35 HG12 VAL 35 13.748 6.141 -6.964 232 HG13 VAL 35 HG13 VAL 35 14.902 7.468 -6.821 233 HG21 VAL 35 HG21 VAL 35 15.671 6.987 -3.267 234 HG22 VAL 35 HG22 VAL 35 14.501 8.162 -3.867 235 HG23 VAL 35 HG23 VAL 35 16.030 7.929 -4.716 236 H LEU 36 HN LEU 36 12.569 5.723 -1.883 237 HA LEU 36 HA LEU 36 10.431 7.600 -2.419 238 HB2 LEU 36 HB2 LEU 36 11.297 6.277 0.148 239 HB3 LEU 36 HB1 LEU 36 9.799 7.147 -0.104 240 HG LEU 36 HG LEU 36 10.483 4.725 -1.735 241 HD11 LEU 36 HD11 LEU 36 9.170 3.408 -0.141 242 HD12 LEU 36 HD12 LEU 36 9.090 4.805 0.934 243 HD13 LEU 36 HD13 LEU 36 10.647 4.052 0.578 244 HD21 LEU 36 HD21 LEU 36 8.685 6.155 -2.532 245 HD22 LEU 36 HD22 LEU 36 7.894 6.053 -0.960 246 HD23 LEU 36 HD23 LEU 36 8.052 4.611 -1.963 247 H GLU 37 HN GLU 37 10.286 9.667 -1.695 248 HA GLU 37 HA GLU 37 12.659 11.057 -0.900 249 HB2 GLU 37 HB2 GLU 37 9.775 11.963 -1.002 250 HB3 GLU 37 HB1 GLU 37 11.160 13.023 -0.778 251 HG2 GLU 37 HG2 GLU 37 10.695 11.299 -3.200 252 HG3 GLU 37 HG1 GLU 37 10.288 13.011 -3.086 253 H ASP 38 HN ASP 38 9.980 9.588 0.664 254 HA ASP 38 HA ASP 38 11.261 10.065 3.240 255 HB2 ASP 38 HB2 ASP 38 8.329 10.399 2.599 256 HB3 ASP 38 HB1 ASP 38 8.870 10.001 4.225 257 HA PRO 39 HA PRO 39 10.810 5.613 2.329 258 HB2 PRO 39 HB2 PRO 39 12.837 4.847 3.995 259 HB3 PRO 39 HB1 PRO 39 13.086 5.364 2.324 260 HG2 PRO 39 HG2 PRO 39 13.433 6.911 4.858 261 HG3 PRO 39 HG1 PRO 39 14.446 6.898 3.403 262 HD2 PRO 39 HD2 PRO 39 12.683 8.880 3.930 263 HD3 PRO 39 HD1 PRO 39 13.063 8.362 2.277 264 H THR 40 HN THR 40 10.192 7.528 4.941 265 HA THR 40 HA THR 40 9.867 5.512 6.966 266 HB THR 40 HB THR 40 8.754 7.405 8.224 267 HG1 THR 40 HG1 THR 40 8.049 8.725 6.586 268 HG21 THR 40 HG21 THR 40 11.135 6.889 8.492 269 HG22 THR 40 HG22 THR 40 10.848 8.626 8.586 270 HG23 THR 40 HG23 THR 40 11.517 7.922 7.115 271 H VAL 41 HN VAL 41 8.038 6.527 4.319 272 HA VAL 41 HA VAL 41 5.422 6.309 5.416 273 HB VAL 41 HB VAL 41 4.620 6.270 3.114 274 HG11 VAL 41 HG11 VAL 41 6.843 8.259 3.535 275 HG12 VAL 41 HG12 VAL 41 5.181 8.415 4.104 276 HG13 VAL 41 HG13 VAL 41 5.525 8.420 2.374 277 HG21 VAL 41 HG21 VAL 41 7.524 6.115 2.318 278 HG22 VAL 41 HG22 VAL 41 6.158 6.325 1.222 279 HG23 VAL 41 HG23 VAL 41 6.332 4.828 2.137 280 H LEU 42 HN LEU 42 3.857 4.680 4.949 281 HA LEU 42 HA LEU 42 4.965 2.006 5.094 282 HB2 LEU 42 HB2 LEU 42 2.106 2.974 5.212 283 HB3 LEU 42 HB1 LEU 42 2.617 1.317 5.465 284 HG LEU 42 HG LEU 42 3.354 3.665 7.214 285 HD11 LEU 42 HD11 LEU 42 1.918 2.574 8.872 286 HD12 LEU 42 HD12 LEU 42 1.466 1.359 7.677 287 HD13 LEU 42 HD13 LEU 42 1.012 3.046 7.436 288 HD21 LEU 42 HD21 LEU 42 5.125 2.029 7.181 289 HD22 LEU 42 HD22 LEU 42 3.972 0.725 7.456 290 HD23 LEU 42 HD23 LEU 42 4.260 1.928 8.713 291 H ILE 43 HN ILE 43 5.083 0.622 3.475 292 HA ILE 43 HA ILE 43 3.595 1.267 1.025 293 HB ILE 43 HB ILE 43 5.278 -0.161 -0.180 294 HG12 ILE 43 HG12 ILE 43 6.929 0.217 2.323 295 HG13 ILE 43 HG11 ILE 43 6.159 -1.298 1.867 296 HG21 ILE 43 HG21 ILE 43 6.968 1.618 -0.286 297 HG22 ILE 43 HG22 ILE 43 6.278 2.344 1.166 298 HG23 ILE 43 HG23 ILE 43 5.324 2.255 -0.314 299 HD11 ILE 43 HD11 ILE 43 7.504 -1.416 -0.137 300 HD12 ILE 43 HD12 ILE 43 8.542 -1.224 1.276 301 HD13 ILE 43 HD13 ILE 43 8.220 0.154 0.224 302 H GLY 44 HN GLY 44 2.512 -0.373 -0.050 303 HA2 GLY 44 HA2 GLY 44 2.039 -2.742 1.648 304 HA3 GLY 44 HA1 GLY 44 0.772 -1.925 0.753 305 H ASP 45 HN ASP 45 3.084 -4.371 0.723 306 HA ASP 45 HA ASP 45 3.142 -4.739 -2.138 307 HB2 ASP 45 HB2 ASP 45 5.029 -5.542 -0.834 308 HB3 ASP 45 HB1 ASP 45 3.969 -6.546 0.148 309 H GLY 46 HN GLY 46 1.866 -6.134 -3.334 310 HA2 GLY 46 HA2 GLY 46 0.159 -7.642 -3.777 311 HA3 GLY 46 HA1 GLY 46 0.153 -8.042 -2.081 312 H CYS 47 HN CYS 47 -0.355 -4.889 -3.592 313 HA CYS 47 HA CYS 47 -2.819 -4.702 -2.005 314 HB2 CYS 47 HB2 CYS 47 -0.668 -3.070 -1.960 315 HB3 CYS 47 HB1 CYS 47 -1.645 -2.276 -3.193 316 H ASP 48 HN ASP 48 -4.592 -4.993 -3.086 317 HA ASP 48 HA ASP 48 -4.773 -4.014 -5.838 318 HB2 ASP 48 HB2 ASP 48 -5.509 -6.192 -5.885 319 HB3 ASP 48 HB1 ASP 48 -6.304 -6.085 -4.322 320 HA PRO 49 HA PRO 49 -7.056 -0.464 -4.562 321 HB2 PRO 49 HB2 PRO 49 -8.406 -0.632 -7.159 322 HB3 PRO 49 HB1 PRO 49 -7.333 0.616 -6.540 323 HG2 PRO 49 HG2 PRO 49 -6.628 -1.127 -8.503 324 HG3 PRO 49 HG1 PRO 49 -5.471 -0.360 -7.405 325 HD2 PRO 49 HD2 PRO 49 -6.499 -3.150 -7.422 326 HD3 PRO 49 HD1 PRO 49 -4.941 -2.515 -6.873 327 H ILE 50 HN ILE 50 -8.787 -0.578 -3.224 328 HA ILE 50 HA ILE 50 -10.633 -2.758 -3.482 329 HB ILE 50 HB ILE 50 -10.798 -0.426 -1.564 330 HG12 ILE 50 HG12 ILE 50 -9.578 -3.175 -1.227 331 HG13 ILE 50 HG11 ILE 50 -8.699 -1.654 -1.280 332 HG21 ILE 50 HG21 ILE 50 -12.246 -1.881 -0.266 333 HG22 ILE 50 HG22 ILE 50 -12.054 -3.165 -1.459 334 HG23 ILE 50 HG23 ILE 50 -12.900 -1.677 -1.892 335 HD11 ILE 50 HD11 ILE 50 -10.644 -2.525 0.838 336 HD12 ILE 50 HD12 ILE 50 -9.851 -0.952 0.777 337 HD13 ILE 50 HD13 ILE 50 -8.891 -2.414 0.994 338 H THR 51 HN THR 51 -11.654 -2.454 -5.401 339 HA THR 51 HA THR 51 -13.619 -0.270 -5.431 340 HB THR 51 HB THR 51 -11.849 0.110 -7.131 341 HG1 THR 51 HG1 THR 51 -14.534 -0.118 -7.635 342 HG21 THR 51 HG21 THR 51 -11.722 -1.368 -9.089 343 HG22 THR 51 HG22 THR 51 -12.848 -2.481 -8.311 344 HG23 THR 51 HG23 THR 51 -11.258 -2.198 -7.605 345 H VAL 52 HN VAL 52 -13.337 -3.311 -4.808 346 HA VAL 52 HA VAL 52 -15.391 -4.435 -6.487 347 HB VAL 52 HB VAL 52 -13.459 -5.788 -5.690 348 HG11 VAL 52 HG11 VAL 52 -13.234 -4.855 -3.452 349 HG12 VAL 52 HG12 VAL 52 -13.417 -6.607 -3.392 350 HG13 VAL 52 HG13 VAL 52 -14.780 -5.564 -2.991 351 HG21 VAL 52 HG21 VAL 52 -14.751 -7.777 -5.099 352 HG22 VAL 52 HG22 VAL 52 -15.489 -6.883 -6.425 353 HG23 VAL 52 HG23 VAL 52 -16.163 -6.765 -4.801 354 H ALA 53 HN ALA 53 -17.431 -5.111 -5.737 355 HA ALA 53 HA ALA 53 -18.514 -3.413 -3.649 356 HB1 ALA 53 HB1 ALA 53 -19.691 -3.624 -5.794 357 HB2 ALA 53 HB2 ALA 53 -20.688 -4.157 -4.441 358 HB3 ALA 53 HB3 ALA 53 -19.919 -5.347 -5.491 359 H GLY 54 HN GLY 54 -17.178 -4.655 -2.045 360 HA2 GLY 54 HA2 GLY 54 -18.367 -7.250 -1.334 361 HA3 GLY 54 HA1 GLY 54 -16.818 -6.643 -0.766 362 H SER 55 HN SER 55 -18.632 -4.033 -0.541 363 HA SER 55 HA SER 55 -19.710 -2.894 1.079 364 HB2 SER 55 HB2 SER 55 -21.438 -4.656 0.850 365 HB3 SER 55 HB1 SER 55 -20.614 -5.603 2.085 366 HG SER 55 HG SER 55 -22.194 -3.334 2.328 367 H SER 56 HN SER 56 -19.098 -5.689 3.176 368 HA SER 56 HA SER 56 -17.180 -4.013 4.658 369 HB2 SER 56 HB2 SER 56 -18.824 -6.314 5.726 370 HB3 SER 56 HB1 SER 56 -17.821 -5.208 6.661 371 HG SER 56 HG SER 56 -20.294 -4.756 5.406 372 H ASP 57 HN ASP 57 -17.467 -6.633 2.649 373 HA ASP 57 HA ASP 57 -14.953 -7.811 3.630 374 HB2 ASP 57 HB2 ASP 57 -16.929 -9.337 3.825 375 HB3 ASP 57 HB1 ASP 57 -17.136 -9.229 2.082 376 H ALA 58 HN ALA 58 -14.160 -5.953 2.296 377 HA ALA 58 HA ALA 58 -14.110 -6.656 -0.566 378 HB1 ALA 58 HB1 ALA 58 -15.301 -4.562 -0.096 379 HB2 ALA 58 HB2 ALA 58 -13.850 -4.298 -1.063 380 HB3 ALA 58 HB3 ALA 58 -13.845 -3.914 0.658 381 H CYS 59 HN CYS 59 -12.297 -7.037 2.010 382 HA CYS 59 HA CYS 59 -9.812 -6.701 0.499 383 HB2 CYS 59 HB2 CYS 59 -9.925 -4.759 1.966 384 HB3 CYS 59 HB1 CYS 59 -10.240 -5.791 3.354 385 H SER 60 HN SER 60 -8.206 -8.232 1.006 386 HA SER 60 HA SER 60 -9.204 -10.490 2.607 387 HB2 SER 60 HB2 SER 60 -9.119 -10.867 0.131 388 HB3 SER 60 HB1 SER 60 -7.375 -10.659 0.219 389 HG SER 60 HG SER 60 -7.678 -12.402 1.981 390 H ALA 61 HN ALA 61 -7.245 -8.109 3.130 391 HA ALA 61 HA ALA 61 -5.477 -9.696 4.752 392 HB1 ALA 61 HB1 ALA 61 -4.276 -9.719 2.616 393 HB2 ALA 61 HB2 ALA 61 -3.384 -8.842 3.860 394 HB3 ALA 61 HB3 ALA 61 -4.259 -7.955 2.613 395 H THR 62 HN THR 62 -5.037 -6.395 3.481 396 HA THR 62 HA THR 62 -5.911 -5.275 6.027 397 HB THR 62 HB THR 62 -3.140 -4.693 4.959 398 HG1 THR 62 HG1 THR 62 -4.067 -6.711 6.584 399 HG21 THR 62 HG21 THR 62 -4.469 -3.974 7.577 400 HG22 THR 62 HG22 THR 62 -4.158 -2.866 6.240 401 HG23 THR 62 HG23 THR 62 -2.810 -3.589 7.118 402 H ALA 63 HN ALA 63 -6.925 -3.378 5.714 403 HA ALA 63 HA ALA 63 -6.960 -2.263 3.028 404 HB1 ALA 63 HB1 ALA 63 -8.899 -1.000 3.767 405 HB2 ALA 63 HB2 ALA 63 -8.654 -1.551 5.424 406 HB3 ALA 63 HB3 ALA 63 -9.101 -2.707 4.167 407 H VAL 64 HN VAL 64 -6.167 -0.301 2.512 408 HA VAL 64 HA VAL 64 -5.178 1.441 4.643 409 HB VAL 64 HB VAL 64 -3.028 1.719 3.333 410 HG11 VAL 64 HG11 VAL 64 -2.971 0.583 5.443 411 HG12 VAL 64 HG12 VAL 64 -1.973 -0.318 4.303 412 HG13 VAL 64 HG13 VAL 64 -3.587 -0.898 4.712 413 HG21 VAL 64 HG21 VAL 64 -3.784 0.661 1.281 414 HG22 VAL 64 HG22 VAL 64 -3.952 -0.881 2.133 415 HG23 VAL 64 HG23 VAL 64 -2.354 -0.158 1.919 416 H CYS 65 HN CYS 65 -4.662 3.557 3.930 417 HA CYS 65 HA CYS 65 -5.942 4.308 1.392 418 HB2 CYS 65 HB2 CYS 65 -7.021 5.406 3.240 419 HB3 CYS 65 HB1 CYS 65 -5.475 5.855 3.950 420 H CYS 66 HN CYS 66 -4.381 4.361 -0.133 421 HA CYS 66 HA CYS 66 -1.719 5.277 0.608 422 HB2 CYS 66 HB2 CYS 66 -2.736 4.162 -2.005 423 HB3 CYS 66 HB1 CYS 66 -1.048 4.460 -1.590 424 H SER 67 HN SER 67 -1.091 7.258 0.387 425 HA SER 67 HA SER 67 -2.711 9.206 -0.952 426 HB2 SER 67 HB2 SER 67 -1.490 9.617 1.202 427 HB3 SER 67 HB1 SER 67 0.017 9.558 0.293 428 HG SER 67 HG SER 67 -0.302 11.563 -0.181 429 H ASP 68 HN ASP 68 -0.023 7.262 -1.739 430 HA ASP 68 HA ASP 68 0.533 8.859 -4.148 431 HB2 ASP 68 HB2 ASP 68 2.418 8.164 -2.524 432 HB3 ASP 68 HB1 ASP 68 2.195 6.542 -3.172 433 H ASN 69 HN ASN 69 0.579 7.767 -6.201 434 HA ASN 69 HA ASN 69 -1.055 5.321 -6.169 435 HB2 ASN 69 HB2 ASN 69 -2.056 6.114 -8.318 436 HB3 ASN 69 HB1 ASN 69 -2.456 7.098 -6.920 437 HD21 ASN 69 HD21 ASN 69 0.631 7.258 -8.623 438 HD22 ASN 69 HD22 ASN 69 0.397 8.849 -9.250 439 H ASN 70 HN ASN 70 1.998 6.188 -6.746 440 HA ASN 70 HA ASN 70 2.280 4.917 -9.338 441 HB2 ASN 70 HB2 ASN 70 4.431 5.700 -9.421 442 HB3 ASN 70 HB1 ASN 70 3.739 6.870 -8.311 443 HD21 ASN 70 HD21 ASN 70 4.254 6.731 -6.103 444 HD22 ASN 70 HD22 ASN 70 5.675 5.890 -5.574 445 H VAL 71 HN VAL 71 2.256 2.843 -9.580 446 HA VAL 71 HA VAL 71 3.045 1.125 -7.321 447 HB VAL 71 HB VAL 71 0.705 0.814 -9.189 448 HG11 VAL 71 HG11 VAL 71 1.915 -1.130 -7.290 449 HG12 VAL 71 HG12 VAL 71 1.321 -1.385 -8.932 450 HG13 VAL 71 HG13 VAL 71 0.184 -1.151 -7.611 451 HG21 VAL 71 HG21 VAL 71 0.317 2.406 -7.410 452 HG22 VAL 71 HG22 VAL 71 0.842 1.219 -6.217 453 HG23 VAL 71 HG23 VAL 71 -0.635 0.947 -7.141 454 H SER 72 HN SER 72 4.268 -0.608 -7.760 455 HA SER 72 HA SER 72 5.653 -0.720 -10.264 456 HB2 SER 72 HB2 SER 72 6.992 -2.444 -9.183 457 HB3 SER 72 HB1 SER 72 6.718 -1.125 -8.042 458 HG SER 72 HG SER 72 5.946 -3.735 -7.893 459 H GLY 73 HN GLY 73 2.733 -1.824 -9.419 460 HA2 GLY 73 HA2 GLY 73 1.634 -3.186 -11.210 461 HA3 GLY 73 HA1 GLY 73 2.936 -4.330 -10.947 462 H VAL 74 HN VAL 74 2.921 -3.973 -8.023 463 HA VAL 74 HA VAL 74 0.255 -4.999 -7.379 464 HB VAL 74 HB VAL 74 1.079 -6.867 -6.160 465 HG11 VAL 74 HG11 VAL 74 0.727 -7.356 -8.454 466 HG12 VAL 74 HG12 VAL 74 2.219 -8.166 -7.976 467 HG13 VAL 74 HG13 VAL 74 2.284 -6.663 -8.903 468 HG21 VAL 74 HG21 VAL 74 3.488 -7.447 -6.127 469 HG22 VAL 74 HG22 VAL 74 3.093 -5.983 -5.230 470 HG23 VAL 74 HG23 VAL 74 3.834 -5.865 -6.827 471 H ILE 75 HN ILE 75 2.660 -2.859 -6.562 472 HA ILE 75 HA ILE 75 2.334 -3.155 -3.682 473 HB ILE 75 HB ILE 75 4.027 -1.378 -3.491 474 HG12 ILE 75 HG12 ILE 75 4.636 -1.591 -6.388 475 HG13 ILE 75 HG11 ILE 75 3.279 -0.564 -5.937 476 HG21 ILE 75 HG21 ILE 75 5.884 -2.711 -4.296 477 HG22 ILE 75 HG22 ILE 75 4.787 -3.633 -5.323 478 HG23 ILE 75 HG23 ILE 75 4.649 -3.738 -3.567 479 HD11 ILE 75 HD11 ILE 75 4.774 0.694 -4.446 480 HD12 ILE 75 HD12 ILE 75 5.310 0.730 -6.126 481 HD13 ILE 75 HD13 ILE 75 6.117 -0.323 -4.964 482 H ALA 76 HN ALA 76 2.476 -0.934 -2.543 483 HA ALA 76 HA ALA 76 0.850 1.172 -3.704 484 HB1 ALA 76 HB1 ALA 76 0.130 -0.249 -1.138 485 HB2 ALA 76 HB2 ALA 76 -0.808 -0.249 -2.634 486 HB3 ALA 76 HB3 ALA 76 -0.616 1.243 -1.714 487 H ILE 77 HN ILE 77 1.387 3.211 -2.762 488 HA ILE 77 HA ILE 77 3.544 3.088 -0.763 489 HB ILE 77 HB ILE 77 3.462 4.875 -3.195 490 HG12 ILE 77 HG12 ILE 77 5.305 2.593 -2.453 491 HG13 ILE 77 HG11 ILE 77 4.045 2.533 -3.680 492 HG21 ILE 77 HG21 ILE 77 5.533 4.668 -1.011 493 HG22 ILE 77 HG22 ILE 77 4.437 6.024 -1.277 494 HG23 ILE 77 HG23 ILE 77 5.674 5.641 -2.475 495 HD11 ILE 77 HD11 ILE 77 5.217 4.200 -4.988 496 HD12 ILE 77 HD12 ILE 77 6.255 2.814 -4.656 497 HD13 ILE 77 HD13 ILE 77 6.467 4.313 -3.749 498 H GLY 78 HN GLY 78 3.554 4.571 0.838 499 HA2 GLY 78 HA2 GLY 78 2.932 6.358 2.144 500 HA3 GLY 78 HA1 GLY 78 2.242 7.091 0.704 501 H CYS 79 HN CYS 79 1.541 4.180 2.623 502 HA CYS 79 HA CYS 79 -1.301 4.869 2.349 503 HB2 CYS 79 HB2 CYS 79 -0.194 2.133 2.936 504 HB3 CYS 79 HB1 CYS 79 -1.791 2.561 2.337 505 H LEU 80 HN LEU 80 -2.596 5.032 4.068 506 HA LEU 80 HA LEU 80 -1.455 4.441 6.715 507 HB2 LEU 80 HB2 LEU 80 -3.775 6.226 5.981 508 HB3 LEU 80 HB1 LEU 80 -3.182 5.930 7.606 509 HG LEU 80 HG LEU 80 -1.612 7.282 5.410 510 HD11 LEU 80 HD11 LEU 80 -3.470 8.656 6.191 511 HD12 LEU 80 HD12 LEU 80 -1.925 9.313 6.729 512 HD13 LEU 80 HD13 LEU 80 -2.947 8.427 7.859 513 HD21 LEU 80 HD21 LEU 80 -0.182 6.078 6.965 514 HD22 LEU 80 HD22 LEU 80 -0.990 6.849 8.330 515 HD23 LEU 80 HD23 LEU 80 -0.032 7.818 7.208 516 HA PRO 81 HA PRO 81 -4.106 0.918 6.911 517 HB2 PRO 81 HB2 PRO 81 -3.929 1.238 9.833 518 HB3 PRO 81 HB1 PRO 81 -3.418 -0.110 8.819 519 HG2 PRO 81 HG2 PRO 81 -1.640 1.519 9.968 520 HG3 PRO 81 HG1 PRO 81 -1.367 0.841 8.353 521 HD2 PRO 81 HD2 PRO 81 -2.270 3.591 9.124 522 HD3 PRO 81 HD1 PRO 81 -1.145 3.090 7.854 523 H VAL 82 HN VAL 82 -6.226 0.923 6.609 524 HA VAL 82 HA VAL 82 -7.943 2.329 8.517 525 HB VAL 82 HB VAL 82 -9.538 2.651 6.593 526 HG11 VAL 82 HG11 VAL 82 -8.427 4.686 5.767 527 HG12 VAL 82 HG12 VAL 82 -6.915 4.127 6.481 528 HG13 VAL 82 HG13 VAL 82 -8.287 4.519 7.517 529 HG21 VAL 82 HG21 VAL 82 -8.620 2.710 4.335 530 HG22 VAL 82 HG22 VAL 82 -8.546 1.088 5.025 531 HG23 VAL 82 HG23 VAL 82 -7.091 2.082 4.947 532 H THR 83 HN THR 83 -10.091 1.377 8.686 533 HA THR 83 HA THR 83 -10.542 -1.200 7.480 534 HB THR 83 HB THR 83 -9.134 -1.611 9.559 535 HG1 THR 83 HG1 THR 83 -10.264 -3.343 8.755 536 HG21 THR 83 HG21 THR 83 -10.416 -1.618 11.678 537 HG22 THR 83 HG22 THR 83 -11.722 -0.777 10.840 538 HG23 THR 83 HG23 THR 83 -10.152 -0.000 11.027 539 H LEU 84 HN LEU 84 -12.663 -2.121 8.422 540 HA LEU 84 HA LEU 84 -14.901 -1.945 8.641 541 HB2 LEU 84 HB2 LEU 84 -14.108 0.505 10.183 542 HB3 LEU 84 HB1 LEU 84 -15.735 -0.149 10.159 543 HG LEU 84 HG LEU 84 -13.326 -1.671 11.122 544 HD11 LEU 84 HD11 LEU 84 -14.139 -1.211 13.384 545 HD12 LEU 84 HD12 LEU 84 -15.389 -0.162 12.716 546 HD13 LEU 84 HD13 LEU 84 -13.689 0.272 12.542 547 HD21 LEU 84 HD21 LEU 84 -16.275 -2.185 11.390 548 HD22 LEU 84 HD22 LEU 84 -14.994 -3.130 12.152 549 HD23 LEU 84 HD23 LEU 84 -15.132 -3.089 10.398 Start of MODEL 8 1 H1 GLY 1 HT1 GLY 1 -20.242 -0.458 0.649 2 H2 GLY 1 HT2 GLY 1 -20.589 1.042 -0.044 3 H3 GLY 1 HT3 GLY 1 -19.386 0.916 1.135 4 HA2 GLY 1 HA1 GLY 1 -18.055 -0.458 -0.333 5 HA3 GLY 1 HA2 GLY 1 -19.303 -0.311 -1.561 6 H SER 2 HN SER 2 -16.502 0.486 -1.671 7 HA SER 2 HA SER 2 -16.889 3.340 -2.252 8 HB2 SER 2 HB2 SER 2 -15.608 3.069 -0.134 9 HB3 SER 2 HB1 SER 2 -14.407 2.120 -1.006 10 HG SER 2 HG SER 2 -14.364 4.677 -0.683 11 H TRP 3 HN TRP 3 -15.389 4.161 -3.865 12 HA TRP 3 HA TRP 3 -14.501 2.071 -5.734 13 HB2 TRP 3 HB2 TRP 3 -15.235 4.958 -6.271 14 HB3 TRP 3 HB1 TRP 3 -14.642 3.831 -7.482 15 HD1 TRP 3 HD1 TRP 3 -17.760 4.669 -5.440 16 HE1 TRP 3 HE1 TRP 3 -19.770 3.422 -6.456 17 HE3 TRP 3 HE3 TRP 3 -15.277 1.749 -8.810 18 HZ2 TRP 3 HZ2 TRP 3 -20.239 1.457 -8.429 19 HZ3 TRP 3 HZ3 TRP 3 -16.576 0.210 -10.224 20 HH2 TRP 3 HH2 TRP 3 -19.006 0.068 -10.036 21 H GLY 4 HN GLY 4 -13.077 3.127 -3.380 22 HA2 GLY 4 HA2 GLY 4 -10.716 3.333 -3.143 23 HA3 GLY 4 HA1 GLY 4 -10.649 4.058 -4.744 24 H GLN 5 HN GLN 5 -13.162 5.144 -2.728 25 HA GLN 5 HA GLN 5 -12.148 7.824 -2.780 26 HB2 GLN 5 HB2 GLN 5 -14.624 6.581 -1.594 27 HB3 GLN 5 HB1 GLN 5 -14.277 8.300 -1.511 28 HG2 GLN 5 HG2 GLN 5 -14.396 8.512 -3.882 29 HG3 GLN 5 HG1 GLN 5 -14.488 6.763 -4.084 30 HE21 GLN 5 HE21 GLN 5 -16.428 6.988 -5.233 31 HE22 GLN 5 HE22 GLN 5 -17.921 7.326 -4.426 32 H CYS 6 HN CYS 6 -10.981 8.800 -1.283 33 HA CYS 6 HA CYS 6 -11.209 8.264 1.513 34 HB2 CYS 6 HB2 CYS 6 -9.878 6.330 0.972 35 HB3 CYS 6 HB1 CYS 6 -8.769 7.299 0.009 36 H SER 7 HN SER 7 -10.278 9.893 2.726 37 HA SER 7 HA SER 7 -9.804 12.332 1.336 38 HB2 SER 7 HB2 SER 7 -9.504 11.706 4.280 39 HB3 SER 7 HB1 SER 7 -9.596 13.316 3.567 40 HG SER 7 HG SER 7 -11.671 11.709 2.803 41 H THR 8 HN THR 8 -7.747 9.812 2.358 42 HA THR 8 HA THR 8 -5.386 11.514 2.398 43 HB THR 8 HB THR 8 -5.502 8.498 2.577 44 HG1 THR 8 HG1 THR 8 -5.538 10.459 4.656 45 HG21 THR 8 HG21 THR 8 -3.291 9.419 2.052 46 HG22 THR 8 HG22 THR 8 -3.325 8.740 3.680 47 HG23 THR 8 HG23 THR 8 -3.400 10.488 3.451 48 H GLY 9 HN GLY 9 -7.121 9.376 0.299 49 HA2 GLY 9 HA2 GLY 9 -6.207 10.234 -2.089 50 HA3 GLY 9 HA1 GLY 9 -4.972 9.082 -1.604 51 H SER 10 HN SER 10 -5.249 7.100 -2.306 52 HA SER 10 HA SER 10 -7.934 6.260 -3.166 53 HB2 SER 10 HB2 SER 10 -6.160 6.304 -4.907 54 HB3 SER 10 HB1 SER 10 -5.222 5.156 -3.957 55 HG SER 10 HG SER 10 -7.475 4.759 -5.525 56 H ILE 11 HN ILE 11 -8.660 4.130 -2.611 57 HA ILE 11 HA ILE 11 -7.318 3.062 -0.232 58 HB ILE 11 HB ILE 11 -10.168 2.671 -1.138 59 HG12 ILE 11 HG12 ILE 11 -8.868 4.194 1.109 60 HG13 ILE 11 HG11 ILE 11 -9.835 4.829 -0.211 61 HG21 ILE 11 HG21 ILE 11 -9.297 0.638 -0.081 62 HG22 ILE 11 HG22 ILE 11 -10.496 1.432 0.940 63 HG23 ILE 11 HG23 ILE 11 -8.780 1.587 1.313 64 HD11 ILE 11 HD11 ILE 11 -11.078 4.812 1.873 65 HD12 ILE 11 HD12 ILE 11 -10.827 3.072 2.008 66 HD13 ILE 11 HD13 ILE 11 -11.806 3.721 0.692 67 H GLN 12 HN GLN 12 -6.538 1.123 -0.161 68 HA GLN 12 HA GLN 12 -7.205 -0.812 -2.229 69 HB2 GLN 12 HB2 GLN 12 -4.602 -1.347 -2.217 70 HB3 GLN 12 HB1 GLN 12 -5.322 -0.234 -3.359 71 HG2 GLN 12 HG2 GLN 12 -4.206 0.764 -0.780 72 HG3 GLN 12 HG1 GLN 12 -3.138 0.392 -2.126 73 HE21 GLN 12 HE21 GLN 12 -4.961 1.244 -4.192 74 HE22 GLN 12 HE22 GLN 12 -5.070 2.961 -4.101 75 H CYS 13 HN CYS 13 -6.408 -2.968 -1.749 76 HA CYS 13 HA CYS 13 -6.245 -3.414 1.153 77 HB2 CYS 13 HB2 CYS 13 -8.273 -4.367 0.292 78 HB3 CYS 13 HB1 CYS 13 -7.429 -5.121 -1.051 79 H CYS 14 HN CYS 14 -4.188 -3.645 1.636 80 HA CYS 14 HA CYS 14 -2.308 -4.746 -0.272 81 HB2 CYS 14 HB2 CYS 14 -1.994 -3.522 2.465 82 HB3 CYS 14 HB1 CYS 14 -0.648 -4.214 1.570 83 H GLN 15 HN GLN 15 -1.319 -6.663 -0.143 84 HA GLN 15 HA GLN 15 -2.318 -8.627 1.662 85 HB2 GLN 15 HB2 GLN 15 -1.462 -10.092 0.185 86 HB3 GLN 15 HB1 GLN 15 -1.150 -8.697 -0.822 87 HG2 GLN 15 HG2 GLN 15 0.833 -9.911 -0.846 88 HG3 GLN 15 HG1 GLN 15 1.136 -8.602 0.291 89 HE21 GLN 15 HE21 GLN 15 -0.847 -11.378 1.055 90 HE22 GLN 15 HE22 GLN 15 0.233 -12.083 2.203 91 H ASN 16 HN ASN 16 0.624 -6.696 1.392 92 HA ASN 16 HA ASN 16 1.037 -7.222 4.230 93 HB2 ASN 16 HB2 ASN 16 3.240 -7.660 3.964 94 HB3 ASN 16 HB1 ASN 16 2.736 -8.163 2.376 95 HD21 ASN 16 HD21 ASN 16 4.771 -7.956 1.644 96 HD22 ASN 16 HD22 ASN 16 5.482 -6.421 1.288 97 H VAL 17 HN VAL 17 1.710 -5.436 5.463 98 HA VAL 17 HA VAL 17 1.861 -2.864 4.042 99 HB VAL 17 HB VAL 17 0.435 -3.299 6.681 100 HG11 VAL 17 HG11 VAL 17 0.846 -0.783 5.067 101 HG12 VAL 17 HG12 VAL 17 1.624 -1.167 6.601 102 HG13 VAL 17 HG13 VAL 17 -0.120 -0.918 6.536 103 HG21 VAL 17 HG21 VAL 17 -0.645 -2.543 3.967 104 HG22 VAL 17 HG22 VAL 17 -1.577 -2.588 5.463 105 HG23 VAL 17 HG23 VAL 17 -0.899 -4.076 4.802 106 H VAL 18 HN VAL 18 3.959 -2.423 4.207 107 HA VAL 18 HA VAL 18 5.238 -2.703 6.842 108 HB VAL 18 HB VAL 18 7.337 -3.402 5.592 109 HG11 VAL 18 HG11 VAL 18 6.651 -5.758 5.452 110 HG12 VAL 18 HG12 VAL 18 4.961 -5.261 5.558 111 HG13 VAL 18 HG13 VAL 18 6.050 -4.980 6.916 112 HG21 VAL 18 HG21 VAL 18 7.103 -4.380 3.402 113 HG22 VAL 18 HG22 VAL 18 6.514 -2.717 3.344 114 HG23 VAL 18 HG23 VAL 18 5.369 -4.059 3.402 115 HA PRO 19 HA PRO 19 6.813 1.418 6.145 116 HB2 PRO 19 HB2 PRO 19 9.139 0.450 7.688 117 HB3 PRO 19 HB1 PRO 19 8.098 1.846 7.984 118 HG2 PRO 19 HG2 PRO 19 7.921 -0.351 9.496 119 HG3 PRO 19 HG1 PRO 19 6.483 0.587 9.055 120 HD2 PRO 19 HD2 PRO 19 7.467 -2.007 7.944 121 HD3 PRO 19 HD1 PRO 19 5.806 -1.468 8.259 122 H GLY 20 HN GLY 20 8.108 2.323 4.635 123 HA2 GLY 20 HA2 GLY 20 9.432 0.680 2.759 124 HA3 GLY 20 HA1 GLY 20 9.533 2.431 2.837 125 H ASP 21 HN ASP 21 10.531 2.139 5.687 126 HA ASP 21 HA ASP 21 13.315 1.496 5.016 127 HB2 ASP 21 HB2 ASP 21 12.683 3.780 5.946 128 HB3 ASP 21 HB1 ASP 21 12.332 2.960 7.457 129 H SER 22 HN SER 22 10.905 -0.224 5.911 130 HA SER 22 HA SER 22 11.925 -1.455 8.321 131 HB2 SER 22 HB2 SER 22 9.533 -1.424 8.069 132 HB3 SER 22 HB1 SER 22 9.627 -2.153 6.476 133 HG SER 22 HG SER 22 9.819 -3.306 8.997 134 H ASP 23 HN ASP 23 12.619 -3.669 8.400 135 HA ASP 23 HA ASP 23 14.555 -4.383 6.544 136 HB2 ASP 23 HB2 ASP 23 12.961 -6.052 8.492 137 HB3 ASP 23 HB1 ASP 23 14.229 -6.746 7.494 138 H LEU 24 HN LEU 24 11.163 -5.333 6.721 139 HA LEU 24 HA LEU 24 11.275 -7.013 4.414 140 HB2 LEU 24 HB2 LEU 24 9.175 -5.979 6.195 141 HB3 LEU 24 HB1 LEU 24 8.662 -6.310 4.553 142 HG LEU 24 HG LEU 24 10.010 -8.316 6.362 143 HD11 LEU 24 HD11 LEU 24 7.787 -7.716 7.183 144 HD12 LEU 24 HD12 LEU 24 7.808 -9.354 6.531 145 HD13 LEU 24 HD13 LEU 24 7.107 -8.038 5.588 146 HD21 LEU 24 HD21 LEU 24 10.441 -8.795 4.044 147 HD22 LEU 24 HD22 LEU 24 8.746 -8.543 3.633 148 HD23 LEU 24 HD23 LEU 24 9.215 -9.919 4.631 149 H GLY 25 HN GLY 25 9.726 -3.843 4.911 150 HA2 GLY 25 HA2 GLY 25 8.950 -3.389 2.298 151 HA3 GLY 25 HA1 GLY 25 9.296 -2.121 3.461 152 H THR 26 HN THR 26 12.060 -2.666 3.790 153 HA THR 26 HA THR 26 13.045 -1.117 1.631 154 HB THR 26 HB THR 26 14.530 -2.544 3.845 155 HG1 THR 26 HG1 THR 26 13.165 -0.132 3.636 156 HG21 THR 26 HG21 THR 26 16.382 -1.040 3.362 157 HG22 THR 26 HG22 THR 26 15.486 -0.339 2.015 158 HG23 THR 26 HG23 THR 26 16.008 -2.024 1.947 159 H LEU 27 HN LEU 27 13.476 -4.492 2.594 160 HA LEU 27 HA LEU 27 15.226 -5.172 0.484 161 HB2 LEU 27 HB2 LEU 27 14.671 -6.436 2.675 162 HB3 LEU 27 HB1 LEU 27 13.307 -7.086 1.791 163 HG LEU 27 HG LEU 27 15.319 -8.580 1.910 164 HD11 LEU 27 HD11 LEU 27 13.604 -8.886 0.199 165 HD12 LEU 27 HD12 LEU 27 15.208 -9.299 -0.405 166 HD13 LEU 27 HD13 LEU 27 14.463 -7.768 -0.860 167 HD21 LEU 27 HD21 LEU 27 17.218 -8.106 0.495 168 HD22 LEU 27 HD22 LEU 27 17.007 -6.808 1.670 169 HD23 LEU 27 HD23 LEU 27 16.499 -6.575 -0.002 170 H LEU 28 HN LEU 28 11.737 -5.078 0.822 171 HA LEU 28 HA LEU 28 11.162 -6.537 -1.562 172 HB2 LEU 28 HB2 LEU 28 9.393 -4.554 -0.122 173 HB3 LEU 28 HB1 LEU 28 8.879 -5.742 -1.298 174 HG LEU 28 HG LEU 28 9.722 -6.160 1.547 175 HD11 LEU 28 HD11 LEU 28 7.628 -7.421 1.629 176 HD12 LEU 28 HD12 LEU 28 7.344 -7.056 -0.073 177 HD13 LEU 28 HD13 LEU 28 7.377 -5.754 1.114 178 HD21 LEU 28 HD21 LEU 28 9.605 -8.272 -0.597 179 HD22 LEU 28 HD22 LEU 28 9.713 -8.579 1.136 180 HD23 LEU 28 HD23 LEU 28 11.032 -7.756 0.305 181 H LEU 29 HN LEU 29 11.366 -3.067 -0.795 182 HA LEU 29 HA LEU 29 10.590 -2.309 -3.434 183 HB2 LEU 29 HB2 LEU 29 11.164 -0.055 -2.791 184 HB3 LEU 29 HB1 LEU 29 10.211 -0.819 -1.551 185 HG LEU 29 HG LEU 29 12.473 -1.216 -0.360 186 HD11 LEU 29 HD11 LEU 29 13.945 -0.618 -2.202 187 HD12 LEU 29 HD12 LEU 29 14.163 0.496 -0.852 188 HD13 LEU 29 HD13 LEU 29 13.233 0.994 -2.266 189 HD21 LEU 29 HD21 LEU 29 11.240 1.505 -0.700 190 HD22 LEU 29 HD22 LEU 29 12.349 1.061 0.602 191 HD23 LEU 29 HD23 LEU 29 10.778 0.268 0.472 192 H ASP 30 HN ASP 30 13.600 -3.071 -1.903 193 HA ASP 30 HA ASP 30 15.350 -2.137 -3.921 194 HB2 ASP 30 HB2 ASP 30 16.037 -2.917 -1.639 195 HB3 ASP 30 HB1 ASP 30 15.679 -4.564 -2.136 196 H GLU 31 HN GLU 31 13.387 -4.952 -3.493 197 HA GLU 31 HA GLU 31 14.404 -6.416 -5.733 198 HB2 GLU 31 HB2 GLU 31 12.258 -6.721 -3.704 199 HB3 GLU 31 HB1 GLU 31 12.187 -7.710 -5.138 200 HG2 GLU 31 HG2 GLU 31 14.472 -7.590 -3.192 201 HG3 GLU 31 HG1 GLU 31 13.262 -8.868 -3.286 202 H LEU 32 HN LEU 32 12.329 -3.817 -5.366 203 HA LEU 32 HA LEU 32 10.783 -4.507 -7.769 204 HB2 LEU 32 HB2 LEU 32 10.090 -2.869 -5.351 205 HB3 LEU 32 HB1 LEU 32 9.134 -2.819 -6.817 206 HG LEU 32 HG LEU 32 9.661 -5.328 -5.225 207 HD11 LEU 32 HD11 LEU 32 8.372 -3.763 -3.902 208 HD12 LEU 32 HD12 LEU 32 7.353 -5.095 -4.448 209 HD13 LEU 32 HD13 LEU 32 7.251 -3.525 -5.243 210 HD21 LEU 32 HD21 LEU 32 7.734 -4.728 -7.465 211 HD22 LEU 32 HD22 LEU 32 7.807 -6.234 -6.551 212 HD23 LEU 32 HD23 LEU 32 9.166 -5.750 -7.565 213 H GLY 33 HN GLY 33 13.055 -2.340 -6.464 214 HA2 GLY 33 HA2 GLY 33 14.286 -0.748 -7.602 215 HA3 GLY 33 HA1 GLY 33 13.226 -0.957 -8.985 216 H ILE 34 HN ILE 34 12.363 -0.070 -5.666 217 HA ILE 34 HA ILE 34 10.923 2.239 -6.760 218 HB ILE 34 HB ILE 34 10.783 1.256 -3.915 219 HG12 ILE 34 HG12 ILE 34 8.994 0.401 -6.207 220 HG13 ILE 34 HG11 ILE 34 10.268 -0.603 -5.520 221 HG21 ILE 34 HG21 ILE 34 8.602 2.344 -3.940 222 HG22 ILE 34 HG22 ILE 34 8.842 2.802 -5.626 223 HG23 ILE 34 HG23 ILE 34 9.882 3.478 -4.372 224 HD11 ILE 34 HD11 ILE 34 8.110 -1.238 -4.647 225 HD12 ILE 34 HD12 ILE 34 7.828 0.409 -4.081 226 HD13 ILE 34 HD13 ILE 34 9.112 -0.562 -3.362 227 H VAL 35 HN VAL 35 11.435 4.308 -6.261 228 HA VAL 35 HA VAL 35 13.510 4.728 -4.224 229 HB VAL 35 HB VAL 35 14.469 5.279 -6.352 230 HG11 VAL 35 HG11 VAL 35 12.453 5.589 -7.665 231 HG12 VAL 35 HG12 VAL 35 13.527 6.974 -7.846 232 HG13 VAL 35 HG13 VAL 35 12.105 7.090 -6.810 233 HG21 VAL 35 HG21 VAL 35 15.052 6.745 -4.504 234 HG22 VAL 35 HG22 VAL 35 13.687 7.795 -4.885 235 HG23 VAL 35 HG23 VAL 35 15.027 7.642 -6.022 236 H LEU 36 HN LEU 36 12.419 5.314 -2.466 237 HA LEU 36 HA LEU 36 10.053 6.987 -2.655 238 HB2 LEU 36 HB2 LEU 36 11.483 5.856 -0.254 239 HB3 LEU 36 HB1 LEU 36 9.909 6.621 -0.241 240 HG LEU 36 HG LEU 36 10.431 4.158 -1.874 241 HD11 LEU 36 HD11 LEU 36 9.574 4.309 1.009 242 HD12 LEU 36 HD12 LEU 36 11.092 3.650 0.394 243 HD13 LEU 36 HD13 LEU 36 9.565 2.856 0.008 244 HD21 LEU 36 HD21 LEU 36 8.410 5.419 -2.362 245 HD22 LEU 36 HD22 LEU 36 7.954 5.367 -0.659 246 HD23 LEU 36 HD23 LEU 36 8.015 3.878 -1.602 247 H GLU 37 HN GLU 37 9.904 9.082 -2.057 248 HA GLU 37 HA GLU 37 12.287 10.626 -1.680 249 HB2 GLU 37 HB2 GLU 37 9.365 11.370 -1.463 250 HB3 GLU 37 HB1 GLU 37 10.689 12.521 -1.385 251 HG2 GLU 37 HG2 GLU 37 11.328 12.012 -3.646 252 HG3 GLU 37 HG1 GLU 37 10.117 10.734 -3.735 253 H ASP 38 HN ASP 38 9.863 9.186 0.343 254 HA ASP 38 HA ASP 38 11.457 9.872 2.689 255 HB2 ASP 38 HB2 ASP 38 9.441 11.387 2.557 256 HB3 ASP 38 HB1 ASP 38 8.432 9.952 2.653 257 HA PRO 39 HA PRO 39 10.872 5.403 2.489 258 HB2 PRO 39 HB2 PRO 39 12.885 4.758 4.176 259 HB3 PRO 39 HB1 PRO 39 13.163 5.225 2.494 260 HG2 PRO 39 HG2 PRO 39 13.412 6.869 4.984 261 HG3 PRO 39 HG1 PRO 39 14.491 6.795 3.578 262 HD2 PRO 39 HD2 PRO 39 12.674 8.780 3.942 263 HD3 PRO 39 HD1 PRO 39 13.177 8.214 2.337 264 H THR 40 HN THR 40 10.016 7.528 4.846 265 HA THR 40 HA THR 40 9.680 5.500 6.938 266 HB THR 40 HB THR 40 8.932 7.303 8.406 267 HG1 THR 40 HG1 THR 40 9.456 9.102 6.249 268 HG21 THR 40 HG21 THR 40 11.316 6.877 8.271 269 HG22 THR 40 HG22 THR 40 11.021 8.604 8.480 270 HG23 THR 40 HG23 THR 40 11.454 7.969 6.893 271 H VAL 41 HN VAL 41 8.059 6.309 4.269 272 HA VAL 41 HA VAL 41 5.385 6.326 5.361 273 HB VAL 41 HB VAL 41 4.597 6.369 3.073 274 HG11 VAL 41 HG11 VAL 41 5.629 8.452 2.315 275 HG12 VAL 41 HG12 VAL 41 6.959 8.206 3.448 276 HG13 VAL 41 HG13 VAL 41 5.324 8.474 4.052 277 HG21 VAL 41 HG21 VAL 41 6.204 4.802 2.094 278 HG22 VAL 41 HG22 VAL 41 7.475 6.017 2.240 279 HG23 VAL 41 HG23 VAL 41 6.106 6.298 1.162 280 H LEU 42 HN LEU 42 3.790 4.718 4.737 281 HA LEU 42 HA LEU 42 4.871 2.034 5.018 282 HB2 LEU 42 HB2 LEU 42 2.059 3.122 5.100 283 HB3 LEU 42 HB1 LEU 42 2.431 1.417 5.236 284 HG LEU 42 HG LEU 42 3.394 3.538 7.159 285 HD11 LEU 42 HD11 LEU 42 0.974 3.279 7.287 286 HD12 LEU 42 HD12 LEU 42 1.755 2.592 8.712 287 HD13 LEU 42 HD13 LEU 42 1.160 1.531 7.435 288 HD21 LEU 42 HD21 LEU 42 3.980 1.608 8.564 289 HD22 LEU 42 HD22 LEU 42 4.885 1.630 7.052 290 HD23 LEU 42 HD23 LEU 42 3.523 0.528 7.249 291 H ILE 43 HN ILE 43 5.216 0.756 3.356 292 HA ILE 43 HA ILE 43 3.729 1.271 0.883 293 HB ILE 43 HB ILE 43 5.482 -0.242 -0.184 294 HG12 ILE 43 HG12 ILE 43 7.032 0.480 2.308 295 HG13 ILE 43 HG11 ILE 43 6.401 -1.123 1.954 296 HG21 ILE 43 HG21 ILE 43 6.269 2.458 0.901 297 HG22 ILE 43 HG22 ILE 43 5.393 2.132 -0.594 298 HG23 ILE 43 HG23 ILE 43 7.075 1.626 -0.429 299 HD11 ILE 43 HD11 ILE 43 8.445 0.372 0.330 300 HD12 ILE 43 HD12 ILE 43 7.806 -1.227 -0.042 301 HD13 ILE 43 HD13 ILE 43 8.758 -0.979 1.420 302 H GLY 44 HN GLY 44 2.458 -0.246 0.022 303 HA2 GLY 44 HA2 GLY 44 2.090 -2.664 1.661 304 HA3 GLY 44 HA1 GLY 44 0.806 -1.849 0.799 305 H ASP 45 HN ASP 45 3.086 -4.330 0.702 306 HA ASP 45 HA ASP 45 3.059 -4.618 -2.181 307 HB2 ASP 45 HB2 ASP 45 5.022 -5.411 -0.960 308 HB3 ASP 45 HB1 ASP 45 4.018 -6.513 -0.006 309 H GLY 46 HN GLY 46 1.755 -5.961 -3.354 310 HA2 GLY 46 HA2 GLY 46 0.115 -7.552 -3.762 311 HA3 GLY 46 HA1 GLY 46 0.113 -7.922 -2.057 312 H CYS 47 HN CYS 47 -0.388 -4.776 -3.555 313 HA CYS 47 HA CYS 47 -2.878 -4.605 -2.009 314 HB2 CYS 47 HB2 CYS 47 -0.694 -2.968 -1.946 315 HB3 CYS 47 HB1 CYS 47 -1.743 -2.131 -3.090 316 H ASP 48 HN ASP 48 -4.590 -4.946 -3.171 317 HA ASP 48 HA ASP 48 -4.758 -3.813 -5.877 318 HB2 ASP 48 HB2 ASP 48 -6.589 -5.793 -4.513 319 HB3 ASP 48 HB1 ASP 48 -6.768 -5.210 -6.159 320 HA PRO 49 HA PRO 49 -7.109 -0.412 -4.284 321 HB2 PRO 49 HB2 PRO 49 -8.447 -0.388 -6.911 322 HB3 PRO 49 HB1 PRO 49 -7.485 0.863 -6.129 323 HG2 PRO 49 HG2 PRO 49 -6.577 -0.547 -8.233 324 HG3 PRO 49 HG1 PRO 49 -5.511 0.062 -6.956 325 HD2 PRO 49 HD2 PRO 49 -6.503 -2.704 -7.435 326 HD3 PRO 49 HD1 PRO 49 -4.953 -2.149 -6.781 327 H ILE 50 HN ILE 50 -8.895 -0.496 -3.047 328 HA ILE 50 HA ILE 50 -10.836 -2.597 -3.524 329 HB ILE 50 HB ILE 50 -10.990 -0.495 -1.361 330 HG12 ILE 50 HG12 ILE 50 -9.613 -3.190 -1.278 331 HG13 ILE 50 HG11 ILE 50 -8.814 -1.624 -1.219 332 HG21 ILE 50 HG21 ILE 50 -13.013 -1.837 -1.825 333 HG22 ILE 50 HG22 ILE 50 -12.350 -2.146 -0.220 334 HG23 ILE 50 HG23 ILE 50 -12.079 -3.304 -1.522 335 HD11 ILE 50 HD11 ILE 50 -9.974 -1.146 0.897 336 HD12 ILE 50 HD12 ILE 50 -8.937 -2.569 0.991 337 HD13 ILE 50 HD13 ILE 50 -10.684 -2.757 0.842 338 H THR 51 HN THR 51 -11.803 -1.977 -5.390 339 HA THR 51 HA THR 51 -13.537 0.380 -5.194 340 HB THR 51 HB THR 51 -11.683 0.941 -6.676 341 HG1 THR 51 HG1 THR 51 -14.227 0.544 -7.846 342 HG21 THR 51 HG21 THR 51 -12.515 -1.479 -8.272 343 HG22 THR 51 HG22 THR 51 -11.017 -1.293 -7.362 344 HG23 THR 51 HG23 THR 51 -11.322 -0.284 -8.777 345 H VAL 52 HN VAL 52 -13.572 -2.736 -5.072 346 HA VAL 52 HA VAL 52 -15.795 -3.202 -6.908 347 HB VAL 52 HB VAL 52 -13.925 -4.840 -6.896 348 HG11 VAL 52 HG11 VAL 52 -13.310 -4.696 -4.539 349 HG12 VAL 52 HG12 VAL 52 -13.641 -6.363 -5.010 350 HG13 VAL 52 HG13 VAL 52 -14.837 -5.454 -4.087 351 HG21 VAL 52 HG21 VAL 52 -15.312 -6.853 -6.758 352 HG22 VAL 52 HG22 VAL 52 -16.135 -5.541 -7.601 353 HG23 VAL 52 HG23 VAL 52 -16.564 -5.925 -5.935 354 H ALA 53 HN ALA 53 -17.825 -3.838 -6.151 355 HA ALA 53 HA ALA 53 -18.408 -3.047 -3.419 356 HB1 ALA 53 HB1 ALA 53 -20.268 -3.962 -5.609 357 HB2 ALA 53 HB2 ALA 53 -19.854 -2.288 -5.245 358 HB3 ALA 53 HB3 ALA 53 -20.745 -3.252 -4.067 359 H GLY 54 HN GLY 54 -16.828 -5.262 -3.404 360 HA2 GLY 54 HA2 GLY 54 -18.441 -7.664 -3.286 361 HA3 GLY 54 HA1 GLY 54 -16.715 -7.547 -2.980 362 H SER 55 HN SER 55 -19.876 -6.818 -1.618 363 HA SER 55 HA SER 55 -20.683 -6.685 0.487 364 HB2 SER 55 HB2 SER 55 -19.963 -8.463 2.038 365 HB3 SER 55 HB1 SER 55 -20.244 -9.083 0.416 366 HG SER 55 HG SER 55 -17.729 -8.429 0.438 367 H SER 56 HN SER 56 -19.552 -6.953 3.028 368 HA SER 56 HA SER 56 -18.021 -4.508 3.232 369 HB2 SER 56 HB2 SER 56 -18.846 -6.440 5.408 370 HB3 SER 56 HB1 SER 56 -18.271 -4.789 5.633 371 HG SER 56 HG SER 56 -20.731 -5.706 4.620 372 H ASP 57 HN ASP 57 -17.446 -7.816 2.923 373 HA ASP 57 HA ASP 57 -14.763 -7.713 4.068 374 HB2 ASP 57 HB2 ASP 57 -16.308 -9.680 4.459 375 HB3 ASP 57 HB1 ASP 57 -16.171 -10.047 2.744 376 H ALA 58 HN ALA 58 -14.551 -6.007 2.275 377 HA ALA 58 HA ALA 58 -14.052 -7.152 -0.363 378 HB1 ALA 58 HB1 ALA 58 -13.872 -4.857 -1.133 379 HB2 ALA 58 HB2 ALA 58 -13.963 -4.273 0.529 380 HB3 ALA 58 HB3 ALA 58 -15.351 -5.082 -0.200 381 H CYS 59 HN CYS 59 -12.274 -7.431 2.133 382 HA CYS 59 HA CYS 59 -9.786 -6.990 0.681 383 HB2 CYS 59 HB2 CYS 59 -10.047 -4.984 2.085 384 HB3 CYS 59 HB1 CYS 59 -10.223 -6.002 3.508 385 H SER 60 HN SER 60 -8.177 -8.457 1.195 386 HA SER 60 HA SER 60 -9.145 -10.775 2.697 387 HB2 SER 60 HB2 SER 60 -7.249 -11.928 1.403 388 HB3 SER 60 HB1 SER 60 -8.653 -11.392 0.481 389 HG SER 60 HG SER 60 -7.186 -10.428 -0.684 390 H ALA 61 HN ALA 61 -6.606 -8.386 2.701 391 HA ALA 61 HA ALA 61 -5.335 -9.869 4.903 392 HB1 ALA 61 HB1 ALA 61 -3.158 -9.018 4.212 393 HB2 ALA 61 HB2 ALA 61 -3.907 -8.186 2.849 394 HB3 ALA 61 HB3 ALA 61 -3.915 -9.947 2.920 395 H THR 62 HN THR 62 -4.848 -6.563 3.612 396 HA THR 62 HA THR 62 -5.826 -5.470 6.136 397 HB THR 62 HB THR 62 -3.030 -4.893 5.132 398 HG1 THR 62 HG1 THR 62 -4.048 -6.817 6.820 399 HG21 THR 62 HG21 THR 62 -4.429 -4.048 7.677 400 HG22 THR 62 HG22 THR 62 -4.082 -3.001 6.301 401 HG23 THR 62 HG23 THR 62 -2.757 -3.687 7.242 402 H ALA 63 HN ALA 63 -6.904 -3.625 5.825 403 HA ALA 63 HA ALA 63 -6.979 -2.489 3.158 404 HB1 ALA 63 HB1 ALA 63 -8.591 -1.770 5.605 405 HB2 ALA 63 HB2 ALA 63 -9.073 -2.933 4.370 406 HB3 ALA 63 HB3 ALA 63 -8.896 -1.227 3.954 407 H VAL 64 HN VAL 64 -6.296 -0.490 2.591 408 HA VAL 64 HA VAL 64 -5.202 1.299 4.621 409 HB VAL 64 HB VAL 64 -3.128 1.548 3.116 410 HG11 VAL 64 HG11 VAL 64 -2.960 0.670 5.359 411 HG12 VAL 64 HG12 VAL 64 -1.958 -0.304 4.281 412 HG13 VAL 64 HG13 VAL 64 -3.524 -0.911 4.818 413 HG21 VAL 64 HG21 VAL 64 -3.949 0.230 1.251 414 HG22 VAL 64 HG22 VAL 64 -4.061 -1.195 2.288 415 HG23 VAL 64 HG23 VAL 64 -2.484 -0.495 1.917 416 H CYS 65 HN CYS 65 -4.381 3.329 3.579 417 HA CYS 65 HA CYS 65 -5.778 3.974 1.078 418 HB2 CYS 65 HB2 CYS 65 -7.121 4.891 2.910 419 HB3 CYS 65 HB1 CYS 65 -5.701 5.677 3.584 420 H CYS 66 HN CYS 66 -4.181 4.378 -0.331 421 HA CYS 66 HA CYS 66 -1.684 5.542 0.652 422 HB2 CYS 66 HB2 CYS 66 -2.444 3.868 -1.658 423 HB3 CYS 66 HB1 CYS 66 -1.156 5.030 -1.936 424 H SER 67 HN SER 67 -0.906 7.434 0.101 425 HA SER 67 HA SER 67 -2.637 9.333 -1.194 426 HB2 SER 67 HB2 SER 67 -1.433 10.038 0.782 427 HB3 SER 67 HB1 SER 67 0.101 9.587 0.049 428 HG SER 67 HG SER 67 0.168 11.463 -0.857 429 H ASP 68 HN ASP 68 -0.080 7.283 -2.100 430 HA ASP 68 HA ASP 68 0.345 8.816 -4.574 431 HB2 ASP 68 HB2 ASP 68 2.143 6.840 -3.172 432 HB3 ASP 68 HB1 ASP 68 2.439 7.421 -4.808 433 H ASN 69 HN ASN 69 0.302 7.790 -6.546 434 HA ASN 69 HA ASN 69 -1.059 5.176 -6.556 435 HB2 ASN 69 HB2 ASN 69 -1.286 7.444 -8.548 436 HB3 ASN 69 HB1 ASN 69 -2.095 5.887 -8.684 437 HD21 ASN 69 HD21 ASN 69 -3.837 5.429 -7.364 438 HD22 ASN 69 HD22 ASN 69 -4.649 6.653 -6.448 439 H ASN 70 HN ASN 70 1.842 6.473 -7.011 440 HA ASN 70 HA ASN 70 2.603 5.349 -9.535 441 HB2 ASN 70 HB2 ASN 70 4.200 6.454 -7.220 442 HB3 ASN 70 HB1 ASN 70 4.952 5.814 -8.677 443 HD21 ASN 70 HD21 ASN 70 4.957 8.523 -7.549 444 HD22 ASN 70 HD22 ASN 70 4.348 9.550 -8.800 445 H VAL 71 HN VAL 71 1.663 3.226 -9.091 446 HA VAL 71 HA VAL 71 3.053 1.566 -7.169 447 HB VAL 71 HB VAL 71 1.420 -0.144 -7.779 448 HG11 VAL 71 HG11 VAL 71 -0.587 0.995 -6.970 449 HG12 VAL 71 HG12 VAL 71 0.176 2.553 -7.283 450 HG13 VAL 71 HG13 VAL 71 0.844 1.473 -6.058 451 HG21 VAL 71 HG21 VAL 71 0.375 1.883 -9.749 452 HG22 VAL 71 HG22 VAL 71 -0.411 0.360 -9.335 453 HG23 VAL 71 HG23 VAL 71 1.155 0.352 -10.145 454 H SER 72 HN SER 72 4.264 -0.237 -7.692 455 HA SER 72 HA SER 72 5.450 -0.218 -10.329 456 HB2 SER 72 HB2 SER 72 6.144 -1.835 -7.904 457 HB3 SER 72 HB1 SER 72 7.091 -1.764 -9.380 458 HG SER 72 HG SER 72 7.919 0.042 -8.723 459 H GLY 73 HN GLY 73 2.715 -1.404 -9.311 460 HA2 GLY 73 HA2 GLY 73 1.673 -2.757 -11.145 461 HA3 GLY 73 HA1 GLY 73 2.963 -3.905 -10.851 462 H VAL 74 HN VAL 74 2.843 -3.683 -7.931 463 HA VAL 74 HA VAL 74 0.124 -4.620 -7.401 464 HB VAL 74 HB VAL 74 0.820 -6.601 -6.275 465 HG11 VAL 74 HG11 VAL 74 0.461 -6.916 -8.611 466 HG12 VAL 74 HG12 VAL 74 1.862 -7.881 -8.147 467 HG13 VAL 74 HG13 VAL 74 2.085 -6.345 -8.990 468 HG21 VAL 74 HG21 VAL 74 3.139 -7.341 -6.169 469 HG22 VAL 74 HG22 VAL 74 2.911 -5.805 -5.334 470 HG23 VAL 74 HG23 VAL 74 3.652 -5.838 -6.934 471 H ILE 75 HN ILE 75 2.564 -2.640 -6.484 472 HA ILE 75 HA ILE 75 2.197 -2.989 -3.613 473 HB ILE 75 HB ILE 75 3.903 -1.198 -3.378 474 HG12 ILE 75 HG12 ILE 75 4.401 -1.517 -6.322 475 HG13 ILE 75 HG11 ILE 75 3.326 -0.279 -5.706 476 HG21 ILE 75 HG21 ILE 75 4.640 -3.582 -5.041 477 HG22 ILE 75 HG22 ILE 75 4.572 -3.499 -3.282 478 HG23 ILE 75 HG23 ILE 75 5.784 -2.572 -4.166 479 HD11 ILE 75 HD11 ILE 75 6.232 -0.593 -5.046 480 HD12 ILE 75 HD12 ILE 75 5.162 0.634 -4.371 481 HD13 ILE 75 HD13 ILE 75 5.520 0.629 -6.098 482 H ALA 76 HN ALA 76 2.362 -0.772 -2.446 483 HA ALA 76 HA ALA 76 0.769 1.349 -3.647 484 HB1 ALA 76 HB1 ALA 76 -0.672 1.493 -1.656 485 HB2 ALA 76 HB2 ALA 76 0.087 0.029 -1.012 486 HB3 ALA 76 HB3 ALA 76 -0.870 -0.049 -2.493 487 H ILE 77 HN ILE 77 1.442 3.373 -2.897 488 HA ILE 77 HA ILE 77 3.644 3.306 -0.937 489 HB ILE 77 HB ILE 77 3.352 5.116 -3.341 490 HG12 ILE 77 HG12 ILE 77 5.372 2.951 -2.712 491 HG13 ILE 77 HG11 ILE 77 4.064 2.821 -3.883 492 HG21 ILE 77 HG21 ILE 77 5.538 6.019 -2.713 493 HG22 ILE 77 HG22 ILE 77 5.528 5.031 -1.254 494 HG23 ILE 77 HG23 ILE 77 4.335 6.313 -1.458 495 HD11 ILE 77 HD11 ILE 77 5.068 4.599 -5.208 496 HD12 ILE 77 HD12 ILE 77 6.193 3.262 -4.965 497 HD13 ILE 77 HD13 ILE 77 6.372 4.746 -4.030 498 H GLY 78 HN GLY 78 3.383 4.454 0.838 499 HA2 GLY 78 HA2 GLY 78 2.814 6.226 2.210 500 HA3 GLY 78 HA1 GLY 78 2.117 7.037 0.815 501 H CYS 79 HN CYS 79 1.459 3.983 2.506 502 HA CYS 79 HA CYS 79 -1.392 4.565 2.300 503 HB2 CYS 79 HB2 CYS 79 0.262 2.134 2.400 504 HB3 CYS 79 HB1 CYS 79 -1.270 2.038 3.247 505 H LEU 80 HN LEU 80 -2.671 4.922 3.978 506 HA LEU 80 HA LEU 80 -1.609 4.496 6.682 507 HB2 LEU 80 HB2 LEU 80 -4.033 6.049 5.778 508 HB3 LEU 80 HB1 LEU 80 -3.484 5.868 7.438 509 HG LEU 80 HG LEU 80 -1.985 7.287 5.235 510 HD11 LEU 80 HD11 LEU 80 -3.390 8.342 7.685 511 HD12 LEU 80 HD12 LEU 80 -3.929 8.529 6.015 512 HD13 LEU 80 HD13 LEU 80 -2.433 9.296 6.550 513 HD21 LEU 80 HD21 LEU 80 -1.313 6.853 8.141 514 HD22 LEU 80 HD22 LEU 80 -0.467 7.967 7.068 515 HD23 LEU 80 HD23 LEU 80 -0.431 6.235 6.743 516 HA PRO 81 HA PRO 81 -4.096 0.834 6.920 517 HB2 PRO 81 HB2 PRO 81 -3.881 1.147 9.832 518 HB3 PRO 81 HB1 PRO 81 -3.289 -0.152 8.801 519 HG2 PRO 81 HG2 PRO 81 -1.622 1.598 9.964 520 HG3 PRO 81 HG1 PRO 81 -1.297 0.919 8.361 521 HD2 PRO 81 HD2 PRO 81 -2.379 3.615 9.089 522 HD3 PRO 81 HD1 PRO 81 -1.213 3.175 7.835 523 H VAL 82 HN VAL 82 -6.229 0.814 6.665 524 HA VAL 82 HA VAL 82 -7.886 2.327 8.547 525 HB VAL 82 HB VAL 82 -9.563 2.434 6.646 526 HG11 VAL 82 HG11 VAL 82 -8.342 4.395 7.419 527 HG12 VAL 82 HG12 VAL 82 -8.539 4.439 5.666 528 HG13 VAL 82 HG13 VAL 82 -6.988 3.976 6.368 529 HG21 VAL 82 HG21 VAL 82 -8.694 2.358 4.373 530 HG22 VAL 82 HG22 VAL 82 -8.531 0.793 5.171 531 HG23 VAL 82 HG23 VAL 82 -7.125 1.843 4.988 532 H THR 83 HN THR 83 -9.926 1.393 9.008 533 HA THR 83 HA THR 83 -11.324 -0.262 9.630 534 HB THR 83 HB THR 83 -10.095 -1.638 7.273 535 HG1 THR 83 HG1 THR 83 -11.609 -0.658 6.151 536 HG21 THR 83 HG21 THR 83 -11.011 -3.329 8.777 537 HG22 THR 83 HG22 THR 83 -12.018 -3.178 7.337 538 HG23 THR 83 HG23 THR 83 -12.534 -2.446 8.857 539 H LEU 84 HN LEU 84 -11.310 -1.817 11.140 540 HA LEU 84 HA LEU 84 -10.535 -3.147 12.787 541 HB2 LEU 84 HB2 LEU 84 -8.738 -4.028 10.549 542 HB3 LEU 84 HB1 LEU 84 -8.791 -4.832 12.108 543 HG LEU 84 HG LEU 84 -11.187 -4.506 10.314 544 HD11 LEU 84 HD11 LEU 84 -9.525 -5.860 9.182 545 HD12 LEU 84 HD12 LEU 84 -10.862 -6.866 9.737 546 HD13 LEU 84 HD13 LEU 84 -9.337 -6.862 10.620 547 HD21 LEU 84 HD21 LEU 84 -10.676 -6.211 12.742 548 HD22 LEU 84 HD22 LEU 84 -12.118 -6.284 11.730 549 HD23 LEU 84 HD23 LEU 84 -11.752 -4.818 12.636 Start of MODEL 9 1 H1 GLY 1 HT1 GLY 1 -18.427 0.446 -10.981 2 H2 GLY 1 HT2 GLY 1 -18.837 -0.655 -9.766 3 H3 GLY 1 HT3 GLY 1 -17.866 -1.148 -11.060 4 HA2 GLY 1 HA1 GLY 1 -16.544 -0.808 -9.069 5 HA3 GLY 1 HA2 GLY 1 -16.096 0.307 -10.352 6 H SER 2 HN SER 2 -16.481 0.160 -7.162 7 HA SER 2 HA SER 2 -17.276 2.987 -7.013 8 HB2 SER 2 HB2 SER 2 -19.131 1.509 -6.217 9 HB3 SER 2 HB1 SER 2 -18.044 0.876 -4.981 10 HG SER 2 HG SER 2 -18.844 2.488 -3.870 11 H TRP 3 HN TRP 3 -15.324 3.879 -6.676 12 HA TRP 3 HA TRP 3 -13.375 2.578 -4.995 13 HB2 TRP 3 HB2 TRP 3 -13.238 5.212 -6.468 14 HB3 TRP 3 HB1 TRP 3 -11.893 4.440 -5.643 15 HD1 TRP 3 HD1 TRP 3 -10.605 2.545 -6.935 16 HE1 TRP 3 HE1 TRP 3 -10.782 1.592 -9.325 17 HE3 TRP 3 HE3 TRP 3 -15.004 4.694 -8.313 18 HZ2 TRP 3 HZ2 TRP 3 -12.572 1.751 -11.514 19 HZ3 TRP 3 HZ3 TRP 3 -15.892 4.259 -10.573 20 HH2 TRP 3 HH2 TRP 3 -14.698 2.814 -12.138 21 H GLY 4 HN GLY 4 -13.030 2.999 -2.926 22 HA2 GLY 4 HA2 GLY 4 -14.742 4.786 -1.508 23 HA3 GLY 4 HA1 GLY 4 -13.442 3.819 -0.822 24 H GLN 5 HN GLN 5 -14.460 6.883 -1.429 25 HA GLN 5 HA GLN 5 -11.999 8.166 -2.025 26 HB2 GLN 5 HB2 GLN 5 -14.517 9.273 -0.775 27 HB3 GLN 5 HB1 GLN 5 -13.173 10.237 -1.358 28 HG2 GLN 5 HG2 GLN 5 -14.973 8.484 -3.008 29 HG3 GLN 5 HG1 GLN 5 -14.954 10.245 -2.971 30 HE21 GLN 5 HE21 GLN 5 -13.242 11.350 -3.949 31 HE22 GLN 5 HE22 GLN 5 -12.216 10.586 -5.115 32 H CYS 6 HN CYS 6 -10.428 8.834 -0.732 33 HA CYS 6 HA CYS 6 -10.768 8.421 2.163 34 HB2 CYS 6 HB2 CYS 6 -9.337 6.703 1.287 35 HB3 CYS 6 HB1 CYS 6 -8.392 7.879 0.380 36 H SER 7 HN SER 7 -10.015 10.602 -0.309 37 HA SER 7 HA SER 7 -9.455 12.793 -0.353 38 HB2 SER 7 HB2 SER 7 -10.792 13.126 1.665 39 HB3 SER 7 HB1 SER 7 -9.442 12.610 2.671 40 HG SER 7 HG SER 7 -9.702 14.958 1.117 41 H THR 8 HN THR 8 -7.579 11.087 2.155 42 HA THR 8 HA THR 8 -5.160 12.463 1.698 43 HB THR 8 HB THR 8 -5.363 9.612 2.669 44 HG1 THR 8 HG1 THR 8 -5.787 12.009 4.173 45 HG21 THR 8 HG21 THR 8 -3.504 11.890 3.380 46 HG22 THR 8 HG22 THR 8 -3.102 10.511 2.357 47 HG23 THR 8 HG23 THR 8 -3.454 10.266 4.068 48 H GLY 9 HN GLY 9 -6.719 9.802 0.121 49 HA2 GLY 9 HA2 GLY 9 -5.312 9.985 -2.251 50 HA3 GLY 9 HA1 GLY 9 -4.484 8.773 -1.283 51 H SER 10 HN SER 10 -4.997 7.043 -2.542 52 HA SER 10 HA SER 10 -7.837 6.453 -2.998 53 HB2 SER 10 HB2 SER 10 -6.234 6.453 -4.954 54 HB3 SER 10 HB1 SER 10 -5.414 5.086 -4.203 55 HG SER 10 HG SER 10 -8.160 4.830 -4.500 56 H ILE 11 HN ILE 11 -8.635 4.333 -2.433 57 HA ILE 11 HA ILE 11 -7.168 3.203 -0.166 58 HB ILE 11 HB ILE 11 -10.084 2.947 -0.896 59 HG12 ILE 11 HG12 ILE 11 -8.626 4.436 1.289 60 HG13 ILE 11 HG11 ILE 11 -9.501 5.137 -0.064 61 HG21 ILE 11 HG21 ILE 11 -8.611 1.889 1.515 62 HG22 ILE 11 HG22 ILE 11 -9.253 0.914 0.194 63 HG23 ILE 11 HG23 ILE 11 -10.352 1.809 1.246 64 HD11 ILE 11 HD11 ILE 11 -11.585 4.227 0.817 65 HD12 ILE 11 HD12 ILE 11 -10.785 5.279 1.985 66 HD13 ILE 11 HD13 ILE 11 -10.697 3.527 2.169 67 H GLN 12 HN GLN 12 -6.570 1.174 -0.055 68 HA GLN 12 HA GLN 12 -7.380 -0.735 -2.099 69 HB2 GLN 12 HB2 GLN 12 -4.880 -1.418 -2.290 70 HB3 GLN 12 HB1 GLN 12 -5.487 -0.094 -3.267 71 HG2 GLN 12 HG2 GLN 12 -4.212 0.434 -0.626 72 HG3 GLN 12 HG1 GLN 12 -3.217 0.107 -2.036 73 HE21 GLN 12 HE21 GLN 12 -4.868 1.430 -3.948 74 HE22 GLN 12 HE22 GLN 12 -4.753 3.118 -3.634 75 H CYS 13 HN CYS 13 -6.393 -2.922 -1.632 76 HA CYS 13 HA CYS 13 -6.229 -3.319 1.278 77 HB2 CYS 13 HB2 CYS 13 -8.313 -4.221 0.573 78 HB3 CYS 13 HB1 CYS 13 -7.601 -4.991 -0.835 79 H CYS 14 HN CYS 14 -4.179 -3.627 1.711 80 HA CYS 14 HA CYS 14 -2.387 -4.816 -0.226 81 HB2 CYS 14 HB2 CYS 14 -1.946 -3.578 2.482 82 HB3 CYS 14 HB1 CYS 14 -0.656 -4.302 1.531 83 H GLN 15 HN GLN 15 -1.590 -6.777 -0.177 84 HA GLN 15 HA GLN 15 -2.454 -8.693 1.728 85 HB2 GLN 15 HB2 GLN 15 -1.866 -10.103 0.091 86 HB3 GLN 15 HB1 GLN 15 -1.366 -8.711 -0.848 87 HG2 GLN 15 HG2 GLN 15 0.432 -10.187 -0.935 88 HG3 GLN 15 HG1 GLN 15 0.911 -8.969 0.243 89 HE21 GLN 15 HE21 GLN 15 -1.398 -11.506 0.917 90 HE22 GLN 15 HE22 GLN 15 -0.409 -12.375 2.035 91 H ASN 16 HN ASN 16 0.314 -6.649 1.322 92 HA ASN 16 HA ASN 16 1.291 -7.479 3.962 93 HB2 ASN 16 HB2 ASN 16 2.555 -8.327 1.726 94 HB3 ASN 16 HB1 ASN 16 3.324 -6.766 1.966 95 HD21 ASN 16 HD21 ASN 16 4.303 -9.524 2.201 96 HD22 ASN 16 HD22 ASN 16 5.013 -9.615 3.777 97 H VAL 17 HN VAL 17 1.207 -5.703 5.173 98 HA VAL 17 HA VAL 17 1.762 -3.102 3.916 99 HB VAL 17 HB VAL 17 0.375 -3.677 6.544 100 HG11 VAL 17 HG11 VAL 17 0.848 -1.058 5.118 101 HG12 VAL 17 HG12 VAL 17 1.601 -1.572 6.627 102 HG13 VAL 17 HG13 VAL 17 -0.137 -1.274 6.565 103 HG21 VAL 17 HG21 VAL 17 -0.981 -4.286 4.620 104 HG22 VAL 17 HG22 VAL 17 -0.708 -2.695 3.908 105 HG23 VAL 17 HG23 VAL 17 -1.629 -2.844 5.404 106 H VAL 18 HN VAL 18 3.845 -2.631 4.072 107 HA VAL 18 HA VAL 18 5.175 -2.999 6.668 108 HB VAL 18 HB VAL 18 7.268 -3.612 5.427 109 HG11 VAL 18 HG11 VAL 18 6.627 -5.955 5.063 110 HG12 VAL 18 HG12 VAL 18 4.927 -5.493 5.139 111 HG13 VAL 18 HG13 VAL 18 5.955 -5.313 6.561 112 HG21 VAL 18 HG21 VAL 18 5.356 -3.956 3.117 113 HG22 VAL 18 HG22 VAL 18 7.035 -4.495 3.147 114 HG23 VAL 18 HG23 VAL 18 6.660 -2.773 3.227 115 HA PRO 19 HA PRO 19 6.552 1.226 6.085 116 HB2 PRO 19 HB2 PRO 19 8.849 0.299 7.702 117 HB3 PRO 19 HB1 PRO 19 7.763 1.665 7.971 118 HG2 PRO 19 HG2 PRO 19 7.584 -0.547 9.454 119 HG3 PRO 19 HG1 PRO 19 6.141 0.359 8.969 120 HD2 PRO 19 HD2 PRO 19 7.227 -2.202 7.877 121 HD3 PRO 19 HD1 PRO 19 5.541 -1.701 8.124 122 H GLY 20 HN GLY 20 7.917 2.211 4.663 123 HA2 GLY 20 HA2 GLY 20 9.391 0.607 2.838 124 HA3 GLY 20 HA1 GLY 20 9.402 2.363 2.913 125 H ASP 21 HN ASP 21 10.206 2.090 5.827 126 HA ASP 21 HA ASP 21 13.067 1.630 5.366 127 HB2 ASP 21 HB2 ASP 21 13.445 2.948 7.371 128 HB3 ASP 21 HB1 ASP 21 12.362 3.831 6.303 129 H SER 22 HN SER 22 10.606 -0.192 6.127 130 HA SER 22 HA SER 22 11.586 -1.525 8.489 131 HB2 SER 22 HB2 SER 22 9.209 -1.589 8.087 132 HB3 SER 22 HB1 SER 22 9.440 -2.234 6.472 133 HG SER 22 HG SER 22 9.407 -3.509 8.905 134 H ASP 23 HN ASP 23 12.372 -3.721 8.477 135 HA ASP 23 HA ASP 23 14.431 -4.182 6.654 136 HB2 ASP 23 HB2 ASP 23 12.966 -5.980 8.564 137 HB3 ASP 23 HB1 ASP 23 14.206 -6.627 7.498 138 H LEU 24 HN LEU 24 11.113 -5.346 6.693 139 HA LEU 24 HA LEU 24 11.384 -6.941 4.344 140 HB2 LEU 24 HB2 LEU 24 9.222 -6.127 6.134 141 HB3 LEU 24 HB1 LEU 24 8.720 -6.256 4.460 142 HG LEU 24 HG LEU 24 10.047 -8.459 6.044 143 HD11 LEU 24 HD11 LEU 24 7.177 -8.101 5.192 144 HD12 LEU 24 HD12 LEU 24 7.792 -7.993 6.841 145 HD13 LEU 24 HD13 LEU 24 7.848 -9.528 5.977 146 HD21 LEU 24 HD21 LEU 24 8.885 -8.389 3.260 147 HD22 LEU 24 HD22 LEU 24 9.364 -9.857 4.113 148 HD23 LEU 24 HD23 LEU 24 10.575 -8.645 3.698 149 H GLY 25 HN GLY 25 9.719 -3.837 4.881 150 HA2 GLY 25 HA2 GLY 25 9.010 -3.350 2.243 151 HA3 GLY 25 HA1 GLY 25 9.225 -2.108 3.463 152 H THR 26 HN THR 26 12.017 -2.536 3.893 153 HA THR 26 HA THR 26 13.013 -0.837 1.867 154 HB THR 26 HB THR 26 14.529 -2.406 3.959 155 HG1 THR 26 HG1 THR 26 13.081 -0.021 3.986 156 HG21 THR 26 HG21 THR 26 15.983 -1.623 2.139 157 HG22 THR 26 HG22 THR 26 16.306 -0.773 3.651 158 HG23 THR 26 HG23 THR 26 15.377 0.018 2.375 159 H LEU 27 HN LEU 27 13.452 -4.283 2.546 160 HA LEU 27 HA LEU 27 15.208 -4.726 0.353 161 HB2 LEU 27 HB2 LEU 27 14.861 -6.182 2.432 162 HB3 LEU 27 HB1 LEU 27 13.421 -6.784 1.642 163 HG LEU 27 HG LEU 27 15.501 -8.223 1.473 164 HD11 LEU 27 HD11 LEU 27 15.097 -8.844 -0.856 165 HD12 LEU 27 HD12 LEU 27 14.180 -7.356 -1.090 166 HD13 LEU 27 HD13 LEU 27 13.591 -8.589 0.025 167 HD21 LEU 27 HD21 LEU 27 16.328 -6.115 -0.512 168 HD22 LEU 27 HD22 LEU 27 17.151 -7.641 -0.195 169 HD23 LEU 27 HD23 LEU 27 17.085 -6.399 1.055 170 H LEU 28 HN LEU 28 11.736 -4.729 0.806 171 HA LEU 28 HA LEU 28 11.055 -6.048 -1.596 172 HB2 LEU 28 HB2 LEU 28 9.435 -4.023 -0.048 173 HB3 LEU 28 HB1 LEU 28 8.818 -5.089 -1.290 174 HG LEU 28 HG LEU 28 9.686 -5.766 1.498 175 HD11 LEU 28 HD11 LEU 28 7.217 -6.429 -0.098 176 HD12 LEU 28 HD12 LEU 28 7.356 -5.148 1.104 177 HD13 LEU 28 HD13 LEU 28 7.510 -6.834 1.593 178 HD21 LEU 28 HD21 LEU 28 10.843 -7.374 0.153 179 HD22 LEU 28 HD22 LEU 28 9.393 -7.687 -0.803 180 HD23 LEU 28 HD23 LEU 28 9.446 -8.152 0.898 181 H LEU 29 HN LEU 29 11.379 -2.593 -0.780 182 HA LEU 29 HA LEU 29 10.718 -1.843 -3.473 183 HB2 LEU 29 HB2 LEU 29 11.197 0.442 -2.772 184 HB3 LEU 29 HB1 LEU 29 10.097 -0.355 -1.682 185 HG LEU 29 HG LEU 29 12.112 -0.712 -0.153 186 HD11 LEU 29 HD11 LEU 29 13.283 1.406 -1.955 187 HD12 LEU 29 HD12 LEU 29 13.881 -0.244 -1.776 188 HD13 LEU 29 HD13 LEU 29 13.952 0.873 -0.412 189 HD21 LEU 29 HD21 LEU 29 11.948 1.613 0.696 190 HD22 LEU 29 HD22 LEU 29 10.384 0.873 0.352 191 HD23 LEU 29 HD23 LEU 29 11.073 2.042 -0.776 192 H ASP 30 HN ASP 30 13.589 -2.650 -1.787 193 HA ASP 30 HA ASP 30 15.476 -1.553 -3.583 194 HB2 ASP 30 HB2 ASP 30 16.102 -2.486 -1.389 195 HB3 ASP 30 HB1 ASP 30 15.658 -4.091 -1.946 196 H GLU 31 HN GLU 31 13.599 -4.487 -3.528 197 HA GLU 31 HA GLU 31 14.847 -5.691 -5.802 198 HB2 GLU 31 HB2 GLU 31 13.376 -6.656 -3.769 199 HB3 GLU 31 HB1 GLU 31 12.103 -6.471 -4.970 200 HG2 GLU 31 HG2 GLU 31 13.375 -7.855 -6.524 201 HG3 GLU 31 HG1 GLU 31 14.639 -8.025 -5.309 202 H LEU 32 HN LEU 32 12.627 -3.233 -5.330 203 HA LEU 32 HA LEU 32 11.407 -3.564 -7.974 204 HB2 LEU 32 HB2 LEU 32 10.630 -2.006 -5.531 205 HB3 LEU 32 HB1 LEU 32 9.854 -1.749 -7.079 206 HG LEU 32 HG LEU 32 9.885 -4.350 -5.549 207 HD11 LEU 32 HD11 LEU 32 7.697 -2.320 -5.945 208 HD12 LEU 32 HD12 LEU 32 8.543 -2.664 -4.437 209 HD13 LEU 32 HD13 LEU 32 7.512 -3.892 -5.168 210 HD21 LEU 32 HD21 LEU 32 8.201 -5.059 -7.199 211 HD22 LEU 32 HD22 LEU 32 9.766 -4.730 -7.941 212 HD23 LEU 32 HD23 LEU 32 8.458 -3.556 -8.085 213 H GLY 33 HN GLY 33 13.803 -1.872 -6.353 214 HA2 GLY 33 HA2 GLY 33 15.176 -0.139 -6.953 215 HA3 GLY 33 HA1 GLY 33 14.500 -0.270 -8.568 216 H ILE 34 HN ILE 34 12.810 0.496 -5.545 217 HA ILE 34 HA ILE 34 11.546 2.736 -6.870 218 HB ILE 34 HB ILE 34 11.226 1.827 -4.004 219 HG12 ILE 34 HG12 ILE 34 9.550 1.202 -6.451 220 HG13 ILE 34 HG11 ILE 34 10.606 0.067 -5.617 221 HG21 ILE 34 HG21 ILE 34 10.530 4.133 -4.362 222 HG22 ILE 34 HG22 ILE 34 9.131 3.096 -4.079 223 HG23 ILE 34 HG23 ILE 34 9.516 3.630 -5.715 224 HD11 ILE 34 HD11 ILE 34 8.288 -0.285 -5.016 225 HD12 ILE 34 HD12 ILE 34 8.163 1.384 -4.462 226 HD13 ILE 34 HD13 ILE 34 9.220 0.252 -3.620 227 H VAL 35 HN VAL 35 12.073 4.829 -6.674 228 HA VAL 35 HA VAL 35 14.180 5.572 -4.823 229 HB VAL 35 HB VAL 35 14.239 6.520 -7.090 230 HG11 VAL 35 HG11 VAL 35 11.875 6.681 -7.576 231 HG12 VAL 35 HG12 VAL 35 12.638 8.260 -7.761 232 HG13 VAL 35 HG13 VAL 35 11.677 7.909 -6.327 233 HG21 VAL 35 HG21 VAL 35 15.285 7.732 -5.263 234 HG22 VAL 35 HG22 VAL 35 13.773 8.578 -4.939 235 HG23 VAL 35 HG23 VAL 35 14.628 8.850 -6.456 236 H LEU 36 HN LEU 36 13.719 6.091 -2.825 237 HA LEU 36 HA LEU 36 11.006 6.853 -2.124 238 HB2 LEU 36 HB2 LEU 36 12.006 6.705 0.253 239 HB3 LEU 36 HB1 LEU 36 11.699 5.234 -0.633 240 HG LEU 36 HG LEU 36 14.262 5.611 -1.329 241 HD11 LEU 36 HD11 LEU 36 14.069 6.789 1.427 242 HD12 LEU 36 HD12 LEU 36 14.434 7.688 -0.044 243 HD13 LEU 36 HD13 LEU 36 15.549 6.445 0.530 244 HD21 LEU 36 HD21 LEU 36 14.844 4.087 0.540 245 HD22 LEU 36 HD22 LEU 36 13.437 3.580 -0.392 246 HD23 LEU 36 HD23 LEU 36 13.221 4.334 1.185 247 H GLU 37 HN GLU 37 10.399 8.813 -1.629 248 HA GLU 37 HA GLU 37 12.345 10.965 -1.468 249 HB2 GLU 37 HB2 GLU 37 10.276 11.281 -2.772 250 HB3 GLU 37 HB1 GLU 37 9.320 10.989 -1.329 251 HG2 GLU 37 HG2 GLU 37 10.216 12.998 -0.304 252 HG3 GLU 37 HG1 GLU 37 11.224 13.283 -1.723 253 H ASP 38 HN ASP 38 10.084 9.164 0.471 254 HA ASP 38 HA ASP 38 11.518 9.952 2.862 255 HB2 ASP 38 HB2 ASP 38 8.563 10.364 2.443 256 HB3 ASP 38 HB1 ASP 38 9.210 10.057 4.052 257 HA PRO 39 HA PRO 39 11.119 5.488 2.542 258 HB2 PRO 39 HB2 PRO 39 12.969 4.912 4.460 259 HB3 PRO 39 HB1 PRO 39 13.398 5.349 2.806 260 HG2 PRO 39 HG2 PRO 39 13.377 7.044 5.265 261 HG3 PRO 39 HG1 PRO 39 14.569 6.986 3.955 262 HD2 PRO 39 HD2 PRO 39 12.688 8.926 4.130 263 HD3 PRO 39 HD1 PRO 39 13.303 8.333 2.574 264 H THR 40 HN THR 40 10.180 7.572 4.948 265 HA THR 40 HA THR 40 9.762 5.633 7.051 266 HB THR 40 HB THR 40 8.583 7.619 8.156 267 HG1 THR 40 HG1 THR 40 9.803 9.523 6.765 268 HG21 THR 40 HG21 THR 40 10.854 6.970 8.735 269 HG22 THR 40 HG22 THR 40 10.727 8.729 8.679 270 HG23 THR 40 HG23 THR 40 11.484 7.856 7.347 271 H VAL 41 HN VAL 41 8.112 6.515 4.272 272 HA VAL 41 HA VAL 41 5.435 6.386 5.269 273 HB VAL 41 HB VAL 41 4.717 6.388 2.970 274 HG11 VAL 41 HG11 VAL 41 5.815 8.434 2.175 275 HG12 VAL 41 HG12 VAL 41 7.079 8.209 3.386 276 HG13 VAL 41 HG13 VAL 41 5.416 8.512 3.891 277 HG21 VAL 41 HG21 VAL 41 6.253 6.248 1.095 278 HG22 VAL 41 HG22 VAL 41 6.342 4.784 2.075 279 HG23 VAL 41 HG23 VAL 41 7.607 6.007 2.200 280 H LEU 42 HN LEU 42 3.870 4.758 4.612 281 HA LEU 42 HA LEU 42 4.976 2.081 4.929 282 HB2 LEU 42 HB2 LEU 42 2.119 3.058 4.944 283 HB3 LEU 42 HB1 LEU 42 2.614 1.405 5.247 284 HG LEU 42 HG LEU 42 3.289 3.795 6.966 285 HD11 LEU 42 HD11 LEU 42 1.426 1.470 7.431 286 HD12 LEU 42 HD12 LEU 42 0.952 3.142 7.132 287 HD13 LEU 42 HD13 LEU 42 1.823 2.724 8.606 288 HD21 LEU 42 HD21 LEU 42 3.945 0.871 7.298 289 HD22 LEU 42 HD22 LEU 42 4.180 2.110 8.532 290 HD23 LEU 42 HD23 LEU 42 5.087 2.186 7.023 291 H ILE 43 HN ILE 43 5.122 0.644 3.347 292 HA ILE 43 HA ILE 43 3.701 1.245 0.846 293 HB ILE 43 HB ILE 43 5.420 -0.275 -0.251 294 HG12 ILE 43 HG12 ILE 43 7.007 0.374 2.239 295 HG13 ILE 43 HG11 ILE 43 6.333 -1.210 1.871 296 HG21 ILE 43 HG21 ILE 43 5.380 2.112 -0.608 297 HG22 ILE 43 HG22 ILE 43 7.048 1.559 -0.479 298 HG23 ILE 43 HG23 ILE 43 6.283 2.380 0.881 299 HD11 ILE 43 HD11 ILE 43 7.720 -1.355 -0.117 300 HD12 ILE 43 HD12 ILE 43 8.704 -1.080 1.320 301 HD13 ILE 43 HD13 ILE 43 8.375 0.250 0.208 302 H GLY 44 HN GLY 44 2.477 -0.307 -0.105 303 HA2 GLY 44 HA2 GLY 44 2.008 -2.675 1.585 304 HA3 GLY 44 HA1 GLY 44 0.753 -1.837 0.702 305 H ASP 45 HN ASP 45 3.075 -4.301 0.628 306 HA ASP 45 HA ASP 45 3.046 -4.666 -2.236 307 HB2 ASP 45 HB2 ASP 45 5.012 -5.375 -0.976 308 HB3 ASP 45 HB1 ASP 45 4.030 -6.456 0.006 309 H GLY 46 HN GLY 46 1.784 -6.112 -3.385 310 HA2 GLY 46 HA2 GLY 46 0.098 -7.666 -3.765 311 HA3 GLY 46 HA1 GLY 46 0.141 -8.045 -2.065 312 H CYS 47 HN CYS 47 -0.466 -4.931 -3.631 313 HA CYS 47 HA CYS 47 -2.884 -4.753 -1.970 314 HB2 CYS 47 HB2 CYS 47 -0.715 -3.122 -1.938 315 HB3 CYS 47 HB1 CYS 47 -1.747 -2.291 -3.100 316 H ASP 48 HN ASP 48 -4.646 -5.072 -3.067 317 HA ASP 48 HA ASP 48 -4.886 -4.043 -5.803 318 HB2 ASP 48 HB2 ASP 48 -6.692 -5.936 -4.283 319 HB3 ASP 48 HB1 ASP 48 -6.911 -5.442 -5.956 320 HA PRO 49 HA PRO 49 -7.211 -0.559 -4.339 321 HB2 PRO 49 HB2 PRO 49 -8.683 -0.726 -6.889 322 HB3 PRO 49 HB1 PRO 49 -7.701 0.585 -6.242 323 HG2 PRO 49 HG2 PRO 49 -6.872 -0.946 -8.288 324 HG3 PRO 49 HG1 PRO 49 -5.754 -0.256 -7.099 325 HD2 PRO 49 HD2 PRO 49 -6.752 -3.051 -7.364 326 HD3 PRO 49 HD1 PRO 49 -5.173 -2.451 -6.826 327 H ILE 50 HN ILE 50 -9.024 -0.391 -3.133 328 HA ILE 50 HA ILE 50 -10.947 -2.572 -3.273 329 HB ILE 50 HB ILE 50 -10.900 -0.267 -1.312 330 HG12 ILE 50 HG12 ILE 50 -9.798 -3.074 -1.047 331 HG13 ILE 50 HG11 ILE 50 -8.846 -1.600 -1.143 332 HG21 ILE 50 HG21 ILE 50 -13.060 -1.442 -1.588 333 HG22 ILE 50 HG22 ILE 50 -12.362 -1.654 0.018 334 HG23 ILE 50 HG23 ILE 50 -12.250 -2.954 -1.168 335 HD11 ILE 50 HD11 ILE 50 -8.955 -2.347 1.137 336 HD12 ILE 50 HD12 ILE 50 -10.716 -2.393 1.075 337 HD13 ILE 50 HD13 ILE 50 -9.871 -0.849 0.976 338 H THR 51 HN THR 51 -12.451 -2.364 -4.751 339 HA THR 51 HA THR 51 -13.943 0.142 -4.956 340 HB THR 51 HB THR 51 -12.155 0.247 -6.642 341 HG1 THR 51 HG1 THR 51 -13.495 1.111 -8.035 342 HG21 THR 51 HG21 THR 51 -11.803 -2.117 -7.033 343 HG22 THR 51 HG22 THR 51 -12.166 -1.301 -8.553 344 HG23 THR 51 HG23 THR 51 -13.408 -2.261 -7.750 345 H VAL 52 HN VAL 52 -14.327 -2.715 -4.025 346 HA VAL 52 HA VAL 52 -16.900 -3.151 -5.256 347 HB VAL 52 HB VAL 52 -15.150 -4.394 -6.630 348 HG11 VAL 52 HG11 VAL 52 -15.029 -6.098 -4.147 349 HG12 VAL 52 HG12 VAL 52 -13.715 -5.123 -4.810 350 HG13 VAL 52 HG13 VAL 52 -14.323 -6.511 -5.711 351 HG21 VAL 52 HG21 VAL 52 -17.334 -5.960 -5.294 352 HG22 VAL 52 HG22 VAL 52 -16.518 -6.424 -6.787 353 HG23 VAL 52 HG23 VAL 52 -17.487 -4.953 -6.730 354 H ALA 53 HN ALA 53 -18.212 -4.632 -4.024 355 HA ALA 53 HA ALA 53 -19.005 -5.693 -2.196 356 HB1 ALA 53 HB1 ALA 53 -17.509 -7.176 -0.989 357 HB2 ALA 53 HB2 ALA 53 -16.113 -6.360 -1.692 358 HB3 ALA 53 HB3 ALA 53 -17.216 -7.267 -2.726 359 H GLY 54 HN GLY 54 -18.808 -2.995 -1.826 360 HA2 GLY 54 HA2 GLY 54 -17.365 -2.114 0.406 361 HA3 GLY 54 HA1 GLY 54 -18.850 -1.388 -0.191 362 H SER 55 HN SER 55 -17.453 -2.746 2.432 363 HA SER 55 HA SER 55 -18.184 -3.419 4.464 364 HB2 SER 55 HB2 SER 55 -20.928 -2.633 3.451 365 HB3 SER 55 HB1 SER 55 -20.488 -2.922 5.134 366 HG SER 55 HG SER 55 -20.057 -0.860 5.128 367 H SER 56 HN SER 56 -18.194 -5.160 2.029 368 HA SER 56 HA SER 56 -19.807 -7.357 3.134 369 HB2 SER 56 HB2 SER 56 -19.344 -6.752 0.207 370 HB3 SER 56 HB1 SER 56 -20.230 -8.137 0.840 371 HG SER 56 HG SER 56 -21.508 -6.343 1.956 372 H ASP 57 HN ASP 57 -17.031 -6.559 3.521 373 HA ASP 57 HA ASP 57 -15.010 -7.542 3.805 374 HB2 ASP 57 HB2 ASP 57 -16.231 -9.713 4.065 375 HB3 ASP 57 HB1 ASP 57 -16.078 -9.959 2.329 376 H ALA 58 HN ALA 58 -14.583 -5.782 2.354 377 HA ALA 58 HA ALA 58 -14.135 -6.448 -0.442 378 HB1 ALA 58 HB1 ALA 58 -13.769 -3.818 0.979 379 HB2 ALA 58 HB2 ALA 58 -15.263 -4.347 0.204 380 HB3 ALA 58 HB3 ALA 58 -13.812 -4.089 -0.764 381 H CYS 59 HN CYS 59 -12.443 -6.920 2.258 382 HA CYS 59 HA CYS 59 -9.898 -6.791 0.839 383 HB2 CYS 59 HB2 CYS 59 -9.996 -4.718 2.164 384 HB3 CYS 59 HB1 CYS 59 -10.321 -5.659 3.616 385 H SER 60 HN SER 60 -8.467 -8.407 1.436 386 HA SER 60 HA SER 60 -9.618 -10.440 3.209 387 HB2 SER 60 HB2 SER 60 -9.203 -11.026 0.793 388 HB3 SER 60 HB1 SER 60 -7.484 -10.856 1.128 389 HG SER 60 HG SER 60 -9.266 -12.642 2.425 390 H ALA 61 HN ALA 61 -6.836 -8.401 2.701 391 HA ALA 61 HA ALA 61 -5.475 -9.786 4.908 392 HB1 ALA 61 HB1 ALA 61 -3.367 -8.938 4.025 393 HB2 ALA 61 HB2 ALA 61 -4.235 -8.136 2.715 394 HB3 ALA 61 HB3 ALA 61 -4.229 -9.896 2.822 395 H THR 62 HN THR 62 -4.933 -6.510 3.589 396 HA THR 62 HA THR 62 -5.852 -5.371 6.120 397 HB THR 62 HB THR 62 -3.103 -4.728 5.041 398 HG1 THR 62 HG1 THR 62 -3.985 -6.687 6.849 399 HG21 THR 62 HG21 THR 62 -4.177 -2.957 6.364 400 HG22 THR 62 HG22 THR 62 -2.788 -3.643 7.207 401 HG23 THR 62 HG23 THR 62 -4.425 -4.098 7.684 402 H ALA 63 HN ALA 63 -6.936 -3.535 5.787 403 HA ALA 63 HA ALA 63 -6.999 -2.398 3.123 404 HB1 ALA 63 HB1 ALA 63 -9.100 -2.805 4.328 405 HB2 ALA 63 HB2 ALA 63 -8.893 -1.099 3.932 406 HB3 ALA 63 HB3 ALA 63 -8.597 -1.664 5.576 407 H VAL 64 HN VAL 64 -6.267 -0.411 2.557 408 HA VAL 64 HA VAL 64 -5.072 1.315 4.589 409 HB VAL 64 HB VAL 64 -2.997 1.474 3.079 410 HG11 VAL 64 HG11 VAL 64 -1.917 -0.449 4.194 411 HG12 VAL 64 HG12 VAL 64 -3.507 -1.019 4.704 412 HG13 VAL 64 HG13 VAL 64 -2.885 0.519 5.305 413 HG21 VAL 64 HG21 VAL 64 -3.968 0.232 1.206 414 HG22 VAL 64 HG22 VAL 64 -4.040 -1.217 2.211 415 HG23 VAL 64 HG23 VAL 64 -2.479 -0.515 1.783 416 H CYS 65 HN CYS 65 -4.223 3.330 3.605 417 HA CYS 65 HA CYS 65 -5.614 4.084 1.130 418 HB2 CYS 65 HB2 CYS 65 -6.916 5.046 2.906 419 HB3 CYS 65 HB1 CYS 65 -5.471 5.615 3.732 420 H CYS 66 HN CYS 66 -3.968 4.320 -0.265 421 HA CYS 66 HA CYS 66 -1.458 5.485 0.646 422 HB2 CYS 66 HB2 CYS 66 -2.288 3.872 -1.695 423 HB3 CYS 66 HB1 CYS 66 -0.945 4.982 -1.924 424 H SER 67 HN SER 67 -0.716 7.376 0.175 425 HA SER 67 HA SER 67 -2.457 9.300 -1.094 426 HB2 SER 67 HB2 SER 67 -1.189 9.683 1.072 427 HB3 SER 67 HB1 SER 67 0.277 9.759 0.096 428 HG SER 67 HG SER 67 -2.004 11.420 -0.273 429 H ASP 68 HN ASP 68 0.067 7.279 -2.013 430 HA ASP 68 HA ASP 68 0.826 9.006 -4.272 431 HB2 ASP 68 HB2 ASP 68 2.663 8.232 -2.768 432 HB3 ASP 68 HB1 ASP 68 2.270 6.573 -3.202 433 H ASN 69 HN ASN 69 1.140 7.903 -6.377 434 HA ASN 69 HA ASN 69 -0.900 5.804 -6.691 435 HB2 ASN 69 HB2 ASN 69 -1.631 6.852 -8.749 436 HB3 ASN 69 HB1 ASN 69 -1.700 8.020 -7.434 437 HD21 ASN 69 HD21 ASN 69 -1.534 8.430 -10.319 438 HD22 ASN 69 HD22 ASN 69 -0.127 9.405 -10.574 439 H ASN 70 HN ASN 70 2.372 6.579 -7.303 440 HA ASN 70 HA ASN 70 2.427 5.097 -9.816 441 HB2 ASN 70 HB2 ASN 70 4.874 5.701 -9.858 442 HB3 ASN 70 HB1 ASN 70 3.760 7.057 -9.921 443 HD21 ASN 70 HD21 ASN 70 3.662 8.476 -8.220 444 HD22 ASN 70 HD22 ASN 70 4.818 8.492 -6.936 445 H VAL 71 HN VAL 71 1.727 3.172 -8.734 446 HA VAL 71 HA VAL 71 3.593 1.823 -6.995 447 HB VAL 71 HB VAL 71 1.926 0.091 -6.862 448 HG11 VAL 71 HG11 VAL 71 1.580 2.114 -5.527 449 HG12 VAL 71 HG12 VAL 71 0.048 1.364 -5.978 450 HG13 VAL 71 HG13 VAL 71 0.611 2.802 -6.830 451 HG21 VAL 71 HG21 VAL 71 1.264 0.016 -9.211 452 HG22 VAL 71 HG22 VAL 71 0.443 1.567 -9.031 453 HG23 VAL 71 HG23 VAL 71 -0.142 0.151 -8.157 454 H SER 72 HN SER 72 4.161 -0.479 -7.505 455 HA SER 72 HA SER 72 5.524 -0.493 -10.047 456 HB2 SER 72 HB2 SER 72 6.674 -2.468 -9.133 457 HB3 SER 72 HB1 SER 72 6.680 -1.139 -7.970 458 HG SER 72 HG SER 72 5.707 -3.598 -7.662 459 H GLY 73 HN GLY 73 2.520 -1.442 -9.132 460 HA2 GLY 73 HA2 GLY 73 1.272 -2.536 -11.013 461 HA3 GLY 73 HA1 GLY 73 2.519 -3.766 -10.946 462 H VAL 74 HN VAL 74 2.656 -3.774 -8.036 463 HA VAL 74 HA VAL 74 -0.032 -4.724 -7.369 464 HB VAL 74 HB VAL 74 0.744 -6.727 -6.360 465 HG11 VAL 74 HG11 VAL 74 1.916 -6.290 -9.096 466 HG12 VAL 74 HG12 VAL 74 0.363 -7.016 -8.676 467 HG13 VAL 74 HG13 VAL 74 1.861 -7.872 -8.310 468 HG21 VAL 74 HG21 VAL 74 3.152 -7.373 -6.441 469 HG22 VAL 74 HG22 VAL 74 2.785 -6.027 -5.365 470 HG23 VAL 74 HG23 VAL 74 3.515 -5.721 -6.938 471 H ILE 75 HN ILE 75 2.687 -2.909 -6.442 472 HA ILE 75 HA ILE 75 2.120 -3.185 -3.602 473 HB ILE 75 HB ILE 75 3.951 -1.638 -3.209 474 HG12 ILE 75 HG12 ILE 75 4.404 -1.569 -6.183 475 HG13 ILE 75 HG11 ILE 75 3.492 -0.334 -5.339 476 HG21 ILE 75 HG21 ILE 75 4.621 -3.776 -5.203 477 HG22 ILE 75 HG22 ILE 75 4.481 -3.973 -3.456 478 HG23 ILE 75 HG23 ILE 75 5.771 -2.980 -4.133 479 HD11 ILE 75 HD11 ILE 75 6.347 -1.065 -4.792 480 HD12 ILE 75 HD12 ILE 75 5.431 0.212 -3.994 481 HD13 ILE 75 HD13 ILE 75 5.801 0.335 -5.714 482 H ALA 76 HN ALA 76 2.398 -0.924 -2.484 483 HA ALA 76 HA ALA 76 0.907 1.215 -3.783 484 HB1 ALA 76 HB1 ALA 76 0.081 -0.025 -1.150 485 HB2 ALA 76 HB2 ALA 76 -0.829 -0.080 -2.663 486 HB3 ALA 76 HB3 ALA 76 -0.591 1.460 -1.834 487 H ILE 77 HN ILE 77 1.480 3.276 -2.906 488 HA ILE 77 HA ILE 77 3.706 3.162 -0.975 489 HB ILE 77 HB ILE 77 3.510 5.006 -3.363 490 HG12 ILE 77 HG12 ILE 77 5.382 2.681 -2.855 491 HG13 ILE 77 HG11 ILE 77 4.011 2.650 -3.958 492 HG21 ILE 77 HG21 ILE 77 4.635 6.046 -1.462 493 HG22 ILE 77 HG22 ILE 77 5.780 5.695 -2.757 494 HG23 ILE 77 HG23 ILE 77 5.714 4.657 -1.332 495 HD11 ILE 77 HD11 ILE 77 6.439 4.409 -4.204 496 HD12 ILE 77 HD12 ILE 77 5.064 4.389 -5.309 497 HD13 ILE 77 HD13 ILE 77 6.092 2.964 -5.154 498 H GLY 78 HN GLY 78 3.565 4.456 0.741 499 HA2 GLY 78 HA2 GLY 78 3.023 6.287 2.043 500 HA3 GLY 78 HA1 GLY 78 2.282 7.031 0.633 501 H CYS 79 HN CYS 79 1.648 4.041 2.468 502 HA CYS 79 HA CYS 79 -1.201 4.650 2.294 503 HB2 CYS 79 HB2 CYS 79 0.420 2.201 2.413 504 HB3 CYS 79 HB1 CYS 79 -1.080 2.145 3.319 505 H LEU 80 HN LEU 80 -2.500 4.935 3.976 506 HA LEU 80 HA LEU 80 -1.421 4.557 6.686 507 HB2 LEU 80 HB2 LEU 80 -3.846 6.107 5.773 508 HB3 LEU 80 HB1 LEU 80 -3.316 5.921 7.436 509 HG LEU 80 HG LEU 80 -1.726 7.311 5.278 510 HD11 LEU 80 HD11 LEU 80 -3.745 8.554 5.829 511 HD12 LEU 80 HD12 LEU 80 -2.316 9.369 6.466 512 HD13 LEU 80 HD13 LEU 80 -3.359 8.444 7.547 513 HD21 LEU 80 HD21 LEU 80 -0.378 8.099 7.199 514 HD22 LEU 80 HD22 LEU 80 -0.295 6.354 6.966 515 HD23 LEU 80 HD23 LEU 80 -1.300 7.023 8.250 516 HA PRO 81 HA PRO 81 -3.925 0.903 6.878 517 HB2 PRO 81 HB2 PRO 81 -3.707 1.136 9.789 518 HB3 PRO 81 HB1 PRO 81 -3.083 -0.118 8.723 519 HG2 PRO 81 HG2 PRO 81 -1.467 1.640 9.958 520 HG3 PRO 81 HG1 PRO 81 -1.104 0.991 8.350 521 HD2 PRO 81 HD2 PRO 81 -2.234 3.662 9.097 522 HD3 PRO 81 HD1 PRO 81 -1.046 3.252 7.855 523 H VAL 82 HN VAL 82 -6.065 0.741 6.760 524 HA VAL 82 HA VAL 82 -7.719 2.222 8.660 525 HB VAL 82 HB VAL 82 -9.409 2.427 6.798 526 HG11 VAL 82 HG11 VAL 82 -6.828 3.948 6.504 527 HG12 VAL 82 HG12 VAL 82 -8.152 4.346 7.601 528 HG13 VAL 82 HG13 VAL 82 -8.391 4.448 5.856 529 HG21 VAL 82 HG21 VAL 82 -8.435 0.822 5.245 530 HG22 VAL 82 HG22 VAL 82 -7.020 1.859 5.061 531 HG23 VAL 82 HG23 VAL 82 -8.596 2.412 4.500 532 H THR 83 HN THR 83 -9.851 1.257 8.957 533 HA THR 83 HA THR 83 -9.998 -1.566 8.155 534 HB THR 83 HB THR 83 -10.745 -0.563 10.909 535 HG1 THR 83 HG1 THR 83 -8.336 -1.339 9.840 536 HG21 THR 83 HG21 THR 83 -11.986 -2.551 10.124 537 HG22 THR 83 HG22 THR 83 -10.908 -2.930 11.469 538 HG23 THR 83 HG23 THR 83 -10.452 -3.370 9.825 539 H LEU 84 HN LEU 84 -11.955 -2.248 7.519 540 HA LEU 84 HA LEU 84 -14.088 -2.238 6.810 541 HB2 LEU 84 HB2 LEU 84 -14.379 -0.381 9.144 542 HB3 LEU 84 HB1 LEU 84 -15.745 -0.917 8.183 543 HG LEU 84 HG LEU 84 -13.881 -2.747 9.688 544 HD11 LEU 84 HD11 LEU 84 -15.767 -3.054 11.240 545 HD12 LEU 84 HD12 LEU 84 -16.645 -1.778 10.397 546 HD13 LEU 84 HD13 LEU 84 -15.150 -1.402 11.252 547 HD21 LEU 84 HD21 LEU 84 -16.462 -3.249 8.225 548 HD22 LEU 84 HD22 LEU 84 -15.660 -4.416 9.275 549 HD23 LEU 84 HD23 LEU 84 -14.861 -3.859 7.806 Start of MODEL 10 1 H1 GLY 1 HT1 GLY 1 -21.246 0.511 -0.088 2 H2 GLY 1 HT2 GLY 1 -21.540 -0.953 0.700 3 H3 GLY 1 HT3 GLY 1 -22.791 -0.175 -0.129 4 HA2 GLY 1 HA1 GLY 1 -21.961 -2.054 -1.390 5 HA3 GLY 1 HA2 GLY 1 -21.696 -0.530 -2.225 6 H SER 2 HN SER 2 -19.648 0.149 -2.641 7 HA SER 2 HA SER 2 -17.439 -1.517 -1.669 8 HB2 SER 2 HB2 SER 2 -18.231 -2.256 -3.958 9 HB3 SER 2 HB1 SER 2 -17.746 -0.672 -4.561 10 HG SER 2 HG SER 2 -16.084 -2.638 -3.360 11 H TRP 3 HN TRP 3 -15.391 -0.301 -3.059 12 HA TRP 3 HA TRP 3 -13.944 1.437 -2.910 13 HB2 TRP 3 HB2 TRP 3 -16.516 3.005 -3.190 14 HB3 TRP 3 HB1 TRP 3 -14.922 3.741 -3.237 15 HD1 TRP 3 HD1 TRP 3 -17.370 1.803 -5.367 16 HE1 TRP 3 HE1 TRP 3 -16.439 1.621 -7.763 17 HE3 TRP 3 HE3 TRP 3 -12.657 3.551 -4.520 18 HZ2 TRP 3 HZ2 TRP 3 -14.013 2.154 -9.107 19 HZ3 TRP 3 HZ3 TRP 3 -11.084 3.685 -6.412 20 HH2 TRP 3 HH2 TRP 3 -11.752 2.998 -8.658 21 H GLY 4 HN GLY 4 -14.433 4.030 -1.661 22 HA2 GLY 4 HA2 GLY 4 -15.462 3.827 0.934 23 HA3 GLY 4 HA1 GLY 4 -13.743 3.460 0.996 24 H GLN 5 HN GLN 5 -14.944 5.668 2.268 25 HA GLN 5 HA GLN 5 -13.931 7.920 0.672 26 HB2 GLN 5 HB2 GLN 5 -15.809 7.917 3.047 27 HB3 GLN 5 HB1 GLN 5 -15.206 9.362 2.253 28 HG2 GLN 5 HG2 GLN 5 -17.307 9.120 1.343 29 HG3 GLN 5 HG1 GLN 5 -16.277 8.372 0.127 30 HE21 GLN 5 HE21 GLN 5 -18.644 7.831 2.608 31 HE22 GLN 5 HE22 GLN 5 -19.026 6.199 2.170 32 H CYS 6 HN CYS 6 -11.886 8.352 1.154 33 HA CYS 6 HA CYS 6 -11.052 8.255 3.972 34 HB2 CYS 6 HB2 CYS 6 -10.194 6.243 2.959 35 HB3 CYS 6 HB1 CYS 6 -9.577 7.143 1.580 36 H SER 7 HN SER 7 -9.450 9.072 0.898 37 HA SER 7 HA SER 7 -9.311 11.867 1.556 38 HB2 SER 7 HB2 SER 7 -6.803 10.165 1.612 39 HB3 SER 7 HB1 SER 7 -6.809 11.925 1.581 40 HG SER 7 HG SER 7 -8.419 10.910 3.532 41 H THR 8 HN THR 8 -7.379 12.723 -0.151 42 HA THR 8 HA THR 8 -8.703 12.242 -2.663 43 HB THR 8 HB THR 8 -7.098 14.015 -3.484 44 HG1 THR 8 HG1 THR 8 -5.816 15.025 -1.981 45 HG21 THR 8 HG21 THR 8 -9.367 14.559 -2.743 46 HG22 THR 8 HG22 THR 8 -8.233 15.831 -2.289 47 HG23 THR 8 HG23 THR 8 -8.800 14.681 -1.078 48 H GLY 9 HN GLY 9 -6.624 10.319 -1.302 49 HA2 GLY 9 HA2 GLY 9 -4.723 10.079 -3.512 50 HA3 GLY 9 HA1 GLY 9 -4.642 9.227 -1.979 51 H SER 10 HN SER 10 -5.260 7.184 -1.948 52 HA SER 10 HA SER 10 -7.284 6.213 -3.788 53 HB2 SER 10 HB2 SER 10 -5.075 6.085 -5.005 54 HB3 SER 10 HB1 SER 10 -4.523 4.970 -3.759 55 HG SER 10 HG SER 10 -6.946 4.338 -4.944 56 H ILE 11 HN ILE 11 -8.242 4.259 -3.069 57 HA ILE 11 HA ILE 11 -7.250 3.270 -0.488 58 HB ILE 11 HB ILE 11 -10.038 3.106 -1.632 59 HG12 ILE 11 HG12 ILE 11 -8.800 4.635 0.650 60 HG13 ILE 11 HG11 ILE 11 -9.545 5.288 -0.797 61 HG21 ILE 11 HG21 ILE 11 -10.660 2.077 0.514 62 HG22 ILE 11 HG22 ILE 11 -8.958 2.029 0.974 63 HG23 ILE 11 HG23 ILE 11 -9.528 1.073 -0.394 64 HD11 ILE 11 HD11 ILE 11 -10.957 3.795 1.391 65 HD12 ILE 11 HD12 ILE 11 -11.712 4.443 -0.066 66 HD13 ILE 11 HD13 ILE 11 -11.001 5.537 1.121 67 H GLN 12 HN GLN 12 -6.779 1.214 -0.214 68 HA GLN 12 HA GLN 12 -7.370 -0.783 -2.209 69 HB2 GLN 12 HB2 GLN 12 -4.817 -1.341 -2.314 70 HB3 GLN 12 HB1 GLN 12 -5.500 -0.133 -3.390 71 HG2 GLN 12 HG2 GLN 12 -4.420 0.780 -0.794 72 HG3 GLN 12 HG1 GLN 12 -3.271 0.255 -2.016 73 HE21 GLN 12 HE21 GLN 12 -4.680 1.154 -4.299 74 HE22 GLN 12 HE22 GLN 12 -4.669 2.878 -4.283 75 H CYS 13 HN CYS 13 -6.303 -2.887 -1.622 76 HA CYS 13 HA CYS 13 -6.102 -3.152 1.300 77 HB2 CYS 13 HB2 CYS 13 -8.153 -4.165 0.364 78 HB3 CYS 13 HB1 CYS 13 -7.168 -5.171 -0.701 79 H CYS 14 HN CYS 14 -4.062 -3.503 1.829 80 HA CYS 14 HA CYS 14 -2.226 -4.524 -0.179 81 HB2 CYS 14 HB2 CYS 14 -1.836 -3.149 2.456 82 HB3 CYS 14 HB1 CYS 14 -0.501 -3.896 1.588 83 H GLN 15 HN GLN 15 -1.390 -6.439 -0.199 84 HA GLN 15 HA GLN 15 -2.107 -8.377 1.757 85 HB2 GLN 15 HB2 GLN 15 -1.921 -9.590 -0.098 86 HB3 GLN 15 HB1 GLN 15 -1.101 -8.282 -0.915 87 HG2 GLN 15 HG2 GLN 15 0.320 -10.115 -1.090 88 HG3 GLN 15 HG1 GLN 15 1.017 -9.106 0.174 89 HE21 GLN 15 HE21 GLN 15 -1.818 -11.079 0.673 90 HE22 GLN 15 HE22 GLN 15 -1.079 -12.224 1.731 91 H ASN 16 HN ASN 16 0.652 -6.346 1.160 92 HA ASN 16 HA ASN 16 1.805 -7.314 3.696 93 HB2 ASN 16 HB2 ASN 16 3.019 -7.656 1.183 94 HB3 ASN 16 HB1 ASN 16 3.830 -6.294 1.935 95 HD21 ASN 16 HD21 ASN 16 4.748 -9.002 1.327 96 HD22 ASN 16 HD22 ASN 16 5.334 -9.638 2.824 97 H VAL 17 HN VAL 17 1.187 -5.557 4.896 98 HA VAL 17 HA VAL 17 1.831 -2.883 3.910 99 HB VAL 17 HB VAL 17 0.447 -3.678 6.485 100 HG11 VAL 17 HG11 VAL 17 0.811 -0.967 5.203 101 HG12 VAL 17 HG12 VAL 17 1.615 -1.534 6.666 102 HG13 VAL 17 HG13 VAL 17 -0.134 -1.304 6.654 103 HG21 VAL 17 HG21 VAL 17 -0.873 -4.218 4.511 104 HG22 VAL 17 HG22 VAL 17 -0.656 -2.576 3.907 105 HG23 VAL 17 HG23 VAL 17 -1.579 -2.858 5.383 106 H VAL 18 HN VAL 18 3.921 -2.441 4.091 107 HA VAL 18 HA VAL 18 5.226 -2.908 6.683 108 HB VAL 18 HB VAL 18 7.322 -3.520 5.437 109 HG11 VAL 18 HG11 VAL 18 6.646 -5.843 4.993 110 HG12 VAL 18 HG12 VAL 18 4.954 -5.356 5.085 111 HG13 VAL 18 HG13 VAL 18 5.985 -5.237 6.511 112 HG21 VAL 18 HG21 VAL 18 7.084 -4.344 3.129 113 HG22 VAL 18 HG22 VAL 18 6.754 -2.617 3.255 114 HG23 VAL 18 HG23 VAL 18 5.421 -3.760 3.104 115 HA PRO 19 HA PRO 19 6.697 1.297 6.150 116 HB2 PRO 19 HB2 PRO 19 9.007 0.388 7.738 117 HB3 PRO 19 HB1 PRO 19 7.883 1.710 8.053 118 HG2 PRO 19 HG2 PRO 19 7.804 -0.560 9.480 119 HG3 PRO 19 HG1 PRO 19 6.331 0.335 9.065 120 HD2 PRO 19 HD2 PRO 19 7.435 -2.166 7.857 121 HD3 PRO 19 HD1 PRO 19 5.748 -1.713 8.176 122 H GLY 20 HN GLY 20 8.023 2.245 4.683 123 HA2 GLY 20 HA2 GLY 20 9.377 0.615 2.814 124 HA3 GLY 20 HA1 GLY 20 9.455 2.367 2.895 125 H ASP 21 HN ASP 21 10.454 2.194 5.712 126 HA ASP 21 HA ASP 21 13.255 1.627 5.071 127 HB2 ASP 21 HB2 ASP 21 13.829 2.991 6.939 128 HB3 ASP 21 HB1 ASP 21 12.523 3.832 6.112 129 H SER 22 HN SER 22 10.758 -0.084 6.128 130 HA SER 22 HA SER 22 11.825 -1.383 8.437 131 HB2 SER 22 HB2 SER 22 9.443 -1.453 8.100 132 HB3 SER 22 HB1 SER 22 9.628 -2.157 6.503 133 HG SER 22 HG SER 22 9.829 -3.332 9.024 134 H ASP 23 HN ASP 23 12.640 -3.515 8.532 135 HA ASP 23 HA ASP 23 14.620 -4.147 6.683 136 HB2 ASP 23 HB2 ASP 23 13.160 -5.813 8.731 137 HB3 ASP 23 HB1 ASP 23 14.438 -6.490 7.733 138 H LEU 24 HN LEU 24 11.291 -5.257 6.925 139 HA LEU 24 HA LEU 24 11.428 -6.994 4.678 140 HB2 LEU 24 HB2 LEU 24 9.353 -5.968 6.473 141 HB3 LEU 24 HB1 LEU 24 8.796 -6.267 4.839 142 HG LEU 24 HG LEU 24 8.407 -8.193 6.282 143 HD11 LEU 24 HD11 LEU 24 10.570 -8.747 4.256 144 HD12 LEU 24 HD12 LEU 24 8.869 -8.496 3.872 145 HD13 LEU 24 HD13 LEU 24 9.358 -9.884 4.845 146 HD21 LEU 24 HD21 LEU 24 10.242 -7.871 7.849 147 HD22 LEU 24 HD22 LEU 24 11.406 -8.256 6.581 148 HD23 LEU 24 HD23 LEU 24 10.285 -9.492 7.155 149 H GLY 25 HN GLY 25 9.845 -3.824 5.060 150 HA2 GLY 25 HA2 GLY 25 9.061 -3.479 2.427 151 HA3 GLY 25 HA1 GLY 25 9.377 -2.166 3.548 152 H THR 26 HN THR 26 12.149 -2.648 3.903 153 HA THR 26 HA THR 26 13.107 -1.155 1.691 154 HB THR 26 HB THR 26 14.666 -2.488 3.907 155 HG1 THR 26 HG1 THR 26 13.230 -0.082 3.704 156 HG21 THR 26 HG21 THR 26 16.414 -0.884 3.404 157 HG22 THR 26 HG22 THR 26 15.445 -0.203 2.097 158 HG23 THR 26 HG23 THR 26 16.058 -1.854 1.974 159 H LEU 27 HN LEU 27 13.586 -4.481 2.785 160 HA LEU 27 HA LEU 27 15.372 -5.260 0.750 161 HB2 LEU 27 HB2 LEU 27 14.431 -6.432 2.983 162 HB3 LEU 27 HB1 LEU 27 13.408 -7.226 1.808 163 HG LEU 27 HG LEU 27 15.379 -8.570 2.369 164 HD11 LEU 27 HD11 LEU 27 16.152 -9.039 0.099 165 HD12 LEU 27 HD12 LEU 27 15.414 -7.537 -0.460 166 HD13 LEU 27 HD13 LEU 27 14.401 -8.838 0.164 167 HD21 LEU 27 HD21 LEU 27 16.897 -6.699 2.860 168 HD22 LEU 27 HD22 LEU 27 16.983 -6.337 1.137 169 HD23 LEU 27 HD23 LEU 27 17.604 -7.869 1.747 170 H LEU 28 HN LEU 28 11.872 -5.146 0.983 171 HA LEU 28 HA LEU 28 11.364 -6.613 -1.406 172 HB2 LEU 28 HB2 LEU 28 9.556 -4.621 -0.024 173 HB3 LEU 28 HB1 LEU 28 9.071 -5.834 -1.186 174 HG LEU 28 HG LEU 28 9.890 -6.206 1.676 175 HD11 LEU 28 HD11 LEU 28 7.518 -7.127 0.068 176 HD12 LEU 28 HD12 LEU 28 7.548 -5.790 1.218 177 HD13 LEU 28 HD13 LEU 28 7.792 -7.442 1.782 178 HD21 LEU 28 HD21 LEU 28 9.851 -8.637 1.290 179 HD22 LEU 28 HD22 LEU 28 11.194 -7.829 0.482 180 HD23 LEU 28 HD23 LEU 28 9.783 -8.339 -0.448 181 H LEU 29 HN LEU 29 11.523 -3.130 -0.665 182 HA LEU 29 HA LEU 29 10.876 -2.444 -3.370 183 HB2 LEU 29 HB2 LEU 29 11.277 -0.149 -2.727 184 HB3 LEU 29 HB1 LEU 29 10.250 -0.951 -1.572 185 HG LEU 29 HG LEU 29 12.397 -1.215 -0.161 186 HD11 LEU 29 HD11 LEU 29 13.244 1.003 -2.021 187 HD12 LEU 29 HD12 LEU 29 14.010 -0.579 -1.871 188 HD13 LEU 29 HD13 LEU 29 14.056 0.555 -0.520 189 HD21 LEU 29 HD21 LEU 29 10.569 0.205 0.477 190 HD22 LEU 29 HD22 LEU 29 11.086 1.445 -0.669 191 HD23 LEU 29 HD23 LEU 29 12.085 1.070 0.739 192 H ASP 30 HN ASP 30 13.816 -3.004 -1.596 193 HA ASP 30 HA ASP 30 15.656 -2.017 -3.500 194 HB2 ASP 30 HB2 ASP 30 16.325 -2.755 -1.240 195 HB3 ASP 30 HB1 ASP 30 15.904 -4.407 -1.652 196 H GLU 31 HN GLU 31 13.792 -4.906 -3.210 197 HA GLU 31 HA GLU 31 15.005 -6.292 -5.398 198 HB2 GLU 31 HB2 GLU 31 12.840 -6.751 -3.436 199 HB3 GLU 31 HB1 GLU 31 12.798 -7.693 -4.902 200 HG2 GLU 31 HG2 GLU 31 14.999 -7.583 -2.865 201 HG3 GLU 31 HG1 GLU 31 13.937 -8.946 -3.218 202 H LEU 32 HN LEU 32 12.744 -3.834 -5.109 203 HA LEU 32 HA LEU 32 11.402 -4.561 -7.620 204 HB2 LEU 32 HB2 LEU 32 10.539 -2.864 -5.300 205 HB3 LEU 32 HB1 LEU 32 9.664 -2.900 -6.818 206 HG LEU 32 HG LEU 32 10.129 -5.278 -5.016 207 HD11 LEU 32 HD11 LEU 32 7.754 -5.097 -4.503 208 HD12 LEU 32 HD12 LEU 32 7.650 -3.632 -5.480 209 HD13 LEU 32 HD13 LEU 32 8.629 -3.647 -4.012 210 HD21 LEU 32 HD21 LEU 32 9.934 -5.941 -7.336 211 HD22 LEU 32 HD22 LEU 32 8.476 -4.969 -7.516 212 HD23 LEU 32 HD23 LEU 32 8.470 -6.380 -6.459 213 H GLY 33 HN GLY 33 13.589 -2.381 -6.231 214 HA2 GLY 33 HA2 GLY 33 14.843 -0.750 -7.277 215 HA3 GLY 33 HA1 GLY 33 13.872 -0.973 -8.722 216 H ILE 34 HN ILE 34 12.831 -0.085 -5.442 217 HA ILE 34 HA ILE 34 11.529 2.274 -6.627 218 HB ILE 34 HB ILE 34 10.951 1.148 -3.892 219 HG12 ILE 34 HG12 ILE 34 9.483 0.469 -6.456 220 HG13 ILE 34 HG11 ILE 34 10.637 -0.605 -5.669 221 HG21 ILE 34 HG21 ILE 34 10.167 3.406 -4.329 222 HG22 ILE 34 HG22 ILE 34 8.807 2.289 -4.199 223 HG23 ILE 34 HG23 ILE 34 9.338 2.853 -5.784 224 HD11 ILE 34 HD11 ILE 34 9.207 -0.680 -3.692 225 HD12 ILE 34 HD12 ILE 34 8.358 -1.224 -5.137 226 HD13 ILE 34 HD13 ILE 34 8.053 0.389 -4.490 227 H VAL 35 HN VAL 35 11.953 4.299 -5.900 228 HA VAL 35 HA VAL 35 13.683 4.561 -3.543 229 HB VAL 35 HB VAL 35 15.025 5.126 -5.453 230 HG11 VAL 35 HG11 VAL 35 13.304 5.584 -7.093 231 HG12 VAL 35 HG12 VAL 35 14.438 6.932 -7.009 232 HG13 VAL 35 HG13 VAL 35 12.856 7.063 -6.243 233 HG21 VAL 35 HG21 VAL 35 14.109 7.606 -4.009 234 HG22 VAL 35 HG22 VAL 35 15.600 7.464 -4.940 235 HG23 VAL 35 HG23 VAL 35 15.370 6.490 -3.488 236 H LEU 36 HN LEU 36 12.310 5.141 -1.996 237 HA LEU 36 HA LEU 36 9.980 6.743 -2.500 238 HB2 LEU 36 HB2 LEU 36 11.219 5.864 0.102 239 HB3 LEU 36 HB1 LEU 36 9.601 6.496 -0.106 240 HG LEU 36 HG LEU 36 10.513 3.973 -1.464 241 HD11 LEU 36 HD11 LEU 36 9.219 4.282 1.240 242 HD12 LEU 36 HD12 LEU 36 10.844 3.674 0.909 243 HD13 LEU 36 HD13 LEU 36 9.433 2.760 0.374 244 HD21 LEU 36 HD21 LEU 36 7.806 5.086 -0.750 245 HD22 LEU 36 HD22 LEU 36 8.105 3.533 -1.531 246 HD23 LEU 36 HD23 LEU 36 8.520 5.032 -2.362 247 H GLU 37 HN GLU 37 9.626 8.822 -2.013 248 HA GLU 37 HA GLU 37 11.800 10.618 -1.675 249 HB2 GLU 37 HB2 GLU 37 9.651 11.132 -2.853 250 HB3 GLU 37 HB1 GLU 37 8.840 11.116 -1.296 251 HG2 GLU 37 HG2 GLU 37 10.244 12.988 -0.563 252 HG3 GLU 37 HG1 GLU 37 11.018 13.009 -2.149 253 H ASP 38 HN ASP 38 9.417 9.153 0.420 254 HA ASP 38 HA ASP 38 11.060 9.914 2.725 255 HB2 ASP 38 HB2 ASP 38 8.045 9.929 2.525 256 HB3 ASP 38 HB1 ASP 38 8.875 9.795 4.070 257 HA PRO 39 HA PRO 39 10.957 5.383 2.568 258 HB2 PRO 39 HB2 PRO 39 12.948 5.031 4.404 259 HB3 PRO 39 HB1 PRO 39 13.248 5.350 2.693 260 HG2 PRO 39 HG2 PRO 39 13.307 7.239 5.010 261 HG3 PRO 39 HG1 PRO 39 14.412 7.127 3.629 262 HD2 PRO 39 HD2 PRO 39 12.466 8.994 3.777 263 HD3 PRO 39 HD1 PRO 39 12.990 8.291 2.233 264 H THR 40 HN THR 40 10.023 7.577 4.845 265 HA THR 40 HA THR 40 9.635 5.725 7.040 266 HB THR 40 HB THR 40 8.458 7.785 8.048 267 HG1 THR 40 HG1 THR 40 8.140 9.083 6.298 268 HG21 THR 40 HG21 THR 40 10.689 7.059 8.716 269 HG22 THR 40 HG22 THR 40 10.614 8.818 8.623 270 HG23 THR 40 HG23 THR 40 11.391 7.902 7.334 271 H VAL 41 HN VAL 41 8.013 6.467 4.221 272 HA VAL 41 HA VAL 41 5.330 6.378 5.245 273 HB VAL 41 HB VAL 41 4.584 6.338 2.960 274 HG11 VAL 41 HG11 VAL 41 6.942 8.177 3.287 275 HG12 VAL 41 HG12 VAL 41 5.287 8.483 3.819 276 HG13 VAL 41 HG13 VAL 41 5.654 8.367 2.097 277 HG21 VAL 41 HG21 VAL 41 6.103 6.174 1.063 278 HG22 VAL 41 HG22 VAL 41 6.177 4.720 2.058 279 HG23 VAL 41 HG23 VAL 41 7.461 5.924 2.160 280 H LEU 42 HN LEU 42 3.787 4.724 4.689 281 HA LEU 42 HA LEU 42 4.928 2.062 4.956 282 HB2 LEU 42 HB2 LEU 42 2.071 3.030 5.040 283 HB3 LEU 42 HB1 LEU 42 2.558 1.365 5.280 284 HG LEU 42 HG LEU 42 3.265 3.701 7.056 285 HD11 LEU 42 HD11 LEU 42 1.450 1.337 7.493 286 HD12 LEU 42 HD12 LEU 42 0.947 3.012 7.267 287 HD13 LEU 42 HD13 LEU 42 1.867 2.553 8.701 288 HD21 LEU 42 HD21 LEU 42 3.986 0.783 7.252 289 HD22 LEU 42 HD22 LEU 42 4.213 1.964 8.544 290 HD23 LEU 42 HD23 LEU 42 5.092 2.138 7.025 291 H ILE 43 HN ILE 43 5.233 0.772 3.302 292 HA ILE 43 HA ILE 43 3.746 1.318 0.833 293 HB ILE 43 HB ILE 43 5.471 -0.179 -0.266 294 HG12 ILE 43 HG12 ILE 43 7.043 0.394 2.254 295 HG13 ILE 43 HG11 ILE 43 6.324 -1.165 1.872 296 HG21 ILE 43 HG21 ILE 43 5.465 2.221 -0.555 297 HG22 ILE 43 HG22 ILE 43 7.124 1.634 -0.432 298 HG23 ILE 43 HG23 ILE 43 6.366 2.431 0.947 299 HD11 ILE 43 HD11 ILE 43 8.427 0.241 0.243 300 HD12 ILE 43 HD12 ILE 43 7.724 -1.338 -0.110 301 HD13 ILE 43 HD13 ILE 43 8.699 -1.111 1.343 302 H GLY 44 HN GLY 44 2.574 -0.258 -0.148 303 HA2 GLY 44 HA2 GLY 44 2.093 -2.624 1.545 304 HA3 GLY 44 HA1 GLY 44 0.828 -1.766 0.699 305 H ASP 45 HN ASP 45 3.075 -4.291 0.553 306 HA ASP 45 HA ASP 45 3.072 -4.631 -2.300 307 HB2 ASP 45 HB2 ASP 45 4.722 -5.712 -0.621 308 HB3 ASP 45 HB1 ASP 45 3.439 -6.851 -0.308 309 H GLY 46 HN GLY 46 1.791 -6.049 -3.507 310 HA2 GLY 46 HA2 GLY 46 -0.072 -7.299 -4.034 311 HA3 GLY 46 HA1 GLY 46 0.005 -7.904 -2.416 312 H CYS 47 HN CYS 47 -0.612 -4.656 -3.659 313 HA CYS 47 HA CYS 47 -2.917 -4.539 -1.863 314 HB2 CYS 47 HB2 CYS 47 -0.811 -2.849 -2.096 315 HB3 CYS 47 HB1 CYS 47 -1.970 -2.079 -3.179 316 H ASP 48 HN ASP 48 -4.822 -4.803 -2.705 317 HA ASP 48 HA ASP 48 -5.222 -4.231 -5.551 318 HB2 ASP 48 HB2 ASP 48 -7.109 -5.681 -5.493 319 HB3 ASP 48 HB1 ASP 48 -5.817 -6.496 -4.633 320 HA PRO 49 HA PRO 49 -7.553 -0.571 -4.467 321 HB2 PRO 49 HB2 PRO 49 -8.778 -0.994 -7.119 322 HB3 PRO 49 HB1 PRO 49 -7.897 0.401 -6.500 323 HG2 PRO 49 HG2 PRO 49 -6.835 -1.251 -8.337 324 HG3 PRO 49 HG1 PRO 49 -5.852 -0.434 -7.110 325 HD2 PRO 49 HD2 PRO 49 -6.753 -3.275 -7.233 326 HD3 PRO 49 HD1 PRO 49 -5.242 -2.587 -6.617 327 H ILE 50 HN ILE 50 -9.291 -0.775 -3.156 328 HA ILE 50 HA ILE 50 -10.890 -3.143 -3.328 329 HB ILE 50 HB ILE 50 -11.427 -0.810 -1.496 330 HG12 ILE 50 HG12 ILE 50 -9.525 -3.138 -1.128 331 HG13 ILE 50 HG11 ILE 50 -9.077 -1.444 -1.274 332 HG21 ILE 50 HG21 ILE 50 -13.151 -2.577 -1.676 333 HG22 ILE 50 HG22 ILE 50 -12.420 -2.499 -0.073 334 HG23 ILE 50 HG23 ILE 50 -11.939 -3.770 -1.199 335 HD11 ILE 50 HD11 ILE 50 -10.623 -2.707 0.974 336 HD12 ILE 50 HD12 ILE 50 -10.281 -0.983 0.827 337 HD13 ILE 50 HD13 ILE 50 -8.957 -2.131 1.027 338 H THR 51 HN THR 51 -12.035 -3.105 -5.154 339 HA THR 51 HA THR 51 -14.359 -1.337 -5.201 340 HB THR 51 HB THR 51 -12.714 -0.294 -6.674 341 HG1 THR 51 HG1 THR 51 -14.016 -0.277 -8.592 342 HG21 THR 51 HG21 THR 51 -12.735 -2.907 -8.188 343 HG22 THR 51 HG22 THR 51 -11.385 -2.244 -7.270 344 HG23 THR 51 HG23 THR 51 -11.948 -1.423 -8.725 345 H VAL 52 HN VAL 52 -13.771 -4.103 -4.501 346 HA VAL 52 HA VAL 52 -15.728 -5.421 -6.212 347 HB VAL 52 HB VAL 52 -13.597 -6.201 -7.062 348 HG11 VAL 52 HG11 VAL 52 -12.961 -6.941 -4.210 349 HG12 VAL 52 HG12 VAL 52 -12.182 -5.678 -5.165 350 HG13 VAL 52 HG13 VAL 52 -11.984 -7.372 -5.616 351 HG21 VAL 52 HG21 VAL 52 -15.362 -7.845 -6.943 352 HG22 VAL 52 HG22 VAL 52 -14.897 -8.255 -5.293 353 HG23 VAL 52 HG23 VAL 52 -13.805 -8.609 -6.632 354 H ALA 53 HN ALA 53 -17.197 -6.560 -5.057 355 HA ALA 53 HA ALA 53 -16.863 -6.538 -2.153 356 HB1 ALA 53 HB1 ALA 53 -18.897 -5.536 -3.056 357 HB2 ALA 53 HB2 ALA 53 -19.270 -6.937 -2.051 358 HB3 ALA 53 HB3 ALA 53 -19.326 -7.072 -3.809 359 H GLY 54 HN GLY 54 -16.596 -8.681 -4.742 360 HA2 GLY 54 HA2 GLY 54 -17.485 -11.066 -3.421 361 HA3 GLY 54 HA1 GLY 54 -16.569 -10.981 -4.917 362 H SER 55 HN SER 55 -16.289 -10.756 -1.412 363 HA SER 55 HA SER 55 -13.891 -12.313 -1.384 364 HB2 SER 55 HB2 SER 55 -13.049 -10.009 -1.993 365 HB3 SER 55 HB1 SER 55 -13.680 -9.433 -0.452 366 HG SER 55 HG SER 55 -11.340 -10.579 -0.940 367 H SER 56 HN SER 56 -12.998 -11.667 1.180 368 HA SER 56 HA SER 56 -14.850 -12.922 2.857 369 HB2 SER 56 HB2 SER 56 -12.675 -11.014 3.736 370 HB3 SER 56 HB1 SER 56 -13.372 -12.339 4.667 371 HG SER 56 HG SER 56 -12.562 -13.672 2.790 372 H ASP 57 HN ASP 57 -13.805 -9.539 3.242 373 HA ASP 57 HA ASP 57 -16.616 -8.809 3.709 374 HB2 ASP 57 HB2 ASP 57 -15.414 -8.467 5.766 375 HB3 ASP 57 HB1 ASP 57 -14.115 -7.630 4.927 376 H ALA 58 HN ALA 58 -13.681 -6.976 3.092 377 HA ALA 58 HA ALA 58 -14.879 -6.028 0.576 378 HB1 ALA 58 HB1 ALA 58 -12.991 -4.527 2.389 379 HB2 ALA 58 HB2 ALA 58 -14.725 -4.235 2.240 380 HB3 ALA 58 HB3 ALA 58 -13.660 -3.932 0.868 381 H CYS 59 HN CYS 59 -12.293 -7.537 2.134 382 HA CYS 59 HA CYS 59 -11.027 -8.310 -0.279 383 HB2 CYS 59 HB2 CYS 59 -8.966 -7.137 -0.100 384 HB3 CYS 59 HB1 CYS 59 -10.230 -5.924 0.053 385 H SER 60 HN SER 60 -8.666 -9.275 0.492 386 HA SER 60 HA SER 60 -9.374 -10.939 2.817 387 HB2 SER 60 HB2 SER 60 -7.926 -12.686 1.689 388 HB3 SER 60 HB1 SER 60 -9.422 -12.283 0.846 389 HG SER 60 HG SER 60 -6.833 -11.262 0.259 390 H ALA 61 HN ALA 61 -7.568 -8.401 2.360 391 HA ALA 61 HA ALA 61 -5.390 -9.432 4.038 392 HB1 ALA 61 HB1 ALA 61 -4.514 -9.269 1.765 393 HB2 ALA 61 HB2 ALA 61 -3.746 -8.090 2.825 394 HB3 ALA 61 HB3 ALA 61 -4.996 -7.574 1.693 395 H THR 62 HN THR 62 -4.132 -6.699 3.899 396 HA THR 62 HA THR 62 -5.698 -5.579 6.079 397 HB THR 62 HB THR 62 -3.057 -4.611 4.967 398 HG1 THR 62 HG1 THR 62 -3.705 -6.774 6.608 399 HG21 THR 62 HG21 THR 62 -4.220 -3.014 6.429 400 HG22 THR 62 HG22 THR 62 -2.750 -3.633 7.183 401 HG23 THR 62 HG23 THR 62 -4.326 -4.248 7.685 402 H ALA 63 HN ALA 63 -6.829 -3.702 5.997 403 HA ALA 63 HA ALA 63 -7.261 -2.511 3.388 404 HB1 ALA 63 HB1 ALA 63 -8.556 -1.922 6.053 405 HB2 ALA 63 HB2 ALA 63 -9.197 -2.991 4.804 406 HB3 ALA 63 HB3 ALA 63 -9.058 -1.257 4.499 407 H VAL 64 HN VAL 64 -6.370 -0.664 2.718 408 HA VAL 64 HA VAL 64 -5.164 1.128 4.695 409 HB VAL 64 HB VAL 64 -3.155 1.326 3.129 410 HG11 VAL 64 HG11 VAL 64 -2.022 -0.613 4.168 411 HG12 VAL 64 HG12 VAL 64 -3.590 -1.198 4.726 412 HG13 VAL 64 HG13 VAL 64 -2.955 0.335 5.325 413 HG21 VAL 64 HG21 VAL 64 -2.646 -0.677 1.813 414 HG22 VAL 64 HG22 VAL 64 -4.111 0.125 1.243 415 HG23 VAL 64 HG23 VAL 64 -4.231 -1.341 2.222 416 H CYS 65 HN CYS 65 -4.208 3.067 3.512 417 HA CYS 65 HA CYS 65 -5.832 3.901 1.232 418 HB2 CYS 65 HB2 CYS 65 -7.008 4.542 3.338 419 HB3 CYS 65 HB1 CYS 65 -5.589 5.455 3.823 420 H CYS 66 HN CYS 66 -4.206 4.281 -0.190 421 HA CYS 66 HA CYS 66 -1.697 5.414 0.778 422 HB2 CYS 66 HB2 CYS 66 -2.508 3.819 -1.565 423 HB3 CYS 66 HB1 CYS 66 -1.243 5.007 -1.853 424 H SER 67 HN SER 67 -0.640 7.124 -0.299 425 HA SER 67 HA SER 67 -2.541 9.142 -1.242 426 HB2 SER 67 HB2 SER 67 0.231 9.602 -0.157 427 HB3 SER 67 HB1 SER 67 -1.056 10.790 -0.357 428 HG SER 67 HG SER 67 -1.154 8.542 1.387 429 H ASP 68 HN ASP 68 -0.037 7.138 -2.271 430 HA ASP 68 HA ASP 68 0.687 8.910 -4.502 431 HB2 ASP 68 HB2 ASP 68 2.427 7.715 -2.954 432 HB3 ASP 68 HB1 ASP 68 2.042 6.297 -3.920 433 H ASN 69 HN ASN 69 0.960 7.798 -6.643 434 HA ASN 69 HA ASN 69 -1.196 5.816 -7.010 435 HB2 ASN 69 HB2 ASN 69 -1.772 8.138 -7.770 436 HB3 ASN 69 HB1 ASN 69 -0.455 8.034 -8.932 437 HD21 ASN 69 HD21 ASN 69 -3.620 6.890 -8.069 438 HD22 ASN 69 HD22 ASN 69 -3.994 6.163 -9.594 439 H ASN 70 HN ASN 70 2.072 6.352 -7.264 440 HA ASN 70 HA ASN 70 2.501 5.017 -9.802 441 HB2 ASN 70 HB2 ASN 70 4.404 6.075 -7.710 442 HB3 ASN 70 HB1 ASN 70 4.938 5.249 -9.170 443 HD21 ASN 70 HD21 ASN 70 4.658 6.248 -11.169 444 HD22 ASN 70 HD22 ASN 70 4.363 7.947 -11.304 445 H VAL 71 HN VAL 71 1.526 3.004 -9.358 446 HA VAL 71 HA VAL 71 2.748 1.304 -7.349 447 HB VAL 71 HB VAL 71 1.033 -0.317 -7.991 448 HG11 VAL 71 HG11 VAL 71 -0.039 2.461 -7.541 449 HG12 VAL 71 HG12 VAL 71 0.500 1.330 -6.298 450 HG13 VAL 71 HG13 VAL 71 -0.931 0.964 -7.264 451 HG21 VAL 71 HG21 VAL 71 -0.713 0.280 -9.607 452 HG22 VAL 71 HG22 VAL 71 0.875 0.168 -10.365 453 HG23 VAL 71 HG23 VAL 71 0.178 1.748 -10.010 454 H SER 72 HN SER 72 3.614 -0.784 -7.891 455 HA SER 72 HA SER 72 5.059 -0.771 -10.427 456 HB2 SER 72 HB2 SER 72 6.433 -2.530 -9.396 457 HB3 SER 72 HB1 SER 72 6.324 -1.123 -8.334 458 HG SER 72 HG SER 72 5.550 -3.666 -7.881 459 H GLY 73 HN GLY 73 2.163 -1.752 -9.520 460 HA2 GLY 73 HA2 GLY 73 1.028 -3.200 -11.236 461 HA3 GLY 73 HA1 GLY 73 2.280 -4.370 -10.868 462 H VAL 74 HN VAL 74 2.304 -3.928 -8.014 463 HA VAL 74 HA VAL 74 -0.472 -4.405 -7.244 464 HB VAL 74 HB VAL 74 0.047 -6.250 -5.803 465 HG11 VAL 74 HG11 VAL 74 -0.618 -6.914 -7.961 466 HG12 VAL 74 HG12 VAL 74 0.739 -7.949 -7.513 467 HG13 VAL 74 HG13 VAL 74 0.982 -6.599 -8.633 468 HG21 VAL 74 HG21 VAL 74 2.375 -5.561 -5.288 469 HG22 VAL 74 HG22 VAL 74 2.861 -6.212 -6.852 470 HG23 VAL 74 HG23 VAL 74 2.183 -7.280 -5.624 471 H ILE 75 HN ILE 75 2.624 -3.062 -6.457 472 HA ILE 75 HA ILE 75 2.195 -2.946 -3.643 473 HB ILE 75 HB ILE 75 4.048 -1.396 -3.511 474 HG12 ILE 75 HG12 ILE 75 4.312 -1.497 -6.497 475 HG13 ILE 75 HG11 ILE 75 3.349 -0.258 -5.714 476 HG21 ILE 75 HG21 ILE 75 5.776 -2.798 -4.502 477 HG22 ILE 75 HG22 ILE 75 4.544 -3.637 -5.440 478 HG23 ILE 75 HG23 ILE 75 4.541 -3.748 -3.680 479 HD11 ILE 75 HD11 ILE 75 5.320 0.466 -4.459 480 HD12 ILE 75 HD12 ILE 75 5.573 0.553 -6.203 481 HD13 ILE 75 HD13 ILE 75 6.275 -0.772 -5.274 482 H ALA 76 HN ALA 76 2.350 -0.840 -2.519 483 HA ALA 76 HA ALA 76 0.876 1.352 -3.767 484 HB1 ALA 76 HB1 ALA 76 -0.622 1.528 -1.814 485 HB2 ALA 76 HB2 ALA 76 0.070 0.033 -1.166 486 HB3 ALA 76 HB3 ALA 76 -0.842 0.005 -2.680 487 H ILE 77 HN ILE 77 1.482 3.370 -2.924 488 HA ILE 77 HA ILE 77 3.665 3.262 -0.948 489 HB ILE 77 HB ILE 77 3.431 5.122 -3.317 490 HG12 ILE 77 HG12 ILE 77 5.409 2.909 -2.739 491 HG13 ILE 77 HG11 ILE 77 4.091 2.813 -3.900 492 HG21 ILE 77 HG21 ILE 77 5.580 4.924 -1.212 493 HG22 ILE 77 HG22 ILE 77 4.432 6.247 -1.407 494 HG23 ILE 77 HG23 ILE 77 5.644 5.942 -2.651 495 HD11 ILE 77 HD11 ILE 77 6.214 3.244 -4.993 496 HD12 ILE 77 HD12 ILE 77 6.423 4.710 -4.037 497 HD13 ILE 77 HD13 ILE 77 5.108 4.599 -5.206 498 H GLY 78 HN GLY 78 3.447 4.462 0.813 499 HA2 GLY 78 HA2 GLY 78 2.846 6.228 2.175 500 HA3 GLY 78 HA1 GLY 78 2.121 7.011 0.781 501 H CYS 79 HN CYS 79 1.531 3.950 2.484 502 HA CYS 79 HA CYS 79 -1.331 4.496 2.337 503 HB2 CYS 79 HB2 CYS 79 0.359 2.085 2.398 504 HB3 CYS 79 HB1 CYS 79 -1.150 1.969 3.287 505 H LEU 80 HN LEU 80 -2.595 4.794 4.042 506 HA LEU 80 HA LEU 80 -1.468 4.320 6.719 507 HB2 LEU 80 HB2 LEU 80 -3.849 5.989 5.907 508 HB3 LEU 80 HB1 LEU 80 -3.294 5.731 7.552 509 HG LEU 80 HG LEU 80 -1.719 7.140 5.395 510 HD11 LEU 80 HD11 LEU 80 -3.667 8.424 6.113 511 HD12 LEU 80 HD12 LEU 80 -2.170 9.163 6.681 512 HD13 LEU 80 HD13 LEU 80 -3.176 8.240 7.798 513 HD21 LEU 80 HD21 LEU 80 -0.232 7.763 7.260 514 HD22 LEU 80 HD22 LEU 80 -0.271 6.022 6.983 515 HD23 LEU 80 HD23 LEU 80 -1.167 6.718 8.333 516 HA PRO 81 HA PRO 81 -4.117 0.773 6.877 517 HB2 PRO 81 HB2 PRO 81 -3.793 0.897 9.782 518 HB3 PRO 81 HB1 PRO 81 -3.255 -0.340 8.651 519 HG2 PRO 81 HG2 PRO 81 -1.533 1.309 9.895 520 HG3 PRO 81 HG1 PRO 81 -1.245 0.704 8.255 521 HD2 PRO 81 HD2 PRO 81 -2.260 3.386 9.130 522 HD3 PRO 81 HD1 PRO 81 -1.114 2.981 7.844 523 H VAL 82 HN VAL 82 -6.245 0.897 6.691 524 HA VAL 82 HA VAL 82 -7.727 2.625 8.533 525 HB VAL 82 HB VAL 82 -9.495 2.611 6.715 526 HG11 VAL 82 HG11 VAL 82 -8.396 4.397 5.428 527 HG12 VAL 82 HG12 VAL 82 -6.848 3.931 6.135 528 HG13 VAL 82 HG13 VAL 82 -8.130 4.571 7.162 529 HG21 VAL 82 HG21 VAL 82 -7.196 1.659 5.031 530 HG22 VAL 82 HG22 VAL 82 -8.770 2.188 4.437 531 HG23 VAL 82 HG23 VAL 82 -8.642 0.732 5.427 532 H THR 83 HN THR 83 -9.620 1.892 9.393 533 HA THR 83 HA THR 83 -10.659 -0.726 8.773 534 HB THR 83 HB THR 83 -9.644 -0.202 11.577 535 HG1 THR 83 HG1 THR 83 -8.373 -1.186 9.387 536 HG21 THR 83 HG21 THR 83 -10.246 -2.528 11.988 537 HG22 THR 83 HG22 THR 83 -10.818 -2.687 10.329 538 HG23 THR 83 HG23 THR 83 -11.654 -1.614 11.450 539 H LEU 84 HN LEU 84 -12.781 -0.798 9.159 540 HA LEU 84 HA LEU 84 -14.880 -0.131 9.590 541 HB2 LEU 84 HB2 LEU 84 -13.539 0.876 12.074 542 HB3 LEU 84 HB1 LEU 84 -15.280 0.884 11.853 543 HG LEU 84 HG LEU 84 -13.530 -1.568 11.820 544 HD11 LEU 84 HD11 LEU 84 -15.410 -0.532 13.934 545 HD12 LEU 84 HD12 LEU 84 -13.651 -0.603 14.045 546 HD13 LEU 84 HD13 LEU 84 -14.591 -2.093 13.967 547 HD21 LEU 84 HD21 LEU 84 -15.468 -1.858 10.424 548 HD22 LEU 84 HD22 LEU 84 -16.518 -1.264 11.710 549 HD23 LEU 84 HD23 LEU 84 -15.657 -2.789 11.908 Start of MODEL 11 1 H1 GLY 1 HT1 GLY 1 -16.959 6.178 0.264 2 H2 GLY 1 HT2 GLY 1 -18.045 5.236 -0.626 3 H3 GLY 1 HT3 GLY 1 -18.233 6.916 -0.567 4 HA2 GLY 1 HA1 GLY 1 -17.298 6.251 -2.678 5 HA3 GLY 1 HA2 GLY 1 -16.173 7.233 -1.755 6 H SER 2 HN SER 2 -16.934 4.008 -2.872 7 HA SER 2 HA SER 2 -14.586 2.839 -1.694 8 HB2 SER 2 HB2 SER 2 -15.312 0.832 -3.080 9 HB3 SER 2 HB1 SER 2 -16.475 1.404 -1.885 10 HG SER 2 HG SER 2 -16.492 1.840 -4.689 11 H TRP 3 HN TRP 3 -13.222 4.543 -2.732 12 HA TRP 3 HA TRP 3 -11.607 3.280 -4.648 13 HB2 TRP 3 HB2 TRP 3 -13.285 3.997 -6.281 14 HB3 TRP 3 HB1 TRP 3 -13.157 5.655 -5.711 15 HD1 TRP 3 HD1 TRP 3 -11.157 7.113 -6.633 16 HE1 TRP 3 HE1 TRP 3 -9.353 6.713 -8.428 17 HE3 TRP 3 HE3 TRP 3 -11.808 2.103 -7.313 18 HZ2 TRP 3 HZ2 TRP 3 -8.347 4.548 -9.933 19 HZ3 TRP 3 HZ3 TRP 3 -10.386 0.931 -8.947 20 HH2 TRP 3 HH2 TRP 3 -8.691 2.133 -10.231 21 H GLY 4 HN GLY 4 -12.472 6.678 -3.948 22 HA2 GLY 4 HA2 GLY 4 -9.627 7.077 -3.265 23 HA3 GLY 4 HA1 GLY 4 -10.550 8.233 -4.207 24 H GLN 5 HN GLN 5 -12.923 7.726 -2.333 25 HA GLN 5 HA GLN 5 -12.478 9.997 -0.753 26 HB2 GLN 5 HB2 GLN 5 -14.568 7.837 -0.561 27 HB3 GLN 5 HB1 GLN 5 -14.565 9.263 0.465 28 HG2 GLN 5 HG2 GLN 5 -14.798 9.206 -2.530 29 HG3 GLN 5 HG1 GLN 5 -16.071 9.593 -1.376 30 HE21 GLN 5 HE21 GLN 5 -14.969 11.174 -3.567 31 HE22 GLN 5 HE22 GLN 5 -14.418 12.651 -2.857 32 H CYS 6 HN CYS 6 -11.131 10.185 0.784 33 HA CYS 6 HA CYS 6 -10.870 8.963 3.193 34 HB2 CYS 6 HB2 CYS 6 -10.398 6.806 2.271 35 HB3 CYS 6 HB1 CYS 6 -9.333 7.485 1.045 36 H SER 7 HN SER 7 -9.131 9.952 0.333 37 HA SER 7 HA SER 7 -8.046 12.268 1.562 38 HB2 SER 7 HB2 SER 7 -6.499 10.454 2.422 39 HB3 SER 7 HB1 SER 7 -6.041 10.140 0.750 40 HG SER 7 HG SER 7 -5.348 12.228 2.426 41 H THR 8 HN THR 8 -5.900 12.603 -0.290 42 HA THR 8 HA THR 8 -7.434 13.180 -2.670 43 HB THR 8 HB THR 8 -4.469 13.612 -2.284 44 HG1 THR 8 HG1 THR 8 -4.930 15.117 -0.867 45 HG21 THR 8 HG21 THR 8 -5.360 13.987 -4.548 46 HG22 THR 8 HG22 THR 8 -4.829 15.495 -3.803 47 HG23 THR 8 HG23 THR 8 -6.547 15.110 -3.887 48 H GLY 9 HN GLY 9 -5.786 10.511 -1.560 49 HA2 GLY 9 HA2 GLY 9 -4.672 9.766 -4.163 50 HA3 GLY 9 HA1 GLY 9 -4.319 8.986 -2.632 51 H SER 10 HN SER 10 -5.035 7.001 -2.559 52 HA SER 10 HA SER 10 -7.632 6.295 -3.696 53 HB2 SER 10 HB2 SER 10 -5.954 5.986 -5.508 54 HB3 SER 10 HB1 SER 10 -5.052 4.894 -4.460 55 HG SER 10 HG SER 10 -7.591 4.529 -5.642 56 H ILE 11 HN ILE 11 -8.459 4.287 -2.865 57 HA ILE 11 HA ILE 11 -7.104 3.399 -0.409 58 HB ILE 11 HB ILE 11 -9.948 2.885 -1.272 59 HG12 ILE 11 HG12 ILE 11 -8.801 4.808 0.752 60 HG13 ILE 11 HG11 ILE 11 -9.570 5.228 -0.773 61 HG21 ILE 11 HG21 ILE 11 -8.571 2.363 1.362 62 HG22 ILE 11 HG22 ILE 11 -9.048 1.136 0.190 63 HG23 ILE 11 HG23 ILE 11 -10.278 2.095 1.016 64 HD11 ILE 11 HD11 ILE 11 -11.652 4.191 0.052 65 HD12 ILE 11 HD12 ILE 11 -11.120 5.566 1.018 66 HD13 ILE 11 HD13 ILE 11 -10.850 3.922 1.599 67 H GLN 12 HN GLN 12 -6.568 1.310 -0.083 68 HA GLN 12 HA GLN 12 -7.269 -0.712 -2.025 69 HB2 GLN 12 HB2 GLN 12 -4.689 -1.336 -2.091 70 HB3 GLN 12 HB1 GLN 12 -5.442 -0.312 -3.292 71 HG2 GLN 12 HG2 GLN 12 -4.155 0.890 -0.886 72 HG3 GLN 12 HG1 GLN 12 -3.171 0.342 -2.235 73 HE21 GLN 12 HE21 GLN 12 -5.113 1.049 -4.272 74 HE22 GLN 12 HE22 GLN 12 -5.131 2.767 -4.365 75 H CYS 13 HN CYS 13 -6.428 -2.842 -1.476 76 HA CYS 13 HA CYS 13 -6.070 -3.136 1.430 77 HB2 CYS 13 HB2 CYS 13 -8.204 -4.044 0.923 78 HB3 CYS 13 HB1 CYS 13 -7.622 -4.827 -0.537 79 H CYS 14 HN CYS 14 -4.021 -3.532 1.773 80 HA CYS 14 HA CYS 14 -2.363 -4.680 -0.300 81 HB2 CYS 14 HB2 CYS 14 -1.734 -3.520 2.409 82 HB3 CYS 14 HB1 CYS 14 -0.514 -4.194 1.334 83 H GLN 15 HN GLN 15 -1.392 -6.582 -0.282 84 HA GLN 15 HA GLN 15 -2.235 -8.587 1.563 85 HB2 GLN 15 HB2 GLN 15 -1.633 -9.973 -0.100 86 HB3 GLN 15 HB1 GLN 15 -1.290 -8.540 -1.049 87 HG2 GLN 15 HG2 GLN 15 0.579 -9.923 -1.278 88 HG3 GLN 15 HG1 GLN 15 1.067 -8.663 -0.150 89 HE21 GLN 15 HE21 GLN 15 -1.031 -11.298 0.754 90 HE22 GLN 15 HE22 GLN 15 0.093 -12.095 1.793 91 H ASN 16 HN ASN 16 0.509 -6.497 1.143 92 HA ASN 16 HA ASN 16 1.579 -7.436 3.719 93 HB2 ASN 16 HB2 ASN 16 2.859 -7.933 1.319 94 HB3 ASN 16 HB1 ASN 16 3.591 -6.438 1.872 95 HD21 ASN 16 HD21 ASN 16 4.620 -9.174 1.631 96 HD22 ASN 16 HD22 ASN 16 5.280 -9.544 3.190 97 H VAL 17 HN VAL 17 1.270 -5.719 5.012 98 HA VAL 17 HA VAL 17 1.889 -3.053 3.951 99 HB VAL 17 HB VAL 17 0.468 -3.811 6.512 100 HG11 VAL 17 HG11 VAL 17 0.002 -1.407 6.729 101 HG12 VAL 17 HG12 VAL 17 1.018 -1.090 5.322 102 HG13 VAL 17 HG13 VAL 17 1.732 -1.748 6.795 103 HG21 VAL 17 HG21 VAL 17 -0.552 -2.580 3.956 104 HG22 VAL 17 HG22 VAL 17 -1.502 -2.843 5.418 105 HG23 VAL 17 HG23 VAL 17 -0.866 -4.221 4.519 106 H VAL 18 HN VAL 18 3.962 -2.613 4.137 107 HA VAL 18 HA VAL 18 5.259 -3.053 6.735 108 HB VAL 18 HB VAL 18 7.379 -3.624 5.504 109 HG11 VAL 18 HG11 VAL 18 5.074 -5.541 5.178 110 HG12 VAL 18 HG12 VAL 18 6.076 -5.350 6.616 111 HG13 VAL 18 HG13 VAL 18 6.782 -5.973 5.124 112 HG21 VAL 18 HG21 VAL 18 5.492 -3.982 3.178 113 HG22 VAL 18 HG22 VAL 18 7.179 -4.491 3.219 114 HG23 VAL 18 HG23 VAL 18 6.772 -2.777 3.307 115 HA PRO 19 HA PRO 19 6.629 1.172 6.211 116 HB2 PRO 19 HB2 PRO 19 8.956 0.273 7.790 117 HB3 PRO 19 HB1 PRO 19 7.834 1.599 8.103 118 HG2 PRO 19 HG2 PRO 19 7.742 -0.657 9.534 119 HG3 PRO 19 HG1 PRO 19 6.268 0.224 9.096 120 HD2 PRO 19 HD2 PRO 19 7.406 -2.275 7.919 121 HD3 PRO 19 HD1 PRO 19 5.711 -1.833 8.215 122 H GLY 20 HN GLY 20 7.886 2.143 4.718 123 HA2 GLY 20 HA2 GLY 20 9.237 0.554 2.817 124 HA3 GLY 20 HA1 GLY 20 9.272 2.307 2.896 125 H ASP 21 HN ASP 21 10.357 2.189 5.674 126 HA ASP 21 HA ASP 21 13.141 1.595 4.958 127 HB2 ASP 21 HB2 ASP 21 12.653 3.862 5.776 128 HB3 ASP 21 HB1 ASP 21 12.023 3.183 7.265 129 H SER 22 HN SER 22 10.686 -0.037 6.200 130 HA SER 22 HA SER 22 11.826 -1.266 8.498 131 HB2 SER 22 HB2 SER 22 9.462 -1.518 8.164 132 HB3 SER 22 HB1 SER 22 9.689 -2.166 6.550 133 HG SER 22 HG SER 22 10.025 -3.386 9.047 134 H ASP 23 HN ASP 23 12.757 -3.391 8.600 135 HA ASP 23 HA ASP 23 14.795 -3.904 6.777 136 HB2 ASP 23 HB2 ASP 23 13.346 -5.745 8.691 137 HB3 ASP 23 HB1 ASP 23 14.740 -6.258 7.751 138 H LEU 24 HN LEU 24 11.536 -5.217 6.977 139 HA LEU 24 HA LEU 24 11.786 -6.880 4.677 140 HB2 LEU 24 HB2 LEU 24 9.682 -6.129 6.566 141 HB3 LEU 24 HB1 LEU 24 9.101 -6.410 4.937 142 HG LEU 24 HG LEU 24 8.948 -8.425 6.302 143 HD11 LEU 24 HD11 LEU 24 9.397 -8.511 3.840 144 HD12 LEU 24 HD12 LEU 24 9.919 -9.939 4.734 145 HD13 LEU 24 HD13 LEU 24 11.105 -8.739 4.223 146 HD21 LEU 24 HD21 LEU 24 10.804 -7.995 7.822 147 HD22 LEU 24 HD22 LEU 24 11.949 -8.219 6.499 148 HD23 LEU 24 HD23 LEU 24 10.970 -9.575 7.056 149 H GLY 25 HN GLY 25 10.025 -3.835 5.232 150 HA2 GLY 25 HA2 GLY 25 9.074 -3.461 2.656 151 HA3 GLY 25 HA1 GLY 25 9.400 -2.161 3.792 152 H THR 26 HN THR 26 12.182 -2.489 4.005 153 HA THR 26 HA THR 26 13.012 -1.009 1.738 154 HB THR 26 HB THR 26 14.630 -2.265 3.965 155 HG1 THR 26 HG1 THR 26 13.086 -0.034 3.762 156 HG21 THR 26 HG21 THR 26 16.017 -1.844 1.967 157 HG22 THR 26 HG22 THR 26 16.436 -0.782 3.312 158 HG23 THR 26 HG23 THR 26 15.475 -0.164 1.969 159 H LEU 27 HN LEU 27 13.429 -4.356 2.754 160 HA LEU 27 HA LEU 27 15.163 -5.102 0.638 161 HB2 LEU 27 HB2 LEU 27 14.708 -6.322 2.850 162 HB3 LEU 27 HB1 LEU 27 13.253 -6.928 2.093 163 HG LEU 27 HG LEU 27 15.243 -8.490 2.123 164 HD11 LEU 27 HD11 LEU 27 14.864 -9.314 -0.146 165 HD12 LEU 27 HD12 LEU 27 14.044 -7.807 -0.554 166 HD13 LEU 27 HD13 LEU 27 13.354 -8.887 0.659 167 HD21 LEU 27 HD21 LEU 27 16.969 -8.172 0.461 168 HD22 LEU 27 HD22 LEU 27 16.943 -6.805 1.575 169 HD23 LEU 27 HD23 LEU 27 16.245 -6.643 -0.037 170 H LEU 28 HN LEU 28 11.688 -4.953 1.052 171 HA LEU 28 HA LEU 28 11.007 -6.450 -1.255 172 HB2 LEU 28 HB2 LEU 28 9.367 -4.336 0.147 173 HB3 LEU 28 HB1 LEU 28 8.764 -5.532 -0.979 174 HG LEU 28 HG LEU 28 9.660 -5.910 1.860 175 HD11 LEU 28 HD11 LEU 28 7.225 -6.825 0.344 176 HD12 LEU 28 HD12 LEU 28 7.310 -5.410 1.391 177 HD13 LEU 28 HD13 LEU 28 7.524 -7.022 2.072 178 HD21 LEU 28 HD21 LEU 28 10.873 -7.594 0.660 179 HD22 LEU 28 HD22 LEU 28 9.422 -8.061 -0.233 180 HD23 LEU 28 HD23 LEU 28 9.519 -8.340 1.506 181 H LEU 29 HN LEU 29 11.265 -2.951 -0.644 182 HA LEU 29 HA LEU 29 10.617 -2.354 -3.377 183 HB2 LEU 29 HB2 LEU 29 11.068 -0.031 -2.783 184 HB3 LEU 29 HB1 LEU 29 9.958 -0.787 -1.673 185 HG LEU 29 HG LEU 29 11.970 -1.064 -0.111 186 HD11 LEU 29 HD11 LEU 29 13.776 0.563 -0.410 187 HD12 LEU 29 HD12 LEU 29 13.116 1.002 -1.987 188 HD13 LEU 29 HD13 LEU 29 13.751 -0.621 -1.717 189 HD21 LEU 29 HD21 LEU 29 10.873 1.635 -0.843 190 HD22 LEU 29 HD22 LEU 29 11.769 1.293 0.639 191 HD23 LEU 29 HD23 LEU 29 10.222 0.500 0.341 192 H ASP 30 HN ASP 30 13.519 -2.981 -1.621 193 HA ASP 30 HA ASP 30 15.333 -1.854 -3.496 194 HB2 ASP 30 HB2 ASP 30 15.947 -2.577 -1.178 195 HB3 ASP 30 HB1 ASP 30 15.798 -4.246 -1.704 196 H GLU 31 HN GLU 31 13.600 -4.841 -3.239 197 HA GLU 31 HA GLU 31 14.866 -6.249 -5.342 198 HB2 GLU 31 HB2 GLU 31 13.314 -7.066 -3.419 199 HB3 GLU 31 HB1 GLU 31 12.001 -6.591 -4.487 200 HG2 GLU 31 HG2 GLU 31 12.877 -8.098 -6.202 201 HG3 GLU 31 HG1 GLU 31 14.152 -8.569 -5.082 202 H LEU 32 HN LEU 32 12.562 -3.754 -5.098 203 HA LEU 32 HA LEU 32 11.520 -4.141 -7.794 204 HB2 LEU 32 HB2 LEU 32 10.694 -2.436 -5.463 205 HB3 LEU 32 HB1 LEU 32 9.939 -2.301 -7.038 206 HG LEU 32 HG LEU 32 9.947 -4.753 -5.275 207 HD11 LEU 32 HD11 LEU 32 7.715 -2.871 -6.024 208 HD12 LEU 32 HD12 LEU 32 8.514 -2.950 -4.454 209 HD13 LEU 32 HD13 LEU 32 7.568 -4.321 -5.032 210 HD21 LEU 32 HD21 LEU 32 9.970 -5.398 -7.608 211 HD22 LEU 32 HD22 LEU 32 8.662 -4.269 -7.961 212 HD23 LEU 32 HD23 LEU 32 8.366 -5.667 -6.928 213 H GLY 33 HN GLY 33 13.810 -2.282 -6.107 214 HA2 GLY 33 HA2 GLY 33 15.316 -0.734 -6.922 215 HA3 GLY 33 HA1 GLY 33 14.494 -0.804 -8.473 216 H ILE 34 HN ILE 34 12.875 -0.074 -5.441 217 HA ILE 34 HA ILE 34 12.081 2.507 -6.580 218 HB ILE 34 HB ILE 34 11.027 1.222 -4.058 219 HG12 ILE 34 HG12 ILE 34 9.867 1.055 -6.854 220 HG13 ILE 34 HG11 ILE 34 10.707 -0.260 -6.040 221 HG21 ILE 34 HG21 ILE 34 9.881 3.347 -5.860 222 HG22 ILE 34 HG22 ILE 34 10.597 3.609 -4.270 223 HG23 ILE 34 HG23 ILE 34 9.104 2.683 -4.424 224 HD11 ILE 34 HD11 ILE 34 8.985 -0.294 -4.320 225 HD12 ILE 34 HD12 ILE 34 8.301 -0.533 -5.927 226 HD13 ILE 34 HD13 ILE 34 8.150 1.032 -5.129 227 H VAL 35 HN VAL 35 12.550 4.452 -5.642 228 HA VAL 35 HA VAL 35 14.068 4.404 -3.118 229 HB VAL 35 HB VAL 35 14.506 6.366 -5.378 230 HG11 VAL 35 HG11 VAL 35 16.475 7.036 -4.057 231 HG12 VAL 35 HG12 VAL 35 15.973 5.930 -2.778 232 HG13 VAL 35 HG13 VAL 35 14.961 7.312 -3.196 233 HG21 VAL 35 HG21 VAL 35 15.297 4.139 -6.006 234 HG22 VAL 35 HG22 VAL 35 16.232 4.044 -4.514 235 HG23 VAL 35 HG23 VAL 35 16.646 5.241 -5.740 236 H LEU 36 HN LEU 36 12.539 5.032 -1.704 237 HA LEU 36 HA LEU 36 10.469 6.878 -2.373 238 HB2 LEU 36 HB2 LEU 36 11.346 5.835 0.313 239 HB3 LEU 36 HB1 LEU 36 9.835 6.650 -0.024 240 HG LEU 36 HG LEU 36 10.595 4.059 -1.346 241 HD11 LEU 36 HD11 LEU 36 10.623 3.709 1.038 242 HD12 LEU 36 HD12 LEU 36 9.185 2.967 0.335 243 HD13 LEU 36 HD13 LEU 36 9.054 4.498 1.202 244 HD21 LEU 36 HD21 LEU 36 8.849 5.343 -2.441 245 HD22 LEU 36 HD22 LEU 36 7.973 5.478 -0.918 246 HD23 LEU 36 HD23 LEU 36 8.169 3.902 -1.684 247 H GLU 37 HN GLU 37 10.366 8.997 -2.085 248 HA GLU 37 HA GLU 37 12.591 10.554 -1.246 249 HB2 GLU 37 HB2 GLU 37 10.847 11.288 -2.880 250 HB3 GLU 37 HB1 GLU 37 9.694 11.373 -1.561 251 HG2 GLU 37 HG2 GLU 37 10.533 13.570 -2.113 252 HG3 GLU 37 HG1 GLU 37 11.036 13.096 -0.491 253 H ASP 38 HN ASP 38 9.802 9.196 0.282 254 HA ASP 38 HA ASP 38 10.743 10.198 2.870 255 HB2 ASP 38 HB2 ASP 38 7.859 9.761 2.039 256 HB3 ASP 38 HB1 ASP 38 8.395 10.190 3.657 257 HA PRO 39 HA PRO 39 10.910 5.627 2.734 258 HB2 PRO 39 HB2 PRO 39 12.929 5.368 4.524 259 HB3 PRO 39 HB1 PRO 39 13.209 5.750 2.822 260 HG2 PRO 39 HG2 PRO 39 13.132 7.586 5.188 261 HG3 PRO 39 HG1 PRO 39 14.279 7.552 3.835 262 HD2 PRO 39 HD2 PRO 39 12.224 9.310 3.959 263 HD3 PRO 39 HD1 PRO 39 12.837 8.670 2.422 264 H THR 40 HN THR 40 9.624 7.725 4.808 265 HA THR 40 HA THR 40 9.390 5.866 7.069 266 HB THR 40 HB THR 40 8.230 7.872 8.154 267 HG1 THR 40 HG1 THR 40 7.893 9.490 6.837 268 HG21 THR 40 HG21 THR 40 10.532 7.219 8.689 269 HG22 THR 40 HG22 THR 40 10.357 8.974 8.677 270 HG23 THR 40 HG23 THR 40 11.120 8.154 7.314 271 H VAL 41 HN VAL 41 7.915 6.162 4.271 272 HA VAL 41 HA VAL 41 5.169 6.185 5.235 273 HB VAL 41 HB VAL 41 4.499 6.091 2.909 274 HG11 VAL 41 HG11 VAL 41 5.430 8.220 2.143 275 HG12 VAL 41 HG12 VAL 41 6.687 8.104 3.375 276 HG13 VAL 41 HG13 VAL 41 4.997 8.266 3.852 277 HG21 VAL 41 HG21 VAL 41 6.113 6.099 1.086 278 HG22 VAL 41 HG22 VAL 41 6.260 4.631 2.052 279 HG23 VAL 41 HG23 VAL 41 7.434 5.934 2.244 280 H LEU 42 HN LEU 42 3.704 4.492 4.771 281 HA LEU 42 HA LEU 42 4.883 1.851 4.971 282 HB2 LEU 42 HB2 LEU 42 2.010 2.784 5.017 283 HB3 LEU 42 HB1 LEU 42 2.504 1.116 5.217 284 HG LEU 42 HG LEU 42 3.234 3.380 7.079 285 HD11 LEU 42 HD11 LEU 42 1.697 2.293 8.646 286 HD12 LEU 42 HD12 LEU 42 1.239 1.142 7.392 287 HD13 LEU 42 HD13 LEU 42 0.864 2.853 7.197 288 HD21 LEU 42 HD21 LEU 42 4.937 1.667 7.053 289 HD22 LEU 42 HD22 LEU 42 3.718 0.411 7.258 290 HD23 LEU 42 HD23 LEU 42 4.017 1.571 8.553 291 H ILE 43 HN ILE 43 5.154 0.522 3.323 292 HA ILE 43 HA ILE 43 3.743 1.140 0.827 293 HB ILE 43 HB ILE 43 5.461 -0.396 -0.244 294 HG12 ILE 43 HG12 ILE 43 7.029 0.193 2.269 295 HG13 ILE 43 HG11 ILE 43 6.255 -1.353 1.945 296 HG21 ILE 43 HG21 ILE 43 5.478 2.012 -0.537 297 HG22 ILE 43 HG22 ILE 43 7.124 1.395 -0.417 298 HG23 ILE 43 HG23 ILE 43 6.385 2.207 0.962 299 HD11 ILE 43 HD11 ILE 43 7.643 -1.686 0.006 300 HD12 ILE 43 HD12 ILE 43 8.653 -1.342 1.410 301 HD13 ILE 43 HD13 ILE 43 8.355 -0.087 0.207 302 H GLY 44 HN GLY 44 2.620 -0.443 -0.251 303 HA2 GLY 44 HA2 GLY 44 2.003 -2.779 1.436 304 HA3 GLY 44 HA1 GLY 44 0.802 -1.906 0.514 305 H ASP 45 HN ASP 45 2.944 -4.504 0.537 306 HA ASP 45 HA ASP 45 3.091 -4.908 -2.308 307 HB2 ASP 45 HB2 ASP 45 4.582 -6.000 -0.465 308 HB3 ASP 45 HB1 ASP 45 3.251 -7.116 -0.275 309 H GLY 46 HN GLY 46 1.771 -6.232 -3.556 310 HA2 GLY 46 HA2 GLY 46 -0.121 -7.425 -4.141 311 HA3 GLY 46 HA1 GLY 46 -0.107 -8.030 -2.516 312 H CYS 47 HN CYS 47 -0.659 -4.772 -3.848 313 HA CYS 47 HA CYS 47 -2.962 -4.622 -2.022 314 HB2 CYS 47 HB2 CYS 47 -0.778 -3.045 -2.021 315 HB3 CYS 47 HB1 CYS 47 -1.813 -2.153 -3.136 316 H ASP 48 HN ASP 48 -4.786 -4.889 -3.034 317 HA ASP 48 HA ASP 48 -5.130 -3.725 -5.695 318 HB2 ASP 48 HB2 ASP 48 -5.763 -5.950 -5.788 319 HB3 ASP 48 HB1 ASP 48 -6.613 -5.896 -4.251 320 HA PRO 49 HA PRO 49 -7.326 -0.231 -4.225 321 HB2 PRO 49 HB2 PRO 49 -8.899 -0.595 -6.711 322 HB3 PRO 49 HB1 PRO 49 -7.985 0.798 -6.159 323 HG2 PRO 49 HG2 PRO 49 -7.093 -0.767 -8.137 324 HG3 PRO 49 HG1 PRO 49 -5.991 -0.003 -6.979 325 HD2 PRO 49 HD2 PRO 49 -6.881 -2.846 -7.150 326 HD3 PRO 49 HD1 PRO 49 -5.337 -2.169 -6.614 327 H ILE 50 HN ILE 50 -8.915 -0.240 -2.733 328 HA ILE 50 HA ILE 50 -10.924 -2.318 -2.795 329 HB ILE 50 HB ILE 50 -10.724 -0.002 -0.857 330 HG12 ILE 50 HG12 ILE 50 -9.665 -2.829 -0.635 331 HG13 ILE 50 HG11 ILE 50 -8.692 -1.371 -0.791 332 HG21 ILE 50 HG21 ILE 50 -12.150 -2.652 -0.642 333 HG22 ILE 50 HG22 ILE 50 -12.926 -1.101 -0.975 334 HG23 ILE 50 HG23 ILE 50 -12.128 -1.375 0.575 335 HD11 ILE 50 HD11 ILE 50 -8.717 -2.135 1.498 336 HD12 ILE 50 HD12 ILE 50 -10.479 -2.079 1.519 337 HD13 ILE 50 HD13 ILE 50 -9.552 -0.588 1.365 338 H THR 51 HN THR 51 -12.047 -1.860 -4.630 339 HA THR 51 HA THR 51 -13.594 0.635 -4.637 340 HB THR 51 HB THR 51 -12.178 0.321 -6.614 341 HG1 THR 51 HG1 THR 51 -14.286 1.323 -6.809 342 HG21 THR 51 HG21 THR 51 -12.052 -2.090 -6.689 343 HG22 THR 51 HG22 THR 51 -12.664 -1.477 -8.226 344 HG23 THR 51 HG23 THR 51 -13.774 -2.198 -7.058 345 H VAL 52 HN VAL 52 -13.936 -2.081 -3.304 346 HA VAL 52 HA VAL 52 -16.759 -2.406 -3.996 347 HB VAL 52 HB VAL 52 -15.552 -4.307 -4.947 348 HG11 VAL 52 HG11 VAL 52 -14.505 -4.753 -2.153 349 HG12 VAL 52 HG12 VAL 52 -13.561 -4.284 -3.568 350 HG13 VAL 52 HG13 VAL 52 -14.319 -5.875 -3.500 351 HG21 VAL 52 HG21 VAL 52 -16.727 -6.125 -3.812 352 HG22 VAL 52 HG22 VAL 52 -17.761 -4.712 -4.026 353 HG23 VAL 52 HG23 VAL 52 -17.053 -5.055 -2.448 354 H ALA 53 HN ALA 53 -18.106 -2.743 -2.234 355 HA ALA 53 HA ALA 53 -16.852 -2.359 0.399 356 HB1 ALA 53 HB1 ALA 53 -19.018 -1.478 1.128 357 HB2 ALA 53 HB2 ALA 53 -19.676 -1.762 -0.482 358 HB3 ALA 53 HB3 ALA 53 -18.390 -0.579 -0.252 359 H GLY 54 HN GLY 54 -19.677 -3.942 -1.087 360 HA2 GLY 54 HA2 GLY 54 -20.752 -5.905 -0.608 361 HA3 GLY 54 HA1 GLY 54 -19.147 -6.523 -0.241 362 H SER 55 HN SER 55 -19.145 -7.508 1.631 363 HA SER 55 HA SER 55 -20.508 -6.191 3.891 364 HB2 SER 55 HB2 SER 55 -21.641 -8.298 3.169 365 HB3 SER 55 HB1 SER 55 -20.152 -9.174 3.506 366 HG SER 55 HG SER 55 -22.095 -8.561 5.186 367 H SER 56 HN SER 56 -18.218 -8.896 3.529 368 HA SER 56 HA SER 56 -16.235 -7.345 5.046 369 HB2 SER 56 HB2 SER 56 -16.806 -10.297 5.394 370 HB3 SER 56 HB1 SER 56 -15.577 -9.370 6.252 371 HG SER 56 HG SER 56 -17.862 -9.783 7.180 372 H ASP 57 HN ASP 57 -16.735 -7.918 2.191 373 HA ASP 57 HA ASP 57 -14.369 -9.526 1.516 374 HB2 ASP 57 HB2 ASP 57 -15.453 -9.740 -0.732 375 HB3 ASP 57 HB1 ASP 57 -16.376 -10.461 0.581 376 H ALA 58 HN ALA 58 -14.540 -6.606 2.242 377 HA ALA 58 HA ALA 58 -13.859 -5.272 -0.237 378 HB1 ALA 58 HB1 ALA 58 -15.180 -4.079 1.441 379 HB2 ALA 58 HB2 ALA 58 -13.652 -3.257 1.122 380 HB3 ALA 58 HB3 ALA 58 -13.847 -4.219 2.587 381 H CYS 59 HN CYS 59 -12.311 -6.914 2.281 382 HA CYS 59 HA CYS 59 -9.739 -6.522 1.050 383 HB2 CYS 59 HB2 CYS 59 -9.864 -4.564 2.531 384 HB3 CYS 59 HB1 CYS 59 -10.187 -5.620 3.903 385 H SER 60 HN SER 60 -8.423 -8.242 1.367 386 HA SER 60 HA SER 60 -9.489 -10.378 3.069 387 HB2 SER 60 HB2 SER 60 -7.911 -11.782 1.530 388 HB3 SER 60 HB1 SER 60 -9.453 -11.205 0.896 389 HG SER 60 HG SER 60 -6.890 -10.545 0.165 390 H ALA 61 HN ALA 61 -6.761 -8.297 2.633 391 HA ALA 61 HA ALA 61 -5.291 -9.876 4.637 392 HB1 ALA 61 HB1 ALA 61 -3.200 -8.988 3.737 393 HB2 ALA 61 HB2 ALA 61 -4.102 -8.091 2.514 394 HB3 ALA 61 HB3 ALA 61 -4.111 -9.855 2.500 395 H THR 62 HN THR 62 -4.703 -6.534 3.536 396 HA THR 62 HA THR 62 -5.523 -5.569 6.186 397 HB THR 62 HB THR 62 -2.892 -4.769 4.939 398 HG1 THR 62 HG1 THR 62 -3.523 -6.795 6.829 399 HG21 THR 62 HG21 THR 62 -2.432 -3.886 7.192 400 HG22 THR 62 HG22 THR 62 -4.046 -4.378 7.703 401 HG23 THR 62 HG23 THR 62 -3.855 -3.131 6.471 402 H ALA 63 HN ALA 63 -6.612 -3.683 6.105 403 HA ALA 63 HA ALA 63 -7.040 -2.481 3.498 404 HB1 ALA 63 HB1 ALA 63 -8.973 -2.955 4.916 405 HB2 ALA 63 HB2 ALA 63 -8.830 -1.223 4.602 406 HB3 ALA 63 HB3 ALA 63 -8.331 -1.881 6.160 407 H VAL 64 HN VAL 64 -6.178 -0.638 2.813 408 HA VAL 64 HA VAL 64 -5.056 1.246 4.741 409 HB VAL 64 HB VAL 64 -3.004 1.435 3.224 410 HG11 VAL 64 HG11 VAL 64 -1.824 -0.376 4.407 411 HG12 VAL 64 HG12 VAL 64 -3.377 -1.032 4.923 412 HG13 VAL 64 HG13 VAL 64 -2.859 0.557 5.488 413 HG21 VAL 64 HG21 VAL 64 -3.970 -1.305 2.427 414 HG22 VAL 64 HG22 VAL 64 -2.389 -0.623 2.037 415 HG23 VAL 64 HG23 VAL 64 -3.854 0.110 1.377 416 H CYS 65 HN CYS 65 -4.116 3.165 3.479 417 HA CYS 65 HA CYS 65 -5.729 3.832 1.130 418 HB2 CYS 65 HB2 CYS 65 -6.908 4.555 3.223 419 HB3 CYS 65 HB1 CYS 65 -5.520 5.551 3.613 420 H CYS 66 HN CYS 66 -4.152 4.304 -0.337 421 HA CYS 66 HA CYS 66 -1.636 5.414 0.638 422 HB2 CYS 66 HB2 CYS 66 -2.446 3.834 -1.721 423 HB3 CYS 66 HB1 CYS 66 -1.144 4.988 -1.973 424 H SER 67 HN SER 67 -0.803 7.292 0.137 425 HA SER 67 HA SER 67 -2.501 9.289 -1.073 426 HB2 SER 67 HB2 SER 67 -1.323 9.861 0.973 427 HB3 SER 67 HB1 SER 67 0.218 9.442 0.233 428 HG SER 67 HG SER 67 0.306 11.359 -0.585 429 H ASP 68 HN ASP 68 0.148 7.309 -1.962 430 HA ASP 68 HA ASP 68 0.659 8.940 -4.347 431 HB2 ASP 68 HB2 ASP 68 2.296 6.959 -2.840 432 HB3 ASP 68 HB1 ASP 68 2.542 7.065 -4.580 433 H ASN 69 HN ASN 69 0.240 8.232 -6.345 434 HA ASN 69 HA ASN 69 -1.282 5.735 -6.567 435 HB2 ASN 69 HB2 ASN 69 -1.074 8.084 -8.468 436 HB3 ASN 69 HB1 ASN 69 -2.089 6.666 -8.713 437 HD21 ASN 69 HD21 ASN 69 -3.969 6.442 -7.538 438 HD22 ASN 69 HD22 ASN 69 -4.641 7.735 -6.606 439 H ASN 70 HN ASN 70 1.770 6.862 -6.984 440 HA ASN 70 HA ASN 70 2.481 5.603 -9.452 441 HB2 ASN 70 HB2 ASN 70 3.726 7.534 -8.548 442 HB3 ASN 70 HB1 ASN 70 4.239 6.555 -7.179 443 HD21 ASN 70 HD21 ASN 70 4.008 5.420 -10.493 444 HD22 ASN 70 HD22 ASN 70 5.705 5.188 -10.722 445 H VAL 71 HN VAL 71 1.851 3.456 -9.326 446 HA VAL 71 HA VAL 71 3.030 1.826 -7.196 447 HB VAL 71 HB VAL 71 1.357 0.141 -7.836 448 HG11 VAL 71 HG11 VAL 71 -0.615 1.328 -6.975 449 HG12 VAL 71 HG12 VAL 71 0.219 2.862 -7.230 450 HG13 VAL 71 HG13 VAL 71 0.844 1.702 -6.056 451 HG21 VAL 71 HG21 VAL 71 0.330 2.251 -9.725 452 HG22 VAL 71 HG22 VAL 71 -0.466 0.720 -9.359 453 HG23 VAL 71 HG23 VAL 71 1.092 0.729 -10.187 454 H SER 72 HN SER 72 3.919 -0.235 -7.743 455 HA SER 72 HA SER 72 5.439 -0.201 -10.205 456 HB2 SER 72 HB2 SER 72 6.575 -2.163 -9.226 457 HB3 SER 72 HB1 SER 72 6.515 -0.821 -8.079 458 HG SER 72 HG SER 72 5.722 -3.224 -7.618 459 H GLY 73 HN GLY 73 2.438 -1.229 -9.351 460 HA2 GLY 73 HA2 GLY 73 1.237 -2.286 -11.284 461 HA3 GLY 73 HA1 GLY 73 2.490 -3.510 -11.215 462 H VAL 74 HN VAL 74 2.563 -3.580 -8.291 463 HA VAL 74 HA VAL 74 -0.141 -4.536 -7.708 464 HB VAL 74 HB VAL 74 0.592 -6.581 -6.755 465 HG11 VAL 74 HG11 VAL 74 1.866 -6.115 -9.446 466 HG12 VAL 74 HG12 VAL 74 0.242 -6.720 -9.117 467 HG13 VAL 74 HG13 VAL 74 1.646 -7.708 -8.716 468 HG21 VAL 74 HG21 VAL 74 2.645 -5.888 -5.727 469 HG22 VAL 74 HG22 VAL 74 3.399 -5.654 -7.303 470 HG23 VAL 74 HG23 VAL 74 2.962 -7.277 -6.767 471 H ILE 75 HN ILE 75 2.555 -2.761 -6.678 472 HA ILE 75 HA ILE 75 1.947 -3.148 -3.855 473 HB ILE 75 HB ILE 75 3.825 -1.735 -3.344 474 HG12 ILE 75 HG12 ILE 75 4.332 -1.397 -6.291 475 HG13 ILE 75 HG11 ILE 75 3.406 -0.234 -5.361 476 HG21 ILE 75 HG21 ILE 75 5.623 -3.028 -4.368 477 HG22 ILE 75 HG22 ILE 75 4.470 -3.693 -5.522 478 HG23 ILE 75 HG23 ILE 75 4.302 -4.047 -3.802 479 HD11 ILE 75 HD11 ILE 75 6.250 -1.031 -4.832 480 HD12 ILE 75 HD12 ILE 75 5.321 0.156 -3.916 481 HD13 ILE 75 HD13 ILE 75 5.718 0.460 -5.607 482 H ALA 76 HN ALA 76 2.234 -1.009 -2.606 483 HA ALA 76 HA ALA 76 0.827 1.245 -3.827 484 HB1 ALA 76 HB1 ALA 76 -0.912 -0.063 -2.722 485 HB2 ALA 76 HB2 ALA 76 -0.643 1.457 -1.864 486 HB3 ALA 76 HB3 ALA 76 0.017 -0.055 -1.219 487 H ILE 77 HN ILE 77 1.512 3.243 -2.987 488 HA ILE 77 HA ILE 77 3.670 3.077 -0.987 489 HB ILE 77 HB ILE 77 3.528 4.886 -3.402 490 HG12 ILE 77 HG12 ILE 77 5.421 2.634 -2.695 491 HG13 ILE 77 HG11 ILE 77 4.155 2.565 -3.915 492 HG21 ILE 77 HG21 ILE 77 4.502 6.059 -1.507 493 HG22 ILE 77 HG22 ILE 77 5.740 5.688 -2.708 494 HG23 ILE 77 HG23 ILE 77 5.622 4.722 -1.237 495 HD11 ILE 77 HD11 ILE 77 6.572 4.351 -3.971 496 HD12 ILE 77 HD12 ILE 77 5.298 4.303 -5.189 497 HD13 ILE 77 HD13 ILE 77 6.325 2.893 -4.930 498 H GLY 78 HN GLY 78 3.449 4.314 0.762 499 HA2 GLY 78 HA2 GLY 78 2.896 6.161 2.054 500 HA3 GLY 78 HA1 GLY 78 2.170 6.897 0.637 501 H CYS 79 HN CYS 79 1.564 3.886 2.416 502 HA CYS 79 HA CYS 79 -1.289 4.472 2.248 503 HB2 CYS 79 HB2 CYS 79 0.360 2.040 2.266 504 HB3 CYS 79 HB1 CYS 79 -1.136 1.927 3.179 505 H LEU 80 HN LEU 80 -2.493 4.930 3.936 506 HA LEU 80 HA LEU 80 -1.418 4.437 6.627 507 HB2 LEU 80 HB2 LEU 80 -3.750 6.147 5.758 508 HB3 LEU 80 HB1 LEU 80 -3.178 5.946 7.407 509 HG LEU 80 HG LEU 80 -1.606 7.218 5.162 510 HD11 LEU 80 HD11 LEU 80 -2.970 8.439 7.557 511 HD12 LEU 80 HD12 LEU 80 -3.476 8.605 5.877 512 HD13 LEU 80 HD13 LEU 80 -1.942 9.296 6.409 513 HD21 LEU 80 HD21 LEU 80 -0.161 6.097 6.760 514 HD22 LEU 80 HD22 LEU 80 -0.983 6.902 8.096 515 HD23 LEU 80 HD23 LEU 80 -0.039 7.845 6.944 516 HA PRO 81 HA PRO 81 -4.129 0.950 6.953 517 HB2 PRO 81 HB2 PRO 81 -4.009 1.412 9.857 518 HB3 PRO 81 HB1 PRO 81 -3.484 0.011 8.927 519 HG2 PRO 81 HG2 PRO 81 -1.725 1.691 10.049 520 HG3 PRO 81 HG1 PRO 81 -1.404 0.908 8.493 521 HD2 PRO 81 HD2 PRO 81 -2.284 3.712 9.053 522 HD3 PRO 81 HD1 PRO 81 -1.135 3.115 7.850 523 H VAL 82 HN VAL 82 -6.264 0.926 6.712 524 HA VAL 82 HA VAL 82 -7.891 2.801 8.265 525 HB VAL 82 HB VAL 82 -9.465 2.768 6.304 526 HG11 VAL 82 HG11 VAL 82 -8.056 4.696 6.793 527 HG12 VAL 82 HG12 VAL 82 -8.240 4.479 5.054 528 HG13 VAL 82 HG13 VAL 82 -6.747 3.984 5.852 529 HG21 VAL 82 HG21 VAL 82 -7.075 1.655 4.867 530 HG22 VAL 82 HG22 VAL 82 -8.553 2.241 4.105 531 HG23 VAL 82 HG23 VAL 82 -8.602 0.822 5.150 532 H THR 83 HN THR 83 -10.112 2.112 8.557 533 HA THR 83 HA THR 83 -10.665 -0.713 8.120 534 HB THR 83 HB THR 83 -10.993 0.522 10.855 535 HG1 THR 83 HG1 THR 83 -8.852 -0.727 9.646 536 HG21 THR 83 HG21 THR 83 -11.319 -2.313 9.868 537 HG22 THR 83 HG22 THR 83 -12.613 -1.232 10.376 538 HG23 THR 83 HG23 THR 83 -11.431 -1.803 11.552 539 H LEU 84 HN LEU 84 -12.684 -1.016 7.524 540 HA LEU 84 HA LEU 84 -14.824 -0.666 6.933 541 HB2 LEU 84 HB2 LEU 84 -14.775 0.934 9.469 542 HB3 LEU 84 HB1 LEU 84 -16.244 0.571 8.580 543 HG LEU 84 HG LEU 84 -14.388 -1.489 9.746 544 HD11 LEU 84 HD11 LEU 84 -15.492 -0.208 11.500 545 HD12 LEU 84 HD12 LEU 84 -16.135 -1.847 11.415 546 HD13 LEU 84 HD13 LEU 84 -17.055 -0.504 10.740 547 HD21 LEU 84 HD21 LEU 84 -17.090 -1.727 8.453 548 HD22 LEU 84 HD22 LEU 84 -16.255 -3.029 9.299 549 HD23 LEU 84 HD23 LEU 84 -15.557 -2.341 7.835 Start of MODEL 12 1 H1 GLY 1 HT1 GLY 1 -19.904 -0.019 -9.458 2 H2 GLY 1 HT2 GLY 1 -18.703 -0.963 -10.186 3 H3 GLY 1 HT3 GLY 1 -18.448 0.690 -9.937 4 HA2 GLY 1 HA1 GLY 1 -18.771 -1.331 -7.794 5 HA3 GLY 1 HA2 GLY 1 -17.240 -0.639 -8.313 6 H SER 2 HN SER 2 -17.982 -0.423 -5.681 7 HA SER 2 HA SER 2 -19.272 2.154 -5.316 8 HB2 SER 2 HB2 SER 2 -18.117 0.277 -3.242 9 HB3 SER 2 HB1 SER 2 -19.193 1.642 -2.945 10 HG SER 2 HG SER 2 -20.799 0.561 -4.145 11 H TRP 3 HN TRP 3 -16.257 1.179 -6.085 12 HA TRP 3 HA TRP 3 -14.228 2.182 -6.179 13 HB2 TRP 3 HB2 TRP 3 -15.737 4.578 -5.115 14 HB3 TRP 3 HB1 TRP 3 -14.072 4.621 -5.679 15 HD1 TRP 3 HD1 TRP 3 -17.651 4.129 -7.003 16 HE1 TRP 3 HE1 TRP 3 -17.672 4.681 -9.518 17 HE3 TRP 3 HE3 TRP 3 -12.633 4.792 -7.718 18 HZ2 TRP 3 HZ2 TRP 3 -15.799 5.312 -11.533 19 HZ3 TRP 3 HZ3 TRP 3 -11.832 5.373 -9.970 20 HH2 TRP 3 HH2 TRP 3 -13.383 5.626 -11.836 21 H GLY 4 HN GLY 4 -12.612 3.496 -4.715 22 HA2 GLY 4 HA2 GLY 4 -12.979 2.609 -1.921 23 HA3 GLY 4 HA1 GLY 4 -11.434 2.489 -2.758 24 H GLN 5 HN GLN 5 -13.862 4.754 -1.580 25 HA GLN 5 HA GLN 5 -12.094 6.979 -2.110 26 HB2 GLN 5 HB2 GLN 5 -13.950 8.409 -1.393 27 HB3 GLN 5 HB1 GLN 5 -14.425 7.301 -2.672 28 HG2 GLN 5 HG2 GLN 5 -14.833 6.300 0.016 29 HG3 GLN 5 HG1 GLN 5 -15.787 7.729 -0.366 30 HE21 GLN 5 HE21 GLN 5 -14.858 5.428 -2.817 31 HE22 GLN 5 HE22 GLN 5 -16.431 4.744 -3.058 32 H CYS 6 HN CYS 6 -10.707 7.716 -0.730 33 HA CYS 6 HA CYS 6 -11.121 7.179 2.129 34 HB2 CYS 6 HB2 CYS 6 -9.134 6.090 1.398 35 HB3 CYS 6 HB1 CYS 6 -8.607 7.495 0.492 36 H SER 7 HN SER 7 -8.979 9.493 0.522 37 HA SER 7 HA SER 7 -10.494 11.801 0.809 38 HB2 SER 7 HB2 SER 7 -9.282 12.791 2.827 39 HB3 SER 7 HB1 SER 7 -10.505 11.570 3.178 40 HG SER 7 HG SER 7 -9.002 10.409 4.058 41 H THR 8 HN THR 8 -7.234 11.500 2.082 42 HA THR 8 HA THR 8 -6.206 13.126 -0.109 43 HB THR 8 HB THR 8 -4.080 13.001 1.347 44 HG1 THR 8 HG1 THR 8 -4.226 11.924 3.174 45 HG21 THR 8 HG21 THR 8 -4.955 14.706 2.909 46 HG22 THR 8 HG22 THR 8 -6.594 14.297 2.403 47 HG23 THR 8 HG23 THR 8 -5.461 14.993 1.244 48 H GLY 9 HN GLY 9 -6.956 10.165 -0.135 49 HA2 GLY 9 HA2 GLY 9 -4.881 9.312 -1.881 50 HA3 GLY 9 HA1 GLY 9 -4.798 8.483 -0.331 51 H SER 10 HN SER 10 -5.160 6.872 -2.312 52 HA SER 10 HA SER 10 -8.026 6.392 -2.686 53 HB2 SER 10 HB2 SER 10 -6.497 6.351 -4.674 54 HB3 SER 10 HB1 SER 10 -5.668 4.972 -3.956 55 HG SER 10 HG SER 10 -7.420 4.554 -5.545 56 H ILE 11 HN ILE 11 -8.915 4.294 -2.171 57 HA ILE 11 HA ILE 11 -7.431 2.989 -0.020 58 HB ILE 11 HB ILE 11 -10.321 2.717 -0.829 59 HG12 ILE 11 HG12 ILE 11 -8.867 3.967 1.493 60 HG13 ILE 11 HG11 ILE 11 -9.894 4.751 0.302 61 HG21 ILE 11 HG21 ILE 11 -10.594 1.255 1.102 62 HG22 ILE 11 HG22 ILE 11 -8.863 1.339 1.427 63 HG23 ILE 11 HG23 ILE 11 -9.448 0.559 -0.044 64 HD11 ILE 11 HD11 ILE 11 -11.827 3.576 1.208 65 HD12 ILE 11 HD12 ILE 11 -11.023 4.565 2.425 66 HD13 ILE 11 HD13 ILE 11 -10.787 2.816 2.410 67 H GLN 12 HN GLN 12 -6.559 1.126 -0.166 68 HA GLN 12 HA GLN 12 -7.371 -0.734 -2.261 69 HB2 GLN 12 HB2 GLN 12 -4.769 -1.306 -2.344 70 HB3 GLN 12 HB1 GLN 12 -5.526 -0.178 -3.447 71 HG2 GLN 12 HG2 GLN 12 -4.369 0.861 -0.923 72 HG3 GLN 12 HG1 GLN 12 -3.280 0.363 -2.207 73 HE21 GLN 12 HE21 GLN 12 -4.983 1.153 -4.385 74 HE22 GLN 12 HE22 GLN 12 -4.983 2.873 -4.420 75 H CYS 13 HN CYS 13 -6.414 -2.904 -1.905 76 HA CYS 13 HA CYS 13 -6.395 -3.498 0.969 77 HB2 CYS 13 HB2 CYS 13 -8.217 -4.593 -0.128 78 HB3 CYS 13 HB1 CYS 13 -7.186 -5.149 -1.445 79 H CYS 14 HN CYS 14 -4.297 -3.493 1.580 80 HA CYS 14 HA CYS 14 -2.272 -4.536 -0.217 81 HB2 CYS 14 HB2 CYS 14 -2.141 -3.159 2.458 82 HB3 CYS 14 HB1 CYS 14 -0.723 -3.901 1.727 83 H GLN 15 HN GLN 15 -1.355 -6.435 -0.088 84 HA GLN 15 HA GLN 15 -2.302 -8.336 1.838 85 HB2 GLN 15 HB2 GLN 15 -1.829 -9.814 0.222 86 HB3 GLN 15 HB1 GLN 15 -1.432 -8.441 -0.796 87 HG2 GLN 15 HG2 GLN 15 0.364 -9.888 -1.026 88 HG3 GLN 15 HG1 GLN 15 0.925 -8.659 0.102 89 HE21 GLN 15 HE21 GLN 15 -1.296 -11.180 1.027 90 HE22 GLN 15 HE22 GLN 15 -0.205 -12.039 2.049 91 H ASN 16 HN ASN 16 0.563 -6.420 1.284 92 HA ASN 16 HA ASN 16 1.571 -7.282 3.916 93 HB2 ASN 16 HB2 ASN 16 2.938 -7.481 1.351 94 HB3 ASN 16 HB1 ASN 16 3.841 -6.533 2.517 95 HD21 ASN 16 HD21 ASN 16 4.460 -9.098 1.358 96 HD22 ASN 16 HD22 ASN 16 4.624 -10.205 2.677 97 H VAL 17 HN VAL 17 1.104 -5.470 5.078 98 HA VAL 17 HA VAL 17 1.846 -2.866 3.961 99 HB VAL 17 HB VAL 17 0.414 -3.486 6.552 100 HG11 VAL 17 HG11 VAL 17 1.636 -1.375 6.642 101 HG12 VAL 17 HG12 VAL 17 -0.103 -1.089 6.582 102 HG13 VAL 17 HG13 VAL 17 0.878 -0.862 5.134 103 HG21 VAL 17 HG21 VAL 17 -0.913 -4.095 4.604 104 HG22 VAL 17 HG22 VAL 17 -0.648 -2.494 3.912 105 HG23 VAL 17 HG23 VAL 17 -1.583 -2.670 5.396 106 H VAL 18 HN VAL 18 3.938 -2.493 4.158 107 HA VAL 18 HA VAL 18 5.200 -2.906 6.780 108 HB VAL 18 HB VAL 18 7.302 -3.566 5.564 109 HG11 VAL 18 HG11 VAL 18 4.920 -5.389 5.247 110 HG12 VAL 18 HG12 VAL 18 5.944 -5.242 6.675 111 HG13 VAL 18 HG13 VAL 18 6.607 -5.893 5.176 112 HG21 VAL 18 HG21 VAL 18 7.081 -4.438 3.277 113 HG22 VAL 18 HG22 VAL 18 6.744 -2.709 3.355 114 HG23 VAL 18 HG23 VAL 18 5.415 -3.861 3.225 115 HA PRO 19 HA PRO 19 6.713 1.272 6.215 116 HB2 PRO 19 HB2 PRO 19 9.035 0.315 7.766 117 HB3 PRO 19 HB1 PRO 19 7.963 1.681 8.079 118 HG2 PRO 19 HG2 PRO 19 7.823 -0.562 9.539 119 HG3 PRO 19 HG1 PRO 19 6.374 0.371 9.126 120 HD2 PRO 19 HD2 PRO 19 7.379 -2.188 7.957 121 HD3 PRO 19 HD1 PRO 19 5.711 -1.661 8.265 122 H GLY 20 HN GLY 20 7.963 2.178 4.675 123 HA2 GLY 20 HA2 GLY 20 9.350 0.544 2.833 124 HA3 GLY 20 HA1 GLY 20 9.391 2.299 2.879 125 H ASP 21 HN ASP 21 10.350 2.189 5.700 126 HA ASP 21 HA ASP 21 13.182 1.709 5.143 127 HB2 ASP 21 HB2 ASP 21 13.579 2.987 7.200 128 HB3 ASP 21 HB1 ASP 21 12.510 3.882 6.122 129 H SER 22 HN SER 22 10.773 -0.164 6.051 130 HA SER 22 HA SER 22 11.892 -1.394 8.403 131 HB2 SER 22 HB2 SER 22 9.498 -1.482 8.164 132 HB3 SER 22 HB1 SER 22 9.625 -2.195 6.565 133 HG SER 22 HG SER 22 9.488 -3.426 8.908 134 H ASP 23 HN ASP 23 12.739 -3.515 8.479 135 HA ASP 23 HA ASP 23 14.669 -4.133 6.579 136 HB2 ASP 23 HB2 ASP 23 13.303 -5.770 8.695 137 HB3 ASP 23 HB1 ASP 23 14.460 -6.519 7.602 138 H LEU 24 HN LEU 24 11.344 -5.243 6.851 139 HA LEU 24 HA LEU 24 11.458 -6.987 4.609 140 HB2 LEU 24 HB2 LEU 24 9.384 -5.905 6.379 141 HB3 LEU 24 HB1 LEU 24 8.840 -6.225 4.746 142 HG LEU 24 HG LEU 24 8.403 -8.115 6.230 143 HD11 LEU 24 HD11 LEU 24 8.860 -8.473 3.830 144 HD12 LEU 24 HD12 LEU 24 9.318 -9.850 4.831 145 HD13 LEU 24 HD13 LEU 24 10.556 -8.752 4.221 146 HD21 LEU 24 HD21 LEU 24 11.398 -8.245 6.536 147 HD22 LEU 24 HD22 LEU 24 10.246 -9.439 7.135 148 HD23 LEU 24 HD23 LEU 24 10.245 -7.804 7.795 149 H GLY 25 HN GLY 25 9.829 -3.839 4.959 150 HA2 GLY 25 HA2 GLY 25 9.102 -3.514 2.315 151 HA3 GLY 25 HA1 GLY 25 9.354 -2.193 3.441 152 H THR 26 HN THR 26 12.144 -2.604 3.850 153 HA THR 26 HA THR 26 13.097 -1.063 1.668 154 HB THR 26 HB THR 26 14.675 -2.396 3.877 155 HG1 THR 26 HG1 THR 26 13.128 -0.075 3.744 156 HG21 THR 26 HG21 THR 26 15.408 -0.042 2.138 157 HG22 THR 26 HG22 THR 26 16.050 -1.677 1.952 158 HG23 THR 26 HG23 THR 26 16.391 -0.754 3.417 159 H LEU 27 HN LEU 27 13.657 -4.390 2.723 160 HA LEU 27 HA LEU 27 15.468 -5.062 0.655 161 HB2 LEU 27 HB2 LEU 27 14.613 -6.272 2.928 162 HB3 LEU 27 HB1 LEU 27 13.687 -7.167 1.744 163 HG LEU 27 HG LEU 27 15.735 -8.345 2.306 164 HD11 LEU 27 HD11 LEU 27 15.877 -7.207 -0.478 165 HD12 LEU 27 HD12 LEU 27 14.857 -8.552 0.031 166 HD13 LEU 27 HD13 LEU 27 16.613 -8.710 0.082 167 HD21 LEU 27 HD21 LEU 27 17.923 -7.425 1.770 168 HD22 LEU 27 HD22 LEU 27 17.086 -6.419 2.952 169 HD23 LEU 27 HD23 LEU 27 17.176 -5.911 1.268 170 H LEU 28 HN LEU 28 11.975 -5.103 0.969 171 HA LEU 28 HA LEU 28 11.438 -6.632 -1.357 172 HB2 LEU 28 HB2 LEU 28 9.669 -4.577 -0.025 173 HB3 LEU 28 HB1 LEU 28 9.152 -5.786 -1.179 174 HG LEU 28 HG LEU 28 9.972 -6.164 1.684 175 HD11 LEU 28 HD11 LEU 28 7.639 -5.674 1.242 176 HD12 LEU 28 HD12 LEU 28 7.833 -7.333 1.807 177 HD13 LEU 28 HD13 LEU 28 7.558 -7.010 0.094 178 HD21 LEU 28 HD21 LEU 28 9.862 -8.590 1.314 179 HD22 LEU 28 HD22 LEU 28 11.213 -7.830 0.473 180 HD23 LEU 28 HD23 LEU 28 9.770 -8.304 -0.426 181 H LEU 29 HN LEU 29 11.516 -3.128 -0.747 182 HA LEU 29 HA LEU 29 10.778 -2.544 -3.445 183 HB2 LEU 29 HB2 LEU 29 11.084 -0.220 -2.848 184 HB3 LEU 29 HB1 LEU 29 10.131 -1.051 -1.652 185 HG LEU 29 HG LEU 29 12.293 -1.176 -0.271 186 HD11 LEU 29 HD11 LEU 29 13.921 0.595 -0.711 187 HD12 LEU 29 HD12 LEU 29 13.082 1.001 -2.209 188 HD13 LEU 29 HD13 LEU 29 13.871 -0.567 -2.038 189 HD21 LEU 29 HD21 LEU 29 11.947 1.144 0.530 190 HD22 LEU 29 HD22 LEU 29 10.453 0.228 0.338 191 HD23 LEU 29 HD23 LEU 29 10.914 1.427 -0.874 192 H ASP 30 HN ASP 30 13.793 -2.966 -1.789 193 HA ASP 30 HA ASP 30 15.465 -1.734 -3.709 194 HB2 ASP 30 HB2 ASP 30 16.201 -2.509 -1.428 195 HB3 ASP 30 HB1 ASP 30 16.133 -4.160 -2.029 196 H GLU 31 HN GLU 31 13.926 -4.824 -3.459 197 HA GLU 31 HA GLU 31 15.318 -6.016 -5.677 198 HB2 GLU 31 HB2 GLU 31 13.851 -6.951 -3.527 199 HB3 GLU 31 HB1 GLU 31 12.758 -7.203 -4.879 200 HG2 GLU 31 HG2 GLU 31 15.572 -8.230 -4.665 201 HG3 GLU 31 HG1 GLU 31 14.104 -9.176 -4.432 202 H LEU 32 HN LEU 32 12.337 -4.345 -5.058 203 HA LEU 32 HA LEU 32 11.191 -4.901 -7.640 204 HB2 LEU 32 HB2 LEU 32 10.369 -3.158 -5.334 205 HB3 LEU 32 HB1 LEU 32 9.429 -3.289 -6.808 206 HG LEU 32 HG LEU 32 10.059 -5.545 -4.900 207 HD11 LEU 32 HD11 LEU 32 7.690 -5.482 -4.373 208 HD12 LEU 32 HD12 LEU 32 7.466 -4.120 -5.470 209 HD13 LEU 32 HD13 LEU 32 8.448 -3.930 -4.017 210 HD21 LEU 32 HD21 LEU 32 8.475 -6.839 -6.276 211 HD22 LEU 32 HD22 LEU 32 9.922 -6.374 -7.167 212 HD23 LEU 32 HD23 LEU 32 8.411 -5.503 -7.426 213 H GLY 33 HN GLY 33 13.412 -2.673 -6.460 214 HA2 GLY 33 HA2 GLY 33 14.549 -1.003 -7.565 215 HA3 GLY 33 HA1 GLY 33 13.558 -1.324 -8.978 216 H ILE 34 HN ILE 34 12.716 -0.261 -5.686 217 HA ILE 34 HA ILE 34 11.278 2.004 -6.908 218 HB ILE 34 HB ILE 34 10.825 0.988 -4.110 219 HG12 ILE 34 HG12 ILE 34 9.263 0.127 -6.559 220 HG13 ILE 34 HG11 ILE 34 10.515 -0.860 -5.810 221 HG21 ILE 34 HG21 ILE 34 9.074 2.511 -6.031 222 HG22 ILE 34 HG22 ILE 34 9.963 3.199 -4.672 223 HG23 ILE 34 HG23 ILE 34 8.653 2.054 -4.380 224 HD11 ILE 34 HD11 ILE 34 9.237 -0.975 -3.764 225 HD12 ILE 34 HD12 ILE 34 8.261 -1.519 -5.129 226 HD13 ILE 34 HD13 ILE 34 8.008 0.089 -4.447 227 H VAL 35 HN VAL 35 11.757 4.057 -6.288 228 HA VAL 35 HA VAL 35 13.559 4.389 -3.992 229 HB VAL 35 HB VAL 35 14.844 4.862 -5.972 230 HG11 VAL 35 HG11 VAL 35 13.064 5.319 -7.553 231 HG12 VAL 35 HG12 VAL 35 14.240 6.633 -7.555 232 HG13 VAL 35 HG13 VAL 35 12.695 6.834 -6.729 233 HG21 VAL 35 HG21 VAL 35 15.285 6.265 -4.052 234 HG22 VAL 35 HG22 VAL 35 14.039 7.402 -4.565 235 HG23 VAL 35 HG23 VAL 35 15.495 7.193 -5.537 236 H LEU 36 HN LEU 36 12.311 5.100 -2.405 237 HA LEU 36 HA LEU 36 9.980 6.719 -2.904 238 HB2 LEU 36 HB2 LEU 36 11.256 5.916 -0.295 239 HB3 LEU 36 HB1 LEU 36 9.637 6.546 -0.508 240 HG LEU 36 HG LEU 36 10.522 3.965 -1.769 241 HD11 LEU 36 HD11 LEU 36 9.453 2.842 0.137 242 HD12 LEU 36 HD12 LEU 36 9.278 4.404 0.938 243 HD13 LEU 36 HD13 LEU 36 10.885 3.759 0.603 244 HD21 LEU 36 HD21 LEU 36 8.108 3.535 -1.781 245 HD22 LEU 36 HD22 LEU 36 8.522 4.990 -2.686 246 HD23 LEU 36 HD23 LEU 36 7.831 5.125 -1.071 247 H GLU 37 HN GLU 37 9.668 8.830 -2.388 248 HA GLU 37 HA GLU 37 11.977 10.512 -2.026 249 HB2 GLU 37 HB2 GLU 37 9.024 11.180 -2.047 250 HB3 GLU 37 HB1 GLU 37 10.333 12.355 -2.075 251 HG2 GLU 37 HG2 GLU 37 9.748 10.303 -4.198 252 HG3 GLU 37 HG1 GLU 37 9.400 12.029 -4.291 253 H ASP 38 HN ASP 38 9.607 8.988 -0.087 254 HA ASP 38 HA ASP 38 10.929 10.004 2.304 255 HB2 ASP 38 HB2 ASP 38 8.793 11.244 2.104 256 HB3 ASP 38 HB1 ASP 38 7.923 9.718 1.985 257 HA PRO 39 HA PRO 39 11.001 5.489 2.120 258 HB2 PRO 39 HB2 PRO 39 13.057 5.155 3.856 259 HB3 PRO 39 HB1 PRO 39 13.297 5.614 2.166 260 HG2 PRO 39 HG2 PRO 39 13.276 7.341 4.612 261 HG3 PRO 39 HG1 PRO 39 14.383 7.377 3.229 262 HD2 PRO 39 HD2 PRO 39 12.324 9.115 3.495 263 HD3 PRO 39 HD1 PRO 39 12.902 8.555 1.913 264 H THR 40 HN THR 40 9.985 7.552 4.490 265 HA THR 40 HA THR 40 9.715 5.427 6.501 266 HB THR 40 HB THR 40 9.003 7.347 8.023 267 HG1 THR 40 HG1 THR 40 8.998 8.733 5.845 268 HG21 THR 40 HG21 THR 40 11.326 8.008 8.446 269 HG22 THR 40 HG22 THR 40 11.796 7.338 6.883 270 HG23 THR 40 HG23 THR 40 11.193 6.274 8.152 271 H VAL 41 HN VAL 41 8.073 5.965 3.997 272 HA VAL 41 HA VAL 41 5.422 6.251 5.183 273 HB VAL 41 HB VAL 41 4.554 6.095 2.909 274 HG11 VAL 41 HG11 VAL 41 6.867 8.009 3.119 275 HG12 VAL 41 HG12 VAL 41 5.228 8.281 3.712 276 HG13 VAL 41 HG13 VAL 41 5.527 8.140 1.979 277 HG21 VAL 41 HG21 VAL 41 6.180 4.513 1.997 278 HG22 VAL 41 HG22 VAL 41 7.420 5.769 2.031 279 HG23 VAL 41 HG23 VAL 41 6.017 5.940 0.974 280 H LEU 42 HN LEU 42 3.780 4.610 4.724 281 HA LEU 42 HA LEU 42 4.851 1.927 5.002 282 HB2 LEU 42 HB2 LEU 42 2.030 2.995 5.077 283 HB3 LEU 42 HB1 LEU 42 2.435 1.301 5.266 284 HG LEU 42 HG LEU 42 3.355 3.501 7.117 285 HD11 LEU 42 HD11 LEU 42 0.953 3.196 7.276 286 HD12 LEU 42 HD12 LEU 42 1.750 2.535 8.703 287 HD13 LEU 42 HD13 LEU 42 1.166 1.454 7.439 288 HD21 LEU 42 HD21 LEU 42 4.032 1.650 8.569 289 HD22 LEU 42 HD22 LEU 42 4.884 1.603 7.026 290 HD23 LEU 42 HD23 LEU 42 3.544 0.497 7.326 291 H ILE 43 HN ILE 43 5.208 0.668 3.330 292 HA ILE 43 HA ILE 43 3.727 1.201 0.858 293 HB ILE 43 HB ILE 43 5.454 -0.318 -0.218 294 HG12 ILE 43 HG12 ILE 43 7.011 0.289 2.300 295 HG13 ILE 43 HG11 ILE 43 6.304 -1.277 1.923 296 HG21 ILE 43 HG21 ILE 43 7.100 1.496 -0.409 297 HG22 ILE 43 HG22 ILE 43 6.339 2.311 0.957 298 HG23 ILE 43 HG23 ILE 43 5.441 2.078 -0.543 299 HD11 ILE 43 HD11 ILE 43 8.687 -1.197 1.408 300 HD12 ILE 43 HD12 ILE 43 8.396 0.132 0.285 301 HD13 ILE 43 HD13 ILE 43 7.716 -1.463 -0.040 302 H GLY 44 HN GLY 44 2.531 -0.353 -0.114 303 HA2 GLY 44 HA2 GLY 44 2.041 -2.724 1.565 304 HA3 GLY 44 HA1 GLY 44 0.787 -1.872 0.695 305 H ASP 45 HN ASP 45 3.014 -4.406 0.613 306 HA ASP 45 HA ASP 45 3.043 -4.772 -2.244 307 HB2 ASP 45 HB2 ASP 45 4.710 -5.815 -0.585 308 HB3 ASP 45 HB1 ASP 45 3.435 -6.932 -0.186 309 H GLY 46 HN GLY 46 1.719 -6.155 -3.438 310 HA2 GLY 46 HA2 GLY 46 -0.115 -7.491 -3.897 311 HA3 GLY 46 HA1 GLY 46 -0.108 -7.933 -2.220 312 H CYS 47 HN CYS 47 -0.459 -4.701 -3.540 313 HA CYS 47 HA CYS 47 -2.918 -4.485 -1.967 314 HB2 CYS 47 HB2 CYS 47 -0.726 -2.891 -1.958 315 HB3 CYS 47 HB1 CYS 47 -1.746 -2.056 -3.133 316 H ASP 48 HN ASP 48 -4.672 -4.817 -3.067 317 HA ASP 48 HA ASP 48 -4.793 -3.915 -5.856 318 HB2 ASP 48 HB2 ASP 48 -6.486 -5.466 -6.269 319 HB3 ASP 48 HB1 ASP 48 -5.408 -6.316 -5.179 320 HA PRO 49 HA PRO 49 -7.191 -0.401 -4.598 321 HB2 PRO 49 HB2 PRO 49 -8.270 -0.536 -7.339 322 HB3 PRO 49 HB1 PRO 49 -7.404 0.770 -6.540 323 HG2 PRO 49 HG2 PRO 49 -6.287 -0.751 -8.471 324 HG3 PRO 49 HG1 PRO 49 -5.353 -0.022 -7.156 325 HD2 PRO 49 HD2 PRO 49 -6.189 -2.847 -7.542 326 HD3 PRO 49 HD1 PRO 49 -4.756 -2.182 -6.740 327 H ILE 50 HN ILE 50 -8.952 -0.723 -3.381 328 HA ILE 50 HA ILE 50 -10.859 -2.772 -4.067 329 HB ILE 50 HB ILE 50 -11.243 -0.773 -1.844 330 HG12 ILE 50 HG12 ILE 50 -9.588 -3.305 -1.749 331 HG13 ILE 50 HG11 ILE 50 -8.953 -1.668 -1.669 332 HG21 ILE 50 HG21 ILE 50 -13.071 -2.339 -2.425 333 HG22 ILE 50 HG22 ILE 50 -12.439 -2.597 -0.796 334 HG23 ILE 50 HG23 ILE 50 -11.975 -3.687 -2.102 335 HD11 ILE 50 HD11 ILE 50 -10.195 -1.320 0.428 336 HD12 ILE 50 HD12 ILE 50 -9.026 -2.634 0.534 337 HD13 ILE 50 HD13 ILE 50 -10.743 -2.994 0.351 338 H THR 51 HN THR 51 -12.328 -2.396 -5.540 339 HA THR 51 HA THR 51 -13.667 0.203 -5.642 340 HB THR 51 HB THR 51 -11.798 0.370 -7.213 341 HG1 THR 51 HG1 THR 51 -14.312 0.070 -8.536 342 HG21 THR 51 HG21 THR 51 -13.008 -2.069 -8.513 343 HG22 THR 51 HG22 THR 51 -11.441 -1.966 -7.710 344 HG23 THR 51 HG23 THR 51 -11.720 -1.085 -9.212 345 H VAL 52 HN VAL 52 -14.190 -2.738 -5.034 346 HA VAL 52 HA VAL 52 -16.013 -3.627 -7.060 347 HB VAL 52 HB VAL 52 -14.628 -5.146 -5.625 348 HG11 VAL 52 HG11 VAL 52 -16.602 -4.352 -3.491 349 HG12 VAL 52 HG12 VAL 52 -14.867 -4.035 -3.494 350 HG13 VAL 52 HG13 VAL 52 -15.460 -5.691 -3.372 351 HG21 VAL 52 HG21 VAL 52 -17.607 -5.582 -5.576 352 HG22 VAL 52 HG22 VAL 52 -16.393 -6.830 -5.299 353 HG23 VAL 52 HG23 VAL 52 -16.494 -6.032 -6.868 354 H ALA 53 HN ALA 53 -18.273 -3.924 -6.770 355 HA ALA 53 HA ALA 53 -19.644 -1.835 -5.430 356 HB1 ALA 53 HB1 ALA 53 -20.727 -4.404 -6.586 357 HB2 ALA 53 HB2 ALA 53 -20.538 -2.878 -7.450 358 HB3 ALA 53 HB3 ALA 53 -21.684 -3.001 -6.115 359 H GLY 54 HN GLY 54 -19.910 -1.686 -3.326 360 HA2 GLY 54 HA2 GLY 54 -20.573 -2.317 -1.191 361 HA3 GLY 54 HA1 GLY 54 -20.779 -3.965 -1.767 362 H SER 55 HN SER 55 -18.293 -1.573 -0.961 363 HA SER 55 HA SER 55 -16.337 -3.713 -0.623 364 HB2 SER 55 HB2 SER 55 -16.006 -0.705 -0.490 365 HB3 SER 55 HB1 SER 55 -14.696 -1.883 -0.425 366 HG SER 55 HG SER 55 -16.500 -1.912 -2.587 367 H SER 56 HN SER 56 -18.306 -3.901 1.250 368 HA SER 56 HA SER 56 -17.730 -2.513 3.661 369 HB2 SER 56 HB2 SER 56 -19.149 -4.455 4.631 370 HB3 SER 56 HB1 SER 56 -19.917 -3.337 3.501 371 HG SER 56 HG SER 56 -19.484 -6.005 3.263 372 H ASP 57 HN ASP 57 -16.851 -5.685 2.384 373 HA ASP 57 HA ASP 57 -14.441 -5.650 3.967 374 HB2 ASP 57 HB2 ASP 57 -16.069 -6.724 5.510 375 HB3 ASP 57 HB1 ASP 57 -16.375 -7.958 4.291 376 H ALA 58 HN ALA 58 -13.774 -5.390 1.753 377 HA ALA 58 HA ALA 58 -13.818 -7.880 0.189 378 HB1 ALA 58 HB1 ALA 58 -14.652 -5.903 -0.983 379 HB2 ALA 58 HB2 ALA 58 -13.167 -6.502 -1.723 380 HB3 ALA 58 HB3 ALA 58 -13.124 -5.076 -0.685 381 H CYS 59 HN CYS 59 -12.124 -7.024 2.556 382 HA CYS 59 HA CYS 59 -9.599 -7.937 1.475 383 HB2 CYS 59 HB2 CYS 59 -9.558 -5.438 1.264 384 HB3 CYS 59 HB1 CYS 59 -9.735 -5.340 3.016 385 H SER 60 HN SER 60 -8.723 -9.342 2.858 386 HA SER 60 HA SER 60 -9.411 -9.071 5.699 387 HB2 SER 60 HB2 SER 60 -8.987 -11.582 4.096 388 HB3 SER 60 HB1 SER 60 -9.137 -11.550 5.851 389 HG SER 60 HG SER 60 -11.200 -10.461 5.472 390 H ALA 61 HN ALA 61 -6.915 -8.834 3.491 391 HA ALA 61 HA ALA 61 -4.830 -9.663 5.304 392 HB1 ALA 61 HB1 ALA 61 -4.417 -9.764 2.890 393 HB2 ALA 61 HB2 ALA 61 -3.265 -8.690 3.682 394 HB3 ALA 61 HB3 ALA 61 -4.620 -8.016 2.776 395 H THR 62 HN THR 62 -4.873 -6.437 3.814 396 HA THR 62 HA THR 62 -5.653 -5.216 6.328 397 HB THR 62 HB THR 62 -3.006 -4.471 5.068 398 HG1 THR 62 HG1 THR 62 -3.621 -6.443 6.795 399 HG21 THR 62 HG21 THR 62 -2.731 -3.102 7.099 400 HG22 THR 62 HG22 THR 62 -4.351 -3.565 7.619 401 HG23 THR 62 HG23 THR 62 -4.136 -2.600 6.160 402 H ALA 63 HN ALA 63 -6.912 -3.510 5.956 403 HA ALA 63 HA ALA 63 -7.173 -2.466 3.258 404 HB1 ALA 63 HB1 ALA 63 -9.096 -1.245 4.134 405 HB2 ALA 63 HB2 ALA 63 -8.690 -1.753 5.773 406 HB3 ALA 63 HB3 ALA 63 -9.194 -2.950 4.579 407 H VAL 64 HN VAL 64 -6.439 -0.491 2.606 408 HA VAL 64 HA VAL 64 -5.247 1.271 4.620 409 HB VAL 64 HB VAL 64 -3.212 1.474 3.081 410 HG11 VAL 64 HG11 VAL 64 -2.091 -0.450 4.128 411 HG12 VAL 64 HG12 VAL 64 -3.661 -1.083 4.623 412 HG13 VAL 64 HG13 VAL 64 -3.077 0.445 5.284 413 HG21 VAL 64 HG21 VAL 64 -4.289 -1.180 2.146 414 HG22 VAL 64 HG22 VAL 64 -2.713 -0.500 1.734 415 HG23 VAL 64 HG23 VAL 64 -4.189 0.296 1.183 416 H CYS 65 HN CYS 65 -4.369 3.258 3.614 417 HA CYS 65 HA CYS 65 -5.892 4.132 1.261 418 HB2 CYS 65 HB2 CYS 65 -7.066 5.042 3.154 419 HB3 CYS 65 HB1 CYS 65 -5.568 5.515 3.937 420 H CYS 66 HN CYS 66 -4.209 4.244 -0.194 421 HA CYS 66 HA CYS 66 -1.669 5.345 0.697 422 HB2 CYS 66 HB2 CYS 66 -2.546 3.773 -1.633 423 HB3 CYS 66 HB1 CYS 66 -1.224 4.898 -1.909 424 H SER 67 HN SER 67 -1.033 7.261 0.460 425 HA SER 67 HA SER 67 -2.679 9.222 -0.873 426 HB2 SER 67 HB2 SER 67 -1.640 9.520 1.413 427 HB3 SER 67 HB1 SER 67 -0.079 9.634 0.602 428 HG SER 67 HG SER 67 -2.262 11.294 -0.113 429 H ASP 68 HN ASP 68 0.083 7.365 -1.532 430 HA ASP 68 HA ASP 68 0.811 9.105 -3.792 431 HB2 ASP 68 HB2 ASP 68 2.609 8.622 -2.100 432 HB3 ASP 68 HB1 ASP 68 2.496 6.923 -2.547 433 H ASN 69 HN ASN 69 0.917 8.207 -5.859 434 HA ASN 69 HA ASN 69 -0.379 5.566 -6.054 435 HB2 ASN 69 HB2 ASN 69 -0.813 7.962 -7.849 436 HB3 ASN 69 HB1 ASN 69 -1.561 6.382 -8.053 437 HD21 ASN 69 HD21 ASN 69 -1.556 9.344 -6.282 438 HD22 ASN 69 HD22 ASN 69 -3.016 9.067 -5.398 439 H ASN 70 HN ASN 70 2.523 6.387 -6.231 440 HA ASN 70 HA ASN 70 3.150 5.780 -9.010 441 HB2 ASN 70 HB2 ASN 70 4.919 6.269 -6.606 442 HB3 ASN 70 HB1 ASN 70 5.535 5.887 -8.210 443 HD21 ASN 70 HD21 ASN 70 4.022 8.266 -6.208 444 HD22 ASN 70 HD22 ASN 70 4.203 9.599 -7.308 445 H VAL 71 HN VAL 71 1.755 3.758 -8.398 446 HA VAL 71 HA VAL 71 3.041 1.698 -6.909 447 HB VAL 71 HB VAL 71 1.195 0.277 -7.690 448 HG11 VAL 71 HG11 VAL 71 -0.622 1.538 -6.637 449 HG12 VAL 71 HG12 VAL 71 0.343 3.010 -6.757 450 HG13 VAL 71 HG13 VAL 71 0.887 1.679 -5.735 451 HG21 VAL 71 HG21 VAL 71 0.343 2.688 -9.288 452 HG22 VAL 71 HG22 VAL 71 -0.590 1.206 -9.079 453 HG23 VAL 71 HG23 VAL 71 0.942 1.169 -9.953 454 H SER 72 HN SER 72 4.157 -0.057 -7.598 455 HA SER 72 HA SER 72 5.238 0.078 -10.279 456 HB2 SER 72 HB2 SER 72 6.008 -1.711 -8.005 457 HB3 SER 72 HB1 SER 72 6.915 -1.479 -9.490 458 HG SER 72 HG SER 72 7.060 0.771 -8.869 459 H GLY 73 HN GLY 73 2.511 -1.167 -9.225 460 HA2 GLY 73 HA2 GLY 73 1.430 -2.376 -11.149 461 HA3 GLY 73 HA1 GLY 73 2.724 -3.540 -10.967 462 H VAL 74 HN VAL 74 2.662 -3.633 -8.062 463 HA VAL 74 HA VAL 74 -0.100 -4.435 -7.518 464 HB VAL 74 HB VAL 74 0.499 -6.521 -6.515 465 HG11 VAL 74 HG11 VAL 74 1.423 -7.751 -8.498 466 HG12 VAL 74 HG12 VAL 74 1.668 -6.178 -9.270 467 HG13 VAL 74 HG13 VAL 74 0.040 -6.709 -8.839 468 HG21 VAL 74 HG21 VAL 74 2.797 -7.404 -6.591 469 HG22 VAL 74 HG22 VAL 74 2.639 -5.968 -5.580 470 HG23 VAL 74 HG23 VAL 74 3.349 -5.840 -7.189 471 H ILE 75 HN ILE 75 2.616 -2.797 -6.570 472 HA ILE 75 HA ILE 75 2.170 -3.099 -3.717 473 HB ILE 75 HB ILE 75 4.019 -1.505 -3.440 474 HG12 ILE 75 HG12 ILE 75 4.519 -1.623 -6.387 475 HG13 ILE 75 HG11 ILE 75 3.412 -0.427 -5.737 476 HG21 ILE 75 HG21 ILE 75 4.588 -3.766 -5.331 477 HG22 ILE 75 HG22 ILE 75 4.514 -3.859 -3.572 478 HG23 ILE 75 HG23 ILE 75 5.790 -2.927 -4.355 479 HD11 ILE 75 HD11 ILE 75 5.178 0.461 -4.325 480 HD12 ILE 75 HD12 ILE 75 5.646 0.479 -6.027 481 HD13 ILE 75 HD13 ILE 75 6.286 -0.762 -4.948 482 H ALA 76 HN ALA 76 2.356 -0.954 -2.509 483 HA ALA 76 HA ALA 76 0.894 1.249 -3.751 484 HB1 ALA 76 HB1 ALA 76 0.070 -0.079 -1.165 485 HB2 ALA 76 HB2 ALA 76 -0.831 -0.099 -2.686 486 HB3 ALA 76 HB3 ALA 76 -0.613 1.419 -1.811 487 H ILE 77 HN ILE 77 1.421 3.279 -2.814 488 HA ILE 77 HA ILE 77 3.629 3.168 -0.864 489 HB ILE 77 HB ILE 77 3.389 5.045 -3.222 490 HG12 ILE 77 HG12 ILE 77 5.349 2.801 -2.683 491 HG13 ILE 77 HG11 ILE 77 4.026 2.741 -3.843 492 HG21 ILE 77 HG21 ILE 77 5.606 5.846 -2.561 493 HG22 ILE 77 HG22 ILE 77 5.560 4.800 -1.142 494 HG23 ILE 77 HG23 ILE 77 4.413 6.131 -1.294 495 HD11 ILE 77 HD11 ILE 77 6.375 4.617 -3.957 496 HD12 ILE 77 HD12 ILE 77 5.058 4.528 -5.126 497 HD13 ILE 77 HD13 ILE 77 6.157 3.163 -4.931 498 H GLY 78 HN GLY 78 3.452 4.453 0.875 499 HA2 GLY 78 HA2 GLY 78 2.806 6.219 2.214 500 HA3 GLY 78 HA1 GLY 78 2.093 6.981 0.799 501 H CYS 79 HN CYS 79 1.470 3.922 2.514 502 HA CYS 79 HA CYS 79 -1.380 4.515 2.320 503 HB2 CYS 79 HB2 CYS 79 0.257 2.077 2.379 504 HB3 CYS 79 HB1 CYS 79 -1.233 1.985 3.300 505 H LEU 80 HN LEU 80 -2.617 4.931 4.006 506 HA LEU 80 HA LEU 80 -1.540 4.419 6.691 507 HB2 LEU 80 HB2 LEU 80 -3.842 6.171 5.838 508 HB3 LEU 80 HB1 LEU 80 -3.306 5.916 7.491 509 HG LEU 80 HG LEU 80 -1.681 7.228 5.314 510 HD11 LEU 80 HD11 LEU 80 -3.040 8.389 7.740 511 HD12 LEU 80 HD12 LEU 80 -3.533 8.620 6.062 512 HD13 LEU 80 HD13 LEU 80 -1.991 9.266 6.625 513 HD21 LEU 80 HD21 LEU 80 -1.099 6.743 8.233 514 HD22 LEU 80 HD22 LEU 80 -0.140 7.773 7.170 515 HD23 LEU 80 HD23 LEU 80 -0.251 6.042 6.854 516 HA PRO 81 HA PRO 81 -4.234 0.931 6.810 517 HB2 PRO 81 HB2 PRO 81 -3.952 1.038 9.722 518 HB3 PRO 81 HB1 PRO 81 -3.418 -0.203 8.592 519 HG2 PRO 81 HG2 PRO 81 -1.690 1.419 9.862 520 HG3 PRO 81 HG1 PRO 81 -1.389 0.809 8.227 521 HD2 PRO 81 HD2 PRO 81 -2.356 3.510 9.092 522 HD3 PRO 81 HD1 PRO 81 -1.220 3.079 7.808 523 H VAL 82 HN VAL 82 -6.344 1.051 6.587 524 HA VAL 82 HA VAL 82 -7.912 2.598 8.516 525 HB VAL 82 HB VAL 82 -9.714 2.478 6.712 526 HG11 VAL 82 HG11 VAL 82 -8.820 4.425 5.513 527 HG12 VAL 82 HG12 VAL 82 -7.216 4.074 6.155 528 HG13 VAL 82 HG13 VAL 82 -8.521 4.537 7.248 529 HG21 VAL 82 HG21 VAL 82 -8.960 2.229 4.409 530 HG22 VAL 82 HG22 VAL 82 -8.689 0.749 5.331 531 HG23 VAL 82 HG23 VAL 82 -7.339 1.830 4.979 532 H THR 83 HN THR 83 -9.851 1.641 9.265 533 HA THR 83 HA THR 83 -9.932 -1.287 8.997 534 HB THR 83 HB THR 83 -10.210 0.134 11.650 535 HG1 THR 83 HG1 THR 83 -7.925 -0.980 10.375 536 HG21 THR 83 HG21 THR 83 -9.830 -2.108 12.572 537 HG22 THR 83 HG22 THR 83 -9.738 -2.764 10.937 538 HG23 THR 83 HG23 THR 83 -11.250 -2.076 11.528 539 H LEU 84 HN LEU 84 -11.954 -2.233 9.303 540 HA LEU 84 HA LEU 84 -14.192 -2.461 9.387 541 HB2 LEU 84 HB2 LEU 84 -13.945 0.136 10.865 542 HB3 LEU 84 HB1 LEU 84 -15.481 -0.682 10.644 543 HG LEU 84 HG LEU 84 -13.108 -1.962 11.994 544 HD11 LEU 84 HD11 LEU 84 -14.234 -1.468 14.108 545 HD12 LEU 84 HD12 LEU 84 -15.440 -0.519 13.239 546 HD13 LEU 84 HD13 LEU 84 -13.755 0.001 13.262 547 HD21 LEU 84 HD21 LEU 84 -14.821 -3.481 12.885 548 HD22 LEU 84 HD22 LEU 84 -14.731 -3.531 11.125 549 HD23 LEU 84 HD23 LEU 84 -16.040 -2.653 11.916 Start of MODEL 13 1 H1 GLY 1 HT1 GLY 1 -20.920 2.139 -2.205 2 H2 GLY 1 HT2 GLY 1 -21.377 3.599 -1.490 3 H3 GLY 1 HT3 GLY 1 -19.872 2.918 -1.130 4 HA2 GLY 1 HA1 GLY 1 -20.721 3.971 -3.769 5 HA3 GLY 1 HA2 GLY 1 -19.615 4.763 -2.653 6 H SER 2 HN SER 2 -18.559 4.469 -5.002 7 HA SER 2 HA SER 2 -17.174 1.904 -5.174 8 HB2 SER 2 HB2 SER 2 -18.213 2.976 -7.208 9 HB3 SER 2 HB1 SER 2 -17.012 4.260 -7.071 10 HG SER 2 HG SER 2 -15.985 2.907 -8.367 11 H TRP 3 HN TRP 3 -15.040 1.652 -4.808 12 HA TRP 3 HA TRP 3 -12.924 2.019 -4.101 13 HB2 TRP 3 HB2 TRP 3 -13.509 4.856 -4.952 14 HB3 TRP 3 HB1 TRP 3 -11.954 4.348 -4.308 15 HD1 TRP 3 HD1 TRP 3 -14.250 3.684 -7.348 16 HE1 TRP 3 HE1 TRP 3 -12.768 2.929 -9.319 17 HE3 TRP 3 HE3 TRP 3 -9.761 3.422 -4.921 18 HZ2 TRP 3 HZ2 TRP 3 -10.053 2.310 -9.772 19 HZ3 TRP 3 HZ3 TRP 3 -7.770 2.744 -6.194 20 HH2 TRP 3 HH2 TRP 3 -7.914 2.198 -8.570 21 H GLY 4 HN GLY 4 -14.686 4.936 -3.053 22 HA2 GLY 4 HA2 GLY 4 -15.502 4.822 -0.681 23 HA3 GLY 4 HA1 GLY 4 -13.873 4.289 -0.292 24 H GLN 5 HN GLN 5 -14.839 6.426 1.007 25 HA GLN 5 HA GLN 5 -13.696 8.777 -0.315 26 HB2 GLN 5 HB2 GLN 5 -15.467 8.489 2.115 27 HB3 GLN 5 HB1 GLN 5 -14.702 10.005 1.671 28 HG2 GLN 5 HG2 GLN 5 -16.912 10.106 0.868 29 HG3 GLN 5 HG1 GLN 5 -15.885 9.840 -0.538 30 HE21 GLN 5 HE21 GLN 5 -18.249 8.439 1.598 31 HE22 GLN 5 HE22 GLN 5 -18.659 7.103 0.581 32 H CYS 6 HN CYS 6 -11.587 9.064 0.058 33 HA CYS 6 HA CYS 6 -10.669 9.112 2.809 34 HB2 CYS 6 HB2 CYS 6 -10.259 6.761 2.014 35 HB3 CYS 6 HB1 CYS 6 -9.192 7.425 0.779 36 H SER 7 HN SER 7 -10.784 11.370 2.042 37 HA SER 7 HA SER 7 -9.776 13.318 1.468 38 HB2 SER 7 HB2 SER 7 -8.102 12.333 3.075 39 HB3 SER 7 HB1 SER 7 -7.203 11.735 1.683 40 HG SER 7 HG SER 7 -6.960 14.069 2.798 41 H THR 8 HN THR 8 -7.106 13.344 0.039 42 HA THR 8 HA THR 8 -8.162 13.039 -2.662 43 HB THR 8 HB THR 8 -6.035 14.226 -3.308 44 HG1 THR 8 HG1 THR 8 -4.561 14.490 -1.820 45 HG21 THR 8 HG21 THR 8 -8.120 15.458 -3.025 46 HG22 THR 8 HG22 THR 8 -6.753 16.417 -2.458 47 HG23 THR 8 HG23 THR 8 -7.809 15.613 -1.295 48 H GLY 9 HN GLY 9 -7.251 10.774 -0.868 49 HA2 GLY 9 HA2 GLY 9 -4.910 9.810 -2.358 50 HA3 GLY 9 HA1 GLY 9 -5.458 9.198 -0.806 51 H SER 10 HN SER 10 -5.142 7.137 -1.905 52 HA SER 10 HA SER 10 -7.510 6.357 -3.475 53 HB2 SER 10 HB2 SER 10 -5.391 6.355 -4.815 54 HB3 SER 10 HB1 SER 10 -4.717 5.189 -3.679 55 HG SER 10 HG SER 10 -6.872 4.857 -5.481 56 H ILE 11 HN ILE 11 -8.342 4.236 -2.986 57 HA ILE 11 HA ILE 11 -7.362 3.210 -0.417 58 HB ILE 11 HB ILE 11 -10.155 2.958 -1.525 59 HG12 ILE 11 HG12 ILE 11 -8.957 4.639 0.671 60 HG13 ILE 11 HG11 ILE 11 -9.732 5.199 -0.800 61 HG21 ILE 11 HG21 ILE 11 -10.700 2.006 0.668 62 HG22 ILE 11 HG22 ILE 11 -9.000 2.085 1.125 63 HG23 ILE 11 HG23 ILE 11 -9.513 1.016 -0.183 64 HD11 ILE 11 HD11 ILE 11 -11.028 3.807 1.512 65 HD12 ILE 11 HD12 ILE 11 -11.846 4.197 0.000 66 HD13 ILE 11 HD13 ILE 11 -11.237 5.490 1.032 67 H GLN 12 HN GLN 12 -6.729 1.254 -0.250 68 HA GLN 12 HA GLN 12 -7.370 -0.753 -2.239 69 HB2 GLN 12 HB2 GLN 12 -4.793 -1.332 -2.257 70 HB3 GLN 12 HB1 GLN 12 -5.485 -0.216 -3.413 71 HG2 GLN 12 HG2 GLN 12 -4.312 0.801 -0.867 72 HG3 GLN 12 HG1 GLN 12 -3.269 0.358 -2.210 73 HE21 GLN 12 HE21 GLN 12 -5.030 1.194 -4.297 74 HE22 GLN 12 HE22 GLN 12 -5.103 2.916 -4.268 75 H CYS 13 HN CYS 13 -6.286 -2.876 -1.647 76 HA CYS 13 HA CYS 13 -6.154 -3.092 1.282 77 HB2 CYS 13 HB2 CYS 13 -8.207 -4.119 0.537 78 HB3 CYS 13 HB1 CYS 13 -7.358 -5.041 -0.696 79 H CYS 14 HN CYS 14 -4.136 -3.366 1.792 80 HA CYS 14 HA CYS 14 -2.269 -4.584 -0.043 81 HB2 CYS 14 HB2 CYS 14 -1.932 -3.300 2.658 82 HB3 CYS 14 HB1 CYS 14 -0.609 -4.034 1.762 83 H GLN 15 HN GLN 15 -1.720 -6.603 -0.028 84 HA GLN 15 HA GLN 15 -2.536 -8.431 1.937 85 HB2 GLN 15 HB2 GLN 15 -2.069 -9.829 0.264 86 HB3 GLN 15 HB1 GLN 15 -1.375 -8.497 -0.634 87 HG2 GLN 15 HG2 GLN 15 0.242 -10.186 -0.613 88 HG3 GLN 15 HG1 GLN 15 0.787 -8.976 0.540 89 HE21 GLN 15 HE21 GLN 15 -1.796 -11.226 1.217 90 HE22 GLN 15 HE22 GLN 15 -0.941 -12.167 2.384 91 H ASN 16 HN ASN 16 0.415 -6.614 1.397 92 HA ASN 16 HA ASN 16 1.275 -7.341 4.117 93 HB2 ASN 16 HB2 ASN 16 2.580 -8.173 1.826 94 HB3 ASN 16 HB1 ASN 16 3.451 -6.721 2.296 95 HD21 ASN 16 HD21 ASN 16 4.263 -9.511 2.305 96 HD22 ASN 16 HD22 ASN 16 4.773 -9.852 3.924 97 H VAL 17 HN VAL 17 1.072 -5.506 5.234 98 HA VAL 17 HA VAL 17 1.806 -2.961 3.980 99 HB VAL 17 HB VAL 17 0.465 -3.480 6.648 100 HG11 VAL 17 HG11 VAL 17 1.797 -1.433 6.699 101 HG12 VAL 17 HG12 VAL 17 0.074 -1.059 6.704 102 HG13 VAL 17 HG13 VAL 17 1.011 -0.874 5.222 103 HG21 VAL 17 HG21 VAL 17 -0.979 -4.011 4.772 104 HG22 VAL 17 HG22 VAL 17 -0.634 -2.445 4.038 105 HG23 VAL 17 HG23 VAL 17 -1.522 -2.528 5.559 106 H VAL 18 HN VAL 18 3.915 -2.549 4.092 107 HA VAL 18 HA VAL 18 5.276 -2.985 6.662 108 HB VAL 18 HB VAL 18 7.333 -3.637 5.388 109 HG11 VAL 18 HG11 VAL 18 5.967 -5.328 6.482 110 HG12 VAL 18 HG12 VAL 18 6.627 -5.950 4.969 111 HG13 VAL 18 HG13 VAL 18 4.939 -5.443 5.054 112 HG21 VAL 18 HG21 VAL 18 5.405 -3.869 3.078 113 HG22 VAL 18 HG22 VAL 18 7.073 -4.438 3.086 114 HG23 VAL 18 HG23 VAL 18 6.731 -2.714 3.217 115 HA PRO 19 HA PRO 19 6.720 1.214 6.098 116 HB2 PRO 19 HB2 PRO 19 9.028 0.298 7.686 117 HB3 PRO 19 HB1 PRO 19 7.923 1.640 7.987 118 HG2 PRO 19 HG2 PRO 19 7.807 -0.607 9.436 119 HG3 PRO 19 HG1 PRO 19 6.343 0.291 8.996 120 HD2 PRO 19 HD2 PRO 19 7.442 -2.231 7.829 121 HD3 PRO 19 HD1 PRO 19 5.755 -1.763 8.128 122 H GLY 20 HN GLY 20 8.042 2.187 4.654 123 HA2 GLY 20 HA2 GLY 20 9.462 0.587 2.797 124 HA3 GLY 20 HA1 GLY 20 9.483 2.342 2.872 125 H ASP 21 HN ASP 21 10.407 2.062 5.761 126 HA ASP 21 HA ASP 21 13.249 1.628 5.165 127 HB2 ASP 21 HB2 ASP 21 13.742 2.977 7.064 128 HB3 ASP 21 HB1 ASP 21 12.411 3.789 6.248 129 H SER 22 HN SER 22 10.777 -0.181 6.098 130 HA SER 22 HA SER 22 11.872 -1.520 8.388 131 HB2 SER 22 HB2 SER 22 9.475 -1.562 8.074 132 HB3 SER 22 HB1 SER 22 9.643 -2.260 6.474 133 HG SER 22 HG SER 22 10.298 -3.472 8.961 134 H ASP 23 HN ASP 23 12.702 -3.666 8.398 135 HA ASP 23 HA ASP 23 14.666 -4.234 6.523 136 HB2 ASP 23 HB2 ASP 23 13.199 -5.940 8.514 137 HB3 ASP 23 HB1 ASP 23 14.316 -6.693 7.384 138 H LEU 24 HN LEU 24 11.313 -5.311 6.642 139 HA LEU 24 HA LEU 24 11.532 -6.984 4.338 140 HB2 LEU 24 HB2 LEU 24 9.407 -6.109 6.162 141 HB3 LEU 24 HB1 LEU 24 8.875 -6.399 4.519 142 HG LEU 24 HG LEU 24 8.584 -8.370 5.957 143 HD11 LEU 24 HD11 LEU 24 8.952 -8.620 3.540 144 HD12 LEU 24 HD12 LEU 24 9.586 -9.987 4.457 145 HD13 LEU 24 HD13 LEU 24 10.685 -8.760 3.831 146 HD21 LEU 24 HD21 LEU 24 10.548 -9.617 6.722 147 HD22 LEU 24 HD22 LEU 24 10.452 -8.024 7.473 148 HD23 LEU 24 HD23 LEU 24 11.591 -8.312 6.157 149 H GLY 25 HN GLY 25 9.800 -3.912 4.858 150 HA2 GLY 25 HA2 GLY 25 9.012 -3.474 2.245 151 HA3 GLY 25 HA1 GLY 25 9.280 -2.201 3.423 152 H THR 26 HN THR 26 12.070 -2.626 3.765 153 HA THR 26 HA THR 26 13.017 -1.014 1.642 154 HB THR 26 HB THR 26 14.583 -2.502 3.761 155 HG1 THR 26 HG1 THR 26 13.166 -0.083 3.717 156 HG21 THR 26 HG21 THR 26 16.362 -0.921 3.337 157 HG22 THR 26 HG22 THR 26 15.392 -0.111 2.109 158 HG23 THR 26 HG23 THR 26 15.959 -1.760 1.838 159 H LEU 27 HN LEU 27 13.596 -4.399 2.533 160 HA LEU 27 HA LEU 27 15.278 -4.979 0.338 161 HB2 LEU 27 HB2 LEU 27 14.934 -6.284 2.520 162 HB3 LEU 27 HB1 LEU 27 13.513 -6.963 1.760 163 HG LEU 27 HG LEU 27 15.622 -8.375 1.716 164 HD11 LEU 27 HD11 LEU 27 13.709 -8.854 0.282 165 HD12 LEU 27 HD12 LEU 27 15.231 -9.196 -0.541 166 HD13 LEU 27 HD13 LEU 27 14.330 -7.730 -0.928 167 HD21 LEU 27 HD21 LEU 27 16.421 -6.392 -0.409 168 HD22 LEU 27 HD22 LEU 27 17.269 -7.879 0.008 169 HD23 LEU 27 HD23 LEU 27 17.178 -6.561 1.175 170 H LEU 28 HN LEU 28 11.807 -4.962 0.795 171 HA LEU 28 HA LEU 28 11.150 -6.452 -1.527 172 HB2 LEU 28 HB2 LEU 28 9.474 -4.417 -0.055 173 HB3 LEU 28 HB1 LEU 28 8.882 -5.561 -1.238 174 HG LEU 28 HG LEU 28 9.821 -6.081 1.563 175 HD11 LEU 28 HD11 LEU 28 7.682 -7.215 1.746 176 HD12 LEU 28 HD12 LEU 28 7.336 -6.862 0.053 177 HD13 LEU 28 HD13 LEU 28 7.473 -5.546 1.220 178 HD21 LEU 28 HD21 LEU 28 9.658 -8.491 1.082 179 HD22 LEU 28 HD22 LEU 28 10.995 -7.704 0.245 180 HD23 LEU 28 HD23 LEU 28 9.522 -8.115 -0.636 181 H LEU 29 HN LEU 29 11.409 -2.960 -0.883 182 HA LEU 29 HA LEU 29 10.709 -2.345 -3.614 183 HB2 LEU 29 HB2 LEU 29 11.082 -0.033 -3.010 184 HB3 LEU 29 HB1 LEU 29 10.061 -0.821 -1.843 185 HG LEU 29 HG LEU 29 12.185 -1.023 -0.402 186 HD11 LEU 29 HD11 LEU 29 13.075 1.122 -2.329 187 HD12 LEU 29 HD12 LEU 29 13.830 -0.457 -2.108 188 HD13 LEU 29 HD13 LEU 29 13.860 0.725 -0.800 189 HD21 LEU 29 HD21 LEU 29 10.905 1.629 -1.021 190 HD22 LEU 29 HD22 LEU 29 11.862 1.283 0.424 191 HD23 LEU 29 HD23 LEU 29 10.345 0.429 0.146 192 H ASP 30 HN ASP 30 13.594 -2.926 -1.823 193 HA ASP 30 HA ASP 30 15.511 -1.936 -3.637 194 HB2 ASP 30 HB2 ASP 30 16.083 -2.723 -1.383 195 HB3 ASP 30 HB1 ASP 30 15.616 -4.357 -1.819 196 H GLU 31 HN GLU 31 13.608 -4.828 -3.496 197 HA GLU 31 HA GLU 31 14.899 -6.221 -5.615 198 HB2 GLU 31 HB2 GLU 31 13.805 -7.541 -4.010 199 HB3 GLU 31 HB1 GLU 31 12.377 -6.532 -4.040 200 HG2 GLU 31 HG2 GLU 31 11.896 -7.326 -6.297 201 HG3 GLU 31 HG1 GLU 31 13.271 -8.424 -6.188 202 H LEU 32 HN LEU 32 12.128 -4.162 -5.221 203 HA LEU 32 HA LEU 32 11.154 -4.539 -7.898 204 HB2 LEU 32 HB2 LEU 32 10.366 -2.804 -5.588 205 HB3 LEU 32 HB1 LEU 32 9.570 -2.679 -7.143 206 HG LEU 32 HG LEU 32 9.680 -5.162 -5.429 207 HD11 LEU 32 HD11 LEU 32 7.303 -4.753 -5.062 208 HD12 LEU 32 HD12 LEU 32 7.421 -3.245 -5.968 209 HD13 LEU 32 HD13 LEU 32 8.290 -3.429 -4.444 210 HD21 LEU 32 HD21 LEU 32 9.565 -5.719 -7.782 211 HD22 LEU 32 HD22 LEU 32 8.228 -4.593 -8.009 212 HD23 LEU 32 HD23 LEU 32 8.010 -6.032 -7.013 213 H GLY 33 HN GLY 33 13.337 -2.395 -6.352 214 HA2 GLY 33 HA2 GLY 33 14.767 -0.864 -7.340 215 HA3 GLY 33 HA1 GLY 33 13.924 -1.104 -8.862 216 H ILE 34 HN ILE 34 12.434 -0.192 -5.809 217 HA ILE 34 HA ILE 34 11.181 2.066 -7.141 218 HB ILE 34 HB ILE 34 10.843 1.214 -4.263 219 HG12 ILE 34 HG12 ILE 34 9.159 0.434 -6.657 220 HG13 ILE 34 HG11 ILE 34 10.322 -0.629 -5.872 221 HG21 ILE 34 HG21 ILE 34 9.083 2.850 -6.087 222 HG22 ILE 34 HG22 ILE 34 10.092 3.480 -4.785 223 HG23 ILE 34 HG23 ILE 34 8.730 2.422 -4.412 224 HD11 ILE 34 HD11 ILE 34 7.906 0.573 -4.546 225 HD12 ILE 34 HD12 ILE 34 9.036 -0.576 -3.831 226 HD13 ILE 34 HD13 ILE 34 8.015 -1.069 -5.180 227 H VAL 35 HN VAL 35 11.777 4.130 -6.935 228 HA VAL 35 HA VAL 35 13.925 4.799 -5.095 229 HB VAL 35 HB VAL 35 12.513 6.580 -7.090 230 HG11 VAL 35 HG11 VAL 35 15.094 6.947 -5.571 231 HG12 VAL 35 HG12 VAL 35 13.585 7.815 -5.288 232 HG13 VAL 35 HG13 VAL 35 14.463 8.041 -6.802 233 HG21 VAL 35 HG21 VAL 35 15.127 5.092 -7.347 234 HG22 VAL 35 HG22 VAL 35 14.480 6.247 -8.513 235 HG23 VAL 35 HG23 VAL 35 13.635 4.728 -8.212 236 H LEU 36 HN LEU 36 13.153 4.951 -3.061 237 HA LEU 36 HA LEU 36 10.605 6.073 -2.449 238 HB2 LEU 36 HB2 LEU 36 11.576 6.075 -0.058 239 HB3 LEU 36 HB1 LEU 36 11.253 4.543 -0.825 240 HG LEU 36 HG LEU 36 13.815 4.759 -1.510 241 HD11 LEU 36 HD11 LEU 36 15.129 5.802 0.217 242 HD12 LEU 36 HD12 LEU 36 13.666 6.296 1.066 243 HD13 LEU 36 HD13 LEU 36 14.041 6.987 -0.512 244 HD21 LEU 36 HD21 LEU 36 12.952 2.896 -0.299 245 HD22 LEU 36 HD22 LEU 36 12.741 3.869 1.155 246 HD23 LEU 36 HD23 LEU 36 14.364 3.501 0.568 247 H GLU 37 HN GLU 37 10.075 8.110 -2.291 248 HA GLU 37 HA GLU 37 12.027 10.215 -2.260 249 HB2 GLU 37 HB2 GLU 37 9.040 10.371 -1.802 250 HB3 GLU 37 HB1 GLU 37 10.107 11.717 -2.163 251 HG2 GLU 37 HG2 GLU 37 10.583 10.730 -4.358 252 HG3 GLU 37 HG1 GLU 37 9.454 9.425 -3.995 253 H ASP 38 HN ASP 38 9.899 8.606 -0.040 254 HA ASP 38 HA ASP 38 11.445 9.580 2.208 255 HB2 ASP 38 HB2 ASP 38 8.447 9.862 1.928 256 HB3 ASP 38 HB1 ASP 38 9.247 9.846 3.495 257 HA PRO 39 HA PRO 39 10.968 5.120 2.419 258 HB2 PRO 39 HB2 PRO 39 12.844 4.711 4.346 259 HB3 PRO 39 HB1 PRO 39 13.263 5.005 2.656 260 HG2 PRO 39 HG2 PRO 39 13.261 6.908 4.965 261 HG3 PRO 39 HG1 PRO 39 14.454 6.727 3.667 262 HD2 PRO 39 HD2 PRO 39 12.570 8.681 3.677 263 HD3 PRO 39 HD1 PRO 39 13.209 7.972 2.182 264 H THR 40 HN THR 40 10.135 7.500 4.568 265 HA THR 40 HA THR 40 9.650 5.806 6.879 266 HB THR 40 HB THR 40 8.799 7.971 7.882 267 HG1 THR 40 HG1 THR 40 8.374 9.405 6.355 268 HG21 THR 40 HG21 THR 40 11.615 7.986 6.785 269 HG22 THR 40 HG22 THR 40 11.091 7.149 8.245 270 HG23 THR 40 HG23 THR 40 11.036 8.910 8.171 271 H VAL 41 HN VAL 41 8.118 5.860 4.171 272 HA VAL 41 HA VAL 41 5.420 6.213 5.260 273 HB VAL 41 HB VAL 41 4.601 6.221 2.990 274 HG11 VAL 41 HG11 VAL 41 7.020 7.994 3.264 275 HG12 VAL 41 HG12 VAL 41 5.404 8.331 3.885 276 HG13 VAL 41 HG13 VAL 41 5.679 8.245 2.145 277 HG21 VAL 41 HG21 VAL 41 7.451 5.757 2.116 278 HG22 VAL 41 HG22 VAL 41 6.073 6.054 1.054 279 HG23 VAL 41 HG23 VAL 41 6.138 4.584 2.024 280 H LEU 42 HN LEU 42 3.821 4.604 4.783 281 HA LEU 42 HA LEU 42 4.875 1.913 4.991 282 HB2 LEU 42 HB2 LEU 42 2.066 3.009 5.087 283 HB3 LEU 42 HB1 LEU 42 2.442 1.304 5.224 284 HG LEU 42 HG LEU 42 3.378 3.444 7.141 285 HD11 LEU 42 HD11 LEU 42 0.975 3.105 7.286 286 HD12 LEU 42 HD12 LEU 42 1.787 2.436 8.702 287 HD13 LEU 42 HD13 LEU 42 1.216 1.363 7.424 288 HD21 LEU 42 HD21 LEU 42 3.611 0.438 7.225 289 HD22 LEU 42 HD22 LEU 42 4.049 1.534 8.536 290 HD23 LEU 42 HD23 LEU 42 4.931 1.587 7.010 291 H ILE 43 HN ILE 43 5.262 0.717 3.280 292 HA ILE 43 HA ILE 43 3.761 1.291 0.832 293 HB ILE 43 HB ILE 43 5.475 -0.216 -0.283 294 HG12 ILE 43 HG12 ILE 43 7.085 0.378 2.203 295 HG13 ILE 43 HG11 ILE 43 6.353 -1.185 1.858 296 HG21 ILE 43 HG21 ILE 43 5.453 2.177 -0.588 297 HG22 ILE 43 HG22 ILE 43 7.117 1.607 -0.467 298 HG23 ILE 43 HG23 ILE 43 6.356 2.406 0.908 299 HD11 ILE 43 HD11 ILE 43 8.734 -1.101 1.275 300 HD12 ILE 43 HD12 ILE 43 8.389 0.188 0.120 301 HD13 ILE 43 HD13 ILE 43 7.710 -1.419 -0.124 302 H GLY 44 HN GLY 44 2.472 -0.167 -0.073 303 HA2 GLY 44 HA2 GLY 44 1.951 -2.548 1.567 304 HA3 GLY 44 HA1 GLY 44 0.770 -1.734 0.569 305 H ASP 45 HN ASP 45 3.151 -4.155 0.723 306 HA ASP 45 HA ASP 45 3.198 -4.624 -2.135 307 HB2 ASP 45 HB2 ASP 45 5.169 -5.203 -0.739 308 HB3 ASP 45 HB1 ASP 45 4.189 -6.388 0.122 309 H GLY 46 HN GLY 46 1.823 -5.922 -3.216 310 HA2 GLY 46 HA2 GLY 46 0.174 -7.555 -3.511 311 HA3 GLY 46 HA1 GLY 46 0.228 -7.855 -1.795 312 H CYS 47 HN CYS 47 -0.255 -4.731 -3.342 313 HA CYS 47 HA CYS 47 -2.746 -4.526 -1.794 314 HB2 CYS 47 HB2 CYS 47 -0.577 -2.879 -1.756 315 HB3 CYS 47 HB1 CYS 47 -1.605 -2.083 -2.947 316 H ASP 48 HN ASP 48 -4.426 -4.968 -2.973 317 HA ASP 48 HA ASP 48 -4.570 -3.922 -5.700 318 HB2 ASP 48 HB2 ASP 48 -5.126 -6.146 -5.840 319 HB3 ASP 48 HB1 ASP 48 -5.981 -6.155 -4.307 320 HA PRO 49 HA PRO 49 -7.122 -0.580 -4.427 321 HB2 PRO 49 HB2 PRO 49 -8.327 -0.669 -7.083 322 HB3 PRO 49 HB1 PRO 49 -7.306 0.567 -6.367 323 HG2 PRO 49 HG2 PRO 49 -6.507 -1.113 -8.371 324 HG3 PRO 49 HG1 PRO 49 -5.408 -0.310 -7.240 325 HD2 PRO 49 HD2 PRO 49 -6.282 -3.143 -7.332 326 HD3 PRO 49 HD1 PRO 49 -4.790 -2.431 -6.698 327 H ILE 50 HN ILE 50 -8.930 -0.766 -3.229 328 HA ILE 50 HA ILE 50 -10.765 -2.936 -3.732 329 HB ILE 50 HB ILE 50 -11.161 -0.732 -1.706 330 HG12 ILE 50 HG12 ILE 50 -9.684 -3.343 -1.304 331 HG13 ILE 50 HG11 ILE 50 -8.912 -1.767 -1.421 332 HG21 ILE 50 HG21 ILE 50 -12.471 -2.405 -0.539 333 HG22 ILE 50 HG22 ILE 50 -12.055 -3.611 -1.754 334 HG23 ILE 50 HG23 ILE 50 -13.064 -2.229 -2.193 335 HD11 ILE 50 HD11 ILE 50 -10.181 -1.049 0.570 336 HD12 ILE 50 HD12 ILE 50 -9.091 -2.397 0.882 337 HD13 ILE 50 HD13 ILE 50 -10.821 -2.684 0.707 338 H THR 51 HN THR 51 -11.642 -2.427 -5.704 339 HA THR 51 HA THR 51 -13.391 -0.067 -5.735 340 HB THR 51 HB THR 51 -11.541 0.123 -7.357 341 HG1 THR 51 HG1 THR 51 -13.118 1.207 -8.270 342 HG21 THR 51 HG21 THR 51 -12.745 -2.344 -8.608 343 HG22 THR 51 HG22 THR 51 -11.169 -2.232 -7.823 344 HG23 THR 51 HG23 THR 51 -11.474 -1.349 -9.319 345 H VAL 52 HN VAL 52 -13.588 -3.109 -5.103 346 HA VAL 52 HA VAL 52 -15.954 -3.652 -6.725 347 HB VAL 52 HB VAL 52 -14.431 -5.514 -6.610 348 HG11 VAL 52 HG11 VAL 52 -14.715 -5.360 -3.615 349 HG12 VAL 52 HG12 VAL 52 -13.268 -4.969 -4.543 350 HG13 VAL 52 HG13 VAL 52 -13.867 -6.627 -4.501 351 HG21 VAL 52 HG21 VAL 52 -16.865 -5.984 -4.906 352 HG22 VAL 52 HG22 VAL 52 -15.910 -7.244 -5.688 353 HG23 VAL 52 HG23 VAL 52 -16.781 -6.062 -6.666 354 H ALA 53 HN ALA 53 -17.870 -3.195 -5.957 355 HA ALA 53 HA ALA 53 -18.097 -2.566 -3.097 356 HB1 ALA 53 HB1 ALA 53 -18.557 -0.707 -4.630 357 HB2 ALA 53 HB2 ALA 53 -19.983 -1.150 -3.693 358 HB3 ALA 53 HB3 ALA 53 -19.846 -1.649 -5.379 359 H GLY 54 HN GLY 54 -20.103 -3.116 -2.015 360 HA2 GLY 54 HA2 GLY 54 -22.270 -4.397 -2.468 361 HA3 GLY 54 HA1 GLY 54 -21.183 -5.655 -3.038 362 H SER 55 HN SER 55 -19.165 -5.159 -1.035 363 HA SER 55 HA SER 55 -20.559 -5.866 1.444 364 HB2 SER 55 HB2 SER 55 -18.830 -7.694 1.785 365 HB3 SER 55 HB1 SER 55 -20.032 -8.012 0.537 366 HG SER 55 HG SER 55 -18.015 -6.752 -0.617 367 H SER 56 HN SER 56 -19.379 -5.475 3.344 368 HA SER 56 HA SER 56 -17.534 -3.296 3.171 369 HB2 SER 56 HB2 SER 56 -19.205 -3.496 4.991 370 HB3 SER 56 HB1 SER 56 -18.368 -4.929 5.580 371 HG SER 56 HG SER 56 -16.888 -2.574 5.244 372 H ASP 57 HN ASP 57 -17.326 -6.744 3.836 373 HA ASP 57 HA ASP 57 -14.450 -6.569 4.225 374 HB2 ASP 57 HB2 ASP 57 -14.545 -9.000 4.620 375 HB3 ASP 57 HB1 ASP 57 -15.671 -8.133 5.654 376 H ALA 58 HN ALA 58 -14.769 -5.549 1.940 377 HA ALA 58 HA ALA 58 -14.997 -7.289 -0.292 378 HB1 ALA 58 HB1 ALA 58 -14.245 -5.386 -1.607 379 HB2 ALA 58 HB2 ALA 58 -13.757 -4.547 -0.136 380 HB3 ALA 58 HB3 ALA 58 -15.460 -4.890 -0.432 381 H CYS 59 HN CYS 59 -12.594 -6.935 1.945 382 HA CYS 59 HA CYS 59 -10.872 -8.707 0.534 383 HB2 CYS 59 HB2 CYS 59 -10.063 -6.626 -0.440 384 HB3 CYS 59 HB1 CYS 59 -9.848 -5.939 1.164 385 H SER 60 HN SER 60 -9.441 -9.776 1.944 386 HA SER 60 HA SER 60 -10.238 -9.392 4.742 387 HB2 SER 60 HB2 SER 60 -10.944 -11.505 3.638 388 HB3 SER 60 HB1 SER 60 -9.245 -11.909 3.417 389 HG SER 60 HG SER 60 -9.065 -11.708 5.757 390 H ALA 61 HN ALA 61 -7.600 -8.860 2.777 391 HA ALA 61 HA ALA 61 -5.575 -9.823 4.575 392 HB1 ALA 61 HB1 ALA 61 -3.965 -8.775 3.110 393 HB2 ALA 61 HB2 ALA 61 -5.250 -7.907 2.269 394 HB3 ALA 61 HB3 ALA 61 -5.152 -9.664 2.157 395 H THR 62 HN THR 62 -5.475 -6.494 3.415 396 HA THR 62 HA THR 62 -6.007 -5.446 6.073 397 HB THR 62 HB THR 62 -3.348 -4.905 4.728 398 HG1 THR 62 HG1 THR 62 -4.159 -6.872 6.485 399 HG21 THR 62 HG21 THR 62 -4.181 -3.041 6.080 400 HG22 THR 62 HG22 THR 62 -2.778 -3.798 6.838 401 HG23 THR 62 HG23 THR 62 -4.399 -4.128 7.451 402 H ALA 63 HN ALA 63 -7.140 -3.608 5.860 403 HA ALA 63 HA ALA 63 -7.372 -2.399 3.236 404 HB1 ALA 63 HB1 ALA 63 -9.389 -2.803 4.576 405 HB2 ALA 63 HB2 ALA 63 -9.180 -1.089 4.210 406 HB3 ALA 63 HB3 ALA 63 -8.779 -1.703 5.814 407 H VAL 64 HN VAL 64 -6.504 -0.513 2.630 408 HA VAL 64 HA VAL 64 -5.304 1.237 4.640 409 HB VAL 64 HB VAL 64 -3.251 1.412 3.113 410 HG11 VAL 64 HG11 VAL 64 -3.078 0.454 5.316 411 HG12 VAL 64 HG12 VAL 64 -2.161 -0.545 4.189 412 HG13 VAL 64 HG13 VAL 64 -3.749 -1.074 4.747 413 HG21 VAL 64 HG21 VAL 64 -2.726 -0.595 1.825 414 HG22 VAL 64 HG22 VAL 64 -4.192 0.186 1.230 415 HG23 VAL 64 HG23 VAL 64 -4.309 -1.267 2.227 416 H CYS 65 HN CYS 65 -4.360 3.197 3.526 417 HA CYS 65 HA CYS 65 -5.855 3.968 1.126 418 HB2 CYS 65 HB2 CYS 65 -7.120 4.774 3.087 419 HB3 CYS 65 HB1 CYS 65 -5.680 5.593 3.677 420 H CYS 66 HN CYS 66 -4.164 4.254 -0.243 421 HA CYS 66 HA CYS 66 -1.696 5.427 0.755 422 HB2 CYS 66 HB2 CYS 66 -2.477 3.892 -1.639 423 HB3 CYS 66 HB1 CYS 66 -1.199 5.075 -1.867 424 H SER 67 HN SER 67 -1.028 7.385 0.448 425 HA SER 67 HA SER 67 -2.749 9.342 -0.728 426 HB2 SER 67 HB2 SER 67 -1.380 9.826 1.274 427 HB3 SER 67 HB1 SER 67 0.076 9.625 0.304 428 HG SER 67 HG SER 67 -0.584 11.407 -0.951 429 H ASP 68 HN ASP 68 -0.058 7.470 -1.725 430 HA ASP 68 HA ASP 68 0.046 8.950 -4.260 431 HB2 ASP 68 HB2 ASP 68 2.131 7.422 -2.758 432 HB3 ASP 68 HB1 ASP 68 2.226 7.479 -4.515 433 H ASN 69 HN ASN 69 -0.499 7.966 -6.093 434 HA ASN 69 HA ASN 69 -1.416 5.186 -5.898 435 HB2 ASN 69 HB2 ASN 69 -2.692 5.661 -7.958 436 HB3 ASN 69 HB1 ASN 69 -3.092 6.793 -6.670 437 HD21 ASN 69 HD21 ASN 69 -1.683 6.386 -9.789 438 HD22 ASN 69 HD22 ASN 69 -1.465 8.065 -10.139 439 H ASN 70 HN ASN 70 1.369 6.330 -6.324 440 HA ASN 70 HA ASN 70 2.148 5.416 -8.934 441 HB2 ASN 70 HB2 ASN 70 3.352 7.234 -7.753 442 HB3 ASN 70 HB1 ASN 70 3.849 6.084 -6.518 443 HD21 ASN 70 HD21 ASN 70 4.296 7.157 -9.786 444 HD22 ASN 70 HD22 ASN 70 5.750 6.271 -10.087 445 H VAL 71 HN VAL 71 1.643 3.268 -9.155 446 HA VAL 71 HA VAL 71 2.666 1.418 -7.134 447 HB VAL 71 HB VAL 71 1.100 -0.213 -8.126 448 HG11 VAL 71 HG11 VAL 71 0.429 1.080 -6.193 449 HG12 VAL 71 HG12 VAL 71 -0.954 0.814 -7.259 450 HG13 VAL 71 HG13 VAL 71 -0.143 2.380 -7.240 451 HG21 VAL 71 HG21 VAL 71 0.169 2.120 -9.787 452 HG22 VAL 71 HG22 VAL 71 -0.649 0.563 -9.664 453 HG23 VAL 71 HG23 VAL 71 0.957 0.661 -10.386 454 H SER 72 HN SER 72 4.055 -0.196 -7.647 455 HA SER 72 HA SER 72 5.300 -0.126 -10.263 456 HB2 SER 72 HB2 SER 72 6.061 -1.727 -7.849 457 HB3 SER 72 HB1 SER 72 7.038 -1.498 -9.292 458 HG SER 72 HG SER 72 6.464 0.903 -8.520 459 H GLY 73 HN GLY 73 2.626 -1.491 -9.267 460 HA2 GLY 73 HA2 GLY 73 1.729 -2.961 -11.094 461 HA3 GLY 73 HA1 GLY 73 3.100 -3.995 -10.753 462 H VAL 74 HN VAL 74 2.933 -3.815 -7.857 463 HA VAL 74 HA VAL 74 0.212 -4.762 -7.321 464 HB VAL 74 HB VAL 74 0.917 -6.694 -6.121 465 HG11 VAL 74 HG11 VAL 74 2.219 -6.509 -8.827 466 HG12 VAL 74 HG12 VAL 74 0.610 -7.126 -8.439 467 HG13 VAL 74 HG13 VAL 74 2.043 -8.019 -7.927 468 HG21 VAL 74 HG21 VAL 74 3.278 -7.388 -5.997 469 HG22 VAL 74 HG22 VAL 74 2.947 -5.890 -5.130 470 HG23 VAL 74 HG23 VAL 74 3.738 -5.841 -6.704 471 H ILE 75 HN ILE 75 2.592 -2.710 -6.489 472 HA ILE 75 HA ILE 75 2.261 -2.971 -3.601 473 HB ILE 75 HB ILE 75 4.034 -1.282 -3.409 474 HG12 ILE 75 HG12 ILE 75 4.696 -1.488 -6.287 475 HG13 ILE 75 HG11 ILE 75 3.318 -0.480 -5.876 476 HG21 ILE 75 HG21 ILE 75 5.850 -2.671 -4.249 477 HG22 ILE 75 HG22 ILE 75 4.698 -3.577 -5.227 478 HG23 ILE 75 HG23 ILE 75 4.600 -3.638 -3.466 479 HD11 ILE 75 HD11 ILE 75 5.400 0.794 -6.030 480 HD12 ILE 75 HD12 ILE 75 6.079 -0.189 -4.733 481 HD13 ILE 75 HD13 ILE 75 4.700 0.861 -4.414 482 H ALA 76 HN ALA 76 2.454 -0.718 -2.516 483 HA ALA 76 HA ALA 76 0.933 1.397 -3.797 484 HB1 ALA 76 HB1 ALA 76 0.067 0.082 -1.217 485 HB2 ALA 76 HB2 ALA 76 -0.809 0.063 -2.749 486 HB3 ALA 76 HB3 ALA 76 -0.609 1.580 -1.869 487 H ILE 77 HN ILE 77 1.533 3.441 -2.952 488 HA ILE 77 HA ILE 77 3.693 3.317 -0.947 489 HB ILE 77 HB ILE 77 3.455 5.228 -3.278 490 HG12 ILE 77 HG12 ILE 77 5.427 2.994 -2.739 491 HG13 ILE 77 HG11 ILE 77 4.133 2.952 -3.932 492 HG21 ILE 77 HG21 ILE 77 4.443 6.312 -1.334 493 HG22 ILE 77 HG22 ILE 77 5.661 6.045 -2.581 494 HG23 ILE 77 HG23 ILE 77 5.599 4.992 -1.168 495 HD11 ILE 77 HD11 ILE 77 5.191 4.785 -5.142 496 HD12 ILE 77 HD12 ILE 77 6.274 3.403 -4.970 497 HD13 ILE 77 HD13 ILE 77 6.487 4.824 -3.947 498 H GLY 78 HN GLY 78 3.383 4.399 0.861 499 HA2 GLY 78 HA2 GLY 78 2.805 6.152 2.260 500 HA3 GLY 78 HA1 GLY 78 2.106 6.987 0.878 501 H CYS 79 HN CYS 79 1.471 3.879 2.483 502 HA CYS 79 HA CYS 79 -1.381 4.450 2.287 503 HB2 CYS 79 HB2 CYS 79 0.282 2.022 2.341 504 HB3 CYS 79 HB1 CYS 79 -1.250 1.905 3.187 505 H LEU 80 HN LEU 80 -2.606 4.902 3.949 506 HA LEU 80 HA LEU 80 -1.563 4.451 6.651 507 HB2 LEU 80 HB2 LEU 80 -3.949 6.055 5.736 508 HB3 LEU 80 HB1 LEU 80 -3.397 5.884 7.396 509 HG LEU 80 HG LEU 80 -1.764 7.148 5.195 510 HD11 LEU 80 HD11 LEU 80 -3.746 8.484 5.666 511 HD12 LEU 80 HD12 LEU 80 -2.292 9.276 6.276 512 HD13 LEU 80 HD13 LEU 80 -3.375 8.442 7.389 513 HD21 LEU 80 HD21 LEU 80 -0.406 6.196 6.954 514 HD22 LEU 80 HD22 LEU 80 -1.389 6.990 8.183 515 HD23 LEU 80 HD23 LEU 80 -0.399 7.956 7.086 516 HA PRO 81 HA PRO 81 -4.134 0.854 6.880 517 HB2 PRO 81 HB2 PRO 81 -3.819 1.063 9.783 518 HB3 PRO 81 HB1 PRO 81 -3.260 -0.196 8.686 519 HG2 PRO 81 HG2 PRO 81 -1.567 1.515 9.881 520 HG3 PRO 81 HG1 PRO 81 -1.268 0.867 8.260 521 HD2 PRO 81 HD2 PRO 81 -2.315 3.557 9.060 522 HD3 PRO 81 HD1 PRO 81 -1.175 3.132 7.778 523 H VAL 82 HN VAL 82 -6.253 0.930 6.678 524 HA VAL 82 HA VAL 82 -7.808 2.501 8.597 525 HB VAL 82 HB VAL 82 -9.533 2.648 6.769 526 HG11 VAL 82 HG11 VAL 82 -8.131 4.549 7.381 527 HG12 VAL 82 HG12 VAL 82 -8.447 4.536 5.647 528 HG13 VAL 82 HG13 VAL 82 -6.886 3.995 6.263 529 HG21 VAL 82 HG21 VAL 82 -7.235 1.806 5.022 530 HG22 VAL 82 HG22 VAL 82 -8.792 2.409 4.458 531 HG23 VAL 82 HG23 VAL 82 -8.701 0.875 5.325 532 H THR 83 HN THR 83 -9.785 1.607 9.255 533 HA THR 83 HA THR 83 -10.291 -1.171 8.488 534 HB THR 83 HB THR 83 -10.248 -0.266 11.374 535 HG1 THR 83 HG1 THR 83 -8.289 -1.405 9.723 536 HG21 THR 83 HG21 THR 83 -11.820 -2.087 10.894 537 HG22 THR 83 HG22 THR 83 -10.467 -2.651 11.872 538 HG23 THR 83 HG23 THR 83 -10.520 -3.014 10.147 539 H LEU 84 HN LEU 84 -12.380 -1.629 8.262 540 HA LEU 84 HA LEU 84 -14.605 -1.370 8.032 541 HB2 LEU 84 HB2 LEU 84 -14.227 0.143 10.598 542 HB3 LEU 84 HB1 LEU 84 -15.798 -0.271 9.936 543 HG LEU 84 HG LEU 84 -13.686 -2.276 10.697 544 HD11 LEU 84 HD11 LEU 84 -15.119 -2.770 12.628 545 HD12 LEU 84 HD12 LEU 84 -16.157 -1.414 12.190 546 HD13 LEU 84 HD13 LEU 84 -14.487 -1.125 12.677 547 HD21 LEU 84 HD21 LEU 84 -15.509 -3.897 10.506 548 HD22 LEU 84 HD22 LEU 84 -15.169 -3.091 8.976 549 HD23 LEU 84 HD23 LEU 84 -16.574 -2.615 9.930 Start of MODEL 14 1 H1 GLY 1 HT1 GLY 1 -19.919 3.359 -0.981 2 H2 GLY 1 HT2 GLY 1 -18.450 2.557 -1.198 3 H3 GLY 1 HT3 GLY 1 -19.902 1.741 -1.474 4 HA2 GLY 1 HA1 GLY 1 -20.404 3.211 -3.323 5 HA3 GLY 1 HA2 GLY 1 -18.874 4.030 -3.045 6 H SER 2 HN SER 2 -18.710 3.358 -5.397 7 HA SER 2 HA SER 2 -17.944 0.552 -5.729 8 HB2 SER 2 HB2 SER 2 -19.489 1.566 -7.383 9 HB3 SER 2 HB1 SER 2 -18.245 2.739 -7.807 10 HG SER 2 HG SER 2 -16.926 0.737 -8.247 11 H TRP 3 HN TRP 3 -16.480 3.186 -4.654 12 HA TRP 3 HA TRP 3 -13.853 2.207 -5.369 13 HB2 TRP 3 HB2 TRP 3 -14.286 3.813 -7.171 14 HB3 TRP 3 HB1 TRP 3 -14.700 5.048 -5.994 15 HD1 TRP 3 HD1 TRP 3 -12.732 6.436 -4.955 16 HE1 TRP 3 HE1 TRP 3 -10.186 6.476 -5.340 17 HE3 TRP 3 HE3 TRP 3 -12.282 2.193 -7.744 18 HZ2 TRP 3 HZ2 TRP 3 -8.242 4.902 -6.660 19 HZ3 TRP 3 HZ3 TRP 3 -10.046 1.518 -8.532 20 HH2 TRP 3 HH2 TRP 3 -8.069 2.849 -8.001 21 H GLY 4 HN GLY 4 -12.455 2.476 -3.699 22 HA2 GLY 4 HA2 GLY 4 -13.475 3.365 -1.196 23 HA3 GLY 4 HA1 GLY 4 -11.827 2.854 -1.524 24 H GLN 5 HN GLN 5 -13.999 5.517 -1.243 25 HA GLN 5 HA GLN 5 -12.184 7.534 -2.133 26 HB2 GLN 5 HB2 GLN 5 -14.645 7.791 -0.397 27 HB3 GLN 5 HB1 GLN 5 -13.833 9.095 -1.248 28 HG2 GLN 5 HG2 GLN 5 -15.085 6.738 -2.627 29 HG3 GLN 5 HG1 GLN 5 -15.931 8.250 -2.314 30 HE21 GLN 5 HE21 GLN 5 -16.235 8.637 -4.484 31 HE22 GLN 5 HE22 GLN 5 -14.949 9.137 -5.526 32 H CYS 6 HN CYS 6 -10.717 8.658 -0.976 33 HA CYS 6 HA CYS 6 -10.721 8.423 1.937 34 HB2 CYS 6 HB2 CYS 6 -9.261 6.617 1.026 35 HB3 CYS 6 HB1 CYS 6 -8.273 7.848 0.252 36 H SER 7 HN SER 7 -11.578 10.608 0.827 37 HA SER 7 HA SER 7 -11.382 12.849 0.762 38 HB2 SER 7 HB2 SER 7 -8.791 12.388 2.255 39 HB3 SER 7 HB1 SER 7 -9.650 13.922 2.124 40 HG SER 7 HG SER 7 -10.077 11.855 3.812 41 H THR 8 HN THR 8 -7.896 12.186 0.513 42 HA THR 8 HA THR 8 -7.972 13.393 -2.171 43 HB THR 8 HB THR 8 -5.584 13.400 -0.324 44 HG1 THR 8 HG1 THR 8 -7.452 15.529 -0.691 45 HG21 THR 8 HG21 THR 8 -6.295 15.115 -2.707 46 HG22 THR 8 HG22 THR 8 -5.143 13.783 -2.711 47 HG23 THR 8 HG23 THR 8 -4.817 15.225 -1.752 48 H GLY 9 HN GLY 9 -6.919 10.765 -0.171 49 HA2 GLY 9 HA2 GLY 9 -5.130 9.724 -2.238 50 HA3 GLY 9 HA1 GLY 9 -5.263 9.135 -0.590 51 H SER 10 HN SER 10 -5.184 7.122 -2.001 52 HA SER 10 HA SER 10 -7.895 6.381 -2.886 53 HB2 SER 10 HB2 SER 10 -6.188 6.415 -4.694 54 HB3 SER 10 HB1 SER 10 -5.240 5.235 -3.795 55 HG SER 10 HG SER 10 -6.528 4.237 -5.383 56 H ILE 11 HN ILE 11 -8.628 4.247 -2.339 57 HA ILE 11 HA ILE 11 -7.185 3.122 -0.040 58 HB ILE 11 HB ILE 11 -10.106 2.824 -0.721 59 HG12 ILE 11 HG12 ILE 11 -8.632 4.404 1.379 60 HG13 ILE 11 HG11 ILE 11 -9.628 5.021 0.071 61 HG21 ILE 11 HG21 ILE 11 -10.311 1.686 1.419 62 HG22 ILE 11 HG22 ILE 11 -8.576 1.850 1.686 63 HG23 ILE 11 HG23 ILE 11 -9.174 0.830 0.377 64 HD11 ILE 11 HD11 ILE 11 -11.604 4.061 1.095 65 HD12 ILE 11 HD12 ILE 11 -10.771 5.132 2.222 66 HD13 ILE 11 HD13 ILE 11 -10.610 3.382 2.384 67 H GLN 12 HN GLN 12 -6.501 1.162 -0.042 68 HA GLN 12 HA GLN 12 -7.372 -0.729 -2.082 69 HB2 GLN 12 HB2 GLN 12 -4.817 -1.375 -2.251 70 HB3 GLN 12 HB1 GLN 12 -5.527 -0.168 -3.303 71 HG2 GLN 12 HG2 GLN 12 -4.219 0.647 -0.751 72 HG3 GLN 12 HG1 GLN 12 -3.246 0.266 -2.162 73 HE21 GLN 12 HE21 GLN 12 -5.052 1.286 -4.120 74 HE22 GLN 12 HE22 GLN 12 -5.042 3.001 -3.979 75 H CYS 13 HN CYS 13 -6.514 -2.923 -1.664 76 HA CYS 13 HA CYS 13 -6.302 -3.391 1.229 77 HB2 CYS 13 HB2 CYS 13 -8.336 -4.336 0.321 78 HB3 CYS 13 HB1 CYS 13 -7.450 -5.137 -0.977 79 H CYS 14 HN CYS 14 -4.225 -3.650 1.715 80 HA CYS 14 HA CYS 14 -2.388 -4.748 -0.256 81 HB2 CYS 14 HB2 CYS 14 -1.976 -3.369 2.382 82 HB3 CYS 14 HB1 CYS 14 -0.659 -4.109 1.481 83 H GLN 15 HN GLN 15 -1.581 -6.687 -0.214 84 HA GLN 15 HA GLN 15 -2.304 -8.570 1.776 85 HB2 GLN 15 HB2 GLN 15 -1.887 -9.966 0.087 86 HB3 GLN 15 HB1 GLN 15 -1.331 -8.607 -0.866 87 HG2 GLN 15 HG2 GLN 15 0.381 -10.172 -0.996 88 HG3 GLN 15 HG1 GLN 15 0.947 -8.995 0.182 89 HE21 GLN 15 HE21 GLN 15 -1.480 -11.428 0.868 90 HE22 GLN 15 HE22 GLN 15 -0.514 -12.357 1.958 91 H ASN 16 HN ASN 16 0.444 -6.521 1.196 92 HA ASN 16 HA ASN 16 1.590 -7.410 3.753 93 HB2 ASN 16 HB2 ASN 16 2.727 -8.150 1.399 94 HB3 ASN 16 HB1 ASN 16 3.499 -6.599 1.691 95 HD21 ASN 16 HD21 ASN 16 4.573 -9.322 1.707 96 HD22 ASN 16 HD22 ASN 16 5.331 -9.508 3.253 97 H VAL 17 HN VAL 17 1.217 -5.621 4.926 98 HA VAL 17 HA VAL 17 1.887 -2.998 3.788 99 HB VAL 17 HB VAL 17 0.403 -3.632 6.352 100 HG11 VAL 17 HG11 VAL 17 1.644 -1.535 6.509 101 HG12 VAL 17 HG12 VAL 17 -0.090 -1.229 6.413 102 HG13 VAL 17 HG13 VAL 17 0.927 -0.986 4.994 103 HG21 VAL 17 HG21 VAL 17 -0.868 -4.180 4.329 104 HG22 VAL 17 HG22 VAL 17 -0.611 -2.542 3.731 105 HG23 VAL 17 HG23 VAL 17 -1.568 -2.808 5.187 106 H VAL 18 HN VAL 18 3.973 -2.564 4.035 107 HA VAL 18 HA VAL 18 5.195 -3.012 6.674 108 HB VAL 18 HB VAL 18 7.318 -3.649 5.515 109 HG11 VAL 18 HG11 VAL 18 6.635 -5.951 4.997 110 HG12 VAL 18 HG12 VAL 18 4.946 -5.443 4.997 111 HG13 VAL 18 HG13 VAL 18 5.892 -5.364 6.483 112 HG21 VAL 18 HG21 VAL 18 5.534 -3.823 3.085 113 HG22 VAL 18 HG22 VAL 18 7.196 -4.405 3.183 114 HG23 VAL 18 HG23 VAL 18 6.856 -2.681 3.331 115 HA PRO 19 HA PRO 19 6.696 1.184 6.205 116 HB2 PRO 19 HB2 PRO 19 8.988 0.256 7.809 117 HB3 PRO 19 HB1 PRO 19 7.863 1.577 8.122 118 HG2 PRO 19 HG2 PRO 19 7.762 -0.706 9.525 119 HG3 PRO 19 HG1 PRO 19 6.295 0.194 9.100 120 HD2 PRO 19 HD2 PRO 19 7.414 -2.295 7.881 121 HD3 PRO 19 HD1 PRO 19 5.722 -1.844 8.183 122 H GLY 20 HN GLY 20 7.962 2.122 4.703 123 HA2 GLY 20 HA2 GLY 20 9.415 0.518 2.882 124 HA3 GLY 20 HA1 GLY 20 9.409 2.274 2.927 125 H ASP 21 HN ASP 21 10.337 2.136 5.783 126 HA ASP 21 HA ASP 21 13.190 1.746 5.232 127 HB2 ASP 21 HB2 ASP 21 13.551 3.044 7.280 128 HB3 ASP 21 HB1 ASP 21 12.455 3.906 6.207 129 H SER 22 HN SER 22 10.732 -0.088 6.245 130 HA SER 22 HA SER 22 11.895 -1.393 8.517 131 HB2 SER 22 HB2 SER 22 9.496 -1.529 8.230 132 HB3 SER 22 HB1 SER 22 9.676 -2.203 6.619 133 HG SER 22 HG SER 22 9.572 -3.481 8.956 134 H ASP 23 HN ASP 23 12.756 -3.542 8.512 135 HA ASP 23 HA ASP 23 14.684 -4.090 6.568 136 HB2 ASP 23 HB2 ASP 23 13.274 -5.924 8.516 137 HB3 ASP 23 HB1 ASP 23 14.607 -6.453 7.500 138 H LEU 24 HN LEU 24 11.397 -5.248 6.943 139 HA LEU 24 HA LEU 24 11.320 -6.922 4.678 140 HB2 LEU 24 HB2 LEU 24 9.452 -5.835 6.616 141 HB3 LEU 24 HB1 LEU 24 8.754 -5.894 5.012 142 HG LEU 24 HG LEU 24 8.240 -7.895 6.333 143 HD11 LEU 24 HD11 LEU 24 8.334 -8.029 3.896 144 HD12 LEU 24 HD12 LEU 24 8.851 -9.540 4.642 145 HD13 LEU 24 HD13 LEU 24 10.050 -8.428 3.981 146 HD21 LEU 24 HD21 LEU 24 9.990 -9.509 6.855 147 HD22 LEU 24 HD22 LEU 24 10.274 -7.975 7.679 148 HD23 LEU 24 HD23 LEU 24 11.211 -8.393 6.244 149 H GLY 25 HN GLY 25 9.885 -3.686 5.093 150 HA2 GLY 25 HA2 GLY 25 9.067 -3.370 2.454 151 HA3 GLY 25 HA1 GLY 25 9.342 -2.056 3.583 152 H THR 26 HN THR 26 12.136 -2.450 3.943 153 HA THR 26 HA THR 26 13.070 -0.939 1.741 154 HB THR 26 HB THR 26 14.693 -2.346 3.870 155 HG1 THR 26 HG1 THR 26 13.170 -0.018 3.859 156 HG21 THR 26 HG21 THR 26 15.412 0.032 2.165 157 HG22 THR 26 HG22 THR 26 15.997 -1.612 1.894 158 HG23 THR 26 HG23 THR 26 16.432 -0.753 3.372 159 H LEU 27 HN LEU 27 13.474 -4.304 2.716 160 HA LEU 27 HA LEU 27 15.187 -5.040 0.594 161 HB2 LEU 27 HB2 LEU 27 14.688 -6.288 2.776 162 HB3 LEU 27 HB1 LEU 27 13.222 -6.848 2.002 163 HG LEU 27 HG LEU 27 15.167 -8.460 2.017 164 HD11 LEU 27 HD11 LEU 27 13.278 -8.755 0.513 165 HD12 LEU 27 HD12 LEU 27 14.787 -9.248 -0.255 166 HD13 LEU 27 HD13 LEU 27 14.047 -7.702 -0.674 167 HD21 LEU 27 HD21 LEU 27 16.921 -6.824 1.537 168 HD22 LEU 27 HD22 LEU 27 16.245 -6.579 -0.074 169 HD23 LEU 27 HD23 LEU 27 16.917 -8.146 0.371 170 H LEU 28 HN LEU 28 11.695 -4.867 0.972 171 HA LEU 28 HA LEU 28 11.026 -6.333 -1.349 172 HB2 LEU 28 HB2 LEU 28 9.407 -4.187 0.022 173 HB3 LEU 28 HB1 LEU 28 8.799 -5.353 -1.130 174 HG LEU 28 HG LEU 28 9.620 -5.782 1.718 175 HD11 LEU 28 HD11 LEU 28 7.444 -6.856 1.858 176 HD12 LEU 28 HD12 LEU 28 7.185 -6.588 0.134 177 HD13 LEU 28 HD13 LEU 28 7.296 -5.214 1.234 178 HD21 LEU 28 HD21 LEU 28 9.347 -7.915 -0.391 179 HD22 LEU 28 HD22 LEU 28 9.435 -8.202 1.348 180 HD23 LEU 28 HD23 LEU 28 10.808 -7.487 0.504 181 H LEU 29 HN LEU 29 11.379 -2.838 -0.752 182 HA LEU 29 HA LEU 29 10.664 -2.255 -3.470 183 HB2 LEU 29 HB2 LEU 29 11.105 0.073 -2.899 184 HB3 LEU 29 HB1 LEU 29 10.032 -0.687 -1.761 185 HG LEU 29 HG LEU 29 12.051 -0.913 -0.223 186 HD11 LEU 29 HD11 LEU 29 13.814 -0.525 -1.873 187 HD12 LEU 29 HD12 LEU 29 13.870 0.680 -0.585 188 HD13 LEU 29 HD13 LEU 29 13.193 1.101 -2.159 189 HD21 LEU 29 HD21 LEU 29 11.860 1.458 0.475 190 HD22 LEU 29 HD22 LEU 29 10.306 0.677 0.183 191 HD23 LEU 29 HD23 LEU 29 10.977 1.781 -1.023 192 H ASP 30 HN ASP 30 13.590 -2.889 -1.792 193 HA ASP 30 HA ASP 30 15.368 -1.769 -3.705 194 HB2 ASP 30 HB2 ASP 30 16.028 -2.486 -1.394 195 HB3 ASP 30 HB1 ASP 30 15.853 -4.156 -1.911 196 H GLU 31 HN GLU 31 13.662 -4.773 -3.378 197 HA GLU 31 HA GLU 31 14.996 -6.055 -5.591 198 HB2 GLU 31 HB2 GLU 31 13.558 -6.940 -3.406 199 HB3 GLU 31 HB1 GLU 31 12.434 -7.185 -4.737 200 HG2 GLU 31 HG2 GLU 31 14.111 -8.492 -5.921 201 HG3 GLU 31 HG1 GLU 31 15.246 -8.225 -4.600 202 H LEU 32 HN LEU 32 12.605 -3.765 -5.241 203 HA LEU 32 HA LEU 32 11.306 -4.467 -7.777 204 HB2 LEU 32 HB2 LEU 32 10.417 -2.798 -5.441 205 HB3 LEU 32 HB1 LEU 32 9.570 -2.787 -6.974 206 HG LEU 32 HG LEU 32 9.980 -5.231 -5.249 207 HD11 LEU 32 HD11 LEU 32 7.553 -3.488 -5.634 208 HD12 LEU 32 HD12 LEU 32 8.511 -3.641 -4.161 209 HD13 LEU 32 HD13 LEU 32 7.587 -5.019 -4.759 210 HD21 LEU 32 HD21 LEU 32 8.332 -4.785 -7.737 211 HD22 LEU 32 HD22 LEU 32 8.289 -6.234 -6.737 212 HD23 LEU 32 HD23 LEU 32 9.766 -5.801 -7.595 213 H GLY 33 HN GLY 33 13.702 -2.577 -6.609 214 HA2 GLY 33 HA2 GLY 33 14.898 -0.830 -7.478 215 HA3 GLY 33 HA1 GLY 33 14.025 -1.102 -8.976 216 H ILE 34 HN ILE 34 12.831 -0.067 -5.786 217 HA ILE 34 HA ILE 34 11.439 2.126 -7.136 218 HB ILE 34 HB ILE 34 11.129 1.275 -4.254 219 HG12 ILE 34 HG12 ILE 34 9.500 0.422 -6.664 220 HG13 ILE 34 HG11 ILE 34 10.639 -0.603 -5.799 221 HG21 ILE 34 HG21 ILE 34 8.968 2.418 -4.434 222 HG22 ILE 34 HG22 ILE 34 9.349 2.872 -6.096 223 HG23 ILE 34 HG23 ILE 34 10.312 3.512 -4.764 224 HD11 ILE 34 HD11 ILE 34 8.368 -1.100 -5.149 225 HD12 ILE 34 HD12 ILE 34 8.112 0.581 -4.678 226 HD13 ILE 34 HD13 ILE 34 9.259 -0.420 -3.788 227 H VAL 35 HN VAL 35 11.842 4.228 -6.780 228 HA VAL 35 HA VAL 35 14.083 4.920 -5.031 229 HB VAL 35 HB VAL 35 12.653 6.630 -7.077 230 HG11 VAL 35 HG11 VAL 35 15.207 7.109 -5.546 231 HG12 VAL 35 HG12 VAL 35 13.678 7.959 -5.320 232 HG13 VAL 35 HG13 VAL 35 14.573 8.139 -6.829 233 HG21 VAL 35 HG21 VAL 35 15.299 5.190 -7.259 234 HG22 VAL 35 HG22 VAL 35 14.649 6.302 -8.462 235 HG23 VAL 35 HG23 VAL 35 13.826 4.778 -8.136 236 H LEU 36 HN LEU 36 13.370 5.187 -2.988 237 HA LEU 36 HA LEU 36 10.773 6.232 -2.398 238 HB2 LEU 36 HB2 LEU 36 11.742 6.293 -0.006 239 HB3 LEU 36 HB1 LEU 36 11.453 4.744 -0.755 240 HG LEU 36 HG LEU 36 14.010 5.002 -1.434 241 HD11 LEU 36 HD11 LEU 36 15.289 6.072 0.330 242 HD12 LEU 36 HD12 LEU 36 13.795 6.615 1.092 243 HD13 LEU 36 HD13 LEU 36 14.247 7.229 -0.497 244 HD21 LEU 36 HD21 LEU 36 12.965 4.134 1.250 245 HD22 LEU 36 HD22 LEU 36 14.578 3.767 0.641 246 HD23 LEU 36 HD23 LEU 36 13.156 3.144 -0.196 247 H GLU 37 HN GLU 37 10.156 8.229 -1.989 248 HA GLU 37 HA GLU 37 12.101 10.392 -2.102 249 HB2 GLU 37 HB2 GLU 37 9.930 10.528 -3.330 250 HB3 GLU 37 HB1 GLU 37 9.090 10.494 -1.787 251 HG2 GLU 37 HG2 GLU 37 10.257 12.575 -1.153 252 HG3 GLU 37 HG1 GLU 37 10.969 12.627 -2.766 253 H ASP 38 HN ASP 38 9.981 8.734 0.067 254 HA ASP 38 HA ASP 38 11.407 9.799 2.347 255 HB2 ASP 38 HB2 ASP 38 9.408 11.236 2.210 256 HB3 ASP 38 HB1 ASP 38 8.381 9.809 2.120 257 HA PRO 39 HA PRO 39 11.108 5.350 2.475 258 HB2 PRO 39 HB2 PRO 39 12.982 4.931 4.384 259 HB3 PRO 39 HB1 PRO 39 13.404 5.366 2.725 260 HG2 PRO 39 HG2 PRO 39 13.269 7.097 5.161 261 HG3 PRO 39 HG1 PRO 39 14.482 7.077 3.867 262 HD2 PRO 39 HD2 PRO 39 12.460 8.903 4.000 263 HD3 PRO 39 HD1 PRO 39 13.199 8.374 2.475 264 H THR 40 HN THR 40 10.046 7.556 4.747 265 HA THR 40 HA THR 40 9.593 5.512 6.804 266 HB THR 40 HB THR 40 8.935 7.363 8.312 267 HG1 THR 40 HG1 THR 40 8.959 8.801 6.021 268 HG21 THR 40 HG21 THR 40 11.650 7.643 7.030 269 HG22 THR 40 HG22 THR 40 11.214 6.517 8.317 270 HG23 THR 40 HG23 THR 40 11.197 8.254 8.622 271 H VAL 41 HN VAL 41 8.124 5.911 4.229 272 HA VAL 41 HA VAL 41 5.413 6.221 5.287 273 HB VAL 41 HB VAL 41 4.644 6.217 2.989 274 HG11 VAL 41 HG11 VAL 41 5.691 8.278 2.206 275 HG12 VAL 41 HG12 VAL 41 7.019 8.038 3.341 276 HG13 VAL 41 HG13 VAL 41 5.386 8.333 3.942 277 HG21 VAL 41 HG21 VAL 41 6.263 4.623 2.066 278 HG22 VAL 41 HG22 VAL 41 7.530 5.846 2.186 279 HG23 VAL 41 HG23 VAL 41 6.162 6.092 1.096 280 H LEU 42 HN LEU 42 3.833 4.587 4.851 281 HA LEU 42 HA LEU 42 4.924 1.906 5.015 282 HB2 LEU 42 HB2 LEU 42 2.084 2.927 5.109 283 HB3 LEU 42 HB1 LEU 42 2.522 1.237 5.261 284 HG LEU 42 HG LEU 42 3.349 3.427 7.168 285 HD11 LEU 42 HD11 LEU 42 1.314 1.223 7.473 286 HD12 LEU 42 HD12 LEU 42 0.959 2.940 7.283 287 HD13 LEU 42 HD13 LEU 42 1.800 2.369 8.724 288 HD21 LEU 42 HD21 LEU 42 3.750 0.442 7.265 289 HD22 LEU 42 HD22 LEU 42 4.102 1.559 8.583 290 HD23 LEU 42 HD23 LEU 42 5.003 1.666 7.073 291 H ILE 43 HN ILE 43 5.215 0.626 3.341 292 HA ILE 43 HA ILE 43 3.732 1.225 0.882 293 HB ILE 43 HB ILE 43 5.438 -0.282 -0.243 294 HG12 ILE 43 HG12 ILE 43 7.040 0.287 2.258 295 HG13 ILE 43 HG11 ILE 43 6.323 -1.274 1.874 296 HG21 ILE 43 HG21 ILE 43 5.426 2.113 -0.537 297 HG22 ILE 43 HG22 ILE 43 7.088 1.535 -0.425 298 HG23 ILE 43 HG23 ILE 43 6.336 2.333 0.957 299 HD11 ILE 43 HD11 ILE 43 8.377 0.149 0.198 300 HD12 ILE 43 HD12 ILE 43 7.700 -1.449 -0.107 301 HD13 ILE 43 HD13 ILE 43 8.703 -1.174 1.316 302 H GLY 44 HN GLY 44 2.420 -0.234 -0.002 303 HA2 GLY 44 HA2 GLY 44 2.022 -2.697 1.567 304 HA3 GLY 44 HA1 GLY 44 0.728 -1.802 0.801 305 H ASP 45 HN ASP 45 3.105 -4.202 0.443 306 HA ASP 45 HA ASP 45 2.846 -4.403 -2.427 307 HB2 ASP 45 HB2 ASP 45 4.956 -5.073 -1.400 308 HB3 ASP 45 HB1 ASP 45 4.123 -6.278 -0.419 309 H GLY 46 HN GLY 46 1.721 -6.039 -3.540 310 HA2 GLY 46 HA2 GLY 46 0.080 -7.658 -3.836 311 HA3 GLY 46 HA1 GLY 46 0.177 -7.983 -2.130 312 H CYS 47 HN CYS 47 -0.509 -4.896 -3.647 313 HA CYS 47 HA CYS 47 -2.932 -4.775 -2.006 314 HB2 CYS 47 HB2 CYS 47 -0.829 -3.055 -2.115 315 HB3 CYS 47 HB1 CYS 47 -1.936 -2.306 -3.263 316 H ASP 48 HN ASP 48 -4.767 -5.064 -2.977 317 HA ASP 48 HA ASP 48 -5.061 -4.309 -5.795 318 HB2 ASP 48 HB2 ASP 48 -6.656 -5.942 -6.015 319 HB3 ASP 48 HB1 ASP 48 -5.753 -6.627 -4.678 320 HA PRO 49 HA PRO 49 -7.274 -0.744 -4.478 321 HB2 PRO 49 HB2 PRO 49 -8.616 -0.210 -6.796 322 HB3 PRO 49 HB1 PRO 49 -6.937 0.218 -6.501 323 HG2 PRO 49 HG2 PRO 49 -8.065 -1.959 -8.126 324 HG3 PRO 49 HG1 PRO 49 -6.535 -1.095 -8.304 325 HD2 PRO 49 HD2 PRO 49 -6.856 -3.649 -7.267 326 HD3 PRO 49 HD1 PRO 49 -5.425 -2.633 -7.058 327 H ILE 50 HN ILE 50 -9.033 -0.708 -3.216 328 HA ILE 50 HA ILE 50 -11.021 -2.759 -3.526 329 HB ILE 50 HB ILE 50 -11.186 -0.458 -1.582 330 HG12 ILE 50 HG12 ILE 50 -9.722 -3.093 -1.277 331 HG13 ILE 50 HG11 ILE 50 -8.982 -1.499 -1.344 332 HG21 ILE 50 HG21 ILE 50 -12.519 -1.982 -0.287 333 HG22 ILE 50 HG22 ILE 50 -12.160 -3.304 -1.398 334 HG23 ILE 50 HG23 ILE 50 -13.159 -1.947 -1.932 335 HD11 ILE 50 HD11 ILE 50 -9.061 -2.288 0.929 336 HD12 ILE 50 HD12 ILE 50 -10.802 -2.536 0.811 337 HD13 ILE 50 HD13 ILE 50 -10.139 -0.905 0.741 338 H THR 51 HN THR 51 -12.010 -2.370 -5.415 339 HA THR 51 HA THR 51 -13.650 0.060 -5.589 340 HB THR 51 HB THR 51 -11.846 0.209 -7.204 341 HG1 THR 51 HG1 THR 51 -14.405 0.302 -7.846 342 HG21 THR 51 HG21 THR 51 -12.791 -2.477 -8.200 343 HG22 THR 51 HG22 THR 51 -11.243 -2.111 -7.432 344 HG23 THR 51 HG23 THR 51 -11.615 -1.450 -9.023 345 H VAL 52 HN VAL 52 -13.922 -2.915 -4.782 346 HA VAL 52 HA VAL 52 -16.170 -3.654 -6.478 347 HB VAL 52 HB VAL 52 -14.577 -5.429 -6.008 348 HG11 VAL 52 HG11 VAL 52 -14.210 -6.290 -3.762 349 HG12 VAL 52 HG12 VAL 52 -15.236 -5.019 -3.096 350 HG13 VAL 52 HG13 VAL 52 -13.712 -4.603 -3.879 351 HG21 VAL 52 HG21 VAL 52 -16.892 -6.082 -6.274 352 HG22 VAL 52 HG22 VAL 52 -17.182 -5.834 -4.554 353 HG23 VAL 52 HG23 VAL 52 -16.101 -7.121 -5.086 354 H ALA 53 HN ALA 53 -18.259 -3.795 -5.735 355 HA ALA 53 HA ALA 53 -18.759 -2.697 -3.047 356 HB1 ALA 53 HB1 ALA 53 -20.745 -1.591 -3.934 357 HB2 ALA 53 HB2 ALA 53 -20.385 -2.217 -5.543 358 HB3 ALA 53 HB3 ALA 53 -19.294 -1.058 -4.783 359 H GLY 54 HN GLY 54 -20.938 -3.278 -2.182 360 HA2 GLY 54 HA2 GLY 54 -22.811 -4.712 -2.075 361 HA3 GLY 54 HA1 GLY 54 -22.071 -5.735 -3.296 362 H SER 55 HN SER 55 -19.708 -5.006 -1.140 363 HA SER 55 HA SER 55 -20.354 -6.939 0.889 364 HB2 SER 55 HB2 SER 55 -19.644 -8.393 -0.989 365 HB3 SER 55 HB1 SER 55 -18.113 -7.522 -1.069 366 HG SER 55 HG SER 55 -17.733 -9.303 0.158 367 H SER 56 HN SER 56 -19.500 -6.189 2.705 368 HA SER 56 HA SER 56 -17.565 -4.093 2.710 369 HB2 SER 56 HB2 SER 56 -17.663 -4.601 5.258 370 HB3 SER 56 HB1 SER 56 -19.109 -3.972 4.464 371 HG SER 56 HG SER 56 -19.617 -5.762 5.765 372 H ASP 57 HN ASP 57 -17.460 -7.520 2.832 373 HA ASP 57 HA ASP 57 -14.755 -7.693 3.830 374 HB2 ASP 57 HB2 ASP 57 -16.435 -9.509 4.188 375 HB3 ASP 57 HB1 ASP 57 -16.433 -9.810 2.455 376 H ALA 58 HN ALA 58 -14.613 -5.909 1.961 377 HA ALA 58 HA ALA 58 -14.029 -7.101 -0.632 378 HB1 ALA 58 HB1 ALA 58 -14.029 -4.214 0.240 379 HB2 ALA 58 HB2 ALA 58 -15.371 -5.057 -0.535 380 HB3 ALA 58 HB3 ALA 58 -13.865 -4.797 -1.415 381 H CYS 59 HN CYS 59 -12.358 -7.266 1.939 382 HA CYS 59 HA CYS 59 -9.819 -6.753 0.590 383 HB2 CYS 59 HB2 CYS 59 -10.178 -4.847 2.095 384 HB3 CYS 59 HB1 CYS 59 -10.419 -5.950 3.445 385 H SER 60 HN SER 60 -8.443 -8.395 0.759 386 HA SER 60 HA SER 60 -9.290 -10.719 2.279 387 HB2 SER 60 HB2 SER 60 -7.313 -11.763 0.991 388 HB3 SER 60 HB1 SER 60 -8.729 -11.264 0.064 389 HG SER 60 HG SER 60 -7.631 -9.622 -0.785 390 H ALA 61 HN ALA 61 -6.915 -8.204 2.491 391 HA ALA 61 HA ALA 61 -5.672 -9.662 4.721 392 HB1 ALA 61 HB1 ALA 61 -3.472 -8.802 4.115 393 HB2 ALA 61 HB2 ALA 61 -4.162 -8.013 2.696 394 HB3 ALA 61 HB3 ALA 61 -4.158 -9.773 2.812 395 H THR 62 HN THR 62 -4.814 -6.439 3.527 396 HA THR 62 HA THR 62 -5.886 -5.315 6.030 397 HB THR 62 HB THR 62 -3.155 -4.741 4.865 398 HG1 THR 62 HG1 THR 62 -4.005 -6.257 7.124 399 HG21 THR 62 HG21 THR 62 -4.478 -3.739 7.386 400 HG22 THR 62 HG22 THR 62 -4.086 -2.780 5.960 401 HG23 THR 62 HG23 THR 62 -2.793 -3.466 6.945 402 H ALA 63 HN ALA 63 -6.975 -3.459 5.791 403 HA ALA 63 HA ALA 63 -7.168 -2.279 3.146 404 HB1 ALA 63 HB1 ALA 63 -9.018 -0.992 4.071 405 HB2 ALA 63 HB2 ALA 63 -8.646 -1.591 5.687 406 HB3 ALA 63 HB3 ALA 63 -9.213 -2.705 4.444 407 H VAL 64 HN VAL 64 -6.297 -0.375 2.561 408 HA VAL 64 HA VAL 64 -5.089 1.341 4.603 409 HB VAL 64 HB VAL 64 -3.012 1.472 3.115 410 HG11 VAL 64 HG11 VAL 64 -2.919 0.465 5.308 411 HG12 VAL 64 HG12 VAL 64 -1.984 -0.514 4.178 412 HG13 VAL 64 HG13 VAL 64 -3.591 -1.040 4.681 413 HG21 VAL 64 HG21 VAL 64 -2.529 -0.530 1.794 414 HG22 VAL 64 HG22 VAL 64 -3.957 0.315 1.193 415 HG23 VAL 64 HG23 VAL 64 -4.141 -1.153 2.155 416 H CYS 65 HN CYS 65 -4.229 3.354 3.648 417 HA CYS 65 HA CYS 65 -5.645 4.143 1.197 418 HB2 CYS 65 HB2 CYS 65 -6.874 5.104 3.038 419 HB3 CYS 65 HB1 CYS 65 -5.393 5.681 3.790 420 H CYS 66 HN CYS 66 -4.022 4.308 -0.235 421 HA CYS 66 HA CYS 66 -1.488 5.478 0.611 422 HB2 CYS 66 HB2 CYS 66 -2.355 3.782 -1.656 423 HB3 CYS 66 HB1 CYS 66 -1.035 4.904 -1.966 424 H SER 67 HN SER 67 -0.694 7.335 -0.013 425 HA SER 67 HA SER 67 -2.478 9.209 -1.312 426 HB2 SER 67 HB2 SER 67 -1.262 9.790 0.782 427 HB3 SER 67 HB1 SER 67 0.254 9.650 -0.102 428 HG SER 67 HG SER 67 -0.291 11.412 -1.321 429 H ASP 68 HN ASP 68 0.196 7.252 -2.075 430 HA ASP 68 HA ASP 68 0.859 8.862 -4.441 431 HB2 ASP 68 HB2 ASP 68 2.378 6.570 -3.177 432 HB3 ASP 68 HB1 ASP 68 2.907 7.494 -4.579 433 H ASN 69 HN ASN 69 0.902 7.918 -6.502 434 HA ASN 69 HA ASN 69 -0.546 5.357 -6.696 435 HB2 ASN 69 HB2 ASN 69 -0.780 7.818 -8.424 436 HB3 ASN 69 HB1 ASN 69 -1.380 6.243 -8.927 437 HD21 ASN 69 HD21 ASN 69 -2.217 5.479 -6.240 438 HD22 ASN 69 HD22 ASN 69 -3.649 6.393 -5.920 439 H ASN 70 HN ASN 70 2.392 6.617 -7.034 440 HA ASN 70 HA ASN 70 3.121 5.524 -9.600 441 HB2 ASN 70 HB2 ASN 70 5.447 6.110 -8.927 442 HB3 ASN 70 HB1 ASN 70 4.337 7.468 -8.836 443 HD21 ASN 70 HD21 ASN 70 6.895 7.025 -7.510 444 HD22 ASN 70 HD22 ASN 70 6.584 7.157 -5.818 445 H VAL 71 HN VAL 71 2.048 3.466 -8.825 446 HA VAL 71 HA VAL 71 3.745 1.827 -7.115 447 HB VAL 71 HB VAL 71 1.866 0.302 -7.034 448 HG11 VAL 71 HG11 VAL 71 1.878 2.175 -5.477 449 HG12 VAL 71 HG12 VAL 71 0.227 1.751 -5.928 450 HG13 VAL 71 HG13 VAL 71 1.000 3.161 -6.647 451 HG21 VAL 71 HG21 VAL 71 1.047 0.527 -9.310 452 HG22 VAL 71 HG22 VAL 71 0.519 2.174 -8.971 453 HG23 VAL 71 HG23 VAL 71 -0.256 0.816 -8.159 454 H SER 72 HN SER 72 4.088 -0.436 -7.759 455 HA SER 72 HA SER 72 5.147 -0.547 -10.441 456 HB2 SER 72 HB2 SER 72 6.166 -2.654 -9.673 457 HB3 SER 72 HB1 SER 72 6.455 -1.352 -8.518 458 HG SER 72 HG SER 72 5.229 -3.696 -8.123 459 H GLY 73 HN GLY 73 2.190 -1.166 -9.166 460 HA2 GLY 73 HA2 GLY 73 0.573 -2.029 -10.855 461 HA3 GLY 73 HA1 GLY 73 1.676 -3.377 -11.049 462 H VAL 74 HN VAL 74 2.254 -3.605 -8.211 463 HA VAL 74 HA VAL 74 -0.388 -4.420 -7.234 464 HB VAL 74 HB VAL 74 0.408 -6.502 -6.409 465 HG11 VAL 74 HG11 VAL 74 1.210 -7.582 -8.553 466 HG12 VAL 74 HG12 VAL 74 1.215 -5.957 -9.255 467 HG13 VAL 74 HG13 VAL 74 -0.290 -6.658 -8.657 468 HG21 VAL 74 HG21 VAL 74 2.743 -7.254 -6.823 469 HG22 VAL 74 HG22 VAL 74 2.599 -5.931 -5.666 470 HG23 VAL 74 HG23 VAL 74 3.132 -5.606 -7.318 471 H ILE 75 HN ILE 75 2.521 -2.789 -6.570 472 HA ILE 75 HA ILE 75 2.195 -3.044 -3.699 473 HB ILE 75 HB ILE 75 4.049 -1.463 -3.487 474 HG12 ILE 75 HG12 ILE 75 4.293 -1.512 -6.482 475 HG13 ILE 75 HG11 ILE 75 3.414 -0.252 -5.640 476 HG21 ILE 75 HG21 ILE 75 4.534 -3.820 -3.699 477 HG22 ILE 75 HG22 ILE 75 5.785 -2.851 -4.479 478 HG23 ILE 75 HG23 ILE 75 4.567 -3.667 -5.455 479 HD11 ILE 75 HD11 ILE 75 6.317 -0.916 -5.283 480 HD12 ILE 75 HD12 ILE 75 5.440 0.347 -4.419 481 HD13 ILE 75 HD13 ILE 75 5.662 0.464 -6.165 482 H ALA 76 HN ALA 76 2.439 -0.867 -2.532 483 HA ALA 76 HA ALA 76 0.905 1.303 -3.715 484 HB1 ALA 76 HB1 ALA 76 -0.593 1.424 -1.754 485 HB2 ALA 76 HB2 ALA 76 0.111 -0.080 -1.147 486 HB3 ALA 76 HB3 ALA 76 -0.802 -0.079 -2.658 487 H ILE 77 HN ILE 77 1.566 3.303 -2.896 488 HA ILE 77 HA ILE 77 3.704 3.158 -0.872 489 HB ILE 77 HB ILE 77 3.601 5.023 -3.249 490 HG12 ILE 77 HG12 ILE 77 5.418 2.665 -2.687 491 HG13 ILE 77 HG11 ILE 77 4.112 2.687 -3.869 492 HG21 ILE 77 HG21 ILE 77 4.661 6.041 -1.305 493 HG22 ILE 77 HG22 ILE 77 5.853 5.689 -2.555 494 HG23 ILE 77 HG23 ILE 77 5.726 4.645 -1.140 495 HD11 ILE 77 HD11 ILE 77 6.581 4.406 -3.937 496 HD12 ILE 77 HD12 ILE 77 5.275 4.424 -5.122 497 HD13 ILE 77 HD13 ILE 77 6.272 2.982 -4.932 498 H GLY 78 HN GLY 78 3.509 4.438 0.850 499 HA2 GLY 78 HA2 GLY 78 2.914 6.255 2.154 500 HA3 GLY 78 HA1 GLY 78 2.193 6.996 0.733 501 H CYS 79 HN CYS 79 1.577 3.968 2.501 502 HA CYS 79 HA CYS 79 -1.280 4.546 2.328 503 HB2 CYS 79 HB2 CYS 79 0.377 2.114 2.407 504 HB3 CYS 79 HB1 CYS 79 -1.135 2.020 3.289 505 H LEU 80 HN LEU 80 -2.515 4.954 4.022 506 HA LEU 80 HA LEU 80 -1.437 4.458 6.709 507 HB2 LEU 80 HB2 LEU 80 -3.778 6.160 5.855 508 HB3 LEU 80 HB1 LEU 80 -3.243 5.913 7.509 509 HG LEU 80 HG LEU 80 -1.610 7.248 5.349 510 HD11 LEU 80 HD11 LEU 80 -2.030 9.307 6.580 511 HD12 LEU 80 HD12 LEU 80 -3.070 8.433 7.705 512 HD13 LEU 80 HD13 LEU 80 -3.540 8.593 6.013 513 HD21 LEU 80 HD21 LEU 80 -1.118 6.850 8.295 514 HD22 LEU 80 HD22 LEU 80 -0.158 7.889 7.244 515 HD23 LEU 80 HD23 LEU 80 -0.198 6.149 6.965 516 HA PRO 81 HA PRO 81 -4.049 0.896 6.846 517 HB2 PRO 81 HB2 PRO 81 -3.726 1.001 9.754 518 HB3 PRO 81 HB1 PRO 81 -3.165 -0.219 8.613 519 HG2 PRO 81 HG2 PRO 81 -1.470 1.451 9.864 520 HG3 PRO 81 HG1 PRO 81 -1.177 0.863 8.219 521 HD2 PRO 81 HD2 PRO 81 -2.227 3.521 9.119 522 HD3 PRO 81 HD1 PRO 81 -1.083 3.142 7.826 523 H VAL 82 HN VAL 82 -6.190 0.853 6.745 524 HA VAL 82 HA VAL 82 -7.743 2.329 8.742 525 HB VAL 82 HB VAL 82 -9.471 2.575 6.889 526 HG11 VAL 82 HG11 VAL 82 -8.449 4.634 6.035 527 HG12 VAL 82 HG12 VAL 82 -6.889 4.110 6.665 528 HG13 VAL 82 HG13 VAL 82 -8.213 4.464 7.774 529 HG21 VAL 82 HG21 VAL 82 -8.625 2.651 4.598 530 HG22 VAL 82 HG22 VAL 82 -8.497 1.032 5.284 531 HG23 VAL 82 HG23 VAL 82 -7.064 2.052 5.161 532 H THR 83 HN THR 83 -9.897 1.446 9.079 533 HA THR 83 HA THR 83 -10.101 -1.401 8.361 534 HB THR 83 HB THR 83 -11.074 -0.193 10.956 535 HG1 THR 83 HG1 THR 83 -8.677 -0.349 10.583 536 HG21 THR 83 HG21 THR 83 -12.286 -2.198 10.220 537 HG22 THR 83 HG22 THR 83 -11.317 -2.527 11.655 538 HG23 THR 83 HG23 THR 83 -10.759 -3.064 10.072 539 H LEU 84 HN LEU 84 -11.992 -2.050 7.540 540 HA LEU 84 HA LEU 84 -14.019 -2.000 6.575 541 HB2 LEU 84 HB2 LEU 84 -14.572 -0.226 8.926 542 HB3 LEU 84 HB1 LEU 84 -15.823 -0.787 7.832 543 HG LEU 84 HG LEU 84 -14.043 -2.562 9.487 544 HD11 LEU 84 HD11 LEU 84 -16.056 -2.995 10.818 545 HD12 LEU 84 HD12 LEU 84 -16.931 -1.792 9.873 546 HD13 LEU 84 HD13 LEU 84 -15.578 -1.300 10.892 547 HD21 LEU 84 HD21 LEU 84 -15.643 -4.323 8.838 548 HD22 LEU 84 HD22 LEU 84 -14.731 -3.675 7.477 549 HD23 LEU 84 HD23 LEU 84 -16.406 -3.182 7.732 Start of MODEL 15 1 H1 GLY 1 HT1 GLY 1 -22.126 1.647 -6.063 2 H2 GLY 1 HT2 GLY 1 -21.136 2.961 -5.671 3 H3 GLY 1 HT3 GLY 1 -21.601 1.868 -4.470 4 HA2 GLY 1 HA1 GLY 1 -20.359 0.104 -5.551 5 HA3 GLY 1 HA2 GLY 1 -19.861 1.253 -6.786 6 H SER 2 HN SER 2 -17.720 0.424 -5.964 7 HA SER 2 HA SER 2 -16.829 2.159 -3.764 8 HB2 SER 2 HB2 SER 2 -15.754 -0.609 -4.355 9 HB3 SER 2 HB1 SER 2 -15.310 0.433 -3.004 10 HG SER 2 HG SER 2 -17.109 -1.381 -2.932 11 H TRP 3 HN TRP 3 -15.329 3.578 -4.431 12 HA TRP 3 HA TRP 3 -13.510 2.745 -6.587 13 HB2 TRP 3 HB2 TRP 3 -14.872 5.422 -6.282 14 HB3 TRP 3 HB1 TRP 3 -13.503 5.149 -7.351 15 HD1 TRP 3 HD1 TRP 3 -17.241 4.616 -7.103 16 HE1 TRP 3 HE1 TRP 3 -18.106 3.641 -9.323 17 HE3 TRP 3 HE3 TRP 3 -12.765 3.588 -9.314 18 HZ2 TRP 3 HZ2 TRP 3 -17.021 2.568 -11.701 19 HZ3 TRP 3 HZ3 TRP 3 -12.756 2.584 -11.563 20 HH2 TRP 3 HH2 TRP 3 -14.842 2.085 -12.731 21 H GLY 4 HN GLY 4 -13.627 3.288 -3.470 22 HA2 GLY 4 HA2 GLY 4 -11.816 3.436 -2.028 23 HA3 GLY 4 HA1 GLY 4 -10.824 3.992 -3.365 24 H GLN 5 HN GLN 5 -13.731 5.186 -1.663 25 HA GLN 5 HA GLN 5 -12.762 7.899 -1.776 26 HB2 GLN 5 HB2 GLN 5 -15.110 6.701 -0.296 27 HB3 GLN 5 HB1 GLN 5 -14.750 8.418 -0.377 28 HG2 GLN 5 HG2 GLN 5 -15.042 8.350 -2.808 29 HG3 GLN 5 HG1 GLN 5 -15.450 6.638 -2.697 30 HE21 GLN 5 HE21 GLN 5 -17.054 8.861 -3.669 31 HE22 GLN 5 HE22 GLN 5 -18.490 8.880 -2.705 32 H CYS 6 HN CYS 6 -11.147 8.504 -0.516 33 HA CYS 6 HA CYS 6 -11.151 7.619 2.288 34 HB2 CYS 6 HB2 CYS 6 -9.419 6.380 1.129 35 HB3 CYS 6 HB1 CYS 6 -8.778 7.860 0.429 36 H SER 7 HN SER 7 -9.388 9.879 0.185 37 HA SER 7 HA SER 7 -10.481 12.203 1.317 38 HB2 SER 7 HB2 SER 7 -8.280 12.978 2.414 39 HB3 SER 7 HB1 SER 7 -9.275 11.830 3.311 40 HG SER 7 HG SER 7 -7.896 10.195 2.759 41 H THR 8 HN THR 8 -7.049 11.819 0.627 42 HA THR 8 HA THR 8 -7.485 13.200 -1.937 43 HB THR 8 HB THR 8 -5.183 14.183 -1.582 44 HG1 THR 8 HG1 THR 8 -4.607 14.267 0.734 45 HG21 THR 8 HG21 THR 8 -5.970 15.951 -0.069 46 HG22 THR 8 HG22 THR 8 -7.331 14.934 0.404 47 HG23 THR 8 HG23 THR 8 -7.200 15.517 -1.256 48 H GLY 9 HN GLY 9 -7.159 10.276 -1.208 49 HA2 GLY 9 HA2 GLY 9 -4.940 9.738 -3.056 50 HA3 GLY 9 HA1 GLY 9 -4.953 8.941 -1.490 51 H SER 10 HN SER 10 -5.396 6.888 -1.843 52 HA SER 10 HA SER 10 -7.864 6.179 -3.223 53 HB2 SER 10 HB2 SER 10 -6.085 6.095 -4.953 54 HB3 SER 10 HB1 SER 10 -5.172 4.978 -3.942 55 HG SER 10 HG SER 10 -7.583 4.562 -5.337 56 H ILE 11 HN ILE 11 -8.661 4.107 -2.578 57 HA ILE 11 HA ILE 11 -7.326 3.046 -0.192 58 HB ILE 11 HB ILE 11 -10.195 2.743 -1.065 59 HG12 ILE 11 HG12 ILE 11 -8.823 4.219 1.172 60 HG13 ILE 11 HG11 ILE 11 -9.759 4.899 -0.148 61 HG21 ILE 11 HG21 ILE 11 -8.822 1.620 1.376 62 HG22 ILE 11 HG22 ILE 11 -9.383 0.684 -0.010 63 HG23 ILE 11 HG23 ILE 11 -10.546 1.523 1.018 64 HD11 ILE 11 HD11 ILE 11 -11.000 4.930 1.943 65 HD12 ILE 11 HD12 ILE 11 -10.836 3.177 2.060 66 HD13 ILE 11 HD13 ILE 11 -11.778 3.888 0.750 67 H GLN 12 HN GLN 12 -6.554 1.115 -0.133 68 HA GLN 12 HA GLN 12 -7.299 -0.842 -2.152 69 HB2 GLN 12 HB2 GLN 12 -4.684 -1.376 -2.197 70 HB3 GLN 12 HB1 GLN 12 -5.465 -0.331 -3.361 71 HG2 GLN 12 HG2 GLN 12 -4.309 0.859 -0.893 72 HG3 GLN 12 HG1 GLN 12 -3.234 0.354 -2.189 73 HE21 GLN 12 HE21 GLN 12 -5.064 1.009 -4.331 74 HE22 GLN 12 HE22 GLN 12 -5.148 2.723 -4.417 75 H CYS 13 HN CYS 13 -6.448 -2.987 -1.692 76 HA CYS 13 HA CYS 13 -6.280 -3.442 1.203 77 HB2 CYS 13 HB2 CYS 13 -8.230 -4.463 0.143 78 HB3 CYS 13 HB1 CYS 13 -7.203 -5.281 -1.034 79 H CYS 14 HN CYS 14 -4.179 -3.528 1.709 80 HA CYS 14 HA CYS 14 -2.254 -4.600 -0.171 81 HB2 CYS 14 HB2 CYS 14 -2.004 -3.235 2.492 82 HB3 CYS 14 HB1 CYS 14 -0.623 -3.976 1.692 83 H GLN 15 HN GLN 15 -1.421 -6.527 -0.138 84 HA GLN 15 HA GLN 15 -2.235 -8.452 1.793 85 HB2 GLN 15 HB2 GLN 15 -1.794 -9.839 0.103 86 HB3 GLN 15 HB1 GLN 15 -1.268 -8.462 -0.840 87 HG2 GLN 15 HG2 GLN 15 0.452 -10.018 -1.012 88 HG3 GLN 15 HG1 GLN 15 1.033 -8.837 0.157 89 HE21 GLN 15 HE21 GLN 15 -1.361 -11.298 0.870 90 HE22 GLN 15 HE22 GLN 15 -0.373 -12.223 1.944 91 H ASN 16 HN ASN 16 0.546 -6.447 1.254 92 HA ASN 16 HA ASN 16 1.670 -7.364 3.812 93 HB2 ASN 16 HB2 ASN 16 2.821 -8.007 1.428 94 HB3 ASN 16 HB1 ASN 16 3.584 -6.465 1.788 95 HD21 ASN 16 HD21 ASN 16 4.684 -9.158 1.676 96 HD22 ASN 16 HD22 ASN 16 5.424 -9.424 3.218 97 H VAL 17 HN VAL 17 1.461 -5.643 5.097 98 HA VAL 17 HA VAL 17 1.904 -2.960 3.968 99 HB VAL 17 HB VAL 17 0.504 -3.673 6.557 100 HG11 VAL 17 HG11 VAL 17 0.754 -1.029 5.122 101 HG12 VAL 17 HG12 VAL 17 1.585 -1.475 6.612 102 HG13 VAL 17 HG13 VAL 17 -0.172 -1.326 6.594 103 HG21 VAL 17 HG21 VAL 17 -0.622 -2.789 3.905 104 HG22 VAL 17 HG22 VAL 17 -1.546 -2.986 5.394 105 HG23 VAL 17 HG23 VAL 17 -0.793 -4.387 4.631 106 H VAL 18 HN VAL 18 3.956 -2.397 4.215 107 HA VAL 18 HA VAL 18 5.249 -2.850 6.816 108 HB VAL 18 HB VAL 18 7.345 -3.487 5.623 109 HG11 VAL 18 HG11 VAL 18 6.674 -5.790 5.120 110 HG12 VAL 18 HG12 VAL 18 4.982 -5.295 5.115 111 HG13 VAL 18 HG13 VAL 18 5.923 -5.206 6.605 112 HG21 VAL 18 HG21 VAL 18 7.181 -4.249 3.287 113 HG22 VAL 18 HG22 VAL 18 6.867 -2.520 3.447 114 HG23 VAL 18 HG23 VAL 18 5.526 -3.643 3.218 115 HA PRO 19 HA PRO 19 6.811 1.326 6.220 116 HB2 PRO 19 HB2 PRO 19 9.127 0.404 7.780 117 HB3 PRO 19 HB1 PRO 19 8.020 1.737 8.104 118 HG2 PRO 19 HG2 PRO 19 7.955 -0.527 9.543 119 HG3 PRO 19 HG1 PRO 19 6.483 0.386 9.166 120 HD2 PRO 19 HD2 PRO 19 7.521 -2.134 7.939 121 HD3 PRO 19 HD1 PRO 19 5.848 -1.656 8.298 122 H GLY 20 HN GLY 20 8.104 2.210 4.701 123 HA2 GLY 20 HA2 GLY 20 9.389 0.543 2.825 124 HA3 GLY 20 HA1 GLY 20 9.518 2.293 2.896 125 H ASP 21 HN ASP 21 10.603 2.274 5.617 126 HA ASP 21 HA ASP 21 13.348 1.507 4.949 127 HB2 ASP 21 HB2 ASP 21 14.041 2.961 6.742 128 HB3 ASP 21 HB1 ASP 21 12.844 3.823 5.782 129 H SER 22 HN SER 22 10.885 -0.091 6.119 130 HA SER 22 HA SER 22 12.034 -1.293 8.462 131 HB2 SER 22 HB2 SER 22 9.632 -1.366 8.254 132 HB3 SER 22 HB1 SER 22 9.735 -2.107 6.667 133 HG SER 22 HG SER 22 9.786 -3.259 9.127 134 H ASP 23 HN ASP 23 12.823 -3.468 8.567 135 HA ASP 23 HA ASP 23 14.705 -4.221 6.688 136 HB2 ASP 23 HB2 ASP 23 13.079 -5.992 8.535 137 HB3 ASP 23 HB1 ASP 23 14.500 -6.526 7.654 138 H LEU 24 HN LEU 24 11.349 -5.237 6.996 139 HA LEU 24 HA LEU 24 11.278 -6.968 4.774 140 HB2 LEU 24 HB2 LEU 24 9.414 -5.824 6.669 141 HB3 LEU 24 HB1 LEU 24 8.723 -5.882 5.060 142 HG LEU 24 HG LEU 24 8.180 -7.863 6.423 143 HD11 LEU 24 HD11 LEU 24 8.735 -9.527 4.721 144 HD12 LEU 24 HD12 LEU 24 9.914 -8.418 4.021 145 HD13 LEU 24 HD13 LEU 24 8.198 -8.014 3.993 146 HD21 LEU 24 HD21 LEU 24 9.932 -9.519 6.870 147 HD22 LEU 24 HD22 LEU 24 10.216 -8.008 7.733 148 HD23 LEU 24 HD23 LEU 24 11.145 -8.382 6.281 149 H GLY 25 HN GLY 25 9.881 -3.702 5.079 150 HA2 GLY 25 HA2 GLY 25 9.095 -3.423 2.434 151 HA3 GLY 25 HA1 GLY 25 9.432 -2.087 3.521 152 H THR 26 HN THR 26 12.212 -2.693 3.888 153 HA THR 26 HA THR 26 13.210 -1.246 1.658 154 HB THR 26 HB THR 26 14.726 -2.607 3.891 155 HG1 THR 26 HG1 THR 26 13.217 -0.327 3.762 156 HG21 THR 26 HG21 THR 26 15.610 -0.388 2.049 157 HG22 THR 26 HG22 THR 26 16.132 -2.070 1.924 158 HG23 THR 26 HG23 THR 26 16.553 -1.117 3.349 159 H LEU 27 HN LEU 27 13.441 -4.606 2.706 160 HA LEU 27 HA LEU 27 15.176 -5.479 0.645 161 HB2 LEU 27 HB2 LEU 27 14.371 -6.632 2.853 162 HB3 LEU 27 HB1 LEU 27 13.050 -7.206 1.867 163 HG LEU 27 HG LEU 27 14.896 -8.852 2.147 164 HD11 LEU 27 HD11 LEU 27 13.394 -9.045 0.258 165 HD12 LEU 27 HD12 LEU 27 15.030 -9.504 -0.208 166 HD13 LEU 27 HD13 LEU 27 14.391 -7.929 -0.674 167 HD21 LEU 27 HD21 LEU 27 16.982 -8.544 0.973 168 HD22 LEU 27 HD22 LEU 27 16.753 -7.237 2.135 169 HD23 LEU 27 HD23 LEU 27 16.470 -6.952 0.418 170 H LEU 28 HN LEU 28 11.715 -5.154 0.985 171 HA LEU 28 HA LEU 28 10.951 -6.539 -1.353 172 HB2 LEU 28 HB2 LEU 28 9.473 -4.295 0.019 173 HB3 LEU 28 HB1 LEU 28 8.792 -5.453 -1.100 174 HG LEU 28 HG LEU 28 9.683 -5.902 1.731 175 HD11 LEU 28 HD11 LEU 28 7.422 -6.758 1.987 176 HD12 LEU 28 HD12 LEU 28 7.105 -6.460 0.278 177 HD13 LEU 28 HD13 LEU 28 7.409 -5.107 1.366 178 HD21 LEU 28 HD21 LEU 28 9.085 -8.008 -0.340 179 HD22 LEU 28 HD22 LEU 28 9.232 -8.295 1.394 180 HD23 LEU 28 HD23 LEU 28 10.626 -7.730 0.473 181 H LEU 29 HN LEU 29 11.304 -3.040 -0.728 182 HA LEU 29 HA LEU 29 10.641 -2.398 -3.422 183 HB2 LEU 29 HB2 LEU 29 11.190 -0.103 -2.828 184 HB3 LEU 29 HB1 LEU 29 10.135 -0.837 -1.656 185 HG LEU 29 HG LEU 29 12.227 -1.187 -0.223 186 HD11 LEU 29 HD11 LEU 29 14.064 0.381 -0.628 187 HD12 LEU 29 HD12 LEU 29 13.326 0.850 -2.160 188 HD13 LEU 29 HD13 LEU 29 13.919 -0.796 -1.934 189 HD21 LEU 29 HD21 LEU 29 10.555 0.436 0.333 190 HD22 LEU 29 HD22 LEU 29 11.188 1.560 -0.871 191 HD23 LEU 29 HD23 LEU 29 12.146 1.165 0.559 192 H ASP 30 HN ASP 30 13.565 -3.169 -1.806 193 HA ASP 30 HA ASP 30 15.422 -2.143 -3.650 194 HB2 ASP 30 HB2 ASP 30 16.052 -3.067 -1.456 195 HB3 ASP 30 HB1 ASP 30 15.577 -4.669 -1.993 196 H GLU 31 HN GLU 31 13.511 -5.061 -3.565 197 HA GLU 31 HA GLU 31 14.755 -6.286 -5.834 198 HB2 GLU 31 HB2 GLU 31 13.314 -7.257 -3.793 199 HB3 GLU 31 HB1 GLU 31 12.016 -7.056 -4.963 200 HG2 GLU 31 HG2 GLU 31 13.363 -8.385 -6.575 201 HG3 GLU 31 HG1 GLU 31 14.506 -8.678 -5.265 202 H LEU 32 HN LEU 32 12.113 -4.175 -5.197 203 HA LEU 32 HA LEU 32 10.894 -4.477 -7.797 204 HB2 LEU 32 HB2 LEU 32 10.337 -2.743 -5.409 205 HB3 LEU 32 HB1 LEU 32 9.412 -2.626 -6.893 206 HG LEU 32 HG LEU 32 9.657 -5.161 -5.276 207 HD11 LEU 32 HD11 LEU 32 8.574 -3.457 -3.932 208 HD12 LEU 32 HD12 LEU 32 7.398 -4.658 -4.468 209 HD13 LEU 32 HD13 LEU 32 7.476 -3.084 -5.260 210 HD21 LEU 32 HD21 LEU 32 7.702 -5.849 -6.581 211 HD22 LEU 32 HD22 LEU 32 9.082 -5.498 -7.620 212 HD23 LEU 32 HD23 LEU 32 7.767 -4.333 -7.476 213 H GLY 33 HN GLY 33 13.403 -2.655 -6.469 214 HA2 GLY 33 HA2 GLY 33 14.830 -1.183 -7.526 215 HA3 GLY 33 HA1 GLY 33 13.802 -1.264 -8.947 216 H ILE 34 HN ILE 34 12.686 -0.365 -5.735 217 HA ILE 34 HA ILE 34 11.775 2.177 -6.864 218 HB ILE 34 HB ILE 34 11.144 1.180 -4.092 219 HG12 ILE 34 HG12 ILE 34 9.553 0.592 -6.603 220 HG13 ILE 34 HG11 ILE 34 10.584 -0.581 -5.788 221 HG21 ILE 34 HG21 ILE 34 9.149 2.557 -4.366 222 HG22 ILE 34 HG22 ILE 34 9.661 2.985 -5.997 223 HG23 ILE 34 HG23 ILE 34 10.615 3.507 -4.610 224 HD11 ILE 34 HD11 ILE 34 9.190 -0.378 -3.781 225 HD12 ILE 34 HD12 ILE 34 8.278 -0.923 -5.188 226 HD13 ILE 34 HD13 ILE 34 8.141 0.750 -4.643 227 H VAL 35 HN VAL 35 12.448 4.138 -6.146 228 HA VAL 35 HA VAL 35 14.251 4.210 -3.838 229 HB VAL 35 HB VAL 35 15.650 4.493 -5.758 230 HG11 VAL 35 HG11 VAL 35 15.319 6.233 -7.430 231 HG12 VAL 35 HG12 VAL 35 13.806 6.699 -6.655 232 HG13 VAL 35 HG13 VAL 35 13.962 5.108 -7.401 233 HG21 VAL 35 HG21 VAL 35 15.104 7.160 -4.463 234 HG22 VAL 35 HG22 VAL 35 16.559 6.747 -5.370 235 HG23 VAL 35 HG23 VAL 35 16.189 5.905 -3.866 236 H LEU 36 HN LEU 36 12.986 5.046 -2.314 237 HA LEU 36 HA LEU 36 11.125 7.208 -2.958 238 HB2 LEU 36 HB2 LEU 36 11.560 5.689 -0.388 239 HB3 LEU 36 HB1 LEU 36 10.245 6.797 -0.722 240 HG LEU 36 HG LEU 36 10.640 4.360 -2.420 241 HD11 LEU 36 HD11 LEU 36 10.619 3.581 -0.124 242 HD12 LEU 36 HD12 LEU 36 9.118 3.153 -0.946 243 HD13 LEU 36 HD13 LEU 36 9.147 4.501 0.193 244 HD21 LEU 36 HD21 LEU 36 8.228 4.612 -2.727 245 HD22 LEU 36 HD22 LEU 36 9.096 6.075 -3.190 246 HD23 LEU 36 HD23 LEU 36 8.239 6.009 -1.651 247 H GLU 37 HN GLU 37 11.199 9.215 -1.998 248 HA GLU 37 HA GLU 37 13.789 10.141 -1.182 249 HB2 GLU 37 HB2 GLU 37 11.115 11.546 -1.280 250 HB3 GLU 37 HB1 GLU 37 12.651 12.338 -0.961 251 HG2 GLU 37 HG2 GLU 37 13.449 11.690 -3.175 252 HG3 GLU 37 HG1 GLU 37 11.911 10.889 -3.494 253 H ASP 38 HN ASP 38 10.822 9.210 0.350 254 HA ASP 38 HA ASP 38 12.188 9.318 2.922 255 HB2 ASP 38 HB2 ASP 38 9.443 10.434 2.341 256 HB3 ASP 38 HB1 ASP 38 9.945 9.970 3.962 257 HA PRO 39 HA PRO 39 10.408 5.177 2.193 258 HB2 PRO 39 HB2 PRO 39 12.288 3.841 3.615 259 HB3 PRO 39 HB1 PRO 39 12.542 4.347 1.940 260 HG2 PRO 39 HG2 PRO 39 13.485 5.635 4.470 261 HG3 PRO 39 HG1 PRO 39 14.361 5.380 2.951 262 HD2 PRO 39 HD2 PRO 39 13.248 7.759 3.632 263 HD3 PRO 39 HD1 PRO 39 13.413 7.219 1.949 264 H THR 40 HN THR 40 10.409 7.272 4.643 265 HA THR 40 HA THR 40 9.920 5.581 6.903 266 HB THR 40 HB THR 40 9.031 7.806 7.868 267 HG1 THR 40 HG1 THR 40 8.703 9.163 6.234 268 HG21 THR 40 HG21 THR 40 11.321 8.670 8.153 269 HG22 THR 40 HG22 THR 40 11.876 7.594 6.872 270 HG23 THR 40 HG23 THR 40 11.248 6.922 8.377 271 H VAL 41 HN VAL 41 8.121 6.333 4.210 272 HA VAL 41 HA VAL 41 5.517 6.360 5.461 273 HB VAL 41 HB VAL 41 4.614 6.382 3.196 274 HG11 VAL 41 HG11 VAL 41 5.376 8.489 4.184 275 HG12 VAL 41 HG12 VAL 41 5.539 8.489 2.430 276 HG13 VAL 41 HG13 VAL 41 6.961 8.256 3.447 277 HG21 VAL 41 HG21 VAL 41 6.064 6.358 1.233 278 HG22 VAL 41 HG22 VAL 41 6.209 4.855 2.144 279 HG23 VAL 41 HG23 VAL 41 7.468 6.083 2.264 280 H LEU 42 HN LEU 42 3.863 4.764 4.838 281 HA LEU 42 HA LEU 42 4.916 2.069 5.062 282 HB2 LEU 42 HB2 LEU 42 2.096 3.146 5.112 283 HB3 LEU 42 HB1 LEU 42 2.493 1.450 5.281 284 HG LEU 42 HG LEU 42 3.332 3.642 7.184 285 HD11 LEU 42 HD11 LEU 42 1.262 1.470 7.468 286 HD12 LEU 42 HD12 LEU 42 0.944 3.197 7.300 287 HD13 LEU 42 HD13 LEU 42 1.763 2.586 8.736 288 HD21 LEU 42 HD21 LEU 42 4.978 1.873 7.119 289 HD22 LEU 42 HD22 LEU 42 3.718 0.654 7.293 290 HD23 LEU 42 HD23 LEU 42 4.055 1.769 8.618 291 H ILE 43 HN ILE 43 5.242 0.799 3.387 292 HA ILE 43 HA ILE 43 3.784 1.385 0.911 293 HB ILE 43 HB ILE 43 5.480 -0.137 -0.192 294 HG12 ILE 43 HG12 ILE 43 7.051 0.374 2.342 295 HG13 ILE 43 HG11 ILE 43 6.324 -1.171 1.914 296 HG21 ILE 43 HG21 ILE 43 5.520 2.265 -0.466 297 HG22 ILE 43 HG22 ILE 43 7.165 1.647 -0.347 298 HG23 ILE 43 HG23 ILE 43 6.425 2.450 1.036 299 HD11 ILE 43 HD11 ILE 43 8.707 -1.115 1.400 300 HD12 ILE 43 HD12 ILE 43 8.447 0.261 0.329 301 HD13 ILE 43 HD13 ILE 43 7.736 -1.305 -0.060 302 H GLY 44 HN GLY 44 2.562 -0.139 -0.071 303 HA2 GLY 44 HA2 GLY 44 2.061 -2.544 1.562 304 HA3 GLY 44 HA1 GLY 44 0.802 -1.652 0.738 305 H ASP 45 HN ASP 45 3.101 -4.127 0.523 306 HA ASP 45 HA ASP 45 2.971 -4.386 -2.355 307 HB2 ASP 45 HB2 ASP 45 5.002 -5.107 -1.203 308 HB3 ASP 45 HB1 ASP 45 4.076 -6.250 -0.237 309 H GLY 46 HN GLY 46 1.757 -5.918 -3.491 310 HA2 GLY 46 HA2 GLY 46 0.067 -7.464 -3.836 311 HA3 GLY 46 HA1 GLY 46 0.173 -7.864 -2.147 312 H CYS 47 HN CYS 47 -0.503 -4.726 -3.592 313 HA CYS 47 HA CYS 47 -2.888 -4.597 -1.886 314 HB2 CYS 47 HB2 CYS 47 -0.762 -2.908 -1.999 315 HB3 CYS 47 HB1 CYS 47 -1.868 -2.131 -3.130 316 H ASP 48 HN ASP 48 -4.740 -4.884 -2.867 317 HA ASP 48 HA ASP 48 -4.994 -4.117 -5.688 318 HB2 ASP 48 HB2 ASP 48 -6.828 -5.593 -5.881 319 HB3 ASP 48 HB1 ASP 48 -5.638 -6.452 -4.920 320 HA PRO 49 HA PRO 49 -7.320 -0.496 -4.499 321 HB2 PRO 49 HB2 PRO 49 -8.498 -0.788 -7.189 322 HB3 PRO 49 HB1 PRO 49 -7.626 0.569 -6.493 323 HG2 PRO 49 HG2 PRO 49 -6.542 -1.016 -8.376 324 HG3 PRO 49 HG1 PRO 49 -5.575 -0.248 -7.105 325 HD2 PRO 49 HD2 PRO 49 -6.460 -3.080 -7.363 326 HD3 PRO 49 HD1 PRO 49 -4.978 -2.410 -6.662 327 H ILE 50 HN ILE 50 -9.090 -0.680 -3.243 328 HA ILE 50 HA ILE 50 -10.838 -2.937 -3.603 329 HB ILE 50 HB ILE 50 -11.241 -0.724 -1.596 330 HG12 ILE 50 HG12 ILE 50 -9.535 -3.217 -1.364 331 HG13 ILE 50 HG11 ILE 50 -8.947 -1.559 -1.382 332 HG21 ILE 50 HG21 ILE 50 -12.421 -2.420 -0.355 333 HG22 ILE 50 HG22 ILE 50 -11.949 -3.655 -1.522 334 HG23 ILE 50 HG23 ILE 50 -13.068 -2.371 -1.996 335 HD11 ILE 50 HD11 ILE 50 -8.960 -2.436 0.868 336 HD12 ILE 50 HD12 ILE 50 -10.678 -2.808 0.734 337 HD13 ILE 50 HD13 ILE 50 -10.135 -1.131 0.715 338 H THR 51 HN THR 51 -11.881 -2.607 -5.483 339 HA THR 51 HA THR 51 -13.723 -0.316 -5.588 340 HB THR 51 HB THR 51 -11.960 -0.152 -7.286 341 HG1 THR 51 HG1 THR 51 -14.345 0.342 -7.693 342 HG21 THR 51 HG21 THR 51 -11.413 -2.480 -7.602 343 HG22 THR 51 HG22 THR 51 -11.884 -1.777 -9.150 344 HG23 THR 51 HG23 THR 51 -13.016 -2.802 -8.266 345 H VAL 52 HN VAL 52 -13.876 -3.208 -4.624 346 HA VAL 52 HA VAL 52 -15.913 -4.345 -6.333 347 HB VAL 52 HB VAL 52 -14.302 -5.852 -5.301 348 HG11 VAL 52 HG11 VAL 52 -13.807 -4.571 -3.289 349 HG12 VAL 52 HG12 VAL 52 -14.258 -6.226 -2.884 350 HG13 VAL 52 HG13 VAL 52 -15.417 -4.918 -2.659 351 HG21 VAL 52 HG21 VAL 52 -16.506 -6.740 -5.753 352 HG22 VAL 52 HG22 VAL 52 -17.080 -6.185 -4.181 353 HG23 VAL 52 HG23 VAL 52 -15.863 -7.456 -4.276 354 H ALA 53 HN ALA 53 -18.076 -4.397 -5.916 355 HA ALA 53 HA ALA 53 -18.990 -2.853 -3.580 356 HB1 ALA 53 HB1 ALA 53 -20.417 -3.269 -6.205 357 HB2 ALA 53 HB2 ALA 53 -19.513 -1.823 -5.754 358 HB3 ALA 53 HB3 ALA 53 -20.966 -2.270 -4.859 359 H GLY 54 HN GLY 54 -20.592 -3.668 -2.285 360 HA2 GLY 54 HA2 GLY 54 -22.036 -5.194 -1.361 361 HA3 GLY 54 HA1 GLY 54 -22.168 -5.939 -2.946 362 H SER 55 HN SER 55 -19.555 -5.536 -0.558 363 HA SER 55 HA SER 55 -19.373 -8.380 -0.175 364 HB2 SER 55 HB2 SER 55 -18.153 -7.938 -2.354 365 HB3 SER 55 HB1 SER 55 -17.002 -6.974 -1.430 366 HG SER 55 HG SER 55 -16.128 -8.976 -1.505 367 H SER 56 HN SER 56 -19.039 -8.553 1.942 368 HA SER 56 HA SER 56 -17.904 -6.442 3.498 369 HB2 SER 56 HB2 SER 56 -18.022 -8.254 5.330 370 HB3 SER 56 HB1 SER 56 -19.544 -7.720 4.616 371 HG SER 56 HG SER 56 -19.219 -10.059 4.812 372 H ASP 57 HN ASP 57 -16.808 -9.482 2.151 373 HA ASP 57 HA ASP 57 -14.143 -9.192 3.247 374 HB2 ASP 57 HB2 ASP 57 -15.068 -11.442 2.846 375 HB3 ASP 57 HB1 ASP 57 -15.207 -11.085 1.130 376 H ALA 58 HN ALA 58 -14.643 -6.890 2.161 377 HA ALA 58 HA ALA 58 -13.879 -6.672 -0.593 378 HB1 ALA 58 HB1 ALA 58 -13.844 -4.265 -0.175 379 HB2 ALA 58 HB2 ALA 58 -13.986 -4.559 1.558 380 HB3 ALA 58 HB3 ALA 58 -15.310 -4.994 0.477 381 H CYS 59 HN CYS 59 -12.270 -7.262 2.244 382 HA CYS 59 HA CYS 59 -9.712 -7.118 0.951 383 HB2 CYS 59 HB2 CYS 59 -9.928 -4.828 1.824 384 HB3 CYS 59 HB1 CYS 59 -10.237 -5.470 3.435 385 H SER 60 HN SER 60 -8.812 -9.002 1.451 386 HA SER 60 HA SER 60 -9.653 -10.386 3.865 387 HB2 SER 60 HB2 SER 60 -7.900 -11.351 1.616 388 HB3 SER 60 HB1 SER 60 -8.605 -12.343 2.887 389 HG SER 60 HG SER 60 -10.697 -11.390 2.013 390 H ALA 61 HN ALA 61 -6.913 -8.648 2.651 391 HA ALA 61 HA ALA 61 -5.194 -9.796 4.721 392 HB1 ALA 61 HB1 ALA 61 -4.265 -9.707 2.469 393 HB2 ALA 61 HB2 ALA 61 -3.337 -8.705 3.584 394 HB3 ALA 61 HB3 ALA 61 -4.462 -7.954 2.451 395 H THR 62 HN THR 62 -5.009 -6.473 3.505 396 HA THR 62 HA THR 62 -5.830 -5.419 6.096 397 HB THR 62 HB THR 62 -3.087 -4.821 4.962 398 HG1 THR 62 HG1 THR 62 -4.005 -6.748 6.724 399 HG21 THR 62 HG21 THR 62 -4.085 -2.946 6.197 400 HG22 THR 62 HG22 THR 62 -2.719 -3.639 7.072 401 HG23 THR 62 HG23 THR 62 -4.368 -4.008 7.576 402 H ALA 63 HN ALA 63 -6.954 -3.587 5.819 403 HA ALA 63 HA ALA 63 -7.107 -2.450 3.152 404 HB1 ALA 63 HB1 ALA 63 -9.039 -1.234 3.972 405 HB2 ALA 63 HB2 ALA 63 -8.698 -1.759 5.621 406 HB3 ALA 63 HB3 ALA 63 -9.175 -2.941 4.400 407 H VAL 64 HN VAL 64 -6.316 -0.517 2.560 408 HA VAL 64 HA VAL 64 -5.246 1.273 4.612 409 HB VAL 64 HB VAL 64 -3.143 1.495 3.167 410 HG11 VAL 64 HG11 VAL 64 -2.044 -0.433 4.270 411 HG12 VAL 64 HG12 VAL 64 -3.634 -1.024 4.754 412 HG13 VAL 64 HG13 VAL 64 -3.039 0.516 5.372 413 HG21 VAL 64 HG21 VAL 64 -2.533 -0.486 1.879 414 HG22 VAL 64 HG22 VAL 64 -3.996 0.268 1.242 415 HG23 VAL 64 HG23 VAL 64 -4.111 -1.196 2.222 416 H CYS 65 HN CYS 65 -4.304 3.252 3.539 417 HA CYS 65 HA CYS 65 -5.794 4.025 1.131 418 HB2 CYS 65 HB2 CYS 65 -7.025 4.928 3.026 419 HB3 CYS 65 HB1 CYS 65 -5.548 5.577 3.722 420 H CYS 66 HN CYS 66 -4.138 4.238 -0.294 421 HA CYS 66 HA CYS 66 -1.652 5.463 0.614 422 HB2 CYS 66 HB2 CYS 66 -2.436 3.781 -1.676 423 HB3 CYS 66 HB1 CYS 66 -1.175 4.967 -1.982 424 H SER 67 HN SER 67 -1.046 7.405 0.226 425 HA SER 67 HA SER 67 -2.778 9.280 -1.052 426 HB2 SER 67 HB2 SER 67 -0.000 9.586 0.081 427 HB3 SER 67 HB1 SER 67 -1.042 10.922 -0.415 428 HG SER 67 HG SER 67 -2.585 9.773 1.154 429 H ASP 68 HN ASP 68 0.119 7.577 -1.880 430 HA ASP 68 HA ASP 68 0.245 9.024 -4.439 431 HB2 ASP 68 HB2 ASP 68 2.279 8.579 -2.630 432 HB3 ASP 68 HB1 ASP 68 2.525 7.297 -3.811 433 H ASN 69 HN ASN 69 0.188 7.886 -6.346 434 HA ASN 69 HA ASN 69 -0.510 5.041 -6.048 435 HB2 ASN 69 HB2 ASN 69 -1.773 7.081 -7.885 436 HB3 ASN 69 HB1 ASN 69 -2.124 5.358 -7.909 437 HD21 ASN 69 HD21 ASN 69 -2.013 5.046 -5.032 438 HD22 ASN 69 HD22 ASN 69 -3.440 5.786 -4.404 439 H ASN 70 HN ASN 70 2.036 6.454 -6.822 440 HA ASN 70 HA ASN 70 2.435 5.657 -9.575 441 HB2 ASN 70 HB2 ASN 70 4.778 6.345 -9.210 442 HB3 ASN 70 HB1 ASN 70 3.647 7.600 -8.726 443 HD21 ASN 70 HD21 ASN 70 6.392 7.248 -7.939 444 HD22 ASN 70 HD22 ASN 70 6.394 7.098 -6.214 445 H VAL 71 HN VAL 71 1.519 3.499 -8.717 446 HA VAL 71 HA VAL 71 3.306 1.873 -7.155 447 HB VAL 71 HB VAL 71 1.530 0.238 -7.199 448 HG11 VAL 71 HG11 VAL 71 0.437 3.026 -6.851 449 HG12 VAL 71 HG12 VAL 71 1.334 2.109 -5.641 450 HG13 VAL 71 HG13 VAL 71 -0.254 1.552 -6.170 451 HG21 VAL 71 HG21 VAL 71 0.838 0.454 -9.528 452 HG22 VAL 71 HG22 VAL 71 0.157 2.045 -9.185 453 HG23 VAL 71 HG23 VAL 71 -0.546 0.607 -8.445 454 H SER 72 HN SER 72 3.941 -0.268 -7.789 455 HA SER 72 HA SER 72 5.099 -0.306 -10.427 456 HB2 SER 72 HB2 SER 72 6.285 -2.285 -9.620 457 HB3 SER 72 HB1 SER 72 6.349 -1.014 -8.397 458 HG SER 72 HG SER 72 5.453 -3.474 -8.115 459 H GLY 73 HN GLY 73 2.151 -1.166 -9.269 460 HA2 GLY 73 HA2 GLY 73 0.704 -2.156 -11.060 461 HA3 GLY 73 HA1 GLY 73 1.891 -3.441 -11.127 462 H VAL 74 HN VAL 74 2.264 -3.533 -8.231 463 HA VAL 74 HA VAL 74 -0.402 -4.375 -7.367 464 HB VAL 74 HB VAL 74 0.368 -6.442 -6.460 465 HG11 VAL 74 HG11 VAL 74 -0.333 -6.649 -8.709 466 HG12 VAL 74 HG12 VAL 74 1.149 -7.599 -8.569 467 HG13 VAL 74 HG13 VAL 74 1.188 -5.998 -9.320 468 HG21 VAL 74 HG21 VAL 74 2.685 -7.237 -6.817 469 HG22 VAL 74 HG22 VAL 74 2.572 -5.846 -5.741 470 HG23 VAL 74 HG23 VAL 74 3.106 -5.629 -7.409 471 H ILE 75 HN ILE 75 2.388 -2.653 -6.649 472 HA ILE 75 HA ILE 75 2.069 -2.987 -3.772 473 HB ILE 75 HB ILE 75 3.950 -1.462 -3.511 474 HG12 ILE 75 HG12 ILE 75 4.195 -1.410 -6.508 475 HG13 ILE 75 HG11 ILE 75 3.348 -0.161 -5.616 476 HG21 ILE 75 HG21 ILE 75 4.368 -3.833 -3.825 477 HG22 ILE 75 HG22 ILE 75 5.662 -2.851 -4.509 478 HG23 ILE 75 HG23 ILE 75 4.462 -3.584 -5.568 479 HD11 ILE 75 HD11 ILE 75 6.236 -0.907 -5.298 480 HD12 ILE 75 HD12 ILE 75 5.393 0.340 -4.378 481 HD13 ILE 75 HD13 ILE 75 5.609 0.523 -6.119 482 H ALA 76 HN ALA 76 2.428 -0.758 -2.623 483 HA ALA 76 HA ALA 76 0.869 1.408 -3.768 484 HB1 ALA 76 HB1 ALA 76 -0.610 1.523 -1.801 485 HB2 ALA 76 HB2 ALA 76 0.106 0.024 -1.194 486 HB3 ALA 76 HB3 ALA 76 -0.820 0.017 -2.698 487 H ILE 77 HN ILE 77 1.491 3.418 -2.896 488 HA ILE 77 HA ILE 77 3.688 3.274 -0.935 489 HB ILE 77 HB ILE 77 3.512 5.134 -3.313 490 HG12 ILE 77 HG12 ILE 77 5.406 2.834 -2.766 491 HG13 ILE 77 HG11 ILE 77 4.059 2.784 -3.897 492 HG21 ILE 77 HG21 ILE 77 5.668 4.819 -1.223 493 HG22 ILE 77 HG22 ILE 77 4.578 6.195 -1.397 494 HG23 ILE 77 HG23 ILE 77 5.766 5.847 -2.653 495 HD11 ILE 77 HD11 ILE 77 6.456 4.590 -4.096 496 HD12 ILE 77 HD12 ILE 77 5.115 4.515 -5.239 497 HD13 ILE 77 HD13 ILE 77 6.178 3.124 -5.034 498 H GLY 78 HN GLY 78 3.363 4.396 0.853 499 HA2 GLY 78 HA2 GLY 78 2.808 6.218 2.189 500 HA3 GLY 78 HA1 GLY 78 2.098 7.002 0.784 501 H CYS 79 HN CYS 79 1.500 3.944 2.483 502 HA CYS 79 HA CYS 79 -1.361 4.470 2.268 503 HB2 CYS 79 HB2 CYS 79 0.341 2.071 2.348 504 HB3 CYS 79 HB1 CYS 79 -1.189 1.935 3.192 505 H LEU 80 HN LEU 80 -2.639 4.805 3.945 506 HA LEU 80 HA LEU 80 -1.568 4.330 6.643 507 HB2 LEU 80 HB2 LEU 80 -3.862 6.087 5.776 508 HB3 LEU 80 HB1 LEU 80 -3.298 5.863 7.426 509 HG LEU 80 HG LEU 80 -1.680 7.101 5.198 510 HD11 LEU 80 HD11 LEU 80 -1.982 9.190 6.449 511 HD12 LEU 80 HD12 LEU 80 -3.077 8.359 7.553 512 HD13 LEU 80 HD13 LEU 80 -3.511 8.544 5.855 513 HD21 LEU 80 HD21 LEU 80 -0.221 6.020 6.750 514 HD22 LEU 80 HD22 LEU 80 -1.114 6.664 8.125 515 HD23 LEU 80 HD23 LEU 80 -0.181 7.750 7.093 516 HA PRO 81 HA PRO 81 -4.279 0.844 6.841 517 HB2 PRO 81 HB2 PRO 81 -4.072 1.144 9.761 518 HB3 PRO 81 HB1 PRO 81 -3.572 -0.200 8.735 519 HG2 PRO 81 HG2 PRO 81 -1.783 1.417 9.891 520 HG3 PRO 81 HG1 PRO 81 -1.516 0.737 8.277 521 HD2 PRO 81 HD2 PRO 81 -2.405 3.493 9.046 522 HD3 PRO 81 HD1 PRO 81 -1.273 2.989 7.784 523 H VAL 82 HN VAL 82 -6.407 0.694 6.756 524 HA VAL 82 HA VAL 82 -8.058 2.244 8.605 525 HB VAL 82 HB VAL 82 -9.714 2.409 6.669 526 HG11 VAL 82 HG11 VAL 82 -8.702 4.485 5.822 527 HG12 VAL 82 HG12 VAL 82 -7.169 4.021 6.561 528 HG13 VAL 82 HG13 VAL 82 -8.572 4.356 7.576 529 HG21 VAL 82 HG21 VAL 82 -7.211 1.925 5.073 530 HG22 VAL 82 HG22 VAL 82 -8.750 2.484 4.419 531 HG23 VAL 82 HG23 VAL 82 -8.629 0.878 5.135 532 H THR 83 HN THR 83 -10.232 1.287 8.851 533 HA THR 83 HA THR 83 -10.031 -1.628 8.758 534 HB THR 83 HB THR 83 -12.204 -0.042 10.080 535 HG1 THR 83 HG1 THR 83 -9.560 -0.301 10.785 536 HG21 THR 83 HG21 THR 83 -12.656 -2.416 9.803 537 HG22 THR 83 HG22 THR 83 -12.386 -2.041 11.507 538 HG23 THR 83 HG23 THR 83 -11.113 -2.810 10.562 539 H LEU 84 HN LEU 84 -10.793 -2.520 7.025 540 HA LEU 84 HA LEU 84 -12.073 -3.079 5.228 541 HB2 LEU 84 HB2 LEU 84 -13.954 -2.702 7.514 542 HB3 LEU 84 HB1 LEU 84 -14.575 -3.178 5.945 543 HG LEU 84 HG LEU 84 -13.182 -5.199 5.999 544 HD11 LEU 84 HD11 LEU 84 -12.015 -5.849 8.047 545 HD12 LEU 84 HD12 LEU 84 -12.366 -4.268 8.744 546 HD13 LEU 84 HD13 LEU 84 -11.319 -4.395 7.332 547 HD21 LEU 84 HD21 LEU 84 -15.455 -5.252 6.903 548 HD22 LEU 84 HD22 LEU 84 -14.820 -4.833 8.497 549 HD23 LEU 84 HD23 LEU 84 -14.387 -6.372 7.752 Start of MODEL 16 1 H1 GLY 1 HT1 GLY 1 -19.823 3.349 -2.321 2 H2 GLY 1 HT2 GLY 1 -19.168 4.906 -2.262 3 H3 GLY 1 HT3 GLY 1 -20.536 4.529 -1.345 4 HA2 GLY 1 HA1 GLY 1 -18.608 4.605 0.072 5 HA3 GLY 1 HA2 GLY 1 -19.259 2.976 -0.014 6 H SER 2 HN SER 2 -18.132 1.381 -1.189 7 HA SER 2 HA SER 2 -15.285 1.766 -1.105 8 HB2 SER 2 HB2 SER 2 -16.881 -0.661 -1.950 9 HB3 SER 2 HB1 SER 2 -15.160 -0.627 -1.564 10 HG SER 2 HG SER 2 -16.571 -1.335 0.174 11 H TRP 3 HN TRP 3 -15.245 3.402 -2.808 12 HA TRP 3 HA TRP 3 -14.917 2.112 -5.429 13 HB2 TRP 3 HB2 TRP 3 -16.116 4.845 -4.929 14 HB3 TRP 3 HB1 TRP 3 -15.688 4.214 -6.511 15 HD1 TRP 3 HD1 TRP 3 -18.480 4.271 -4.029 16 HE1 TRP 3 HE1 TRP 3 -20.423 2.802 -4.868 17 HE3 TRP 3 HE3 TRP 3 -16.087 1.907 -7.854 18 HZ2 TRP 3 HZ2 TRP 3 -20.872 0.886 -6.895 19 HZ3 TRP 3 HZ3 TRP 3 -17.335 0.265 -9.201 20 HH2 TRP 3 HH2 TRP 3 -19.679 -0.233 -8.729 21 H GLY 4 HN GLY 4 -13.069 2.748 -3.234 22 HA2 GLY 4 HA2 GLY 4 -10.865 3.425 -3.132 23 HA3 GLY 4 HA1 GLY 4 -11.000 3.973 -4.795 24 H GLN 5 HN GLN 5 -13.350 5.151 -2.612 25 HA GLN 5 HA GLN 5 -12.352 7.838 -2.961 26 HB2 GLN 5 HB2 GLN 5 -14.877 6.681 -1.811 27 HB3 GLN 5 HB1 GLN 5 -14.496 8.391 -1.666 28 HG2 GLN 5 HG2 GLN 5 -14.687 6.903 -4.273 29 HG3 GLN 5 HG1 GLN 5 -15.990 7.854 -3.561 30 HE21 GLN 5 HE21 GLN 5 -14.571 8.198 -6.091 31 HE22 GLN 5 HE22 GLN 5 -13.914 9.795 -6.052 32 H CYS 6 HN CYS 6 -10.821 8.515 -1.664 33 HA CYS 6 HA CYS 6 -11.204 8.320 1.223 34 HB2 CYS 6 HB2 CYS 6 -9.753 6.442 0.715 35 HB3 CYS 6 HB1 CYS 6 -8.688 7.474 -0.231 36 H SER 7 HN SER 7 -10.339 10.042 2.351 37 HA SER 7 HA SER 7 -10.111 12.447 0.846 38 HB2 SER 7 HB2 SER 7 -9.698 13.435 3.165 39 HB3 SER 7 HB1 SER 7 -11.231 12.599 2.920 40 HG SER 7 HG SER 7 -9.818 12.118 4.878 41 H THR 8 HN THR 8 -7.811 10.170 1.979 42 HA THR 8 HA THR 8 -5.659 12.131 1.600 43 HB THR 8 HB THR 8 -4.254 10.209 2.669 44 HG1 THR 8 HG1 THR 8 -5.870 8.622 2.712 45 HG21 THR 8 HG21 THR 8 -6.224 11.832 4.286 46 HG22 THR 8 HG22 THR 8 -4.643 12.376 3.724 47 HG23 THR 8 HG23 THR 8 -4.757 11.078 4.913 48 H GLY 9 HN GLY 9 -7.278 10.157 -0.305 49 HA2 GLY 9 HA2 GLY 9 -5.868 10.130 -2.498 50 HA3 GLY 9 HA1 GLY 9 -4.932 8.954 -1.592 51 H SER 10 HN SER 10 -5.342 6.991 -2.268 52 HA SER 10 HA SER 10 -8.068 6.318 -3.168 53 HB2 SER 10 HB2 SER 10 -6.275 6.328 -4.940 54 HB3 SER 10 HB1 SER 10 -5.472 5.032 -4.058 55 HG SER 10 HG SER 10 -6.705 3.964 -5.481 56 H ILE 11 HN ILE 11 -8.814 4.148 -2.664 57 HA ILE 11 HA ILE 11 -7.494 3.100 -0.263 58 HB ILE 11 HB ILE 11 -10.337 2.677 -1.173 59 HG12 ILE 11 HG12 ILE 11 -9.076 4.304 1.028 60 HG13 ILE 11 HG11 ILE 11 -10.013 4.883 -0.340 61 HG21 ILE 11 HG21 ILE 11 -10.664 1.532 0.957 62 HG22 ILE 11 HG22 ILE 11 -8.953 1.726 1.333 63 HG23 ILE 11 HG23 ILE 11 -9.448 0.706 -0.017 64 HD11 ILE 11 HD11 ILE 11 -12.002 3.809 0.570 65 HD12 ILE 11 HD12 ILE 11 -11.306 4.957 1.711 66 HD13 ILE 11 HD13 ILE 11 -11.053 3.225 1.935 67 H GLN 12 HN GLN 12 -6.721 1.174 -0.154 68 HA GLN 12 HA GLN 12 -7.407 -0.862 -2.116 69 HB2 GLN 12 HB2 GLN 12 -4.814 -1.386 -2.175 70 HB3 GLN 12 HB1 GLN 12 -5.547 -0.290 -3.326 71 HG2 GLN 12 HG2 GLN 12 -4.383 0.771 -0.804 72 HG3 GLN 12 HG1 GLN 12 -3.330 0.329 -2.139 73 HE21 GLN 12 HE21 GLN 12 -5.079 1.099 -4.249 74 HE22 GLN 12 HE22 GLN 12 -5.178 2.818 -4.238 75 H CYS 13 HN CYS 13 -6.552 -2.989 -1.509 76 HA CYS 13 HA CYS 13 -6.149 -3.184 1.398 77 HB2 CYS 13 HB2 CYS 13 -8.267 -4.177 0.841 78 HB3 CYS 13 HB1 CYS 13 -7.565 -5.091 -0.484 79 H CYS 14 HN CYS 14 -4.133 -3.582 1.831 80 HA CYS 14 HA CYS 14 -2.389 -4.700 -0.203 81 HB2 CYS 14 HB2 CYS 14 -1.850 -3.405 2.457 82 HB3 CYS 14 HB1 CYS 14 -0.589 -4.100 1.447 83 H GLN 15 HN GLN 15 -1.461 -6.599 -0.153 84 HA GLN 15 HA GLN 15 -2.311 -8.544 1.737 85 HB2 GLN 15 HB2 GLN 15 -1.823 -9.937 0.057 86 HB3 GLN 15 HB1 GLN 15 -1.353 -8.537 -0.883 87 HG2 GLN 15 HG2 GLN 15 0.433 -9.999 -1.093 88 HG3 GLN 15 HG1 GLN 15 0.966 -8.843 0.126 89 HE21 GLN 15 HE21 GLN 15 -1.356 -11.364 0.797 90 HE22 GLN 15 HE22 GLN 15 -0.330 -12.304 1.817 91 H ASN 16 HN ASN 16 0.478 -6.528 1.303 92 HA ASN 16 HA ASN 16 1.466 -7.424 3.912 93 HB2 ASN 16 HB2 ASN 16 2.735 -8.094 1.500 94 HB3 ASN 16 HB1 ASN 16 3.657 -6.754 2.174 95 HD21 ASN 16 HD21 ASN 16 4.405 -9.533 1.842 96 HD22 ASN 16 HD22 ASN 16 4.829 -10.106 3.419 97 H VAL 17 HN VAL 17 1.062 -5.590 4.999 98 HA VAL 17 HA VAL 17 1.847 -3.012 3.868 99 HB VAL 17 HB VAL 17 0.424 -3.624 6.475 100 HG11 VAL 17 HG11 VAL 17 0.962 -0.979 5.119 101 HG12 VAL 17 HG12 VAL 17 1.717 -1.554 6.605 102 HG13 VAL 17 HG13 VAL 17 -0.013 -1.213 6.571 103 HG21 VAL 17 HG21 VAL 17 -0.921 -4.137 4.498 104 HG22 VAL 17 HG22 VAL 17 -0.628 -2.511 3.877 105 HG23 VAL 17 HG23 VAL 17 -1.554 -2.734 5.361 106 H VAL 18 HN VAL 18 3.948 -2.595 4.064 107 HA VAL 18 HA VAL 18 5.232 -3.091 6.664 108 HB VAL 18 HB VAL 18 7.332 -3.672 5.406 109 HG11 VAL 18 HG11 VAL 18 6.672 -5.992 4.956 110 HG12 VAL 18 HG12 VAL 18 4.975 -5.517 5.026 111 HG13 VAL 18 HG13 VAL 18 5.983 -5.398 6.467 112 HG21 VAL 18 HG21 VAL 18 5.423 -3.895 3.078 113 HG22 VAL 18 HG22 VAL 18 7.093 -4.465 3.091 114 HG23 VAL 18 HG23 VAL 18 6.748 -2.742 3.238 115 HA PRO 19 HA PRO 19 6.714 1.127 6.286 116 HB2 PRO 19 HB2 PRO 19 9.039 0.098 7.790 117 HB3 PRO 19 HB1 PRO 19 7.968 1.449 8.166 118 HG2 PRO 19 HG2 PRO 19 7.825 -0.852 9.522 119 HG3 PRO 19 HG1 PRO 19 6.374 0.093 9.144 120 HD2 PRO 19 HD2 PRO 19 7.396 -2.407 7.866 121 HD3 PRO 19 HD1 PRO 19 5.725 -1.907 8.196 122 H GLY 20 HN GLY 20 8.011 2.136 4.829 123 HA2 GLY 20 HA2 GLY 20 9.387 0.568 2.905 124 HA3 GLY 20 HA1 GLY 20 9.407 2.321 3.010 125 H ASP 21 HN ASP 21 10.372 2.007 5.868 126 HA ASP 21 HA ASP 21 13.205 1.552 5.251 127 HB2 ASP 21 HB2 ASP 21 13.670 2.815 7.292 128 HB3 ASP 21 HB1 ASP 21 12.588 3.733 6.252 129 H SER 22 HN SER 22 10.741 -0.238 6.180 130 HA SER 22 HA SER 22 11.797 -1.637 8.441 131 HB2 SER 22 HB2 SER 22 9.441 -1.810 8.090 132 HB3 SER 22 HB1 SER 22 9.654 -2.272 6.407 133 HG SER 22 HG SER 22 9.904 -3.798 8.730 134 H ASP 23 HN ASP 23 12.699 -3.787 8.390 135 HA ASP 23 HA ASP 23 14.684 -4.200 6.460 136 HB2 ASP 23 HB2 ASP 23 13.383 -6.010 8.475 137 HB3 ASP 23 HB1 ASP 23 14.548 -6.654 7.323 138 H LEU 24 HN LEU 24 11.405 -5.453 6.704 139 HA LEU 24 HA LEU 24 11.515 -7.020 4.336 140 HB2 LEU 24 HB2 LEU 24 9.569 -6.293 6.346 141 HB3 LEU 24 HB1 LEU 24 8.864 -6.211 4.744 142 HG LEU 24 HG LEU 24 8.530 -8.389 5.861 143 HD11 LEU 24 HD11 LEU 24 8.525 -8.188 3.415 144 HD12 LEU 24 HD12 LEU 24 9.129 -9.756 3.949 145 HD13 LEU 24 HD13 LEU 24 10.256 -8.518 3.394 146 HD21 LEU 24 HD21 LEU 24 10.641 -8.485 7.088 147 HD22 LEU 24 HD22 LEU 24 11.517 -8.661 5.570 148 HD23 LEU 24 HD23 LEU 24 10.406 -9.924 6.097 149 H GLY 25 HN GLY 25 9.935 -3.900 5.025 150 HA2 GLY 25 HA2 GLY 25 9.025 -3.380 2.452 151 HA3 GLY 25 HA1 GLY 25 9.346 -2.153 3.666 152 H THR 26 HN THR 26 12.133 -2.528 3.901 153 HA THR 26 HA THR 26 12.991 -0.878 1.772 154 HB THR 26 HB THR 26 14.642 -2.371 3.816 155 HG1 THR 26 HG1 THR 26 13.141 -0.046 3.877 156 HG21 THR 26 HG21 THR 26 15.955 -1.640 1.851 157 HG22 THR 26 HG22 THR 26 16.407 -0.794 3.332 158 HG23 THR 26 HG23 THR 26 15.399 0.012 2.131 159 H LEU 27 HN LEU 27 13.448 -4.294 2.520 160 HA LEU 27 HA LEU 27 15.139 -4.889 0.342 161 HB2 LEU 27 HB2 LEU 27 14.665 -6.289 2.423 162 HB3 LEU 27 HB1 LEU 27 13.178 -6.777 1.643 163 HG LEU 27 HG LEU 27 15.122 -8.398 1.503 164 HD11 LEU 27 HD11 LEU 27 14.662 -9.021 -0.812 165 HD12 LEU 27 HD12 LEU 27 13.892 -7.458 -1.078 166 HD13 LEU 27 HD13 LEU 27 13.185 -8.607 0.056 167 HD21 LEU 27 HD21 LEU 27 16.860 -6.723 1.055 168 HD22 LEU 27 HD22 LEU 27 16.131 -6.406 -0.519 169 HD23 LEU 27 HD23 LEU 27 16.819 -7.990 -0.169 170 H LEU 28 HN LEU 28 11.654 -4.735 0.738 171 HA LEU 28 HA LEU 28 10.966 -6.000 -1.695 172 HB2 LEU 28 HB2 LEU 28 9.368 -3.957 -0.152 173 HB3 LEU 28 HB1 LEU 28 8.747 -5.050 -1.367 174 HG LEU 28 HG LEU 28 9.626 -5.666 1.432 175 HD11 LEU 28 HD11 LEU 28 7.302 -5.041 1.055 176 HD12 LEU 28 HD12 LEU 28 7.443 -6.727 1.553 177 HD13 LEU 28 HD13 LEU 28 7.143 -6.328 -0.139 178 HD21 LEU 28 HD21 LEU 28 10.758 -7.304 0.086 179 HD22 LEU 28 HD22 LEU 28 9.278 -7.640 -0.815 180 HD23 LEU 28 HD23 LEU 28 9.384 -8.057 0.896 181 H LEU 29 HN LEU 29 11.242 -2.565 -0.796 182 HA LEU 29 HA LEU 29 10.613 -1.726 -3.465 183 HB2 LEU 29 HB2 LEU 29 11.091 0.536 -2.656 184 HB3 LEU 29 HB1 LEU 29 9.948 -0.310 -1.649 185 HG LEU 29 HG LEU 29 11.920 -0.769 -0.080 186 HD11 LEU 29 HD11 LEU 29 13.751 0.850 -0.185 187 HD12 LEU 29 HD12 LEU 29 13.128 1.453 -1.722 188 HD13 LEU 29 HD13 LEU 29 13.733 -0.200 -1.603 189 HD21 LEU 29 HD21 LEU 29 10.890 2.018 -0.549 190 HD22 LEU 29 HD22 LEU 29 11.725 1.491 0.913 191 HD23 LEU 29 HD23 LEU 29 10.173 0.777 0.478 192 H ASP 30 HN ASP 30 13.486 -2.544 -1.776 193 HA ASP 30 HA ASP 30 15.386 -1.288 -3.457 194 HB2 ASP 30 HB2 ASP 30 15.914 -2.316 -1.258 195 HB3 ASP 30 HB1 ASP 30 15.623 -3.903 -1.949 196 H GLU 31 HN GLU 31 13.543 -4.211 -3.629 197 HA GLU 31 HA GLU 31 14.881 -5.343 -5.892 198 HB2 GLU 31 HB2 GLU 31 13.204 -6.276 -3.949 199 HB3 GLU 31 HB1 GLU 31 12.091 -6.116 -5.297 200 HG2 GLU 31 HG2 GLU 31 14.673 -7.628 -5.425 201 HG3 GLU 31 HG1 GLU 31 13.120 -8.364 -5.035 202 H LEU 32 HN LEU 32 12.419 -3.052 -5.309 203 HA LEU 32 HA LEU 32 11.281 -3.244 -7.977 204 HB2 LEU 32 HB2 LEU 32 10.521 -1.702 -5.516 205 HB3 LEU 32 HB1 LEU 32 9.671 -1.546 -7.041 206 HG LEU 32 HG LEU 32 9.924 -4.091 -5.435 207 HD11 LEU 32 HD11 LEU 32 8.524 -2.451 -4.318 208 HD12 LEU 32 HD12 LEU 32 7.552 -3.776 -4.958 209 HD13 LEU 32 HD13 LEU 32 7.589 -2.225 -5.796 210 HD21 LEU 32 HD21 LEU 32 9.728 -4.536 -7.817 211 HD22 LEU 32 HD22 LEU 32 8.326 -3.471 -7.917 212 HD23 LEU 32 HD23 LEU 32 8.235 -4.963 -6.982 213 H GLY 33 HN GLY 33 13.558 -1.387 -6.248 214 HA2 GLY 33 HA2 GLY 33 15.021 0.198 -7.095 215 HA3 GLY 33 HA1 GLY 33 14.099 0.208 -8.591 216 H ILE 34 HN ILE 34 12.819 0.776 -5.356 217 HA ILE 34 HA ILE 34 11.840 3.378 -6.290 218 HB ILE 34 HB ILE 34 11.058 1.970 -3.743 219 HG12 ILE 34 HG12 ILE 34 9.619 1.824 -6.408 220 HG13 ILE 34 HG11 ILE 34 10.622 0.534 -5.751 221 HG21 ILE 34 HG21 ILE 34 9.722 4.116 -5.378 222 HG22 ILE 34 HG22 ILE 34 10.518 4.325 -3.819 223 HG23 ILE 34 HG23 ILE 34 9.043 3.364 -3.935 224 HD11 ILE 34 HD11 ILE 34 9.121 0.329 -3.849 225 HD12 ILE 34 HD12 ILE 34 8.258 0.123 -5.373 226 HD13 ILE 34 HD13 ILE 34 8.130 1.641 -4.485 227 H VAL 35 HN VAL 35 12.627 5.234 -5.507 228 HA VAL 35 HA VAL 35 14.212 5.110 -3.034 229 HB VAL 35 HB VAL 35 15.716 5.581 -4.841 230 HG11 VAL 35 HG11 VAL 35 14.185 6.400 -6.516 231 HG12 VAL 35 HG12 VAL 35 15.479 7.572 -6.270 232 HG13 VAL 35 HG13 VAL 35 13.884 7.858 -5.571 233 HG21 VAL 35 HG21 VAL 35 16.179 6.730 -2.783 234 HG22 VAL 35 HG22 VAL 35 15.095 8.047 -3.231 235 HG23 VAL 35 HG23 VAL 35 16.585 7.784 -4.138 236 H LEU 36 HN LEU 36 12.831 5.742 -1.523 237 HA LEU 36 HA LEU 36 10.846 7.777 -2.011 238 HB2 LEU 36 HB2 LEU 36 11.591 6.311 0.514 239 HB3 LEU 36 HB1 LEU 36 10.155 7.286 0.282 240 HG LEU 36 HG LEU 36 10.722 4.875 -1.417 241 HD11 LEU 36 HD11 LEU 36 10.740 4.142 0.882 242 HD12 LEU 36 HD12 LEU 36 9.253 3.620 0.088 243 HD13 LEU 36 HD13 LEU 36 9.229 4.996 1.195 244 HD21 LEU 36 HD21 LEU 36 9.070 6.457 -2.246 245 HD22 LEU 36 HD22 LEU 36 8.206 6.373 -0.712 246 HD23 LEU 36 HD23 LEU 36 8.302 4.950 -1.749 247 H GLU 37 HN GLU 37 10.755 9.789 -1.192 248 HA GLU 37 HA GLU 37 13.122 11.121 -0.320 249 HB2 GLU 37 HB2 GLU 37 10.229 12.013 -0.218 250 HB3 GLU 37 HB1 GLU 37 11.629 13.058 -0.022 251 HG2 GLU 37 HG2 GLU 37 12.257 12.804 -2.279 252 HG3 GLU 37 HG1 GLU 37 11.145 11.456 -2.513 253 H ASP 38 HN ASP 38 10.204 9.907 1.208 254 HA ASP 38 HA ASP 38 11.566 10.033 3.803 255 HB2 ASP 38 HB2 ASP 38 8.660 10.536 3.152 256 HB3 ASP 38 HB1 ASP 38 9.180 10.069 4.766 257 HA PRO 39 HA PRO 39 10.865 5.662 2.674 258 HB2 PRO 39 HB2 PRO 39 12.875 4.694 4.238 259 HB3 PRO 39 HB1 PRO 39 13.134 5.323 2.607 260 HG2 PRO 39 HG2 PRO 39 13.561 6.665 5.245 261 HG3 PRO 39 HG1 PRO 39 14.581 6.698 3.796 262 HD2 PRO 39 HD2 PRO 39 12.919 8.729 4.449 263 HD3 PRO 39 HD1 PRO 39 13.280 8.302 2.765 264 H THR 40 HN THR 40 10.186 7.463 5.281 265 HA THR 40 HA THR 40 9.866 5.377 7.256 266 HB THR 40 HB THR 40 8.751 7.260 8.562 267 HG1 THR 40 HG1 THR 40 9.731 9.338 7.382 268 HG21 THR 40 HG21 THR 40 11.581 7.657 7.582 269 HG22 THR 40 HG22 THR 40 11.080 6.613 8.912 270 HG23 THR 40 HG23 THR 40 10.891 8.362 9.045 271 H VAL 41 HN VAL 41 8.117 6.494 4.629 272 HA VAL 41 HA VAL 41 5.465 6.261 5.636 273 HB VAL 41 HB VAL 41 4.771 6.255 3.266 274 HG11 VAL 41 HG11 VAL 41 5.179 8.368 4.410 275 HG12 VAL 41 HG12 VAL 41 5.618 8.480 2.708 276 HG13 VAL 41 HG13 VAL 41 6.876 8.310 3.931 277 HG21 VAL 41 HG21 VAL 41 7.732 6.248 2.684 278 HG22 VAL 41 HG22 VAL 41 6.448 6.481 1.496 279 HG23 VAL 41 HG23 VAL 41 6.603 4.938 2.338 280 H LEU 42 HN LEU 42 3.893 4.661 4.907 281 HA LEU 42 HA LEU 42 5.001 1.973 5.104 282 HB2 LEU 42 HB2 LEU 42 2.150 2.969 5.184 283 HB3 LEU 42 HB1 LEU 42 2.625 1.293 5.377 284 HG LEU 42 HG LEU 42 3.393 3.541 7.240 285 HD11 LEU 42 HD11 LEU 42 1.381 1.318 7.559 286 HD12 LEU 42 HD12 LEU 42 1.019 3.034 7.376 287 HD13 LEU 42 HD13 LEU 42 1.860 2.459 8.815 288 HD21 LEU 42 HD21 LEU 42 5.083 1.820 7.186 289 HD22 LEU 42 HD22 LEU 42 3.860 0.567 7.383 290 HD23 LEU 42 HD23 LEU 42 4.173 1.708 8.692 291 H ILE 43 HN ILE 43 5.207 0.658 3.428 292 HA ILE 43 HA ILE 43 3.786 1.373 0.962 293 HB ILE 43 HB ILE 43 5.449 -0.174 -0.175 294 HG12 ILE 43 HG12 ILE 43 7.077 0.308 2.323 295 HG13 ILE 43 HG11 ILE 43 6.260 -1.210 1.973 296 HG21 ILE 43 HG21 ILE 43 7.192 1.586 -0.259 297 HG22 ILE 43 HG22 ILE 43 6.385 2.399 1.083 298 HG23 ILE 43 HG23 ILE 43 5.554 2.204 -0.460 299 HD11 ILE 43 HD11 ILE 43 7.597 -1.510 -0.013 300 HD12 ILE 43 HD12 ILE 43 8.642 -1.253 1.386 301 HD13 ILE 43 HD13 ILE 43 8.363 0.058 0.238 302 H GLY 44 HN GLY 44 2.499 -0.072 -0.043 303 HA2 GLY 44 HA2 GLY 44 1.865 -2.456 1.562 304 HA3 GLY 44 HA1 GLY 44 0.699 -1.553 0.628 305 H ASP 45 HN ASP 45 3.026 -4.045 0.622 306 HA ASP 45 HA ASP 45 3.022 -4.411 -2.245 307 HB2 ASP 45 HB2 ASP 45 4.978 -5.074 -0.876 308 HB3 ASP 45 HB1 ASP 45 3.986 -6.269 -0.049 309 H GLY 46 HN GLY 46 1.836 -5.943 -3.395 310 HA2 GLY 46 HA2 GLY 46 0.151 -7.484 -3.793 311 HA3 GLY 46 HA1 GLY 46 0.209 -7.881 -2.093 312 H CYS 47 HN CYS 47 -0.517 -4.770 -3.650 313 HA CYS 47 HA CYS 47 -2.893 -4.699 -1.929 314 HB2 CYS 47 HB2 CYS 47 -0.836 -2.928 -2.060 315 HB3 CYS 47 HB1 CYS 47 -1.989 -2.194 -3.174 316 H ASP 48 HN ASP 48 -4.737 -5.037 -2.856 317 HA ASP 48 HA ASP 48 -5.133 -4.242 -5.646 318 HB2 ASP 48 HB2 ASP 48 -5.803 -6.430 -5.514 319 HB3 ASP 48 HB1 ASP 48 -6.430 -6.267 -3.883 320 HA PRO 49 HA PRO 49 -7.363 -0.713 -4.333 321 HB2 PRO 49 HB2 PRO 49 -8.801 -0.521 -6.775 322 HB3 PRO 49 HB1 PRO 49 -7.348 0.348 -6.307 323 HG2 PRO 49 HG2 PRO 49 -7.585 -1.687 -8.258 324 HG3 PRO 49 HG1 PRO 49 -6.113 -0.877 -7.710 325 HD2 PRO 49 HD2 PRO 49 -7.064 -3.562 -7.115 326 HD3 PRO 49 HD1 PRO 49 -5.479 -2.843 -6.809 327 H ILE 50 HN ILE 50 -9.069 -0.719 -3.002 328 HA ILE 50 HA ILE 50 -11.126 -2.726 -3.302 329 HB ILE 50 HB ILE 50 -11.122 -0.494 -1.272 330 HG12 ILE 50 HG12 ILE 50 -9.813 -3.216 -1.071 331 HG13 ILE 50 HG11 ILE 50 -8.970 -1.675 -1.159 332 HG21 ILE 50 HG21 ILE 50 -12.475 -2.007 0.028 333 HG22 ILE 50 HG22 ILE 50 -12.256 -3.283 -1.169 334 HG23 ILE 50 HG23 ILE 50 -13.189 -1.839 -1.578 335 HD11 ILE 50 HD11 ILE 50 -8.989 -2.403 1.113 336 HD12 ILE 50 HD12 ILE 50 -10.733 -2.660 1.064 337 HD13 ILE 50 HD13 ILE 50 -10.079 -1.025 0.969 338 H THR 51 HN THR 51 -12.273 -2.234 -5.096 339 HA THR 51 HA THR 51 -13.866 0.231 -4.984 340 HB THR 51 HB THR 51 -12.060 0.632 -6.561 341 HG1 THR 51 HG1 THR 51 -14.682 0.316 -7.573 342 HG21 THR 51 HG21 THR 51 -13.076 -1.808 -8.014 343 HG22 THR 51 HG22 THR 51 -11.520 -1.645 -7.203 344 HG23 THR 51 HG23 THR 51 -11.872 -0.682 -8.638 345 H VAL 52 HN VAL 52 -14.263 -2.738 -4.486 346 HA VAL 52 HA VAL 52 -16.399 -3.242 -6.408 347 HB VAL 52 HB VAL 52 -14.891 -5.108 -6.008 348 HG11 VAL 52 HG11 VAL 52 -14.814 -6.251 -3.839 349 HG12 VAL 52 HG12 VAL 52 -15.799 -4.964 -3.140 350 HG13 VAL 52 HG13 VAL 52 -14.182 -4.607 -3.744 351 HG21 VAL 52 HG21 VAL 52 -17.638 -5.556 -4.868 352 HG22 VAL 52 HG22 VAL 52 -16.554 -6.825 -5.440 353 HG23 VAL 52 HG23 VAL 52 -17.180 -5.624 -6.570 354 H ALA 53 HN ALA 53 -18.453 -2.945 -5.930 355 HA ALA 53 HA ALA 53 -19.159 -2.122 -3.215 356 HB1 ALA 53 HB1 ALA 53 -20.749 -1.943 -5.775 357 HB2 ALA 53 HB2 ALA 53 -19.818 -0.639 -5.041 358 HB3 ALA 53 HB3 ALA 53 -21.230 -1.288 -4.210 359 H GLY 54 HN GLY 54 -21.128 -2.952 -2.237 360 HA2 GLY 54 HA2 GLY 54 -22.676 -4.606 -1.746 361 HA3 GLY 54 HA1 GLY 54 -22.250 -5.408 -3.252 362 H SER 55 HN SER 55 -19.751 -6.079 -3.128 363 HA SER 55 HA SER 55 -19.625 -8.174 -1.232 364 HB2 SER 55 HB2 SER 55 -17.382 -7.051 -2.926 365 HB3 SER 55 HB1 SER 55 -17.464 -8.662 -2.213 366 HG SER 55 HG SER 55 -19.625 -8.575 -3.552 367 H SER 56 HN SER 56 -19.480 -7.662 0.866 368 HA SER 56 HA SER 56 -18.001 -5.411 1.831 369 HB2 SER 56 HB2 SER 56 -19.092 -7.719 3.444 370 HB3 SER 56 HB1 SER 56 -18.762 -6.079 4.002 371 HG SER 56 HG SER 56 -20.467 -5.331 2.768 372 H ASP 57 HN ASP 57 -17.327 -8.728 1.230 373 HA ASP 57 HA ASP 57 -14.992 -8.885 2.907 374 HB2 ASP 57 HB2 ASP 57 -16.104 -10.723 0.778 375 HB3 ASP 57 HB1 ASP 57 -14.690 -11.084 1.750 376 H ALA 58 HN ALA 58 -14.580 -6.717 1.494 377 HA ALA 58 HA ALA 58 -13.342 -7.342 -1.071 378 HB1 ALA 58 HB1 ALA 58 -14.968 -5.505 -0.895 379 HB2 ALA 58 HB2 ALA 58 -13.392 -4.974 -1.481 380 HB3 ALA 58 HB3 ALA 58 -13.862 -4.659 0.189 381 H CYS 59 HN CYS 59 -12.085 -7.777 1.742 382 HA CYS 59 HA CYS 59 -9.465 -6.871 0.881 383 HB2 CYS 59 HB2 CYS 59 -10.296 -5.011 2.275 384 HB3 CYS 59 HB1 CYS 59 -10.532 -6.133 3.613 385 H SER 60 HN SER 60 -8.203 -8.588 0.989 386 HA SER 60 HA SER 60 -8.971 -10.803 2.699 387 HB2 SER 60 HB2 SER 60 -6.801 -10.643 0.620 388 HB3 SER 60 HB1 SER 60 -7.400 -12.110 1.389 389 HG SER 60 HG SER 60 -9.471 -10.771 0.375 390 H ALA 61 HN ALA 61 -6.744 -8.218 2.820 391 HA ALA 61 HA ALA 61 -5.324 -9.619 4.969 392 HB1 ALA 61 HB1 ALA 61 -3.183 -8.716 4.251 393 HB2 ALA 61 HB2 ALA 61 -3.958 -7.961 2.860 394 HB3 ALA 61 HB3 ALA 61 -3.904 -9.718 2.993 395 H THR 62 HN THR 62 -4.754 -6.349 3.651 396 HA THR 62 HA THR 62 -5.778 -5.243 6.175 397 HB THR 62 HB THR 62 -3.067 -4.518 5.047 398 HG1 THR 62 HG1 THR 62 -3.863 -6.352 7.058 399 HG21 THR 62 HG21 THR 62 -4.165 -2.731 6.333 400 HG22 THR 62 HG22 THR 62 -2.752 -3.365 7.178 401 HG23 THR 62 HG23 THR 62 -4.373 -3.841 7.688 402 H ALA 63 HN ALA 63 -6.916 -3.424 5.903 403 HA ALA 63 HA ALA 63 -7.166 -2.309 3.241 404 HB1 ALA 63 HB1 ALA 63 -8.641 -1.616 5.783 405 HB2 ALA 63 HB2 ALA 63 -9.185 -2.766 4.560 406 HB3 ALA 63 HB3 ALA 63 -9.044 -1.052 4.161 407 H VAL 64 HN VAL 64 -6.316 -0.463 2.588 408 HA VAL 64 HA VAL 64 -5.276 1.429 4.559 409 HB VAL 64 HB VAL 64 -3.173 1.622 3.146 410 HG11 VAL 64 HG11 VAL 64 -2.065 -0.295 4.249 411 HG12 VAL 64 HG12 VAL 64 -3.652 -0.908 4.714 412 HG13 VAL 64 HG13 VAL 64 -3.082 0.636 5.347 413 HG21 VAL 64 HG21 VAL 64 -3.992 0.400 1.208 414 HG22 VAL 64 HG22 VAL 64 -4.125 -1.068 2.182 415 HG23 VAL 64 HG23 VAL 64 -2.539 -0.359 1.860 416 H CYS 65 HN CYS 65 -4.835 3.489 3.714 417 HA CYS 65 HA CYS 65 -6.025 4.045 1.078 418 HB2 CYS 65 HB2 CYS 65 -7.320 5.128 2.823 419 HB3 CYS 65 HB1 CYS 65 -5.864 5.789 3.547 420 H CYS 66 HN CYS 66 -4.451 4.408 -0.379 421 HA CYS 66 HA CYS 66 -1.885 5.333 0.681 422 HB2 CYS 66 HB2 CYS 66 -2.400 3.115 -0.770 423 HB3 CYS 66 HB1 CYS 66 -1.958 4.246 -2.046 424 H SER 67 HN SER 67 -0.837 7.024 -0.031 425 HA SER 67 HA SER 67 -2.433 9.027 -1.327 426 HB2 SER 67 HB2 SER 67 -1.088 9.529 0.683 427 HB3 SER 67 HB1 SER 67 0.375 9.181 -0.234 428 HG SER 67 HG SER 67 0.216 11.044 -1.239 429 H ASP 68 HN ASP 68 0.386 7.123 -2.087 430 HA ASP 68 HA ASP 68 0.765 8.580 -4.582 431 HB2 ASP 68 HB2 ASP 68 2.785 7.989 -3.329 432 HB3 ASP 68 HB1 ASP 68 2.356 6.284 -3.436 433 H ASN 69 HN ASN 69 0.160 7.869 -6.519 434 HA ASN 69 HA ASN 69 -1.266 5.298 -6.590 435 HB2 ASN 69 HB2 ASN 69 -1.599 7.842 -8.169 436 HB3 ASN 69 HB1 ASN 69 -2.297 6.325 -8.712 437 HD21 ASN 69 HD21 ASN 69 -2.036 7.160 -5.330 438 HD22 ASN 69 HD22 ASN 69 -3.727 7.390 -5.060 439 H ASN 70 HN ASN 70 1.706 6.143 -7.138 440 HA ASN 70 HA ASN 70 1.948 5.145 -9.881 441 HB2 ASN 70 HB2 ASN 70 4.058 6.302 -8.043 442 HB3 ASN 70 HB1 ASN 70 4.312 5.831 -9.718 443 HD21 ASN 70 HD21 ASN 70 3.073 8.215 -7.570 444 HD22 ASN 70 HD22 ASN 70 2.673 9.395 -8.779 445 H VAL 71 HN VAL 71 1.206 3.053 -9.107 446 HA VAL 71 HA VAL 71 2.765 1.557 -7.248 447 HB VAL 71 HB VAL 71 1.312 -0.320 -7.884 448 HG11 VAL 71 HG11 VAL 71 -0.094 2.297 -7.397 449 HG12 VAL 71 HG12 VAL 71 0.564 1.199 -6.179 450 HG13 VAL 71 HG13 VAL 71 -0.816 0.706 -7.163 451 HG21 VAL 71 HG21 VAL 71 -0.514 0.024 -9.484 452 HG22 VAL 71 HG22 VAL 71 1.064 0.147 -10.261 453 HG23 VAL 71 HG23 VAL 71 0.146 1.607 -9.890 454 H SER 72 HN SER 72 3.976 -0.322 -7.672 455 HA SER 72 HA SER 72 5.442 -0.214 -10.179 456 HB2 SER 72 HB2 SER 72 6.549 -0.401 -7.881 457 HB3 SER 72 HB1 SER 72 5.961 -2.056 -7.841 458 HG SER 72 HG SER 72 7.076 -2.257 -9.958 459 H GLY 73 HN GLY 73 2.649 -1.491 -9.415 460 HA2 GLY 73 HA2 GLY 73 1.782 -2.934 -11.269 461 HA3 GLY 73 HA1 GLY 73 3.101 -4.016 -10.868 462 H VAL 74 HN VAL 74 2.842 -3.751 -8.000 463 HA VAL 74 HA VAL 74 0.101 -4.625 -7.510 464 HB VAL 74 HB VAL 74 0.764 -6.548 -6.212 465 HG11 VAL 74 HG11 VAL 74 1.883 -6.473 -9.001 466 HG12 VAL 74 HG12 VAL 74 0.293 -7.039 -8.481 467 HG13 VAL 74 HG13 VAL 74 1.738 -7.955 -8.053 468 HG21 VAL 74 HG21 VAL 74 2.952 -5.687 -5.468 469 HG22 VAL 74 HG22 VAL 74 3.591 -6.007 -7.080 470 HG23 VAL 74 HG23 VAL 74 3.029 -7.341 -6.074 471 H ILE 75 HN ILE 75 2.881 -2.942 -6.464 472 HA ILE 75 HA ILE 75 2.238 -3.051 -3.651 473 HB ILE 75 HB ILE 75 4.028 -1.401 -3.357 474 HG12 ILE 75 HG12 ILE 75 4.581 -1.611 -6.298 475 HG13 ILE 75 HG11 ILE 75 3.508 -0.373 -5.664 476 HG21 ILE 75 HG21 ILE 75 4.613 -3.728 -3.359 477 HG22 ILE 75 HG22 ILE 75 5.875 -2.800 -4.171 478 HG23 ILE 75 HG23 ILE 75 4.716 -3.728 -5.118 479 HD11 ILE 75 HD11 ILE 75 5.787 0.443 -5.989 480 HD12 ILE 75 HD12 ILE 75 6.373 -0.771 -4.853 481 HD13 ILE 75 HD13 ILE 75 5.297 0.510 -4.297 482 H ALA 76 HN ALA 76 2.469 -0.779 -2.578 483 HA ALA 76 HA ALA 76 1.101 1.387 -3.934 484 HB1 ALA 76 HB1 ALA 76 0.067 0.100 -1.397 485 HB2 ALA 76 HB2 ALA 76 -0.762 0.170 -2.958 486 HB3 ALA 76 HB3 ALA 76 -0.494 1.650 -2.034 487 H ILE 77 HN ILE 77 1.766 3.423 -3.017 488 HA ILE 77 HA ILE 77 3.900 3.124 -0.999 489 HB ILE 77 HB ILE 77 3.856 5.059 -3.316 490 HG12 ILE 77 HG12 ILE 77 5.650 2.678 -2.797 491 HG13 ILE 77 HG11 ILE 77 4.318 2.700 -3.947 492 HG21 ILE 77 HG21 ILE 77 4.913 6.021 -1.349 493 HG22 ILE 77 HG22 ILE 77 6.118 5.657 -2.584 494 HG23 ILE 77 HG23 ILE 77 5.939 4.596 -1.187 495 HD11 ILE 77 HD11 ILE 77 6.456 2.999 -5.057 496 HD12 ILE 77 HD12 ILE 77 6.780 4.426 -4.072 497 HD13 ILE 77 HD13 ILE 77 5.448 4.437 -5.229 498 H GLY 78 HN GLY 78 3.617 4.195 0.820 499 HA2 GLY 78 HA2 GLY 78 3.117 5.955 2.241 500 HA3 GLY 78 HA1 GLY 78 2.551 6.875 0.852 501 H CYS 79 HN CYS 79 1.598 3.797 2.374 502 HA CYS 79 HA CYS 79 -1.184 4.650 2.072 503 HB2 CYS 79 HB2 CYS 79 -0.359 1.898 2.899 504 HB3 CYS 79 HB1 CYS 79 -1.831 2.413 2.097 505 H LEU 80 HN LEU 80 -2.609 4.783 3.702 506 HA LEU 80 HA LEU 80 -1.536 4.506 6.424 507 HB2 LEU 80 HB2 LEU 80 -3.925 6.072 5.449 508 HB3 LEU 80 HB1 LEU 80 -3.343 5.989 7.107 509 HG LEU 80 HG LEU 80 -1.740 7.126 4.818 510 HD11 LEU 80 HD11 LEU 80 -3.711 8.492 5.219 511 HD12 LEU 80 HD12 LEU 80 -2.258 9.313 5.789 512 HD13 LEU 80 HD13 LEU 80 -3.343 8.541 6.943 513 HD21 LEU 80 HD21 LEU 80 -0.367 8.053 6.658 514 HD22 LEU 80 HD22 LEU 80 -0.352 6.291 6.604 515 HD23 LEU 80 HD23 LEU 80 -1.335 7.126 7.807 516 HA PRO 81 HA PRO 81 -4.218 0.990 6.876 517 HB2 PRO 81 HB2 PRO 81 -3.894 1.387 9.761 518 HB3 PRO 81 HB1 PRO 81 -3.379 0.036 8.755 519 HG2 PRO 81 HG2 PRO 81 -1.623 1.763 9.832 520 HG3 PRO 81 HG1 PRO 81 -1.351 0.999 8.258 521 HD2 PRO 81 HD2 PRO 81 -2.303 3.772 8.875 522 HD3 PRO 81 HD1 PRO 81 -1.177 3.222 7.627 523 H VAL 82 HN VAL 82 -6.359 1.080 6.717 524 HA VAL 82 HA VAL 82 -7.791 2.983 8.426 525 HB VAL 82 HB VAL 82 -9.603 2.795 6.621 526 HG11 VAL 82 HG11 VAL 82 -7.019 4.231 6.023 527 HG12 VAL 82 HG12 VAL 82 -8.331 4.832 7.036 528 HG13 VAL 82 HG13 VAL 82 -8.586 4.605 5.306 529 HG21 VAL 82 HG21 VAL 82 -8.832 2.334 4.374 530 HG22 VAL 82 HG22 VAL 82 -8.628 0.924 5.416 531 HG23 VAL 82 HG23 VAL 82 -7.235 1.922 4.998 532 H THR 83 HN THR 83 -9.570 2.359 9.441 533 HA THR 83 HA THR 83 -10.632 -0.306 9.167 534 HB THR 83 HB THR 83 -8.758 -0.513 10.723 535 HG1 THR 83 HG1 THR 83 -10.214 -2.029 11.224 536 HG21 THR 83 HG21 THR 83 -8.941 0.498 12.963 537 HG22 THR 83 HG22 THR 83 -10.352 1.393 12.398 538 HG23 THR 83 HG23 THR 83 -8.774 1.690 11.676 539 H LEU 84 HN LEU 84 -11.418 2.214 8.632 540 HA LEU 84 HA LEU 84 -13.826 2.514 10.242 541 HB2 LEU 84 HB2 LEU 84 -11.810 4.720 9.828 542 HB3 LEU 84 HB1 LEU 84 -13.450 4.996 10.384 543 HG LEU 84 HG LEU 84 -11.523 3.210 11.850 544 HD11 LEU 84 HD11 LEU 84 -12.066 6.140 12.307 545 HD12 LEU 84 HD12 LEU 84 -10.551 5.436 11.737 546 HD13 LEU 84 HD13 LEU 84 -11.128 5.087 13.366 547 HD21 LEU 84 HD21 LEU 84 -13.045 3.620 13.728 548 HD22 LEU 84 HD22 LEU 84 -13.867 2.857 12.367 549 HD23 LEU 84 HD23 LEU 84 -14.077 4.581 12.670 Start of MODEL 17 1 H1 GLY 1 HT1 GLY 1 -15.815 9.419 -6.934 2 H2 GLY 1 HT2 GLY 1 -16.187 8.677 -8.405 3 H3 GLY 1 HT3 GLY 1 -14.759 8.281 -7.598 4 HA2 GLY 1 HA1 GLY 1 -17.510 7.716 -6.653 5 HA3 GLY 1 HA2 GLY 1 -16.385 6.534 -7.310 6 H SER 2 HN SER 2 -16.618 5.374 -5.301 7 HA SER 2 HA SER 2 -14.977 6.548 -3.161 8 HB2 SER 2 HB2 SER 2 -17.403 6.517 -2.558 9 HB3 SER 2 HB1 SER 2 -17.393 4.767 -2.752 10 HG SER 2 HG SER 2 -16.827 6.102 -0.592 11 H TRP 3 HN TRP 3 -13.268 5.344 -2.631 12 HA TRP 3 HA TRP 3 -13.169 2.598 -3.649 13 HB2 TRP 3 HB2 TRP 3 -10.876 4.314 -2.703 14 HB3 TRP 3 HB1 TRP 3 -10.757 2.752 -3.506 15 HD1 TRP 3 HD1 TRP 3 -10.978 2.723 -6.151 16 HE1 TRP 3 HE1 TRP 3 -11.011 4.596 -7.921 17 HE3 TRP 3 HE3 TRP 3 -11.736 6.678 -3.070 18 HZ2 TRP 3 HZ2 TRP 3 -11.321 7.416 -7.982 19 HZ3 TRP 3 HZ3 TRP 3 -11.890 8.945 -4.035 20 HH2 TRP 3 HH2 TRP 3 -11.689 9.303 -6.445 21 H GLY 4 HN GLY 4 -13.883 4.211 -0.920 22 HA2 GLY 4 HA2 GLY 4 -14.208 2.390 0.937 23 HA3 GLY 4 HA1 GLY 4 -12.450 2.487 0.945 24 H GLN 5 HN GLN 5 -13.470 3.111 3.271 25 HA GLN 5 HA GLN 5 -14.201 5.895 3.422 26 HB2 GLN 5 HB2 GLN 5 -13.583 3.917 5.624 27 HB3 GLN 5 HB1 GLN 5 -14.293 5.507 5.843 28 HG2 GLN 5 HG2 GLN 5 -15.523 3.167 4.413 29 HG3 GLN 5 HG1 GLN 5 -16.008 3.835 5.971 30 HE21 GLN 5 HE21 GLN 5 -17.141 5.769 6.036 31 HE22 GLN 5 HE22 GLN 5 -17.895 6.442 4.633 32 H CYS 6 HN CYS 6 -12.687 7.337 3.069 33 HA CYS 6 HA CYS 6 -10.574 7.905 4.746 34 HB2 CYS 6 HB2 CYS 6 -9.470 5.878 3.944 35 HB3 CYS 6 HB1 CYS 6 -9.689 6.387 2.274 36 H SER 7 HN SER 7 -9.302 9.737 3.958 37 HA SER 7 HA SER 7 -10.330 10.919 1.470 38 HB2 SER 7 HB2 SER 7 -10.201 13.158 2.720 39 HB3 SER 7 HB1 SER 7 -11.545 12.088 3.121 40 HG SER 7 HG SER 7 -9.154 12.523 4.587 41 H THR 8 HN THR 8 -7.771 9.560 2.453 42 HA THR 8 HA THR 8 -5.815 11.702 2.350 43 HB THR 8 HB THR 8 -5.373 8.717 2.580 44 HG1 THR 8 HG1 THR 8 -6.149 10.665 4.397 45 HG21 THR 8 HG21 THR 8 -3.188 9.321 3.468 46 HG22 THR 8 HG22 THR 8 -3.559 11.035 3.270 47 HG23 THR 8 HG23 THR 8 -3.395 9.999 1.853 48 H GLY 9 HN GLY 9 -7.214 9.383 0.210 49 HA2 GLY 9 HA2 GLY 9 -6.204 10.445 -2.123 50 HA3 GLY 9 HA1 GLY 9 -5.038 9.232 -1.633 51 H SER 10 HN SER 10 -5.413 7.183 -2.069 52 HA SER 10 HA SER 10 -8.098 6.416 -3.007 53 HB2 SER 10 HB2 SER 10 -6.398 6.634 -4.865 54 HB3 SER 10 HB1 SER 10 -5.476 5.347 -4.094 55 HG SER 10 HG SER 10 -7.623 5.175 -5.716 56 H ILE 11 HN ILE 11 -8.816 4.382 -2.304 57 HA ILE 11 HA ILE 11 -7.240 3.229 -0.153 58 HB ILE 11 HB ILE 11 -10.114 2.763 -0.937 59 HG12 ILE 11 HG12 ILE 11 -10.394 3.916 1.331 60 HG13 ILE 11 HG11 ILE 11 -8.764 4.497 1.105 61 HG21 ILE 11 HG21 ILE 11 -9.152 0.803 0.164 62 HG22 ILE 11 HG22 ILE 11 -10.331 1.607 1.202 63 HG23 ILE 11 HG23 ILE 11 -8.605 1.818 1.498 64 HD11 ILE 11 HD11 ILE 11 -11.114 5.012 -0.697 65 HD12 ILE 11 HD12 ILE 11 -9.462 5.563 -0.977 66 HD13 ILE 11 HD13 ILE 11 -10.368 6.160 0.413 67 H GLN 12 HN GLN 12 -6.638 1.176 -0.047 68 HA GLN 12 HA GLN 12 -7.302 -0.680 -2.178 69 HB2 GLN 12 HB2 GLN 12 -4.748 -1.313 -2.249 70 HB3 GLN 12 HB1 GLN 12 -5.412 -0.101 -3.319 71 HG2 GLN 12 HG2 GLN 12 -4.153 0.647 -0.716 72 HG3 GLN 12 HG1 GLN 12 -3.182 0.340 -2.148 73 HE21 GLN 12 HE21 GLN 12 -5.108 1.448 -4.014 74 HE22 GLN 12 HE22 GLN 12 -5.083 3.152 -3.792 75 H CYS 13 HN CYS 13 -6.367 -2.860 -1.760 76 HA CYS 13 HA CYS 13 -6.290 -3.348 1.141 77 HB2 CYS 13 HB2 CYS 13 -8.323 -4.254 0.218 78 HB3 CYS 13 HB1 CYS 13 -7.450 -5.051 -1.083 79 H CYS 14 HN CYS 14 -4.264 -3.657 1.682 80 HA CYS 14 HA CYS 14 -2.355 -4.753 -0.207 81 HB2 CYS 14 HB2 CYS 14 -2.087 -3.499 2.511 82 HB3 CYS 14 HB1 CYS 14 -0.731 -4.265 1.694 83 H GLN 15 HN GLN 15 -1.582 -6.722 -0.187 84 HA GLN 15 HA GLN 15 -2.442 -8.677 1.677 85 HB2 GLN 15 HB2 GLN 15 -1.757 -10.061 0.054 86 HB3 GLN 15 HB1 GLN 15 -1.284 -8.647 -0.864 87 HG2 GLN 15 HG2 GLN 15 0.570 -10.045 -0.919 88 HG3 GLN 15 HG1 GLN 15 0.971 -8.834 0.294 89 HE21 GLN 15 HE21 GLN 15 -1.269 -11.455 0.873 90 HE22 GLN 15 HE22 GLN 15 -0.275 -12.311 1.996 91 H ASN 16 HN ASN 16 0.223 -6.500 1.435 92 HA ASN 16 HA ASN 16 1.134 -7.307 4.089 93 HB2 ASN 16 HB2 ASN 16 2.470 -8.278 1.970 94 HB3 ASN 16 HB1 ASN 16 3.242 -6.707 2.107 95 HD21 ASN 16 HD21 ASN 16 4.178 -9.454 2.573 96 HD22 ASN 16 HD22 ASN 16 4.850 -9.441 4.168 97 H VAL 17 HN VAL 17 1.436 -5.539 5.322 98 HA VAL 17 HA VAL 17 1.884 -2.967 3.949 99 HB VAL 17 HB VAL 17 0.511 -3.421 6.607 100 HG11 VAL 17 HG11 VAL 17 0.966 -0.870 5.060 101 HG12 VAL 17 HG12 VAL 17 1.761 -1.323 6.566 102 HG13 VAL 17 HG13 VAL 17 0.024 -1.023 6.542 103 HG21 VAL 17 HG21 VAL 17 -0.878 -4.107 4.738 104 HG22 VAL 17 HG22 VAL 17 -0.595 -2.563 3.935 105 HG23 VAL 17 HG23 VAL 17 -1.501 -2.619 5.448 106 H VAL 18 HN VAL 18 3.969 -2.496 4.089 107 HA VAL 18 HA VAL 18 5.319 -2.830 6.681 108 HB VAL 18 HB VAL 18 7.389 -3.480 5.428 109 HG11 VAL 18 HG11 VAL 18 6.051 -5.164 6.563 110 HG12 VAL 18 HG12 VAL 18 6.722 -5.813 5.067 111 HG13 VAL 18 HG13 VAL 18 5.027 -5.333 5.139 112 HG21 VAL 18 HG21 VAL 18 6.777 -2.624 3.233 113 HG22 VAL 18 HG22 VAL 18 5.465 -3.799 3.124 114 HG23 VAL 18 HG23 VAL 18 7.140 -4.347 3.146 115 HA PRO 19 HA PRO 19 6.751 1.358 5.928 116 HB2 PRO 19 HB2 PRO 19 9.081 0.570 7.549 117 HB3 PRO 19 HB1 PRO 19 7.926 1.879 7.808 118 HG2 PRO 19 HG2 PRO 19 7.906 -0.321 9.336 119 HG3 PRO 19 HG1 PRO 19 6.409 0.511 8.883 120 HD2 PRO 19 HD2 PRO 19 7.592 -2.001 7.771 121 HD3 PRO 19 HD1 PRO 19 5.895 -1.602 8.101 122 H GLY 20 HN GLY 20 8.076 2.261 4.425 123 HA2 GLY 20 HA2 GLY 20 9.442 0.558 2.622 124 HA3 GLY 20 HA1 GLY 20 9.493 2.314 2.615 125 H ASP 21 HN ASP 21 10.483 2.231 5.449 126 HA ASP 21 HA ASP 21 13.300 1.707 4.833 127 HB2 ASP 21 HB2 ASP 21 12.673 3.960 5.635 128 HB3 ASP 21 HB1 ASP 21 12.041 3.247 7.105 129 H SER 22 HN SER 22 10.841 0.009 5.960 130 HA SER 22 HA SER 22 11.921 -1.146 8.347 131 HB2 SER 22 HB2 SER 22 9.538 -1.254 8.031 132 HB3 SER 22 HB1 SER 22 9.720 -2.012 6.459 133 HG SER 22 HG SER 22 9.745 -3.118 8.967 134 H ASP 23 HN ASP 23 12.712 -3.319 8.535 135 HA ASP 23 HA ASP 23 14.693 -4.039 6.708 136 HB2 ASP 23 HB2 ASP 23 13.199 -5.648 8.781 137 HB3 ASP 23 HB1 ASP 23 14.472 -6.357 7.801 138 H LEU 24 HN LEU 24 11.351 -5.124 7.000 139 HA LEU 24 HA LEU 24 11.517 -6.927 4.793 140 HB2 LEU 24 HB2 LEU 24 9.447 -5.978 6.634 141 HB3 LEU 24 HB1 LEU 24 8.858 -6.325 5.021 142 HG LEU 24 HG LEU 24 8.621 -8.241 6.541 143 HD11 LEU 24 HD11 LEU 24 9.565 -9.913 5.056 144 HD12 LEU 24 HD12 LEU 24 10.632 -8.704 4.343 145 HD13 LEU 24 HD13 LEU 24 8.887 -8.579 4.122 146 HD21 LEU 24 HD21 LEU 24 11.634 -8.217 6.603 147 HD22 LEU 24 HD22 LEU 24 10.592 -9.462 7.292 148 HD23 LEU 24 HD23 LEU 24 10.569 -7.828 7.952 149 H GLY 25 HN GLY 25 9.929 -3.761 5.190 150 HA2 GLY 25 HA2 GLY 25 9.016 -3.469 2.584 151 HA3 GLY 25 HA1 GLY 25 9.391 -2.136 3.662 152 H THR 26 HN THR 26 12.165 -2.629 3.920 153 HA THR 26 HA THR 26 13.063 -1.247 1.607 154 HB THR 26 HB THR 26 14.674 -2.484 3.851 155 HG1 THR 26 HG1 THR 26 13.212 -0.127 3.589 156 HG21 THR 26 HG21 THR 26 15.435 -0.334 1.875 157 HG22 THR 26 HG22 THR 26 16.039 -1.993 1.867 158 HG23 THR 26 HG23 THR 26 16.424 -0.918 3.211 159 H LEU 27 HN LEU 27 13.433 -4.545 2.810 160 HA LEU 27 HA LEU 27 15.104 -5.465 0.718 161 HB2 LEU 27 HB2 LEU 27 14.623 -6.542 2.991 162 HB3 LEU 27 HB1 LEU 27 13.130 -7.122 2.289 163 HG LEU 27 HG LEU 27 15.015 -8.786 2.384 164 HD11 LEU 27 HD11 LEU 27 14.617 -9.698 0.158 165 HD12 LEU 27 HD12 LEU 27 13.908 -8.163 -0.347 166 HD13 LEU 27 HD13 LEU 27 13.122 -9.130 0.902 167 HD21 LEU 27 HD21 LEU 27 16.156 -7.078 0.181 168 HD22 LEU 27 HD22 LEU 27 16.773 -8.640 0.720 169 HD23 LEU 27 HD23 LEU 27 16.826 -7.250 1.803 170 H LEU 28 HN LEU 28 11.632 -5.176 1.137 171 HA LEU 28 HA LEU 28 10.891 -6.773 -1.084 172 HB2 LEU 28 HB2 LEU 28 9.336 -4.573 0.277 173 HB3 LEU 28 HB1 LEU 28 8.673 -5.739 -0.844 174 HG LEU 28 HG LEU 28 9.551 -6.140 1.989 175 HD11 LEU 28 HD11 LEU 28 7.219 -5.588 1.517 176 HD12 LEU 28 HD12 LEU 28 7.386 -7.211 2.185 177 HD13 LEU 28 HD13 LEU 28 7.102 -6.993 0.458 178 HD21 LEU 28 HD21 LEU 28 9.361 -8.570 1.656 179 HD22 LEU 28 HD22 LEU 28 10.731 -7.863 0.802 180 HD23 LEU 28 HD23 LEU 28 9.271 -8.306 -0.086 181 H LEU 29 HN LEU 29 11.225 -3.252 -0.658 182 HA LEU 29 HA LEU 29 10.519 -2.744 -3.384 183 HB2 LEU 29 HB2 LEU 29 11.112 -0.437 -2.929 184 HB3 LEU 29 HB1 LEU 29 10.078 -1.077 -1.680 185 HG LEU 29 HG LEU 29 12.273 -1.425 -0.348 186 HD11 LEU 29 HD11 LEU 29 13.180 0.646 -2.345 187 HD12 LEU 29 HD12 LEU 29 13.822 -0.989 -2.191 188 HD13 LEU 29 HD13 LEU 29 14.040 0.171 -0.880 189 HD21 LEU 29 HD21 LEU 29 11.136 1.298 -0.939 190 HD22 LEU 29 HD22 LEU 29 12.151 0.904 0.451 191 HD23 LEU 29 HD23 LEU 29 10.566 0.152 0.276 192 H ASP 30 HN ASP 30 13.430 -3.444 -1.695 193 HA ASP 30 HA ASP 30 15.334 -2.634 -3.587 194 HB2 ASP 30 HB2 ASP 30 15.867 -3.446 -1.313 195 HB3 ASP 30 HB1 ASP 30 15.365 -5.063 -1.778 196 H GLU 31 HN GLU 31 13.287 -5.446 -3.347 197 HA GLU 31 HA GLU 31 14.413 -6.900 -5.516 198 HB2 GLU 31 HB2 GLU 31 12.925 -7.647 -3.483 199 HB3 GLU 31 HB1 GLU 31 11.593 -7.214 -4.545 200 HG2 GLU 31 HG2 GLU 31 12.547 -8.757 -6.244 201 HG3 GLU 31 HG1 GLU 31 13.719 -9.248 -5.022 202 H LEU 32 HN LEU 32 12.052 -4.436 -5.110 203 HA LEU 32 HA LEU 32 10.788 -4.913 -7.683 204 HB2 LEU 32 HB2 LEU 32 10.199 -3.099 -5.365 205 HB3 LEU 32 HB1 LEU 32 9.279 -3.048 -6.856 206 HG LEU 32 HG LEU 32 9.528 -5.468 -5.065 207 HD11 LEU 32 HD11 LEU 32 7.208 -4.990 -4.450 208 HD12 LEU 32 HD12 LEU 32 7.273 -3.499 -5.388 209 HD13 LEU 32 HD13 LEU 32 8.296 -3.690 -3.966 210 HD21 LEU 32 HD21 LEU 32 7.775 -4.922 -7.459 211 HD22 LEU 32 HD22 LEU 32 7.679 -6.344 -6.420 212 HD23 LEU 32 HD23 LEU 32 9.124 -6.056 -7.388 213 H GLY 33 HN GLY 33 13.191 -2.911 -6.330 214 HA2 GLY 33 HA2 GLY 33 14.597 -1.427 -7.405 215 HA3 GLY 33 HA1 GLY 33 13.633 -1.617 -8.861 216 H ILE 34 HN ILE 34 12.460 -0.608 -5.686 217 HA ILE 34 HA ILE 34 11.338 1.782 -6.950 218 HB ILE 34 HB ILE 34 10.835 0.867 -4.121 219 HG12 ILE 34 HG12 ILE 34 9.230 0.129 -6.580 220 HG13 ILE 34 HG11 ILE 34 10.325 -0.966 -5.743 221 HG21 ILE 34 HG21 ILE 34 8.746 2.117 -4.397 222 HG22 ILE 34 HG22 ILE 34 9.236 2.563 -6.032 223 HG23 ILE 34 HG23 ILE 34 10.162 3.140 -4.646 224 HD11 ILE 34 HD11 ILE 34 7.860 0.298 -4.570 225 HD12 ILE 34 HD12 ILE 34 8.952 -0.808 -3.737 226 HD13 ILE 34 HD13 ILE 34 8.014 -1.370 -5.121 227 H VAL 35 HN VAL 35 11.884 3.839 -6.374 228 HA VAL 35 HA VAL 35 13.865 4.148 -4.214 229 HB VAL 35 HB VAL 35 13.691 5.898 -6.672 230 HG11 VAL 35 HG11 VAL 35 15.826 6.779 -5.888 231 HG12 VAL 35 HG12 VAL 35 15.769 5.698 -4.496 232 HG13 VAL 35 HG13 VAL 35 14.572 6.981 -4.663 233 HG21 VAL 35 HG21 VAL 35 15.771 4.818 -7.407 234 HG22 VAL 35 HG22 VAL 35 14.429 3.677 -7.332 235 HG23 VAL 35 HG23 VAL 35 15.650 3.686 -6.060 236 H LEU 36 HN LEU 36 12.555 4.810 -2.595 237 HA LEU 36 HA LEU 36 10.372 6.640 -3.080 238 HB2 LEU 36 HB2 LEU 36 11.459 5.504 -0.509 239 HB3 LEU 36 HB1 LEU 36 9.947 6.371 -0.686 240 HG LEU 36 HG LEU 36 10.484 3.818 -2.176 241 HD11 LEU 36 HD11 LEU 36 10.812 3.360 0.176 242 HD12 LEU 36 HD12 LEU 36 9.293 2.657 -0.385 243 HD13 LEU 36 HD13 LEU 36 9.280 4.144 0.566 244 HD21 LEU 36 HD21 LEU 36 8.642 5.182 -2.970 245 HD22 LEU 36 HD22 LEU 36 7.975 5.262 -1.340 246 HD23 LEU 36 HD23 LEU 36 8.033 3.719 -2.194 247 H GLU 37 HN GLU 37 10.350 8.762 -2.720 248 HA GLU 37 HA GLU 37 12.718 10.191 -2.005 249 HB2 GLU 37 HB2 GLU 37 9.846 11.113 -2.256 250 HB3 GLU 37 HB1 GLU 37 11.231 12.180 -2.067 251 HG2 GLU 37 HG2 GLU 37 10.786 10.293 -4.370 252 HG3 GLU 37 HG1 GLU 37 10.480 12.030 -4.390 253 H ASP 38 HN ASP 38 10.046 8.861 -0.315 254 HA ASP 38 HA ASP 38 11.131 9.814 2.218 255 HB2 ASP 38 HB2 ASP 38 9.078 11.159 1.539 256 HB3 ASP 38 HB1 ASP 38 8.162 9.661 1.637 257 HA PRO 39 HA PRO 39 10.672 5.262 2.027 258 HB2 PRO 39 HB2 PRO 39 12.763 4.698 3.655 259 HB3 PRO 39 HB1 PRO 39 12.966 5.067 1.937 260 HG2 PRO 39 HG2 PRO 39 13.327 6.852 4.315 261 HG3 PRO 39 HG1 PRO 39 14.347 6.688 2.874 262 HD2 PRO 39 HD2 PRO 39 12.566 8.707 3.182 263 HD3 PRO 39 HD1 PRO 39 12.976 8.028 1.594 264 H THR 40 HN THR 40 10.120 7.552 4.339 265 HA THR 40 HA THR 40 9.731 5.638 6.511 266 HB THR 40 HB THR 40 9.067 7.759 7.812 267 HG1 THR 40 HG1 THR 40 9.078 8.947 5.594 268 HG21 THR 40 HG21 THR 40 11.433 8.315 8.203 269 HG22 THR 40 HG22 THR 40 11.872 7.392 6.764 270 HG23 THR 40 HG23 THR 40 11.159 6.574 8.156 271 H VAL 41 HN VAL 41 8.065 5.960 4.005 272 HA VAL 41 HA VAL 41 5.445 6.291 5.279 273 HB VAL 41 HB VAL 41 4.494 6.234 3.037 274 HG11 VAL 41 HG11 VAL 41 6.827 8.130 3.238 275 HG12 VAL 41 HG12 VAL 41 5.206 8.387 3.887 276 HG13 VAL 41 HG13 VAL 41 5.455 8.306 2.143 277 HG21 VAL 41 HG21 VAL 41 7.324 5.908 2.050 278 HG22 VAL 41 HG22 VAL 41 5.898 6.147 1.040 279 HG23 VAL 41 HG23 VAL 41 6.063 4.676 2.000 280 H LEU 42 HN LEU 42 3.797 4.653 4.775 281 HA LEU 42 HA LEU 42 4.885 1.973 4.973 282 HB2 LEU 42 HB2 LEU 42 2.060 3.027 5.087 283 HB3 LEU 42 HB1 LEU 42 2.464 1.328 5.220 284 HG LEU 42 HG LEU 42 3.362 3.480 7.142 285 HD11 LEU 42 HD11 LEU 42 1.790 2.424 8.700 286 HD12 LEU 42 HD12 LEU 42 1.236 1.358 7.410 287 HD13 LEU 42 HD13 LEU 42 0.966 3.097 7.293 288 HD21 LEU 42 HD21 LEU 42 4.945 1.634 6.989 289 HD22 LEU 42 HD22 LEU 42 3.638 0.479 7.246 290 HD23 LEU 42 HD23 LEU 42 4.089 1.600 8.530 291 H ILE 43 HN ILE 43 5.231 0.741 3.273 292 HA ILE 43 HA ILE 43 3.739 1.324 0.821 293 HB ILE 43 HB ILE 43 5.456 -0.159 -0.307 294 HG12 ILE 43 HG12 ILE 43 7.025 0.341 2.231 295 HG13 ILE 43 HG11 ILE 43 6.307 -1.205 1.796 296 HG21 ILE 43 HG21 ILE 43 5.454 2.263 -0.523 297 HG22 ILE 43 HG22 ILE 43 7.105 1.644 -0.460 298 HG23 ILE 43 HG23 ILE 43 6.397 2.411 0.961 299 HD11 ILE 43 HD11 ILE 43 7.715 -1.308 -0.188 300 HD12 ILE 43 HD12 ILE 43 8.682 -1.142 1.278 301 HD13 ILE 43 HD13 ILE 43 8.421 0.252 0.230 302 H GLY 44 HN GLY 44 2.523 -0.191 -0.151 303 HA2 GLY 44 HA2 GLY 44 1.986 -2.567 1.499 304 HA3 GLY 44 HA1 GLY 44 0.808 -1.768 0.478 305 H ASP 45 HN ASP 45 2.988 -4.298 0.725 306 HA ASP 45 HA ASP 45 3.225 -4.720 -2.142 307 HB2 ASP 45 HB2 ASP 45 5.091 -5.397 -0.668 308 HB3 ASP 45 HB1 ASP 45 4.015 -6.507 0.175 309 H GLY 46 HN GLY 46 1.883 -5.990 -3.316 310 HA2 GLY 46 HA2 GLY 46 0.243 -7.594 -3.748 311 HA3 GLY 46 HA1 GLY 46 0.251 -7.986 -2.049 312 H CYS 47 HN CYS 47 -0.284 -4.825 -3.507 313 HA CYS 47 HA CYS 47 -2.773 -4.697 -1.960 314 HB2 CYS 47 HB2 CYS 47 -0.626 -3.028 -1.902 315 HB3 CYS 47 HB1 CYS 47 -1.664 -2.214 -3.072 316 H ASP 48 HN ASP 48 -4.538 -4.962 -3.061 317 HA ASP 48 HA ASP 48 -4.678 -4.060 -5.845 318 HB2 ASP 48 HB2 ASP 48 -6.673 -5.709 -4.286 319 HB3 ASP 48 HB1 ASP 48 -6.758 -5.333 -5.997 320 HA PRO 49 HA PRO 49 -6.855 -0.435 -4.454 321 HB2 PRO 49 HB2 PRO 49 -7.945 -0.254 -7.156 322 HB3 PRO 49 HB1 PRO 49 -6.833 0.830 -6.330 323 HG2 PRO 49 HG2 PRO 49 -6.099 -0.779 -8.394 324 HG3 PRO 49 HG1 PRO 49 -4.988 -0.221 -7.135 325 HD2 PRO 49 HD2 PRO 49 -6.262 -2.886 -7.491 326 HD3 PRO 49 HD1 PRO 49 -4.682 -2.458 -6.813 327 H ILE 50 HN ILE 50 -8.741 -0.452 -3.361 328 HA ILE 50 HA ILE 50 -10.655 -2.529 -3.969 329 HB ILE 50 HB ILE 50 -10.960 -0.399 -1.852 330 HG12 ILE 50 HG12 ILE 50 -9.647 -3.117 -1.624 331 HG13 ILE 50 HG11 ILE 50 -8.813 -1.571 -1.555 332 HG21 ILE 50 HG21 ILE 50 -12.957 -1.741 -2.458 333 HG22 ILE 50 HG22 ILE 50 -12.421 -2.009 -0.798 334 HG23 ILE 50 HG23 ILE 50 -12.056 -3.203 -2.043 335 HD11 ILE 50 HD11 ILE 50 -10.841 -2.601 0.405 336 HD12 ILE 50 HD12 ILE 50 -10.104 -1.003 0.461 337 HD13 ILE 50 HD13 ILE 50 -9.105 -2.441 0.666 338 H THR 51 HN THR 51 -11.479 -1.902 -5.941 339 HA THR 51 HA THR 51 -13.385 0.326 -5.757 340 HB THR 51 HB THR 51 -11.544 0.952 -7.254 341 HG1 THR 51 HG1 THR 51 -14.069 0.451 -8.469 342 HG21 THR 51 HG21 THR 51 -12.361 -1.478 -8.846 343 HG22 THR 51 HG22 THR 51 -10.830 -1.240 -8.002 344 HG23 THR 51 HG23 THR 51 -11.235 -0.236 -9.394 345 H VAL 52 HN VAL 52 -13.306 -2.727 -5.477 346 HA VAL 52 HA VAL 52 -15.188 -3.621 -7.463 347 HB VAL 52 HB VAL 52 -13.458 -5.129 -6.493 348 HG11 VAL 52 HG11 VAL 52 -13.811 -6.068 -4.248 349 HG12 VAL 52 HG12 VAL 52 -15.105 -4.898 -3.980 350 HG13 VAL 52 HG13 VAL 52 -13.447 -4.342 -4.207 351 HG21 VAL 52 HG21 VAL 52 -15.426 -6.072 -7.544 352 HG22 VAL 52 HG22 VAL 52 -16.308 -5.978 -6.021 353 HG23 VAL 52 HG23 VAL 52 -14.928 -7.064 -6.174 354 H ALA 53 HN ALA 53 -17.355 -4.130 -7.069 355 HA ALA 53 HA ALA 53 -18.634 -2.511 -5.055 356 HB1 ALA 53 HB1 ALA 53 -20.724 -3.258 -6.086 357 HB2 ALA 53 HB2 ALA 53 -19.824 -4.393 -7.090 358 HB3 ALA 53 HB3 ALA 53 -19.588 -2.658 -7.293 359 H GLY 54 HN GLY 54 -17.289 -3.997 -3.506 360 HA2 GLY 54 HA2 GLY 54 -19.098 -6.154 -2.611 361 HA3 GLY 54 HA1 GLY 54 -17.346 -6.286 -2.508 362 H SER 55 HN SER 55 -20.121 -5.479 -0.850 363 HA SER 55 HA SER 55 -18.823 -3.609 0.958 364 HB2 SER 55 HB2 SER 55 -21.615 -4.776 1.027 365 HB3 SER 55 HB1 SER 55 -21.019 -3.450 2.026 366 HG SER 55 HG SER 55 -20.466 -2.568 -0.257 367 H SER 56 HN SER 56 -19.754 -6.968 0.806 368 HA SER 56 HA SER 56 -19.056 -7.409 3.597 369 HB2 SER 56 HB2 SER 56 -19.863 -9.397 1.466 370 HB3 SER 56 HB1 SER 56 -19.729 -9.723 3.193 371 HG SER 56 HG SER 56 -21.338 -7.582 2.565 372 H ASP 57 HN ASP 57 -17.653 -7.596 0.466 373 HA ASP 57 HA ASP 57 -15.211 -8.750 1.604 374 HB2 ASP 57 HB2 ASP 57 -16.471 -10.516 0.363 375 HB3 ASP 57 HB1 ASP 57 -16.366 -9.523 -1.087 376 H ALA 58 HN ALA 58 -14.610 -6.512 1.668 377 HA ALA 58 HA ALA 58 -14.046 -5.306 -0.935 378 HB1 ALA 58 HB1 ALA 58 -13.874 -4.082 1.811 379 HB2 ALA 58 HB2 ALA 58 -15.233 -3.916 0.700 380 HB3 ALA 58 HB3 ALA 58 -13.662 -3.234 0.281 381 H CYS 59 HN CYS 59 -12.548 -6.648 1.851 382 HA CYS 59 HA CYS 59 -9.957 -6.571 0.536 383 HB2 CYS 59 HB2 CYS 59 -9.968 -4.511 1.852 384 HB3 CYS 59 HB1 CYS 59 -10.408 -5.416 3.296 385 H SER 60 HN SER 60 -8.624 -8.235 1.103 386 HA SER 60 HA SER 60 -9.829 -10.300 2.793 387 HB2 SER 60 HB2 SER 60 -8.095 -11.761 1.589 388 HB3 SER 60 HB1 SER 60 -9.432 -11.138 0.622 389 HG SER 60 HG SER 60 -7.436 -10.837 -0.432 390 H ALA 61 HN ALA 61 -6.799 -8.525 2.282 391 HA ALA 61 HA ALA 61 -5.676 -9.872 4.631 392 HB1 ALA 61 HB1 ALA 61 -4.261 -8.194 2.564 393 HB2 ALA 61 HB2 ALA 61 -4.317 -9.956 2.599 394 HB3 ALA 61 HB3 ALA 61 -3.499 -9.074 3.888 395 H THR 62 HN THR 62 -4.833 -6.620 3.469 396 HA THR 62 HA THR 62 -5.786 -5.538 6.040 397 HB THR 62 HB THR 62 -3.118 -4.848 4.787 398 HG1 THR 62 HG1 THR 62 -3.029 -6.946 5.655 399 HG21 THR 62 HG21 THR 62 -4.096 -3.034 6.103 400 HG22 THR 62 HG22 THR 62 -2.696 -3.720 6.929 401 HG23 THR 62 HG23 THR 62 -4.326 -4.132 7.464 402 H ALA 63 HN ALA 63 -6.922 -3.702 5.844 403 HA ALA 63 HA ALA 63 -7.183 -2.491 3.219 404 HB1 ALA 63 HB1 ALA 63 -9.195 -2.954 4.548 405 HB2 ALA 63 HB2 ALA 63 -9.027 -1.233 4.196 406 HB3 ALA 63 HB3 ALA 63 -8.618 -1.849 5.797 407 H VAL 64 HN VAL 64 -6.313 -0.599 2.624 408 HA VAL 64 HA VAL 64 -5.161 1.163 4.654 409 HB VAL 64 HB VAL 64 -3.080 1.345 3.178 410 HG11 VAL 64 HG11 VAL 64 -2.982 0.353 5.385 411 HG12 VAL 64 HG12 VAL 64 -1.999 -0.595 4.268 412 HG13 VAL 64 HG13 VAL 64 -3.593 -1.176 4.755 413 HG21 VAL 64 HG21 VAL 64 -2.526 -0.648 1.877 414 HG22 VAL 64 HG22 VAL 64 -3.978 0.142 1.261 415 HG23 VAL 64 HG23 VAL 64 -4.116 -1.322 2.236 416 H CYS 65 HN CYS 65 -4.244 3.151 3.591 417 HA CYS 65 HA CYS 65 -5.725 3.916 1.180 418 HB2 CYS 65 HB2 CYS 65 -6.970 4.603 3.246 419 HB3 CYS 65 HB1 CYS 65 -5.580 5.569 3.711 420 H CYS 66 HN CYS 66 -4.111 4.369 -0.205 421 HA CYS 66 HA CYS 66 -1.650 5.566 0.805 422 HB2 CYS 66 HB2 CYS 66 -2.403 4.042 -1.627 423 HB3 CYS 66 HB1 CYS 66 -1.092 5.201 -1.783 424 H SER 67 HN SER 67 -0.917 7.512 0.337 425 HA SER 67 HA SER 67 -2.755 9.414 -0.836 426 HB2 SER 67 HB2 SER 67 -1.568 9.957 1.255 427 HB3 SER 67 HB1 SER 67 -0.030 9.808 0.410 428 HG SER 67 HG SER 67 -0.633 11.563 -0.894 429 H ASP 68 HN ASP 68 -0.036 7.603 -1.793 430 HA ASP 68 HA ASP 68 0.608 9.457 -3.966 431 HB2 ASP 68 HB2 ASP 68 2.432 8.520 -2.490 432 HB3 ASP 68 HB1 ASP 68 2.090 6.941 -3.188 433 H ASN 69 HN ASN 69 0.996 8.476 -6.145 434 HA ASN 69 HA ASN 69 -1.084 6.447 -6.650 435 HB2 ASN 69 HB2 ASN 69 -0.350 8.885 -8.277 436 HB3 ASN 69 HB1 ASN 69 -1.431 7.620 -8.845 437 HD21 ASN 69 HD21 ASN 69 -1.012 10.235 -6.584 438 HD22 ASN 69 HD22 ASN 69 -2.681 10.390 -6.153 439 H ASN 70 HN ASN 70 2.131 6.677 -6.596 440 HA ASN 70 HA ASN 70 2.707 5.600 -9.232 441 HB2 ASN 70 HB2 ASN 70 4.466 6.097 -6.825 442 HB3 ASN 70 HB1 ASN 70 5.053 5.412 -8.335 443 HD21 ASN 70 HD21 ASN 70 3.847 8.252 -6.747 444 HD22 ASN 70 HD22 ASN 70 4.311 9.381 -7.983 445 H VAL 71 HN VAL 71 1.566 3.659 -9.276 446 HA VAL 71 HA VAL 71 2.344 1.637 -7.322 447 HB VAL 71 HB VAL 71 0.505 0.294 -8.426 448 HG11 VAL 71 HG11 VAL 71 -1.265 1.483 -7.222 449 HG12 VAL 71 HG12 VAL 71 -0.228 2.905 -7.113 450 HG13 VAL 71 HG13 VAL 71 0.227 1.416 -6.282 451 HG21 VAL 71 HG21 VAL 71 -0.153 2.967 -9.656 452 HG22 VAL 71 HG22 VAL 71 -1.175 1.530 -9.699 453 HG23 VAL 71 HG23 VAL 71 0.381 1.530 -10.528 454 H SER 72 HN SER 72 3.636 -0.003 -7.819 455 HA SER 72 HA SER 72 4.891 -0.103 -10.405 456 HB2 SER 72 HB2 SER 72 6.062 -0.473 -8.181 457 HB3 SER 72 HB1 SER 72 5.260 -2.034 -8.110 458 HG SER 72 HG SER 72 6.350 -1.928 -10.485 459 H GLY 73 HN GLY 73 2.042 -1.253 -9.299 460 HA2 GLY 73 HA2 GLY 73 0.823 -2.487 -11.106 461 HA3 GLY 73 HA1 GLY 73 2.137 -3.644 -11.020 462 H VAL 74 HN VAL 74 2.365 -3.638 -8.138 463 HA VAL 74 HA VAL 74 -0.312 -4.428 -7.273 464 HB VAL 74 HB VAL 74 0.396 -6.468 -6.284 465 HG11 VAL 74 HG11 VAL 74 -0.286 -6.728 -8.538 466 HG12 VAL 74 HG12 VAL 74 1.139 -7.744 -8.315 467 HG13 VAL 74 HG13 VAL 74 1.280 -6.189 -9.139 468 HG21 VAL 74 HG21 VAL 74 2.643 -5.816 -5.615 469 HG22 VAL 74 HG22 VAL 74 3.166 -5.889 -7.295 470 HG23 VAL 74 HG23 VAL 74 2.650 -7.357 -6.471 471 H ILE 75 HN ILE 75 2.186 -2.492 -6.693 472 HA ILE 75 HA ILE 75 2.101 -2.836 -3.785 473 HB ILE 75 HB ILE 75 3.929 -1.252 -3.626 474 HG12 ILE 75 HG12 ILE 75 4.113 -1.203 -6.619 475 HG13 ILE 75 HG11 ILE 75 3.139 -0.027 -5.754 476 HG21 ILE 75 HG21 ILE 75 4.430 -3.600 -3.951 477 HG22 ILE 75 HG22 ILE 75 5.649 -2.572 -4.702 478 HG23 ILE 75 HG23 ILE 75 4.429 -3.361 -5.698 479 HD11 ILE 75 HD11 ILE 75 5.301 0.904 -6.217 480 HD12 ILE 75 HD12 ILE 75 6.092 -0.479 -5.462 481 HD13 ILE 75 HD13 ILE 75 5.145 0.639 -4.479 482 H ALA 76 HN ALA 76 2.298 -0.729 -2.587 483 HA ALA 76 HA ALA 76 0.784 1.488 -3.731 484 HB1 ALA 76 HB1 ALA 76 -0.661 1.633 -1.750 485 HB2 ALA 76 HB2 ALA 76 0.046 0.132 -1.134 486 HB3 ALA 76 HB3 ALA 76 -0.902 0.116 -2.623 487 H ILE 77 HN ILE 77 1.437 3.485 -2.887 488 HA ILE 77 HA ILE 77 3.618 3.359 -0.906 489 HB ILE 77 HB ILE 77 3.404 5.221 -3.279 490 HG12 ILE 77 HG12 ILE 77 5.366 2.991 -2.691 491 HG13 ILE 77 HG11 ILE 77 4.051 2.907 -3.858 492 HG21 ILE 77 HG21 ILE 77 4.402 6.342 -1.366 493 HG22 ILE 77 HG22 ILE 77 5.620 6.026 -2.601 494 HG23 ILE 77 HG23 ILE 77 5.541 5.012 -1.160 495 HD11 ILE 77 HD11 ILE 77 6.406 4.774 -3.985 496 HD12 ILE 77 HD12 ILE 77 5.090 4.690 -5.156 497 HD13 ILE 77 HD13 ILE 77 6.176 3.315 -4.950 498 H GLY 78 HN GLY 78 3.330 4.525 0.878 499 HA2 GLY 78 HA2 GLY 78 2.766 6.358 2.196 500 HA3 GLY 78 HA1 GLY 78 1.995 7.096 0.799 501 H CYS 79 HN CYS 79 1.471 4.017 2.517 502 HA CYS 79 HA CYS 79 -1.392 4.568 2.410 503 HB2 CYS 79 HB2 CYS 79 0.290 2.147 2.396 504 HB3 CYS 79 HB1 CYS 79 -1.229 2.018 3.264 505 H LEU 80 HN LEU 80 -2.664 4.755 4.127 506 HA LEU 80 HA LEU 80 -1.513 4.255 6.789 507 HB2 LEU 80 HB2 LEU 80 -3.892 5.946 6.014 508 HB3 LEU 80 HB1 LEU 80 -3.319 5.673 7.652 509 HG LEU 80 HG LEU 80 -1.734 7.063 5.491 510 HD11 LEU 80 HD11 LEU 80 -2.163 9.098 6.786 511 HD12 LEU 80 HD12 LEU 80 -3.230 8.186 7.854 512 HD13 LEU 80 HD13 LEU 80 -3.651 8.394 6.154 513 HD21 LEU 80 HD21 LEU 80 -0.260 7.694 7.361 514 HD22 LEU 80 HD22 LEU 80 -0.310 5.951 7.105 515 HD23 LEU 80 HD23 LEU 80 -1.213 6.671 8.436 516 HA PRO 81 HA PRO 81 -4.129 0.686 6.941 517 HB2 PRO 81 HB2 PRO 81 -3.862 0.851 9.856 518 HB3 PRO 81 HB1 PRO 81 -3.309 -0.405 8.753 519 HG2 PRO 81 HG2 PRO 81 -1.598 1.258 9.985 520 HG3 PRO 81 HG1 PRO 81 -1.298 0.638 8.354 521 HD2 PRO 81 HD2 PRO 81 -2.310 3.328 9.199 522 HD3 PRO 81 HD1 PRO 81 -1.165 2.908 7.917 523 H VAL 82 HN VAL 82 -6.253 0.719 6.726 524 HA VAL 82 HA VAL 82 -7.875 2.216 8.653 525 HB VAL 82 HB VAL 82 -9.520 2.476 6.749 526 HG11 VAL 82 HG11 VAL 82 -8.428 4.471 5.856 527 HG12 VAL 82 HG12 VAL 82 -6.882 3.909 6.493 528 HG13 VAL 82 HG13 VAL 82 -8.186 4.342 7.599 529 HG21 VAL 82 HG21 VAL 82 -8.588 0.844 5.221 530 HG22 VAL 82 HG22 VAL 82 -7.110 1.795 5.090 531 HG23 VAL 82 HG23 VAL 82 -8.630 2.440 4.473 532 H THR 83 HN THR 83 -10.067 1.352 8.892 533 HA THR 83 HA THR 83 -10.468 -1.370 7.927 534 HB THR 83 HB THR 83 -10.733 -0.698 10.860 535 HG1 THR 83 HG1 THR 83 -8.641 -1.759 9.333 536 HG21 THR 83 HG21 THR 83 -10.960 -3.322 9.383 537 HG22 THR 83 HG22 THR 83 -12.296 -2.414 10.088 538 HG23 THR 83 HG23 THR 83 -11.057 -3.114 11.131 539 H LEU 84 HN LEU 84 -12.499 -1.767 7.400 540 HA LEU 84 HA LEU 84 -14.670 -1.458 6.900 541 HB2 LEU 84 HB2 LEU 84 -14.659 -0.519 9.745 542 HB3 LEU 84 HB1 LEU 84 -16.128 -0.774 8.821 543 HG LEU 84 HG LEU 84 -14.072 -2.870 9.476 544 HD11 LEU 84 HD11 LEU 84 -15.364 -2.192 11.427 545 HD12 LEU 84 HD12 LEU 84 -15.810 -3.819 10.911 546 HD13 LEU 84 HD13 LEU 84 -16.861 -2.454 10.534 547 HD21 LEU 84 HD21 LEU 84 -15.771 -4.435 8.581 548 HD22 LEU 84 HD22 LEU 84 -15.057 -3.375 7.369 549 HD23 LEU 84 HD23 LEU 84 -16.674 -3.041 7.988 Start of MODEL 18 1 H1 GLY 1 HT1 GLY 1 -20.578 3.239 -0.573 2 H2 GLY 1 HT2 GLY 1 -21.148 1.869 0.233 3 H3 GLY 1 HT3 GLY 1 -22.236 2.911 -0.534 4 HA2 GLY 1 HA1 GLY 1 -21.925 0.931 -1.856 5 HA3 GLY 1 HA2 GLY 1 -21.302 2.348 -2.688 6 H SER 2 HN SER 2 -20.211 0.423 -3.815 7 HA SER 2 HA SER 2 -17.969 -0.694 -2.349 8 HB2 SER 2 HB2 SER 2 -18.758 -1.110 -5.239 9 HB3 SER 2 HB1 SER 2 -17.631 -2.091 -4.301 10 HG SER 2 HG SER 2 -19.827 -2.056 -2.899 11 H TRP 3 HN TRP 3 -17.660 2.031 -2.539 12 HA TRP 3 HA TRP 3 -15.446 2.236 -4.464 13 HB2 TRP 3 HB2 TRP 3 -17.290 4.377 -3.418 14 HB3 TRP 3 HB1 TRP 3 -15.749 4.756 -4.171 15 HD1 TRP 3 HD1 TRP 3 -15.582 4.533 -6.805 16 HE1 TRP 3 HE1 TRP 3 -17.362 4.245 -8.648 17 HE3 TRP 3 HE3 TRP 3 -19.529 3.216 -3.881 18 HZ2 TRP 3 HZ2 TRP 3 -20.096 3.552 -8.818 19 HZ3 TRP 3 HZ3 TRP 3 -21.701 2.760 -4.947 20 HH2 TRP 3 HH2 TRP 3 -21.972 2.922 -7.366 21 H GLY 4 HN GLY 4 -13.491 2.359 -3.615 22 HA2 GLY 4 HA2 GLY 4 -13.196 2.710 -0.740 23 HA3 GLY 4 HA1 GLY 4 -11.945 2.197 -1.865 24 H GLN 5 HN GLN 5 -13.992 5.036 -1.236 25 HA GLN 5 HA GLN 5 -11.877 6.785 -2.180 26 HB2 GLN 5 HB2 GLN 5 -14.669 7.367 -1.184 27 HB3 GLN 5 HB1 GLN 5 -13.538 8.602 -1.725 28 HG2 GLN 5 HG2 GLN 5 -13.456 7.509 -3.933 29 HG3 GLN 5 HG1 GLN 5 -14.664 6.354 -3.377 30 HE21 GLN 5 HE21 GLN 5 -14.755 8.291 -5.559 31 HE22 GLN 5 HE22 GLN 5 -16.141 9.283 -5.253 32 H CYS 6 HN CYS 6 -10.602 8.009 -0.953 33 HA CYS 6 HA CYS 6 -11.021 8.020 1.951 34 HB2 CYS 6 HB2 CYS 6 -9.452 6.242 1.574 35 HB3 CYS 6 HB1 CYS 6 -8.517 7.226 0.455 36 H SER 7 HN SER 7 -10.263 9.850 2.997 37 HA SER 7 HA SER 7 -10.149 12.195 1.378 38 HB2 SER 7 HB2 SER 7 -9.822 13.300 3.660 39 HB3 SER 7 HB1 SER 7 -11.307 12.380 3.432 40 HG SER 7 HG SER 7 -9.315 11.992 5.212 41 H THR 8 HN THR 8 -7.789 10.026 2.411 42 HA THR 8 HA THR 8 -5.659 12.038 2.232 43 HB THR 8 HB THR 8 -5.315 9.136 2.997 44 HG1 THR 8 HG1 THR 8 -6.528 11.170 4.389 45 HG21 THR 8 HG21 THR 8 -3.277 10.404 2.439 46 HG22 THR 8 HG22 THR 8 -3.323 9.960 4.146 47 HG23 THR 8 HG23 THR 8 -3.704 11.610 3.653 48 H GLY 9 HN GLY 9 -7.321 9.839 0.328 49 HA2 GLY 9 HA2 GLY 9 -6.157 10.187 -2.037 50 HA3 GLY 9 HA1 GLY 9 -5.043 9.048 -1.300 51 H SER 10 HN SER 10 -5.368 7.083 -2.042 52 HA SER 10 HA SER 10 -8.103 6.260 -2.755 53 HB2 SER 10 HB2 SER 10 -6.555 6.229 -4.640 54 HB3 SER 10 HB1 SER 10 -5.413 5.248 -3.723 55 HG SER 10 HG SER 10 -6.798 3.535 -3.829 56 H ILE 11 HN ILE 11 -8.861 4.195 -2.081 57 HA ILE 11 HA ILE 11 -7.306 3.016 0.107 58 HB ILE 11 HB ILE 11 -10.212 2.617 -0.605 59 HG12 ILE 11 HG12 ILE 11 -8.818 4.063 1.646 60 HG13 ILE 11 HG11 ILE 11 -9.780 4.777 0.361 61 HG21 ILE 11 HG21 ILE 11 -8.644 1.505 1.721 62 HG22 ILE 11 HG22 ILE 11 -9.220 0.578 0.338 63 HG23 ILE 11 HG23 ILE 11 -10.375 1.315 1.448 64 HD11 ILE 11 HD11 ILE 11 -11.770 3.689 1.235 65 HD12 ILE 11 HD12 ILE 11 -11.001 4.696 2.463 66 HD13 ILE 11 HD13 ILE 11 -10.803 2.943 2.507 67 H GLN 12 HN GLN 12 -6.599 1.017 0.074 68 HA GLN 12 HA GLN 12 -7.350 -0.800 -2.073 69 HB2 GLN 12 HB2 GLN 12 -4.694 -1.281 -2.108 70 HB3 GLN 12 HB1 GLN 12 -5.514 -0.245 -3.261 71 HG2 GLN 12 HG2 GLN 12 -4.571 1.041 -0.796 72 HG3 GLN 12 HG1 GLN 12 -3.329 0.453 -1.889 73 HE21 GLN 12 HE21 GLN 12 -4.654 0.887 -4.326 74 HE22 GLN 12 HE22 GLN 12 -4.768 2.589 -4.573 75 H CYS 13 HN CYS 13 -6.617 -2.988 -1.707 76 HA CYS 13 HA CYS 13 -6.335 -3.547 1.164 77 HB2 CYS 13 HB2 CYS 13 -8.347 -4.504 0.194 78 HB3 CYS 13 HB1 CYS 13 -7.415 -5.275 -1.081 79 H CYS 14 HN CYS 14 -4.265 -3.708 1.617 80 HA CYS 14 HA CYS 14 -2.362 -4.757 -0.299 81 HB2 CYS 14 HB2 CYS 14 -2.072 -3.580 2.460 82 HB3 CYS 14 HB1 CYS 14 -0.717 -4.240 1.558 83 H GLN 15 HN GLN 15 -1.463 -6.687 -0.253 84 HA GLN 15 HA GLN 15 -2.325 -8.667 1.610 85 HB2 GLN 15 HB2 GLN 15 -1.719 -10.015 -0.063 86 HB3 GLN 15 HB1 GLN 15 -1.204 -8.600 -0.956 87 HG2 GLN 15 HG2 GLN 15 0.617 -10.032 -1.044 88 HG3 GLN 15 HG1 GLN 15 1.039 -8.887 0.226 89 HE21 GLN 15 HE21 GLN 15 -1.280 -11.473 0.638 90 HE22 GLN 15 HE22 GLN 15 -0.334 -12.404 1.742 91 H ASN 16 HN ASN 16 0.424 -6.568 1.223 92 HA ASN 16 HA ASN 16 1.423 -7.418 3.853 93 HB2 ASN 16 HB2 ASN 16 2.701 -8.126 1.535 94 HB3 ASN 16 HB1 ASN 16 3.483 -6.605 1.939 95 HD21 ASN 16 HD21 ASN 16 4.534 -9.311 1.920 96 HD22 ASN 16 HD22 ASN 16 5.150 -9.595 3.511 97 H VAL 17 HN VAL 17 1.403 -5.666 5.133 98 HA VAL 17 HA VAL 17 1.858 -3.030 3.896 99 HB VAL 17 HB VAL 17 0.417 -3.646 6.486 100 HG11 VAL 17 HG11 VAL 17 1.579 -1.505 6.579 101 HG12 VAL 17 HG12 VAL 17 -0.165 -1.258 6.479 102 HG13 VAL 17 HG13 VAL 17 0.844 -1.024 5.051 103 HG21 VAL 17 HG21 VAL 17 -0.865 -4.300 4.511 104 HG22 VAL 17 HG22 VAL 17 -0.652 -2.685 3.834 105 HG23 VAL 17 HG23 VAL 17 -1.591 -2.906 5.311 106 H VAL 18 HN VAL 18 3.935 -2.562 4.107 107 HA VAL 18 HA VAL 18 5.195 -2.914 6.741 108 HB VAL 18 HB VAL 18 7.307 -3.584 5.545 109 HG11 VAL 18 HG11 VAL 18 4.950 -5.445 5.241 110 HG12 VAL 18 HG12 VAL 18 5.920 -5.230 6.699 111 HG13 VAL 18 HG13 VAL 18 6.647 -5.923 5.250 112 HG21 VAL 18 HG21 VAL 18 7.121 -4.481 3.280 113 HG22 VAL 18 HG22 VAL 18 6.693 -2.771 3.313 114 HG23 VAL 18 HG23 VAL 18 5.427 -3.994 3.216 115 HA PRO 19 HA PRO 19 6.675 1.261 6.075 116 HB2 PRO 19 HB2 PRO 19 8.981 0.387 7.693 117 HB3 PRO 19 HB1 PRO 19 7.872 1.732 7.956 118 HG2 PRO 19 HG2 PRO 19 7.766 -0.483 9.462 119 HG3 PRO 19 HG1 PRO 19 6.304 0.414 9.015 120 HD2 PRO 19 HD2 PRO 19 7.369 -2.147 7.909 121 HD3 PRO 19 HD1 PRO 19 5.688 -1.646 8.189 122 H GLY 20 HN GLY 20 7.998 2.169 4.580 123 HA2 GLY 20 HA2 GLY 20 9.446 0.498 2.808 124 HA3 GLY 20 HA1 GLY 20 9.474 2.254 2.818 125 H ASP 21 HN ASP 21 10.354 2.162 5.695 126 HA ASP 21 HA ASP 21 13.200 1.720 5.213 127 HB2 ASP 21 HB2 ASP 21 12.563 3.838 6.216 128 HB3 ASP 21 HB1 ASP 21 11.699 3.004 7.495 129 H SER 22 HN SER 22 10.638 -0.046 6.288 130 HA SER 22 HA SER 22 11.730 -1.398 8.535 131 HB2 SER 22 HB2 SER 22 9.350 -1.475 8.176 132 HB3 SER 22 HB1 SER 22 9.557 -2.165 6.575 133 HG SER 22 HG SER 22 9.776 -3.358 9.093 134 H ASP 23 HN ASP 23 12.522 -3.561 8.601 135 HA ASP 23 HA ASP 23 14.538 -4.195 6.800 136 HB2 ASP 23 HB2 ASP 23 12.910 -6.014 8.596 137 HB3 ASP 23 HB1 ASP 23 14.359 -6.523 7.747 138 H LEU 24 HN LEU 24 11.195 -5.334 6.928 139 HA LEU 24 HA LEU 24 11.416 -6.977 4.617 140 HB2 LEU 24 HB2 LEU 24 9.353 -6.203 6.499 141 HB3 LEU 24 HB1 LEU 24 8.742 -6.255 4.858 142 HG LEU 24 HG LEU 24 8.426 -8.374 6.092 143 HD11 LEU 24 HD11 LEU 24 8.521 -8.380 3.663 144 HD12 LEU 24 HD12 LEU 24 9.269 -9.840 4.313 145 HD13 LEU 24 HD13 LEU 24 10.277 -8.522 3.717 146 HD21 LEU 24 HD21 LEU 24 10.478 -8.287 7.434 147 HD22 LEU 24 HD22 LEU 24 11.431 -8.559 5.977 148 HD23 LEU 24 HD23 LEU 24 10.327 -9.806 6.554 149 H GLY 25 HN GLY 25 9.823 -3.826 5.124 150 HA2 GLY 25 HA2 GLY 25 9.005 -3.411 2.500 151 HA3 GLY 25 HA1 GLY 25 9.313 -2.133 3.663 152 H THR 26 HN THR 26 12.092 -2.608 3.999 153 HA THR 26 HA THR 26 13.069 -1.084 1.823 154 HB THR 26 HB THR 26 14.597 -2.513 4.009 155 HG1 THR 26 HG1 THR 26 13.215 -0.084 3.851 156 HG21 THR 26 HG21 THR 26 16.410 -1.002 3.541 157 HG22 THR 26 HG22 THR 26 15.464 -0.192 2.294 158 HG23 THR 26 HG23 THR 26 15.993 -1.860 2.057 159 H LEU 27 HN LEU 27 13.442 -4.459 2.791 160 HA LEU 27 HA LEU 27 15.096 -5.297 0.679 161 HB2 LEU 27 HB2 LEU 27 14.325 -6.521 2.830 162 HB3 LEU 27 HB1 LEU 27 12.917 -6.970 1.908 163 HG LEU 27 HG LEU 27 14.672 -8.738 2.049 164 HD11 LEU 27 HD11 LEU 27 14.602 -9.355 -0.324 165 HD12 LEU 27 HD12 LEU 27 14.005 -7.742 -0.714 166 HD13 LEU 27 HD13 LEU 27 13.032 -8.825 0.281 167 HD21 LEU 27 HD21 LEU 27 16.233 -6.881 0.262 168 HD22 LEU 27 HD22 LEU 27 16.671 -8.536 0.684 169 HD23 LEU 27 HD23 LEU 27 16.633 -7.289 1.930 170 H LEU 28 HN LEU 28 11.617 -5.007 1.035 171 HA LEU 28 HA LEU 28 10.871 -6.334 -1.323 172 HB2 LEU 28 HB2 LEU 28 9.382 -4.122 0.089 173 HB3 LEU 28 HB1 LEU 28 8.707 -5.213 -1.101 174 HG LEU 28 HG LEU 28 9.486 -5.778 1.736 175 HD11 LEU 28 HD11 LEU 28 7.008 -6.373 0.129 176 HD12 LEU 28 HD12 LEU 28 7.210 -5.037 1.260 177 HD13 LEU 28 HD13 LEU 28 7.244 -6.700 1.846 178 HD21 LEU 28 HD21 LEU 28 9.070 -7.828 -0.433 179 HD22 LEU 28 HD22 LEU 28 9.141 -8.168 1.297 180 HD23 LEU 28 HD23 LEU 28 10.558 -7.526 0.467 181 H LEU 29 HN LEU 29 11.286 -2.846 -0.696 182 HA LEU 29 HA LEU 29 10.630 -2.241 -3.420 183 HB2 LEU 29 HB2 LEU 29 11.107 0.078 -2.828 184 HB3 LEU 29 HB1 LEU 29 10.001 -0.672 -1.713 185 HG LEU 29 HG LEU 29 12.005 -0.950 -0.151 186 HD11 LEU 29 HD11 LEU 29 13.841 0.631 -0.472 187 HD12 LEU 29 HD12 LEU 29 13.180 1.088 -2.043 188 HD13 LEU 29 HD13 LEU 29 13.784 -0.549 -1.783 189 HD21 LEU 29 HD21 LEU 29 11.821 1.398 0.597 190 HD22 LEU 29 HD22 LEU 29 10.260 0.656 0.249 191 HD23 LEU 29 HD23 LEU 29 10.981 1.777 -0.911 192 H ASP 30 HN ASP 30 13.539 -2.899 -1.704 193 HA ASP 30 HA ASP 30 15.350 -1.745 -3.561 194 HB2 ASP 30 HB2 ASP 30 15.871 -2.609 -1.198 195 HB3 ASP 30 HB1 ASP 30 15.906 -4.214 -1.917 196 H GLU 31 HN GLU 31 13.624 -4.756 -3.360 197 HA GLU 31 HA GLU 31 15.009 -6.032 -5.526 198 HB2 GLU 31 HB2 GLU 31 13.498 -6.932 -3.468 199 HB3 GLU 31 HB1 GLU 31 12.294 -6.925 -4.749 200 HG2 GLU 31 HG2 GLU 31 13.770 -8.324 -6.119 201 HG3 GLU 31 HG1 GLU 31 14.930 -8.345 -4.791 202 H LEU 32 HN LEU 32 12.409 -3.851 -5.141 203 HA LEU 32 HA LEU 32 11.233 -4.476 -7.739 204 HB2 LEU 32 HB2 LEU 32 10.346 -2.824 -5.395 205 HB3 LEU 32 HB1 LEU 32 9.504 -2.774 -6.928 206 HG LEU 32 HG LEU 32 9.899 -5.264 -5.268 207 HD11 LEU 32 HD11 LEU 32 7.471 -3.509 -5.588 208 HD12 LEU 32 HD12 LEU 32 8.452 -3.675 -4.130 209 HD13 LEU 32 HD13 LEU 32 7.524 -5.049 -4.731 210 HD21 LEU 32 HD21 LEU 32 8.245 -4.727 -7.733 211 HD22 LEU 32 HD22 LEU 32 8.175 -6.199 -6.766 212 HD23 LEU 32 HD23 LEU 32 9.658 -5.777 -7.618 213 H GLY 33 HN GLY 33 13.553 -2.461 -6.500 214 HA2 GLY 33 HA2 GLY 33 14.773 -0.780 -7.470 215 HA3 GLY 33 HA1 GLY 33 13.850 -1.047 -8.941 216 H ILE 34 HN ILE 34 12.786 -0.008 -5.709 217 HA ILE 34 HA ILE 34 11.408 2.236 -6.997 218 HB ILE 34 HB ILE 34 11.117 1.338 -4.125 219 HG12 ILE 34 HG12 ILE 34 9.459 0.525 -6.530 220 HG13 ILE 34 HG11 ILE 34 10.593 -0.521 -5.684 221 HG21 ILE 34 HG21 ILE 34 9.331 2.970 -5.930 222 HG22 ILE 34 HG22 ILE 34 10.319 3.588 -4.607 223 HG23 ILE 34 HG23 ILE 34 8.967 2.507 -4.266 224 HD11 ILE 34 HD11 ILE 34 8.074 0.669 -4.553 225 HD12 ILE 34 HD12 ILE 34 9.227 -0.316 -3.654 226 HD13 ILE 34 HD13 ILE 34 8.338 -1.014 -5.007 227 H VAL 35 HN VAL 35 11.722 4.352 -6.386 228 HA VAL 35 HA VAL 35 14.067 4.883 -4.691 229 HB VAL 35 HB VAL 35 12.745 6.722 -6.700 230 HG11 VAL 35 HG11 VAL 35 14.758 8.095 -6.422 231 HG12 VAL 35 HG12 VAL 35 15.332 6.989 -5.174 232 HG13 VAL 35 HG13 VAL 35 13.862 7.929 -4.912 233 HG21 VAL 35 HG21 VAL 35 14.693 6.310 -8.118 234 HG22 VAL 35 HG22 VAL 35 13.797 4.823 -7.812 235 HG23 VAL 35 HG23 VAL 35 15.300 5.139 -6.946 236 H LEU 36 HN LEU 36 13.576 5.512 -2.686 237 HA LEU 36 HA LEU 36 10.929 6.589 -2.138 238 HB2 LEU 36 HB2 LEU 36 11.785 6.435 0.280 239 HB3 LEU 36 HB1 LEU 36 11.440 4.949 -0.569 240 HG LEU 36 HG LEU 36 14.030 5.071 -1.120 241 HD11 LEU 36 HD11 LEU 36 13.809 6.583 1.464 242 HD12 LEU 36 HD12 LEU 36 14.374 7.232 -0.073 243 HD13 LEU 36 HD13 LEU 36 15.297 5.971 0.745 244 HD21 LEU 36 HD21 LEU 36 13.003 3.227 -0.014 245 HD22 LEU 36 HD22 LEU 36 12.813 4.158 1.470 246 HD23 LEU 36 HD23 LEU 36 14.424 3.712 0.910 247 H GLU 37 HN GLU 37 10.517 8.665 -1.848 248 HA GLU 37 HA GLU 37 12.707 10.545 -1.437 249 HB2 GLU 37 HB2 GLU 37 9.736 10.995 -1.797 250 HB3 GLU 37 HB1 GLU 37 10.913 12.279 -1.568 251 HG2 GLU 37 HG2 GLU 37 12.069 11.483 -3.630 252 HG3 GLU 37 HG1 GLU 37 10.720 10.375 -3.886 253 H ASP 38 HN ASP 38 10.176 8.928 0.223 254 HA ASP 38 HA ASP 38 11.140 9.967 2.766 255 HB2 ASP 38 HB2 ASP 38 8.238 9.824 1.913 256 HB3 ASP 38 HB1 ASP 38 8.749 9.983 3.589 257 HA PRO 39 HA PRO 39 11.093 5.410 2.667 258 HB2 PRO 39 HB2 PRO 39 12.941 5.107 4.654 259 HB3 PRO 39 HB1 PRO 39 13.376 5.397 2.969 260 HG2 PRO 39 HG2 PRO 39 13.249 7.323 5.252 261 HG3 PRO 39 HG1 PRO 39 14.457 7.196 3.962 262 HD2 PRO 39 HD2 PRO 39 12.485 9.053 3.941 263 HD3 PRO 39 HD1 PRO 39 13.149 8.350 2.452 264 H THR 40 HN THR 40 10.048 7.685 4.825 265 HA THR 40 HA THR 40 9.591 5.920 7.090 266 HB THR 40 HB THR 40 8.471 8.043 8.020 267 HG1 THR 40 HG1 THR 40 9.851 9.754 6.517 268 HG21 THR 40 HG21 THR 40 10.643 9.063 8.552 269 HG22 THR 40 HG22 THR 40 11.400 8.093 7.290 270 HG23 THR 40 HG23 THR 40 10.695 7.307 8.701 271 H VAL 41 HN VAL 41 8.118 6.164 4.252 272 HA VAL 41 HA VAL 41 5.382 6.271 5.247 273 HB VAL 41 HB VAL 41 4.657 6.189 2.953 274 HG11 VAL 41 HG11 VAL 41 6.988 8.073 3.237 275 HG12 VAL 41 HG12 VAL 41 5.354 8.348 3.839 276 HG13 VAL 41 HG13 VAL 41 5.646 8.241 2.105 277 HG21 VAL 41 HG21 VAL 41 7.552 5.837 2.184 278 HG22 VAL 41 HG22 VAL 41 6.192 6.034 1.075 279 HG23 VAL 41 HG23 VAL 41 6.301 4.596 2.090 280 H LEU 42 HN LEU 42 3.872 4.602 4.765 281 HA LEU 42 HA LEU 42 5.005 1.937 4.959 282 HB2 LEU 42 HB2 LEU 42 2.143 2.900 5.016 283 HB3 LEU 42 HB1 LEU 42 2.634 1.231 5.227 284 HG LEU 42 HG LEU 42 3.356 3.509 7.074 285 HD11 LEU 42 HD11 LEU 42 0.992 2.942 7.188 286 HD12 LEU 42 HD12 LEU 42 1.835 2.412 8.643 287 HD13 LEU 42 HD13 LEU 42 1.397 1.240 7.400 288 HD21 LEU 42 HD21 LEU 42 4.135 1.675 8.552 289 HD22 LEU 42 HD22 LEU 42 5.086 1.845 7.078 290 HD23 LEU 42 HD23 LEU 42 3.900 0.548 7.215 291 H ILE 43 HN ILE 43 5.202 0.583 3.311 292 HA ILE 43 HA ILE 43 3.817 1.280 0.823 293 HB ILE 43 HB ILE 43 5.471 -0.346 -0.252 294 HG12 ILE 43 HG12 ILE 43 7.065 0.267 2.239 295 HG13 ILE 43 HG11 ILE 43 6.287 -1.279 1.928 296 HG21 ILE 43 HG21 ILE 43 6.446 2.269 0.888 297 HG22 ILE 43 HG22 ILE 43 5.530 2.051 -0.603 298 HG23 ILE 43 HG23 ILE 43 7.169 1.415 -0.474 299 HD11 ILE 43 HD11 ILE 43 8.384 -0.032 0.170 300 HD12 ILE 43 HD12 ILE 43 7.669 -1.635 -0.008 301 HD13 ILE 43 HD13 ILE 43 8.686 -1.272 1.387 302 H GLY 44 HN GLY 44 2.435 -0.079 -0.080 303 HA2 GLY 44 HA2 GLY 44 1.787 -2.468 1.502 304 HA3 GLY 44 HA1 GLY 44 0.643 -1.547 0.554 305 H ASP 45 HN ASP 45 2.948 -4.055 0.565 306 HA ASP 45 HA ASP 45 2.977 -4.438 -2.286 307 HB2 ASP 45 HB2 ASP 45 4.897 -5.180 -1.006 308 HB3 ASP 45 HB1 ASP 45 3.877 -6.210 -0.008 309 H GLY 46 HN GLY 46 1.726 -5.819 -3.471 310 HA2 GLY 46 HA2 GLY 46 -0.015 -7.253 -3.967 311 HA3 GLY 46 HA1 GLY 46 0.030 -7.777 -2.310 312 H CYS 47 HN CYS 47 -0.544 -4.534 -3.600 313 HA CYS 47 HA CYS 47 -3.008 -4.479 -2.006 314 HB2 CYS 47 HB2 CYS 47 -0.868 -2.755 -1.989 315 HB3 CYS 47 HB1 CYS 47 -2.024 -1.928 -3.034 316 H ASP 48 HN ASP 48 -4.722 -4.871 -3.158 317 HA ASP 48 HA ASP 48 -4.917 -3.761 -5.860 318 HB2 ASP 48 HB2 ASP 48 -5.465 -5.992 -6.009 319 HB3 ASP 48 HB1 ASP 48 -6.332 -6.004 -4.481 320 HA PRO 49 HA PRO 49 -7.541 -0.448 -4.611 321 HB2 PRO 49 HB2 PRO 49 -8.819 -0.834 -7.244 322 HB3 PRO 49 HB1 PRO 49 -7.989 0.577 -6.598 323 HG2 PRO 49 HG2 PRO 49 -6.908 -0.972 -8.515 324 HG3 PRO 49 HG1 PRO 49 -5.929 -0.132 -7.300 325 HD2 PRO 49 HD2 PRO 49 -6.656 -3.017 -7.480 326 HD3 PRO 49 HD1 PRO 49 -5.189 -2.250 -6.854 327 H ILE 50 HN ILE 50 -9.225 -0.732 -3.267 328 HA ILE 50 HA ILE 50 -10.992 -2.987 -3.601 329 HB ILE 50 HB ILE 50 -11.235 -0.805 -1.528 330 HG12 ILE 50 HG12 ILE 50 -9.692 -3.404 -1.367 331 HG13 ILE 50 HG11 ILE 50 -8.980 -1.799 -1.465 332 HG21 ILE 50 HG21 ILE 50 -13.184 -2.275 -1.821 333 HG22 ILE 50 HG22 ILE 50 -12.413 -2.506 -0.251 334 HG23 ILE 50 HG23 ILE 50 -12.150 -3.679 -1.542 335 HD11 ILE 50 HD11 ILE 50 -10.055 -1.236 0.686 336 HD12 ILE 50 HD12 ILE 50 -8.911 -2.571 0.804 337 HD13 ILE 50 HD13 ILE 50 -10.645 -2.896 0.787 338 H THR 51 HN THR 51 -12.396 -2.758 -5.218 339 HA THR 51 HA THR 51 -14.253 -0.490 -5.055 340 HB THR 51 HB THR 51 -12.724 0.003 -6.879 341 HG1 THR 51 HG1 THR 51 -15.392 -0.666 -7.454 342 HG21 THR 51 HG21 THR 51 -13.558 -2.665 -8.016 343 HG22 THR 51 HG22 THR 51 -11.956 -2.237 -7.413 344 HG23 THR 51 HG23 THR 51 -12.592 -1.455 -8.863 345 H VAL 52 HN VAL 52 -14.125 -3.488 -4.407 346 HA VAL 52 HA VAL 52 -16.728 -4.134 -5.593 347 HB VAL 52 HB VAL 52 -14.749 -5.481 -6.504 348 HG11 VAL 52 HG11 VAL 52 -13.569 -5.801 -4.387 349 HG12 VAL 52 HG12 VAL 52 -13.970 -7.345 -5.139 350 HG13 VAL 52 HG13 VAL 52 -14.922 -6.754 -3.775 351 HG21 VAL 52 HG21 VAL 52 -17.021 -6.950 -5.195 352 HG22 VAL 52 HG22 VAL 52 -16.022 -7.555 -6.517 353 HG23 VAL 52 HG23 VAL 52 -17.065 -6.156 -6.767 354 H ALA 53 HN ALA 53 -18.127 -5.354 -4.235 355 HA ALA 53 HA ALA 53 -19.053 -6.181 -2.347 356 HB1 ALA 53 HB1 ALA 53 -17.672 -6.990 -0.522 357 HB2 ALA 53 HB2 ALA 53 -16.271 -6.160 -1.198 358 HB3 ALA 53 HB3 ALA 53 -17.018 -7.493 -2.080 359 H GLY 54 HN GLY 54 -16.518 -3.944 -1.188 360 HA2 GLY 54 HA2 GLY 54 -18.204 -1.850 -0.474 361 HA3 GLY 54 HA1 GLY 54 -18.120 -2.920 0.918 362 H SER 55 HN SER 55 -16.582 -2.472 2.339 363 HA SER 55 HA SER 55 -13.959 -1.645 1.423 364 HB2 SER 55 HB2 SER 55 -15.608 0.101 3.264 365 HB3 SER 55 HB1 SER 55 -13.884 0.312 2.964 366 HG SER 55 HG SER 55 -15.243 0.120 0.639 367 H SER 56 HN SER 56 -16.086 -2.491 4.118 368 HA SER 56 HA SER 56 -13.861 -3.113 5.843 369 HB2 SER 56 HB2 SER 56 -16.797 -3.742 6.182 370 HB3 SER 56 HB1 SER 56 -15.560 -3.855 7.430 371 HG SER 56 HG SER 56 -15.343 -1.438 6.497 372 H ASP 57 HN ASP 57 -16.522 -5.083 4.509 373 HA ASP 57 HA ASP 57 -14.909 -7.486 4.852 374 HB2 ASP 57 HB2 ASP 57 -17.338 -7.412 5.508 375 HB3 ASP 57 HB1 ASP 57 -17.740 -7.244 3.803 376 H ALA 58 HN ALA 58 -13.874 -5.718 3.042 377 HA ALA 58 HA ALA 58 -14.220 -7.162 0.503 378 HB1 ALA 58 HB1 ALA 58 -15.326 -4.974 0.360 379 HB2 ALA 58 HB2 ALA 58 -13.938 -5.082 -0.723 380 HB3 ALA 58 HB3 ALA 58 -13.807 -4.187 0.792 381 H CYS 59 HN CYS 59 -12.290 -7.113 2.868 382 HA CYS 59 HA CYS 59 -9.891 -7.305 1.262 383 HB2 CYS 59 HB2 CYS 59 -9.870 -4.948 1.982 384 HB3 CYS 59 HB1 CYS 59 -10.025 -5.460 3.660 385 H SER 60 HN SER 60 -8.763 -9.029 1.897 386 HA SER 60 HA SER 60 -9.608 -10.356 4.343 387 HB2 SER 60 HB2 SER 60 -9.589 -11.634 2.225 388 HB3 SER 60 HB1 SER 60 -7.851 -11.383 2.120 389 HG SER 60 HG SER 60 -9.264 -13.185 3.598 390 H ALA 61 HN ALA 61 -6.722 -8.983 2.855 391 HA ALA 61 HA ALA 61 -5.060 -9.916 5.034 392 HB1 ALA 61 HB1 ALA 61 -4.162 -9.970 2.762 393 HB2 ALA 61 HB2 ALA 61 -3.194 -8.935 3.809 394 HB3 ALA 61 HB3 ALA 61 -4.315 -8.217 2.656 395 H THR 62 HN THR 62 -4.812 -6.659 3.643 396 HA THR 62 HA THR 62 -5.630 -5.460 6.170 397 HB THR 62 HB THR 62 -2.870 -4.925 5.058 398 HG1 THR 62 HG1 THR 62 -3.802 -6.779 6.953 399 HG21 THR 62 HG21 THR 62 -2.515 -3.797 7.210 400 HG22 THR 62 HG22 THR 62 -4.182 -4.146 7.665 401 HG23 THR 62 HG23 THR 62 -3.845 -3.065 6.312 402 H ALA 63 HN ALA 63 -6.582 -3.516 5.843 403 HA ALA 63 HA ALA 63 -6.642 -2.492 3.109 404 HB1 ALA 63 HB1 ALA 63 -8.387 -1.673 5.426 405 HB2 ALA 63 HB2 ALA 63 -8.779 -2.985 4.312 406 HB3 ALA 63 HB3 ALA 63 -8.644 -1.330 3.716 407 H VAL 64 HN VAL 64 -6.009 -0.455 2.572 408 HA VAL 64 HA VAL 64 -5.026 1.326 4.672 409 HB VAL 64 HB VAL 64 -2.907 1.670 3.324 410 HG11 VAL 64 HG11 VAL 64 -3.355 -0.960 4.727 411 HG12 VAL 64 HG12 VAL 64 -2.770 0.547 5.436 412 HG13 VAL 64 HG13 VAL 64 -1.770 -0.329 4.279 413 HG21 VAL 64 HG21 VAL 64 -2.195 -0.161 1.892 414 HG22 VAL 64 HG22 VAL 64 -3.693 0.560 1.293 415 HG23 VAL 64 HG23 VAL 64 -3.738 -0.979 2.162 416 H CYS 65 HN CYS 65 -4.472 3.435 3.866 417 HA CYS 65 HA CYS 65 -5.829 4.139 1.348 418 HB2 CYS 65 HB2 CYS 65 -6.958 5.149 3.230 419 HB3 CYS 65 HB1 CYS 65 -5.436 5.717 3.900 420 H CYS 66 HN CYS 66 -4.312 4.384 -0.199 421 HA CYS 66 HA CYS 66 -1.674 5.413 0.581 422 HB2 CYS 66 HB2 CYS 66 -2.473 4.140 -2.035 423 HB3 CYS 66 HB1 CYS 66 -0.838 4.435 -1.446 424 H SER 67 HN SER 67 -0.789 7.207 -0.257 425 HA SER 67 HA SER 67 -2.575 8.993 -1.715 426 HB2 SER 67 HB2 SER 67 0.050 9.540 -0.331 427 HB3 SER 67 HB1 SER 67 -1.027 10.761 -1.011 428 HG SER 67 HG SER 67 -2.619 10.075 0.496 429 H ASP 68 HN ASP 68 0.181 7.054 -2.191 430 HA ASP 68 HA ASP 68 0.887 8.515 -4.647 431 HB2 ASP 68 HB2 ASP 68 2.694 8.350 -2.964 432 HB3 ASP 68 HB1 ASP 68 2.581 6.596 -3.034 433 H ASN 69 HN ASN 69 0.991 7.426 -6.587 434 HA ASN 69 HA ASN 69 -0.163 4.714 -6.534 435 HB2 ASN 69 HB2 ASN 69 -0.689 7.007 -8.414 436 HB3 ASN 69 HB1 ASN 69 -1.121 5.350 -8.814 437 HD21 ASN 69 HD21 ASN 69 -1.813 8.087 -6.791 438 HD22 ASN 69 HD22 ASN 69 -3.325 7.508 -6.178 439 H ASN 70 HN ASN 70 2.715 5.590 -6.686 440 HA ASN 70 HA ASN 70 3.526 4.809 -9.354 441 HB2 ASN 70 HB2 ASN 70 4.856 6.410 -8.006 442 HB3 ASN 70 HB1 ASN 70 5.191 5.132 -6.847 443 HD21 ASN 70 HD21 ASN 70 7.395 5.291 -7.158 444 HD22 ASN 70 HD22 ASN 70 8.170 4.718 -8.592 445 H VAL 71 HN VAL 71 2.261 2.808 -9.257 446 HA VAL 71 HA VAL 71 3.079 0.771 -7.399 447 HB VAL 71 HB VAL 71 1.310 -0.569 -8.409 448 HG11 VAL 71 HG11 VAL 71 0.444 2.266 -7.868 449 HG12 VAL 71 HG12 VAL 71 0.754 1.033 -6.645 450 HG13 VAL 71 HG13 VAL 71 -0.581 0.834 -7.781 451 HG21 VAL 71 HG21 VAL 71 -0.120 0.340 -10.172 452 HG22 VAL 71 HG22 VAL 71 1.543 0.149 -10.732 453 HG23 VAL 71 HG23 VAL 71 0.933 1.748 -10.301 454 H SER 72 HN SER 72 4.033 -1.160 -7.871 455 HA SER 72 HA SER 72 5.580 -1.295 -10.342 456 HB2 SER 72 HB2 SER 72 6.812 -3.095 -9.169 457 HB3 SER 72 HB1 SER 72 6.753 -1.621 -8.202 458 HG SER 72 HG SER 72 5.723 -4.089 -7.673 459 H GLY 73 HN GLY 73 2.605 -2.087 -9.566 460 HA2 GLY 73 HA2 GLY 73 1.491 -3.569 -11.260 461 HA3 GLY 73 HA1 GLY 73 2.664 -4.777 -10.769 462 H VAL 74 HN VAL 74 2.556 -4.122 -7.947 463 HA VAL 74 HA VAL 74 -0.257 -4.566 -7.306 464 HB VAL 74 HB VAL 74 0.205 -6.343 -5.749 465 HG11 VAL 74 HG11 VAL 74 0.953 -8.114 -7.350 466 HG12 VAL 74 HG12 VAL 74 1.262 -6.821 -8.520 467 HG13 VAL 74 HG13 VAL 74 -0.373 -7.096 -7.913 468 HG21 VAL 74 HG21 VAL 74 2.508 -5.615 -5.183 469 HG22 VAL 74 HG22 VAL 74 3.052 -6.317 -6.703 470 HG23 VAL 74 HG23 VAL 74 2.347 -7.348 -5.459 471 H ILE 75 HN ILE 75 2.786 -3.172 -6.430 472 HA ILE 75 HA ILE 75 2.224 -2.966 -3.639 473 HB ILE 75 HB ILE 75 4.107 -1.428 -3.488 474 HG12 ILE 75 HG12 ILE 75 4.683 -1.769 -6.389 475 HG13 ILE 75 HG11 ILE 75 3.517 -0.553 -5.902 476 HG21 ILE 75 HG21 ILE 75 5.840 -2.956 -4.249 477 HG22 ILE 75 HG22 ILE 75 4.651 -3.812 -5.226 478 HG23 ILE 75 HG23 ILE 75 4.513 -3.814 -3.468 479 HD11 ILE 75 HD11 ILE 75 5.746 0.380 -6.172 480 HD12 ILE 75 HD12 ILE 75 6.354 -0.731 -4.945 481 HD13 ILE 75 HD13 ILE 75 5.185 0.514 -4.505 482 H ALA 76 HN ALA 76 2.459 -0.763 -2.618 483 HA ALA 76 HA ALA 76 1.078 1.406 -3.966 484 HB1 ALA 76 HB1 ALA 76 -0.768 0.134 -3.051 485 HB2 ALA 76 HB2 ALA 76 -0.554 1.602 -2.096 486 HB3 ALA 76 HB3 ALA 76 0.026 0.052 -1.476 487 H ILE 77 HN ILE 77 1.659 3.415 -3.044 488 HA ILE 77 HA ILE 77 3.678 3.186 -0.904 489 HB ILE 77 HB ILE 77 3.753 5.058 -3.277 490 HG12 ILE 77 HG12 ILE 77 5.499 2.688 -2.574 491 HG13 ILE 77 HG11 ILE 77 4.270 2.710 -3.833 492 HG21 ILE 77 HG21 ILE 77 5.725 4.690 -1.022 493 HG22 ILE 77 HG22 ILE 77 4.705 6.103 -1.294 494 HG23 ILE 77 HG23 ILE 77 5.975 5.697 -2.448 495 HD11 ILE 77 HD11 ILE 77 5.536 4.433 -5.017 496 HD12 ILE 77 HD12 ILE 77 6.477 2.962 -4.778 497 HD13 ILE 77 HD13 ILE 77 6.773 4.374 -3.764 498 H GLY 78 HN GLY 78 3.656 4.645 0.730 499 HA2 GLY 78 HA2 GLY 78 3.006 6.430 2.030 500 HA3 GLY 78 HA1 GLY 78 2.286 7.151 0.599 501 H CYS 79 HN CYS 79 1.688 4.202 2.513 502 HA CYS 79 HA CYS 79 -1.175 4.805 2.277 503 HB2 CYS 79 HB2 CYS 79 0.028 2.126 2.956 504 HB3 CYS 79 HB1 CYS 79 -1.599 2.483 2.403 505 H LEU 80 HN LEU 80 -2.520 4.794 3.997 506 HA LEU 80 HA LEU 80 -1.322 4.414 6.662 507 HB2 LEU 80 HB2 LEU 80 -3.683 6.119 5.867 508 HB3 LEU 80 HB1 LEU 80 -3.095 5.889 7.506 509 HG LEU 80 HG LEU 80 -1.502 7.172 5.285 510 HD11 LEU 80 HD11 LEU 80 -3.403 8.556 5.889 511 HD12 LEU 80 HD12 LEU 80 -1.903 9.268 6.485 512 HD13 LEU 80 HD13 LEU 80 -2.981 8.421 7.595 513 HD21 LEU 80 HD21 LEU 80 -0.095 6.108 6.948 514 HD22 LEU 80 HD22 LEU 80 -0.985 6.904 8.246 515 HD23 LEU 80 HD23 LEU 80 -0.016 7.861 7.125 516 HA PRO 81 HA PRO 81 -3.887 0.837 6.940 517 HB2 PRO 81 HB2 PRO 81 -3.677 1.130 9.854 518 HB3 PRO 81 HB1 PRO 81 -3.089 -0.164 8.814 519 HG2 PRO 81 HG2 PRO 81 -1.424 1.577 9.996 520 HG3 PRO 81 HG1 PRO 81 -1.090 0.887 8.398 521 HD2 PRO 81 HD2 PRO 81 -2.134 3.601 9.108 522 HD3 PRO 81 HD1 PRO 81 -0.981 3.129 7.854 523 H VAL 82 HN VAL 82 -6.014 0.637 6.822 524 HA VAL 82 HA VAL 82 -7.730 2.057 8.714 525 HB VAL 82 HB VAL 82 -9.346 2.356 6.788 526 HG11 VAL 82 HG11 VAL 82 -6.782 3.938 6.754 527 HG12 VAL 82 HG12 VAL 82 -8.190 4.253 7.768 528 HG13 VAL 82 HG13 VAL 82 -8.300 4.452 6.019 529 HG21 VAL 82 HG21 VAL 82 -6.868 1.933 5.145 530 HG22 VAL 82 HG22 VAL 82 -8.420 2.509 4.540 531 HG23 VAL 82 HG23 VAL 82 -8.279 0.876 5.188 532 H THR 83 HN THR 83 -9.827 1.057 8.944 533 HA THR 83 HA THR 83 -11.326 -0.634 9.106 534 HB THR 83 HB THR 83 -9.884 -1.581 6.643 535 HG1 THR 83 HG1 THR 83 -11.770 -0.584 5.625 536 HG21 THR 83 HG21 THR 83 -12.644 -2.351 7.592 537 HG22 THR 83 HG22 THR 83 -11.224 -3.392 7.665 538 HG23 THR 83 HG23 THR 83 -11.861 -2.884 6.102 539 H LEU 84 HN LEU 84 -11.530 -2.963 9.656 540 HA LEU 84 HA LEU 84 -10.940 -4.820 10.802 541 HB2 LEU 84 HB2 LEU 84 -8.457 -4.394 9.171 542 HB3 LEU 84 HB1 LEU 84 -8.648 -5.776 10.234 543 HG LEU 84 HG LEU 84 -10.553 -5.141 7.986 544 HD11 LEU 84 HD11 LEU 84 -9.413 -6.911 6.734 545 HD12 LEU 84 HD12 LEU 84 -8.198 -7.021 8.008 546 HD13 LEU 84 HD13 LEU 84 -8.348 -5.543 7.056 547 HD21 LEU 84 HD21 LEU 84 -11.479 -6.535 9.745 548 HD22 LEU 84 HD22 LEU 84 -10.095 -7.620 9.637 549 HD23 LEU 84 HD23 LEU 84 -11.216 -7.480 8.284 Start of MODEL 19 1 H1 GLY 1 HT1 GLY 1 -17.923 7.045 -10.112 2 H2 GLY 1 HT2 GLY 1 -18.447 5.449 -9.924 3 H3 GLY 1 HT3 GLY 1 -18.040 6.028 -11.459 4 HA2 GLY 1 HA1 GLY 1 -16.289 4.620 -10.589 5 HA3 GLY 1 HA2 GLY 1 -15.742 6.276 -10.810 6 H SER 2 HN SER 2 -15.945 3.703 -8.670 7 HA SER 2 HA SER 2 -15.281 5.484 -6.425 8 HB2 SER 2 HB2 SER 2 -17.523 4.467 -6.114 9 HB3 SER 2 HB1 SER 2 -16.795 2.866 -6.238 10 HG SER 2 HG SER 2 -17.148 4.059 -4.055 11 H TRP 3 HN TRP 3 -13.551 4.945 -5.220 12 HA TRP 3 HA TRP 3 -12.237 2.373 -5.665 13 HB2 TRP 3 HB2 TRP 3 -10.025 3.545 -5.784 14 HB3 TRP 3 HB1 TRP 3 -11.064 3.842 -7.171 15 HD1 TRP 3 HD1 TRP 3 -9.531 5.597 -4.153 16 HE1 TRP 3 HE1 TRP 3 -9.754 8.148 -4.472 17 HE3 TRP 3 HE3 TRP 3 -12.511 5.616 -8.288 18 HZ2 TRP 3 HZ2 TRP 3 -11.033 9.924 -6.257 19 HZ3 TRP 3 HZ3 TRP 3 -13.195 7.779 -9.246 20 HH2 TRP 3 HH2 TRP 3 -12.470 9.888 -8.248 21 H GLY 4 HN GLY 4 -13.871 3.380 -3.562 22 HA2 GLY 4 HA2 GLY 4 -13.756 3.028 -1.245 23 HA3 GLY 4 HA1 GLY 4 -12.006 3.143 -1.336 24 H GLN 5 HN GLN 5 -14.187 4.540 0.295 25 HA GLN 5 HA GLN 5 -13.916 7.293 -0.521 26 HB2 GLN 5 HB2 GLN 5 -16.049 6.580 0.350 27 HB3 GLN 5 HB1 GLN 5 -15.294 5.950 1.805 28 HG2 GLN 5 HG2 GLN 5 -14.579 8.257 2.340 29 HG3 GLN 5 HG1 GLN 5 -15.555 8.824 0.987 30 HE21 GLN 5 HE21 GLN 5 -16.434 6.167 3.096 31 HE22 GLN 5 HE22 GLN 5 -17.780 6.957 3.842 32 H CYS 6 HN CYS 6 -12.008 8.218 -0.118 33 HA CYS 6 HA CYS 6 -11.078 8.320 2.624 34 HB2 CYS 6 HB2 CYS 6 -9.877 6.363 1.656 35 HB3 CYS 6 HB1 CYS 6 -9.222 7.423 0.408 36 H SER 7 HN SER 7 -10.029 10.226 3.083 37 HA SER 7 HA SER 7 -10.279 12.243 0.996 38 HB2 SER 7 HB2 SER 7 -9.622 12.588 3.928 39 HB3 SER 7 HB1 SER 7 -10.086 13.860 2.796 40 HG SER 7 HG SER 7 -11.856 11.769 2.881 41 H THR 8 HN THR 8 -7.837 10.360 2.455 42 HA THR 8 HA THR 8 -5.774 12.321 1.780 43 HB THR 8 HB THR 8 -4.273 10.551 2.946 44 HG1 THR 8 HG1 THR 8 -5.539 8.842 3.327 45 HG21 THR 8 HG21 THR 8 -4.734 12.745 3.876 46 HG22 THR 8 HG22 THR 8 -4.807 11.524 5.147 47 HG23 THR 8 HG23 THR 8 -6.296 12.186 4.474 48 H GLY 9 HN GLY 9 -7.326 9.998 0.137 49 HA2 GLY 9 HA2 GLY 9 -5.935 9.964 -2.116 50 HA3 GLY 9 HA1 GLY 9 -4.964 8.865 -1.150 51 H SER 10 HN SER 10 -5.422 7.245 -2.718 52 HA SER 10 HA SER 10 -8.127 6.311 -3.041 53 HB2 SER 10 HB2 SER 10 -6.869 4.516 -4.374 54 HB3 SER 10 HB1 SER 10 -6.795 6.160 -4.994 55 HG SER 10 HG SER 10 -4.826 5.052 -3.275 56 H ILE 11 HN ILE 11 -8.855 4.209 -2.378 57 HA ILE 11 HA ILE 11 -7.306 3.130 -0.137 58 HB ILE 11 HB ILE 11 -10.204 2.695 -0.841 59 HG12 ILE 11 HG12 ILE 11 -8.799 4.197 1.362 60 HG13 ILE 11 HG11 ILE 11 -9.819 4.865 0.099 61 HG21 ILE 11 HG21 ILE 11 -9.201 0.675 0.137 62 HG22 ILE 11 HG22 ILE 11 -10.370 1.426 1.226 63 HG23 ILE 11 HG23 ILE 11 -8.641 1.632 1.509 64 HD11 ILE 11 HD11 ILE 11 -10.963 4.768 2.254 65 HD12 ILE 11 HD12 ILE 11 -10.736 3.020 2.283 66 HD13 ILE 11 HD13 ILE 11 -11.754 3.757 1.046 67 H GLN 12 HN GLN 12 -6.484 1.217 -0.138 68 HA GLN 12 HA GLN 12 -7.272 -0.744 -2.148 69 HB2 GLN 12 HB2 GLN 12 -4.637 -1.284 -2.131 70 HB3 GLN 12 HB1 GLN 12 -5.413 -0.294 -3.349 71 HG2 GLN 12 HG2 GLN 12 -4.279 0.969 -0.906 72 HG3 GLN 12 HG1 GLN 12 -3.217 0.471 -2.211 73 HE21 GLN 12 HE21 GLN 12 -5.013 1.063 -4.355 74 HE22 GLN 12 HE22 GLN 12 -5.121 2.774 -4.474 75 H CYS 13 HN CYS 13 -6.542 -2.927 -1.607 76 HA CYS 13 HA CYS 13 -6.250 -3.217 1.304 77 HB2 CYS 13 HB2 CYS 13 -8.340 -4.171 0.520 78 HB3 CYS 13 HB1 CYS 13 -7.501 -5.114 -0.704 79 H CYS 14 HN CYS 14 -4.251 -3.605 1.840 80 HA CYS 14 HA CYS 14 -2.412 -4.758 -0.094 81 HB2 CYS 14 HB2 CYS 14 -2.002 -3.416 2.567 82 HB3 CYS 14 HB1 CYS 14 -0.695 -4.157 1.652 83 H GLN 15 HN GLN 15 -1.713 -6.734 -0.046 84 HA GLN 15 HA GLN 15 -2.459 -8.586 1.953 85 HB2 GLN 15 HB2 GLN 15 -2.029 -9.965 0.250 86 HB3 GLN 15 HB1 GLN 15 -1.353 -8.631 -0.657 87 HG2 GLN 15 HG2 GLN 15 0.271 -10.320 -0.661 88 HG3 GLN 15 HG1 GLN 15 0.840 -9.108 0.483 89 HE21 GLN 15 HE21 GLN 15 -1.708 -11.443 1.098 90 HE22 GLN 15 HE22 GLN 15 -0.854 -12.345 2.299 91 H ASN 16 HN ASN 16 0.375 -6.651 1.314 92 HA ASN 16 HA ASN 16 1.495 -7.482 3.907 93 HB2 ASN 16 HB2 ASN 16 2.632 -8.179 1.549 94 HB3 ASN 16 HB1 ASN 16 3.357 -6.601 1.815 95 HD21 ASN 16 HD21 ASN 16 4.540 -9.268 1.819 96 HD22 ASN 16 HD22 ASN 16 5.317 -9.427 3.359 97 H VAL 17 HN VAL 17 1.466 -5.750 5.210 98 HA VAL 17 HA VAL 17 1.873 -3.096 3.997 99 HB VAL 17 HB VAL 17 0.498 -3.756 6.614 100 HG11 VAL 17 HG11 VAL 17 1.704 -1.634 6.732 101 HG12 VAL 17 HG12 VAL 17 -0.038 -1.367 6.705 102 HG13 VAL 17 HG13 VAL 17 0.919 -1.094 5.249 103 HG21 VAL 17 HG21 VAL 17 -0.599 -2.725 4.001 104 HG22 VAL 17 HG22 VAL 17 -1.518 -2.928 5.492 105 HG23 VAL 17 HG23 VAL 17 -0.847 -4.337 4.671 106 H VAL 18 HN VAL 18 3.961 -2.630 4.134 107 HA VAL 18 HA VAL 18 5.331 -3.082 6.700 108 HB VAL 18 HB VAL 18 7.399 -3.645 5.401 109 HG11 VAL 18 HG11 VAL 18 6.747 -5.959 4.927 110 HG12 VAL 18 HG12 VAL 18 5.047 -5.497 5.023 111 HG13 VAL 18 HG13 VAL 18 6.071 -5.394 6.455 112 HG21 VAL 18 HG21 VAL 18 6.740 -2.678 3.253 113 HG22 VAL 18 HG22 VAL 18 5.469 -3.891 3.092 114 HG23 VAL 18 HG23 VAL 18 7.163 -4.381 3.081 115 HA PRO 19 HA PRO 19 6.768 1.137 6.233 116 HB2 PRO 19 HB2 PRO 19 9.115 0.189 7.745 117 HB3 PRO 19 HB1 PRO 19 7.998 1.503 8.118 118 HG2 PRO 19 HG2 PRO 19 7.942 -0.793 9.491 119 HG3 PRO 19 HG1 PRO 19 6.456 0.096 9.110 120 HD2 PRO 19 HD2 PRO 19 7.581 -2.359 7.821 121 HD3 PRO 19 HD1 PRO 19 5.894 -1.948 8.191 122 H GLY 20 HN GLY 20 8.096 2.158 4.809 123 HA2 GLY 20 HA2 GLY 20 9.416 0.604 2.848 124 HA3 GLY 20 HA1 GLY 20 9.491 2.352 2.997 125 H ASP 21 HN ASP 21 10.537 2.087 5.790 126 HA ASP 21 HA ASP 21 13.326 1.541 5.074 127 HB2 ASP 21 HB2 ASP 21 13.942 2.841 6.993 128 HB3 ASP 21 HB1 ASP 21 12.678 3.730 6.154 129 H SER 22 HN SER 22 10.884 -0.218 6.092 130 HA SER 22 HA SER 22 12.003 -1.610 8.328 131 HB2 SER 22 HB2 SER 22 9.612 -1.651 8.037 132 HB3 SER 22 HB1 SER 22 9.763 -2.269 6.399 133 HG SER 22 HG SER 22 10.284 -3.596 8.847 134 H ASP 23 HN ASP 23 12.805 -3.781 8.275 135 HA ASP 23 HA ASP 23 14.739 -4.256 6.294 136 HB2 ASP 23 HB2 ASP 23 13.592 -5.833 8.543 137 HB3 ASP 23 HB1 ASP 23 14.467 -6.722 7.303 138 H LEU 24 HN LEU 24 11.420 -5.314 6.616 139 HA LEU 24 HA LEU 24 11.449 -6.996 4.317 140 HB2 LEU 24 HB2 LEU 24 9.478 -5.986 6.219 141 HB3 LEU 24 HB1 LEU 24 8.853 -6.121 4.588 142 HG LEU 24 HG LEU 24 8.391 -8.119 5.911 143 HD11 LEU 24 HD11 LEU 24 9.142 -9.748 4.300 144 HD12 LEU 24 HD12 LEU 24 10.413 -8.662 3.743 145 HD13 LEU 24 HD13 LEU 24 8.722 -8.254 3.460 146 HD21 LEU 24 HD21 LEU 24 10.214 -9.610 6.578 147 HD22 LEU 24 HD22 LEU 24 10.312 -8.054 7.400 148 HD23 LEU 24 HD23 LEU 24 11.389 -8.406 6.049 149 H GLY 25 HN GLY 25 9.959 -3.811 4.858 150 HA2 GLY 25 HA2 GLY 25 9.132 -3.374 2.249 151 HA3 GLY 25 HA1 GLY 25 9.431 -2.108 3.426 152 H THR 26 HN THR 26 12.250 -2.610 3.710 153 HA THR 26 HA THR 26 13.133 -0.938 1.593 154 HB THR 26 HB THR 26 14.763 -2.432 3.650 155 HG1 THR 26 HG1 THR 26 13.237 -0.124 3.716 156 HG21 THR 26 HG21 THR 26 16.518 -0.827 3.197 157 HG22 THR 26 HG22 THR 26 15.515 -0.030 1.986 158 HG23 THR 26 HG23 THR 26 16.093 -1.675 1.709 159 H LEU 27 HN LEU 27 13.682 -4.348 2.389 160 HA LEU 27 HA LEU 27 15.342 -4.914 0.176 161 HB2 LEU 27 HB2 LEU 27 14.971 -6.301 2.289 162 HB3 LEU 27 HB1 LEU 27 13.484 -6.853 1.552 163 HG LEU 27 HG LEU 27 15.463 -8.415 1.387 164 HD11 LEU 27 HD11 LEU 27 13.511 -8.672 -0.047 165 HD12 LEU 27 HD12 LEU 27 14.995 -9.089 -0.904 166 HD13 LEU 27 HD13 LEU 27 14.207 -7.540 -1.205 167 HD21 LEU 27 HD21 LEU 27 17.129 -7.975 -0.312 168 HD22 LEU 27 HD22 LEU 27 17.157 -6.708 0.915 169 HD23 LEU 27 HD23 LEU 27 16.401 -6.406 -0.650 170 H LEU 28 HN LEU 28 11.868 -4.857 0.666 171 HA LEU 28 HA LEU 28 11.147 -6.166 -1.734 172 HB2 LEU 28 HB2 LEU 28 9.559 -4.134 -0.163 173 HB3 LEU 28 HB1 LEU 28 8.921 -5.217 -1.381 174 HG LEU 28 HG LEU 28 9.870 -5.878 1.392 175 HD11 LEU 28 HD11 LEU 28 7.323 -6.453 -0.106 176 HD12 LEU 28 HD12 LEU 28 7.550 -5.215 1.127 177 HD13 LEU 28 HD13 LEU 28 7.675 -6.921 1.557 178 HD21 LEU 28 HD21 LEU 28 10.930 -7.505 -0.032 179 HD22 LEU 28 HD22 LEU 28 9.406 -7.817 -0.866 180 HD23 LEU 28 HD23 LEU 28 9.587 -8.252 0.833 181 H LEU 29 HN LEU 29 11.411 -2.715 -0.890 182 HA LEU 29 HA LEU 29 10.656 -1.914 -3.532 183 HB2 LEU 29 HB2 LEU 29 11.116 0.356 -2.788 184 HB3 LEU 29 HB1 LEU 29 10.093 -0.497 -1.665 185 HG LEU 29 HG LEU 29 12.235 -0.876 -0.289 186 HD11 LEU 29 HD11 LEU 29 13.856 -0.214 -1.996 187 HD12 LEU 29 HD12 LEU 29 13.971 0.815 -0.568 188 HD13 LEU 29 HD13 LEU 29 13.170 1.411 -2.022 189 HD21 LEU 29 HD21 LEU 29 10.464 0.576 0.428 190 HD22 LEU 29 HD22 LEU 29 11.019 1.849 -0.659 191 HD23 LEU 29 HD23 LEU 29 12.010 1.373 0.723 192 H ASP 30 HN ASP 30 13.645 -2.683 -2.008 193 HA ASP 30 HA ASP 30 15.372 -1.367 -3.825 194 HB2 ASP 30 HB2 ASP 30 16.092 -2.405 -1.657 195 HB3 ASP 30 HB1 ASP 30 15.898 -3.984 -2.404 196 H GLU 31 HN GLU 31 13.657 -4.392 -3.865 197 HA GLU 31 HA GLU 31 14.876 -5.476 -6.195 198 HB2 GLU 31 HB2 GLU 31 13.516 -6.599 -4.263 199 HB3 GLU 31 HB1 GLU 31 12.115 -6.148 -5.225 200 HG2 GLU 31 HG2 GLU 31 13.019 -7.407 -7.110 201 HG3 GLU 31 HG1 GLU 31 14.398 -7.853 -6.108 202 H LEU 32 HN LEU 32 12.534 -3.143 -5.521 203 HA LEU 32 HA LEU 32 11.241 -3.306 -8.131 204 HB2 LEU 32 HB2 LEU 32 10.652 -1.736 -5.632 205 HB3 LEU 32 HB1 LEU 32 9.693 -1.631 -7.097 206 HG LEU 32 HG LEU 32 10.075 -4.116 -5.424 207 HD11 LEU 32 HD11 LEU 32 7.696 -2.292 -5.712 208 HD12 LEU 32 HD12 LEU 32 8.729 -2.438 -4.290 209 HD13 LEU 32 HD13 LEU 32 7.738 -3.803 -4.804 210 HD21 LEU 32 HD21 LEU 32 8.311 -3.602 -7.813 211 HD22 LEU 32 HD22 LEU 32 8.313 -5.064 -6.828 212 HD23 LEU 32 HD23 LEU 32 9.736 -4.637 -7.775 213 H GLY 33 HN GLY 33 13.595 -1.502 -6.415 214 HA2 GLY 33 HA2 GLY 33 15.050 0.107 -7.221 215 HA3 GLY 33 HA1 GLY 33 14.142 0.131 -8.724 216 H ILE 34 HN ILE 34 12.518 0.571 -5.674 217 HA ILE 34 HA ILE 34 11.504 3.103 -6.606 218 HB ILE 34 HB ILE 34 11.026 1.872 -3.889 219 HG12 ILE 34 HG12 ILE 34 9.416 1.465 -6.431 220 HG13 ILE 34 HG11 ILE 34 10.471 0.261 -5.698 221 HG21 ILE 34 HG21 ILE 34 10.379 4.215 -4.125 222 HG22 ILE 34 HG22 ILE 34 8.965 3.176 -3.947 223 HG23 ILE 34 HG23 ILE 34 9.401 3.808 -5.535 224 HD11 ILE 34 HD11 ILE 34 8.158 -0.166 -5.154 225 HD12 ILE 34 HD12 ILE 34 8.004 1.445 -4.455 226 HD13 ILE 34 HD13 ILE 34 9.063 0.254 -3.701 227 H VAL 35 HN VAL 35 12.125 5.081 -6.019 228 HA VAL 35 HA VAL 35 14.102 5.332 -3.850 229 HB VAL 35 HB VAL 35 13.669 7.256 -6.143 230 HG11 VAL 35 HG11 VAL 35 15.763 8.256 -5.380 231 HG12 VAL 35 HG12 VAL 35 15.848 7.080 -4.066 232 HG13 VAL 35 HG13 VAL 35 14.546 8.269 -4.099 233 HG21 VAL 35 HG21 VAL 35 14.555 5.151 -6.988 234 HG22 VAL 35 HG22 VAL 35 15.831 5.183 -5.771 235 HG23 VAL 35 HG23 VAL 35 15.792 6.406 -7.041 236 H LEU 36 HN LEU 36 12.803 5.725 -2.120 237 HA LEU 36 HA LEU 36 10.694 7.728 -2.317 238 HB2 LEU 36 HB2 LEU 36 11.540 5.957 -0.031 239 HB3 LEU 36 HB1 LEU 36 10.141 7.010 -0.033 240 HG LEU 36 HG LEU 36 10.427 4.855 -2.094 241 HD11 LEU 36 HD11 LEU 36 10.740 3.802 0.070 242 HD12 LEU 36 HD12 LEU 36 9.178 3.371 -0.627 243 HD13 LEU 36 HD13 LEU 36 9.266 4.565 0.669 244 HD21 LEU 36 HD21 LEU 36 8.718 6.553 -2.430 245 HD22 LEU 36 HD22 LEU 36 8.076 6.243 -0.818 246 HD23 LEU 36 HD23 LEU 36 7.982 4.994 -2.060 247 H GLU 37 HN GLU 37 10.791 9.699 -1.408 248 HA GLU 37 HA GLU 37 13.297 10.660 -0.374 249 HB2 GLU 37 HB2 GLU 37 10.596 12.015 -0.529 250 HB3 GLU 37 HB1 GLU 37 12.121 12.810 -0.160 251 HG2 GLU 37 HG2 GLU 37 11.393 11.468 -2.754 252 HG3 GLU 37 HG1 GLU 37 11.483 13.204 -2.457 253 H ASP 38 HN ASP 38 10.348 9.415 0.865 254 HA ASP 38 HA ASP 38 11.369 9.721 3.589 255 HB2 ASP 38 HB2 ASP 38 8.492 10.075 2.708 256 HB3 ASP 38 HB1 ASP 38 9.018 9.965 4.382 257 HA PRO 39 HA PRO 39 10.567 5.309 2.699 258 HB2 PRO 39 HB2 PRO 39 12.528 4.344 4.292 259 HB3 PRO 39 HB1 PRO 39 12.846 4.939 2.661 260 HG2 PRO 39 HG2 PRO 39 13.247 6.313 5.288 261 HG3 PRO 39 HG1 PRO 39 14.304 6.287 3.865 262 HD2 PRO 39 HD2 PRO 39 12.648 8.367 4.459 263 HD3 PRO 39 HD1 PRO 39 13.117 7.943 2.801 264 H THR 40 HN THR 40 9.902 7.330 5.108 265 HA THR 40 HA THR 40 9.449 5.454 7.262 266 HB THR 40 HB THR 40 8.350 7.494 8.333 267 HG1 THR 40 HG1 THR 40 9.488 9.384 6.941 268 HG21 THR 40 HG21 THR 40 10.643 6.818 8.843 269 HG22 THR 40 HG22 THR 40 10.510 8.574 8.788 270 HG23 THR 40 HG23 THR 40 11.228 7.702 7.435 271 H VAL 41 HN VAL 41 7.855 6.299 4.461 272 HA VAL 41 HA VAL 41 5.165 6.148 5.455 273 HB VAL 41 HB VAL 41 4.469 6.138 3.121 274 HG11 VAL 41 HG11 VAL 41 6.644 8.149 3.662 275 HG12 VAL 41 HG12 VAL 41 4.963 8.267 4.184 276 HG13 VAL 41 HG13 VAL 41 5.359 8.314 2.466 277 HG21 VAL 41 HG21 VAL 41 7.405 6.046 2.444 278 HG22 VAL 41 HG22 VAL 41 6.080 6.251 1.298 279 HG23 VAL 41 HG23 VAL 41 6.246 4.741 2.192 280 H LEU 42 HN LEU 42 3.691 4.494 5.091 281 HA LEU 42 HA LEU 42 4.812 1.839 5.128 282 HB2 LEU 42 HB2 LEU 42 1.956 2.815 5.241 283 HB3 LEU 42 HB1 LEU 42 2.430 1.134 5.387 284 HG LEU 42 HG LEU 42 3.259 3.322 7.297 285 HD11 LEU 42 HD11 LEU 42 0.857 2.886 7.424 286 HD12 LEU 42 HD12 LEU 42 1.690 2.284 8.858 287 HD13 LEU 42 HD13 LEU 42 1.176 1.159 7.600 288 HD21 LEU 42 HD21 LEU 42 3.583 0.328 7.410 289 HD22 LEU 42 HD22 LEU 42 4.021 1.460 8.690 290 HD23 LEU 42 HD23 LEU 42 4.869 1.503 7.144 291 H ILE 43 HN ILE 43 5.203 0.689 3.394 292 HA ILE 43 HA ILE 43 3.706 1.312 0.954 293 HB ILE 43 HB ILE 43 5.447 -0.154 -0.191 294 HG12 ILE 43 HG12 ILE 43 7.008 0.417 2.335 295 HG13 ILE 43 HG11 ILE 43 6.343 -1.156 1.916 296 HG21 ILE 43 HG21 ILE 43 5.385 2.240 -0.455 297 HG22 ILE 43 HG22 ILE 43 7.059 1.705 -0.319 298 HG23 ILE 43 HG23 ILE 43 6.261 2.464 1.058 299 HD11 ILE 43 HD11 ILE 43 8.388 0.358 0.309 300 HD12 ILE 43 HD12 ILE 43 7.746 -1.241 -0.063 301 HD13 ILE 43 HD13 ILE 43 8.719 -0.998 1.388 302 H GLY 44 HN GLY 44 2.399 -0.111 0.036 303 HA2 GLY 44 HA2 GLY 44 1.906 -2.541 1.614 304 HA3 GLY 44 HA1 GLY 44 0.695 -1.676 0.694 305 H ASP 45 HN ASP 45 3.085 -4.096 0.662 306 HA ASP 45 HA ASP 45 3.014 -4.490 -2.202 307 HB2 ASP 45 HB2 ASP 45 5.053 -5.121 -1.068 308 HB3 ASP 45 HB1 ASP 45 4.166 -6.154 0.048 309 H GLY 46 HN GLY 46 1.770 -5.993 -3.280 310 HA2 GLY 46 HA2 GLY 46 0.154 -7.656 -3.538 311 HA3 GLY 46 HA1 GLY 46 0.219 -7.911 -1.813 312 H CYS 47 HN CYS 47 -0.382 -4.836 -3.396 313 HA CYS 47 HA CYS 47 -2.876 -4.709 -1.860 314 HB2 CYS 47 HB2 CYS 47 -0.775 -2.956 -1.934 315 HB3 CYS 47 HB1 CYS 47 -1.905 -2.224 -3.077 316 H ASP 48 HN ASP 48 -4.673 -5.018 -2.910 317 HA ASP 48 HA ASP 48 -4.822 -4.326 -5.755 318 HB2 ASP 48 HB2 ASP 48 -6.751 -5.901 -4.046 319 HB3 ASP 48 HB1 ASP 48 -6.940 -5.591 -5.760 320 HA PRO 49 HA PRO 49 -7.053 -0.623 -4.702 321 HB2 PRO 49 HB2 PRO 49 -8.228 -0.780 -7.378 322 HB3 PRO 49 HB1 PRO 49 -7.143 0.433 -6.708 323 HG2 PRO 49 HG2 PRO 49 -6.389 -1.359 -8.605 324 HG3 PRO 49 HG1 PRO 49 -5.271 -0.644 -7.432 325 HD2 PRO 49 HD2 PRO 49 -6.478 -3.366 -7.486 326 HD3 PRO 49 HD1 PRO 49 -4.893 -2.832 -6.896 327 H ILE 50 HN ILE 50 -8.897 -0.607 -3.538 328 HA ILE 50 HA ILE 50 -10.858 -2.686 -4.005 329 HB ILE 50 HB ILE 50 -11.115 -0.485 -1.961 330 HG12 ILE 50 HG12 ILE 50 -9.663 -3.129 -1.687 331 HG13 ILE 50 HG11 ILE 50 -8.916 -1.538 -1.666 332 HG21 ILE 50 HG21 ILE 50 -12.495 -2.083 -0.806 333 HG22 ILE 50 HG22 ILE 50 -12.082 -3.340 -1.970 334 HG23 ILE 50 HG23 ILE 50 -13.060 -1.957 -2.474 335 HD11 ILE 50 HD11 ILE 50 -10.268 -1.019 0.363 336 HD12 ILE 50 HD12 ILE 50 -9.077 -2.300 0.576 337 HD13 ILE 50 HD13 ILE 50 -10.782 -2.705 0.375 338 H THR 51 HN THR 51 -11.747 -2.147 -5.934 339 HA THR 51 HA THR 51 -13.333 0.331 -5.998 340 HB THR 51 HB THR 51 -11.493 0.366 -7.637 341 HG1 THR 51 HG1 THR 51 -13.670 1.256 -8.113 342 HG21 THR 51 HG21 THR 51 -12.817 -2.084 -8.804 343 HG22 THR 51 HG22 THR 51 -11.238 -2.023 -8.019 344 HG23 THR 51 HG23 THR 51 -11.496 -1.179 -9.546 345 H VAL 52 HN VAL 52 -13.793 -2.564 -5.166 346 HA VAL 52 HA VAL 52 -15.931 -3.350 -6.969 347 HB VAL 52 HB VAL 52 -14.363 -5.069 -6.148 348 HG11 VAL 52 HG11 VAL 52 -15.520 -4.430 -3.441 349 HG12 VAL 52 HG12 VAL 52 -13.856 -4.162 -3.963 350 HG13 VAL 52 HG13 VAL 52 -14.477 -5.806 -3.803 351 HG21 VAL 52 HG21 VAL 52 -16.590 -5.747 -6.793 352 HG22 VAL 52 HG22 VAL 52 -17.191 -5.403 -5.171 353 HG23 VAL 52 HG23 VAL 52 -16.038 -6.712 -5.425 354 H ALA 53 HN ALA 53 -18.071 -3.280 -6.451 355 HA ALA 53 HA ALA 53 -18.863 -1.638 -4.227 356 HB1 ALA 53 HB1 ALA 53 -20.008 -1.444 -6.378 357 HB2 ALA 53 HB2 ALA 53 -21.132 -1.915 -5.102 358 HB3 ALA 53 HB3 ALA 53 -20.546 -3.120 -6.248 359 H GLY 54 HN GLY 54 -20.118 -2.281 -2.457 360 HA2 GLY 54 HA2 GLY 54 -20.983 -3.790 -0.906 361 HA3 GLY 54 HA1 GLY 54 -20.618 -5.104 -2.020 362 H SER 55 HN SER 55 -19.034 -2.727 0.077 363 HA SER 55 HA SER 55 -16.575 -4.209 0.116 364 HB2 SER 55 HB2 SER 55 -17.421 -1.817 1.763 365 HB3 SER 55 HB1 SER 55 -15.776 -2.424 1.580 366 HG SER 55 HG SER 55 -16.823 -2.053 -0.845 367 H SER 56 HN SER 56 -18.347 -5.999 0.966 368 HA SER 56 HA SER 56 -18.389 -6.070 3.866 369 HB2 SER 56 HB2 SER 56 -19.097 -8.339 2.010 370 HB3 SER 56 HB1 SER 56 -19.693 -8.037 3.641 371 HG SER 56 HG SER 56 -21.045 -6.539 2.902 372 H ASP 57 HN ASP 57 -17.097 -8.175 1.298 373 HA ASP 57 HA ASP 57 -14.747 -8.679 3.003 374 HB2 ASP 57 HB2 ASP 57 -16.204 -10.703 2.719 375 HB3 ASP 57 HB1 ASP 57 -15.930 -10.606 0.985 376 H ALA 58 HN ALA 58 -14.672 -6.504 1.539 377 HA ALA 58 HA ALA 58 -13.642 -7.059 -1.123 378 HB1 ALA 58 HB1 ALA 58 -14.060 -4.441 0.316 379 HB2 ALA 58 HB2 ALA 58 -15.164 -5.186 -0.840 380 HB3 ALA 58 HB3 ALA 58 -13.582 -4.623 -1.372 381 H CYS 59 HN CYS 59 -12.429 -7.043 1.920 382 HA CYS 59 HA CYS 59 -9.719 -6.758 0.873 383 HB2 CYS 59 HB2 CYS 59 -10.241 -4.626 1.994 384 HB3 CYS 59 HB1 CYS 59 -10.645 -5.506 3.466 385 H SER 60 HN SER 60 -8.681 -8.584 1.251 386 HA SER 60 HA SER 60 -9.601 -10.267 3.471 387 HB2 SER 60 HB2 SER 60 -8.179 -11.041 0.929 388 HB3 SER 60 HB1 SER 60 -8.673 -12.163 2.193 389 HG SER 60 HG SER 60 -10.803 -11.708 1.753 390 H ALA 61 HN ALA 61 -7.422 -8.057 3.335 391 HA ALA 61 HA ALA 61 -5.533 -9.606 4.925 392 HB1 ALA 61 HB1 ALA 61 -4.623 -7.849 2.653 393 HB2 ALA 61 HB2 ALA 61 -4.569 -9.611 2.684 394 HB3 ALA 61 HB3 ALA 61 -3.580 -8.678 3.808 395 H THR 62 HN THR 62 -5.182 -6.309 3.644 396 HA THR 62 HA THR 62 -5.953 -5.172 6.208 397 HB THR 62 HB THR 62 -3.153 -4.810 5.108 398 HG1 THR 62 HG1 THR 62 -4.204 -6.623 6.791 399 HG21 THR 62 HG21 THR 62 -4.434 -3.647 7.585 400 HG22 THR 62 HG22 THR 62 -4.023 -2.751 6.124 401 HG23 THR 62 HG23 THR 62 -2.744 -3.462 7.111 402 H ALA 63 HN ALA 63 -7.041 -3.345 5.856 403 HA ALA 63 HA ALA 63 -7.099 -2.249 3.172 404 HB1 ALA 63 HB1 ALA 63 -9.032 -0.980 3.931 405 HB2 ALA 63 HB2 ALA 63 -8.747 -1.498 5.591 406 HB3 ALA 63 HB3 ALA 63 -9.215 -2.681 4.366 407 H VAL 64 HN VAL 64 -6.180 -0.414 2.573 408 HA VAL 64 HA VAL 64 -5.245 1.466 4.609 409 HB VAL 64 HB VAL 64 -3.069 1.648 3.319 410 HG11 VAL 64 HG11 VAL 64 -3.104 0.645 5.513 411 HG12 VAL 64 HG12 VAL 64 -2.033 -0.283 4.464 412 HG13 VAL 64 HG13 VAL 64 -3.646 -0.890 4.836 413 HG21 VAL 64 HG21 VAL 64 -3.807 0.439 1.328 414 HG22 VAL 64 HG22 VAL 64 -3.971 -1.036 2.288 415 HG23 VAL 64 HG23 VAL 64 -2.376 -0.312 2.042 416 H CYS 65 HN CYS 65 -4.602 3.516 3.706 417 HA CYS 65 HA CYS 65 -5.827 4.075 1.088 418 HB2 CYS 65 HB2 CYS 65 -7.096 5.073 2.958 419 HB3 CYS 65 HB1 CYS 65 -5.639 5.883 3.511 420 H CYS 66 HN CYS 66 -4.230 4.393 -0.354 421 HA CYS 66 HA CYS 66 -1.667 5.430 0.627 422 HB2 CYS 66 HB2 CYS 66 -2.264 4.279 -2.093 423 HB3 CYS 66 HB1 CYS 66 -0.687 4.493 -1.335 424 H SER 67 HN SER 67 -0.872 7.339 0.106 425 HA SER 67 HA SER 67 -2.563 9.198 -1.310 426 HB2 SER 67 HB2 SER 67 0.143 9.646 -0.055 427 HB3 SER 67 HB1 SER 67 -1.010 10.892 -0.532 428 HG SER 67 HG SER 67 -2.463 9.592 1.002 429 H ASP 68 HN ASP 68 0.246 7.336 -1.924 430 HA ASP 68 HA ASP 68 0.870 8.893 -4.331 431 HB2 ASP 68 HB2 ASP 68 2.472 6.832 -2.805 432 HB3 ASP 68 HB1 ASP 68 2.978 7.497 -4.354 433 H ASN 69 HN ASN 69 0.675 8.035 -6.341 434 HA ASN 69 HA ASN 69 -0.810 5.505 -6.455 435 HB2 ASN 69 HB2 ASN 69 -1.703 6.257 -8.573 436 HB3 ASN 69 HB1 ASN 69 -1.912 7.530 -7.380 437 HD21 ASN 69 HD21 ASN 69 -0.816 9.445 -7.613 438 HD22 ASN 69 HD22 ASN 69 0.049 9.863 -9.053 439 H ASN 70 HN ASN 70 2.261 6.209 -6.586 440 HA ASN 70 HA ASN 70 3.005 5.049 -9.116 441 HB2 ASN 70 HB2 ASN 70 4.596 5.901 -6.695 442 HB3 ASN 70 HB1 ASN 70 5.341 5.107 -8.079 443 HD21 ASN 70 HD21 ASN 70 6.602 6.925 -8.509 444 HD22 ASN 70 HD22 ASN 70 5.937 8.350 -9.229 445 H VAL 71 HN VAL 71 2.549 2.973 -9.406 446 HA VAL 71 HA VAL 71 3.125 1.098 -7.210 447 HB VAL 71 HB VAL 71 0.807 1.080 -9.122 448 HG11 VAL 71 HG11 VAL 71 0.066 -0.923 -7.743 449 HG12 VAL 71 HG12 VAL 71 1.760 -1.050 -7.262 450 HG13 VAL 71 HG13 VAL 71 1.308 -1.178 -8.962 451 HG21 VAL 71 HG21 VAL 71 0.526 2.603 -7.267 452 HG22 VAL 71 HG22 VAL 71 0.922 1.314 -6.130 453 HG23 VAL 71 HG23 VAL 71 -0.555 1.221 -7.091 454 H SER 72 HN SER 72 4.280 -0.642 -7.677 455 HA SER 72 HA SER 72 5.614 -0.809 -10.218 456 HB2 SER 72 HB2 SER 72 6.961 -2.528 -9.128 457 HB3 SER 72 HB1 SER 72 6.762 -1.155 -8.034 458 HG SER 72 HG SER 72 6.229 -3.626 -7.480 459 H GLY 73 HN GLY 73 2.688 -1.810 -9.344 460 HA2 GLY 73 HA2 GLY 73 1.567 -3.189 -11.101 461 HA3 GLY 73 HA1 GLY 73 2.836 -4.363 -10.806 462 H VAL 74 HN VAL 74 2.829 -3.931 -7.914 463 HA VAL 74 HA VAL 74 0.160 -4.891 -7.217 464 HB VAL 74 HB VAL 74 0.965 -6.753 -5.967 465 HG11 VAL 74 HG11 VAL 74 2.150 -6.644 -8.730 466 HG12 VAL 74 HG12 VAL 74 0.577 -7.285 -8.250 467 HG13 VAL 74 HG13 VAL 74 2.053 -8.119 -7.763 468 HG21 VAL 74 HG21 VAL 74 3.722 -5.801 -6.688 469 HG22 VAL 74 HG22 VAL 74 3.371 -7.375 -5.973 470 HG23 VAL 74 HG23 VAL 74 3.006 -5.898 -5.079 471 H ILE 75 HN ILE 75 2.741 -2.871 -6.467 472 HA ILE 75 HA ILE 75 2.367 -3.013 -3.591 473 HB ILE 75 HB ILE 75 4.091 -1.274 -3.445 474 HG12 ILE 75 HG12 ILE 75 4.741 -1.529 -6.320 475 HG13 ILE 75 HG11 ILE 75 3.347 -0.525 -5.933 476 HG21 ILE 75 HG21 ILE 75 5.936 -2.634 -4.241 477 HG22 ILE 75 HG22 ILE 75 4.823 -3.572 -5.233 478 HG23 ILE 75 HG23 ILE 75 4.699 -3.631 -3.475 479 HD11 ILE 75 HD11 ILE 75 4.758 0.819 -4.447 480 HD12 ILE 75 HD12 ILE 75 5.371 0.802 -6.102 481 HD13 ILE 75 HD13 ILE 75 6.143 -0.188 -4.864 482 H ALA 76 HN ALA 76 2.483 -0.788 -2.512 483 HA ALA 76 HA ALA 76 0.971 1.317 -3.808 484 HB1 ALA 76 HB1 ALA 76 -0.781 -0.051 -2.830 485 HB2 ALA 76 HB2 ALA 76 -0.629 1.457 -1.928 486 HB3 ALA 76 HB3 ALA 76 0.049 -0.037 -1.272 487 H ILE 77 HN ILE 77 1.486 3.367 -2.886 488 HA ILE 77 HA ILE 77 3.608 3.238 -0.845 489 HB ILE 77 HB ILE 77 3.453 5.107 -3.213 490 HG12 ILE 77 HG12 ILE 77 5.402 2.891 -2.545 491 HG13 ILE 77 HG11 ILE 77 4.157 2.823 -3.786 492 HG21 ILE 77 HG21 ILE 77 5.627 5.951 -2.464 493 HG22 ILE 77 HG22 ILE 77 5.525 4.931 -1.029 494 HG23 ILE 77 HG23 ILE 77 4.370 6.242 -1.262 495 HD11 ILE 77 HD11 ILE 77 5.265 4.634 -4.988 496 HD12 ILE 77 HD12 ILE 77 6.333 3.250 -4.753 497 HD13 ILE 77 HD13 ILE 77 6.518 4.686 -3.748 498 H GLY 78 HN GLY 78 3.522 4.602 0.846 499 HA2 GLY 78 HA2 GLY 78 2.838 6.312 2.226 500 HA3 GLY 78 HA1 GLY 78 2.150 7.099 0.813 501 H CYS 79 HN CYS 79 1.507 4.068 2.563 502 HA CYS 79 HA CYS 79 -1.348 4.651 2.254 503 HB2 CYS 79 HB2 CYS 79 -0.122 1.992 2.966 504 HB3 CYS 79 HB1 CYS 79 -1.735 2.319 2.351 505 H LEU 80 HN LEU 80 -2.654 4.946 3.906 506 HA LEU 80 HA LEU 80 -1.606 4.509 6.612 507 HB2 LEU 80 HB2 LEU 80 -3.921 6.222 5.715 508 HB3 LEU 80 HB1 LEU 80 -3.336 6.045 7.364 509 HG LEU 80 HG LEU 80 -1.763 7.256 5.087 510 HD11 LEU 80 HD11 LEU 80 -3.101 8.557 7.456 511 HD12 LEU 80 HD12 LEU 80 -3.636 8.666 5.779 512 HD13 LEU 80 HD13 LEU 80 -2.091 9.369 6.259 513 HD21 LEU 80 HD21 LEU 80 -0.333 6.161 6.714 514 HD22 LEU 80 HD22 LEU 80 -1.153 6.999 8.029 515 HD23 LEU 80 HD23 LEU 80 -0.196 7.912 6.862 516 HA PRO 81 HA PRO 81 -4.332 1.030 6.937 517 HB2 PRO 81 HB2 PRO 81 -4.149 1.509 9.841 518 HB3 PRO 81 HB1 PRO 81 -3.691 0.087 8.907 519 HG2 PRO 81 HG2 PRO 81 -1.845 1.703 9.964 520 HG3 PRO 81 HG1 PRO 81 -1.604 0.937 8.383 521 HD2 PRO 81 HD2 PRO 81 -2.412 3.751 9.019 522 HD3 PRO 81 HD1 PRO 81 -1.303 3.157 7.778 523 H VAL 82 HN VAL 82 -6.436 1.165 6.572 524 HA VAL 82 HA VAL 82 -8.082 2.836 8.332 525 HB VAL 82 HB VAL 82 -9.703 2.878 6.374 526 HG11 VAL 82 HG11 VAL 82 -7.077 4.332 6.093 527 HG12 VAL 82 HG12 VAL 82 -8.451 4.851 7.070 528 HG13 VAL 82 HG13 VAL 82 -8.590 4.793 5.312 529 HG21 VAL 82 HG21 VAL 82 -8.684 1.125 5.050 530 HG22 VAL 82 HG22 VAL 82 -7.235 2.108 4.847 531 HG23 VAL 82 HG23 VAL 82 -8.763 2.637 4.144 532 H THR 83 HN THR 83 -9.946 1.951 9.084 533 HA THR 83 HA THR 83 -11.321 0.361 9.916 534 HB THR 83 HB THR 83 -10.683 -0.964 7.300 535 HG1 THR 83 HG1 THR 83 -11.886 1.227 7.642 536 HG21 THR 83 HG21 THR 83 -12.769 -2.235 7.617 537 HG22 THR 83 HG22 THR 83 -12.940 -1.533 9.225 538 HG23 THR 83 HG23 THR 83 -11.587 -2.606 8.871 539 H LEU 84 HN LEU 84 -11.212 -1.419 11.234 540 HA LEU 84 HA LEU 84 -10.333 -3.068 12.497 541 HB2 LEU 84 HB2 LEU 84 -8.800 -3.539 9.967 542 HB3 LEU 84 HB1 LEU 84 -8.594 -4.555 11.384 543 HG LEU 84 HG LEU 84 -11.202 -4.136 9.933 544 HD11 LEU 84 HD11 LEU 84 -10.888 -6.419 9.114 545 HD12 LEU 84 HD12 LEU 84 -9.292 -6.465 9.864 546 HD13 LEU 84 HD13 LEU 84 -9.613 -5.344 8.541 547 HD21 LEU 84 HD21 LEU 84 -11.525 -4.651 12.267 548 HD22 LEU 84 HD22 LEU 84 -10.415 -6.016 12.147 549 HD23 LEU 84 HD23 LEU 84 -11.949 -6.048 11.279 Start of MODEL 20 1 H1 GLY 1 HT1 GLY 1 -20.456 2.945 -10.546 2 H2 GLY 1 HT2 GLY 1 -20.451 4.131 -9.345 3 H3 GLY 1 HT3 GLY 1 -21.140 2.620 -9.035 4 HA2 GLY 1 HA1 GLY 1 -19.005 1.552 -9.191 5 HA3 GLY 1 HA2 GLY 1 -18.270 3.096 -9.599 6 H SER 2 HN SER 2 -17.813 1.232 -7.323 7 HA SER 2 HA SER 2 -18.753 2.761 -5.042 8 HB2 SER 2 HB2 SER 2 -17.418 0.973 -3.774 9 HB3 SER 2 HB1 SER 2 -18.826 0.423 -4.680 10 HG SER 2 HG SER 2 -17.559 -0.762 -5.849 11 H TRP 3 HN TRP 3 -15.544 1.430 -5.754 12 HA TRP 3 HA TRP 3 -13.446 2.233 -5.503 13 HB2 TRP 3 HB2 TRP 3 -14.826 4.800 -6.282 14 HB3 TRP 3 HB1 TRP 3 -13.082 4.657 -6.103 15 HD1 TRP 3 HD1 TRP 3 -15.959 3.531 -8.371 16 HE1 TRP 3 HE1 TRP 3 -14.967 2.704 -10.600 17 HE3 TRP 3 HE3 TRP 3 -11.004 3.674 -7.144 18 HZ2 TRP 3 HZ2 TRP 3 -12.412 2.185 -11.688 19 HZ3 TRP 3 HZ3 TRP 3 -9.347 2.997 -8.833 20 HH2 TRP 3 HH2 TRP 3 -10.039 2.267 -11.058 21 H GLY 4 HN GLY 4 -13.085 1.812 -3.384 22 HA2 GLY 4 HA2 GLY 4 -14.059 3.432 -1.262 23 HA3 GLY 4 HA1 GLY 4 -12.813 2.200 -1.139 24 H GLN 5 HN GLN 5 -13.485 5.514 -1.192 25 HA GLN 5 HA GLN 5 -10.609 6.122 -1.147 26 HB2 GLN 5 HB2 GLN 5 -13.026 7.824 -1.730 27 HB3 GLN 5 HB1 GLN 5 -11.476 8.533 -1.313 28 HG2 GLN 5 HG2 GLN 5 -10.450 7.456 -3.239 29 HG3 GLN 5 HG1 GLN 5 -11.995 6.710 -3.649 30 HE21 GLN 5 HE21 GLN 5 -10.269 8.595 -5.127 31 HE22 GLN 5 HE22 GLN 5 -11.288 9.934 -5.524 32 H CYS 6 HN CYS 6 -9.718 6.982 0.689 33 HA CYS 6 HA CYS 6 -11.318 6.713 3.086 34 HB2 CYS 6 HB2 CYS 6 -9.244 6.997 4.315 35 HB3 CYS 6 HB1 CYS 6 -8.994 5.841 3.012 36 H SER 7 HN SER 7 -9.238 9.263 1.744 37 HA SER 7 HA SER 7 -11.141 11.316 2.313 38 HB2 SER 7 HB2 SER 7 -8.590 11.225 3.956 39 HB3 SER 7 HB1 SER 7 -9.699 12.592 3.886 40 HG SER 7 HG SER 7 -11.024 10.308 4.477 41 H THR 8 HN THR 8 -7.585 11.036 2.114 42 HA THR 8 HA THR 8 -7.611 13.087 0.031 43 HB THR 8 HB THR 8 -5.067 12.999 0.486 44 HG1 THR 8 HG1 THR 8 -4.429 11.905 2.238 45 HG21 THR 8 HG21 THR 8 -6.524 14.842 1.200 46 HG22 THR 8 HG22 THR 8 -5.300 14.487 2.419 47 HG23 THR 8 HG23 THR 8 -6.959 13.936 2.649 48 H GLY 9 HN GLY 9 -6.968 9.720 0.503 49 HA2 GLY 9 HA2 GLY 9 -6.013 9.558 -2.282 50 HA3 GLY 9 HA1 GLY 9 -5.270 8.614 -1.000 51 H SER 10 HN SER 10 -5.963 7.054 -2.848 52 HA SER 10 HA SER 10 -8.703 6.128 -2.528 53 HB2 SER 10 HB2 SER 10 -7.689 6.180 -4.793 54 HB3 SER 10 HB1 SER 10 -6.458 5.043 -4.253 55 HG SER 10 HG SER 10 -8.150 3.536 -3.855 56 H ILE 11 HN ILE 11 -9.203 4.027 -1.781 57 HA ILE 11 HA ILE 11 -7.234 2.976 0.096 58 HB ILE 11 HB ILE 11 -10.184 2.426 -0.205 59 HG12 ILE 11 HG12 ILE 11 -8.538 3.858 1.879 60 HG13 ILE 11 HG11 ILE 11 -9.684 4.581 0.760 61 HG21 ILE 11 HG21 ILE 11 -8.289 1.313 1.863 62 HG22 ILE 11 HG22 ILE 11 -8.998 0.398 0.532 63 HG23 ILE 11 HG23 ILE 11 -10.034 1.060 1.797 64 HD11 ILE 11 HD11 ILE 11 -10.602 4.385 3.005 65 HD12 ILE 11 HD12 ILE 11 -10.358 2.639 2.948 66 HD13 ILE 11 HD13 ILE 11 -11.506 3.405 1.851 67 H GLN 12 HN GLN 12 -6.357 1.063 -0.025 68 HA GLN 12 HA GLN 12 -7.257 -0.813 -2.088 69 HB2 GLN 12 HB2 GLN 12 -4.685 -1.407 -2.216 70 HB3 GLN 12 HB1 GLN 12 -5.397 -0.187 -3.255 71 HG2 GLN 12 HG2 GLN 12 -4.211 0.617 -0.650 72 HG3 GLN 12 HG1 GLN 12 -3.148 0.222 -1.989 73 HE21 GLN 12 HE21 GLN 12 -4.767 1.247 -4.081 74 HE22 GLN 12 HE22 GLN 12 -4.763 2.964 -3.941 75 H CYS 13 HN CYS 13 -6.437 -3.013 -1.713 76 HA CYS 13 HA CYS 13 -6.313 -3.552 1.170 77 HB2 CYS 13 HB2 CYS 13 -8.258 -4.529 0.100 78 HB3 CYS 13 HB1 CYS 13 -7.255 -5.296 -1.130 79 H CYS 14 HN CYS 14 -4.223 -3.608 1.684 80 HA CYS 14 HA CYS 14 -2.261 -4.682 -0.159 81 HB2 CYS 14 HB2 CYS 14 -2.072 -3.279 2.490 82 HB3 CYS 14 HB1 CYS 14 -0.671 -4.047 1.755 83 H GLN 15 HN GLN 15 -1.387 -6.593 -0.079 84 HA GLN 15 HA GLN 15 -2.213 -8.501 1.878 85 HB2 GLN 15 HB2 GLN 15 -1.811 -9.901 0.192 86 HB3 GLN 15 HB1 GLN 15 -1.286 -8.536 -0.768 87 HG2 GLN 15 HG2 GLN 15 0.423 -10.093 -0.958 88 HG3 GLN 15 HG1 GLN 15 1.024 -8.926 0.217 89 HE21 GLN 15 HE21 GLN 15 -1.409 -11.327 0.964 90 HE22 GLN 15 HE22 GLN 15 -0.424 -12.280 2.015 91 H ASN 16 HN ASN 16 0.622 -6.558 1.249 92 HA ASN 16 HA ASN 16 1.662 -7.360 3.878 93 HB2 ASN 16 HB2 ASN 16 3.062 -7.290 1.263 94 HB3 ASN 16 HB1 ASN 16 3.928 -6.670 2.649 95 HD21 ASN 16 HD21 ASN 16 4.520 -8.980 1.053 96 HD22 ASN 16 HD22 ASN 16 4.507 -10.332 2.129 97 H VAL 17 HN VAL 17 0.959 -5.528 4.942 98 HA VAL 17 HA VAL 17 1.759 -2.921 3.913 99 HB VAL 17 HB VAL 17 0.358 -3.609 6.508 100 HG11 VAL 17 HG11 VAL 17 -0.123 -1.213 6.643 101 HG12 VAL 17 HG12 VAL 17 0.827 -0.937 5.182 102 HG13 VAL 17 HG13 VAL 17 1.614 -1.517 6.649 103 HG21 VAL 17 HG21 VAL 17 -1.002 -4.130 4.558 104 HG22 VAL 17 HG22 VAL 17 -0.722 -2.512 3.916 105 HG23 VAL 17 HG23 VAL 17 -1.643 -2.723 5.406 106 H VAL 18 HN VAL 18 3.872 -2.596 4.073 107 HA VAL 18 HA VAL 18 5.170 -3.130 6.660 108 HB VAL 18 HB VAL 18 7.231 -3.779 5.439 109 HG11 VAL 18 HG11 VAL 18 4.813 -5.473 4.815 110 HG12 VAL 18 HG12 VAL 18 5.762 -5.515 6.301 111 HG13 VAL 18 HG13 VAL 18 6.487 -6.024 4.775 112 HG21 VAL 18 HG21 VAL 18 5.440 -3.729 3.011 113 HG22 VAL 18 HG22 VAL 18 7.070 -4.399 3.062 114 HG23 VAL 18 HG23 VAL 18 6.819 -2.674 3.323 115 HA PRO 19 HA PRO 19 6.644 1.080 6.319 116 HB2 PRO 19 HB2 PRO 19 8.957 0.066 7.841 117 HB3 PRO 19 HB1 PRO 19 7.871 1.405 8.211 118 HG2 PRO 19 HG2 PRO 19 7.735 -0.904 9.554 119 HG3 PRO 19 HG1 PRO 19 6.283 0.035 9.169 120 HD2 PRO 19 HD2 PRO 19 7.327 -2.453 7.888 121 HD3 PRO 19 HD1 PRO 19 5.650 -1.960 8.205 122 H GLY 20 HN GLY 20 7.858 2.055 4.793 123 HA2 GLY 20 HA2 GLY 20 9.348 0.499 2.949 124 HA3 GLY 20 HA1 GLY 20 9.283 2.253 3.000 125 H ASP 21 HN ASP 21 10.181 1.925 5.921 126 HA ASP 21 HA ASP 21 13.055 1.681 5.371 127 HB2 ASP 21 HB2 ASP 21 13.354 2.903 7.483 128 HB3 ASP 21 HB1 ASP 21 12.279 3.790 6.408 129 H SER 22 HN SER 22 10.655 -0.276 6.246 130 HA SER 22 HA SER 22 11.809 -1.581 8.541 131 HB2 SER 22 HB2 SER 22 9.414 -1.726 8.261 132 HB3 SER 22 HB1 SER 22 9.588 -2.369 6.637 133 HG SER 22 HG SER 22 9.617 -3.663 9.025 134 H ASP 23 HN ASP 23 12.612 -3.806 8.485 135 HA ASP 23 HA ASP 23 14.582 -4.290 6.584 136 HB2 ASP 23 HB2 ASP 23 13.120 -6.098 8.487 137 HB3 ASP 23 HB1 ASP 23 14.259 -6.775 7.328 138 H LEU 24 HN LEU 24 11.238 -5.408 6.704 139 HA LEU 24 HA LEU 24 11.365 -6.957 4.334 140 HB2 LEU 24 HB2 LEU 24 9.277 -5.997 6.160 141 HB3 LEU 24 HB1 LEU 24 8.746 -6.203 4.504 142 HG LEU 24 HG LEU 24 8.279 -8.189 5.820 143 HD11 LEU 24 HD11 LEU 24 8.835 -8.404 3.426 144 HD12 LEU 24 HD12 LEU 24 9.260 -9.838 4.362 145 HD13 LEU 24 HD13 LEU 24 10.516 -8.703 3.869 146 HD21 LEU 24 HD21 LEU 24 11.256 -8.318 6.255 147 HD22 LEU 24 HD22 LEU 24 10.095 -9.565 6.710 148 HD23 LEU 24 HD23 LEU 24 10.036 -7.982 7.481 149 H GLY 25 HN GLY 25 9.758 -3.833 4.911 150 HA2 GLY 25 HA2 GLY 25 9.060 -3.327 2.277 151 HA3 GLY 25 HA1 GLY 25 9.269 -2.093 3.507 152 H THR 26 HN THR 26 12.086 -2.604 3.917 153 HA THR 26 HA THR 26 13.079 -0.858 1.912 154 HB THR 26 HB THR 26 14.623 -2.452 3.965 155 HG1 THR 26 HG1 THR 26 13.322 -1.094 5.085 156 HG21 THR 26 HG21 THR 26 16.041 -1.617 2.147 157 HG22 THR 26 HG22 THR 26 16.371 -0.780 3.665 158 HG23 THR 26 HG23 THR 26 15.412 0.009 2.415 159 H LEU 27 HN LEU 27 13.572 -4.294 2.617 160 HA LEU 27 HA LEU 27 15.319 -4.780 0.447 161 HB2 LEU 27 HB2 LEU 27 14.771 -6.212 2.560 162 HB3 LEU 27 HB1 LEU 27 13.459 -6.844 1.591 163 HG LEU 27 HG LEU 27 15.521 -8.267 1.643 164 HD11 LEU 27 HD11 LEU 27 14.714 -7.244 -1.073 165 HD12 LEU 27 HD12 LEU 27 13.888 -8.501 -0.152 166 HD13 LEU 27 HD13 LEU 27 15.529 -8.772 -0.739 167 HD21 LEU 27 HD21 LEU 27 17.137 -6.411 1.614 168 HD22 LEU 27 HD22 LEU 27 16.682 -6.069 -0.055 169 HD23 LEU 27 HD23 LEU 27 17.448 -7.604 0.353 170 H LEU 28 HN LEU 28 11.847 -4.754 0.847 171 HA LEU 28 HA LEU 28 11.199 -6.039 -1.590 172 HB2 LEU 28 HB2 LEU 28 9.523 -4.125 0.033 173 HB3 LEU 28 HB1 LEU 28 8.936 -5.166 -1.244 174 HG LEU 28 HG LEU 28 9.853 -5.921 1.512 175 HD11 LEU 28 HD11 LEU 28 7.708 -7.073 1.567 176 HD12 LEU 28 HD12 LEU 28 7.381 -6.553 -0.086 177 HD13 LEU 28 HD13 LEU 28 7.510 -5.358 1.205 178 HD21 LEU 28 HD21 LEU 28 11.029 -7.436 0.064 179 HD22 LEU 28 HD22 LEU 28 9.558 -7.763 -0.852 180 HD23 LEU 28 HD23 LEU 28 9.683 -8.282 0.828 181 H LEU 29 HN LEU 29 11.399 -2.584 -0.684 182 HA LEU 29 HA LEU 29 10.700 -1.809 -3.358 183 HB2 LEU 29 HB2 LEU 29 11.098 0.476 -2.636 184 HB3 LEU 29 HB1 LEU 29 10.043 -0.371 -1.540 185 HG LEU 29 HG LEU 29 12.084 -0.657 -0.031 186 HD11 LEU 29 HD11 LEU 29 13.155 1.507 -1.844 187 HD12 LEU 29 HD12 LEU 29 13.822 -0.118 -1.664 188 HD13 LEU 29 HD13 LEU 29 13.857 1.007 -0.305 189 HD21 LEU 29 HD21 LEU 29 10.308 0.858 0.498 190 HD22 LEU 29 HD22 LEU 29 10.928 2.050 -0.645 191 HD23 LEU 29 HD23 LEU 29 11.845 1.665 0.815 192 H ASP 30 HN ASP 30 13.631 -2.488 -1.684 193 HA ASP 30 HA ASP 30 15.413 -1.314 -3.552 194 HB2 ASP 30 HB2 ASP 30 16.052 -2.184 -1.279 195 HB3 ASP 30 HB1 ASP 30 15.864 -3.815 -1.907 196 H GLU 31 HN GLU 31 13.682 -4.324 -3.352 197 HA GLU 31 HA GLU 31 14.885 -5.669 -5.527 198 HB2 GLU 31 HB2 GLU 31 13.420 -6.529 -3.556 199 HB3 GLU 31 HB1 GLU 31 12.060 -6.057 -4.566 200 HG2 GLU 31 HG2 GLU 31 12.897 -7.543 -6.332 201 HG3 GLU 31 HG1 GLU 31 14.196 -8.025 -5.242 202 H LEU 32 HN LEU 32 12.304 -3.415 -5.102 203 HA LEU 32 HA LEU 32 11.302 -3.714 -7.807 204 HB2 LEU 32 HB2 LEU 32 10.440 -2.188 -5.377 205 HB3 LEU 32 HB1 LEU 32 9.669 -1.943 -6.931 206 HG LEU 32 HG LEU 32 9.786 -4.558 -5.426 207 HD11 LEU 32 HD11 LEU 32 7.411 -4.215 -5.043 208 HD12 LEU 32 HD12 LEU 32 7.492 -2.656 -5.863 209 HD13 LEU 32 HD13 LEU 32 8.355 -2.900 -4.343 210 HD21 LEU 32 HD21 LEU 32 8.149 -5.310 -7.108 211 HD22 LEU 32 HD22 LEU 32 9.717 -4.930 -7.816 212 HD23 LEU 32 HD23 LEU 32 8.377 -3.795 -7.983 213 H GLY 33 HN GLY 33 13.598 -1.868 -6.199 214 HA2 GLY 33 HA2 GLY 33 14.944 -0.151 -6.903 215 HA3 GLY 33 HA1 GLY 33 14.228 -0.333 -8.496 216 H ILE 34 HN ILE 34 12.522 0.431 -5.503 217 HA ILE 34 HA ILE 34 11.166 2.595 -6.816 218 HB ILE 34 HB ILE 34 11.070 1.796 -3.897 219 HG12 ILE 34 HG12 ILE 34 9.246 1.055 -6.203 220 HG13 ILE 34 HG11 ILE 34 10.375 -0.029 -5.397 221 HG21 ILE 34 HG21 ILE 34 9.182 3.498 -5.521 222 HG22 ILE 34 HG22 ILE 34 10.304 4.083 -4.293 223 HG23 ILE 34 HG23 ILE 34 8.966 3.027 -3.835 224 HD11 ILE 34 HD11 ILE 34 9.106 0.226 -3.317 225 HD12 ILE 34 HD12 ILE 34 8.121 -0.415 -4.629 226 HD13 ILE 34 HD13 ILE 34 7.965 1.276 -4.155 227 H VAL 35 HN VAL 35 11.725 4.672 -6.850 228 HA VAL 35 HA VAL 35 13.847 5.619 -5.118 229 HB VAL 35 HB VAL 35 13.991 6.428 -7.365 230 HG11 VAL 35 HG11 VAL 35 11.709 6.173 -8.099 231 HG12 VAL 35 HG12 VAL 35 12.240 7.827 -8.394 232 HG13 VAL 35 HG13 VAL 35 11.184 7.470 -7.027 233 HG21 VAL 35 HG21 VAL 35 13.007 8.631 -5.559 234 HG22 VAL 35 HG22 VAL 35 13.965 8.855 -7.023 235 HG23 VAL 35 HG23 VAL 35 14.651 8.003 -5.640 236 H LEU 36 HN LEU 36 13.203 5.872 -3.093 237 HA LEU 36 HA LEU 36 10.537 6.688 -2.431 238 HB2 LEU 36 HB2 LEU 36 11.505 6.723 -0.061 239 HB3 LEU 36 HB1 LEU 36 11.421 5.184 -0.880 240 HG LEU 36 HG LEU 36 13.917 5.800 -1.538 241 HD11 LEU 36 HD11 LEU 36 13.478 7.285 1.039 242 HD12 LEU 36 HD12 LEU 36 13.904 7.991 -0.518 243 HD13 LEU 36 HD13 LEU 36 15.043 6.932 0.311 244 HD21 LEU 36 HD21 LEU 36 13.297 3.795 -0.373 245 HD22 LEU 36 HD22 LEU 36 13.013 4.698 1.113 246 HD23 LEU 36 HD23 LEU 36 14.648 4.552 0.470 247 H GLU 37 HN GLU 37 9.785 8.650 -2.045 248 HA GLU 37 HA GLU 37 11.576 10.929 -2.011 249 HB2 GLU 37 HB2 GLU 37 8.566 10.813 -1.700 250 HB3 GLU 37 HB1 GLU 37 9.521 12.271 -1.933 251 HG2 GLU 37 HG2 GLU 37 10.247 11.360 -4.133 252 HG3 GLU 37 HG1 GLU 37 9.119 10.027 -3.895 253 H ASP 38 HN ASP 38 9.652 9.000 0.129 254 HA ASP 38 HA ASP 38 11.088 10.088 2.396 255 HB2 ASP 38 HB2 ASP 38 8.930 11.298 2.396 256 HB3 ASP 38 HB1 ASP 38 8.071 9.761 2.332 257 HA PRO 39 HA PRO 39 11.315 5.643 2.335 258 HB2 PRO 39 HB2 PRO 39 13.272 5.352 4.175 259 HB3 PRO 39 HB1 PRO 39 13.595 5.949 2.544 260 HG2 PRO 39 HG2 PRO 39 13.296 7.479 5.098 261 HG3 PRO 39 HG1 PRO 39 14.468 7.706 3.787 262 HD2 PRO 39 HD2 PRO 39 12.216 9.231 4.087 263 HD3 PRO 39 HD1 PRO 39 12.998 8.932 2.522 264 H THR 40 HN THR 40 9.990 7.535 4.722 265 HA THR 40 HA THR 40 9.739 5.260 6.578 266 HB THR 40 HB THR 40 9.023 6.956 8.287 267 HG1 THR 40 HG1 THR 40 9.027 8.593 6.193 268 HG21 THR 40 HG21 THR 40 11.305 7.748 8.732 269 HG22 THR 40 HG22 THR 40 11.778 7.269 7.100 270 HG23 THR 40 HG23 THR 40 11.279 6.046 8.268 271 H VAL 41 HN VAL 41 8.190 6.004 4.091 272 HA VAL 41 HA VAL 41 5.502 6.283 5.150 273 HB VAL 41 HB VAL 41 4.758 6.121 2.824 274 HG11 VAL 41 HG11 VAL 41 5.812 8.162 1.964 275 HG12 VAL 41 HG12 VAL 41 7.062 8.022 3.201 276 HG13 VAL 41 HG13 VAL 41 5.384 8.300 3.669 277 HG21 VAL 41 HG21 VAL 41 6.439 4.529 2.019 278 HG22 VAL 41 HG22 VAL 41 7.671 5.792 2.111 279 HG23 VAL 41 HG23 VAL 41 6.321 5.949 0.981 280 H LEU 42 HN LEU 42 3.863 4.681 4.777 281 HA LEU 42 HA LEU 42 4.861 1.973 5.056 282 HB2 LEU 42 HB2 LEU 42 2.069 3.118 5.124 283 HB3 LEU 42 HB1 LEU 42 2.423 1.412 5.317 284 HG LEU 42 HG LEU 42 3.379 3.601 7.167 285 HD11 LEU 42 HD11 LEU 42 0.973 3.295 7.324 286 HD12 LEU 42 HD12 LEU 42 1.772 2.647 8.757 287 HD13 LEU 42 HD13 LEU 42 1.190 1.553 7.501 288 HD21 LEU 42 HD21 LEU 42 3.579 0.597 7.351 289 HD22 LEU 42 HD22 LEU 42 4.029 1.732 8.624 290 HD23 LEU 42 HD23 LEU 42 4.913 1.722 7.098 291 H ILE 43 HN ILE 43 5.163 0.674 3.394 292 HA ILE 43 HA ILE 43 3.692 1.251 0.923 293 HB ILE 43 HB ILE 43 5.407 -0.205 -0.211 294 HG12 ILE 43 HG12 ILE 43 6.966 0.218 2.345 295 HG13 ILE 43 HG11 ILE 43 6.235 -1.310 1.870 296 HG21 ILE 43 HG21 ILE 43 6.334 2.336 1.117 297 HG22 ILE 43 HG22 ILE 43 5.461 2.196 -0.408 298 HG23 ILE 43 HG23 ILE 43 7.106 1.578 -0.276 299 HD11 ILE 43 HD11 ILE 43 8.621 -1.238 1.370 300 HD12 ILE 43 HD12 ILE 43 8.358 0.161 0.329 301 HD13 ILE 43 HD13 ILE 43 7.653 -1.397 -0.095 302 H GLY 44 HN GLY 44 2.561 -0.327 -0.112 303 HA2 GLY 44 HA2 GLY 44 2.023 -2.693 1.563 304 HA3 GLY 44 HA1 GLY 44 0.786 -1.831 0.680 305 H ASP 45 HN ASP 45 3.011 -4.370 0.606 306 HA ASP 45 HA ASP 45 2.990 -4.678 -2.274 307 HB2 ASP 45 HB2 ASP 45 4.799 -5.585 -0.644 308 HB3 ASP 45 HB1 ASP 45 3.652 -6.861 -0.317 309 H GLY 46 HN GLY 46 1.772 -6.220 -3.407 310 HA2 GLY 46 HA2 GLY 46 -0.002 -7.654 -3.805 311 HA3 GLY 46 HA1 GLY 46 0.048 -8.056 -2.113 312 H CYS 47 HN CYS 47 -0.483 -4.888 -3.552 313 HA CYS 47 HA CYS 47 -2.891 -4.699 -1.889 314 HB2 CYS 47 HB2 CYS 47 -0.729 -3.063 -1.960 315 HB3 CYS 47 HB1 CYS 47 -1.790 -2.260 -3.117 316 H ASP 48 HN ASP 48 -4.722 -4.955 -2.894 317 HA ASP 48 HA ASP 48 -4.915 -4.182 -5.714 318 HB2 ASP 48 HB2 ASP 48 -6.755 -5.636 -5.942 319 HB3 ASP 48 HB1 ASP 48 -5.607 -6.506 -4.943 320 HA PRO 49 HA PRO 49 -7.190 -0.500 -4.610 321 HB2 PRO 49 HB2 PRO 49 -8.373 -0.890 -7.300 322 HB3 PRO 49 HB1 PRO 49 -7.529 0.507 -6.638 323 HG2 PRO 49 HG2 PRO 49 -6.390 -1.094 -8.457 324 HG3 PRO 49 HG1 PRO 49 -5.454 -0.314 -7.171 325 HD2 PRO 49 HD2 PRO 49 -6.337 -3.149 -7.414 326 HD3 PRO 49 HD1 PRO 49 -4.862 -2.474 -6.701 327 H ILE 50 HN ILE 50 -8.954 -0.656 -3.320 328 HA ILE 50 HA ILE 50 -10.792 -2.837 -3.733 329 HB ILE 50 HB ILE 50 -11.121 -0.645 -1.686 330 HG12 ILE 50 HG12 ILE 50 -9.534 -3.218 -1.505 331 HG13 ILE 50 HG11 ILE 50 -8.888 -1.585 -1.420 332 HG21 ILE 50 HG21 ILE 50 -11.982 -3.534 -1.687 333 HG22 ILE 50 HG22 ILE 50 -13.024 -2.185 -2.153 334 HG23 ILE 50 HG23 ILE 50 -12.410 -2.301 -0.501 335 HD11 ILE 50 HD11 ILE 50 -10.175 -1.232 0.659 336 HD12 ILE 50 HD12 ILE 50 -8.984 -2.527 0.783 337 HD13 ILE 50 HD13 ILE 50 -10.693 -2.915 0.582 338 H THR 51 HN THR 51 -11.729 -2.401 -5.637 339 HA THR 51 HA THR 51 -13.483 -0.050 -5.774 340 HB THR 51 HB THR 51 -11.795 -0.108 -7.548 341 HG1 THR 51 HG1 THR 51 -13.206 0.103 -9.301 342 HG21 THR 51 HG21 THR 51 -11.860 -1.903 -9.258 343 HG22 THR 51 HG22 THR 51 -12.974 -2.797 -8.227 344 HG23 THR 51 HG23 THR 51 -11.334 -2.460 -7.671 345 H VAL 52 HN VAL 52 -13.727 -2.845 -4.601 346 HA VAL 52 HA VAL 52 -16.185 -3.689 -5.941 347 HB VAL 52 HB VAL 52 -14.498 -5.441 -5.529 348 HG11 VAL 52 HG11 VAL 52 -13.445 -4.516 -3.548 349 HG12 VAL 52 HG12 VAL 52 -13.991 -6.165 -3.246 350 HG13 VAL 52 HG13 VAL 52 -14.914 -4.801 -2.614 351 HG21 VAL 52 HG21 VAL 52 -16.985 -5.722 -3.860 352 HG22 VAL 52 HG22 VAL 52 -15.953 -7.054 -4.380 353 HG23 VAL 52 HG23 VAL 52 -16.822 -6.090 -5.575 354 H ALA 53 HN ALA 53 -18.140 -3.785 -4.781 355 HA ALA 53 HA ALA 53 -18.253 -1.934 -2.544 356 HB1 ALA 53 HB1 ALA 53 -20.665 -2.010 -2.845 357 HB2 ALA 53 HB2 ALA 53 -20.493 -3.311 -4.021 358 HB3 ALA 53 HB3 ALA 53 -19.859 -1.706 -4.383 359 H GLY 54 HN GLY 54 -17.182 -3.303 -1.010 360 HA2 GLY 54 HA2 GLY 54 -19.037 -5.263 0.169 361 HA3 GLY 54 HA1 GLY 54 -17.335 -5.659 -0.027 362 H SER 55 HN SER 55 -19.408 -4.946 2.262 363 HA SER 55 HA SER 55 -18.212 -2.731 3.589 364 HB2 SER 55 HB2 SER 55 -20.011 -4.883 4.720 365 HB3 SER 55 HB1 SER 55 -19.708 -3.294 5.424 366 HG SER 55 HG SER 55 -20.618 -2.401 3.472 367 H SER 56 HN SER 56 -17.779 -6.216 3.764 368 HA SER 56 HA SER 56 -15.504 -5.749 5.561 369 HB2 SER 56 HB2 SER 56 -17.434 -6.701 6.817 370 HB3 SER 56 HB1 SER 56 -17.394 -8.100 5.747 371 HG SER 56 HG SER 56 -15.929 -8.877 7.015 372 H ASP 57 HN ASP 57 -17.022 -8.105 3.368 373 HA ASP 57 HA ASP 57 -14.551 -9.513 2.981 374 HB2 ASP 57 HB2 ASP 57 -17.307 -9.792 1.790 375 HB3 ASP 57 HB1 ASP 57 -15.955 -10.799 1.298 376 H ALA 58 HN ALA 58 -14.188 -6.889 2.272 377 HA ALA 58 HA ALA 58 -14.020 -6.983 -0.671 378 HB1 ALA 58 HB1 ALA 58 -15.343 -5.108 0.202 379 HB2 ALA 58 HB2 ALA 58 -13.889 -4.553 -0.626 380 HB3 ALA 58 HB3 ALA 58 -13.948 -4.569 1.136 381 H CYS 59 HN CYS 59 -12.254 -7.512 2.028 382 HA CYS 59 HA CYS 59 -9.755 -7.073 0.613 383 HB2 CYS 59 HB2 CYS 59 -10.035 -5.006 1.898 384 HB3 CYS 59 HB1 CYS 59 -10.273 -5.940 3.371 385 H SER 60 HN SER 60 -8.375 -8.697 0.933 386 HA SER 60 HA SER 60 -9.223 -10.816 2.744 387 HB2 SER 60 HB2 SER 60 -7.434 -12.117 1.467 388 HB3 SER 60 HB1 SER 60 -8.834 -11.585 0.537 389 HG SER 60 HG SER 60 -7.634 -10.093 -0.467 390 H ALA 61 HN ALA 61 -6.943 -8.290 2.690 391 HA ALA 61 HA ALA 61 -5.364 -9.682 4.738 392 HB1 ALA 61 HB1 ALA 61 -3.319 -8.703 3.881 393 HB2 ALA 61 HB2 ALA 61 -4.223 -7.919 2.585 394 HB3 ALA 61 HB3 ALA 61 -4.117 -9.678 2.648 395 H THR 62 HN THR 62 -4.971 -6.379 3.475 396 HA THR 62 HA THR 62 -5.877 -5.322 6.055 397 HB THR 62 HB THR 62 -3.206 -4.534 4.882 398 HG1 THR 62 HG1 THR 62 -3.912 -6.688 6.472 399 HG21 THR 62 HG21 THR 62 -2.827 -3.570 7.108 400 HG22 THR 62 HG22 THR 62 -4.441 -4.080 7.602 401 HG23 THR 62 HG23 THR 62 -4.249 -2.867 6.338 402 H ALA 63 HN ALA 63 -6.968 -3.461 5.856 403 HA ALA 63 HA ALA 63 -7.215 -2.273 3.218 404 HB1 ALA 63 HB1 ALA 63 -9.042 -0.979 4.193 405 HB2 ALA 63 HB2 ALA 63 -8.647 -1.606 5.793 406 HB3 ALA 63 HB3 ALA 63 -9.238 -2.698 4.540 407 H VAL 64 HN VAL 64 -6.192 -0.503 2.595 408 HA VAL 64 HA VAL 64 -5.122 1.354 4.594 409 HB VAL 64 HB VAL 64 -2.986 1.441 3.197 410 HG11 VAL 64 HG11 VAL 64 -3.601 -1.005 4.852 411 HG12 VAL 64 HG12 VAL 64 -2.980 0.537 5.439 412 HG13 VAL 64 HG13 VAL 64 -1.981 -0.476 4.399 413 HG21 VAL 64 HG21 VAL 64 -2.420 -0.620 1.998 414 HG22 VAL 64 HG22 VAL 64 -3.819 0.186 1.287 415 HG23 VAL 64 HG23 VAL 64 -4.046 -1.236 2.306 416 H CYS 65 HN CYS 65 -4.302 3.356 3.559 417 HA CYS 65 HA CYS 65 -5.630 3.913 0.995 418 HB2 CYS 65 HB2 CYS 65 -6.942 4.768 2.969 419 HB3 CYS 65 HB1 CYS 65 -5.576 5.803 3.355 420 H CYS 66 HN CYS 66 -4.078 4.450 -0.422 421 HA CYS 66 HA CYS 66 -1.561 5.500 0.618 422 HB2 CYS 66 HB2 CYS 66 -2.340 3.938 -1.764 423 HB3 CYS 66 HB1 CYS 66 -1.007 5.066 -1.974 424 H SER 67 HN SER 67 -0.701 7.365 0.152 425 HA SER 67 HA SER 67 -2.395 9.376 -1.068 426 HB2 SER 67 HB2 SER 67 0.280 9.634 0.309 427 HB3 SER 67 HB1 SER 67 -0.806 10.962 -0.105 428 HG SER 67 HG SER 67 -1.357 8.830 1.698 429 H ASP 68 HN ASP 68 0.278 7.435 -1.878 430 HA ASP 68 HA ASP 68 1.062 9.190 -4.085 431 HB2 ASP 68 HB2 ASP 68 2.349 6.736 -2.891 432 HB3 ASP 68 HB1 ASP 68 2.882 7.426 -4.421 433 H ASN 69 HN ASN 69 1.160 8.409 -6.226 434 HA ASN 69 HA ASN 69 -0.895 6.376 -6.761 435 HB2 ASN 69 HB2 ASN 69 -1.122 7.406 -8.974 436 HB3 ASN 69 HB1 ASN 69 -1.333 8.609 -7.708 437 HD21 ASN 69 HD21 ASN 69 0.183 10.230 -7.463 438 HD22 ASN 69 HD22 ASN 69 1.413 10.543 -8.637 439 H ASN 70 HN ASN 70 2.418 6.879 -6.806 440 HA ASN 70 HA ASN 70 3.175 5.399 -9.098 441 HB2 ASN 70 HB2 ASN 70 4.720 6.941 -7.985 442 HB3 ASN 70 HB1 ASN 70 4.709 5.932 -6.544 443 HD21 ASN 70 HD21 ASN 70 4.806 4.825 -9.889 444 HD22 ASN 70 HD22 ASN 70 6.373 4.103 -9.789 445 H VAL 71 HN VAL 71 2.591 3.344 -9.384 446 HA VAL 71 HA VAL 71 3.036 1.476 -7.173 447 HB VAL 71 HB VAL 71 1.226 0.096 -8.164 448 HG11 VAL 71 HG11 VAL 71 -0.625 1.438 -7.267 449 HG12 VAL 71 HG12 VAL 71 0.427 2.854 -7.260 450 HG13 VAL 71 HG13 VAL 71 0.792 1.479 -6.217 451 HG21 VAL 71 HG21 VAL 71 1.243 1.029 -10.419 452 HG22 VAL 71 HG22 VAL 71 0.644 2.563 -9.786 453 HG23 VAL 71 HG23 VAL 71 -0.365 1.119 -9.701 454 H SER 72 HN SER 72 3.862 -0.543 -7.715 455 HA SER 72 HA SER 72 5.256 -0.682 -10.275 456 HB2 SER 72 HB2 SER 72 6.401 -1.109 -8.024 457 HB3 SER 72 HB1 SER 72 5.497 -2.616 -7.966 458 HG SER 72 HG SER 72 7.110 -1.922 -10.184 459 H GLY 73 HN GLY 73 2.302 -1.309 -9.422 460 HA2 GLY 73 HA2 GLY 73 0.957 -2.472 -11.091 461 HA3 GLY 73 HA1 GLY 73 2.137 -3.765 -11.039 462 H VAL 74 HN VAL 74 2.363 -3.776 -8.143 463 HA VAL 74 HA VAL 74 -0.355 -4.514 -7.351 464 HB VAL 74 HB VAL 74 0.318 -6.590 -6.385 465 HG11 VAL 74 HG11 VAL 74 1.098 -7.820 -8.437 466 HG12 VAL 74 HG12 VAL 74 1.254 -6.244 -9.223 467 HG13 VAL 74 HG13 VAL 74 -0.323 -6.800 -8.658 468 HG21 VAL 74 HG21 VAL 74 2.602 -7.475 -6.632 469 HG22 VAL 74 HG22 VAL 74 2.533 -6.023 -5.634 470 HG23 VAL 74 HG23 VAL 74 3.104 -5.921 -7.298 471 H ILE 75 HN ILE 75 2.289 -2.724 -6.647 472 HA ILE 75 HA ILE 75 1.997 -3.051 -3.753 473 HB ILE 75 HB ILE 75 3.949 -1.604 -3.504 474 HG12 ILE 75 HG12 ILE 75 4.298 -1.713 -6.485 475 HG13 ILE 75 HG11 ILE 75 3.441 -0.396 -5.708 476 HG21 ILE 75 HG21 ILE 75 4.283 -3.981 -3.664 477 HG22 ILE 75 HG22 ILE 75 5.608 -3.127 -4.454 478 HG23 ILE 75 HG23 ILE 75 4.341 -3.877 -5.422 479 HD11 ILE 75 HD11 ILE 75 5.422 0.166 -4.428 480 HD12 ILE 75 HD12 ILE 75 5.765 0.169 -6.159 481 HD13 ILE 75 HD13 ILE 75 6.282 -1.187 -5.160 482 H ALA 76 HN ALA 76 2.250 -0.988 -2.532 483 HA ALA 76 HA ALA 76 0.909 1.313 -3.755 484 HB1 ALA 76 HB1 ALA 76 0.062 0.008 -1.161 485 HB2 ALA 76 HB2 ALA 76 -0.855 0.016 -2.674 486 HB3 ALA 76 HB3 ALA 76 -0.576 1.528 -1.806 487 H ILE 77 HN ILE 77 1.622 3.287 -2.899 488 HA ILE 77 HA ILE 77 3.737 3.073 -0.859 489 HB ILE 77 HB ILE 77 3.711 4.930 -3.245 490 HG12 ILE 77 HG12 ILE 77 5.496 2.564 -2.621 491 HG13 ILE 77 HG11 ILE 77 4.206 2.575 -3.819 492 HG21 ILE 77 HG21 ILE 77 5.964 5.568 -2.513 493 HG22 ILE 77 HG22 ILE 77 5.780 4.555 -1.081 494 HG23 ILE 77 HG23 ILE 77 4.746 5.966 -1.302 495 HD11 ILE 77 HD11 ILE 77 6.682 4.283 -3.883 496 HD12 ILE 77 HD12 ILE 77 5.396 4.278 -5.089 497 HD13 ILE 77 HD13 ILE 77 6.388 2.839 -4.852 498 H GLY 78 HN GLY 78 3.579 4.382 0.854 499 HA2 GLY 78 HA2 GLY 78 2.993 6.195 2.160 500 HA3 GLY 78 HA1 GLY 78 2.344 6.971 0.723 501 H CYS 79 HN CYS 79 1.584 3.979 2.486 502 HA CYS 79 HA CYS 79 -1.249 4.637 2.235 503 HB2 CYS 79 HB2 CYS 79 0.327 2.162 2.333 504 HB3 CYS 79 HB1 CYS 79 -1.186 2.110 3.215 505 H LEU 80 HN LEU 80 -2.549 4.989 3.897 506 HA LEU 80 HA LEU 80 -1.496 4.600 6.612 507 HB2 LEU 80 HB2 LEU 80 -3.870 6.212 5.679 508 HB3 LEU 80 HB1 LEU 80 -3.322 6.053 7.340 509 HG LEU 80 HG LEU 80 -1.763 7.359 5.109 510 HD11 LEU 80 HD11 LEU 80 -3.200 8.554 7.473 511 HD12 LEU 80 HD12 LEU 80 -3.698 8.676 5.786 512 HD13 LEU 80 HD13 LEU 80 -2.197 9.434 6.319 513 HD21 LEU 80 HD21 LEU 80 -1.169 7.058 8.049 514 HD22 LEU 80 HD22 LEU 80 -0.264 8.078 6.933 515 HD23 LEU 80 HD23 LEU 80 -0.280 6.329 6.713 516 HA PRO 81 HA PRO 81 -4.131 1.043 6.919 517 HB2 PRO 81 HB2 PRO 81 -3.958 1.428 9.823 518 HB3 PRO 81 HB1 PRO 81 -3.386 0.083 8.843 519 HG2 PRO 81 HG2 PRO 81 -1.696 1.818 9.998 520 HG3 PRO 81 HG1 PRO 81 -1.351 1.069 8.431 521 HD2 PRO 81 HD2 PRO 81 -2.345 3.829 9.032 522 HD3 PRO 81 HD1 PRO 81 -1.173 3.296 7.821 523 H VAL 82 HN VAL 82 -6.276 1.032 6.696 524 HA VAL 82 HA VAL 82 -7.865 2.782 8.423 525 HB VAL 82 HB VAL 82 -9.522 2.804 6.482 526 HG11 VAL 82 HG11 VAL 82 -6.899 4.257 6.187 527 HG12 VAL 82 HG12 VAL 82 -8.273 4.777 7.162 528 HG13 VAL 82 HG13 VAL 82 -8.413 4.714 5.405 529 HG21 VAL 82 HG21 VAL 82 -8.572 2.577 4.242 530 HG22 VAL 82 HG22 VAL 82 -8.516 1.056 5.133 531 HG23 VAL 82 HG23 VAL 82 -7.055 2.027 4.950 532 H THR 83 HN THR 83 -10.036 2.054 8.782 533 HA THR 83 HA THR 83 -10.452 -0.829 8.412 534 HB THR 83 HB THR 83 -11.150 0.649 10.957 535 HG1 THR 83 HG1 THR 83 -9.084 0.478 11.380 536 HG21 THR 83 HG21 THR 83 -11.424 -1.608 11.878 537 HG22 THR 83 HG22 THR 83 -11.021 -2.299 10.307 538 HG23 THR 83 HG23 THR 83 -12.493 -1.347 10.499 539 H LEU 84 HN LEU 84 -12.560 -1.409 7.996 540 HA LEU 84 HA LEU 84 -14.727 -1.255 7.398 541 HB2 LEU 84 HB2 LEU 84 -14.584 1.180 9.146 542 HB3 LEU 84 HB1 LEU 84 -16.076 0.622 8.411 543 HG LEU 84 HG LEU 84 -14.403 -1.056 10.268 544 HD11 LEU 84 HD11 LEU 84 -16.836 0.610 10.889 545 HD12 LEU 84 HD12 LEU 84 -15.193 0.907 11.460 546 HD13 LEU 84 HD13 LEU 84 -16.062 -0.533 11.988 547 HD21 LEU 84 HD21 LEU 84 -16.466 -2.374 10.456 548 HD22 LEU 84 HD22 LEU 84 -15.833 -2.340 8.813 549 HD23 LEU 84 HD23 LEU 84 -17.220 -1.339 9.244
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