NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
642917 | 6rss | 34407 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 HT1 GLY 1 -39.414 4.687 -4.190 2 H2 GLY 1 HT2 GLY 1 -41.008 4.179 -4.431 3 H3 GLY 1 HT3 GLY 1 -40.379 4.262 -2.859 4 HA2 GLY 1 HA1 GLY 1 -40.962 6.520 -4.690 5 HA3 GLY 1 HA2 GLY 1 -41.806 6.132 -3.200 6 H SER 2 HN SER 2 -40.696 6.439 -1.182 7 HA SER 2 HA SER 2 -39.005 8.771 -1.281 8 HB2 SER 2 HB2 SER 2 -39.156 8.441 1.291 9 HB3 SER 2 HB1 SER 2 -40.626 8.879 0.415 10 HG SER 2 HG SER 2 -39.923 6.492 1.673 11 H HIS 3 HN HIS 3 -38.600 5.384 -1.018 12 HA HIS 3 HA HIS 3 -36.010 5.504 0.249 13 HB2 HIS 3 HB2 HIS 3 -37.924 3.450 -0.463 14 HB3 HIS 3 HB1 HIS 3 -36.301 2.996 -0.960 15 HD1 HIS 3 HD1 HIS 3 -36.441 1.103 0.911 16 HD2 HIS 3 HD2 HIS 3 -36.477 5.026 2.311 17 HE1 HIS 3 HE1 HIS 3 -35.947 0.951 3.369 18 HE2 HIS 3 HE2 HIS 3 -36.118 3.320 4.228 19 H MET 4 HN MET 4 -34.004 5.516 -0.826 20 HA MET 4 HA MET 4 -34.107 5.341 -3.759 21 HB2 MET 4 HB2 MET 4 -32.205 6.958 -3.787 22 HB3 MET 4 HB1 MET 4 -33.685 7.630 -3.134 23 HG2 MET 4 HG2 MET 4 -32.812 7.258 -0.862 24 HG3 MET 4 HG1 MET 4 -31.299 6.692 -1.569 25 HE1 MET 4 HE1 MET 4 -33.613 9.600 -2.903 26 HE2 MET 4 HE2 MET 4 -32.916 10.990 -2.070 27 HE3 MET 4 HE3 MET 4 -33.745 9.736 -1.148 28 H GLN 5 HN GLN 5 -32.565 4.114 -4.773 29 HA GLN 5 HA GLN 5 -31.270 2.110 -3.203 30 HB2 GLN 5 HB2 GLN 5 -32.253 1.572 -5.364 31 HB3 GLN 5 HB1 GLN 5 -31.187 2.711 -6.163 32 HG2 GLN 5 HG2 GLN 5 -29.251 1.329 -5.421 33 HG3 GLN 5 HG1 GLN 5 -30.405 0.146 -4.813 34 HE21 GLN 5 HE21 GLN 5 -29.044 1.643 -7.645 35 HE22 GLN 5 HE22 GLN 5 -29.626 0.445 -8.790 36 H TYR 6 HN TYR 6 -29.154 1.746 -2.850 37 HA TYR 6 HA TYR 6 -27.167 3.606 -3.935 38 HB2 TYR 6 HB2 TYR 6 -27.630 2.909 -1.040 39 HB3 TYR 6 HB1 TYR 6 -25.996 3.288 -1.570 40 HD1 TYR 6 HD1 TYR 6 -25.447 5.554 -2.330 41 HD2 TYR 6 HD2 TYR 6 -29.330 4.611 -0.865 42 HE1 TYR 6 HE1 TYR 6 -25.924 7.951 -2.069 43 HE2 TYR 6 HE2 TYR 6 -29.814 7.006 -0.596 44 HH TYR 6 HH TYR 6 -28.773 9.088 -0.428 45 H LYS 7 HN LYS 7 -25.164 2.638 -4.384 46 HA LYS 7 HA LYS 7 -25.223 -0.302 -4.271 47 HB2 LYS 7 HB2 LYS 7 -23.315 1.297 -5.960 48 HB3 LYS 7 HB1 LYS 7 -23.836 -0.383 -6.203 49 HG2 LYS 7 HG2 LYS 7 -26.106 0.586 -6.761 50 HG3 LYS 7 HG1 LYS 7 -25.307 2.164 -6.792 51 HD2 LYS 7 HD2 LYS 7 -23.765 1.379 -8.494 52 HD3 LYS 7 HD1 LYS 7 -24.503 -0.222 -8.444 53 HE2 LYS 7 HE2 LYS 7 -26.656 0.821 -9.124 54 HE3 LYS 7 HE1 LYS 7 -25.804 2.348 -9.318 55 HZ1 LYS 7 HZ1 LYS 7 -24.489 1.443 -11.057 56 HZ2 LYS 7 HZ2 LYS 7 -26.099 1.036 -11.400 57 HZ3 LYS 7 HZ3 LYS 7 -25.051 -0.129 -10.759 58 H LEU 8 HN LEU 8 -23.185 -1.395 -4.075 59 HA LEU 8 HA LEU 8 -20.971 0.124 -2.929 60 HB2 LEU 8 HB2 LEU 8 -22.395 -0.756 -1.016 61 HB3 LEU 8 HB1 LEU 8 -22.016 -2.361 -1.584 62 HG LEU 8 HG LEU 8 -19.594 -1.851 -1.208 63 HD11 LEU 8 HD11 LEU 8 -19.205 0.008 0.509 64 HD12 LEU 8 HD12 LEU 8 -20.747 0.671 -0.028 65 HD13 LEU 8 HD13 LEU 8 -19.416 0.494 -1.170 66 HD21 LEU 8 HD21 LEU 8 -21.576 -1.825 1.028 67 HD22 LEU 8 HD22 LEU 8 -19.840 -2.022 1.283 68 HD23 LEU 8 HD23 LEU 8 -20.731 -3.206 0.327 69 H ILE 9 HN ILE 9 -18.997 -0.728 -3.402 70 HA ILE 9 HA ILE 9 -18.946 -3.375 -4.692 71 HB ILE 9 HB ILE 9 -17.336 -0.969 -5.619 72 HG12 ILE 9 HG12 ILE 9 -19.486 -2.537 -7.108 73 HG13 ILE 9 HG11 ILE 9 -19.775 -0.942 -6.324 74 HG21 ILE 9 HG21 ILE 9 -17.361 -3.841 -6.552 75 HG22 ILE 9 HG22 ILE 9 -16.012 -2.966 -5.821 76 HG23 ILE 9 HG23 ILE 9 -16.590 -2.520 -7.427 77 HD11 ILE 9 HD11 ILE 9 -19.416 -0.731 -8.734 78 HD12 ILE 9 HD12 ILE 9 -17.836 -1.503 -8.580 79 HD13 ILE 9 HD13 ILE 9 -18.126 0.064 -7.827 80 H LEU 10 HN LEU 10 -17.587 -4.697 -3.628 81 HA LEU 10 HA LEU 10 -15.689 -3.451 -1.775 82 HB2 LEU 10 HB2 LEU 10 -16.439 -6.374 -1.865 83 HB3 LEU 10 HB1 LEU 10 -15.449 -5.590 -0.663 84 HG LEU 10 HG LEU 10 -17.408 -5.855 0.478 85 HD11 LEU 10 HD11 LEU 10 -18.498 -3.777 0.771 86 HD12 LEU 10 HD12 LEU 10 -17.932 -3.210 -0.801 87 HD13 LEU 10 HD13 LEU 10 -16.774 -3.503 0.507 88 HD21 LEU 10 HD21 LEU 10 -19.612 -5.824 -0.390 89 HD22 LEU 10 HD22 LEU 10 -18.626 -6.726 -1.542 90 HD23 LEU 10 HD23 LEU 10 -19.081 -5.058 -1.885 91 H ASN 11 HN ASN 11 -14.020 -2.905 -3.081 92 HA ASN 11 HA ASN 11 -12.912 -4.943 -4.843 93 HB2 ASN 11 HB2 ASN 11 -11.589 -2.280 -4.228 94 HB3 ASN 11 HB1 ASN 11 -11.390 -3.288 -5.644 95 HD21 ASN 11 HD21 ASN 11 -11.766 -1.706 -7.067 96 HD22 ASN 11 HD22 ASN 11 -13.298 -0.946 -7.280 97 H GLY 12 HN GLY 12 -12.321 -6.471 -3.307 98 HA2 GLY 12 HA2 GLY 12 -9.941 -5.695 -1.733 99 HA3 GLY 12 HA1 GLY 12 -11.106 -6.898 -1.150 100 H LYS 13 HN LYS 13 -8.794 -7.894 -1.056 101 HA LYS 13 HA LYS 13 -8.141 -9.154 -3.585 102 HB2 LYS 13 HB2 LYS 13 -6.718 -9.409 -0.921 103 HB3 LYS 13 HB1 LYS 13 -6.124 -9.979 -2.477 104 HG2 LYS 13 HG2 LYS 13 -6.180 -7.631 -3.291 105 HG3 LYS 13 HG1 LYS 13 -6.627 -7.122 -1.663 106 HD2 LYS 13 HD2 LYS 13 -4.531 -8.121 -0.817 107 HD3 LYS 13 HD1 LYS 13 -4.080 -8.513 -2.475 108 HE2 LYS 13 HE2 LYS 13 -2.966 -6.488 -1.915 109 HE3 LYS 13 HE1 LYS 13 -4.285 -6.061 -3.011 110 HZ1 LYS 13 HZ1 LYS 13 -4.356 -4.495 -1.281 111 HZ2 LYS 13 HZ2 LYS 13 -4.122 -5.656 -0.079 112 HZ3 LYS 13 HZ3 LYS 13 -5.601 -5.583 -0.902 113 H THR 14 HN THR 14 -8.870 -10.449 -0.267 114 HA THR 14 HA THR 14 -9.622 -12.954 -1.599 115 HB THR 14 HB THR 14 -8.075 -12.898 0.482 116 HG1 THR 14 HG1 THR 14 -10.367 -14.544 0.183 117 HG21 THR 14 HG21 THR 14 -10.762 -12.455 1.795 118 HG22 THR 14 HG22 THR 14 -9.300 -11.492 2.008 119 HG23 THR 14 HG23 THR 14 -9.374 -13.134 2.637 120 H LEU 15 HN LEU 15 -11.075 -10.222 -1.119 121 HA LEU 15 HA LEU 15 -13.701 -11.381 -0.655 122 HB2 LEU 15 HB2 LEU 15 -12.443 -10.040 1.364 123 HB3 LEU 15 HB1 LEU 15 -13.292 -8.735 0.580 124 HG LEU 15 HG LEU 15 -14.652 -9.487 2.367 125 HD11 LEU 15 HD11 LEU 15 -15.881 -8.965 0.374 126 HD12 LEU 15 HD12 LEU 15 -16.662 -10.300 1.224 127 HD13 LEU 15 HD13 LEU 15 -15.687 -10.613 -0.212 128 HD21 LEU 15 HD21 LEU 15 -15.176 -11.701 2.881 129 HD22 LEU 15 HD22 LEU 15 -13.461 -11.752 2.457 130 HD23 LEU 15 HD23 LEU 15 -14.675 -12.288 1.298 131 H LYS 16 HN LYS 16 -14.453 -11.020 -2.671 132 HA LYS 16 HA LYS 16 -14.508 -8.231 -3.579 133 HB2 LYS 16 HB2 LYS 16 -13.867 -10.595 -5.352 134 HB3 LYS 16 HB1 LYS 16 -14.017 -8.935 -5.879 135 HG2 LYS 16 HG2 LYS 16 -12.026 -8.319 -4.918 136 HG3 LYS 16 HG1 LYS 16 -11.985 -9.693 -3.809 137 HD2 LYS 16 HD2 LYS 16 -11.551 -9.648 -6.770 138 HD3 LYS 16 HD1 LYS 16 -10.352 -9.980 -5.528 139 HE2 LYS 16 HE2 LYS 16 -11.313 -12.068 -4.996 140 HE3 LYS 16 HE1 LYS 16 -12.799 -11.690 -5.864 141 HZ1 LYS 16 HZ1 LYS 16 -11.288 -13.274 -7.020 142 HZ2 LYS 16 HZ2 LYS 16 -10.169 -12.010 -7.209 143 HZ3 LYS 16 HZ3 LYS 16 -11.697 -11.905 -7.928 144 H GLY 17 HN GLY 17 -16.442 -7.615 -4.312 145 HA2 GLY 17 HA2 GLY 17 -18.357 -9.167 -5.573 146 HA3 GLY 17 HA1 GLY 17 -18.706 -9.252 -3.849 147 H GLU 18 HN GLU 18 -20.677 -8.175 -5.140 148 HA GLU 18 HA GLU 18 -20.462 -5.319 -4.524 149 HB2 GLU 18 HB2 GLU 18 -21.755 -6.447 -7.032 150 HB3 GLU 18 HB1 GLU 18 -21.824 -4.767 -6.524 151 HG2 GLU 18 HG2 GLU 18 -19.475 -4.497 -6.839 152 HG3 GLU 18 HG1 GLU 18 -19.265 -6.220 -7.128 153 H THR 19 HN THR 19 -22.583 -4.344 -4.095 154 HA THR 19 HA THR 19 -24.832 -6.113 -3.749 155 HB THR 19 HB THR 19 -23.452 -6.589 -1.725 156 HG1 THR 19 HG1 THR 19 -25.314 -6.900 -0.802 157 HG21 THR 19 HG21 THR 19 -23.363 -4.841 0.048 158 HG22 THR 19 HG22 THR 19 -24.025 -3.678 -1.102 159 HG23 THR 19 HG23 THR 19 -22.435 -4.385 -1.385 160 H THR 20 HN THR 20 -26.613 -4.822 -2.472 161 HA THR 20 HA THR 20 -26.521 -1.982 -3.150 162 HB THR 20 HB THR 20 -28.886 -2.260 -4.127 163 HG1 THR 20 HG1 THR 20 -28.598 -4.724 -3.514 164 HG21 THR 20 HG21 THR 20 -27.993 -2.850 -6.412 165 HG22 THR 20 HG22 THR 20 -26.440 -3.189 -5.647 166 HG23 THR 20 HG23 THR 20 -27.118 -1.560 -5.590 167 H THR 21 HN THR 21 -28.062 -0.717 -1.988 168 HA THR 21 HA THR 21 -29.709 -2.124 -0.043 169 HB THR 21 HB THR 21 -27.436 -1.626 1.086 170 HG1 THR 21 HG1 THR 21 -28.544 -1.259 2.991 171 HG21 THR 21 HG21 THR 21 -28.624 1.177 1.008 172 HG22 THR 21 HG22 THR 21 -27.085 0.690 0.294 173 HG23 THR 21 HG23 THR 21 -27.283 0.691 2.048 174 H GLU 22 HN GLU 22 -31.256 -0.701 1.007 175 HA GLU 22 HA GLU 22 -31.869 1.637 -0.681 176 HB2 GLU 22 HB2 GLU 22 -34.289 1.143 0.068 177 HB3 GLU 22 HB1 GLU 22 -33.584 0.043 -1.107 178 HG2 GLU 22 HG2 GLU 22 -33.093 -1.552 0.684 179 HG3 GLU 22 HG1 GLU 22 -33.834 -0.422 1.869 180 H ALA 23 HN ALA 23 -32.106 3.573 0.328 181 HA ALA 23 HA ALA 23 -32.711 3.713 3.187 182 HB1 ALA 23 HB1 ALA 23 -30.054 4.747 2.153 183 HB2 ALA 23 HB2 ALA 23 -30.263 3.299 3.133 184 HB3 ALA 23 HB3 ALA 23 -30.656 4.880 3.805 185 H VAL 24 HN VAL 24 -32.968 6.063 3.869 186 HA VAL 24 HA VAL 24 -33.747 7.715 1.588 187 HB VAL 24 HB VAL 24 -34.893 9.129 3.312 188 HG11 VAL 24 HG11 VAL 24 -36.704 7.517 3.740 189 HG12 VAL 24 HG12 VAL 24 -35.638 6.210 3.231 190 HG13 VAL 24 HG13 VAL 24 -36.130 7.446 2.074 191 HG21 VAL 24 HG21 VAL 24 -33.971 6.919 5.141 192 HG22 VAL 24 HG22 VAL 24 -35.237 8.071 5.556 193 HG23 VAL 24 HG23 VAL 24 -33.589 8.634 5.269 194 H ASP 25 HN ASP 25 -31.013 7.386 3.389 195 HA ASP 25 HA ASP 25 -30.313 10.215 3.056 196 HB2 ASP 25 HB2 ASP 25 -29.300 8.602 5.400 197 HB3 ASP 25 HB1 ASP 25 -29.127 10.326 5.120 198 H ALA 26 HN ALA 26 -28.022 10.551 2.716 199 HA ALA 26 HA ALA 26 -26.759 8.322 1.395 200 HB1 ALA 26 HB1 ALA 26 -26.575 10.595 0.475 201 HB2 ALA 26 HB2 ALA 26 -24.989 9.914 0.836 202 HB3 ALA 26 HB3 ALA 26 -25.705 11.108 1.920 203 H ALA 27 HN ALA 27 -26.253 10.250 4.307 204 HA ALA 27 HA ALA 27 -23.886 9.045 5.191 205 HB1 ALA 27 HB1 ALA 27 -24.512 9.920 7.422 206 HB2 ALA 27 HB2 ALA 27 -26.102 10.337 6.781 207 HB3 ALA 27 HB3 ALA 27 -24.659 11.123 6.142 208 H THR 28 HN THR 28 -27.269 8.178 5.704 209 HA THR 28 HA THR 28 -26.795 6.079 7.545 210 HB THR 28 HB THR 28 -29.135 6.234 5.627 211 HG1 THR 28 HG1 THR 28 -30.022 7.736 6.917 212 HG21 THR 28 HG21 THR 28 -30.333 5.104 7.466 213 HG22 THR 28 HG22 THR 28 -28.839 5.061 8.403 214 HG23 THR 28 HG23 THR 28 -28.964 4.144 6.900 215 H ALA 29 HN ALA 29 -26.639 6.262 4.056 216 HA ALA 29 HA ALA 29 -26.828 3.433 3.572 217 HB1 ALA 29 HB1 ALA 29 -26.031 4.012 1.309 218 HB2 ALA 29 HB2 ALA 29 -25.774 5.673 1.846 219 HB3 ALA 29 HB3 ALA 29 -27.403 5.003 1.805 220 H GLU 30 HN GLU 30 -24.368 5.807 4.132 221 HA GLU 30 HA GLU 30 -22.085 4.244 3.636 222 HB2 GLU 30 HB2 GLU 30 -22.316 6.804 4.035 223 HB3 GLU 30 HB1 GLU 30 -22.306 6.374 5.736 224 HG2 GLU 30 HG2 GLU 30 -20.137 5.091 5.160 225 HG3 GLU 30 HG1 GLU 30 -20.113 6.160 3.758 226 H LYS 31 HN LYS 31 -23.527 5.242 6.708 227 HA LYS 31 HA LYS 31 -22.059 3.744 8.434 228 HB2 LYS 31 HB2 LYS 31 -24.903 4.653 8.684 229 HB3 LYS 31 HB1 LYS 31 -23.970 3.981 10.018 230 HG2 LYS 31 HG2 LYS 31 -23.297 6.467 8.446 231 HG3 LYS 31 HG1 LYS 31 -23.949 6.407 10.086 232 HD2 LYS 31 HD2 LYS 31 -21.940 5.296 10.875 233 HD3 LYS 31 HD1 LYS 31 -21.298 5.242 9.232 234 HE2 LYS 31 HE2 LYS 31 -21.976 7.789 10.686 235 HE3 LYS 31 HE1 LYS 31 -20.369 7.070 10.688 236 HZ1 LYS 31 HZ1 LYS 31 -20.306 7.299 8.265 237 HZ2 LYS 31 HZ2 LYS 31 -20.551 8.798 9.021 238 HZ3 LYS 31 HZ3 LYS 31 -21.851 8.005 8.288 239 H VAL 32 HN VAL 32 -25.052 2.673 6.840 240 HA VAL 32 HA VAL 32 -25.225 0.205 8.220 241 HB VAL 32 HB VAL 32 -26.350 1.047 5.545 242 HG11 VAL 32 HG11 VAL 32 -26.133 -1.394 5.630 243 HG12 VAL 32 HG12 VAL 32 -27.824 -0.888 5.695 244 HG13 VAL 32 HG13 VAL 32 -27.003 -1.410 7.164 245 HG21 VAL 32 HG21 VAL 32 -27.621 0.762 8.265 246 HG22 VAL 32 HG22 VAL 32 -28.449 1.226 6.777 247 HG23 VAL 32 HG23 VAL 32 -27.217 2.284 7.468 248 H PHE 33 HN PHE 33 -23.766 1.090 5.119 249 HA PHE 33 HA PHE 33 -22.982 -1.591 4.507 250 HB2 PHE 33 HB2 PHE 33 -22.487 1.076 3.286 251 HB3 PHE 33 HB1 PHE 33 -21.387 -0.220 2.890 252 HD1 PHE 33 HD1 PHE 33 -23.602 -2.405 3.046 253 HD2 PHE 33 HD2 PHE 33 -23.305 1.350 1.072 254 HE1 PHE 33 HE1 PHE 33 -25.133 -3.209 1.299 255 HE2 PHE 33 HE2 PHE 33 -24.831 0.551 -0.688 256 HZ PHE 33 HZ PHE 33 -25.753 -1.731 -0.577 257 H LYS 34 HN LYS 34 -21.564 0.932 6.432 258 HA LYS 34 HA LYS 34 -18.873 0.067 6.228 259 HB2 LYS 34 HB2 LYS 34 -20.236 1.551 8.490 260 HB3 LYS 34 HB1 LYS 34 -18.514 1.426 8.295 261 HG2 LYS 34 HG2 LYS 34 -19.158 2.477 5.936 262 HG3 LYS 34 HG1 LYS 34 -20.379 3.200 7.000 263 HD2 LYS 34 HD2 LYS 34 -18.505 4.585 7.148 264 HD3 LYS 34 HD1 LYS 34 -18.495 3.655 8.621 265 HE2 LYS 34 HE2 LYS 34 -16.845 2.140 7.643 266 HE3 LYS 34 HE1 LYS 34 -16.855 3.089 6.153 267 HZ1 LYS 34 HZ1 LYS 34 -16.140 5.024 7.515 268 HZ2 LYS 34 HZ2 LYS 34 -14.992 3.780 7.431 269 HZ3 LYS 34 HZ3 LYS 34 -15.932 3.980 8.831 270 H GLN 35 HN GLN 35 -21.535 -0.656 8.410 271 HA GLN 35 HA GLN 35 -20.126 -2.477 10.068 272 HB2 GLN 35 HB2 GLN 35 -22.291 -1.360 10.653 273 HB3 GLN 35 HB1 GLN 35 -23.098 -2.389 9.483 274 HG2 GLN 35 HG2 GLN 35 -23.446 -3.294 11.658 275 HG3 GLN 35 HG1 GLN 35 -22.351 -4.364 10.781 276 HE21 GLN 35 HE21 GLN 35 -20.262 -4.617 11.494 277 HE22 GLN 35 HE22 GLN 35 -19.685 -3.949 12.983 278 H TYR 36 HN TYR 36 -21.771 -2.691 7.023 279 HA TYR 36 HA TYR 36 -21.926 -5.519 6.832 280 HB2 TYR 36 HB2 TYR 36 -23.369 -4.222 5.429 281 HB3 TYR 36 HB1 TYR 36 -22.029 -3.262 4.826 282 HD1 TYR 36 HD1 TYR 36 -23.635 -6.541 4.691 283 HD2 TYR 36 HD2 TYR 36 -20.731 -3.985 2.947 284 HE1 TYR 36 HE1 TYR 36 -23.467 -8.074 2.780 285 HE2 TYR 36 HE2 TYR 36 -20.562 -5.487 1.003 286 HH TYR 36 HH TYR 36 -20.986 -7.815 0.433 287 H ALA 37 HN ALA 37 -19.676 -3.108 5.503 288 HA ALA 37 HA ALA 37 -17.922 -4.988 4.289 289 HB1 ALA 37 HB1 ALA 37 -18.079 -2.632 3.599 290 HB2 ALA 37 HB2 ALA 37 -16.422 -3.080 4.009 291 HB3 ALA 37 HB3 ALA 37 -17.389 -2.136 5.143 292 H ASN 38 HN ASN 38 -18.079 -3.410 7.416 293 HA ASN 38 HA ASN 38 -15.618 -3.927 8.541 294 HB2 ASN 38 HB2 ASN 38 -17.250 -2.628 9.780 295 HB3 ASN 38 HB1 ASN 38 -18.370 -3.987 9.833 296 HD21 ASN 38 HD21 ASN 38 -18.077 -5.621 11.344 297 HD22 ASN 38 HD22 ASN 38 -16.902 -5.497 12.673 298 H ASP 39 HN ASP 39 -18.439 -6.091 8.622 299 HA ASP 39 HA ASP 39 -17.067 -8.139 10.039 300 HB2 ASP 39 HB2 ASP 39 -19.699 -8.033 8.590 301 HB3 ASP 39 HB1 ASP 39 -19.108 -9.520 9.326 302 H ASN 40 HN ASN 40 -16.768 -7.165 6.885 303 HA ASN 40 HA ASN 40 -15.931 -9.844 6.027 304 HB2 ASN 40 HB2 ASN 40 -16.806 -7.397 4.506 305 HB3 ASN 40 HB1 ASN 40 -15.893 -8.677 3.727 306 HD21 ASN 40 HD21 ASN 40 -18.955 -7.714 5.022 307 HD22 ASN 40 HD22 ASN 40 -19.842 -9.178 4.551 308 H GLY 41 HN GLY 41 -14.674 -7.295 7.511 309 HA2 GLY 41 HA2 GLY 41 -12.521 -6.620 7.883 310 HA3 GLY 41 HA1 GLY 41 -12.002 -7.958 6.869 311 H VAL 42 HN VAL 42 -14.182 -5.577 5.550 312 HA VAL 42 HA VAL 42 -11.950 -4.623 3.919 313 HB VAL 42 HB VAL 42 -14.889 -4.731 3.214 314 HG11 VAL 42 HG11 VAL 42 -14.109 -4.066 0.961 315 HG12 VAL 42 HG12 VAL 42 -12.474 -3.879 1.603 316 HG13 VAL 42 HG13 VAL 42 -13.774 -2.835 2.179 317 HG21 VAL 42 HG21 VAL 42 -12.534 -6.395 2.322 318 HG22 VAL 42 HG22 VAL 42 -14.121 -6.416 1.547 319 HG23 VAL 42 HG23 VAL 42 -13.952 -6.940 3.225 320 H ASP 43 HN ASP 43 -11.315 -2.697 4.325 321 HA ASP 43 HA ASP 43 -13.208 -0.517 4.560 322 HB2 ASP 43 HB2 ASP 43 -12.561 -1.260 6.942 323 HB3 ASP 43 HB1 ASP 43 -10.940 -0.685 6.560 324 H GLY 44 HN GLY 44 -12.275 1.436 3.749 325 HA2 GLY 44 HA2 GLY 44 -9.567 1.609 2.983 326 HA3 GLY 44 HA1 GLY 44 -10.523 1.016 1.633 327 H GLU 45 HN GLU 45 -9.579 3.146 0.796 328 HA GLU 45 HA GLU 45 -10.619 5.623 1.641 329 HB2 GLU 45 HB2 GLU 45 -8.694 5.349 0.082 330 HB3 GLU 45 HB1 GLU 45 -9.806 4.798 -1.162 331 HG2 GLU 45 HG2 GLU 45 -10.887 6.948 -1.222 332 HG3 GLU 45 HG1 GLU 45 -9.931 7.505 0.149 333 H TRP 46 HN TRP 46 -12.753 5.878 1.909 334 HA TRP 46 HA TRP 46 -14.680 4.546 0.335 335 HB2 TRP 46 HB2 TRP 46 -14.561 6.311 2.700 336 HB3 TRP 46 HB1 TRP 46 -16.046 6.336 1.794 337 HD1 TRP 46 HD1 TRP 46 -13.728 3.797 3.523 338 HE1 TRP 46 HE1 TRP 46 -15.131 1.832 4.391 339 HE3 TRP 46 HE3 TRP 46 -18.337 5.182 1.736 340 HZ2 TRP 46 HZ2 TRP 46 -17.787 0.979 4.340 341 HZ3 TRP 46 HZ3 TRP 46 -20.259 3.719 2.215 342 HH2 TRP 46 HH2 TRP 46 -19.979 1.658 3.488 343 H THR 47 HN THR 47 -14.782 5.171 -1.719 344 HA THR 47 HA THR 47 -14.876 8.026 -2.365 345 HB THR 47 HB THR 47 -14.713 7.119 -4.772 346 HG1 THR 47 HG1 THR 47 -13.588 4.845 -3.504 347 HG21 THR 47 HG21 THR 47 -12.868 8.256 -3.694 348 HG22 THR 47 HG22 THR 47 -12.251 6.860 -4.579 349 HG23 THR 47 HG23 THR 47 -12.430 6.783 -2.825 350 H TYR 48 HN TYR 48 -16.525 8.750 -3.946 351 HA TYR 48 HA TYR 48 -18.882 7.088 -4.140 352 HB2 TYR 48 HB2 TYR 48 -19.326 7.983 -1.974 353 HB3 TYR 48 HB1 TYR 48 -18.924 9.611 -2.460 354 HD1 TYR 48 HD1 TYR 48 -20.639 11.041 -3.467 355 HD2 TYR 48 HD2 TYR 48 -21.388 6.885 -2.831 356 HE1 TYR 48 HE1 TYR 48 -23.005 11.388 -3.963 357 HE2 TYR 48 HE2 TYR 48 -23.768 7.242 -3.334 358 HH TYR 48 HH TYR 48 -24.937 10.157 -4.696 359 H ASP 49 HN ASP 49 -20.315 7.731 -5.739 360 HA ASP 49 HA ASP 49 -19.530 10.156 -7.260 361 HB2 ASP 49 HB2 ASP 49 -18.861 7.960 -8.440 362 HB3 ASP 49 HB1 ASP 49 -20.585 7.647 -8.614 363 H ASP 50 HN ASP 50 -21.278 11.471 -7.822 364 HA ASP 50 HA ASP 50 -23.718 10.849 -6.321 365 HB2 ASP 50 HB2 ASP 50 -24.283 13.197 -6.614 366 HB3 ASP 50 HB1 ASP 50 -22.531 13.190 -6.360 367 H ALA 51 HN ALA 51 -22.630 10.529 -9.544 368 HA ALA 51 HA ALA 51 -25.157 10.996 -10.802 369 HB1 ALA 51 HB1 ALA 51 -24.133 10.130 -12.810 370 HB2 ALA 51 HB2 ALA 51 -22.774 9.499 -11.882 371 HB3 ALA 51 HB3 ALA 51 -23.027 11.240 -12.004 372 H THR 52 HN THR 52 -23.494 8.114 -9.592 373 HA THR 52 HA THR 52 -25.838 6.538 -10.422 374 HB THR 52 HB THR 52 -24.217 4.571 -10.170 375 HG1 THR 52 HG1 THR 52 -22.135 6.362 -10.717 376 HG21 THR 52 HG21 THR 52 -23.302 4.915 -12.420 377 HG22 THR 52 HG22 THR 52 -23.711 6.628 -12.333 378 HG23 THR 52 HG23 THR 52 -24.992 5.413 -12.345 379 H LYS 53 HN LYS 53 -24.536 7.837 -7.652 380 HA LYS 53 HA LYS 53 -24.824 7.444 -5.397 381 HB2 LYS 53 HB2 LYS 53 -27.060 5.763 -6.528 382 HB3 LYS 53 HB1 LYS 53 -26.749 5.837 -4.805 383 HG2 LYS 53 HG2 LYS 53 -28.536 7.341 -5.411 384 HG3 LYS 53 HG1 LYS 53 -27.149 8.247 -4.818 385 HD2 LYS 53 HD2 LYS 53 -26.520 8.813 -7.104 386 HD3 LYS 53 HD1 LYS 53 -27.861 7.848 -7.727 387 HE2 LYS 53 HE2 LYS 53 -28.160 10.248 -5.925 388 HE3 LYS 53 HE1 LYS 53 -28.335 10.276 -7.680 389 HZ1 LYS 53 HZ1 LYS 53 -30.478 10.098 -6.638 390 HZ2 LYS 53 HZ2 LYS 53 -30.004 8.725 -5.776 391 HZ3 LYS 53 HZ3 LYS 53 -30.143 8.656 -7.462 392 H THR 54 HN THR 54 -22.836 6.025 -6.712 393 HA THR 54 HA THR 54 -22.945 3.308 -5.627 394 HB THR 54 HB THR 54 -20.896 4.431 -7.556 395 HG1 THR 54 HG1 THR 54 -22.628 4.512 -8.826 396 HG21 THR 54 HG21 THR 54 -20.233 2.214 -7.925 397 HG22 THR 54 HG22 THR 54 -21.772 1.563 -7.377 398 HG23 THR 54 HG23 THR 54 -20.612 2.182 -6.199 399 H TYR 55 HN TYR 55 -22.080 3.118 -3.634 400 HA TYR 55 HA TYR 55 -19.849 4.828 -2.821 401 HB2 TYR 55 HB2 TYR 55 -21.599 2.863 -1.348 402 HB3 TYR 55 HB1 TYR 55 -20.011 3.236 -0.708 403 HD1 TYR 55 HD1 TYR 55 -23.368 4.588 -1.416 404 HD2 TYR 55 HD2 TYR 55 -19.537 5.348 0.285 405 HE1 TYR 55 HE1 TYR 55 -24.275 6.571 -0.275 406 HE2 TYR 55 HE2 TYR 55 -20.430 7.335 1.425 407 HH TYR 55 HH TYR 55 -23.696 7.926 1.798 408 H THR 56 HN THR 56 -17.778 4.202 -3.002 409 HA THR 56 HA THR 56 -17.287 1.383 -3.719 410 HB THR 56 HB THR 56 -15.714 3.786 -4.691 411 HG1 THR 56 HG1 THR 56 -18.046 3.240 -5.454 412 HG21 THR 56 HG21 THR 56 -14.408 1.707 -4.603 413 HG22 THR 56 HG22 THR 56 -14.730 2.178 -6.272 414 HG23 THR 56 HG23 THR 56 -15.659 0.878 -5.525 415 H VAL 57 HN VAL 57 -16.081 0.325 -2.303 416 HA VAL 57 HA VAL 57 -14.243 1.883 -0.625 417 HB VAL 57 HB VAL 57 -16.061 0.967 0.791 418 HG11 VAL 57 HG11 VAL 57 -16.154 -1.487 1.235 419 HG12 VAL 57 HG12 VAL 57 -15.132 -1.736 -0.175 420 HG13 VAL 57 HG13 VAL 57 -16.739 -1.031 -0.361 421 HG21 VAL 57 HG21 VAL 57 -14.647 -0.119 2.464 422 HG22 VAL 57 HG22 VAL 57 -13.857 1.283 1.740 423 HG23 VAL 57 HG23 VAL 57 -13.390 -0.344 1.245 424 H THR 58 HN THR 58 -12.299 1.625 -1.387 425 HA THR 58 HA THR 58 -11.594 -0.909 -2.678 426 HB THR 58 HB THR 58 -9.853 1.531 -2.777 427 HG1 THR 58 HG1 THR 58 -12.439 1.333 -3.679 428 HG21 THR 58 HG21 THR 58 -10.567 -0.521 -4.880 429 HG22 THR 58 HG22 THR 58 -9.181 -0.665 -3.798 430 HG23 THR 58 HG23 THR 58 -9.267 0.671 -4.948 431 H GLU 59 HN GLU 59 -10.248 -2.274 -1.728 432 HA GLU 59 HA GLU 59 -9.235 -1.689 0.900 433 HB2 GLU 59 HB2 GLU 59 -10.211 -3.910 0.095 434 HB3 GLU 59 HB1 GLU 59 -8.713 -4.130 -0.795 435 HG2 GLU 59 HG2 GLU 59 -8.603 -3.689 2.144 436 HG3 GLU 59 HG1 GLU 59 -9.072 -5.257 1.508 437 H GLY 60 HN GLY 60 -7.637 -0.043 0.537 438 HA2 GLY 60 HA2 GLY 60 -5.063 -0.429 0.572 439 HA3 GLY 60 HA1 GLY 60 -5.331 -0.784 -1.133 440 H SER 61 HN SER 61 -3.652 1.198 -0.675 441 HA SER 61 HA SER 61 -5.259 3.613 -1.202 442 HB2 SER 61 HB2 SER 61 -4.143 3.682 1.029 443 HB3 SER 61 HB1 SER 61 -2.585 3.524 0.222 444 HG SER 61 HG SER 61 -3.837 5.516 -0.962 445 H GLY 62 HN GLY 62 -2.478 1.655 -1.979 446 HA2 GLY 62 HA2 GLY 62 -2.392 2.775 -4.626 447 HA3 GLY 62 HA1 GLY 62 -0.989 3.203 -3.653 448 H GLY 63 HN GLY 63 -0.146 1.928 -5.668 449 HA2 GLY 63 HA2 GLY 63 0.051 -0.919 -4.883 450 HA3 GLY 63 HA1 GLY 63 -0.006 -0.402 -6.564 451 H ALA 64 HN ALA 64 1.645 1.987 -5.816 452 HA ALA 64 HA ALA 64 3.803 2.658 -5.750 453 HB1 ALA 64 HB1 ALA 64 5.451 1.364 -4.505 454 HB2 ALA 64 HB2 ALA 64 4.353 -0.015 -4.461 455 HB3 ALA 64 HB3 ALA 64 3.932 1.475 -3.617 456 H GLY 65 HN GLY 65 6.165 1.698 -6.343 457 HA2 GLY 65 HA2 GLY 65 6.087 1.225 -9.108 458 HA3 GLY 65 HA1 GLY 65 7.503 1.048 -8.083 459 H GLY 66 HN GLY 66 6.184 -0.550 -10.355 460 HA2 GLY 66 HA2 GLY 66 5.640 -3.097 -9.068 461 HA3 GLY 66 HA1 GLY 66 5.578 -2.762 -10.792 462 H GLN 67 HN GLN 67 8.383 -1.506 -10.369 463 HA GLN 67 HA GLN 67 9.951 -3.913 -9.916 464 HB2 GLN 67 HB2 GLN 67 9.353 -3.971 -12.333 465 HB3 GLN 67 HB1 GLN 67 10.114 -2.372 -12.535 466 HG2 GLN 67 HG2 GLN 67 11.542 -4.261 -13.264 467 HG3 GLN 67 HG1 GLN 67 12.272 -3.276 -11.998 468 HE21 GLN 67 HE21 GLN 67 10.845 -6.361 -12.773 469 HE22 GLN 67 HE22 GLN 67 11.381 -7.176 -11.338 470 H GLY 68 HN GLY 68 11.990 -3.499 -9.228 471 HA2 GLY 68 HA2 GLY 68 13.761 -1.570 -9.430 472 HA3 GLY 68 HA1 GLY 68 12.543 -0.723 -8.479 473 H MET 69 HN MET 69 13.710 -4.068 -8.395 474 HA MET 69 HA MET 69 13.745 -3.986 -5.500 475 HB2 MET 69 HB2 MET 69 14.665 -6.317 -7.196 476 HB3 MET 69 HB1 MET 69 14.115 -6.334 -5.528 477 HG2 MET 69 HG2 MET 69 12.396 -5.714 -7.917 478 HG3 MET 69 HG1 MET 69 12.446 -7.248 -7.051 479 HE1 MET 69 HE1 MET 69 9.750 -5.508 -7.598 480 HE2 MET 69 HE2 MET 69 8.957 -5.777 -6.047 481 HE3 MET 69 HE3 MET 69 9.812 -7.099 -6.841 482 H ILE 70 HN ILE 70 15.408 -2.280 -5.571 483 HA ILE 70 HA ILE 70 17.500 -1.512 -5.186 484 HB ILE 70 HB ILE 70 17.927 -4.360 -4.232 485 HG12 ILE 70 HG12 ILE 70 17.099 -1.869 -2.715 486 HG13 ILE 70 HG11 ILE 70 16.019 -3.176 -3.188 487 HG21 ILE 70 HG21 ILE 70 19.728 -3.440 -2.813 488 HG22 ILE 70 HG22 ILE 70 19.488 -1.846 -3.516 489 HG23 ILE 70 HG23 ILE 70 20.088 -3.169 -4.521 490 HD11 ILE 70 HD11 ILE 70 17.283 -4.717 -1.761 491 HD12 ILE 70 HD12 ILE 70 16.636 -3.354 -0.846 492 HD13 ILE 70 HD13 ILE 70 18.344 -3.390 -1.287 493 H GLN 71 HN GLN 71 18.017 -1.175 -7.443 494 HA GLN 71 HA GLN 71 20.047 -3.090 -8.408 495 HB2 GLN 71 HB2 GLN 71 17.761 -3.100 -9.619 496 HB3 GLN 71 HB1 GLN 71 18.244 -1.546 -10.267 497 HG2 GLN 71 HG2 GLN 71 18.690 -3.291 -11.850 498 HG3 GLN 71 HG1 GLN 71 20.207 -2.583 -11.296 499 HE21 GLN 71 HE21 GLN 71 18.336 -4.813 -9.363 500 HE22 GLN 71 HE22 GLN 71 19.446 -6.136 -9.456 501 H GLU 72 HN GLU 72 20.038 -0.469 -6.940 502 HA GLU 72 HA GLU 72 21.595 1.121 -8.857 503 HB2 GLU 72 HB2 GLU 72 20.209 2.074 -6.349 504 HB3 GLU 72 HB1 GLU 72 21.027 3.075 -7.542 505 HG2 GLU 72 HG2 GLU 72 19.381 2.205 -9.232 506 HG3 GLU 72 HG1 GLU 72 18.486 1.513 -7.883 507 HA PRO 73 HA PRO 73 25.191 0.578 -6.341 508 HB2 PRO 73 HB2 PRO 73 26.508 2.936 -6.661 509 HB3 PRO 73 HB1 PRO 73 26.331 1.735 -7.997 510 HG2 PRO 73 HG2 PRO 73 24.739 4.235 -7.466 511 HG3 PRO 73 HG1 PRO 73 25.394 3.627 -9.003 512 HD2 PRO 73 HD2 PRO 73 22.796 3.305 -8.270 513 HD3 PRO 73 HD1 PRO 73 23.681 2.116 -9.282 514 H ALA 74 HN ALA 74 26.652 1.900 -4.786 515 HA ALA 74 HA ALA 74 27.005 2.863 -2.785 516 HB1 ALA 74 HB1 ALA 74 25.900 4.848 -3.745 517 HB2 ALA 74 HB2 ALA 74 25.631 4.690 -2.009 518 HB3 ALA 74 HB3 ALA 74 24.355 4.251 -3.143 519 H LEU 75 HN LEU 75 25.778 3.177 -0.521 520 HA LEU 75 HA LEU 75 24.575 0.567 0.001 521 HB2 LEU 75 HB2 LEU 75 25.943 2.572 1.741 522 HB3 LEU 75 HB1 LEU 75 24.929 1.353 2.445 523 HG LEU 75 HG LEU 75 27.150 0.571 2.625 524 HD11 LEU 75 HD11 LEU 75 25.541 -1.125 1.938 525 HD12 LEU 75 HD12 LEU 75 27.139 -1.463 1.276 526 HD13 LEU 75 HD13 LEU 75 25.883 -0.780 0.241 527 HD21 LEU 75 HD21 LEU 75 27.460 1.177 -0.320 528 HD22 LEU 75 HD22 LEU 75 28.653 0.370 0.693 529 HD23 LEU 75 HD23 LEU 75 28.214 2.047 1.016 530 HA PRO 76 HA PRO 76 20.649 2.566 0.595 531 HB2 PRO 76 HB2 PRO 76 19.286 0.392 1.518 532 HB3 PRO 76 HB1 PRO 76 19.662 0.634 -0.167 533 HG2 PRO 76 HG2 PRO 76 20.894 -1.221 1.770 534 HG3 PRO 76 HG1 PRO 76 20.751 -1.346 -0.018 535 HD2 PRO 76 HD2 PRO 76 23.049 -0.586 1.454 536 HD3 PRO 76 HD1 PRO 76 22.828 -0.428 -0.295 537 HA PRO 77 HA PRO 77 20.344 4.028 4.750 538 HB2 PRO 77 HB2 PRO 77 17.500 3.056 4.487 539 HB3 PRO 77 HB1 PRO 77 18.078 4.580 5.180 540 HG2 PRO 77 HG2 PRO 77 17.149 4.636 2.750 541 HG3 PRO 77 HG1 PRO 77 18.706 5.422 3.083 542 HD2 PRO 77 HD2 PRO 77 18.183 2.779 1.729 543 HD3 PRO 77 HD1 PRO 77 19.397 4.054 1.340 544 H GLY 78 HN GLY 78 20.854 3.168 6.663 545 HA2 GLY 78 HA2 GLY 78 20.926 1.676 8.424 546 HA3 GLY 78 HA1 GLY 78 19.658 0.753 7.646 547 H TRP 79 HN TRP 79 22.191 1.001 5.414 548 HA TRP 79 HA TRP 79 23.222 -1.626 6.289 549 HB2 TRP 79 HB2 TRP 79 23.107 -0.291 3.592 550 HB3 TRP 79 HB1 TRP 79 24.074 -1.724 3.882 551 HD1 TRP 79 HD1 TRP 79 20.400 -0.568 3.992 552 HE1 TRP 79 HE1 TRP 79 18.908 -2.571 3.415 553 HE3 TRP 79 HE3 TRP 79 23.979 -4.198 3.875 554 HZ2 TRP 79 HZ2 TRP 79 19.204 -5.370 3.054 555 HZ3 TRP 79 HZ3 TRP 79 23.296 -6.518 3.440 556 HH2 TRP 79 HH2 TRP 79 20.961 -7.095 3.040 557 H GLU 80 HN GLU 80 25.426 -1.974 6.574 558 HA GLU 80 HA GLU 80 27.215 0.285 5.976 559 HB2 GLU 80 HB2 GLU 80 27.371 -1.613 8.338 560 HB3 GLU 80 HB1 GLU 80 28.549 -0.365 7.977 561 HG2 GLU 80 HG2 GLU 80 26.880 1.350 8.388 562 HG3 GLU 80 HG1 GLU 80 25.663 0.109 8.687 563 H MET 81 HN MET 81 29.018 -0.243 4.842 564 HA MET 81 HA MET 81 29.540 -3.110 4.416 565 HB2 MET 81 HB2 MET 81 28.857 -1.966 2.319 566 HB3 MET 81 HB1 MET 81 30.228 -0.836 2.523 567 HG2 MET 81 HG2 MET 81 31.782 -2.724 2.392 568 HG3 MET 81 HG1 MET 81 30.427 -3.829 2.181 569 HE1 MET 81 HE1 MET 81 32.530 -0.937 0.650 570 HE2 MET 81 HE2 MET 81 30.921 -0.215 0.572 571 HE3 MET 81 HE3 MET 81 31.760 -0.672 -0.914 572 H LYS 82 HN LYS 82 31.275 -3.658 5.651 573 HA LYS 82 HA LYS 82 33.497 -1.772 5.738 574 HB2 LYS 82 HB2 LYS 82 32.478 -3.031 8.306 575 HB3 LYS 82 HB1 LYS 82 33.742 -1.831 8.136 576 HG2 LYS 82 HG2 LYS 82 32.067 -0.222 7.281 577 HG3 LYS 82 HG1 LYS 82 30.809 -1.444 7.600 578 HD2 LYS 82 HD2 LYS 82 32.662 -0.389 9.730 579 HD3 LYS 82 HD1 LYS 82 31.090 0.325 9.367 580 HE2 LYS 82 HE2 LYS 82 30.202 -2.084 9.691 581 HE3 LYS 82 HE1 LYS 82 31.734 -2.358 10.517 582 HZ1 LYS 82 HZ1 LYS 82 30.202 -1.744 12.168 583 HZ2 LYS 82 HZ2 LYS 82 29.577 -0.462 11.244 584 HZ3 LYS 82 HZ3 LYS 82 31.137 -0.349 11.907 585 H TYR 83 HN TYR 83 35.524 -2.841 6.488 586 HA TYR 83 HA TYR 83 35.458 -5.678 5.664 587 HB2 TYR 83 HB2 TYR 83 37.538 -3.523 5.168 588 HB3 TYR 83 HB1 TYR 83 37.904 -5.254 4.974 589 HD1 TYR 83 HD1 TYR 83 37.952 -5.929 2.796 590 HD2 TYR 83 HD2 TYR 83 35.141 -2.928 3.887 591 HE1 TYR 83 HE1 TYR 83 37.166 -5.823 0.466 592 HE2 TYR 83 HE2 TYR 83 34.347 -2.821 1.574 593 HH TYR 83 HH TYR 83 35.187 -5.140 -0.777 594 H THR 84 HN THR 84 36.885 -7.108 6.730 595 HA THR 84 HA THR 84 37.439 -6.431 9.475 596 HB THR 84 HB THR 84 38.079 -8.744 9.755 597 HG1 THR 84 HG1 THR 84 38.234 -10.106 7.832 598 HG21 THR 84 HG21 THR 84 35.798 -8.617 7.769 599 HG22 THR 84 HG22 THR 84 35.669 -8.384 9.512 600 HG23 THR 84 HG23 THR 84 36.137 -9.956 8.865 601 H SER 85 HN SER 85 39.802 -7.233 10.255 602 HA SER 85 HA SER 85 41.591 -5.369 9.026 603 HB2 SER 85 HB2 SER 85 43.205 -6.308 10.783 604 HB3 SER 85 HB1 SER 85 41.743 -5.516 11.370 605 HG SER 85 HG SER 85 41.912 -7.410 12.488 606 H GLU 86 HN GLU 86 40.745 -8.131 7.774 607 HA GLU 86 HA GLU 86 43.484 -8.806 6.847 608 HB2 GLU 86 HB2 GLU 86 41.107 -10.679 7.133 609 HB3 GLU 86 HB1 GLU 86 42.691 -11.132 6.518 610 HG2 GLU 86 HG2 GLU 86 43.649 -10.501 8.729 611 HG3 GLU 86 HG1 GLU 86 42.005 -10.236 9.307 612 H GLY 87 HN GLY 87 40.735 -7.274 6.038 613 HA2 GLY 87 HA2 GLY 87 40.237 -6.397 3.923 614 HA3 GLY 87 HA1 GLY 87 41.233 -7.649 3.198 615 H VAL 88 HN VAL 88 39.003 -8.877 5.444 616 HA VAL 88 HA VAL 88 37.497 -10.118 3.311 617 HB VAL 88 HB VAL 88 37.211 -10.390 6.312 618 HG11 VAL 88 HG11 VAL 88 35.121 -10.902 5.147 619 HG12 VAL 88 HG12 VAL 88 35.845 -12.348 5.846 620 HG13 VAL 88 HG13 VAL 88 35.979 -12.043 4.114 621 HG21 VAL 88 HG21 VAL 88 38.304 -12.542 6.011 622 HG22 VAL 88 HG22 VAL 88 39.341 -11.227 5.457 623 HG23 VAL 88 HG23 VAL 88 38.479 -12.224 4.285 624 H ARG 89 HN ARG 89 35.409 -9.708 2.775 625 HA ARG 89 HA ARG 89 34.402 -7.091 3.581 626 HB2 ARG 89 HB2 ARG 89 34.656 -7.773 1.175 627 HB3 ARG 89 HB1 ARG 89 33.385 -8.953 1.427 628 HG2 ARG 89 HG2 ARG 89 31.834 -7.127 1.990 629 HG3 ARG 89 HG1 ARG 89 33.117 -5.963 1.647 630 HD2 ARG 89 HD2 ARG 89 33.282 -6.913 -0.646 631 HD3 ARG 89 HD1 ARG 89 31.889 -7.924 -0.287 632 HE ARG 89 HE ARG 89 31.559 -5.048 0.020 633 HH11 ARG 89 HH11 ARG 89 31.014 -7.934 -1.903 634 HH12 ARG 89 HH12 ARG 89 29.766 -7.188 -2.857 635 HH21 ARG 89 HH21 ARG 89 29.919 -4.087 -1.259 636 HH22 ARG 89 HH22 ARG 89 29.135 -5.031 -2.496 637 H TYR 90 HN TYR 90 32.792 -6.872 5.043 638 HA TYR 90 HA TYR 90 30.764 -8.980 5.137 639 HB2 TYR 90 HB2 TYR 90 30.693 -9.070 7.534 640 HB3 TYR 90 HB1 TYR 90 32.348 -9.337 7.045 641 HD1 TYR 90 HD1 TYR 90 34.037 -7.523 7.363 642 HD2 TYR 90 HD2 TYR 90 30.106 -7.265 8.960 643 HE1 TYR 90 HE1 TYR 90 34.773 -5.715 8.856 644 HE2 TYR 90 HE2 TYR 90 30.828 -5.455 10.465 645 HH TYR 90 HH TYR 90 32.810 -4.555 11.443 646 H PHE 91 HN PHE 91 28.667 -8.208 6.061 647 HA PHE 91 HA PHE 91 28.415 -5.291 5.738 648 HB2 PHE 91 HB2 PHE 91 26.627 -7.499 4.768 649 HB3 PHE 91 HB1 PHE 91 25.963 -5.920 5.137 650 HD1 PHE 91 HD1 PHE 91 25.815 -4.378 3.402 651 HD2 PHE 91 HD2 PHE 91 28.771 -7.437 3.235 652 HE1 PHE 91 HE1 PHE 91 26.491 -3.605 1.169 653 HE2 PHE 91 HE2 PHE 91 29.454 -6.662 1.005 654 HZ PHE 91 HZ PHE 91 28.197 -4.696 -0.047 655 H VAL 92 HN VAL 92 26.687 -4.310 6.985 656 HA VAL 92 HA VAL 92 26.066 -5.832 9.428 657 HB VAL 92 HB VAL 92 26.704 -2.886 9.291 658 HG11 VAL 92 HG11 VAL 92 26.731 -2.997 11.729 659 HG12 VAL 92 HG12 VAL 92 26.241 -4.691 11.652 660 HG13 VAL 92 HG13 VAL 92 25.152 -3.428 11.072 661 HG21 VAL 92 HG21 VAL 92 28.367 -5.167 10.336 662 HG22 VAL 92 HG22 VAL 92 28.759 -3.455 10.496 663 HG23 VAL 92 HG23 VAL 92 28.704 -4.200 8.899 664 H ASP 93 HN ASP 93 23.924 -6.193 9.458 665 HA ASP 93 HA ASP 93 22.038 -4.385 8.172 666 HB2 ASP 93 HB2 ASP 93 21.797 -6.992 9.686 667 HB3 ASP 93 HB1 ASP 93 20.411 -5.903 9.694 668 H HIS 94 HN HIS 94 22.373 -2.384 9.253 669 HA HIS 94 HA HIS 94 22.462 -2.198 12.101 670 HB2 HIS 94 HB2 HIS 94 23.526 -0.589 10.458 671 HB3 HIS 94 HB1 HIS 94 21.911 0.047 10.150 672 HD1 HIS 94 HD1 HIS 94 21.587 2.162 11.396 673 HD2 HIS 94 HD2 HIS 94 23.938 -0.526 13.517 674 HE1 HIS 94 HE1 HIS 94 22.172 3.326 13.545 675 HE2 HIS 94 HE2 HIS 94 23.802 1.776 14.684 676 H ASN 95 HN ASN 95 19.963 -2.621 9.938 677 HA ASN 95 HA ASN 95 17.907 -1.137 11.246 678 HB2 ASN 95 HB2 ASN 95 16.363 -2.505 9.826 679 HB3 ASN 95 HB1 ASN 95 17.641 -1.740 8.886 680 HD21 ASN 95 HD21 ASN 95 19.174 -3.011 7.885 681 HD22 ASN 95 HD22 ASN 95 19.056 -4.741 7.786 682 H THR 96 HN THR 96 19.107 -4.445 11.426 683 HA THR 96 HA THR 96 17.284 -4.933 13.684 684 HB THR 96 HB THR 96 18.088 -7.394 13.210 685 HG1 THR 96 HG1 THR 96 18.241 -6.454 10.556 686 HG21 THR 96 HG21 THR 96 15.775 -6.565 12.954 687 HG22 THR 96 HG22 THR 96 16.209 -7.712 11.689 688 HG23 THR 96 HG23 THR 96 16.175 -5.983 11.336 689 H ARG 97 HN ARG 97 20.384 -4.175 12.895 690 HA ARG 97 HA ARG 97 22.386 -4.103 13.925 691 HB2 ARG 97 HB2 ARG 97 20.717 -4.582 16.384 692 HB3 ARG 97 HB1 ARG 97 22.446 -4.230 16.417 693 HG2 ARG 97 HG2 ARG 97 21.866 -2.165 15.045 694 HG3 ARG 97 HG1 ARG 97 20.192 -2.470 15.501 695 HD2 ARG 97 HD2 ARG 97 20.960 -0.946 17.096 696 HD3 ARG 97 HD1 ARG 97 21.051 -2.507 17.907 697 HE ARG 97 HE ARG 97 23.533 -2.029 16.715 698 HH11 ARG 97 HH11 ARG 97 21.521 -0.680 19.248 699 HH12 ARG 97 HH12 ARG 97 22.862 -0.014 20.131 700 HH21 ARG 97 HH21 ARG 97 25.312 -1.181 17.908 701 HH22 ARG 97 HH22 ARG 97 25.005 -0.329 19.394 702 H THR 98 HN THR 98 22.719 -5.941 12.630 703 HA THR 98 HA THR 98 23.932 -8.061 14.205 704 HB THR 98 HB THR 98 21.535 -8.808 13.718 705 HG1 THR 98 HG1 THR 98 22.256 -10.897 12.949 706 HG21 THR 98 HG21 THR 98 22.599 -8.927 10.890 707 HG22 THR 98 HG22 THR 98 21.347 -7.827 11.467 708 HG23 THR 98 HG23 THR 98 21.048 -9.568 11.429 709 H THR 99 HN THR 99 25.233 -9.518 12.704 710 HA THR 99 HA THR 99 26.304 -7.884 10.491 711 HB THR 99 HB THR 99 28.271 -9.601 10.676 712 HG1 THR 99 HG1 THR 99 27.209 -11.082 12.043 713 HG21 THR 99 HG21 THR 99 29.284 -8.331 12.623 714 HG22 THR 99 HG22 THR 99 27.711 -7.579 12.889 715 HG23 THR 99 HG23 THR 99 28.590 -7.271 11.390 716 H THR 100 HN THR 100 26.513 -8.795 8.391 717 HA THR 100 HA THR 100 25.631 -11.542 7.997 718 HB THR 100 HB THR 100 23.557 -10.117 7.956 719 HG1 THR 100 HG1 THR 100 22.840 -10.984 5.873 720 HG21 THR 100 HG21 THR 100 24.776 -8.985 5.430 721 HG22 THR 100 HG22 THR 100 24.530 -8.102 6.936 722 HG23 THR 100 HG23 THR 100 23.141 -8.684 6.017 723 H PHE 101 HN PHE 101 26.552 -12.469 6.194 724 HA PHE 101 HA PHE 101 28.459 -10.794 4.745 725 HB2 PHE 101 HB2 PHE 101 28.160 -13.782 5.095 726 HB3 PHE 101 HB1 PHE 101 29.204 -13.082 3.792 727 HD1 PHE 101 HD1 PHE 101 31.355 -12.283 4.297 728 HD2 PHE 101 HD2 PHE 101 28.686 -13.236 7.474 729 HE1 PHE 101 HE1 PHE 101 33.204 -12.064 5.914 730 HE2 PHE 101 HE2 PHE 101 30.529 -13.014 9.096 731 HZ PHE 101 HZ PHE 101 32.790 -12.427 8.312 732 H LYS 102 HN LYS 102 27.325 -9.737 3.178 733 HA LYS 102 HA LYS 102 25.805 -11.393 1.295 734 HB2 LYS 102 HB2 LYS 102 25.388 -8.574 2.248 735 HB3 LYS 102 HB1 LYS 102 24.683 -9.148 0.748 736 HG2 LYS 102 HG2 LYS 102 24.196 -10.304 3.485 737 HG3 LYS 102 HG1 LYS 102 23.086 -9.274 2.575 738 HD2 LYS 102 HD2 LYS 102 24.071 -11.992 1.704 739 HD3 LYS 102 HD1 LYS 102 22.491 -11.659 2.414 740 HE2 LYS 102 HE2 LYS 102 21.926 -10.227 0.528 741 HE3 LYS 102 HE1 LYS 102 23.529 -10.481 -0.160 742 HZ1 LYS 102 HZ1 LYS 102 21.525 -12.621 0.301 743 HZ2 LYS 102 HZ2 LYS 102 23.036 -12.802 -0.446 744 HZ3 LYS 102 HZ3 LYS 102 21.826 -11.885 -1.193 745 H ASP 103 HN ASP 103 27.430 -11.845 -0.136 746 HA ASP 103 HA ASP 103 28.565 -9.534 -1.562 747 HB2 ASP 103 HB2 ASP 103 30.239 -10.907 -0.220 748 HB3 ASP 103 HB1 ASP 103 29.894 -12.241 -1.320 749 HA PRO 104 HA PRO 104 26.424 -11.139 -5.083 750 HB2 PRO 104 HB2 PRO 104 28.604 -10.125 -6.792 751 HB3 PRO 104 HB1 PRO 104 26.920 -9.608 -6.741 752 HG2 PRO 104 HG2 PRO 104 28.980 -8.105 -5.811 753 HG3 PRO 104 HG1 PRO 104 27.337 -7.998 -5.158 754 HD2 PRO 104 HD2 PRO 104 29.759 -9.293 -4.031 755 HD3 PRO 104 HD1 PRO 104 28.394 -8.530 -3.194 756 H ARG 105 HN ARG 105 29.628 -12.097 -4.269 757 HA ARG 105 HA ARG 105 29.615 -14.145 -6.378 758 HB2 ARG 105 HB2 ARG 105 31.887 -13.435 -4.506 759 HB3 ARG 105 HB1 ARG 105 31.971 -14.499 -5.902 760 HG2 ARG 105 HG2 ARG 105 31.382 -11.541 -6.015 761 HG3 ARG 105 HG1 ARG 105 32.956 -12.283 -6.330 762 HD2 ARG 105 HD2 ARG 105 30.595 -13.249 -7.866 763 HD3 ARG 105 HD1 ARG 105 31.279 -11.679 -8.279 764 HE ARG 105 HE ARG 105 33.355 -13.582 -8.122 765 HH11 ARG 105 HH11 ARG 105 30.593 -12.782 -10.159 766 HH12 ARG 105 HH12 ARG 105 31.367 -13.325 -11.612 767 HH21 ARG 105 HH21 ARG 105 34.354 -14.284 -10.013 768 HH22 ARG 105 HH22 ARG 105 33.515 -14.184 -11.538 769 HA PRO 106 HA PRO 106 28.262 -16.664 -2.857 770 HB2 PRO 106 HB2 PRO 106 27.416 -18.834 -4.263 771 HB3 PRO 106 HB1 PRO 106 26.436 -17.324 -4.129 772 HG2 PRO 106 HG2 PRO 106 28.122 -18.335 -6.386 773 HG3 PRO 106 HG1 PRO 106 26.592 -17.445 -6.426 774 HD2 PRO 106 HD2 PRO 106 29.106 -16.347 -6.843 775 HD3 PRO 106 HD1 PRO 106 27.635 -15.426 -6.379 776 H GLY 107 HN GLY 107 29.488 -18.005 -1.632 777 HA2 GLY 107 HA2 GLY 107 31.174 -19.461 -1.051 778 HA3 GLY 107 HA1 GLY 107 31.158 -20.050 -2.729 779 H PHE 108 HN PHE 108 31.652 -16.892 -3.191 780 HA PHE 108 HA PHE 108 33.454 -15.504 -3.575 781 HB2 PHE 108 HB2 PHE 108 33.949 -16.411 -1.074 782 HB3 PHE 108 HB1 PHE 108 35.359 -17.110 -1.942 783 HD1 PHE 108 HD1 PHE 108 37.145 -15.735 -2.680 784 HD2 PHE 108 HD2 PHE 108 33.628 -13.970 -1.045 785 HE1 PHE 108 HE1 PHE 108 38.291 -13.574 -2.552 786 HE2 PHE 108 HE2 PHE 108 34.779 -11.799 -0.921 787 HZ PHE 108 HZ PHE 108 37.124 -11.607 -1.631 788 H GLU 109 HN GLU 109 32.786 -17.863 -5.035 789 HA GLU 109 HA GLU 109 33.483 -19.303 -6.631 790 HB2 GLU 109 HB2 GLU 109 34.925 -18.175 -8.398 791 HB3 GLU 109 HB1 GLU 109 33.488 -17.281 -7.920 792 HG2 GLU 109 HG2 GLU 109 34.879 -15.859 -6.483 793 HG3 GLU 109 HG1 GLU 109 36.306 -16.748 -7.005 Start of MODEL 2 1 H1 GLY 1 HT1 GLY 1 -44.532 6.266 -0.407 2 H2 GLY 1 HT2 GLY 1 -44.838 5.459 1.051 3 H3 GLY 1 HT3 GLY 1 -44.133 4.626 -0.249 4 HA2 GLY 1 HA1 GLY 1 -42.905 6.829 1.311 5 HA3 GLY 1 HA2 GLY 1 -42.453 5.131 1.381 6 H SER 2 HN SER 2 -40.448 6.828 0.864 7 HA SER 2 HA SER 2 -39.819 6.212 -1.917 8 HB2 SER 2 HB2 SER 2 -38.983 8.540 -2.295 9 HB3 SER 2 HB1 SER 2 -40.732 8.449 -2.080 10 HG SER 2 HG SER 2 -38.963 8.980 0.068 11 H HIS 3 HN HIS 3 -38.165 4.870 -1.439 12 HA HIS 3 HA HIS 3 -36.064 5.864 0.346 13 HB2 HIS 3 HB2 HIS 3 -35.165 3.561 0.335 14 HB3 HIS 3 HB1 HIS 3 -36.858 3.548 0.799 15 HD1 HIS 3 HD1 HIS 3 -36.937 1.017 0.159 16 HD2 HIS 3 HD2 HIS 3 -36.105 3.563 -3.031 17 HE1 HIS 3 HE1 HIS 3 -37.261 -0.356 -1.921 18 HE2 HIS 3 HE2 HIS 3 -36.509 1.135 -3.803 19 H MET 4 HN MET 4 -33.784 5.450 -0.444 20 HA MET 4 HA MET 4 -33.626 5.760 -3.362 21 HB2 MET 4 HB2 MET 4 -31.543 7.093 -2.969 22 HB3 MET 4 HB1 MET 4 -33.022 7.882 -2.437 23 HG2 MET 4 HG2 MET 4 -32.507 7.072 -0.127 24 HG3 MET 4 HG1 MET 4 -30.940 6.541 -0.735 25 HE1 MET 4 HE1 MET 4 -33.303 9.565 -0.049 26 HE2 MET 4 HE2 MET 4 -32.970 9.799 -1.765 27 HE3 MET 4 HE3 MET 4 -32.337 10.942 -0.583 28 H GLN 5 HN GLN 5 -32.275 4.394 -4.393 29 HA GLN 5 HA GLN 5 -31.168 2.259 -2.764 30 HB2 GLN 5 HB2 GLN 5 -32.686 1.761 -4.675 31 HB3 GLN 5 HB1 GLN 5 -31.483 2.426 -5.768 32 HG2 GLN 5 HG2 GLN 5 -29.905 0.677 -5.078 33 HG3 GLN 5 HG1 GLN 5 -31.137 0.001 -4.015 34 HE21 GLN 5 HE21 GLN 5 -30.122 0.459 -7.299 35 HE22 GLN 5 HE22 GLN 5 -31.243 -0.681 -8.015 36 H TYR 6 HN TYR 6 -29.087 1.813 -2.551 37 HA TYR 6 HA TYR 6 -27.145 3.352 -4.158 38 HB2 TYR 6 HB2 TYR 6 -27.089 2.724 -1.175 39 HB3 TYR 6 HB1 TYR 6 -25.629 3.174 -2.044 40 HD1 TYR 6 HD1 TYR 6 -25.221 5.471 -2.627 41 HD2 TYR 6 HD2 TYR 6 -28.940 4.334 -0.901 42 HE1 TYR 6 HE1 TYR 6 -25.747 7.839 -2.224 43 HE2 TYR 6 HE2 TYR 6 -29.475 6.696 -0.496 44 HH TYR 6 HH TYR 6 -28.416 8.806 -0.253 45 H LYS 7 HN LYS 7 -25.206 2.233 -4.641 46 HA LYS 7 HA LYS 7 -25.208 -0.609 -3.946 47 HB2 LYS 7 HB2 LYS 7 -23.997 -1.018 -6.152 48 HB3 LYS 7 HB1 LYS 7 -25.732 -0.669 -6.255 49 HG2 LYS 7 HG2 LYS 7 -25.311 1.538 -7.004 50 HG3 LYS 7 HG1 LYS 7 -23.587 1.389 -6.683 51 HD2 LYS 7 HD2 LYS 7 -25.185 -0.138 -8.739 52 HD3 LYS 7 HD1 LYS 7 -23.974 1.105 -9.055 53 HE2 LYS 7 HE2 LYS 7 -22.223 -0.291 -8.182 54 HE3 LYS 7 HE1 LYS 7 -23.391 -1.495 -7.640 55 HZ1 LYS 7 HZ1 LYS 7 -22.394 -2.267 -9.635 56 HZ2 LYS 7 HZ2 LYS 7 -22.703 -0.810 -10.451 57 HZ3 LYS 7 HZ3 LYS 7 -23.987 -1.828 -10.016 58 H LEU 8 HN LEU 8 -23.246 -1.597 -3.653 59 HA LEU 8 HA LEU 8 -20.954 0.222 -3.236 60 HB2 LEU 8 HB2 LEU 8 -22.078 -0.236 -1.046 61 HB3 LEU 8 HB1 LEU 8 -21.930 -1.939 -1.363 62 HG LEU 8 HG LEU 8 -19.376 -1.465 -1.459 63 HD11 LEU 8 HD11 LEU 8 -20.345 0.872 0.181 64 HD12 LEU 8 HD12 LEU 8 -19.523 0.966 -1.381 65 HD13 LEU 8 HD13 LEU 8 -18.673 0.333 0.029 66 HD21 LEU 8 HD21 LEU 8 -21.113 -1.618 0.958 67 HD22 LEU 8 HD22 LEU 8 -19.354 -1.630 1.079 68 HD23 LEU 8 HD23 LEU 8 -20.186 -2.894 0.171 69 H ILE 9 HN ILE 9 -19.089 -0.531 -4.032 70 HA ILE 9 HA ILE 9 -18.978 -3.360 -4.846 71 HB ILE 9 HB ILE 9 -17.294 -1.071 -5.907 72 HG12 ILE 9 HG12 ILE 9 -19.542 -2.486 -7.404 73 HG13 ILE 9 HG11 ILE 9 -19.727 -0.913 -6.557 74 HG21 ILE 9 HG21 ILE 9 -16.167 -3.152 -6.077 75 HG22 ILE 9 HG22 ILE 9 -16.749 -2.686 -7.681 76 HG23 ILE 9 HG23 ILE 9 -17.610 -3.919 -6.760 77 HD11 ILE 9 HD11 ILE 9 -17.822 -1.487 -8.830 78 HD12 ILE 9 HD12 ILE 9 -18.043 0.066 -8.024 79 HD13 ILE 9 HD13 ILE 9 -19.363 -0.635 -8.961 80 H LEU 10 HN LEU 10 -17.551 -4.639 -3.865 81 HA LEU 10 HA LEU 10 -15.736 -3.358 -1.956 82 HB2 LEU 10 HB2 LEU 10 -16.437 -6.281 -2.155 83 HB3 LEU 10 HB1 LEU 10 -15.417 -5.548 -0.948 84 HG LEU 10 HG LEU 10 -17.399 -5.962 0.162 85 HD11 LEU 10 HD11 LEU 10 -17.683 -3.117 -0.689 86 HD12 LEU 10 HD12 LEU 10 -16.588 -3.723 0.560 87 HD13 LEU 10 HD13 LEU 10 -18.332 -3.869 0.766 88 HD21 LEU 10 HD21 LEU 10 -19.615 -5.556 -0.615 89 HD22 LEU 10 HD22 LEU 10 -18.757 -6.458 -1.864 90 HD23 LEU 10 HD23 LEU 10 -19.019 -4.720 -2.046 91 H ASN 11 HN ASN 11 -13.991 -2.797 -3.047 92 HA ASN 11 HA ASN 11 -12.747 -4.773 -4.818 93 HB2 ASN 11 HB2 ASN 11 -12.191 -1.841 -4.308 94 HB3 ASN 11 HB1 ASN 11 -11.077 -2.861 -5.183 95 HD21 ASN 11 HD21 ASN 11 -12.473 -0.503 -6.031 96 HD22 ASN 11 HD22 ASN 11 -13.401 -0.959 -7.413 97 H GLY 12 HN GLY 12 -12.182 -6.218 -3.175 98 HA2 GLY 12 HA2 GLY 12 -9.693 -5.473 -1.824 99 HA3 GLY 12 HA1 GLY 12 -11.046 -6.017 -0.804 100 H LYS 13 HN LYS 13 -8.303 -7.113 -1.752 101 HA LYS 13 HA LYS 13 -8.653 -9.434 -3.221 102 HB2 LYS 13 HB2 LYS 13 -6.669 -8.903 -0.994 103 HB3 LYS 13 HB1 LYS 13 -6.536 -10.191 -2.191 104 HG2 LYS 13 HG2 LYS 13 -6.309 -8.605 -3.968 105 HG3 LYS 13 HG1 LYS 13 -6.648 -7.257 -2.880 106 HD2 LYS 13 HD2 LYS 13 -4.231 -7.541 -3.448 107 HD3 LYS 13 HD1 LYS 13 -4.576 -7.601 -1.721 108 HE2 LYS 13 HE2 LYS 13 -4.624 -10.196 -3.102 109 HE3 LYS 13 HE1 LYS 13 -3.048 -9.412 -3.040 110 HZ1 LYS 13 HZ1 LYS 13 -4.759 -9.841 -0.648 111 HZ2 LYS 13 HZ2 LYS 13 -3.142 -9.336 -0.682 112 HZ3 LYS 13 HZ3 LYS 13 -3.544 -10.917 -1.140 113 H THR 14 HN THR 14 -9.643 -8.822 0.028 114 HA THR 14 HA THR 14 -9.897 -11.670 0.641 115 HB THR 14 HB THR 14 -10.862 -10.678 2.822 116 HG1 THR 14 HG1 THR 14 -10.873 -8.559 2.989 117 HG21 THR 14 HG21 THR 14 -8.625 -10.213 3.713 118 HG22 THR 14 HG22 THR 14 -7.990 -10.106 2.072 119 HG23 THR 14 HG23 THR 14 -8.611 -11.641 2.675 120 H LEU 15 HN LEU 15 -11.742 -9.205 -0.763 121 HA LEU 15 HA LEU 15 -14.134 -10.740 -0.816 122 HB2 LEU 15 HB2 LEU 15 -13.872 -9.144 1.409 123 HB3 LEU 15 HB1 LEU 15 -14.738 -8.099 0.313 124 HG LEU 15 HG LEU 15 -16.351 -9.160 1.657 125 HD11 LEU 15 HD11 LEU 15 -16.225 -10.611 -0.969 126 HD12 LEU 15 HD12 LEU 15 -16.952 -9.032 -0.680 127 HD13 LEU 15 HD13 LEU 15 -17.646 -10.474 0.063 128 HD21 LEU 15 HD21 LEU 15 -16.493 -11.604 1.900 129 HD22 LEU 15 HD22 LEU 15 -15.001 -10.938 2.563 130 HD23 LEU 15 HD23 LEU 15 -14.977 -11.765 1.010 131 H LYS 16 HN LYS 16 -14.210 -10.538 -2.981 132 HA LYS 16 HA LYS 16 -14.396 -7.824 -4.096 133 HB2 LYS 16 HB2 LYS 16 -13.487 -10.430 -5.304 134 HB3 LYS 16 HB1 LYS 16 -13.929 -9.057 -6.298 135 HG2 LYS 16 HG2 LYS 16 -12.041 -7.985 -5.860 136 HG3 LYS 16 HG1 LYS 16 -11.935 -8.522 -4.182 137 HD2 LYS 16 HD2 LYS 16 -11.134 -10.664 -4.947 138 HD3 LYS 16 HD1 LYS 16 -11.444 -10.169 -6.612 139 HE2 LYS 16 HE2 LYS 16 -9.593 -8.556 -4.943 140 HE3 LYS 16 HE1 LYS 16 -9.023 -10.062 -5.667 141 HZ1 LYS 16 HZ1 LYS 16 -10.347 -7.926 -7.237 142 HZ2 LYS 16 HZ2 LYS 16 -9.491 -9.262 -7.817 143 HZ3 LYS 16 HZ3 LYS 16 -8.665 -8.006 -7.034 144 H GLY 17 HN GLY 17 -16.337 -7.210 -4.680 145 HA2 GLY 17 HA2 GLY 17 -18.176 -8.607 -6.190 146 HA3 GLY 17 HA1 GLY 17 -18.609 -8.911 -4.510 147 H GLU 18 HN GLU 18 -20.605 -7.760 -5.288 148 HA GLU 18 HA GLU 18 -20.515 -5.140 -4.196 149 HB2 GLU 18 HB2 GLU 18 -21.456 -3.939 -6.174 150 HB3 GLU 18 HB1 GLU 18 -19.782 -4.428 -6.361 151 HG2 GLU 18 HG2 GLU 18 -20.534 -6.358 -7.701 152 HG3 GLU 18 HG1 GLU 18 -22.179 -5.758 -7.572 153 H THR 19 HN THR 19 -22.581 -4.247 -3.810 154 HA THR 19 HA THR 19 -24.867 -5.975 -4.267 155 HB THR 19 HB THR 19 -23.750 -6.901 -2.227 156 HG1 THR 19 HG1 THR 19 -25.668 -7.293 -1.331 157 HG21 THR 19 HG21 THR 19 -24.459 -4.188 -1.062 158 HG22 THR 19 HG22 THR 19 -22.848 -4.890 -1.200 159 HG23 THR 19 HG23 THR 19 -24.026 -5.597 -0.092 160 H THR 20 HN THR 20 -26.792 -4.946 -2.832 161 HA THR 20 HA THR 20 -26.632 -2.030 -3.081 162 HB THR 20 HB THR 20 -28.946 -2.031 -4.054 163 HG1 THR 20 HG1 THR 20 -28.773 -4.626 -3.545 164 HG21 THR 20 HG21 THR 20 -26.755 -3.353 -5.679 165 HG22 THR 20 HG22 THR 20 -27.084 -1.625 -5.558 166 HG23 THR 20 HG23 THR 20 -28.234 -2.686 -6.370 167 H THR 21 HN THR 21 -28.271 -0.872 -1.905 168 HA THR 21 HA THR 21 -29.908 -2.365 -0.041 169 HB THR 21 HB THR 21 -27.653 -2.053 1.146 170 HG1 THR 21 HG1 THR 21 -29.514 -0.695 2.699 171 HG21 THR 21 HG21 THR 21 -28.633 0.834 1.163 172 HG22 THR 21 HG22 THR 21 -27.123 0.253 0.458 173 HG23 THR 21 HG23 THR 21 -27.355 0.216 2.209 174 H GLU 22 HN GLU 22 -31.478 -1.000 1.025 175 HA GLU 22 HA GLU 22 -31.998 1.446 -0.521 176 HB2 GLU 22 HB2 GLU 22 -34.333 1.166 0.130 177 HB3 GLU 22 HB1 GLU 22 -33.770 -0.346 -0.566 178 HG2 GLU 22 HG2 GLU 22 -33.504 -1.304 1.639 179 HG3 GLU 22 HG1 GLU 22 -34.027 0.253 2.383 180 H ALA 23 HN ALA 23 -32.077 3.393 0.486 181 HA ALA 23 HA ALA 23 -32.270 3.485 3.421 182 HB1 ALA 23 HB1 ALA 23 -30.293 4.894 3.637 183 HB2 ALA 23 HB2 ALA 23 -30.009 4.815 1.899 184 HB3 ALA 23 HB3 ALA 23 -29.848 3.362 2.884 185 H VAL 24 HN VAL 24 -32.732 5.752 4.169 186 HA VAL 24 HA VAL 24 -34.063 7.282 2.046 187 HB VAL 24 HB VAL 24 -35.244 8.442 3.941 188 HG11 VAL 24 HG11 VAL 24 -36.343 6.674 2.706 189 HG12 VAL 24 HG12 VAL 24 -36.752 6.546 4.417 190 HG13 VAL 24 HG13 VAL 24 -35.564 5.450 3.709 191 HG21 VAL 24 HG21 VAL 24 -33.632 7.970 5.708 192 HG22 VAL 24 HG22 VAL 24 -33.982 6.245 5.574 193 HG23 VAL 24 HG23 VAL 24 -35.232 7.357 6.130 194 H ASP 25 HN ASP 25 -31.133 7.283 3.149 195 HA ASP 25 HA ASP 25 -30.759 10.116 2.928 196 HB2 ASP 25 HB2 ASP 25 -31.185 10.125 5.282 197 HB3 ASP 25 HB1 ASP 25 -30.178 8.709 5.537 198 H ALA 26 HN ALA 26 -28.450 10.677 2.857 199 HA ALA 26 HA ALA 26 -27.057 8.678 1.303 200 HB1 ALA 26 HB1 ALA 26 -27.074 11.027 0.591 201 HB2 ALA 26 HB2 ALA 26 -25.431 10.443 0.858 202 HB3 ALA 26 HB3 ALA 26 -26.204 11.475 2.059 203 H ALA 27 HN ALA 27 -26.611 10.276 4.439 204 HA ALA 27 HA ALA 27 -23.987 9.143 4.868 205 HB1 ALA 27 HB1 ALA 27 -24.157 10.127 7.093 206 HB2 ALA 27 HB2 ALA 27 -25.861 10.489 6.814 207 HB3 ALA 27 HB3 ALA 27 -24.620 11.296 5.856 208 H THR 28 HN THR 28 -27.281 8.457 5.729 209 HA THR 28 HA THR 28 -26.820 6.382 7.579 210 HB THR 28 HB THR 28 -29.187 6.539 5.676 211 HG1 THR 28 HG1 THR 28 -28.738 8.562 6.849 212 HG21 THR 28 HG21 THR 28 -30.398 5.483 7.529 213 HG22 THR 28 HG22 THR 28 -28.928 5.469 8.500 214 HG23 THR 28 HG23 THR 28 -29.026 4.483 7.040 215 H ALA 29 HN ALA 29 -26.547 6.474 4.117 216 HA ALA 29 HA ALA 29 -26.835 3.638 3.693 217 HB1 ALA 29 HB1 ALA 29 -26.084 4.106 1.423 218 HB2 ALA 29 HB2 ALA 29 -25.618 5.740 1.898 219 HB3 ALA 29 HB3 ALA 29 -27.316 5.272 1.913 220 H GLU 30 HN GLU 30 -24.283 5.950 4.242 221 HA GLU 30 HA GLU 30 -22.043 4.324 3.825 222 HB2 GLU 30 HB2 GLU 30 -22.190 6.881 4.246 223 HB3 GLU 30 HB1 GLU 30 -22.251 6.444 5.943 224 HG2 GLU 30 HG2 GLU 30 -20.106 5.101 5.455 225 HG3 GLU 30 HG1 GLU 30 -20.015 6.119 4.021 226 H LYS 31 HN LYS 31 -23.627 5.253 6.842 227 HA LYS 31 HA LYS 31 -22.251 3.761 8.632 228 HB2 LYS 31 HB2 LYS 31 -25.191 4.403 8.766 229 HB3 LYS 31 HB1 LYS 31 -24.163 3.962 10.125 230 HG2 LYS 31 HG2 LYS 31 -24.085 6.462 8.463 231 HG3 LYS 31 HG1 LYS 31 -24.341 6.300 10.205 232 HD2 LYS 31 HD2 LYS 31 -22.063 5.587 10.524 233 HD3 LYS 31 HD1 LYS 31 -21.788 5.559 8.780 234 HE2 LYS 31 HE2 LYS 31 -22.292 8.018 8.768 235 HE3 LYS 31 HE1 LYS 31 -22.279 7.961 10.532 236 HZ1 LYS 31 HZ1 LYS 31 -20.133 8.635 9.790 237 HZ2 LYS 31 HZ2 LYS 31 -20.026 7.345 8.692 238 HZ3 LYS 31 HZ3 LYS 31 -19.986 7.043 10.365 239 H VAL 32 HN VAL 32 -25.056 2.628 6.753 240 HA VAL 32 HA VAL 32 -25.220 0.130 8.134 241 HB VAL 32 HB VAL 32 -26.297 0.882 5.407 242 HG11 VAL 32 HG11 VAL 32 -27.823 -1.005 5.685 243 HG12 VAL 32 HG12 VAL 32 -27.022 -1.433 7.197 244 HG13 VAL 32 HG13 VAL 32 -26.140 -1.533 5.675 245 HG21 VAL 32 HG21 VAL 32 -28.431 1.220 6.587 246 HG22 VAL 32 HG22 VAL 32 -27.174 2.313 7.166 247 HG23 VAL 32 HG23 VAL 32 -27.619 0.900 8.122 248 H PHE 33 HN PHE 33 -23.769 1.109 5.036 249 HA PHE 33 HA PHE 33 -22.909 -1.533 4.393 250 HB2 PHE 33 HB2 PHE 33 -22.380 1.171 3.254 251 HB3 PHE 33 HB1 PHE 33 -21.286 -0.128 2.844 252 HD1 PHE 33 HD1 PHE 33 -23.266 -2.381 2.720 253 HD2 PHE 33 HD2 PHE 33 -23.406 1.591 1.193 254 HE1 PHE 33 HE1 PHE 33 -24.783 -3.128 0.934 255 HE2 PHE 33 HE2 PHE 33 -24.928 0.851 -0.598 256 HZ PHE 33 HZ PHE 33 -25.624 -1.513 -0.727 257 H LYS 34 HN LYS 34 -21.600 0.946 6.414 258 HA LYS 34 HA LYS 34 -18.899 0.115 6.260 259 HB2 LYS 34 HB2 LYS 34 -20.418 1.662 8.355 260 HB3 LYS 34 HB1 LYS 34 -18.712 1.350 8.488 261 HG2 LYS 34 HG2 LYS 34 -18.651 2.417 6.089 262 HG3 LYS 34 HG1 LYS 34 -20.168 3.151 6.623 263 HD2 LYS 34 HD2 LYS 34 -18.354 4.673 7.156 264 HD3 LYS 34 HD1 LYS 34 -19.011 3.996 8.648 265 HE2 LYS 34 HE2 LYS 34 -17.188 2.355 8.706 266 HE3 LYS 34 HE1 LYS 34 -16.539 3.027 7.212 267 HZ1 LYS 34 HZ1 LYS 34 -16.676 4.313 9.876 268 HZ2 LYS 34 HZ2 LYS 34 -16.347 5.183 8.460 269 HZ3 LYS 34 HZ3 LYS 34 -15.291 3.951 8.959 270 H GLN 35 HN GLN 35 -21.575 -0.652 8.444 271 HA GLN 35 HA GLN 35 -20.106 -2.442 10.078 272 HB2 GLN 35 HB2 GLN 35 -22.288 -1.364 10.715 273 HB3 GLN 35 HB1 GLN 35 -23.088 -2.413 9.557 274 HG2 GLN 35 HG2 GLN 35 -23.277 -3.228 11.868 275 HG3 GLN 35 HG1 GLN 35 -22.459 -4.373 10.806 276 HE21 GLN 35 HE21 GLN 35 -22.120 -2.185 13.470 277 HE22 GLN 35 HE22 GLN 35 -20.550 -2.708 13.968 278 H TYR 36 HN TYR 36 -21.734 -2.622 7.059 279 HA TYR 36 HA TYR 36 -21.897 -5.442 6.785 280 HB2 TYR 36 HB2 TYR 36 -23.314 -4.124 5.409 281 HB3 TYR 36 HB1 TYR 36 -21.985 -3.101 4.894 282 HD1 TYR 36 HD1 TYR 36 -23.090 -6.675 4.646 283 HD2 TYR 36 HD2 TYR 36 -21.091 -3.390 2.873 284 HE1 TYR 36 HE1 TYR 36 -22.826 -7.973 2.569 285 HE2 TYR 36 HE2 TYR 36 -20.817 -4.641 0.783 286 HH TYR 36 HH TYR 36 -22.460 -7.593 0.184 287 H ALA 37 HN ALA 37 -19.645 -3.020 5.466 288 HA ALA 37 HA ALA 37 -17.865 -4.917 4.335 289 HB1 ALA 37 HB1 ALA 37 -17.993 -2.593 3.564 290 HB2 ALA 37 HB2 ALA 37 -16.349 -3.023 4.037 291 HB3 ALA 37 HB3 ALA 37 -17.350 -2.043 5.110 292 H ASN 38 HN ASN 38 -18.091 -3.366 7.450 293 HA ASN 38 HA ASN 38 -15.538 -4.111 8.436 294 HB2 ASN 38 HB2 ASN 38 -17.087 -2.337 9.444 295 HB3 ASN 38 HB1 ASN 38 -18.059 -3.659 10.084 296 HD21 ASN 38 HD21 ASN 38 -15.302 -1.657 10.583 297 HD22 ASN 38 HD22 ASN 38 -14.708 -2.468 12.050 298 H ASP 39 HN ASP 39 -18.551 -5.756 8.092 299 HA ASP 39 HA ASP 39 -18.106 -7.841 9.963 300 HB2 ASP 39 HB2 ASP 39 -20.317 -7.109 8.869 301 HB3 ASP 39 HB1 ASP 39 -19.812 -8.080 7.491 302 H ASN 40 HN ASN 40 -17.175 -7.337 6.622 303 HA ASN 40 HA ASN 40 -16.049 -10.044 6.541 304 HB2 ASN 40 HB2 ASN 40 -15.643 -9.469 4.066 305 HB3 ASN 40 HB1 ASN 40 -17.295 -9.777 4.577 306 HD21 ASN 40 HD21 ASN 40 -18.813 -8.199 4.395 307 HD22 ASN 40 HD22 ASN 40 -18.469 -6.610 3.701 308 H GLY 41 HN GLY 41 -15.168 -7.122 7.546 309 HA2 GLY 41 HA2 GLY 41 -13.101 -6.449 8.300 310 HA3 GLY 41 HA1 GLY 41 -12.405 -7.861 7.531 311 H VAL 42 HN VAL 42 -14.294 -5.575 5.637 312 HA VAL 42 HA VAL 42 -11.792 -4.820 4.337 313 HB VAL 42 HB VAL 42 -14.632 -4.675 3.294 314 HG11 VAL 42 HG11 VAL 42 -12.027 -3.975 1.925 315 HG12 VAL 42 HG12 VAL 42 -13.238 -2.815 2.470 316 HG13 VAL 42 HG13 VAL 42 -13.626 -3.960 1.183 317 HG21 VAL 42 HG21 VAL 42 -13.799 -6.928 3.351 318 HG22 VAL 42 HG22 VAL 42 -12.268 -6.428 2.624 319 HG23 VAL 42 HG23 VAL 42 -13.755 -6.359 1.677 320 H ASP 43 HN ASP 43 -10.964 -2.995 4.928 321 HA ASP 43 HA ASP 43 -12.717 -0.683 5.345 322 HB2 ASP 43 HB2 ASP 43 -11.959 -1.638 7.573 323 HB3 ASP 43 HB1 ASP 43 -10.310 -1.232 7.110 324 H GLY 44 HN GLY 44 -12.150 0.716 3.738 325 HA2 GLY 44 HA2 GLY 44 -9.352 1.249 3.200 326 HA3 GLY 44 HA1 GLY 44 -10.238 0.494 1.882 327 H GLU 45 HN GLU 45 -9.542 2.563 0.836 328 HA GLU 45 HA GLU 45 -10.504 5.097 1.533 329 HB2 GLU 45 HB2 GLU 45 -10.222 4.046 -1.290 330 HB3 GLU 45 HB1 GLU 45 -10.162 5.720 -0.773 331 HG2 GLU 45 HG2 GLU 45 -8.170 3.685 0.143 332 HG3 GLU 45 HG1 GLU 45 -7.972 4.615 -1.338 333 H TRP 46 HN TRP 46 -12.387 6.184 1.130 334 HA TRP 46 HA TRP 46 -14.618 4.548 0.119 335 HB2 TRP 46 HB2 TRP 46 -14.493 6.416 2.457 336 HB3 TRP 46 HB1 TRP 46 -15.992 6.342 1.556 337 HD1 TRP 46 HD1 TRP 46 -13.560 3.895 3.313 338 HE1 TRP 46 HE1 TRP 46 -14.926 1.991 4.379 339 HE3 TRP 46 HE3 TRP 46 -18.268 5.236 1.715 340 HZ2 TRP 46 HZ2 TRP 46 -17.606 1.183 4.534 341 HZ3 TRP 46 HZ3 TRP 46 -20.166 3.834 2.393 342 HH2 TRP 46 HH2 TRP 46 -19.840 1.846 3.766 343 H THR 47 HN THR 47 -14.721 5.167 -1.943 344 HA THR 47 HA THR 47 -14.879 8.035 -2.563 345 HB THR 47 HB THR 47 -14.677 7.071 -4.987 346 HG1 THR 47 HG1 THR 47 -14.891 4.900 -4.565 347 HG21 THR 47 HG21 THR 47 -12.386 7.023 -3.022 348 HG22 THR 47 HG22 THR 47 -12.931 8.403 -3.977 349 HG23 THR 47 HG23 THR 47 -12.204 7.007 -4.774 350 H TYR 48 HN TYR 48 -16.543 8.582 -4.340 351 HA TYR 48 HA TYR 48 -18.830 6.834 -4.414 352 HB2 TYR 48 HB2 TYR 48 -19.300 7.781 -2.283 353 HB3 TYR 48 HB1 TYR 48 -18.907 9.398 -2.804 354 HD1 TYR 48 HD1 TYR 48 -20.730 10.864 -3.394 355 HD2 TYR 48 HD2 TYR 48 -21.320 6.624 -3.482 356 HE1 TYR 48 HE1 TYR 48 -23.108 11.201 -3.825 357 HE2 TYR 48 HE2 TYR 48 -23.712 6.986 -3.930 358 HH TYR 48 HH TYR 48 -25.005 10.114 -4.691 359 H ASP 49 HN ASP 49 -20.458 7.492 -5.853 360 HA ASP 49 HA ASP 49 -19.891 9.841 -7.546 361 HB2 ASP 49 HB2 ASP 49 -18.860 8.041 -8.866 362 HB3 ASP 49 HB1 ASP 49 -20.299 7.053 -8.743 363 H ASP 50 HN ASP 50 -21.821 10.834 -8.271 364 HA ASP 50 HA ASP 50 -24.082 9.887 -6.637 365 HB2 ASP 50 HB2 ASP 50 -23.270 12.300 -6.450 366 HB3 ASP 50 HB1 ASP 50 -23.913 12.540 -8.073 367 H ALA 51 HN ALA 51 -23.108 10.215 -9.931 368 HA ALA 51 HA ALA 51 -25.712 10.199 -11.063 369 HB1 ALA 51 HB1 ALA 51 -24.581 9.646 -13.159 370 HB2 ALA 51 HB2 ALA 51 -23.086 9.346 -12.273 371 HB3 ALA 51 HB3 ALA 51 -23.775 10.968 -12.315 372 H THR 52 HN THR 52 -23.604 7.720 -9.843 373 HA THR 52 HA THR 52 -25.477 5.673 -10.817 374 HB THR 52 HB THR 52 -23.556 4.071 -10.423 375 HG1 THR 52 HG1 THR 52 -22.009 6.480 -10.405 376 HG21 THR 52 HG21 THR 52 -23.157 6.267 -12.462 377 HG22 THR 52 HG22 THR 52 -24.174 4.842 -12.668 378 HG23 THR 52 HG23 THR 52 -22.424 4.662 -12.523 379 H LYS 53 HN LYS 53 -24.886 7.320 -8.050 380 HA LYS 53 HA LYS 53 -25.019 6.937 -5.776 381 HB2 LYS 53 HB2 LYS 53 -27.204 5.508 -7.092 382 HB3 LYS 53 HB1 LYS 53 -26.803 4.844 -5.520 383 HG2 LYS 53 HG2 LYS 53 -28.564 6.542 -5.385 384 HG3 LYS 53 HG1 LYS 53 -27.127 6.984 -4.465 385 HD2 LYS 53 HD2 LYS 53 -26.415 8.450 -6.295 386 HD3 LYS 53 HD1 LYS 53 -27.877 8.031 -7.192 387 HE2 LYS 53 HE2 LYS 53 -29.251 8.977 -5.428 388 HE3 LYS 53 HE1 LYS 53 -27.811 9.337 -4.481 389 HZ1 LYS 53 HZ1 LYS 53 -28.737 11.249 -5.729 390 HZ2 LYS 53 HZ2 LYS 53 -28.326 10.466 -7.173 391 HZ3 LYS 53 HZ3 LYS 53 -27.113 10.927 -6.075 392 H THR 54 HN THR 54 -22.859 5.579 -6.950 393 HA THR 54 HA THR 54 -22.867 2.980 -5.606 394 HB THR 54 HB THR 54 -20.815 3.942 -7.603 395 HG1 THR 54 HG1 THR 54 -23.332 3.503 -8.110 396 HG21 THR 54 HG21 THR 54 -20.314 1.562 -7.830 397 HG22 THR 54 HG22 THR 54 -21.619 1.151 -6.712 398 HG23 THR 54 HG23 THR 54 -20.201 2.023 -6.127 399 H TYR 55 HN TYR 55 -21.987 2.940 -3.669 400 HA TYR 55 HA TYR 55 -19.827 4.756 -2.940 401 HB2 TYR 55 HB2 TYR 55 -21.430 2.718 -1.368 402 HB3 TYR 55 HB1 TYR 55 -19.864 3.259 -0.781 403 HD1 TYR 55 HD1 TYR 55 -23.311 4.409 -1.565 404 HD2 TYR 55 HD2 TYR 55 -19.567 5.370 0.226 405 HE1 TYR 55 HE1 TYR 55 -24.323 6.382 -0.501 406 HE2 TYR 55 HE2 TYR 55 -20.573 7.346 1.285 407 HH TYR 55 HH TYR 55 -23.867 7.849 1.523 408 H THR 56 HN THR 56 -17.686 4.146 -2.860 409 HA THR 56 HA THR 56 -17.147 1.369 -3.708 410 HB THR 56 HB THR 56 -14.960 2.892 -4.567 411 HG1 THR 56 HG1 THR 56 -17.382 4.321 -4.771 412 HG21 THR 56 HG21 THR 56 -17.365 1.928 -6.139 413 HG22 THR 56 HG22 THR 56 -15.876 1.026 -5.828 414 HG23 THR 56 HG23 THR 56 -15.844 2.459 -6.853 415 H VAL 57 HN VAL 57 -16.027 0.269 -2.247 416 HA VAL 57 HA VAL 57 -14.153 1.789 -0.562 417 HB VAL 57 HB VAL 57 -15.951 0.789 0.849 418 HG11 VAL 57 HG11 VAL 57 -15.955 -1.665 1.225 419 HG12 VAL 57 HG12 VAL 57 -14.912 -1.844 -0.180 420 HG13 VAL 57 HG13 VAL 57 -16.542 -1.196 -0.366 421 HG21 VAL 57 HG21 VAL 57 -14.470 -0.307 2.478 422 HG22 VAL 57 HG22 VAL 57 -13.764 1.170 1.817 423 HG23 VAL 57 HG23 VAL 57 -13.210 -0.404 1.247 424 H THR 58 HN THR 58 -12.193 1.531 -1.253 425 HA THR 58 HA THR 58 -11.509 -0.976 -2.636 426 HB THR 58 HB THR 58 -10.012 1.593 -3.077 427 HG1 THR 58 HG1 THR 58 -12.408 1.788 -3.386 428 HG21 THR 58 HG21 THR 58 -10.662 -0.697 -4.947 429 HG22 THR 58 HG22 THR 58 -9.177 -0.583 -4.000 430 HG23 THR 58 HG23 THR 58 -9.532 0.624 -5.238 431 H GLU 59 HN GLU 59 -9.925 -2.167 -1.858 432 HA GLU 59 HA GLU 59 -8.584 -1.361 0.571 433 HB2 GLU 59 HB2 GLU 59 -9.524 -3.689 0.002 434 HB3 GLU 59 HB1 GLU 59 -8.102 -3.888 -1.005 435 HG2 GLU 59 HG2 GLU 59 -8.166 -3.510 1.978 436 HG3 GLU 59 HG1 GLU 59 -7.805 -4.988 1.104 437 H GLY 60 HN GLY 60 -7.049 0.275 0.011 438 HA2 GLY 60 HA2 GLY 60 -5.095 -0.469 -2.066 439 HA3 GLY 60 HA1 GLY 60 -5.365 1.162 -1.459 440 H SER 61 HN SER 61 -3.570 -1.687 -1.147 441 HA SER 61 HA SER 61 -2.140 -0.540 1.157 442 HB2 SER 61 HB2 SER 61 -1.609 -2.968 1.735 443 HB3 SER 61 HB1 SER 61 -3.298 -2.498 1.945 444 HG SER 61 HG SER 61 -3.880 -3.788 0.369 445 H GLY 62 HN GLY 62 -1.875 -0.758 -1.979 446 HA2 GLY 62 HA2 GLY 62 0.205 -0.273 -3.071 447 HA3 GLY 62 HA1 GLY 62 1.018 -1.284 -1.884 448 H GLY 63 HN GLY 63 -1.485 -3.128 -2.451 449 HA2 GLY 63 HA2 GLY 63 -0.073 -4.884 -4.202 450 HA3 GLY 63 HA1 GLY 63 -1.682 -5.141 -3.550 451 H ALA 64 HN ALA 64 -2.102 -2.278 -4.839 452 HA ALA 64 HA ALA 64 -2.479 -3.191 -7.598 453 HB1 ALA 64 HB1 ALA 64 -4.736 -2.200 -7.643 454 HB2 ALA 64 HB2 ALA 64 -4.609 -1.873 -5.915 455 HB3 ALA 64 HB3 ALA 64 -4.622 -3.537 -6.499 456 H GLY 65 HN GLY 65 -2.803 -1.364 -9.107 457 HA2 GLY 65 HA2 GLY 65 -2.776 1.261 -8.783 458 HA3 GLY 65 HA1 GLY 65 -1.137 0.882 -8.270 459 H GLY 66 HN GLY 66 0.258 -0.223 -9.823 460 HA2 GLY 66 HA2 GLY 66 0.156 1.022 -12.361 461 HA3 GLY 66 HA1 GLY 66 1.275 -0.243 -11.882 462 H GLN 67 HN GLN 67 -0.962 -2.070 -11.232 463 HA GLN 67 HA GLN 67 -2.351 -3.612 -12.148 464 HB2 GLN 67 HB2 GLN 67 -3.583 -1.815 -13.219 465 HB3 GLN 67 HB1 GLN 67 -2.382 -1.727 -14.532 466 HG2 GLN 67 HG2 GLN 67 -3.014 -4.015 -15.194 467 HG3 GLN 67 HG1 GLN 67 -4.258 -4.019 -13.943 468 HE21 GLN 67 HE21 GLN 67 -4.462 -4.237 -16.875 469 HE22 GLN 67 HE22 GLN 67 -5.537 -2.966 -17.353 470 H GLY 68 HN GLY 68 -0.527 -2.524 -15.014 471 HA2 GLY 68 HA2 GLY 68 1.304 -4.645 -15.029 472 HA3 GLY 68 HA1 GLY 68 -0.082 -5.115 -16.007 473 H MET 69 HN MET 69 1.666 -5.138 -17.712 474 HA MET 69 HA MET 69 2.609 -4.263 -19.595 475 HB2 MET 69 HB2 MET 69 0.755 -1.923 -19.088 476 HB3 MET 69 HB1 MET 69 1.592 -2.258 -20.594 477 HG2 MET 69 HG2 MET 69 0.303 -4.276 -20.906 478 HG3 MET 69 HG1 MET 69 -0.477 -4.046 -19.341 479 HE1 MET 69 HE1 MET 69 -0.824 -0.854 -19.362 480 HE2 MET 69 HE2 MET 69 -2.096 -1.941 -18.802 481 HE3 MET 69 HE3 MET 69 -2.463 -0.691 -19.991 482 H ILE 70 HN ILE 70 3.356 -1.715 -20.315 483 HA ILE 70 HA ILE 70 4.408 0.279 -19.731 484 HB ILE 70 HB ILE 70 3.645 -0.472 -17.150 485 HG12 ILE 70 HG12 ILE 70 4.624 1.803 -16.544 486 HG13 ILE 70 HG11 ILE 70 5.244 1.873 -18.191 487 HG21 ILE 70 HG21 ILE 70 6.670 -0.188 -17.197 488 HG22 ILE 70 HG22 ILE 70 5.762 -1.613 -16.687 489 HG23 ILE 70 HG23 ILE 70 5.671 -0.123 -15.743 490 HD11 ILE 70 HD11 ILE 70 3.117 3.087 -17.891 491 HD12 ILE 70 HD12 ILE 70 2.331 1.565 -17.470 492 HD13 ILE 70 HD13 ILE 70 3.007 1.794 -19.083 493 H GLN 71 HN GLN 71 5.302 -2.683 -20.239 494 HA GLN 71 HA GLN 71 8.182 -2.297 -19.832 495 HB2 GLN 71 HB2 GLN 71 8.381 -4.692 -20.329 496 HB3 GLN 71 HB1 GLN 71 7.276 -4.404 -18.996 497 HG2 GLN 71 HG2 GLN 71 5.374 -4.759 -20.433 498 HG3 GLN 71 HG1 GLN 71 6.430 -4.914 -21.837 499 HE21 GLN 71 HE21 GLN 71 8.433 -6.416 -20.365 500 HE22 GLN 71 HE22 GLN 71 7.795 -8.011 -20.156 501 H GLU 72 HN GLU 72 6.169 -1.268 -21.922 502 HA GLU 72 HA GLU 72 7.468 -2.233 -24.365 503 HB2 GLU 72 HB2 GLU 72 5.091 -0.373 -24.145 504 HB3 GLU 72 HB1 GLU 72 5.652 -1.219 -25.578 505 HG2 GLU 72 HG2 GLU 72 3.903 -2.550 -25.004 506 HG3 GLU 72 HG1 GLU 72 5.191 -3.350 -24.102 507 HA PRO 73 HA PRO 73 9.750 1.558 -24.631 508 HB2 PRO 73 HB2 PRO 73 10.426 1.616 -27.232 509 HB3 PRO 73 HB1 PRO 73 10.986 0.242 -26.195 510 HG2 PRO 73 HG2 PRO 73 8.598 0.402 -28.029 511 HG3 PRO 73 HG1 PRO 73 9.862 -0.849 -27.963 512 HD2 PRO 73 HD2 PRO 73 7.452 -1.123 -26.715 513 HD3 PRO 73 HD1 PRO 73 8.966 -1.830 -26.059 514 H ALA 74 HN ALA 74 9.634 3.717 -25.432 515 HA ALA 74 HA ALA 74 7.275 4.480 -26.952 516 HB1 ALA 74 HB1 ALA 74 6.516 4.493 -24.617 517 HB2 ALA 74 HB2 ALA 74 6.551 6.121 -25.297 518 HB3 ALA 74 HB3 ALA 74 7.829 5.594 -24.201 519 H LEU 75 HN LEU 75 7.330 7.030 -27.093 520 HA LEU 75 HA LEU 75 9.836 7.680 -28.301 521 HB2 LEU 75 HB2 LEU 75 7.343 9.335 -27.875 522 HB3 LEU 75 HB1 LEU 75 8.753 9.916 -28.721 523 HG LEU 75 HG LEU 75 7.185 9.321 -30.363 524 HD11 LEU 75 HD11 LEU 75 9.431 8.644 -30.918 525 HD12 LEU 75 HD12 LEU 75 8.286 7.467 -31.563 526 HD13 LEU 75 HD13 LEU 75 9.205 7.098 -30.104 527 HD21 LEU 75 HD21 LEU 75 6.886 6.634 -29.021 528 HD22 LEU 75 HD22 LEU 75 6.075 7.159 -30.498 529 HD23 LEU 75 HD23 LEU 75 5.715 7.951 -28.965 530 HA PRO 76 HA PRO 76 11.580 9.721 -24.727 531 HB2 PRO 76 HB2 PRO 76 13.022 11.549 -26.557 532 HB3 PRO 76 HB1 PRO 76 13.707 10.342 -25.466 533 HG2 PRO 76 HG2 PRO 76 13.780 10.004 -28.119 534 HG3 PRO 76 HG1 PRO 76 13.469 8.615 -27.005 535 HD2 PRO 76 HD2 PRO 76 11.436 10.253 -28.583 536 HD3 PRO 76 HD1 PRO 76 11.602 8.490 -28.448 537 HA PRO 77 HA PRO 77 9.184 13.381 -24.036 538 HB2 PRO 77 HB2 PRO 77 10.837 14.984 -22.580 539 HB3 PRO 77 HB1 PRO 77 10.078 13.534 -21.906 540 HG2 PRO 77 HG2 PRO 77 12.807 13.866 -23.093 541 HG3 PRO 77 HG1 PRO 77 12.368 13.133 -21.531 542 HD2 PRO 77 HD2 PRO 77 12.847 11.540 -23.633 543 HD3 PRO 77 HD1 PRO 77 11.451 11.208 -22.541 544 H GLY 78 HN GLY 78 8.695 15.054 -25.313 545 HA2 GLY 78 HA2 GLY 78 9.083 16.952 -26.631 546 HA3 GLY 78 HA1 GLY 78 10.807 16.659 -26.506 547 H TRP 79 HN TRP 79 10.066 13.743 -27.460 548 HA TRP 79 HA TRP 79 10.253 14.452 -30.305 549 HB2 TRP 79 HB2 TRP 79 10.772 11.870 -28.815 550 HB3 TRP 79 HB1 TRP 79 10.739 11.962 -30.572 551 HD1 TRP 79 HD1 TRP 79 12.798 13.252 -27.569 552 HE1 TRP 79 HE1 TRP 79 15.146 13.873 -28.418 553 HE3 TRP 79 HE3 TRP 79 12.070 12.547 -32.585 554 HZ2 TRP 79 HZ2 TRP 79 16.509 14.035 -30.874 555 HZ3 TRP 79 HZ3 TRP 79 13.951 12.962 -34.115 556 HH2 TRP 79 HH2 TRP 79 16.119 13.691 -33.281 557 H GLU 80 HN GLU 80 8.521 14.260 -31.663 558 HA GLU 80 HA GLU 80 6.301 12.533 -30.806 559 HB2 GLU 80 HB2 GLU 80 6.263 14.864 -32.743 560 HB3 GLU 80 HB1 GLU 80 4.870 13.899 -32.308 561 HG2 GLU 80 HG2 GLU 80 4.981 14.706 -30.034 562 HG3 GLU 80 HG1 GLU 80 6.450 15.608 -30.398 563 H MET 81 HN MET 81 5.320 11.190 -32.385 564 HA MET 81 HA MET 81 6.952 10.711 -34.786 565 HB2 MET 81 HB2 MET 81 7.336 9.051 -32.913 566 HB3 MET 81 HB1 MET 81 5.638 8.555 -33.106 567 HG2 MET 81 HG2 MET 81 7.687 8.454 -35.311 568 HG3 MET 81 HG1 MET 81 7.355 7.108 -34.230 569 HE1 MET 81 HE1 MET 81 3.622 6.282 -35.134 570 HE2 MET 81 HE2 MET 81 4.207 7.343 -33.851 571 HE3 MET 81 HE3 MET 81 5.017 5.810 -34.166 572 H LYS 82 HN LYS 82 5.700 10.951 -36.615 573 HA LYS 82 HA LYS 82 2.891 10.173 -36.513 574 HB2 LYS 82 HB2 LYS 82 3.570 12.923 -37.560 575 HB3 LYS 82 HB1 LYS 82 1.990 12.270 -37.182 576 HG2 LYS 82 HG2 LYS 82 2.515 12.317 -34.806 577 HG3 LYS 82 HG1 LYS 82 4.143 12.943 -35.182 578 HD2 LYS 82 HD2 LYS 82 3.006 14.901 -36.289 579 HD3 LYS 82 HD1 LYS 82 1.483 14.311 -35.620 580 HE2 LYS 82 HE2 LYS 82 2.562 14.411 -33.348 581 HE3 LYS 82 HE1 LYS 82 3.934 15.209 -34.105 582 HZ1 LYS 82 HZ1 LYS 82 2.496 17.015 -34.773 583 HZ2 LYS 82 HZ2 LYS 82 2.389 16.779 -33.097 584 HZ3 LYS 82 HZ3 LYS 82 1.141 16.235 -34.112 585 H TYR 83 HN TYR 83 1.930 10.027 -38.684 586 HA TYR 83 HA TYR 83 4.020 9.594 -40.742 587 HB2 TYR 83 HB2 TYR 83 1.369 8.193 -40.264 588 HB3 TYR 83 HB1 TYR 83 2.239 8.063 -41.811 589 HD1 TYR 83 HD1 TYR 83 4.191 6.697 -42.003 590 HD2 TYR 83 HD2 TYR 83 2.295 7.176 -38.226 591 HE1 TYR 83 HE1 TYR 83 5.460 4.783 -41.127 592 HE2 TYR 83 HE2 TYR 83 3.556 5.258 -37.341 593 HH TYR 83 HH TYR 83 6.191 3.843 -39.044 594 H THR 84 HN THR 84 3.444 10.005 -42.972 595 HA THR 84 HA THR 84 1.630 12.260 -43.304 596 HB THR 84 HB THR 84 2.558 12.521 -45.507 597 HG1 THR 84 HG1 THR 84 3.942 10.952 -46.417 598 HG21 THR 84 HG21 THR 84 4.965 12.689 -45.082 599 HG22 THR 84 HG22 THR 84 4.771 11.715 -43.626 600 HG23 THR 84 HG23 THR 84 4.018 13.306 -43.729 601 H SER 85 HN SER 85 0.684 11.802 -45.938 602 HA SER 85 HA SER 85 -1.316 9.768 -45.320 603 HB2 SER 85 HB2 SER 85 -2.431 10.747 -47.417 604 HB3 SER 85 HB1 SER 85 -2.348 11.767 -45.982 605 HG SER 85 HG SER 85 -1.494 13.127 -47.345 606 H GLU 86 HN GLU 86 1.559 9.453 -46.519 607 HA GLU 86 HA GLU 86 0.739 7.562 -48.668 608 HB2 GLU 86 HB2 GLU 86 2.060 9.542 -49.476 609 HB3 GLU 86 HB1 GLU 86 3.368 9.064 -48.402 610 HG2 GLU 86 HG2 GLU 86 3.622 6.969 -49.613 611 HG3 GLU 86 HG1 GLU 86 2.294 7.420 -50.684 612 H GLY 87 HN GLY 87 1.629 7.727 -45.564 613 HA2 GLY 87 HA2 GLY 87 2.277 5.934 -44.197 614 HA3 GLY 87 HA1 GLY 87 2.890 5.099 -45.616 615 H VAL 88 HN VAL 88 4.018 8.201 -45.767 616 HA VAL 88 HA VAL 88 6.681 7.406 -45.089 617 HB VAL 88 HB VAL 88 5.553 10.122 -45.799 618 HG11 VAL 88 HG11 VAL 88 7.880 10.816 -46.152 619 HG12 VAL 88 HG12 VAL 88 8.434 9.271 -45.508 620 HG13 VAL 88 HG13 VAL 88 7.569 10.402 -44.466 621 HG21 VAL 88 HG21 VAL 88 5.418 8.542 -47.624 622 HG22 VAL 88 HG22 VAL 88 7.105 8.085 -47.395 623 HG23 VAL 88 HG23 VAL 88 6.698 9.707 -47.956 624 H ARG 89 HN ARG 89 7.766 7.712 -43.250 625 HA ARG 89 HA ARG 89 6.238 8.732 -40.975 626 HB2 ARG 89 HB2 ARG 89 7.332 6.405 -41.083 627 HB3 ARG 89 HB1 ARG 89 8.850 7.254 -40.891 628 HG2 ARG 89 HG2 ARG 89 8.181 8.077 -38.736 629 HG3 ARG 89 HG1 ARG 89 6.566 7.383 -38.939 630 HD2 ARG 89 HD2 ARG 89 7.611 5.148 -39.159 631 HD3 ARG 89 HD1 ARG 89 9.170 5.882 -38.818 632 HE ARG 89 HE ARG 89 7.653 6.589 -36.683 633 HH11 ARG 89 HH11 ARG 89 8.288 3.529 -38.260 634 HH12 ARG 89 HH12 ARG 89 8.183 2.597 -36.793 635 HH21 ARG 89 HH21 ARG 89 7.492 5.359 -34.746 636 HH22 ARG 89 HH22 ARG 89 7.748 3.638 -34.789 637 H TYR 90 HN TYR 90 6.704 10.689 -40.158 638 HA TYR 90 HA TYR 90 9.418 11.715 -40.603 639 HB2 TYR 90 HB2 TYR 90 8.582 13.994 -40.828 640 HB3 TYR 90 HB1 TYR 90 7.853 12.966 -42.041 641 HD1 TYR 90 HD1 TYR 90 5.466 12.249 -41.752 642 HD2 TYR 90 HD2 TYR 90 7.262 15.222 -39.302 643 HE1 TYR 90 HE1 TYR 90 3.238 13.074 -41.141 644 HE2 TYR 90 HE2 TYR 90 5.038 16.061 -38.674 645 HH TYR 90 HH TYR 90 2.167 14.313 -39.384 646 H PHE 91 HN PHE 91 10.138 13.250 -38.839 647 HA PHE 91 HA PHE 91 8.790 12.480 -36.344 648 HB2 PHE 91 HB2 PHE 91 11.759 12.547 -36.909 649 HB3 PHE 91 HB1 PHE 91 11.109 12.597 -35.285 650 HD1 PHE 91 HD1 PHE 91 10.862 10.636 -34.141 651 HD2 PHE 91 HD2 PHE 91 10.823 10.507 -38.403 652 HE1 PHE 91 HE1 PHE 91 10.745 8.185 -34.079 653 HE2 PHE 91 HE2 PHE 91 10.689 8.063 -38.328 654 HZ PHE 91 HZ PHE 91 10.658 6.895 -36.166 655 H VAL 92 HN VAL 92 8.778 14.048 -34.714 656 HA VAL 92 HA VAL 92 9.217 16.752 -35.791 657 HB VAL 92 HB VAL 92 7.239 15.940 -33.664 658 HG11 VAL 92 HG11 VAL 92 6.288 18.153 -33.982 659 HG12 VAL 92 HG12 VAL 92 7.543 18.535 -35.161 660 HG13 VAL 92 HG13 VAL 92 7.973 18.256 -33.474 661 HG21 VAL 92 HG21 VAL 92 6.761 16.531 -36.580 662 HG22 VAL 92 HG22 VAL 92 5.504 16.284 -35.366 663 HG23 VAL 92 HG23 VAL 92 6.594 14.964 -35.789 664 H ASP 93 HN ASP 93 11.148 17.389 -34.999 665 HA ASP 93 HA ASP 93 12.006 16.865 -32.268 666 HB2 ASP 93 HB2 ASP 93 13.077 18.519 -34.568 667 HB3 ASP 93 HB1 ASP 93 13.534 18.979 -32.929 668 H HIS 94 HN HIS 94 10.179 17.610 -31.027 669 HA HIS 94 HA HIS 94 9.038 20.188 -31.504 670 HB2 HIS 94 HB2 HIS 94 7.901 18.111 -30.462 671 HB3 HIS 94 HB1 HIS 94 8.654 18.633 -28.957 672 HD1 HIS 94 HD1 HIS 94 7.202 20.116 -27.582 673 HD2 HIS 94 HD2 HIS 94 6.312 20.352 -31.641 674 HE1 HIS 94 HE1 HIS 94 5.275 21.728 -27.766 675 HE2 HIS 94 HE2 HIS 94 4.676 21.758 -30.211 676 H ASN 95 HN ASN 95 11.901 19.343 -30.109 677 HA ASN 95 HA ASN 95 11.994 21.327 -28.048 678 HB2 ASN 95 HB2 ASN 95 14.427 20.900 -27.998 679 HB3 ASN 95 HB1 ASN 95 13.531 19.383 -28.012 680 HD21 ASN 95 HD21 ASN 95 13.681 18.034 -29.792 681 HD22 ASN 95 HD22 ASN 95 14.849 18.273 -31.047 682 H THR 96 HN THR 96 12.591 21.261 -31.486 683 HA THR 96 HA THR 96 13.119 24.155 -31.385 684 HB THR 96 HB THR 96 14.085 23.781 -33.732 685 HG1 THR 96 HG1 THR 96 13.755 21.775 -34.398 686 HG21 THR 96 HG21 THR 96 16.265 22.999 -32.846 687 HG22 THR 96 HG22 THR 96 15.466 22.577 -31.330 688 HG23 THR 96 HG23 THR 96 15.528 24.259 -31.859 689 H ARG 97 HN ARG 97 10.916 21.797 -32.126 690 HA ARG 97 HA ARG 97 8.807 21.814 -32.994 691 HB2 ARG 97 HB2 ARG 97 9.182 24.774 -33.440 692 HB3 ARG 97 HB1 ARG 97 7.659 23.888 -33.357 693 HG2 ARG 97 HG2 ARG 97 8.158 23.313 -31.020 694 HG3 ARG 97 HG1 ARG 97 9.629 24.284 -31.136 695 HD2 ARG 97 HD2 ARG 97 7.815 25.554 -30.083 696 HD3 ARG 97 HD1 ARG 97 8.268 26.270 -31.633 697 HE ARG 97 HE ARG 97 6.230 24.594 -32.268 698 HH11 ARG 97 HH11 ARG 97 6.586 27.253 -30.005 699 HH12 ARG 97 HH12 ARG 97 4.885 27.623 -30.003 700 HH21 ARG 97 HH21 ARG 97 4.022 25.104 -32.277 701 HH22 ARG 97 HH22 ARG 97 3.435 26.410 -31.292 702 H THR 98 HN THR 98 11.099 21.343 -34.533 703 HA THR 98 HA THR 98 10.282 22.312 -37.196 704 HB THR 98 HB THR 98 12.595 21.410 -37.882 705 HG1 THR 98 HG1 THR 98 13.308 20.227 -36.213 706 HG21 THR 98 HG21 THR 98 12.130 23.821 -37.646 707 HG22 THR 98 HG22 THR 98 13.752 23.437 -37.066 708 HG23 THR 98 HG23 THR 98 12.446 23.713 -35.913 709 H THR 99 HN THR 99 10.245 20.739 -38.979 710 HA THR 99 HA THR 99 9.463 18.057 -38.018 711 HB THR 99 HB THR 99 8.694 17.778 -40.490 712 HG1 THR 99 HG1 THR 99 9.270 20.567 -40.392 713 HG21 THR 99 HG21 THR 99 7.033 18.090 -38.683 714 HG22 THR 99 HG22 THR 99 6.551 19.046 -40.090 715 HG23 THR 99 HG23 THR 99 7.307 19.832 -38.708 716 H THR 100 HN THR 100 10.916 16.378 -38.313 717 HA THR 100 HA THR 100 13.121 16.884 -40.183 718 HB THR 100 HB THR 100 13.738 17.231 -37.718 719 HG1 THR 100 HG1 THR 100 15.656 16.831 -38.494 720 HG21 THR 100 HG21 THR 100 14.289 15.106 -36.501 721 HG22 THR 100 HG22 THR 100 13.366 14.231 -37.725 722 HG23 THR 100 HG23 THR 100 12.562 15.406 -36.684 723 H PHE 101 HN PHE 101 14.178 14.970 -40.945 724 HA PHE 101 HA PHE 101 12.466 12.579 -40.818 725 HB2 PHE 101 HB2 PHE 101 14.074 13.746 -43.102 726 HB3 PHE 101 HB1 PHE 101 13.621 11.993 -43.061 727 HD1 PHE 101 HD1 PHE 101 11.483 11.315 -43.655 728 HD2 PHE 101 HD2 PHE 101 12.263 15.454 -43.087 729 HE1 PHE 101 HE1 PHE 101 9.297 11.852 -44.640 730 HE2 PHE 101 HE2 PHE 101 10.075 16.007 -44.074 731 HZ PHE 101 HZ PHE 101 8.588 14.200 -44.859 732 H LYS 102 HN LYS 102 13.452 11.488 -39.207 733 HA LYS 102 HA LYS 102 16.220 10.661 -39.668 734 HB2 LYS 102 HB2 LYS 102 15.083 11.785 -37.119 735 HB3 LYS 102 HB1 LYS 102 16.470 10.709 -37.100 736 HG2 LYS 102 HG2 LYS 102 17.589 12.343 -38.683 737 HG3 LYS 102 HG1 LYS 102 16.260 13.447 -38.318 738 HD2 LYS 102 HD2 LYS 102 17.961 12.186 -36.175 739 HD3 LYS 102 HD1 LYS 102 18.369 13.725 -36.931 740 HE2 LYS 102 HE2 LYS 102 15.654 13.311 -35.755 741 HE3 LYS 102 HE1 LYS 102 17.018 13.670 -34.701 742 HZ1 LYS 102 HZ1 LYS 102 15.768 15.660 -35.404 743 HZ2 LYS 102 HZ2 LYS 102 16.213 15.347 -37.013 744 HZ3 LYS 102 HZ3 LYS 102 17.404 15.703 -35.863 745 H ASP 103 HN ASP 103 15.927 8.581 -40.142 746 HA ASP 103 HA ASP 103 13.912 7.002 -38.817 747 HB2 ASP 103 HB2 ASP 103 14.843 5.177 -40.266 748 HB3 ASP 103 HB1 ASP 103 14.257 6.575 -41.154 749 HA PRO 104 HA PRO 104 16.700 5.713 -35.598 750 HB2 PRO 104 HB2 PRO 104 14.653 3.726 -34.906 751 HB3 PRO 104 HB1 PRO 104 15.165 5.133 -33.967 752 HG2 PRO 104 HG2 PRO 104 12.726 4.941 -35.161 753 HG3 PRO 104 HG1 PRO 104 13.544 6.485 -34.869 754 HD2 PRO 104 HD2 PRO 104 13.281 4.919 -37.396 755 HD3 PRO 104 HD1 PRO 104 13.276 6.680 -37.150 756 H ARG 105 HN ARG 105 15.064 3.679 -37.890 757 HA ARG 105 HA ARG 105 17.114 1.607 -37.558 758 HB2 ARG 105 HB2 ARG 105 14.375 1.399 -38.819 759 HB3 ARG 105 HB1 ARG 105 15.543 0.090 -38.726 760 HG2 ARG 105 HG2 ARG 105 13.979 1.379 -36.511 761 HG3 ARG 105 HG1 ARG 105 14.017 -0.322 -36.999 762 HD2 ARG 105 HD2 ARG 105 16.479 -0.274 -36.322 763 HD3 ARG 105 HD1 ARG 105 16.124 1.263 -35.545 764 HE ARG 105 HE ARG 105 14.449 -1.013 -34.809 765 HH11 ARG 105 HH11 ARG 105 17.102 1.150 -33.935 766 HH12 ARG 105 HH12 ARG 105 17.143 0.606 -32.285 767 HH21 ARG 105 HH21 ARG 105 14.547 -1.716 -32.657 768 HH22 ARG 105 HH22 ARG 105 15.692 -1.003 -31.560 769 HA PRO 106 HA PRO 106 18.683 3.548 -41.212 770 HB2 PRO 106 HB2 PRO 106 20.536 1.683 -41.974 771 HB3 PRO 106 HB1 PRO 106 20.788 2.836 -40.610 772 HG2 PRO 106 HG2 PRO 106 19.963 -0.050 -40.559 773 HG3 PRO 106 HG1 PRO 106 21.071 0.831 -39.492 774 HD2 PRO 106 HD2 PRO 106 18.512 0.228 -38.812 775 HD3 PRO 106 HD1 PRO 106 19.381 1.680 -38.203 776 H GLY 107 HN GLY 107 17.455 3.656 -42.961 777 HA2 GLY 107 HA2 GLY 107 16.906 3.073 -45.150 778 HA3 GLY 107 HA1 GLY 107 17.511 1.429 -44.844 779 H PHE 108 HN PHE 108 15.832 1.123 -42.406 780 HA PHE 108 HA PHE 108 13.816 0.085 -41.912 781 HB2 PHE 108 HB2 PHE 108 13.256 2.639 -43.161 782 HB3 PHE 108 HB1 PHE 108 11.927 1.466 -43.439 783 HD1 PHE 108 HD1 PHE 108 13.796 3.395 -40.913 784 HD2 PHE 108 HD2 PHE 108 10.617 0.634 -41.595 785 HE1 PHE 108 HE1 PHE 108 12.945 3.813 -38.651 786 HE2 PHE 108 HE2 PHE 108 9.765 1.060 -39.324 787 HZ PHE 108 HZ PHE 108 10.932 2.652 -37.849 788 H GLU 109 HN GLU 109 15.291 -0.649 -44.492 789 HA GLU 109 HA GLU 109 15.143 -2.254 -46.080 790 HB2 GLU 109 HB2 GLU 109 14.057 -3.578 -44.302 791 HB3 GLU 109 HB1 GLU 109 12.497 -2.929 -44.777 792 HG2 GLU 109 HG2 GLU 109 12.742 -5.149 -45.654 793 HG3 GLU 109 HG1 GLU 109 12.758 -3.995 -46.983 Start of MODEL 3 1 H1 GLY 1 HT1 GLY 1 -35.488 9.832 4.525 2 H2 GLY 1 HT2 GLY 1 -37.035 10.023 5.192 3 H3 GLY 1 HT3 GLY 1 -35.998 11.358 5.056 4 HA2 GLY 1 HA1 GLY 1 -37.680 11.433 3.347 5 HA3 GLY 1 HA2 GLY 1 -36.080 11.221 2.650 6 H SER 2 HN SER 2 -37.222 10.386 0.777 7 HA SER 2 HA SER 2 -38.721 7.961 0.985 8 HB2 SER 2 HB2 SER 2 -37.477 9.247 -1.455 9 HB3 SER 2 HB1 SER 2 -38.757 8.032 -1.454 10 HG SER 2 HG SER 2 -39.880 9.874 -1.592 11 H HIS 3 HN HIS 3 -38.145 5.901 0.193 12 HA HIS 3 HA HIS 3 -35.535 5.040 0.836 13 HB2 HIS 3 HB2 HIS 3 -37.936 3.763 -0.393 14 HB3 HIS 3 HB1 HIS 3 -36.396 2.924 -0.492 15 HD1 HIS 3 HD1 HIS 3 -39.202 2.536 1.323 16 HD2 HIS 3 HD2 HIS 3 -35.285 3.300 2.509 17 HE1 HIS 3 HE1 HIS 3 -39.040 1.743 3.709 18 HE2 HIS 3 HE2 HIS 3 -36.712 2.353 4.449 19 H MET 4 HN MET 4 -33.869 5.931 -0.448 20 HA MET 4 HA MET 4 -34.109 5.519 -3.342 21 HB2 MET 4 HB2 MET 4 -32.184 7.081 -3.522 22 HB3 MET 4 HB1 MET 4 -33.580 7.806 -2.745 23 HG2 MET 4 HG2 MET 4 -32.510 7.388 -0.549 24 HG3 MET 4 HG1 MET 4 -31.085 6.800 -1.402 25 HE1 MET 4 HE1 MET 4 -31.139 8.826 -3.942 26 HE2 MET 4 HE2 MET 4 -29.663 8.344 -3.106 27 HE3 MET 4 HE3 MET 4 -30.007 10.052 -3.375 28 H GLN 5 HN GLN 5 -32.711 4.158 -4.409 29 HA GLN 5 HA GLN 5 -31.356 2.255 -2.726 30 HB2 GLN 5 HB2 GLN 5 -32.753 1.551 -4.651 31 HB3 GLN 5 HB1 GLN 5 -31.601 2.315 -5.733 32 HG2 GLN 5 HG2 GLN 5 -29.867 0.766 -5.005 33 HG3 GLN 5 HG1 GLN 5 -31.001 0.000 -3.893 34 HE21 GLN 5 HE21 GLN 5 -32.682 -1.245 -4.706 35 HE22 GLN 5 HE22 GLN 5 -32.623 -1.906 -6.328 36 H TYR 6 HN TYR 6 -29.226 1.820 -2.600 37 HA TYR 6 HA TYR 6 -27.412 3.598 -4.081 38 HB2 TYR 6 HB2 TYR 6 -27.380 2.870 -1.155 39 HB3 TYR 6 HB1 TYR 6 -25.862 3.254 -1.960 40 HD1 TYR 6 HD1 TYR 6 -25.497 5.526 -2.878 41 HD2 TYR 6 HD2 TYR 6 -28.982 4.555 -0.631 42 HE1 TYR 6 HE1 TYR 6 -25.932 7.917 -2.534 43 HE2 TYR 6 HE2 TYR 6 -29.428 6.946 -0.279 44 HH TYR 6 HH TYR 6 -28.323 9.057 -0.314 45 H LYS 7 HN LYS 7 -25.172 2.724 -4.203 46 HA LYS 7 HA LYS 7 -25.274 -0.197 -4.636 47 HB2 LYS 7 HB2 LYS 7 -25.578 1.292 -6.715 48 HB3 LYS 7 HB1 LYS 7 -23.886 1.746 -6.511 49 HG2 LYS 7 HG2 LYS 7 -24.876 -1.070 -6.949 50 HG3 LYS 7 HG1 LYS 7 -24.279 0.003 -8.204 51 HD2 LYS 7 HD2 LYS 7 -22.126 0.148 -6.953 52 HD3 LYS 7 HD1 LYS 7 -22.740 -1.116 -5.886 53 HE2 LYS 7 HE2 LYS 7 -22.367 -1.343 -8.868 54 HE3 LYS 7 HE1 LYS 7 -21.316 -2.042 -7.637 55 HZ1 LYS 7 HZ1 LYS 7 -22.812 -3.703 -8.476 56 HZ2 LYS 7 HZ2 LYS 7 -24.163 -2.739 -8.133 57 HZ3 LYS 7 HZ3 LYS 7 -23.223 -3.360 -6.870 58 H LEU 8 HN LEU 8 -23.425 -1.344 -4.093 59 HA LEU 8 HA LEU 8 -21.035 0.208 -3.330 60 HB2 LEU 8 HB2 LEU 8 -22.292 -0.377 -1.250 61 HB3 LEU 8 HB1 LEU 8 -22.257 -2.045 -1.738 62 HG LEU 8 HG LEU 8 -19.699 -1.866 -1.625 63 HD11 LEU 8 HD11 LEU 8 -18.872 -0.181 -0.035 64 HD12 LEU 8 HD12 LEU 8 -20.463 0.577 -0.022 65 HD13 LEU 8 HD13 LEU 8 -19.506 0.555 -1.504 66 HD21 LEU 8 HD21 LEU 8 -19.729 -2.257 0.800 67 HD22 LEU 8 HD22 LEU 8 -20.999 -3.144 -0.048 68 HD23 LEU 8 HD23 LEU 8 -21.393 -1.677 0.850 69 H ILE 9 HN ILE 9 -19.090 -0.718 -3.655 70 HA ILE 9 HA ILE 9 -19.016 -3.416 -4.816 71 HB ILE 9 HB ILE 9 -17.447 -1.013 -5.809 72 HG12 ILE 9 HG12 ILE 9 -19.439 -2.800 -7.268 73 HG13 ILE 9 HG11 ILE 9 -19.835 -1.162 -6.626 74 HG21 ILE 9 HG21 ILE 9 -17.266 -3.934 -6.532 75 HG22 ILE 9 HG22 ILE 9 -16.001 -2.911 -5.842 76 HG23 ILE 9 HG23 ILE 9 -16.558 -2.638 -7.495 77 HD11 ILE 9 HD11 ILE 9 -19.378 -1.046 -9.003 78 HD12 ILE 9 HD12 ILE 9 -17.827 -1.858 -8.789 79 HD13 ILE 9 HD13 ILE 9 -18.074 -0.241 -8.125 80 H LEU 10 HN LEU 10 -17.543 -4.714 -3.826 81 HA LEU 10 HA LEU 10 -15.775 -3.410 -1.897 82 HB2 LEU 10 HB2 LEU 10 -16.426 -6.348 -2.073 83 HB3 LEU 10 HB1 LEU 10 -15.422 -5.603 -0.867 84 HG LEU 10 HG LEU 10 -17.349 -5.940 0.298 85 HD11 LEU 10 HD11 LEU 10 -16.751 -3.571 0.385 86 HD12 LEU 10 HD12 LEU 10 -18.450 -3.908 0.719 87 HD13 LEU 10 HD13 LEU 10 -17.979 -3.265 -0.857 88 HD21 LEU 10 HD21 LEU 10 -19.601 -5.788 -0.539 89 HD22 LEU 10 HD22 LEU 10 -18.640 -6.815 -1.603 90 HD23 LEU 10 HD23 LEU 10 -19.017 -5.159 -2.076 91 H ASN 11 HN ASN 11 -13.998 -2.809 -2.885 92 HA ASN 11 HA ASN 11 -12.652 -4.649 -4.734 93 HB2 ASN 11 HB2 ASN 11 -12.102 -1.751 -3.984 94 HB3 ASN 11 HB1 ASN 11 -11.106 -2.691 -5.068 95 HD21 ASN 11 HD21 ASN 11 -11.538 -2.517 -7.139 96 HD22 ASN 11 HD22 ASN 11 -13.008 -1.944 -7.822 97 H GLY 12 HN GLY 12 -12.065 -6.141 -3.136 98 HA2 GLY 12 HA2 GLY 12 -9.548 -5.439 -1.846 99 HA3 GLY 12 HA1 GLY 12 -10.851 -6.002 -0.787 100 H LYS 13 HN LYS 13 -8.151 -7.112 -1.882 101 HA LYS 13 HA LYS 13 -8.600 -9.388 -3.398 102 HB2 LYS 13 HB2 LYS 13 -6.550 -8.924 -1.234 103 HB3 LYS 13 HB1 LYS 13 -6.581 -10.366 -2.235 104 HG2 LYS 13 HG2 LYS 13 -6.420 -8.837 -4.230 105 HG3 LYS 13 HG1 LYS 13 -6.071 -7.535 -3.086 106 HD2 LYS 13 HD2 LYS 13 -4.163 -8.798 -2.231 107 HD3 LYS 13 HD1 LYS 13 -4.526 -10.113 -3.349 108 HE2 LYS 13 HE2 LYS 13 -4.186 -8.544 -5.231 109 HE3 LYS 13 HE1 LYS 13 -3.704 -7.309 -4.070 110 HZ1 LYS 13 HZ1 LYS 13 -1.789 -8.419 -5.027 111 HZ2 LYS 13 HZ2 LYS 13 -2.349 -9.920 -4.469 112 HZ3 LYS 13 HZ3 LYS 13 -1.881 -8.725 -3.358 113 H THR 14 HN THR 14 -9.542 -8.831 -0.137 114 HA THR 14 HA THR 14 -9.656 -11.643 0.574 115 HB THR 14 HB THR 14 -10.953 -10.760 2.565 116 HG1 THR 14 HG1 THR 14 -10.058 -8.188 1.735 117 HG21 THR 14 HG21 THR 14 -8.210 -9.617 2.039 118 HG22 THR 14 HG22 THR 14 -8.570 -11.209 2.705 119 HG23 THR 14 HG23 THR 14 -8.966 -9.757 3.624 120 H LEU 15 HN LEU 15 -12.039 -9.069 -0.090 121 HA LEU 15 HA LEU 15 -13.903 -11.129 -1.024 122 HB2 LEU 15 HB2 LEU 15 -14.282 -9.268 1.204 123 HB3 LEU 15 HB1 LEU 15 -15.577 -9.235 0.041 124 HG LEU 15 HG LEU 15 -16.203 -10.735 1.770 125 HD11 LEU 15 HD11 LEU 15 -16.822 -11.444 -0.426 126 HD12 LEU 15 HD12 LEU 15 -16.395 -12.863 0.536 127 HD13 LEU 15 HD13 LEU 15 -15.262 -12.224 -0.657 128 HD21 LEU 15 HD21 LEU 15 -13.606 -12.197 1.319 129 HD22 LEU 15 HD22 LEU 15 -14.874 -12.640 2.462 130 HD23 LEU 15 HD23 LEU 15 -13.960 -11.149 2.691 131 H LYS 16 HN LYS 16 -13.922 -10.675 -3.164 132 HA LYS 16 HA LYS 16 -14.429 -7.881 -3.948 133 HB2 LYS 16 HB2 LYS 16 -13.584 -10.177 -5.731 134 HB3 LYS 16 HB1 LYS 16 -13.757 -8.498 -6.212 135 HG2 LYS 16 HG2 LYS 16 -11.554 -8.361 -5.857 136 HG3 LYS 16 HG1 LYS 16 -11.961 -8.345 -4.144 137 HD2 LYS 16 HD2 LYS 16 -10.219 -9.975 -4.852 138 HD3 LYS 16 HD1 LYS 16 -11.560 -10.657 -3.932 139 HE2 LYS 16 HE2 LYS 16 -12.579 -11.412 -6.041 140 HE3 LYS 16 HE1 LYS 16 -11.208 -10.748 -6.930 141 HZ1 LYS 16 HZ1 LYS 16 -9.754 -12.294 -5.789 142 HZ2 LYS 16 HZ2 LYS 16 -10.998 -13.135 -6.575 143 HZ3 LYS 16 HZ3 LYS 16 -11.055 -12.911 -4.898 144 H GLY 17 HN GLY 17 -16.405 -7.358 -4.579 145 HA2 GLY 17 HA2 GLY 17 -18.175 -8.900 -6.057 146 HA3 GLY 17 HA1 GLY 17 -18.549 -9.191 -4.362 147 H GLU 18 HN GLU 18 -20.626 -8.183 -5.311 148 HA GLU 18 HA GLU 18 -20.539 -5.318 -4.672 149 HB2 GLU 18 HB2 GLU 18 -21.926 -6.471 -7.104 150 HB3 GLU 18 HB1 GLU 18 -22.018 -4.799 -6.576 151 HG2 GLU 18 HG2 GLU 18 -19.695 -4.461 -7.041 152 HG3 GLU 18 HG1 GLU 18 -19.471 -6.176 -7.388 153 H THR 19 HN THR 19 -22.724 -4.406 -4.293 154 HA THR 19 HA THR 19 -24.938 -6.175 -3.866 155 HB THR 19 HB THR 19 -23.482 -6.648 -1.872 156 HG1 THR 19 HG1 THR 19 -25.289 -6.981 -0.819 157 HG21 THR 19 HG21 THR 19 -22.554 -4.385 -1.543 158 HG22 THR 19 HG22 THR 19 -23.389 -4.931 -0.083 159 HG23 THR 19 HG23 THR 19 -24.165 -3.776 -1.163 160 H THR 20 HN THR 20 -26.722 -4.898 -2.591 161 HA THR 20 HA THR 20 -26.597 -2.019 -3.102 162 HB THR 20 HB THR 20 -28.883 -2.070 -4.125 163 HG1 THR 20 HG1 THR 20 -28.408 -4.861 -4.467 164 HG21 THR 20 HG21 THR 20 -28.185 -2.949 -6.369 165 HG22 THR 20 HG22 THR 20 -26.710 -3.555 -5.614 166 HG23 THR 20 HG23 THR 20 -27.033 -1.823 -5.653 167 H THR 21 HN THR 21 -28.236 -0.829 -1.904 168 HA THR 21 HA THR 21 -29.933 -2.317 -0.084 169 HB THR 21 HB THR 21 -27.660 -2.082 1.108 170 HG1 THR 21 HG1 THR 21 -29.314 -0.841 2.842 171 HG21 THR 21 HG21 THR 21 -27.356 0.134 2.264 172 HG22 THR 21 HG22 THR 21 -28.635 0.798 1.244 173 HG23 THR 21 HG23 THR 21 -27.127 0.247 0.514 174 H GLU 22 HN GLU 22 -31.442 -0.937 1.055 175 HA GLU 22 HA GLU 22 -32.023 1.492 -0.489 176 HB2 GLU 22 HB2 GLU 22 -34.240 1.358 0.837 177 HB3 GLU 22 HB1 GLU 22 -33.968 0.121 -0.383 178 HG2 GLU 22 HG2 GLU 22 -33.384 -1.494 1.285 179 HG3 GLU 22 HG1 GLU 22 -33.422 -0.226 2.561 180 H ALA 23 HN ALA 23 -32.127 3.519 0.451 181 HA ALA 23 HA ALA 23 -31.716 3.679 3.370 182 HB1 ALA 23 HB1 ALA 23 -29.996 5.171 1.370 183 HB2 ALA 23 HB2 ALA 23 -29.481 3.772 2.310 184 HB3 ALA 23 HB3 ALA 23 -29.894 5.278 3.127 185 H VAL 24 HN VAL 24 -32.574 5.614 4.304 186 HA VAL 24 HA VAL 24 -34.250 7.185 2.494 187 HB VAL 24 HB VAL 24 -35.350 7.999 4.579 188 HG11 VAL 24 HG11 VAL 24 -35.256 5.015 4.165 189 HG12 VAL 24 HG12 VAL 24 -36.324 6.164 3.358 190 HG13 VAL 24 HG13 VAL 24 -36.494 5.867 5.087 191 HG21 VAL 24 HG21 VAL 24 -33.464 7.673 6.113 192 HG22 VAL 24 HG22 VAL 24 -33.614 5.925 5.923 193 HG23 VAL 24 HG23 VAL 24 -34.911 6.844 6.687 194 H ASP 25 HN ASP 25 -31.233 7.399 3.403 195 HA ASP 25 HA ASP 25 -31.025 10.212 3.114 196 HB2 ASP 25 HB2 ASP 25 -31.605 9.992 5.576 197 HB3 ASP 25 HB1 ASP 25 -30.101 9.100 5.779 198 H ALA 26 HN ALA 26 -28.702 10.830 3.044 199 HA ALA 26 HA ALA 26 -27.206 8.792 1.690 200 HB1 ALA 26 HB1 ALA 26 -27.159 11.157 0.986 201 HB2 ALA 26 HB2 ALA 26 -25.546 10.529 1.323 202 HB3 ALA 26 HB3 ALA 26 -26.345 11.576 2.495 203 H ALA 27 HN ALA 27 -27.091 10.318 4.863 204 HA ALA 27 HA ALA 27 -24.499 9.345 5.568 205 HB1 ALA 27 HB1 ALA 27 -26.753 10.206 7.376 206 HB2 ALA 27 HB2 ALA 27 -25.540 11.273 6.673 207 HB3 ALA 27 HB3 ALA 27 -25.056 10.032 7.829 208 H THR 28 HN THR 28 -27.746 8.103 5.839 209 HA THR 28 HA THR 28 -27.194 5.988 7.641 210 HB THR 28 HB THR 28 -29.386 5.900 5.579 211 HG1 THR 28 HG1 THR 28 -30.293 7.146 7.734 212 HG21 THR 28 HG21 THR 28 -29.256 5.090 8.496 213 HG22 THR 28 HG22 THR 28 -29.156 3.990 7.122 214 HG23 THR 28 HG23 THR 28 -30.649 4.879 7.432 215 H ALA 29 HN ALA 29 -26.759 6.357 4.213 216 HA ALA 29 HA ALA 29 -26.811 3.575 3.540 217 HB1 ALA 29 HB1 ALA 29 -25.944 4.282 1.378 218 HB2 ALA 29 HB2 ALA 29 -25.635 5.898 2.014 219 HB3 ALA 29 HB3 ALA 29 -27.291 5.304 1.878 220 H GLU 30 HN GLU 30 -24.307 5.962 4.211 221 HA GLU 30 HA GLU 30 -22.097 4.262 3.746 222 HB2 GLU 30 HB2 GLU 30 -22.347 6.913 4.207 223 HB3 GLU 30 HB1 GLU 30 -21.882 6.376 5.807 224 HG2 GLU 30 HG2 GLU 30 -19.898 5.253 4.775 225 HG3 GLU 30 HG1 GLU 30 -20.321 6.069 3.269 226 H LYS 31 HN LYS 31 -23.639 5.307 6.782 227 HA LYS 31 HA LYS 31 -22.143 3.871 8.560 228 HB2 LYS 31 HB2 LYS 31 -25.036 4.663 8.693 229 HB3 LYS 31 HB1 LYS 31 -24.198 3.912 10.043 230 HG2 LYS 31 HG2 LYS 31 -23.577 6.562 8.754 231 HG3 LYS 31 HG1 LYS 31 -24.193 6.272 10.380 232 HD2 LYS 31 HD2 LYS 31 -21.466 5.522 9.320 233 HD3 LYS 31 HD1 LYS 31 -21.832 6.796 10.483 234 HE2 LYS 31 HE2 LYS 31 -22.366 3.861 10.936 235 HE3 LYS 31 HE1 LYS 31 -20.933 4.712 11.509 236 HZ1 LYS 31 HZ1 LYS 31 -22.911 4.409 13.096 237 HZ2 LYS 31 HZ2 LYS 31 -23.623 5.680 12.224 238 HZ3 LYS 31 HZ3 LYS 31 -22.153 5.926 13.026 239 H VAL 32 HN VAL 32 -25.007 2.679 6.813 240 HA VAL 32 HA VAL 32 -25.112 0.196 8.198 241 HB VAL 32 HB VAL 32 -26.262 0.988 5.514 242 HG11 VAL 32 HG11 VAL 32 -26.864 -1.444 7.192 243 HG12 VAL 32 HG12 VAL 32 -25.971 -1.444 5.673 244 HG13 VAL 32 HG13 VAL 32 -27.674 -0.985 5.695 245 HG21 VAL 32 HG21 VAL 32 -27.173 2.244 7.396 246 HG22 VAL 32 HG22 VAL 32 -27.529 0.735 8.240 247 HG23 VAL 32 HG23 VAL 32 -28.373 1.128 6.742 248 H PHE 33 HN PHE 33 -23.873 1.081 4.977 249 HA PHE 33 HA PHE 33 -22.956 -1.538 4.375 250 HB2 PHE 33 HB2 PHE 33 -22.564 1.147 3.156 251 HB3 PHE 33 HB1 PHE 33 -21.414 -0.105 2.744 252 HD1 PHE 33 HD1 PHE 33 -23.560 -2.351 2.973 253 HD2 PHE 33 HD2 PHE 33 -23.391 1.369 0.917 254 HE1 PHE 33 HE1 PHE 33 -25.162 -3.201 1.308 255 HE2 PHE 33 HE2 PHE 33 -24.988 0.528 -0.751 256 HZ PHE 33 HZ PHE 33 -25.764 -1.777 -0.651 257 H LYS 34 HN LYS 34 -21.552 1.013 6.292 258 HA LYS 34 HA LYS 34 -18.867 0.118 6.030 259 HB2 LYS 34 HB2 LYS 34 -20.242 1.882 8.035 260 HB3 LYS 34 HB1 LYS 34 -18.545 1.528 8.143 261 HG2 LYS 34 HG2 LYS 34 -18.459 2.408 5.696 262 HG3 LYS 34 HG1 LYS 34 -20.003 3.150 6.105 263 HD2 LYS 34 HD2 LYS 34 -18.354 4.792 6.563 264 HD3 LYS 34 HD1 LYS 34 -18.897 4.148 8.114 265 HE2 LYS 34 HE2 LYS 34 -16.495 4.346 8.119 266 HE3 LYS 34 HE1 LYS 34 -16.946 2.640 8.150 267 HZ1 LYS 34 HZ1 LYS 34 -16.436 2.505 5.813 268 HZ2 LYS 34 HZ2 LYS 34 -15.103 3.150 6.629 269 HZ3 LYS 34 HZ3 LYS 34 -16.123 4.168 5.736 270 H GLN 35 HN GLN 35 -21.448 -0.453 8.351 271 HA GLN 35 HA GLN 35 -19.953 -2.227 9.995 272 HB2 GLN 35 HB2 GLN 35 -22.063 -1.080 10.702 273 HB3 GLN 35 HB1 GLN 35 -22.960 -2.113 9.602 274 HG2 GLN 35 HG2 GLN 35 -23.210 -3.041 11.743 275 HG3 GLN 35 HG1 GLN 35 -22.076 -4.077 10.881 276 HE21 GLN 35 HE21 GLN 35 -22.523 -3.652 13.741 277 HE22 GLN 35 HE22 GLN 35 -20.982 -3.209 14.395 278 H TYR 36 HN TYR 36 -21.829 -2.507 7.096 279 HA TYR 36 HA TYR 36 -22.058 -5.320 6.929 280 HB2 TYR 36 HB2 TYR 36 -23.500 -4.051 5.546 281 HB3 TYR 36 HB1 TYR 36 -22.191 -3.033 4.980 282 HD1 TYR 36 HD1 TYR 36 -23.287 -6.611 4.834 283 HD2 TYR 36 HD2 TYR 36 -21.349 -3.361 2.924 284 HE1 TYR 36 HE1 TYR 36 -23.063 -7.957 2.791 285 HE2 TYR 36 HE2 TYR 36 -21.118 -4.673 0.859 286 HH TYR 36 HH TYR 36 -21.050 -7.073 0.216 287 H ALA 37 HN ALA 37 -19.820 -3.014 5.429 288 HA ALA 37 HA ALA 37 -18.119 -4.948 4.256 289 HB1 ALA 37 HB1 ALA 37 -17.477 -2.096 5.032 290 HB2 ALA 37 HB2 ALA 37 -18.262 -2.584 3.531 291 HB3 ALA 37 HB3 ALA 37 -16.604 -3.091 3.866 292 H ASN 38 HN ASN 38 -18.316 -3.464 7.397 293 HA ASN 38 HA ASN 38 -15.735 -4.036 8.381 294 HB2 ASN 38 HB2 ASN 38 -17.359 -2.477 9.496 295 HB3 ASN 38 HB1 ASN 38 -18.331 -3.867 9.965 296 HD21 ASN 38 HD21 ASN 38 -15.720 -1.832 10.825 297 HD22 ASN 38 HD22 ASN 38 -15.178 -2.746 12.252 298 H ASP 39 HN ASP 39 -18.722 -5.935 8.378 299 HA ASP 39 HA ASP 39 -17.849 -8.073 9.959 300 HB2 ASP 39 HB2 ASP 39 -19.916 -7.808 7.812 301 HB3 ASP 39 HB1 ASP 39 -19.522 -9.403 8.441 302 H ASN 40 HN ASN 40 -17.048 -7.235 6.707 303 HA ASN 40 HA ASN 40 -15.897 -9.892 6.264 304 HB2 ASN 40 HB2 ASN 40 -16.706 -7.695 4.364 305 HB3 ASN 40 HB1 ASN 40 -15.689 -9.038 3.871 306 HD21 ASN 40 HD21 ASN 40 -18.889 -7.999 4.638 307 HD22 ASN 40 HD22 ASN 40 -19.694 -9.528 4.273 308 H GLY 41 HN GLY 41 -15.025 -7.182 7.645 309 HA2 GLY 41 HA2 GLY 41 -13.005 -6.225 8.158 310 HA3 GLY 41 HA1 GLY 41 -12.255 -7.620 7.400 311 H VAL 42 HN VAL 42 -14.399 -5.707 5.461 312 HA VAL 42 HA VAL 42 -12.077 -4.780 3.963 313 HB VAL 42 HB VAL 42 -14.954 -5.075 3.059 314 HG11 VAL 42 HG11 VAL 42 -12.462 -4.202 1.587 315 HG12 VAL 42 HG12 VAL 42 -13.882 -3.219 1.932 316 HG13 VAL 42 HG13 VAL 42 -14.001 -4.580 0.812 317 HG21 VAL 42 HG21 VAL 42 -14.000 -6.868 1.635 318 HG22 VAL 42 HG22 VAL 42 -13.859 -7.213 3.361 319 HG23 VAL 42 HG23 VAL 42 -12.450 -6.654 2.455 320 H ASP 43 HN ASP 43 -11.509 -2.863 4.612 321 HA ASP 43 HA ASP 43 -13.445 -0.720 4.319 322 HB2 ASP 43 HB2 ASP 43 -13.302 -1.350 6.805 323 HB3 ASP 43 HB1 ASP 43 -11.653 -0.734 6.751 324 H GLY 44 HN GLY 44 -12.477 1.206 3.613 325 HA2 GLY 44 HA2 GLY 44 -9.676 1.527 3.353 326 HA3 GLY 44 HA1 GLY 44 -10.354 0.860 1.874 327 H GLU 45 HN GLU 45 -9.452 3.006 1.112 328 HA GLU 45 HA GLU 45 -10.634 5.462 1.747 329 HB2 GLU 45 HB2 GLU 45 -9.349 4.388 -0.754 330 HB3 GLU 45 HB1 GLU 45 -10.016 6.014 -0.706 331 HG2 GLU 45 HG2 GLU 45 -8.528 6.551 1.170 332 HG3 GLU 45 HG1 GLU 45 -7.847 4.928 1.082 333 H TRP 46 HN TRP 46 -12.699 5.925 1.752 334 HA TRP 46 HA TRP 46 -14.565 4.478 0.069 335 HB2 TRP 46 HB2 TRP 46 -14.933 6.400 2.362 336 HB3 TRP 46 HB1 TRP 46 -16.256 6.154 1.244 337 HD1 TRP 46 HD1 TRP 46 -13.835 3.828 3.216 338 HE1 TRP 46 HE1 TRP 46 -15.167 1.840 4.128 339 HE3 TRP 46 HE3 TRP 46 -18.521 5.080 1.458 340 HZ2 TRP 46 HZ2 TRP 46 -17.817 0.954 4.144 341 HZ3 TRP 46 HZ3 TRP 46 -20.396 3.607 2.039 342 HH2 TRP 46 HH2 TRP 46 -20.045 1.575 3.340 343 H THR 47 HN THR 47 -14.703 5.035 -1.962 344 HA THR 47 HA THR 47 -14.699 7.890 -2.684 345 HB THR 47 HB THR 47 -14.566 6.309 -5.027 346 HG1 THR 47 HG1 THR 47 -13.176 5.219 -2.863 347 HG21 THR 47 HG21 THR 47 -12.426 7.869 -3.565 348 HG22 THR 47 HG22 THR 47 -13.557 8.508 -4.758 349 HG23 THR 47 HG23 THR 47 -12.333 7.337 -5.244 350 H TYR 48 HN TYR 48 -16.289 8.531 -4.373 351 HA TYR 48 HA TYR 48 -18.588 6.769 -4.623 352 HB2 TYR 48 HB2 TYR 48 -19.078 7.897 -2.574 353 HB3 TYR 48 HB1 TYR 48 -18.651 9.428 -3.214 354 HD1 TYR 48 HD1 TYR 48 -20.220 10.800 -4.330 355 HD2 TYR 48 HD2 TYR 48 -21.239 6.758 -3.412 356 HE1 TYR 48 HE1 TYR 48 -22.561 11.258 -4.905 357 HE2 TYR 48 HE2 TYR 48 -23.578 7.222 -3.990 358 HH TYR 48 HH TYR 48 -25.091 9.233 -4.096 359 H ASP 49 HN ASP 49 -19.964 7.287 -6.348 360 HA ASP 49 HA ASP 49 -19.054 9.529 -8.074 361 HB2 ASP 49 HB2 ASP 49 -18.521 7.327 -9.177 362 HB3 ASP 49 HB1 ASP 49 -20.216 6.902 -9.102 363 H ASP 50 HN ASP 50 -20.702 10.734 -9.087 364 HA ASP 50 HA ASP 50 -23.117 10.826 -7.449 365 HB2 ASP 50 HB2 ASP 50 -22.029 12.960 -8.005 366 HB3 ASP 50 HB1 ASP 50 -22.150 12.595 -9.722 367 H ALA 51 HN ALA 51 -22.243 9.973 -10.750 368 HA ALA 51 HA ALA 51 -24.950 9.996 -11.694 369 HB1 ALA 51 HB1 ALA 51 -23.022 10.405 -13.170 370 HB2 ALA 51 HB2 ALA 51 -24.069 9.107 -13.748 371 HB3 ALA 51 HB3 ALA 51 -22.539 8.720 -12.964 372 H THR 52 HN THR 52 -22.889 7.584 -10.237 373 HA THR 52 HA THR 52 -24.856 5.525 -10.917 374 HB THR 52 HB THR 52 -23.016 3.944 -10.184 375 HG1 THR 52 HG1 THR 52 -21.281 6.156 -10.511 376 HG21 THR 52 HG21 THR 52 -22.338 5.819 -12.461 377 HG22 THR 52 HG22 THR 52 -23.493 4.489 -12.567 378 HG23 THR 52 HG23 THR 52 -21.786 4.158 -12.267 379 H LYS 53 HN LYS 53 -23.829 7.360 -8.203 380 HA LYS 53 HA LYS 53 -24.256 7.226 -5.930 381 HB2 LYS 53 HB2 LYS 53 -26.471 5.493 -7.015 382 HB3 LYS 53 HB1 LYS 53 -26.235 5.679 -5.285 383 HG2 LYS 53 HG2 LYS 53 -27.915 7.227 -5.999 384 HG3 LYS 53 HG1 LYS 53 -26.467 8.129 -5.550 385 HD2 LYS 53 HD2 LYS 53 -25.864 8.254 -7.951 386 HD3 LYS 53 HD1 LYS 53 -27.394 7.469 -8.345 387 HE2 LYS 53 HE2 LYS 53 -28.608 9.301 -7.273 388 HE3 LYS 53 HE1 LYS 53 -27.079 10.095 -6.905 389 HZ1 LYS 53 HZ1 LYS 53 -28.159 10.991 -8.899 390 HZ2 LYS 53 HZ2 LYS 53 -28.052 9.465 -9.638 391 HZ3 LYS 53 HZ3 LYS 53 -26.638 10.320 -9.247 392 H THR 54 HN THR 54 -22.464 5.378 -7.329 393 HA THR 54 HA THR 54 -22.508 2.948 -5.780 394 HB THR 54 HB THR 54 -20.475 3.850 -7.851 395 HG1 THR 54 HG1 THR 54 -22.962 3.282 -8.251 396 HG21 THR 54 HG21 THR 54 -19.810 1.522 -7.944 397 HG22 THR 54 HG22 THR 54 -21.092 1.057 -6.828 398 HG23 THR 54 HG23 THR 54 -19.734 2.034 -6.256 399 H TYR 55 HN TYR 55 -21.733 3.022 -3.773 400 HA TYR 55 HA TYR 55 -19.441 4.624 -3.054 401 HB2 TYR 55 HB2 TYR 55 -20.941 2.473 -1.484 402 HB3 TYR 55 HB1 TYR 55 -19.611 3.419 -0.834 403 HD1 TYR 55 HD1 TYR 55 -23.144 3.234 -1.267 404 HD2 TYR 55 HD2 TYR 55 -19.935 5.994 -0.768 405 HE1 TYR 55 HE1 TYR 55 -24.737 4.957 -0.544 406 HE2 TYR 55 HE2 TYR 55 -21.522 7.711 -0.032 407 HH TYR 55 HH TYR 55 -24.754 7.018 0.770 408 H THR 56 HN THR 56 -17.396 3.989 -3.415 409 HA THR 56 HA THR 56 -16.932 1.125 -3.876 410 HB THR 56 HB THR 56 -15.220 3.403 -4.909 411 HG1 THR 56 HG1 THR 56 -16.280 3.061 -6.891 412 HG21 THR 56 HG21 THR 56 -15.334 0.480 -5.686 413 HG22 THR 56 HG22 THR 56 -14.092 1.209 -4.669 414 HG23 THR 56 HG23 THR 56 -14.246 1.696 -6.358 415 H VAL 57 HN VAL 57 -15.833 0.111 -2.348 416 HA VAL 57 HA VAL 57 -14.031 1.712 -0.647 417 HB VAL 57 HB VAL 57 -15.916 0.793 0.707 418 HG11 VAL 57 HG11 VAL 57 -16.478 -1.248 -0.413 419 HG12 VAL 57 HG12 VAL 57 -15.950 -1.645 1.217 420 HG13 VAL 57 HG13 VAL 57 -14.861 -1.896 -0.142 421 HG21 VAL 57 HG21 VAL 57 -13.767 1.206 1.741 422 HG22 VAL 57 HG22 VAL 57 -13.229 -0.417 1.315 423 HG23 VAL 57 HG23 VAL 57 -14.545 -0.200 2.468 424 H THR 58 HN THR 58 -12.029 1.399 -1.150 425 HA THR 58 HA THR 58 -11.248 -1.161 -2.367 426 HB THR 58 HB THR 58 -9.750 1.453 -2.586 427 HG1 THR 58 HG1 THR 58 -12.119 0.669 -3.750 428 HG21 THR 58 HG21 THR 58 -8.811 0.434 -4.587 429 HG22 THR 58 HG22 THR 58 -9.833 -0.988 -4.372 430 HG23 THR 58 HG23 THR 58 -8.557 -0.632 -3.205 431 H GLU 59 HN GLU 59 -9.789 -2.408 -1.393 432 HA GLU 59 HA GLU 59 -8.709 -1.668 1.159 433 HB2 GLU 59 HB2 GLU 59 -8.119 -4.090 -0.576 434 HB3 GLU 59 HB1 GLU 59 -7.431 -3.855 1.000 435 HG2 GLU 59 HG2 GLU 59 -9.871 -3.757 1.842 436 HG3 GLU 59 HG1 GLU 59 -10.268 -4.471 0.280 437 H GLY 60 HN GLY 60 -6.401 -1.540 1.697 438 HA2 GLY 60 HA2 GLY 60 -4.600 -1.013 -0.540 439 HA3 GLY 60 HA1 GLY 60 -4.972 0.364 0.491 440 H SER 61 HN SER 61 -2.613 0.292 0.830 441 HA SER 61 HA SER 61 -0.822 -0.038 2.176 442 HB2 SER 61 HB2 SER 61 -2.790 -1.426 4.019 443 HB3 SER 61 HB1 SER 61 -1.204 -0.797 4.464 444 HG SER 61 HG SER 61 -2.873 0.655 5.014 445 H GLY 62 HN GLY 62 -0.077 -2.212 3.816 446 HA2 GLY 62 HA2 GLY 62 -0.213 -4.726 3.459 447 HA3 GLY 62 HA1 GLY 62 0.140 -4.331 1.780 448 H GLY 63 HN GLY 63 2.115 -5.473 1.739 449 HA2 GLY 63 HA2 GLY 63 4.153 -5.126 3.664 450 HA3 GLY 63 HA1 GLY 63 4.360 -5.796 2.052 451 H ALA 64 HN ALA 64 3.045 -3.064 1.259 452 HA ALA 64 HA ALA 64 3.623 -0.974 0.627 453 HB1 ALA 64 HB1 ALA 64 6.013 -1.239 2.445 454 HB2 ALA 64 HB2 ALA 64 4.433 -0.613 2.913 455 HB3 ALA 64 HB3 ALA 64 5.406 0.252 1.722 456 H GLY 65 HN GLY 65 6.605 -2.912 0.875 457 HA2 GLY 65 HA2 GLY 65 7.911 -3.676 -0.911 458 HA3 GLY 65 HA1 GLY 65 6.963 -2.677 -2.005 459 H GLY 66 HN GLY 66 9.647 -2.755 0.227 460 HA2 GLY 66 HA2 GLY 66 10.300 0.040 -0.313 461 HA3 GLY 66 HA1 GLY 66 11.143 -1.026 0.803 462 H GLN 67 HN GLN 67 10.674 -2.668 -2.027 463 HA GLN 67 HA GLN 67 13.075 -1.660 -3.345 464 HB2 GLN 67 HB2 GLN 67 12.731 -4.463 -2.252 465 HB3 GLN 67 HB1 GLN 67 13.822 -4.110 -3.616 466 HG2 GLN 67 HG2 GLN 67 13.998 -2.772 -0.925 467 HG3 GLN 67 HG1 GLN 67 14.910 -4.212 -1.373 468 HE21 GLN 67 HE21 GLN 67 16.866 -3.175 -1.121 469 HE22 GLN 67 HE22 GLN 67 17.456 -2.009 -2.269 470 H GLY 68 HN GLY 68 12.720 -1.521 -5.453 471 HA2 GLY 68 HA2 GLY 68 10.444 -2.924 -6.626 472 HA3 GLY 68 HA1 GLY 68 11.387 -1.649 -7.389 473 H MET 69 HN MET 69 13.733 -2.274 -7.789 474 HA MET 69 HA MET 69 15.271 -3.505 -8.888 475 HB2 MET 69 HB2 MET 69 13.952 -5.759 -7.383 476 HB3 MET 69 HB1 MET 69 15.466 -5.907 -8.264 477 HG2 MET 69 HG2 MET 69 14.951 -4.097 -5.917 478 HG3 MET 69 HG1 MET 69 15.855 -5.609 -5.890 479 HE1 MET 69 HE1 MET 69 17.893 -4.391 -4.733 480 HE2 MET 69 HE2 MET 69 17.022 -2.858 -4.747 481 HE3 MET 69 HE3 MET 69 18.669 -2.943 -5.374 482 H ILE 70 HN ILE 70 12.372 -3.329 -9.942 483 HA ILE 70 HA ILE 70 12.796 -5.223 -12.140 484 HB ILE 70 HB ILE 70 10.086 -4.724 -10.841 485 HG12 ILE 70 HG12 ILE 70 11.516 -6.282 -9.571 486 HG13 ILE 70 HG11 ILE 70 10.123 -7.097 -10.268 487 HG21 ILE 70 HG21 ILE 70 10.728 -6.543 -13.185 488 HG22 ILE 70 HG22 ILE 70 9.996 -4.946 -13.337 489 HG23 ILE 70 HG23 ILE 70 9.140 -6.233 -12.483 490 HD11 ILE 70 HD11 ILE 70 12.929 -7.159 -11.354 491 HD12 ILE 70 HD12 ILE 70 11.535 -7.979 -12.059 492 HD13 ILE 70 HD13 ILE 70 12.125 -8.454 -10.466 493 H GLN 71 HN GLN 71 13.661 -3.357 -13.211 494 HA GLN 71 HA GLN 71 11.625 -1.372 -13.942 495 HB2 GLN 71 HB2 GLN 71 13.538 0.124 -14.488 496 HB3 GLN 71 HB1 GLN 71 13.427 -0.304 -12.791 497 HG2 GLN 71 HG2 GLN 71 15.189 -2.027 -13.182 498 HG3 GLN 71 HG1 GLN 71 15.361 -1.399 -14.821 499 HE21 GLN 71 HE21 GLN 71 17.285 -1.478 -12.604 500 HE22 GLN 71 HE22 GLN 71 17.777 0.160 -12.330 501 H GLU 72 HN GLU 72 12.345 -4.070 -15.090 502 HA GLU 72 HA GLU 72 13.422 -3.660 -17.660 503 HB2 GLU 72 HB2 GLU 72 12.684 -5.881 -18.193 504 HB3 GLU 72 HB1 GLU 72 13.286 -5.880 -16.545 505 HG2 GLU 72 HG2 GLU 72 10.975 -5.827 -15.716 506 HG3 GLU 72 HG1 GLU 72 10.404 -5.839 -17.384 507 HA PRO 73 HA PRO 73 10.181 -1.647 -19.728 508 HB2 PRO 73 HB2 PRO 73 10.648 -2.304 -22.305 509 HB3 PRO 73 HB1 PRO 73 11.801 -1.290 -21.353 510 HG2 PRO 73 HG2 PRO 73 11.909 -4.248 -21.944 511 HG3 PRO 73 HG1 PRO 73 13.199 -3.034 -22.060 512 HD2 PRO 73 HD2 PRO 73 12.929 -4.692 -19.925 513 HD3 PRO 73 HD1 PRO 73 13.579 -3.024 -19.788 514 H ALA 74 HN ALA 74 8.535 -1.865 -21.453 515 HA ALA 74 HA ALA 74 6.812 -2.795 -22.550 516 HB1 ALA 74 HB1 ALA 74 8.352 -4.635 -23.117 517 HB2 ALA 74 HB2 ALA 74 6.661 -5.117 -23.002 518 HB3 ALA 74 HB3 ALA 74 7.779 -5.502 -21.693 519 H LEU 75 HN LEU 75 5.170 -2.008 -21.478 520 HA LEU 75 HA LEU 75 4.069 -3.504 -19.196 521 HB2 LEU 75 HB2 LEU 75 3.409 -0.758 -20.287 522 HB3 LEU 75 HB1 LEU 75 2.460 -1.545 -19.075 523 HG LEU 75 HG LEU 75 3.804 0.055 -17.972 524 HD11 LEU 75 HD11 LEU 75 5.149 -1.345 -16.459 525 HD12 LEU 75 HD12 LEU 75 4.980 -2.700 -17.575 526 HD13 LEU 75 HD13 LEU 75 3.556 -2.035 -16.774 527 HD21 LEU 75 HD21 LEU 75 5.505 0.365 -19.697 528 HD22 LEU 75 HD22 LEU 75 6.202 -1.208 -19.308 529 HD23 LEU 75 HD23 LEU 75 6.245 0.093 -18.118 530 HA PRO 76 HA PRO 76 1.070 -5.101 -22.074 531 HB2 PRO 76 HB2 PRO 76 -0.917 -5.860 -20.417 532 HB3 PRO 76 HB1 PRO 76 0.595 -6.719 -20.486 533 HG2 PRO 76 HG2 PRO 76 -0.342 -4.750 -18.458 534 HG3 PRO 76 HG1 PRO 76 0.622 -6.254 -18.237 535 HD2 PRO 76 HD2 PRO 76 1.677 -3.680 -18.295 536 HD3 PRO 76 HD1 PRO 76 2.599 -5.145 -18.649 537 HA PRO 77 HA PRO 77 -1.359 -1.683 -23.444 538 HB2 PRO 77 HB2 PRO 77 -3.380 -3.897 -23.800 539 HB3 PRO 77 HB1 PRO 77 -3.018 -2.552 -24.895 540 HG2 PRO 77 HG2 PRO 77 -1.946 -4.876 -25.418 541 HG3 PRO 77 HG1 PRO 77 -0.921 -3.427 -25.459 542 HD2 PRO 77 HD2 PRO 77 -1.049 -5.580 -23.358 543 HD3 PRO 77 HD1 PRO 77 0.365 -4.645 -23.972 544 H GLY 78 HN GLY 78 -2.496 -0.193 -22.383 545 HA2 GLY 78 HA2 GLY 78 -4.258 0.649 -21.097 546 HA3 GLY 78 HA1 GLY 78 -4.690 -0.987 -20.647 547 H TRP 79 HN TRP 79 -1.615 -1.200 -19.854 548 HA TRP 79 HA TRP 79 -2.178 -0.381 -17.085 549 HB2 TRP 79 HB2 TRP 79 -0.046 -2.147 -18.298 550 HB3 TRP 79 HB1 TRP 79 -0.080 -1.737 -16.597 551 HD1 TRP 79 HD1 TRP 79 -2.130 -3.631 -19.235 552 HE1 TRP 79 HE1 TRP 79 -3.448 -5.485 -18.067 553 HE3 TRP 79 HE3 TRP 79 -1.075 -2.392 -14.418 554 HZ2 TRP 79 HZ2 TRP 79 -4.050 -6.270 -15.396 555 HZ3 TRP 79 HZ3 TRP 79 -2.074 -3.716 -12.600 556 HH2 TRP 79 HH2 TRP 79 -3.529 -5.610 -13.077 557 H GLU 80 HN GLU 80 -0.847 1.021 -15.892 558 HA GLU 80 HA GLU 80 1.389 2.325 -17.310 559 HB2 GLU 80 HB2 GLU 80 -0.552 3.847 -17.263 560 HB3 GLU 80 HB1 GLU 80 -0.768 3.557 -15.550 561 HG2 GLU 80 HG2 GLU 80 0.219 5.629 -15.594 562 HG3 GLU 80 HG1 GLU 80 1.585 4.556 -15.302 563 H MET 81 HN MET 81 3.148 2.915 -15.989 564 HA MET 81 HA MET 81 3.077 1.753 -13.293 565 HB2 MET 81 HB2 MET 81 4.256 0.274 -14.911 566 HB3 MET 81 HB1 MET 81 5.396 1.602 -15.230 567 HG2 MET 81 HG2 MET 81 5.002 0.497 -12.467 568 HG3 MET 81 HG1 MET 81 6.087 -0.276 -13.619 569 HE1 MET 81 HE1 MET 81 8.726 2.555 -14.278 570 HE2 MET 81 HE2 MET 81 7.255 2.278 -15.213 571 HE3 MET 81 HE3 MET 81 8.227 0.912 -14.665 572 H LYS 82 HN LYS 82 3.835 3.087 -11.701 573 HA LYS 82 HA LYS 82 5.713 5.194 -12.311 574 HB2 LYS 82 HB2 LYS 82 2.995 5.942 -11.175 575 HB3 LYS 82 HB1 LYS 82 4.347 7.029 -11.404 576 HG2 LYS 82 HG2 LYS 82 4.184 6.706 -13.842 577 HG3 LYS 82 HG1 LYS 82 2.761 5.653 -13.570 578 HD2 LYS 82 HD2 LYS 82 1.661 7.578 -12.421 579 HD3 LYS 82 HD1 LYS 82 3.034 8.588 -12.881 580 HE2 LYS 82 HE2 LYS 82 1.134 7.167 -14.743 581 HE3 LYS 82 HE1 LYS 82 1.199 8.901 -14.435 582 HZ1 LYS 82 HZ1 LYS 82 3.643 8.625 -15.244 583 HZ2 LYS 82 HZ2 LYS 82 2.384 8.730 -16.370 584 HZ3 LYS 82 HZ3 LYS 82 3.045 7.215 -15.987 585 H TYR 83 HN TYR 83 6.615 6.151 -10.348 586 HA TYR 83 HA TYR 83 6.318 4.327 -8.040 587 HB2 TYR 83 HB2 TYR 83 8.673 6.077 -8.877 588 HB3 TYR 83 HB1 TYR 83 8.627 5.117 -7.376 589 HD1 TYR 83 HD1 TYR 83 8.925 5.002 -11.046 590 HD2 TYR 83 HD2 TYR 83 8.962 2.723 -7.450 591 HE1 TYR 83 HE1 TYR 83 9.917 3.111 -12.257 592 HE2 TYR 83 HE2 TYR 83 9.952 0.822 -8.661 593 HH TYR 83 HH TYR 83 11.233 1.133 -11.800 594 H THR 84 HN THR 84 6.486 5.320 -5.882 595 HA THR 84 HA THR 84 5.394 8.042 -5.881 596 HB THR 84 HB THR 84 4.577 7.674 -3.701 597 HG1 THR 84 HG1 THR 84 5.393 6.103 -2.320 598 HG21 THR 84 HG21 THR 84 3.334 6.331 -5.286 599 HG22 THR 84 HG22 THR 84 3.438 5.485 -3.743 600 HG23 THR 84 HG23 THR 84 4.468 4.996 -5.091 601 H SER 85 HN SER 85 6.253 9.332 -3.836 602 HA SER 85 HA SER 85 9.054 9.714 -4.295 603 HB2 SER 85 HB2 SER 85 8.589 11.456 -2.372 604 HB3 SER 85 HB1 SER 85 7.945 11.714 -3.994 605 HG SER 85 HG SER 85 6.350 12.008 -2.363 606 H GLU 86 HN GLU 86 7.754 7.339 -2.642 607 HA GLU 86 HA GLU 86 9.636 7.516 -0.346 608 HB2 GLU 86 HB2 GLU 86 6.952 6.097 -0.498 609 HB3 GLU 86 HB1 GLU 86 8.030 6.072 0.891 610 HG2 GLU 86 HG2 GLU 86 6.728 8.527 -0.261 611 HG3 GLU 86 HG1 GLU 86 6.152 7.631 1.145 612 H GLY 87 HN GLY 87 9.329 6.169 -3.255 613 HA2 GLY 87 HA2 GLY 87 10.649 4.445 -4.127 614 HA3 GLY 87 HA1 GLY 87 10.892 3.841 -2.495 615 H VAL 88 HN VAL 88 7.689 4.395 -2.729 616 HA VAL 88 HA VAL 88 7.088 1.587 -3.002 617 HB VAL 88 HB VAL 88 5.269 3.965 -2.535 618 HG11 VAL 88 HG11 VAL 88 4.653 1.015 -2.380 619 HG12 VAL 88 HG12 VAL 88 4.019 2.153 -3.570 620 HG13 VAL 88 HG13 VAL 88 3.573 2.313 -1.873 621 HG21 VAL 88 HG21 VAL 88 6.823 3.557 -0.702 622 HG22 VAL 88 HG22 VAL 88 6.309 1.873 -0.631 623 HG23 VAL 88 HG23 VAL 88 5.171 3.159 -0.229 624 H ARG 89 HN ARG 89 5.758 0.685 -4.601 625 HA ARG 89 HA ARG 89 5.693 2.228 -7.114 626 HB2 ARG 89 HB2 ARG 89 7.200 0.286 -7.097 627 HB3 ARG 89 HB1 ARG 89 5.860 -0.755 -6.661 628 HG2 ARG 89 HG2 ARG 89 4.797 -0.337 -8.796 629 HG3 ARG 89 HG1 ARG 89 6.088 0.788 -9.237 630 HD2 ARG 89 HD2 ARG 89 7.724 -0.996 -9.104 631 HD3 ARG 89 HD1 ARG 89 6.484 -2.125 -8.569 632 HE ARG 89 HE ARG 89 5.456 -1.641 -10.855 633 HH11 ARG 89 HH11 ARG 89 8.871 -1.486 -10.223 634 HH12 ARG 89 HH12 ARG 89 9.344 -2.005 -11.807 635 HH21 ARG 89 HH21 ARG 89 6.046 -2.351 -12.975 636 HH22 ARG 89 HH22 ARG 89 7.724 -2.523 -13.376 637 H TYR 90 HN TYR 90 3.743 2.596 -8.026 638 HA TYR 90 HA TYR 90 1.529 0.868 -7.199 639 HB2 TYR 90 HB2 TYR 90 -0.015 2.685 -6.965 640 HB3 TYR 90 HB1 TYR 90 1.385 3.056 -5.987 641 HD1 TYR 90 HD1 TYR 90 3.049 4.756 -6.844 642 HD2 TYR 90 HD2 TYR 90 -0.766 4.179 -8.639 643 HE1 TYR 90 HE1 TYR 90 3.261 6.923 -7.981 644 HE2 TYR 90 HE2 TYR 90 -0.569 6.352 -9.776 645 HH TYR 90 HH TYR 90 2.405 8.081 -9.902 646 H PHE 91 HN PHE 91 -0.269 0.828 -8.818 647 HA PHE 91 HA PHE 91 0.819 1.350 -11.495 648 HB2 PHE 91 HB2 PHE 91 -0.845 -0.997 -10.562 649 HB3 PHE 91 HB1 PHE 91 -0.517 -0.628 -12.243 650 HD1 PHE 91 HD1 PHE 91 1.008 -1.865 -9.095 651 HD2 PHE 91 HD2 PHE 91 1.616 -0.994 -13.229 652 HE1 PHE 91 HE1 PHE 91 3.110 -3.121 -9.052 653 HE2 PHE 91 HE2 PHE 91 3.723 -2.260 -13.175 654 HZ PHE 91 HZ PHE 91 4.469 -3.322 -11.091 655 H VAL 92 HN VAL 92 -0.719 1.813 -13.140 656 HA VAL 92 HA VAL 92 -3.278 2.841 -12.106 657 HB VAL 92 HB VAL 92 -1.571 4.223 -14.179 658 HG11 VAL 92 HG11 VAL 92 -4.130 5.071 -12.837 659 HG12 VAL 92 HG12 VAL 92 -3.935 4.606 -14.527 660 HG13 VAL 92 HG13 VAL 92 -3.163 6.071 -13.920 661 HG21 VAL 92 HG21 VAL 92 -1.216 5.961 -12.478 662 HG22 VAL 92 HG22 VAL 92 -0.517 4.411 -12.009 663 HG23 VAL 92 HG23 VAL 92 -2.039 4.946 -11.294 664 H ASP 93 HN ASP 93 -4.858 1.697 -13.035 665 HA ASP 93 HA ASP 93 -4.490 0.423 -15.635 666 HB2 ASP 93 HB2 ASP 93 -6.701 0.453 -13.568 667 HB3 ASP 93 HB1 ASP 93 -7.090 0.035 -15.235 668 H HIS 94 HN HIS 94 -4.298 2.114 -17.181 669 HA HIS 94 HA HIS 94 -6.124 4.335 -17.151 670 HB2 HIS 94 HB2 HIS 94 -3.965 3.483 -19.061 671 HB3 HIS 94 HB1 HIS 94 -5.128 4.710 -19.534 672 HD1 HIS 94 HD1 HIS 94 -1.897 4.878 -18.700 673 HD2 HIS 94 HD2 HIS 94 -5.231 6.434 -16.761 674 HE1 HIS 94 HE1 HIS 94 -1.041 6.782 -17.302 675 HE2 HIS 94 HE2 HIS 94 -3.080 7.760 -16.189 676 H ASN 95 HN ASN 95 -6.509 1.199 -18.041 677 HA ASN 95 HA ASN 95 -8.287 1.596 -20.258 678 HB2 ASN 95 HB2 ASN 95 -8.866 -0.801 -19.953 679 HB3 ASN 95 HB1 ASN 95 -7.121 -0.562 -19.999 680 HD21 ASN 95 HD21 ASN 95 -5.917 -0.938 -18.158 681 HD22 ASN 95 HD22 ASN 95 -6.560 -1.737 -16.760 682 H THR 96 HN THR 96 -8.589 1.376 -16.773 683 HA THR 96 HA THR 96 -11.458 1.956 -17.025 684 HB THR 96 HB THR 96 -11.379 1.301 -14.490 685 HG1 THR 96 HG1 THR 96 -9.661 -0.525 -14.508 686 HG21 THR 96 HG21 THR 96 -11.103 -0.778 -16.673 687 HG22 THR 96 HG22 THR 96 -12.598 0.025 -16.190 688 HG23 THR 96 HG23 THR 96 -11.774 -1.057 -15.068 689 H ARG 97 HN ARG 97 -8.459 3.226 -16.223 690 HA ARG 97 HA ARG 97 -7.761 5.302 -15.588 691 HB2 ARG 97 HB2 ARG 97 -10.696 6.035 -15.616 692 HB3 ARG 97 HB1 ARG 97 -9.339 7.165 -15.572 693 HG2 ARG 97 HG2 ARG 97 -8.572 6.361 -17.728 694 HG3 ARG 97 HG1 ARG 97 -9.878 5.183 -17.748 695 HD2 ARG 97 HD2 ARG 97 -11.515 6.990 -17.770 696 HD3 ARG 97 HD1 ARG 97 -10.206 8.172 -17.739 697 HE ARG 97 HE ARG 97 -10.004 6.320 -19.930 698 HH11 ARG 97 HH11 ARG 97 -11.434 9.338 -18.874 699 HH12 ARG 97 HH12 ARG 97 -11.678 9.928 -20.492 700 HH21 ARG 97 HH21 ARG 97 -10.318 7.103 -22.049 701 HH22 ARG 97 HH22 ARG 97 -11.072 8.655 -22.285 702 H THR 98 HN THR 98 -7.978 3.344 -13.865 703 HA THR 98 HA THR 98 -8.739 4.641 -11.311 704 HB THR 98 HB THR 98 -10.196 2.637 -11.917 705 HG1 THR 98 HG1 THR 98 -9.703 3.340 -9.691 706 HG21 THR 98 HG21 THR 98 -9.192 0.393 -11.615 707 HG22 THR 98 HG22 THR 98 -7.602 1.139 -11.467 708 HG23 THR 98 HG23 THR 98 -8.484 1.246 -12.991 709 H THR 99 HN THR 99 -7.468 3.654 -9.437 710 HA THR 99 HA THR 99 -4.655 3.214 -10.285 711 HB THR 99 HB THR 99 -4.101 4.094 -7.922 712 HG1 THR 99 HG1 THR 99 -6.354 3.842 -7.226 713 HG21 THR 99 HG21 THR 99 -4.393 6.503 -8.563 714 HG22 THR 99 HG22 THR 99 -5.469 6.004 -9.868 715 HG23 THR 99 HG23 THR 99 -3.767 5.543 -9.909 716 H THR 100 HN THR 100 -3.586 1.392 -9.376 717 HA THR 100 HA THR 100 -4.994 -0.062 -7.278 718 HB THR 100 HB THR 100 -5.818 -0.944 -9.490 719 HG1 THR 100 HG1 THR 100 -5.858 -2.961 -8.694 720 HG21 THR 100 HG21 THR 100 -3.766 -0.771 -10.800 721 HG22 THR 100 HG22 THR 100 -4.313 -2.449 -10.752 722 HG23 THR 100 HG23 THR 100 -2.969 -1.929 -9.735 723 H PHE 101 HN PHE 101 -3.708 -1.491 -6.109 724 HA PHE 101 HA PHE 101 -0.811 -1.149 -6.489 725 HB2 PHE 101 HB2 PHE 101 -2.547 -1.585 -4.072 726 HB3 PHE 101 HB1 PHE 101 -0.851 -2.226 -4.060 727 HD1 PHE 101 HD1 PHE 101 0.991 -0.760 -3.903 728 HD2 PHE 101 HD2 PHE 101 -2.943 0.832 -4.242 729 HE1 PHE 101 HE1 PHE 101 1.844 1.457 -3.273 730 HE2 PHE 101 HE2 PHE 101 -2.096 3.058 -3.613 731 HZ PHE 101 HZ PHE 101 0.302 3.370 -3.132 732 H LYS 102 HN LYS 102 -0.209 -2.744 -7.836 733 HA LYS 102 HA LYS 102 -1.051 -5.477 -7.146 734 HB2 LYS 102 HB2 LYS 102 -1.692 -4.435 -9.461 735 HB3 LYS 102 HB1 LYS 102 -0.006 -4.733 -9.862 736 HG2 LYS 102 HG2 LYS 102 -0.411 -7.129 -9.144 737 HG3 LYS 102 HG1 LYS 102 -2.128 -6.729 -9.157 738 HD2 LYS 102 HD2 LYS 102 -1.882 -7.534 -11.288 739 HD3 LYS 102 HD1 LYS 102 -1.558 -5.821 -11.562 740 HE2 LYS 102 HE2 LYS 102 0.121 -7.121 -12.708 741 HE3 LYS 102 HE1 LYS 102 0.873 -6.298 -11.343 742 HZ1 LYS 102 HZ1 LYS 102 0.001 -9.142 -11.371 743 HZ2 LYS 102 HZ2 LYS 102 0.748 -8.347 -10.070 744 HZ3 LYS 102 HZ3 LYS 102 1.605 -8.601 -11.507 745 H ASP 103 HN ASP 103 0.527 -7.062 -7.050 746 HA ASP 103 HA ASP 103 3.171 -6.203 -6.508 747 HB2 ASP 103 HB2 ASP 103 3.478 -8.587 -6.013 748 HB3 ASP 103 HB1 ASP 103 2.067 -7.947 -5.211 749 HA PRO 104 HA PRO 104 4.606 -6.970 -10.677 750 HB2 PRO 104 HB2 PRO 104 7.321 -6.536 -9.741 751 HB3 PRO 104 HB1 PRO 104 6.330 -5.439 -10.703 752 HG2 PRO 104 HG2 PRO 104 7.077 -4.978 -8.099 753 HG3 PRO 104 HG1 PRO 104 5.663 -4.250 -8.878 754 HD2 PRO 104 HD2 PRO 104 5.813 -6.541 -6.969 755 HD3 PRO 104 HD1 PRO 104 4.573 -5.281 -7.130 756 H ARG 105 HN ARG 105 6.097 -8.344 -7.804 757 HA ARG 105 HA ARG 105 6.799 -10.736 -9.349 758 HB2 ARG 105 HB2 ARG 105 8.083 -9.660 -6.833 759 HB3 ARG 105 HB1 ARG 105 8.433 -11.237 -7.520 760 HG2 ARG 105 HG2 ARG 105 8.963 -8.561 -8.785 761 HG3 ARG 105 HG1 ARG 105 10.160 -9.698 -8.144 762 HD2 ARG 105 HD2 ARG 105 8.361 -10.074 -10.542 763 HD3 ARG 105 HD1 ARG 105 10.122 -9.940 -10.548 764 HE ARG 105 HE ARG 105 9.882 -12.104 -9.074 765 HH11 ARG 105 HH11 ARG 105 8.013 -11.220 -11.903 766 HH12 ARG 105 HH12 ARG 105 7.708 -12.863 -12.385 767 HH21 ARG 105 HH21 ARG 105 9.455 -14.265 -9.666 768 HH22 ARG 105 HH22 ARG 105 8.542 -14.605 -11.106 769 HA PRO 106 HA PRO 106 3.234 -12.297 -6.961 770 HB2 PRO 106 HB2 PRO 106 4.466 -14.805 -8.075 771 HB3 PRO 106 HB1 PRO 106 2.730 -14.325 -7.977 772 HG2 PRO 106 HG2 PRO 106 4.053 -14.137 -10.278 773 HG3 PRO 106 HG1 PRO 106 2.920 -12.866 -9.778 774 HD2 PRO 106 HD2 PRO 106 5.906 -12.858 -9.798 775 HD3 PRO 106 HD1 PRO 106 4.743 -11.515 -10.086 776 H GLY 107 HN GLY 107 3.192 -12.931 -4.858 777 HA2 GLY 107 HA2 GLY 107 3.927 -13.766 -2.839 778 HA3 GLY 107 HA1 GLY 107 5.148 -14.684 -3.738 779 H PHE 108 HN PHE 108 5.365 -11.270 -4.257 780 HA PHE 108 HA PHE 108 7.594 -11.161 -2.351 781 HB2 PHE 108 HB2 PHE 108 8.430 -10.840 -4.591 782 HB3 PHE 108 HB1 PHE 108 7.139 -9.653 -4.968 783 HD1 PHE 108 HD1 PHE 108 10.305 -10.213 -3.139 784 HD2 PHE 108 HD2 PHE 108 7.354 -7.372 -4.326 785 HE1 PHE 108 HE1 PHE 108 11.795 -8.385 -2.456 786 HE2 PHE 108 HE2 PHE 108 8.846 -5.536 -3.637 787 HZ PHE 108 HZ PHE 108 11.080 -6.033 -2.763 788 H GLU 109 HN GLU 109 7.895 -9.104 -1.173 789 HA GLU 109 HA GLU 109 5.864 -7.147 -1.163 790 HB2 GLU 109 HB2 GLU 109 4.872 -7.500 0.997 791 HB3 GLU 109 HB1 GLU 109 4.661 -8.992 0.097 792 HG2 GLU 109 HG2 GLU 109 6.383 -10.069 1.356 793 HG3 GLU 109 HG1 GLU 109 6.844 -8.546 2.123 Start of MODEL 4 1 H1 GLY 1 HT1 GLY 1 -43.050 4.380 -1.288 2 H2 GLY 1 HT2 GLY 1 -41.467 4.070 -1.817 3 H3 GLY 1 HT3 GLY 1 -42.382 5.294 -2.550 4 HA2 GLY 1 HA1 GLY 1 -42.393 6.575 -0.525 5 HA3 GLY 1 HA2 GLY 1 -41.495 5.296 0.279 6 H SER 2 HN SER 2 -40.394 7.713 0.418 7 HA SER 2 HA SER 2 -38.629 8.274 -1.764 8 HB2 SER 2 HB2 SER 2 -38.502 9.252 1.099 9 HB3 SER 2 HB1 SER 2 -37.648 9.950 -0.279 10 HG SER 2 HG SER 2 -39.603 10.564 -1.167 11 H HIS 3 HN HIS 3 -37.658 6.211 -2.051 12 HA HIS 3 HA HIS 3 -35.514 5.660 -0.105 13 HB2 HIS 3 HB2 HIS 3 -37.459 3.887 -1.405 14 HB3 HIS 3 HB1 HIS 3 -35.800 3.341 -1.608 15 HD1 HIS 3 HD1 HIS 3 -38.002 1.887 0.116 16 HD2 HIS 3 HD2 HIS 3 -34.982 4.356 1.551 17 HE1 HIS 3 HE1 HIS 3 -37.637 1.189 2.504 18 HE2 HIS 3 HE2 HIS 3 -35.626 2.515 3.246 19 H MET 4 HN MET 4 -33.432 5.221 -1.003 20 HA MET 4 HA MET 4 -33.202 5.584 -3.918 21 HB2 MET 4 HB2 MET 4 -31.255 6.556 -1.794 22 HB3 MET 4 HB1 MET 4 -30.994 6.651 -3.526 23 HG2 MET 4 HG2 MET 4 -33.209 8.031 -2.033 24 HG3 MET 4 HG1 MET 4 -31.699 8.782 -2.548 25 HE1 MET 4 HE1 MET 4 -34.288 10.412 -4.976 26 HE2 MET 4 HE2 MET 4 -32.941 10.706 -3.876 27 HE3 MET 4 HE3 MET 4 -34.454 10.048 -3.259 28 H GLN 5 HN GLN 5 -31.949 4.059 -4.956 29 HA GLN 5 HA GLN 5 -31.214 1.760 -3.338 30 HB2 GLN 5 HB2 GLN 5 -32.413 1.457 -5.491 31 HB3 GLN 5 HB1 GLN 5 -31.029 2.149 -6.329 32 HG2 GLN 5 HG2 GLN 5 -29.643 0.303 -5.350 33 HG3 GLN 5 HG1 GLN 5 -31.151 -0.431 -4.802 34 HE21 GLN 5 HE21 GLN 5 -32.612 -1.203 -6.302 35 HE22 GLN 5 HE22 GLN 5 -32.127 -1.580 -7.941 36 H TYR 6 HN TYR 6 -29.352 2.129 -2.261 37 HA TYR 6 HA TYR 6 -27.115 3.320 -3.719 38 HB2 TYR 6 HB2 TYR 6 -27.416 2.645 -0.759 39 HB3 TYR 6 HB1 TYR 6 -25.912 3.234 -1.452 40 HD1 TYR 6 HD1 TYR 6 -25.761 5.532 -2.303 41 HD2 TYR 6 HD2 TYR 6 -29.287 4.114 -0.390 42 HE1 TYR 6 HE1 TYR 6 -26.514 7.847 -1.984 43 HE2 TYR 6 HE2 TYR 6 -30.046 6.428 -0.065 44 HH TYR 6 HH TYR 6 -28.634 9.057 -1.649 45 H LYS 7 HN LYS 7 -25.317 2.192 -4.265 46 HA LYS 7 HA LYS 7 -25.359 -0.692 -3.718 47 HB2 LYS 7 HB2 LYS 7 -24.159 -0.814 -6.031 48 HB3 LYS 7 HB1 LYS 7 -25.922 -0.605 -5.997 49 HG2 LYS 7 HG2 LYS 7 -25.424 1.905 -6.159 50 HG3 LYS 7 HG1 LYS 7 -23.807 1.403 -6.636 51 HD2 LYS 7 HD2 LYS 7 -25.003 1.709 -8.648 52 HD3 LYS 7 HD1 LYS 7 -24.919 -0.036 -8.403 53 HE2 LYS 7 HE2 LYS 7 -27.151 0.531 -9.085 54 HE3 LYS 7 HE1 LYS 7 -27.183 0.049 -7.389 55 HZ1 LYS 7 HZ1 LYS 7 -27.474 2.253 -6.700 56 HZ2 LYS 7 HZ2 LYS 7 -28.500 2.108 -8.039 57 HZ3 LYS 7 HZ3 LYS 7 -27.009 2.894 -8.196 58 H LEU 8 HN LEU 8 -23.367 -1.725 -3.565 59 HA LEU 8 HA LEU 8 -21.107 0.083 -2.980 60 HB2 LEU 8 HB2 LEU 8 -22.314 -0.704 -0.885 61 HB3 LEU 8 HB1 LEU 8 -21.834 -2.324 -1.315 62 HG LEU 8 HG LEU 8 -19.437 -1.507 -1.214 63 HD11 LEU 8 HD11 LEU 8 -19.154 0.440 0.384 64 HD12 LEU 8 HD12 LEU 8 -20.833 0.855 0.048 65 HD13 LEU 8 HD13 LEU 8 -19.639 0.864 -1.254 66 HD21 LEU 8 HD21 LEU 8 -20.195 -2.927 0.460 67 HD22 LEU 8 HD22 LEU 8 -21.294 -1.713 1.108 68 HD23 LEU 8 HD23 LEU 8 -19.551 -1.535 1.337 69 H ILE 9 HN ILE 9 -19.121 -0.668 -3.565 70 HA ILE 9 HA ILE 9 -19.019 -3.379 -4.691 71 HB ILE 9 HB ILE 9 -17.566 -0.930 -5.739 72 HG12 ILE 9 HG12 ILE 9 -19.613 -2.737 -7.112 73 HG13 ILE 9 HG11 ILE 9 -20.007 -1.123 -6.415 74 HG21 ILE 9 HG21 ILE 9 -17.374 -3.837 -6.533 75 HG22 ILE 9 HG22 ILE 9 -16.090 -2.817 -5.874 76 HG23 ILE 9 HG23 ILE 9 -16.731 -2.503 -7.489 77 HD11 ILE 9 HD11 ILE 9 -18.502 -0.070 -8.012 78 HD12 ILE 9 HD12 ILE 9 -19.675 -1.083 -8.863 79 HD13 ILE 9 HD13 ILE 9 -18.018 -1.645 -8.645 80 H LEU 10 HN LEU 10 -17.616 -4.655 -3.688 81 HA LEU 10 HA LEU 10 -15.812 -3.395 -1.777 82 HB2 LEU 10 HB2 LEU 10 -16.370 -6.339 -2.130 83 HB3 LEU 10 HB1 LEU 10 -15.392 -5.617 -0.874 84 HG LEU 10 HG LEU 10 -17.285 -6.040 0.289 85 HD11 LEU 10 HD11 LEU 10 -16.828 -3.641 0.417 86 HD12 LEU 10 HD12 LEU 10 -18.508 -4.070 0.733 87 HD13 LEU 10 HD13 LEU 10 -18.061 -3.377 -0.827 88 HD21 LEU 10 HD21 LEU 10 -19.508 -6.128 -0.517 89 HD22 LEU 10 HD22 LEU 10 -18.495 -6.894 -1.741 90 HD23 LEU 10 HD23 LEU 10 -19.082 -5.249 -1.982 91 H ASN 11 HN ASN 11 -14.187 -2.599 -2.989 92 HA ASN 11 HA ASN 11 -12.903 -4.363 -4.892 93 HB2 ASN 11 HB2 ASN 11 -11.901 -1.637 -4.023 94 HB3 ASN 11 HB1 ASN 11 -11.518 -2.499 -5.502 95 HD21 ASN 11 HD21 ASN 11 -12.085 -0.795 -6.805 96 HD22 ASN 11 HD22 ASN 11 -13.730 -0.322 -7.046 97 H GLY 12 HN GLY 12 -12.310 -5.979 -3.364 98 HA2 GLY 12 HA2 GLY 12 -9.815 -5.234 -1.995 99 HA3 GLY 12 HA1 GLY 12 -11.003 -6.241 -1.157 100 H LYS 13 HN LYS 13 -8.160 -6.492 -2.420 101 HA LYS 13 HA LYS 13 -8.009 -8.262 -4.471 102 HB2 LYS 13 HB2 LYS 13 -6.230 -8.222 -2.026 103 HB3 LYS 13 HB1 LYS 13 -5.798 -8.863 -3.606 104 HG2 LYS 13 HG2 LYS 13 -5.827 -6.685 -4.574 105 HG3 LYS 13 HG1 LYS 13 -6.537 -5.989 -3.119 106 HD2 LYS 13 HD2 LYS 13 -3.790 -7.237 -3.303 107 HD3 LYS 13 HD1 LYS 13 -4.125 -5.504 -3.301 108 HE2 LYS 13 HE2 LYS 13 -5.178 -5.756 -1.067 109 HE3 LYS 13 HE1 LYS 13 -4.702 -7.453 -1.063 110 HZ1 LYS 13 HZ1 LYS 13 -2.878 -5.102 -1.122 111 HZ2 LYS 13 HZ2 LYS 13 -2.368 -6.715 -1.240 112 HZ3 LYS 13 HZ3 LYS 13 -3.118 -6.164 0.175 113 H THR 14 HN THR 14 -8.897 -9.003 -1.158 114 HA THR 14 HA THR 14 -8.488 -11.852 -1.536 115 HB THR 14 HB THR 14 -9.810 -10.411 0.782 116 HG1 THR 14 HG1 THR 14 -7.130 -11.247 0.258 117 HG21 THR 14 HG21 THR 14 -8.710 -13.218 0.573 118 HG22 THR 14 HG22 THR 14 -10.421 -12.793 0.601 119 HG23 THR 14 HG23 THR 14 -9.410 -12.480 2.014 120 H LEU 15 HN LEU 15 -11.338 -9.683 -1.253 121 HA LEU 15 HA LEU 15 -12.777 -11.564 -2.824 122 HB2 LEU 15 HB2 LEU 15 -14.674 -11.443 -1.343 123 HB3 LEU 15 HB1 LEU 15 -13.333 -12.083 -0.463 124 HG LEU 15 HG LEU 15 -14.310 -10.727 1.091 125 HD11 LEU 15 HD11 LEU 15 -13.133 -8.442 1.009 126 HD12 LEU 15 HD12 LEU 15 -12.334 -9.118 -0.422 127 HD13 LEU 15 HD13 LEU 15 -12.168 -9.915 1.147 128 HD21 LEU 15 HD21 LEU 15 -15.421 -8.597 0.622 129 HD22 LEU 15 HD22 LEU 15 -16.113 -9.927 -0.306 130 HD23 LEU 15 HD23 LEU 15 -15.025 -8.778 -1.087 131 H LYS 16 HN LYS 16 -13.795 -10.610 -4.407 132 HA LYS 16 HA LYS 16 -14.355 -7.718 -4.197 133 HB2 LYS 16 HB2 LYS 16 -13.702 -9.203 -6.760 134 HB3 LYS 16 HB1 LYS 16 -13.884 -7.469 -6.560 135 HG2 LYS 16 HG2 LYS 16 -11.607 -7.643 -6.646 136 HG3 LYS 16 HG1 LYS 16 -11.832 -7.778 -4.911 137 HD2 LYS 16 HD2 LYS 16 -10.250 -9.367 -5.831 138 HD3 LYS 16 HD1 LYS 16 -11.612 -10.176 -5.056 139 HE2 LYS 16 HE2 LYS 16 -10.945 -11.230 -7.201 140 HE3 LYS 16 HE1 LYS 16 -12.601 -10.624 -7.223 141 HZ1 LYS 16 HZ1 LYS 16 -12.082 -8.982 -8.700 142 HZ2 LYS 16 HZ2 LYS 16 -10.947 -10.146 -9.188 143 HZ3 LYS 16 HZ3 LYS 16 -10.468 -8.852 -8.198 144 H GLY 17 HN GLY 17 -16.390 -7.076 -4.798 145 HA2 GLY 17 HA2 GLY 17 -18.188 -8.508 -6.380 146 HA3 GLY 17 HA1 GLY 17 -18.446 -9.006 -4.715 147 H GLU 18 HN GLU 18 -20.606 -8.058 -5.337 148 HA GLU 18 HA GLU 18 -20.632 -5.199 -4.654 149 HB2 GLU 18 HB2 GLU 18 -22.425 -6.553 -6.690 150 HB3 GLU 18 HB1 GLU 18 -22.534 -4.872 -6.186 151 HG2 GLU 18 HG2 GLU 18 -20.574 -4.287 -7.295 152 HG3 GLU 18 HG1 GLU 18 -20.036 -5.965 -7.414 153 H THR 19 HN THR 19 -22.849 -4.485 -4.016 154 HA THR 19 HA THR 19 -24.772 -6.364 -3.110 155 HB THR 19 HB THR 19 -23.035 -6.683 -1.346 156 HG1 THR 19 HG1 THR 19 -25.021 -7.112 -0.575 157 HG21 THR 19 HG21 THR 19 -22.644 -4.876 0.293 158 HG22 THR 19 HG22 THR 19 -23.644 -3.791 -0.672 159 HG23 THR 19 HG23 THR 19 -22.117 -4.389 -1.323 160 H THR 20 HN THR 20 -26.640 -5.229 -2.150 161 HA THR 20 HA THR 20 -26.629 -2.338 -2.681 162 HB THR 20 HB THR 20 -28.962 -2.653 -3.666 163 HG1 THR 20 HG1 THR 20 -29.007 -4.895 -4.706 164 HG21 THR 20 HG21 THR 20 -26.551 -3.729 -5.152 165 HG22 THR 20 HG22 THR 20 -27.140 -2.063 -5.146 166 HG23 THR 20 HG23 THR 20 -28.090 -3.332 -5.918 167 H THR 21 HN THR 21 -28.378 -1.170 -1.680 168 HA THR 21 HA THR 21 -30.129 -2.499 0.185 169 HB THR 21 HB THR 21 -27.871 -2.235 1.426 170 HG1 THR 21 HG1 THR 21 -30.008 -2.508 2.412 171 HG21 THR 21 HG21 THR 21 -27.516 0.022 2.452 172 HG22 THR 21 HG22 THR 21 -28.805 0.664 1.434 173 HG23 THR 21 HG23 THR 21 -27.323 0.063 0.695 174 H GLU 22 HN GLU 22 -31.683 -0.977 1.114 175 HA GLU 22 HA GLU 22 -31.934 1.381 -0.629 176 HB2 GLU 22 HB2 GLU 22 -34.388 1.229 0.523 177 HB3 GLU 22 HB1 GLU 22 -33.988 0.429 -0.986 178 HG2 GLU 22 HG2 GLU 22 -35.204 -1.076 0.429 179 HG3 GLU 22 HG1 GLU 22 -33.506 -1.647 0.264 180 H ALA 23 HN ALA 23 -31.812 3.388 0.206 181 HA ALA 23 HA ALA 23 -32.266 3.738 3.093 182 HB1 ALA 23 HB1 ALA 23 -29.841 3.343 2.849 183 HB2 ALA 23 HB2 ALA 23 -30.182 4.985 3.391 184 HB3 ALA 23 HB3 ALA 23 -29.742 4.683 1.710 185 H VAL 24 HN VAL 24 -32.654 6.011 3.665 186 HA VAL 24 HA VAL 24 -33.783 7.473 1.410 187 HB VAL 24 HB VAL 24 -34.838 8.901 3.109 188 HG11 VAL 24 HG11 VAL 24 -35.129 5.948 3.647 189 HG12 VAL 24 HG12 VAL 24 -36.001 6.880 2.431 190 HG13 VAL 24 HG13 VAL 24 -36.275 7.190 4.145 191 HG21 VAL 24 HG21 VAL 24 -34.631 8.322 5.483 192 HG22 VAL 24 HG22 VAL 24 -33.101 8.864 4.793 193 HG23 VAL 24 HG23 VAL 24 -33.386 7.145 5.068 194 H ASP 25 HN ASP 25 -30.823 7.385 2.796 195 HA ASP 25 HA ASP 25 -30.131 10.013 1.853 196 HB2 ASP 25 HB2 ASP 25 -30.737 10.690 4.063 197 HB3 ASP 25 HB1 ASP 25 -29.909 9.314 4.782 198 H ALA 26 HN ALA 26 -27.797 10.356 1.864 199 HA ALA 26 HA ALA 26 -26.475 7.930 1.030 200 HB1 ALA 26 HB1 ALA 26 -24.656 9.439 0.341 201 HB2 ALA 26 HB2 ALA 26 -25.499 10.790 1.099 202 HB3 ALA 26 HB3 ALA 26 -26.219 9.967 -0.285 203 H ALA 27 HN ALA 27 -26.133 10.295 3.658 204 HA ALA 27 HA ALA 27 -23.680 9.224 4.659 205 HB1 ALA 27 HB1 ALA 27 -24.071 10.632 6.602 206 HB2 ALA 27 HB2 ALA 27 -25.731 10.918 6.085 207 HB3 ALA 27 HB3 ALA 27 -24.390 11.535 5.121 208 H THR 28 HN THR 28 -27.049 8.623 5.137 209 HA THR 28 HA THR 28 -26.809 6.949 7.436 210 HB THR 28 HB THR 28 -29.068 6.884 5.419 211 HG1 THR 28 HG1 THR 28 -28.448 9.080 6.258 212 HG21 THR 28 HG21 THR 28 -28.990 6.405 8.408 213 HG22 THR 28 HG22 THR 28 -29.083 5.149 7.174 214 HG23 THR 28 HG23 THR 28 -30.416 6.287 7.379 215 H ALA 29 HN ALA 29 -26.412 6.449 4.020 216 HA ALA 29 HA ALA 29 -26.818 3.579 4.087 217 HB1 ALA 29 HB1 ALA 29 -27.290 4.823 2.035 218 HB2 ALA 29 HB2 ALA 29 -26.011 3.636 1.772 219 HB3 ALA 29 HB3 ALA 29 -25.609 5.343 1.955 220 H GLU 30 HN GLU 30 -24.192 5.891 4.051 221 HA GLU 30 HA GLU 30 -21.944 4.329 3.912 222 HB2 GLU 30 HB2 GLU 30 -22.079 6.865 4.141 223 HB3 GLU 30 HB1 GLU 30 -22.346 6.603 5.852 224 HG2 GLU 30 HG2 GLU 30 -20.144 5.234 5.734 225 HG3 GLU 30 HG1 GLU 30 -19.885 6.184 4.270 226 H LYS 31 HN LYS 31 -23.548 5.355 6.900 227 HA LYS 31 HA LYS 31 -22.091 3.994 8.754 228 HB2 LYS 31 HB2 LYS 31 -25.070 4.415 8.966 229 HB3 LYS 31 HB1 LYS 31 -23.915 4.290 10.285 230 HG2 LYS 31 HG2 LYS 31 -24.260 6.536 8.321 231 HG3 LYS 31 HG1 LYS 31 -24.464 6.573 10.073 232 HD2 LYS 31 HD2 LYS 31 -22.066 6.197 10.359 233 HD3 LYS 31 HD1 LYS 31 -21.863 6.142 8.607 234 HE2 LYS 31 HE2 LYS 31 -22.799 8.454 8.512 235 HE3 LYS 31 HE1 LYS 31 -22.749 8.492 10.274 236 HZ1 LYS 31 HZ1 LYS 31 -20.456 8.244 8.404 237 HZ2 LYS 31 HZ2 LYS 31 -20.327 7.991 10.073 238 HZ3 LYS 31 HZ3 LYS 31 -20.786 9.516 9.489 239 H VAL 32 HN VAL 32 -24.876 2.716 6.947 240 HA VAL 32 HA VAL 32 -24.980 0.277 8.453 241 HB VAL 32 HB VAL 32 -26.203 0.908 5.761 242 HG11 VAL 32 HG11 VAL 32 -26.772 -1.299 7.735 243 HG12 VAL 32 HG12 VAL 32 -26.081 -1.474 6.121 244 HG13 VAL 32 HG13 VAL 32 -27.748 -0.940 6.312 245 HG21 VAL 32 HG21 VAL 32 -27.341 1.146 8.544 246 HG22 VAL 32 HG22 VAL 32 -28.269 1.298 7.054 247 HG23 VAL 32 HG23 VAL 32 -26.999 2.465 7.421 248 H PHE 33 HN PHE 33 -23.758 1.172 5.234 249 HA PHE 33 HA PHE 33 -22.881 -1.469 4.609 250 HB2 PHE 33 HB2 PHE 33 -22.494 1.210 3.380 251 HB3 PHE 33 HB1 PHE 33 -21.343 -0.042 2.967 252 HD1 PHE 33 HD1 PHE 33 -23.229 -2.388 3.024 253 HD2 PHE 33 HD2 PHE 33 -23.591 1.501 1.327 254 HE1 PHE 33 HE1 PHE 33 -24.770 -3.272 1.323 255 HE2 PHE 33 HE2 PHE 33 -25.138 0.620 -0.370 256 HZ PHE 33 HZ PHE 33 -25.729 -1.771 -0.374 257 H LYS 34 HN LYS 34 -21.502 1.030 6.551 258 HA LYS 34 HA LYS 34 -18.799 0.196 6.254 259 HB2 LYS 34 HB2 LYS 34 -20.230 1.899 8.276 260 HB3 LYS 34 HB1 LYS 34 -18.526 1.560 8.423 261 HG2 LYS 34 HG2 LYS 34 -18.424 2.449 5.972 262 HG3 LYS 34 HG1 LYS 34 -19.971 3.193 6.386 263 HD2 LYS 34 HD2 LYS 34 -18.311 4.829 6.854 264 HD3 LYS 34 HD1 LYS 34 -18.847 4.177 8.402 265 HE2 LYS 34 HE2 LYS 34 -16.912 2.727 8.507 266 HE3 LYS 34 HE1 LYS 34 -16.387 3.273 6.916 267 HZ1 LYS 34 HZ1 LYS 34 -16.293 4.685 9.490 268 HZ2 LYS 34 HZ2 LYS 34 -16.454 5.590 8.069 269 HZ3 LYS 34 HZ3 LYS 34 -15.113 4.580 8.273 270 H GLN 35 HN GLN 35 -21.340 -0.421 8.647 271 HA GLN 35 HA GLN 35 -19.847 -2.250 10.195 272 HB2 GLN 35 HB2 GLN 35 -21.987 -1.192 10.936 273 HB3 GLN 35 HB1 GLN 35 -22.853 -2.190 9.780 274 HG2 GLN 35 HG2 GLN 35 -23.042 -3.154 11.968 275 HG3 GLN 35 HG1 GLN 35 -22.058 -4.203 10.949 276 HE21 GLN 35 HE21 GLN 35 -21.037 -5.198 12.641 277 HE22 GLN 35 HE22 GLN 35 -19.881 -4.390 13.650 278 H TYR 36 HN TYR 36 -21.651 -2.474 7.226 279 HA TYR 36 HA TYR 36 -21.774 -5.302 7.029 280 HB2 TYR 36 HB2 TYR 36 -23.255 -4.057 5.631 281 HB3 TYR 36 HB1 TYR 36 -21.942 -3.072 4.998 282 HD1 TYR 36 HD1 TYR 36 -20.662 -3.795 3.112 283 HD2 TYR 36 HD2 TYR 36 -23.477 -6.418 4.917 284 HE1 TYR 36 HE1 TYR 36 -20.462 -5.327 1.197 285 HE2 TYR 36 HE2 TYR 36 -23.295 -7.950 3.021 286 HH TYR 36 HH TYR 36 -20.840 -7.710 0.694 287 H ALA 37 HN ALA 37 -19.572 -2.899 5.564 288 HA ALA 37 HA ALA 37 -17.857 -4.790 4.340 289 HB1 ALA 37 HB1 ALA 37 -16.275 -2.917 4.125 290 HB2 ALA 37 HB2 ALA 37 -17.273 -1.954 5.216 291 HB3 ALA 37 HB3 ALA 37 -17.909 -2.454 3.649 292 H ASN 38 HN ASN 38 -17.888 -3.212 7.468 293 HA ASN 38 HA ASN 38 -15.459 -4.024 8.532 294 HB2 ASN 38 HB2 ASN 38 -16.952 -2.466 9.726 295 HB3 ASN 38 HB1 ASN 38 -18.145 -3.748 9.935 296 HD21 ASN 38 HD21 ASN 38 -17.824 -5.340 11.475 297 HD22 ASN 38 HD22 ASN 38 -16.575 -5.212 12.739 298 H ASP 39 HN ASP 39 -18.542 -5.737 8.455 299 HA ASP 39 HA ASP 39 -17.616 -7.981 9.962 300 HB2 ASP 39 HB2 ASP 39 -20.042 -7.113 9.655 301 HB3 ASP 39 HB1 ASP 39 -20.019 -8.020 8.147 302 H ASN 40 HN ASN 40 -17.388 -7.031 6.695 303 HA ASN 40 HA ASN 40 -17.015 -9.751 5.714 304 HB2 ASN 40 HB2 ASN 40 -17.375 -7.081 4.418 305 HB3 ASN 40 HB1 ASN 40 -16.514 -8.333 3.532 306 HD21 ASN 40 HD21 ASN 40 -19.571 -7.305 4.839 307 HD22 ASN 40 HD22 ASN 40 -20.540 -8.540 4.019 308 H GLY 41 HN GLY 41 -15.205 -7.285 7.046 309 HA2 GLY 41 HA2 GLY 41 -12.949 -7.451 7.616 310 HA3 GLY 41 HA1 GLY 41 -12.741 -8.670 6.371 311 H VAL 42 HN VAL 42 -14.415 -5.910 5.280 312 HA VAL 42 HA VAL 42 -12.029 -5.069 3.819 313 HB VAL 42 HB VAL 42 -14.929 -4.381 3.279 314 HG11 VAL 42 HG11 VAL 42 -12.489 -4.067 1.513 315 HG12 VAL 42 HG12 VAL 42 -13.236 -2.759 2.434 316 HG13 VAL 42 HG13 VAL 42 -14.139 -3.555 1.142 317 HG21 VAL 42 HG21 VAL 42 -14.622 -6.736 2.978 318 HG22 VAL 42 HG22 VAL 42 -13.128 -6.474 2.078 319 HG23 VAL 42 HG23 VAL 42 -14.674 -5.983 1.381 320 H ASP 43 HN ASP 43 -11.122 -3.174 4.117 321 HA ASP 43 HA ASP 43 -12.531 -0.962 5.361 322 HB2 ASP 43 HB2 ASP 43 -11.693 -2.212 7.340 323 HB3 ASP 43 HB1 ASP 43 -10.063 -2.123 6.680 324 H GLY 44 HN GLY 44 -12.114 0.373 3.644 325 HA2 GLY 44 HA2 GLY 44 -9.356 1.096 3.109 326 HA3 GLY 44 HA1 GLY 44 -10.249 0.397 1.769 327 H GLU 45 HN GLU 45 -9.682 2.532 0.837 328 HA GLU 45 HA GLU 45 -10.626 5.005 1.726 329 HB2 GLU 45 HB2 GLU 45 -10.565 4.251 -1.188 330 HB3 GLU 45 HB1 GLU 45 -10.203 5.802 -0.448 331 HG2 GLU 45 HG2 GLU 45 -8.508 3.384 0.040 332 HG3 GLU 45 HG1 GLU 45 -8.258 4.427 -1.359 333 H TRP 46 HN TRP 46 -12.453 6.247 1.119 334 HA TRP 46 HA TRP 46 -14.786 4.666 0.249 335 HB2 TRP 46 HB2 TRP 46 -14.449 6.319 2.705 336 HB3 TRP 46 HB1 TRP 46 -15.999 6.432 1.888 337 HD1 TRP 46 HD1 TRP 46 -13.664 3.781 3.443 338 HE1 TRP 46 HE1 TRP 46 -15.085 1.838 4.325 339 HE3 TRP 46 HE3 TRP 46 -18.310 5.324 1.836 340 HZ2 TRP 46 HZ2 TRP 46 -17.774 1.060 4.349 341 HZ3 TRP 46 HZ3 TRP 46 -20.250 3.904 2.359 342 HH2 TRP 46 HH2 TRP 46 -19.982 1.810 3.583 343 H THR 47 HN THR 47 -15.400 5.454 -1.651 344 HA THR 47 HA THR 47 -15.646 8.370 -1.906 345 HB THR 47 HB THR 47 -15.295 7.787 -4.469 346 HG1 THR 47 HG1 THR 47 -14.964 5.555 -4.194 347 HG21 THR 47 HG21 THR 47 -13.971 9.382 -3.151 348 HG22 THR 47 HG22 THR 47 -12.946 8.420 -4.217 349 HG23 THR 47 HG23 THR 47 -13.020 8.046 -2.494 350 H TYR 48 HN TYR 48 -17.368 9.098 -3.321 351 HA TYR 48 HA TYR 48 -19.395 7.064 -3.884 352 HB2 TYR 48 HB2 TYR 48 -20.107 7.943 -1.791 353 HB3 TYR 48 HB1 TYR 48 -19.753 9.574 -2.265 354 HD1 TYR 48 HD1 TYR 48 -21.553 10.931 -2.718 355 HD2 TYR 48 HD2 TYR 48 -21.942 6.745 -3.401 356 HE1 TYR 48 HE1 TYR 48 -23.908 11.255 -3.337 357 HE2 TYR 48 HE2 TYR 48 -24.299 7.062 -4.019 358 HH TYR 48 HH TYR 48 -25.662 10.173 -4.582 359 H ASP 49 HN ASP 49 -20.907 7.599 -5.502 360 HA ASP 49 HA ASP 49 -20.331 10.055 -7.042 361 HB2 ASP 49 HB2 ASP 49 -19.198 8.203 -8.290 362 HB3 ASP 49 HB1 ASP 49 -20.735 7.358 -8.430 363 H ASP 50 HN ASP 50 -22.224 11.062 -7.776 364 HA ASP 50 HA ASP 50 -24.608 10.009 -6.402 365 HB2 ASP 50 HB2 ASP 50 -23.882 12.372 -5.975 366 HB3 ASP 50 HB1 ASP 50 -24.187 12.739 -7.670 367 H ALA 51 HN ALA 51 -23.316 9.975 -9.496 368 HA ALA 51 HA ALA 51 -25.767 10.302 -10.935 369 HB1 ALA 51 HB1 ALA 51 -23.171 9.082 -11.847 370 HB2 ALA 51 HB2 ALA 51 -23.606 10.787 -11.969 371 HB3 ALA 51 HB3 ALA 51 -24.509 9.578 -12.882 372 H THR 52 HN THR 52 -23.981 7.529 -9.639 373 HA THR 52 HA THR 52 -26.223 5.832 -10.518 374 HB THR 52 HB THR 52 -24.526 3.940 -10.327 375 HG1 THR 52 HG1 THR 52 -22.714 4.617 -9.440 376 HG21 THR 52 HG21 THR 52 -25.273 4.770 -12.498 377 HG22 THR 52 HG22 THR 52 -23.538 4.446 -12.551 378 HG23 THR 52 HG23 THR 52 -24.123 6.102 -12.405 379 H LYS 53 HN LYS 53 -25.253 7.302 -7.813 380 HA LYS 53 HA LYS 53 -25.384 6.904 -5.535 381 HB2 LYS 53 HB2 LYS 53 -27.561 5.276 -6.743 382 HB3 LYS 53 HB1 LYS 53 -27.140 4.911 -5.079 383 HG2 LYS 53 HG2 LYS 53 -28.995 6.510 -5.273 384 HG3 LYS 53 HG1 LYS 53 -27.616 7.165 -4.397 385 HD2 LYS 53 HD2 LYS 53 -26.914 8.374 -6.402 386 HD3 LYS 53 HD1 LYS 53 -28.292 7.714 -7.285 387 HE2 LYS 53 HE2 LYS 53 -29.832 8.831 -5.790 388 HE3 LYS 53 HE1 LYS 53 -28.490 9.416 -4.810 389 HZ1 LYS 53 HZ1 LYS 53 -29.392 11.089 -6.352 390 HZ2 LYS 53 HZ2 LYS 53 -28.903 10.125 -7.663 391 HZ3 LYS 53 HZ3 LYS 53 -27.746 10.776 -6.604 392 H THR 54 HN THR 54 -23.156 5.790 -6.475 393 HA THR 54 HA THR 54 -23.108 3.082 -5.340 394 HB THR 54 HB THR 54 -21.147 4.124 -7.387 395 HG1 THR 54 HG1 THR 54 -23.622 2.763 -7.743 396 HG21 THR 54 HG21 THR 54 -20.344 2.196 -6.130 397 HG22 THR 54 HG22 THR 54 -20.772 1.676 -7.762 398 HG23 THR 54 HG23 THR 54 -21.856 1.335 -6.415 399 H TYR 55 HN TYR 55 -21.962 2.861 -3.540 400 HA TYR 55 HA TYR 55 -19.852 4.800 -2.930 401 HB2 TYR 55 HB2 TYR 55 -21.463 2.951 -1.197 402 HB3 TYR 55 HB1 TYR 55 -19.854 3.421 -0.679 403 HD1 TYR 55 HD1 TYR 55 -19.371 5.737 -0.051 404 HD2 TYR 55 HD2 TYR 55 -23.275 4.545 -1.259 405 HE1 TYR 55 HE1 TYR 55 -20.287 7.835 0.849 406 HE2 TYR 55 HE2 TYR 55 -24.198 6.635 -0.360 407 HH TYR 55 HH TYR 55 -23.611 8.339 1.307 408 H THR 56 HN THR 56 -17.741 4.202 -2.777 409 HA THR 56 HA THR 56 -17.169 1.417 -3.557 410 HB THR 56 HB THR 56 -14.914 2.796 -4.336 411 HG1 THR 56 HG1 THR 56 -17.179 4.497 -4.611 412 HG21 THR 56 HG21 THR 56 -17.412 2.243 -5.969 413 HG22 THR 56 HG22 THR 56 -16.028 1.167 -5.753 414 HG23 THR 56 HG23 THR 56 -15.845 2.670 -6.656 415 H VAL 57 HN VAL 57 -15.923 0.275 -2.228 416 HA VAL 57 HA VAL 57 -14.212 1.750 -0.351 417 HB VAL 57 HB VAL 57 -16.123 0.789 0.929 418 HG11 VAL 57 HG11 VAL 57 -15.093 -1.891 -0.001 419 HG12 VAL 57 HG12 VAL 57 -16.667 -1.184 -0.359 420 HG13 VAL 57 HG13 VAL 57 -16.267 -1.658 1.289 421 HG21 VAL 57 HG21 VAL 57 -13.451 -0.484 1.502 422 HG22 VAL 57 HG22 VAL 57 -14.776 -0.329 2.655 423 HG23 VAL 57 HG23 VAL 57 -13.987 1.114 2.018 424 H THR 58 HN THR 58 -12.287 1.528 -1.161 425 HA THR 58 HA THR 58 -11.501 -1.019 -2.392 426 HB THR 58 HB THR 58 -10.125 1.664 -2.636 427 HG1 THR 58 HG1 THR 58 -12.407 0.776 -3.735 428 HG21 THR 58 HG21 THR 58 -9.859 -0.888 -4.240 429 HG22 THR 58 HG22 THR 58 -8.665 -0.240 -3.115 430 HG23 THR 58 HG23 THR 58 -9.050 0.639 -4.594 431 H GLU 59 HN GLU 59 -10.019 -2.262 -1.510 432 HA GLU 59 HA GLU 59 -9.050 -1.804 1.105 433 HB2 GLU 59 HB2 GLU 59 -8.283 -3.847 -0.981 434 HB3 GLU 59 HB1 GLU 59 -7.465 -3.760 0.547 435 HG2 GLU 59 HG2 GLU 59 -10.429 -4.108 0.357 436 HG3 GLU 59 HG1 GLU 59 -9.289 -5.453 0.406 437 H GLY 60 HN GLY 60 -6.930 -1.228 1.859 438 HA2 GLY 60 HA2 GLY 60 -5.371 0.269 -0.159 439 HA3 GLY 60 HA1 GLY 60 -5.393 0.608 1.567 440 H SER 61 HN SER 61 -3.024 0.559 1.239 441 HA SER 61 HA SER 61 -2.009 -2.200 1.339 442 HB2 SER 61 HB2 SER 61 -0.553 0.281 0.403 443 HB3 SER 61 HB1 SER 61 0.115 -1.352 0.449 444 HG SER 61 HG SER 61 -0.832 -0.507 -1.617 445 H GLY 62 HN GLY 62 -1.351 -2.787 3.303 446 HA2 GLY 62 HA2 GLY 62 0.051 -0.832 4.982 447 HA3 GLY 62 HA1 GLY 62 -1.385 -1.612 5.635 448 H GLY 63 HN GLY 63 0.476 -2.175 7.233 449 HA2 GLY 63 HA2 GLY 63 2.141 -4.380 6.319 450 HA3 GLY 63 HA1 GLY 63 2.167 -3.641 7.912 451 H ALA 64 HN ALA 64 -0.830 -3.913 8.038 452 HA ALA 64 HA ALA 64 -0.916 -6.381 9.412 453 HB1 ALA 64 HB1 ALA 64 -2.393 -4.534 9.994 454 HB2 ALA 64 HB2 ALA 64 -3.331 -5.974 9.593 455 HB3 ALA 64 HB3 ALA 64 -3.187 -4.659 8.425 456 H GLY 65 HN GLY 65 -1.607 -8.358 8.833 457 HA2 GLY 65 HA2 GLY 65 -3.057 -9.632 7.235 458 HA3 GLY 65 HA1 GLY 65 -2.218 -8.742 5.971 459 H GLY 66 HN GLY 66 0.374 -8.833 7.128 460 HA2 GLY 66 HA2 GLY 66 1.179 -11.462 6.291 461 HA3 GLY 66 HA1 GLY 66 2.234 -10.205 6.929 462 H GLN 67 HN GLN 67 1.001 -9.756 9.360 463 HA GLN 67 HA GLN 67 0.841 -10.416 11.511 464 HB2 GLN 67 HB2 GLN 67 0.360 -13.209 10.428 465 HB3 GLN 67 HB1 GLN 67 -0.053 -12.600 12.051 466 HG2 GLN 67 HG2 GLN 67 -1.259 -11.741 9.424 467 HG3 GLN 67 HG1 GLN 67 -2.030 -12.710 10.676 468 HE21 GLN 67 HE21 GLN 67 -2.760 -11.718 12.549 469 HE22 GLN 67 HE22 GLN 67 -2.937 -9.996 12.665 470 H GLY 68 HN GLY 68 1.830 -11.832 13.198 471 HA2 GLY 68 HA2 GLY 68 4.178 -13.340 12.530 472 HA3 GLY 68 HA1 GLY 68 4.556 -11.749 13.174 473 H MET 69 HN MET 69 2.456 -11.495 14.987 474 HA MET 69 HA MET 69 1.847 -11.927 17.118 475 HB2 MET 69 HB2 MET 69 2.414 -14.770 16.288 476 HB3 MET 69 HB1 MET 69 1.763 -14.338 17.864 477 HG2 MET 69 HG2 MET 69 0.483 -13.825 15.190 478 HG3 MET 69 HG1 MET 69 -0.017 -15.015 16.392 479 HE1 MET 69 HE1 MET 69 -2.511 -14.152 16.415 480 HE2 MET 69 HE2 MET 69 -2.083 -13.015 15.138 481 HE3 MET 69 HE3 MET 69 -2.955 -12.455 16.566 482 H ILE 70 HN ILE 70 2.748 -13.559 19.074 483 HA ILE 70 HA ILE 70 4.353 -13.908 20.606 484 HB ILE 70 HB ILE 70 6.336 -13.295 18.395 485 HG12 ILE 70 HG12 ILE 70 5.341 -15.881 19.621 486 HG13 ILE 70 HG11 ILE 70 5.073 -15.307 17.978 487 HG21 ILE 70 HG21 ILE 70 8.076 -14.170 19.865 488 HG22 ILE 70 HG22 ILE 70 6.894 -14.495 21.131 489 HG23 ILE 70 HG23 ILE 70 7.260 -12.831 20.677 490 HD11 ILE 70 HD11 ILE 70 7.449 -15.528 17.494 491 HD12 ILE 70 HD12 ILE 70 6.765 -17.055 18.050 492 HD13 ILE 70 HD13 ILE 70 7.740 -16.075 19.146 493 H GLN 71 HN GLN 71 3.062 -11.941 21.057 494 HA GLN 71 HA GLN 71 4.806 -9.602 21.421 495 HB2 GLN 71 HB2 GLN 71 2.715 -8.289 21.608 496 HB3 GLN 71 HB1 GLN 71 2.871 -9.072 20.047 497 HG2 GLN 71 HG2 GLN 71 1.249 -10.260 22.275 498 HG3 GLN 71 HG1 GLN 71 0.581 -9.082 21.152 499 HE21 GLN 71 HE21 GLN 71 0.294 -9.662 18.979 500 HE22 GLN 71 HE22 GLN 71 0.270 -11.327 18.484 501 H GLU 72 HN GLU 72 4.474 -12.120 22.946 502 HA GLU 72 HA GLU 72 3.156 -11.393 25.419 503 HB2 GLU 72 HB2 GLU 72 4.886 -13.796 24.783 504 HB3 GLU 72 HB1 GLU 72 3.845 -13.606 26.185 505 HG2 GLU 72 HG2 GLU 72 3.030 -13.970 23.316 506 HG3 GLU 72 HG1 GLU 72 2.736 -15.045 24.680 507 HA PRO 73 HA PRO 73 6.679 -9.849 27.615 508 HB2 PRO 73 HB2 PRO 73 6.807 -11.357 29.919 509 HB3 PRO 73 HB1 PRO 73 5.623 -10.020 29.653 510 HG2 PRO 73 HG2 PRO 73 5.244 -12.994 29.333 511 HG3 PRO 73 HG1 PRO 73 4.157 -11.790 30.055 512 HD2 PRO 73 HD2 PRO 73 3.771 -12.734 27.573 513 HD3 PRO 73 HD1 PRO 73 3.418 -11.027 27.998 514 H ALA 74 HN ALA 74 8.683 -10.620 28.961 515 HA ALA 74 HA ALA 74 10.712 -11.598 28.971 516 HB1 ALA 74 HB1 ALA 74 10.934 -13.962 28.567 517 HB2 ALA 74 HB2 ALA 74 9.369 -14.005 27.753 518 HB3 ALA 74 HB3 ALA 74 9.458 -13.655 29.479 519 H LEU 75 HN LEU 75 12.538 -11.943 27.689 520 HA LEU 75 HA LEU 75 12.164 -11.176 24.889 521 HB2 LEU 75 HB2 LEU 75 14.522 -10.956 26.742 522 HB3 LEU 75 HB1 LEU 75 14.678 -10.756 25.013 523 HG LEU 75 HG LEU 75 14.581 -8.593 25.988 524 HD11 LEU 75 HD11 LEU 75 13.419 -8.753 23.900 525 HD12 LEU 75 HD12 LEU 75 12.541 -7.647 24.955 526 HD13 LEU 75 HD13 LEU 75 11.947 -9.290 24.711 527 HD21 LEU 75 HD21 LEU 75 13.592 -9.122 28.127 528 HD22 LEU 75 HD22 LEU 75 12.043 -9.470 27.358 529 HD23 LEU 75 HD23 LEU 75 12.680 -7.827 27.350 530 HA PRO 76 HA PRO 76 13.448 -15.244 23.437 531 HB2 PRO 76 HB2 PRO 76 15.370 -13.739 21.687 532 HB3 PRO 76 HB1 PRO 76 14.274 -15.049 21.238 533 HG2 PRO 76 HG2 PRO 76 13.679 -12.537 20.614 534 HG3 PRO 76 HG1 PRO 76 12.400 -13.654 21.221 535 HD2 PRO 76 HD2 PRO 76 13.785 -11.403 22.627 536 HD3 PRO 76 HD1 PRO 76 12.124 -11.979 22.773 537 HA PRO 77 HA PRO 77 16.827 -16.428 25.983 538 HB2 PRO 77 HB2 PRO 77 17.445 -18.139 23.578 539 HB3 PRO 77 HB1 PRO 77 17.455 -18.592 25.290 540 HG2 PRO 77 HG2 PRO 77 15.365 -19.250 23.871 541 HG3 PRO 77 HG1 PRO 77 15.115 -18.470 25.449 542 HD2 PRO 77 HD2 PRO 77 14.884 -17.257 22.693 543 HD3 PRO 77 HD1 PRO 77 13.849 -17.022 24.151 544 H GLY 78 HN GLY 78 18.662 -15.420 26.374 545 HA2 GLY 78 HA2 GLY 78 20.822 -14.650 26.023 546 HA3 GLY 78 HA1 GLY 78 20.723 -15.213 24.367 547 H TRP 79 HN TRP 79 18.081 -13.345 24.461 548 HA TRP 79 HA TRP 79 19.616 -11.047 23.436 549 HB2 TRP 79 HB2 TRP 79 16.707 -11.849 23.149 550 HB3 TRP 79 HB1 TRP 79 17.340 -10.309 22.590 551 HD1 TRP 79 HD1 TRP 79 17.811 -14.095 21.917 552 HE1 TRP 79 HE1 TRP 79 18.616 -14.381 19.487 553 HE3 TRP 79 HE3 TRP 79 18.354 -9.177 20.648 554 HZ2 TRP 79 HZ2 TRP 79 19.366 -12.744 17.320 555 HZ3 TRP 79 HZ3 TRP 79 19.115 -8.619 18.371 556 HH2 TRP 79 HH2 TRP 79 19.614 -10.366 16.746 557 H GLU 80 HN GLU 80 19.585 -9.029 24.422 558 HA GLU 80 HA GLU 80 17.823 -8.747 26.774 559 HB2 GLU 80 HB2 GLU 80 20.294 -8.871 27.313 560 HB3 GLU 80 HB1 GLU 80 20.514 -7.404 26.370 561 HG2 GLU 80 HG2 GLU 80 19.005 -6.208 27.897 562 HG3 GLU 80 HG1 GLU 80 18.837 -7.674 28.859 563 H MET 81 HN MET 81 17.025 -6.594 27.183 564 HA MET 81 HA MET 81 17.097 -4.801 24.881 565 HB2 MET 81 HB2 MET 81 15.075 -6.283 24.711 566 HB3 MET 81 HB1 MET 81 14.520 -5.610 26.262 567 HG2 MET 81 HG2 MET 81 15.101 -3.851 23.895 568 HG3 MET 81 HG1 MET 81 13.551 -4.673 24.074 569 HE1 MET 81 HE1 MET 81 12.293 -3.158 27.495 570 HE2 MET 81 HE2 MET 81 13.232 -4.631 27.254 571 HE3 MET 81 HE3 MET 81 11.897 -4.247 26.166 572 H LYS 82 HN LYS 82 17.021 -2.614 25.452 573 HA LYS 82 HA LYS 82 16.281 -1.712 28.000 574 HB2 LYS 82 HB2 LYS 82 18.741 -0.882 28.569 575 HB3 LYS 82 HB1 LYS 82 18.199 -2.468 29.082 576 HG2 LYS 82 HG2 LYS 82 19.371 -3.512 27.232 577 HG3 LYS 82 HG1 LYS 82 19.884 -1.895 26.643 578 HD2 LYS 82 HD2 LYS 82 21.032 -1.571 28.835 579 HD3 LYS 82 HD1 LYS 82 20.609 -3.233 29.256 580 HE2 LYS 82 HE2 LYS 82 21.778 -3.879 27.061 581 HE3 LYS 82 HE1 LYS 82 22.460 -2.255 27.106 582 HZ1 LYS 82 HZ1 LYS 82 22.747 -4.289 29.247 583 HZ2 LYS 82 HZ2 LYS 82 23.444 -2.741 29.235 584 HZ3 LYS 82 HZ3 LYS 82 23.935 -3.899 28.105 585 H TYR 83 HN TYR 83 16.664 0.665 28.213 586 HA TYR 83 HA TYR 83 16.594 1.822 25.498 587 HB2 TYR 83 HB2 TYR 83 15.510 2.923 28.129 588 HB3 TYR 83 HB1 TYR 83 15.322 3.704 26.534 589 HD1 TYR 83 HD1 TYR 83 13.910 2.597 24.803 590 HD2 TYR 83 HD2 TYR 83 14.088 1.154 28.796 591 HE1 TYR 83 HE1 TYR 83 11.833 1.343 24.436 592 HE2 TYR 83 HE2 TYR 83 12.005 -0.099 28.439 593 HH TYR 83 HH TYR 83 10.704 -0.658 25.404 594 H THR 84 HN THR 84 17.538 3.916 25.114 595 HA THR 84 HA THR 84 20.081 4.263 26.455 596 HB THR 84 HB THR 84 20.610 5.899 24.769 597 HG1 THR 84 HG1 THR 84 19.103 7.003 23.663 598 HG21 THR 84 HG21 THR 84 20.159 4.733 22.673 599 HG22 THR 84 HG22 THR 84 18.922 3.764 23.471 600 HG23 THR 84 HG23 THR 84 20.609 3.597 23.948 601 H SER 85 HN SER 85 20.491 6.961 26.547 602 HA SER 85 HA SER 85 18.853 7.718 28.808 603 HB2 SER 85 HB2 SER 85 20.499 9.750 28.711 604 HB3 SER 85 HB1 SER 85 21.102 8.163 29.204 605 HG SER 85 HG SER 85 21.185 9.101 26.515 606 H GLU 86 HN GLU 86 18.072 7.832 25.776 607 HA GLU 86 HA GLU 86 16.870 10.549 25.922 608 HB2 GLU 86 HB2 GLU 86 17.475 9.039 23.347 609 HB3 GLU 86 HB1 GLU 86 16.915 10.697 23.488 610 HG2 GLU 86 HG2 GLU 86 19.142 10.977 23.011 611 HG3 GLU 86 HG1 GLU 86 19.135 11.065 24.772 612 H GLY 87 HN GLY 87 16.274 7.375 26.288 613 HA2 GLY 87 HA2 GLY 87 14.190 6.327 26.502 614 HA3 GLY 87 HA1 GLY 87 13.462 7.645 25.594 615 H VAL 88 HN VAL 88 16.179 6.550 23.992 616 HA VAL 88 HA VAL 88 14.575 5.385 21.903 617 HB VAL 88 HB VAL 88 17.576 5.722 22.122 618 HG11 VAL 88 HG11 VAL 88 15.926 4.972 19.718 619 HG12 VAL 88 HG12 VAL 88 16.991 3.882 20.610 620 HG13 VAL 88 HG13 VAL 88 17.664 5.263 19.743 621 HG21 VAL 88 HG21 VAL 88 17.270 7.555 20.545 622 HG22 VAL 88 HG22 VAL 88 16.361 7.840 22.031 623 HG23 VAL 88 HG23 VAL 88 15.526 7.296 20.578 624 H ARG 89 HN ARG 89 14.490 3.272 21.281 625 HA ARG 89 HA ARG 89 15.232 1.318 23.317 626 HB2 ARG 89 HB2 ARG 89 12.937 1.594 22.007 627 HB3 ARG 89 HB1 ARG 89 13.770 0.614 20.814 628 HG2 ARG 89 HG2 ARG 89 14.013 -1.181 22.339 629 HG3 ARG 89 HG1 ARG 89 13.460 -0.178 23.692 630 HD2 ARG 89 HD2 ARG 89 11.313 0.132 22.419 631 HD3 ARG 89 HD1 ARG 89 11.880 -1.115 21.317 632 HE ARG 89 HE ARG 89 11.795 -1.824 24.132 633 HH11 ARG 89 HH11 ARG 89 10.334 -2.035 20.963 634 HH12 ARG 89 HH12 ARG 89 9.131 -3.193 21.459 635 HH21 ARG 89 HH21 ARG 89 10.221 -3.361 24.783 636 HH22 ARG 89 HH22 ARG 89 9.042 -3.923 23.640 637 H TYR 90 HN TYR 90 16.821 -0.157 23.063 638 HA TYR 90 HA TYR 90 17.756 -0.746 20.366 639 HB2 TYR 90 HB2 TYR 90 20.100 -0.548 20.964 640 HB3 TYR 90 HB1 TYR 90 19.286 0.974 21.253 641 HD1 TYR 90 HD1 TYR 90 18.837 1.711 23.588 642 HD2 TYR 90 HD2 TYR 90 21.165 -1.741 22.727 643 HE1 TYR 90 HE1 TYR 90 19.807 1.808 25.845 644 HE2 TYR 90 HE2 TYR 90 22.126 -1.651 24.991 645 HH TYR 90 HH TYR 90 20.882 0.325 27.452 646 H PHE 91 HN PHE 91 18.973 -2.823 20.257 647 HA PHE 91 HA PHE 91 18.194 -4.583 22.473 648 HB2 PHE 91 HB2 PHE 91 18.121 -5.014 19.507 649 HB3 PHE 91 HB1 PHE 91 18.383 -6.374 20.573 650 HD1 PHE 91 HD1 PHE 91 16.557 -7.600 21.141 651 HD2 PHE 91 HD2 PHE 91 16.052 -3.442 20.369 652 HE1 PHE 91 HE1 PHE 91 14.148 -7.821 21.551 653 HE2 PHE 91 HE2 PHE 91 13.636 -3.660 20.788 654 HZ PHE 91 HZ PHE 91 12.680 -5.849 21.381 655 H VAL 92 HN VAL 92 19.641 -6.326 22.952 656 HA VAL 92 HA VAL 92 22.435 -5.647 22.265 657 HB VAL 92 HB VAL 92 21.487 -6.850 24.872 658 HG11 VAL 92 HG11 VAL 92 23.688 -6.225 25.699 659 HG12 VAL 92 HG12 VAL 92 24.106 -5.564 24.120 660 HG13 VAL 92 HG13 VAL 92 23.822 -7.297 24.308 661 HG21 VAL 92 HG21 VAL 92 20.535 -4.668 24.765 662 HG22 VAL 92 HG22 VAL 92 22.052 -3.979 24.193 663 HG23 VAL 92 HG23 VAL 92 21.933 -4.602 25.838 664 H ASP 93 HN ASP 93 23.600 -7.269 21.344 665 HA ASP 93 HA ASP 93 22.520 -10.000 21.503 666 HB2 ASP 93 HB2 ASP 93 23.251 -9.268 19.261 667 HB3 ASP 93 HB1 ASP 93 24.868 -8.951 19.866 668 H HIS 94 HN HIS 94 23.488 -11.549 22.814 669 HA HIS 94 HA HIS 94 25.414 -10.503 24.686 670 HB2 HIS 94 HB2 HIS 94 24.922 -12.381 26.031 671 HB3 HIS 94 HB1 HIS 94 23.395 -11.927 25.284 672 HD1 HIS 94 HD1 HIS 94 22.617 -13.503 23.220 673 HD2 HIS 94 HD2 HIS 94 25.699 -14.977 25.600 674 HE1 HIS 94 HE1 HIS 94 22.771 -15.961 22.702 675 HE2 HIS 94 HE2 HIS 94 24.582 -16.850 24.202 676 H ASN 95 HN ASN 95 25.554 -12.490 21.844 677 HA ASN 95 HA ASN 95 27.898 -13.930 22.738 678 HB2 ASN 95 HB2 ASN 95 27.259 -15.432 21.139 679 HB3 ASN 95 HB1 ASN 95 25.881 -14.385 20.826 680 HD21 ASN 95 HD21 ASN 95 25.934 -12.973 19.069 681 HD22 ASN 95 HD22 ASN 95 27.057 -13.210 17.763 682 H THR 96 HN THR 96 27.191 -11.262 20.525 683 HA THR 96 HA THR 96 30.036 -11.028 19.912 684 HB THR 96 HB THR 96 29.208 -9.131 18.422 685 HG1 THR 96 HG1 THR 96 26.685 -10.347 19.010 686 HG21 THR 96 HG21 THR 96 28.192 -11.929 17.915 687 HG22 THR 96 HG22 THR 96 29.783 -11.301 17.490 688 HG23 THR 96 HG23 THR 96 28.346 -10.665 16.693 689 H ARG 97 HN ARG 97 27.741 -9.739 22.037 690 HA ARG 97 HA ARG 97 27.633 -7.953 23.433 691 HB2 ARG 97 HB2 ARG 97 30.596 -8.326 23.184 692 HB3 ARG 97 HB1 ARG 97 29.945 -6.968 24.095 693 HG2 ARG 97 HG2 ARG 97 28.582 -8.641 25.383 694 HG3 ARG 97 HG1 ARG 97 29.556 -9.897 24.613 695 HD2 ARG 97 HD2 ARG 97 31.550 -9.052 25.583 696 HD3 ARG 97 HD1 ARG 97 30.740 -7.591 26.141 697 HE ARG 97 HE ARG 97 29.614 -9.982 27.248 698 HH11 ARG 97 HH11 ARG 97 32.210 -7.646 27.579 699 HH12 ARG 97 HH12 ARG 97 32.398 -7.909 29.286 700 HH21 ARG 97 HH21 ARG 97 29.860 -10.326 29.507 701 HH22 ARG 97 HH22 ARG 97 31.070 -9.439 30.385 702 H THR 98 HN THR 98 26.573 -6.995 21.639 703 HA THR 98 HA THR 98 27.847 -4.496 20.809 704 HB THR 98 HB THR 98 28.130 -6.340 19.005 705 HG1 THR 98 HG1 THR 98 27.918 -4.773 17.426 706 HG21 THR 98 HG21 THR 98 26.210 -6.670 17.515 707 HG22 THR 98 HG22 THR 98 25.200 -5.697 18.584 708 HG23 THR 98 HG23 THR 98 25.830 -7.247 19.141 709 H THR 99 HN THR 99 26.142 -3.088 19.676 710 HA THR 99 HA THR 99 23.518 -3.554 20.954 711 HB THR 99 HB THR 99 23.327 -0.975 20.885 712 HG1 THR 99 HG1 THR 99 24.953 0.033 20.024 713 HG21 THR 99 HG21 THR 99 24.639 -0.690 22.985 714 HG22 THR 99 HG22 THR 99 25.492 -2.197 22.660 715 HG23 THR 99 HG23 THR 99 23.765 -2.227 23.010 716 H THR 100 HN THR 100 21.812 -3.717 19.489 717 HA THR 100 HA THR 100 22.217 -2.523 16.840 718 HB THR 100 HB THR 100 22.750 -4.968 16.719 719 HG1 THR 100 HG1 THR 100 21.226 -5.343 14.936 720 HG21 THR 100 HG21 THR 100 19.867 -5.239 17.549 721 HG22 THR 100 HG22 THR 100 21.286 -5.920 18.345 722 HG23 THR 100 HG23 THR 100 20.779 -6.534 16.772 723 H PHE 101 HN PHE 101 20.195 -2.211 15.651 724 HA PHE 101 HA PHE 101 17.986 -1.684 17.520 725 HB2 PHE 101 HB2 PHE 101 18.731 -0.396 14.872 726 HB3 PHE 101 HB1 PHE 101 17.187 -0.064 15.765 727 HD1 PHE 101 HD1 PHE 101 20.856 0.349 15.782 728 HD2 PHE 101 HD2 PHE 101 17.187 1.254 17.736 729 HE1 PHE 101 HE1 PHE 101 21.998 2.078 17.119 730 HE2 PHE 101 HE2 PHE 101 18.312 2.975 19.073 731 HZ PHE 101 HZ PHE 101 20.728 3.390 18.766 732 H LYS 102 HN LYS 102 16.697 -3.428 17.477 733 HA LYS 102 HA LYS 102 15.489 -4.113 14.900 734 HB2 LYS 102 HB2 LYS 102 17.309 -5.796 15.531 735 HB3 LYS 102 HB1 LYS 102 16.287 -6.257 16.883 736 HG2 LYS 102 HG2 LYS 102 15.270 -6.329 14.062 737 HG3 LYS 102 HG1 LYS 102 16.190 -7.665 14.749 738 HD2 LYS 102 HD2 LYS 102 13.682 -6.549 16.005 739 HD3 LYS 102 HD1 LYS 102 13.690 -7.910 14.882 740 HE2 LYS 102 HE2 LYS 102 15.370 -7.892 17.370 741 HE3 LYS 102 HE1 LYS 102 13.692 -8.436 17.388 742 HZ1 LYS 102 HZ1 LYS 102 15.281 -10.263 17.104 743 HZ2 LYS 102 HZ2 LYS 102 15.823 -9.573 15.651 744 HZ3 LYS 102 HZ3 LYS 102 14.224 -10.124 15.786 745 H ASP 103 HN ASP 103 13.606 -3.083 15.432 746 HA ASP 103 HA ASP 103 12.119 -4.201 17.719 747 HB2 ASP 103 HB2 ASP 103 12.787 -1.722 17.881 748 HB3 ASP 103 HB1 ASP 103 11.649 -1.441 16.567 749 HA PRO 104 HA PRO 104 9.445 -5.626 14.476 750 HB2 PRO 104 HB2 PRO 104 7.408 -6.109 16.537 751 HB3 PRO 104 HB1 PRO 104 8.300 -7.295 15.582 752 HG2 PRO 104 HG2 PRO 104 8.698 -6.932 18.246 753 HG3 PRO 104 HG1 PRO 104 9.978 -7.479 17.149 754 HD2 PRO 104 HD2 PRO 104 9.498 -4.768 18.309 755 HD3 PRO 104 HD1 PRO 104 11.033 -5.612 18.008 756 H ARG 105 HN ARG 105 8.764 -2.990 16.548 757 HA ARG 105 HA ARG 105 6.135 -2.376 15.569 758 HB2 ARG 105 HB2 ARG 105 7.925 -1.409 17.560 759 HB3 ARG 105 HB1 ARG 105 7.426 -0.051 16.559 760 HG2 ARG 105 HG2 ARG 105 5.977 -0.290 18.472 761 HG3 ARG 105 HG1 ARG 105 5.091 -0.599 16.977 762 HD2 ARG 105 HD2 ARG 105 5.314 -3.020 17.363 763 HD3 ARG 105 HD1 ARG 105 6.172 -2.693 18.870 764 HE ARG 105 HE ARG 105 3.758 -1.312 18.988 765 HH11 ARG 105 HH11 ARG 105 4.805 -4.653 18.806 766 HH12 ARG 105 HH12 ARG 105 3.462 -5.252 19.720 767 HH21 ARG 105 HH21 ARG 105 1.990 -2.099 20.180 768 HH22 ARG 105 HH22 ARG 105 1.878 -3.805 20.531 769 HA PRO 106 HA PRO 106 7.846 -0.803 11.640 770 HB2 PRO 106 HB2 PRO 106 5.006 0.049 11.311 771 HB3 PRO 106 HB1 PRO 106 6.064 -0.871 10.181 772 HG2 PRO 106 HG2 PRO 106 4.092 -2.052 11.593 773 HG3 PRO 106 HG1 PRO 106 5.598 -2.870 11.228 774 HD2 PRO 106 HD2 PRO 106 4.658 -1.774 13.758 775 HD3 PRO 106 HD1 PRO 106 5.744 -3.154 13.444 776 H GLY 107 HN GLY 107 8.922 1.067 11.780 777 HA2 GLY 107 HA2 GLY 107 9.175 3.362 11.657 778 HA3 GLY 107 HA1 GLY 107 7.442 3.558 11.993 779 H PHE 108 HN PHE 108 7.582 1.956 14.489 780 HA PHE 108 HA PHE 108 7.466 2.629 16.716 781 HB2 PHE 108 HB2 PHE 108 9.771 2.758 17.753 782 HB3 PHE 108 HB1 PHE 108 9.469 1.299 16.752 783 HD1 PHE 108 HD1 PHE 108 11.332 4.446 17.059 784 HD2 PHE 108 HD2 PHE 108 10.689 0.968 14.676 785 HE1 PHE 108 HE1 PHE 108 13.399 4.912 15.813 786 HE2 PHE 108 HE2 PHE 108 12.750 1.438 13.429 787 HZ PHE 108 HZ PHE 108 14.113 3.412 13.999 788 H GLU 109 HN GLU 109 7.133 4.868 14.919 789 HA GLU 109 HA GLU 109 7.034 6.991 16.713 790 HB2 GLU 109 HB2 GLU 109 9.486 7.033 16.536 791 HB3 GLU 109 HB1 GLU 109 9.369 7.130 14.786 792 HG2 GLU 109 HG2 GLU 109 9.883 9.297 15.628 793 HG3 GLU 109 HG1 GLU 109 8.222 9.320 15.040 Start of MODEL 5 1 H1 GLY 1 HT1 GLY 1 -40.139 3.114 -5.212 2 H2 GLY 1 HT2 GLY 1 -38.715 3.627 -4.454 3 H3 GLY 1 HT3 GLY 1 -39.617 4.714 -5.390 4 HA2 GLY 1 HA1 GLY 1 -41.463 4.546 -3.828 5 HA3 GLY 1 HA2 GLY 1 -40.494 3.450 -2.852 6 H SER 2 HN SER 2 -40.570 4.807 -1.063 7 HA SER 2 HA SER 2 -39.708 7.540 -1.198 8 HB2 SER 2 HB2 SER 2 -39.972 5.802 1.264 9 HB3 SER 2 HB1 SER 2 -40.061 7.563 1.174 10 HG SER 2 HG SER 2 -41.957 7.246 -0.179 11 H HIS 3 HN HIS 3 -38.171 4.487 -0.816 12 HA HIS 3 HA HIS 3 -35.762 5.676 0.334 13 HB2 HIS 3 HB2 HIS 3 -36.285 2.792 -0.444 14 HB3 HIS 3 HB1 HIS 3 -34.911 3.388 0.477 15 HD1 HIS 3 HD1 HIS 3 -36.954 1.199 1.480 16 HD2 HIS 3 HD2 HIS 3 -37.012 5.236 2.502 17 HE1 HIS 3 HE1 HIS 3 -38.196 1.337 3.664 18 HE2 HIS 3 HE2 HIS 3 -38.430 3.799 4.122 19 H MET 4 HN MET 4 -33.642 5.328 -0.765 20 HA MET 4 HA MET 4 -33.974 5.209 -3.692 21 HB2 MET 4 HB2 MET 4 -31.816 6.696 -2.165 22 HB3 MET 4 HB1 MET 4 -31.989 6.635 -3.907 23 HG2 MET 4 HG2 MET 4 -34.225 7.731 -3.632 24 HG3 MET 4 HG1 MET 4 -33.806 7.971 -1.937 25 HE1 MET 4 HE1 MET 4 -31.575 9.857 -5.508 26 HE2 MET 4 HE2 MET 4 -33.049 8.898 -5.650 27 HE3 MET 4 HE3 MET 4 -31.540 8.129 -5.161 28 H GLN 5 HN GLN 5 -32.722 3.781 -4.816 29 HA GLN 5 HA GLN 5 -31.451 1.705 -3.346 30 HB2 GLN 5 HB2 GLN 5 -32.553 1.160 -5.401 31 HB3 GLN 5 HB1 GLN 5 -31.575 2.311 -6.297 32 HG2 GLN 5 HG2 GLN 5 -29.607 0.959 -5.977 33 HG3 GLN 5 HG1 GLN 5 -30.505 -0.157 -4.948 34 HE21 GLN 5 HE21 GLN 5 -30.037 1.004 -8.204 35 HE22 GLN 5 HE22 GLN 5 -30.823 -0.348 -9.005 36 H TYR 6 HN TYR 6 -29.495 1.721 -2.519 37 HA TYR 6 HA TYR 6 -27.412 3.332 -3.859 38 HB2 TYR 6 HB2 TYR 6 -27.831 2.746 -0.901 39 HB3 TYR 6 HB1 TYR 6 -26.238 3.182 -1.503 40 HD1 TYR 6 HD1 TYR 6 -25.742 5.471 -2.121 41 HD2 TYR 6 HD2 TYR 6 -29.692 4.352 -0.986 42 HE1 TYR 6 HE1 TYR 6 -26.359 7.840 -1.939 43 HE2 TYR 6 HE2 TYR 6 -30.310 6.724 -0.806 44 HH TYR 6 HH TYR 6 -29.261 8.890 -0.492 45 H LYS 7 HN LYS 7 -25.529 2.257 -4.395 46 HA LYS 7 HA LYS 7 -25.506 -0.609 -3.761 47 HB2 LYS 7 HB2 LYS 7 -24.224 -0.788 -6.025 48 HB3 LYS 7 HB1 LYS 7 -25.996 -0.635 -6.039 49 HG2 LYS 7 HG2 LYS 7 -25.634 1.848 -6.337 50 HG3 LYS 7 HG1 LYS 7 -23.940 1.463 -6.647 51 HD2 LYS 7 HD2 LYS 7 -26.275 0.314 -8.174 52 HD3 LYS 7 HD1 LYS 7 -25.288 1.670 -8.719 53 HE2 LYS 7 HE2 LYS 7 -24.171 -1.047 -8.073 54 HE3 LYS 7 HE1 LYS 7 -24.692 -0.572 -9.686 55 HZ1 LYS 7 HZ1 LYS 7 -22.655 0.942 -8.156 56 HZ2 LYS 7 HZ2 LYS 7 -23.020 1.069 -9.804 57 HZ3 LYS 7 HZ3 LYS 7 -22.263 -0.326 -9.210 58 H LEU 8 HN LEU 8 -23.521 -1.674 -3.668 59 HA LEU 8 HA LEU 8 -21.255 0.088 -2.974 60 HB2 LEU 8 HB2 LEU 8 -22.409 -0.798 -0.915 61 HB3 LEU 8 HB1 LEU 8 -22.036 -2.413 -1.461 62 HG LEU 8 HG LEU 8 -19.592 -1.783 -1.334 63 HD11 LEU 8 HD11 LEU 8 -19.161 0.110 0.310 64 HD12 LEU 8 HD12 LEU 8 -20.800 0.662 -0.051 65 HD13 LEU 8 HD13 LEU 8 -19.588 0.575 -1.328 66 HD21 LEU 8 HD21 LEU 8 -19.665 -1.882 1.217 67 HD22 LEU 8 HD22 LEU 8 -20.442 -3.188 0.321 68 HD23 LEU 8 HD23 LEU 8 -21.419 -1.902 1.029 69 H ILE 9 HN ILE 9 -19.232 -0.690 -3.432 70 HA ILE 9 HA ILE 9 -19.067 -3.278 -4.822 71 HB ILE 9 HB ILE 9 -17.654 -0.712 -5.617 72 HG12 ILE 9 HG12 ILE 9 -19.632 -2.416 -7.197 73 HG13 ILE 9 HG11 ILE 9 -20.073 -0.886 -6.352 74 HG21 ILE 9 HG21 ILE 9 -16.719 -2.062 -7.468 75 HG22 ILE 9 HG22 ILE 9 -17.403 -3.507 -6.723 76 HG23 ILE 9 HG23 ILE 9 -16.162 -2.585 -5.878 77 HD11 ILE 9 HD11 ILE 9 -19.722 -0.532 -8.742 78 HD12 ILE 9 HD12 ILE 9 -18.087 -1.187 -8.621 79 HD13 ILE 9 HD13 ILE 9 -18.495 0.318 -7.798 80 H LEU 10 HN LEU 10 -17.688 -4.603 -3.794 81 HA LEU 10 HA LEU 10 -15.851 -3.400 -1.865 82 HB2 LEU 10 HB2 LEU 10 -16.500 -6.320 -2.224 83 HB3 LEU 10 HB1 LEU 10 -15.470 -5.645 -0.989 84 HG LEU 10 HG LEU 10 -17.374 -6.057 0.190 85 HD11 LEU 10 HD11 LEU 10 -16.758 -3.706 0.438 86 HD12 LEU 10 HD12 LEU 10 -18.458 -4.043 0.759 87 HD13 LEU 10 HD13 LEU 10 -17.986 -3.293 -0.766 88 HD21 LEU 10 HD21 LEU 10 -18.712 -6.770 -1.769 89 HD22 LEU 10 HD22 LEU 10 -19.118 -5.076 -2.053 90 HD23 LEU 10 HD23 LEU 10 -19.632 -5.869 -0.567 91 H ASN 11 HN ASN 11 -13.975 -2.840 -2.677 92 HA ASN 11 HA ASN 11 -12.817 -4.569 -4.754 93 HB2 ASN 11 HB2 ASN 11 -13.189 -1.982 -5.017 94 HB3 ASN 11 HB1 ASN 11 -11.729 -1.862 -4.045 95 HD21 ASN 11 HD21 ASN 11 -12.207 -1.037 -6.761 96 HD22 ASN 11 HD22 ASN 11 -11.051 -1.867 -7.745 97 H GLY 12 HN GLY 12 -12.115 -6.136 -3.237 98 HA2 GLY 12 HA2 GLY 12 -9.665 -5.272 -1.817 99 HA3 GLY 12 HA1 GLY 12 -10.761 -6.497 -1.129 100 H LYS 13 HN LYS 13 -8.853 -7.843 -1.077 101 HA LYS 13 HA LYS 13 -7.939 -8.781 -3.674 102 HB2 LYS 13 HB2 LYS 13 -6.992 -9.503 -0.899 103 HB3 LYS 13 HB1 LYS 13 -6.408 -10.292 -2.355 104 HG2 LYS 13 HG2 LYS 13 -5.815 -7.946 -3.169 105 HG3 LYS 13 HG1 LYS 13 -6.044 -7.453 -1.488 106 HD2 LYS 13 HD2 LYS 13 -3.702 -7.931 -1.874 107 HD3 LYS 13 HD1 LYS 13 -4.384 -9.159 -0.804 108 HE2 LYS 13 HE2 LYS 13 -4.724 -10.589 -2.852 109 HE3 LYS 13 HE1 LYS 13 -3.762 -9.408 -3.742 110 HZ1 LYS 13 HZ1 LYS 13 -2.508 -11.369 -2.909 111 HZ2 LYS 13 HZ2 LYS 13 -2.796 -10.840 -1.323 112 HZ3 LYS 13 HZ3 LYS 13 -1.884 -9.880 -2.388 113 H THR 14 HN THR 14 -9.291 -10.517 -0.786 114 HA THR 14 HA THR 14 -10.021 -12.680 -2.611 115 HB THR 14 HB THR 14 -10.694 -13.763 -0.341 116 HG1 THR 14 HG1 THR 14 -9.829 -12.834 1.467 117 HG21 THR 14 HG21 THR 14 -7.806 -13.171 -1.011 118 HG22 THR 14 HG22 THR 14 -8.781 -14.491 -1.662 119 HG23 THR 14 HG23 THR 14 -8.366 -14.462 0.050 120 H LEU 15 HN LEU 15 -11.417 -9.969 -1.192 121 HA LEU 15 HA LEU 15 -14.098 -11.082 -1.523 122 HB2 LEU 15 HB2 LEU 15 -12.973 -9.139 0.417 123 HB3 LEU 15 HB1 LEU 15 -14.642 -9.001 -0.040 124 HG LEU 15 HG LEU 15 -13.382 -11.477 1.125 125 HD11 LEU 15 HD11 LEU 15 -14.518 -10.891 3.170 126 HD12 LEU 15 HD12 LEU 15 -15.153 -9.424 2.427 127 HD13 LEU 15 HD13 LEU 15 -13.416 -9.601 2.691 128 HD21 LEU 15 HD21 LEU 15 -16.276 -10.767 0.707 129 HD22 LEU 15 HD22 LEU 15 -15.629 -12.289 1.318 130 HD23 LEU 15 HD23 LEU 15 -15.339 -11.814 -0.355 131 H LYS 16 HN LYS 16 -14.439 -10.597 -3.595 132 HA LYS 16 HA LYS 16 -14.542 -7.761 -4.300 133 HB2 LYS 16 HB2 LYS 16 -13.474 -10.059 -5.950 134 HB3 LYS 16 HB1 LYS 16 -13.855 -8.479 -6.621 135 HG2 LYS 16 HG2 LYS 16 -12.096 -7.456 -5.555 136 HG3 LYS 16 HG1 LYS 16 -11.992 -8.681 -4.296 137 HD2 LYS 16 HD2 LYS 16 -10.165 -8.623 -6.019 138 HD3 LYS 16 HD1 LYS 16 -10.923 -10.190 -5.728 139 HE2 LYS 16 HE2 LYS 16 -10.608 -9.848 -8.119 140 HE3 LYS 16 HE1 LYS 16 -12.328 -9.825 -7.738 141 HZ1 LYS 16 HZ1 LYS 16 -10.636 -7.407 -8.148 142 HZ2 LYS 16 HZ2 LYS 16 -12.306 -7.421 -7.845 143 HZ3 LYS 16 HZ3 LYS 16 -11.705 -8.065 -9.287 144 H GLY 17 HN GLY 17 -16.527 -7.235 -4.762 145 HA2 GLY 17 HA2 GLY 17 -18.263 -8.520 -6.486 146 HA3 GLY 17 HA1 GLY 17 -18.652 -9.096 -4.866 147 H GLU 18 HN GLU 18 -20.709 -7.937 -5.640 148 HA GLU 18 HA GLU 18 -20.594 -5.212 -4.538 149 HB2 GLU 18 HB2 GLU 18 -22.032 -6.086 -7.051 150 HB3 GLU 18 HB1 GLU 18 -22.263 -4.526 -6.271 151 HG2 GLU 18 HG2 GLU 18 -20.403 -3.685 -7.150 152 HG3 GLU 18 HG1 GLU 18 -19.464 -5.134 -6.794 153 H THR 19 HN THR 19 -22.842 -4.391 -4.089 154 HA THR 19 HA THR 19 -24.906 -6.308 -3.561 155 HB THR 19 HB THR 19 -23.363 -6.708 -1.631 156 HG1 THR 19 HG1 THR 19 -25.182 -7.145 -0.678 157 HG21 THR 19 HG21 THR 19 -23.181 -4.975 0.122 158 HG22 THR 19 HG22 THR 19 -24.051 -3.841 -0.909 159 HG23 THR 19 HG23 THR 19 -22.455 -4.419 -1.390 160 H THR 20 HN THR 20 -26.746 -5.108 -2.290 161 HA THR 20 HA THR 20 -26.732 -2.254 -2.866 162 HB THR 20 HB THR 20 -29.079 -2.547 -3.883 163 HG1 THR 20 HG1 THR 20 -28.721 -4.803 -5.133 164 HG21 THR 20 HG21 THR 20 -26.586 -3.349 -5.400 165 HG22 THR 20 HG22 THR 20 -27.313 -1.743 -5.308 166 HG23 THR 20 HG23 THR 20 -28.133 -3.036 -6.177 167 H THR 21 HN THR 21 -28.351 -1.051 -1.812 168 HA THR 21 HA THR 21 -30.271 -2.379 -0.110 169 HB THR 21 HB THR 21 -28.083 -2.232 1.275 170 HG1 THR 21 HG1 THR 21 -30.019 -2.610 2.326 171 HG21 THR 21 HG21 THR 21 -28.927 0.698 1.293 172 HG22 THR 21 HG22 THR 21 -27.401 0.064 0.675 173 HG23 THR 21 HG23 THR 21 -27.754 -0.004 2.406 174 H GLU 22 HN GLU 22 -31.820 -0.796 0.801 175 HA GLU 22 HA GLU 22 -31.880 1.611 -0.894 176 HB2 GLU 22 HB2 GLU 22 -34.363 1.562 -0.453 177 HB3 GLU 22 HB1 GLU 22 -33.794 0.145 -1.329 178 HG2 GLU 22 HG2 GLU 22 -33.758 -1.115 0.799 179 HG3 GLU 22 HG1 GLU 22 -34.505 0.313 1.605 180 H ALA 23 HN ALA 23 -31.627 3.545 0.030 181 HA ALA 23 HA ALA 23 -32.339 3.872 2.874 182 HB1 ALA 23 HB1 ALA 23 -29.663 4.746 1.744 183 HB2 ALA 23 HB2 ALA 23 -29.904 3.326 2.760 184 HB3 ALA 23 HB3 ALA 23 -30.222 4.936 3.406 185 H VAL 24 HN VAL 24 -32.580 6.190 3.453 186 HA VAL 24 HA VAL 24 -33.445 7.730 1.122 187 HB VAL 24 HB VAL 24 -34.642 9.163 2.730 188 HG11 VAL 24 HG11 VAL 24 -35.190 6.219 3.092 189 HG12 VAL 24 HG12 VAL 24 -35.766 7.224 1.763 190 HG13 VAL 24 HG13 VAL 24 -36.328 7.529 3.407 191 HG21 VAL 24 HG21 VAL 24 -34.793 8.490 5.091 192 HG22 VAL 24 HG22 VAL 24 -33.150 8.942 4.640 193 HG23 VAL 24 HG23 VAL 24 -33.582 7.241 4.803 194 H ASP 25 HN ASP 25 -30.623 7.437 2.534 195 HA ASP 25 HA ASP 25 -29.860 10.175 2.085 196 HB2 ASP 25 HB2 ASP 25 -30.606 10.429 4.347 197 HB3 ASP 25 HB1 ASP 25 -29.743 8.984 4.852 198 H ALA 26 HN ALA 26 -27.534 10.499 2.246 199 HA ALA 26 HA ALA 26 -26.173 8.191 1.134 200 HB1 ALA 26 HB1 ALA 26 -25.925 10.446 0.127 201 HB2 ALA 26 HB2 ALA 26 -24.381 9.727 0.591 202 HB3 ALA 26 HB3 ALA 26 -25.108 10.980 1.598 203 H ALA 27 HN ALA 27 -25.978 10.223 4.027 204 HA ALA 27 HA ALA 27 -23.540 9.058 4.996 205 HB1 ALA 27 HB1 ALA 27 -24.237 11.323 5.654 206 HB2 ALA 27 HB2 ALA 27 -24.009 10.278 7.054 207 HB3 ALA 27 HB3 ALA 27 -25.637 10.646 6.485 208 H THR 28 HN THR 28 -26.963 8.610 5.482 209 HA THR 28 HA THR 28 -26.826 6.639 7.502 210 HB THR 28 HB THR 28 -29.002 6.869 5.410 211 HG1 THR 28 HG1 THR 28 -28.501 8.931 6.418 212 HG21 THR 28 HG21 THR 28 -29.142 4.916 6.909 213 HG22 THR 28 HG22 THR 28 -30.445 6.068 7.222 214 HG23 THR 28 HG23 THR 28 -29.053 5.990 8.305 215 H ALA 29 HN ALA 29 -26.423 6.461 4.034 216 HA ALA 29 HA ALA 29 -26.780 3.595 3.875 217 HB1 ALA 29 HB1 ALA 29 -26.069 3.850 1.564 218 HB2 ALA 29 HB2 ALA 29 -25.580 5.515 1.875 219 HB3 ALA 29 HB3 ALA 29 -27.282 5.063 1.959 220 H GLU 30 HN GLU 30 -24.172 5.930 4.060 221 HA GLU 30 HA GLU 30 -21.971 4.281 3.683 222 HB2 GLU 30 HB2 GLU 30 -22.077 6.842 3.940 223 HB3 GLU 30 HB1 GLU 30 -22.081 6.542 5.671 224 HG2 GLU 30 HG2 GLU 30 -19.943 5.283 5.373 225 HG3 GLU 30 HG1 GLU 30 -19.931 5.861 3.706 226 H LYS 31 HN LYS 31 -23.245 5.407 6.796 227 HA LYS 31 HA LYS 31 -21.801 3.933 8.518 228 HB2 LYS 31 HB2 LYS 31 -24.711 4.635 8.817 229 HB3 LYS 31 HB1 LYS 31 -23.655 4.127 10.126 230 HG2 LYS 31 HG2 LYS 31 -23.416 6.627 8.471 231 HG3 LYS 31 HG1 LYS 31 -23.853 6.509 10.173 232 HD2 LYS 31 HD2 LYS 31 -21.193 5.675 9.018 233 HD3 LYS 31 HD1 LYS 31 -21.507 7.219 9.810 234 HE2 LYS 31 HE2 LYS 31 -21.895 4.536 11.119 235 HE3 LYS 31 HE1 LYS 31 -20.432 5.505 11.266 236 HZ1 LYS 31 HZ1 LYS 31 -21.776 7.283 12.232 237 HZ2 LYS 31 HZ2 LYS 31 -21.860 5.862 13.149 238 HZ3 LYS 31 HZ3 LYS 31 -23.153 6.301 12.147 239 H VAL 32 HN VAL 32 -24.754 2.760 6.910 240 HA VAL 32 HA VAL 32 -24.867 0.330 8.412 241 HB VAL 32 HB VAL 32 -26.096 0.980 5.721 242 HG11 VAL 32 HG11 VAL 32 -26.710 -1.252 7.663 243 HG12 VAL 32 HG12 VAL 32 -25.978 -1.422 6.066 244 HG13 VAL 32 HG13 VAL 32 -27.647 -0.871 6.218 245 HG21 VAL 32 HG21 VAL 32 -28.149 1.393 6.987 246 HG22 VAL 32 HG22 VAL 32 -26.858 2.496 7.464 247 HG23 VAL 32 HG23 VAL 32 -27.273 1.126 8.494 248 H PHE 33 HN PHE 33 -23.726 1.115 5.121 249 HA PHE 33 HA PHE 33 -22.890 -1.536 4.532 250 HB2 PHE 33 HB2 PHE 33 -22.416 1.127 3.281 251 HB3 PHE 33 HB1 PHE 33 -21.352 -0.188 2.840 252 HD1 PHE 33 HD1 PHE 33 -23.339 -2.444 2.872 253 HD2 PHE 33 HD2 PHE 33 -23.584 1.515 1.328 254 HE1 PHE 33 HE1 PHE 33 -24.975 -3.201 1.198 255 HE2 PHE 33 HE2 PHE 33 -25.229 0.767 -0.341 256 HZ PHE 33 HZ PHE 33 -25.932 -1.598 -0.415 257 H LYS 34 HN LYS 34 -21.429 1.003 6.389 258 HA LYS 34 HA LYS 34 -18.753 0.156 6.151 259 HB2 LYS 34 HB2 LYS 34 -20.127 1.588 8.445 260 HB3 LYS 34 HB1 LYS 34 -18.400 1.438 8.282 261 HG2 LYS 34 HG2 LYS 34 -19.056 2.519 5.908 262 HG3 LYS 34 HG1 LYS 34 -20.179 3.298 7.042 263 HD2 LYS 34 HD2 LYS 34 -18.211 4.564 7.101 264 HD3 LYS 34 HD1 LYS 34 -18.196 3.623 8.565 265 HE2 LYS 34 HE2 LYS 34 -16.688 2.012 7.512 266 HE3 LYS 34 HE1 LYS 34 -16.716 2.951 6.020 267 HZ1 LYS 34 HZ1 LYS 34 -14.739 3.503 7.182 268 HZ2 LYS 34 HZ2 LYS 34 -15.578 3.775 8.631 269 HZ3 LYS 34 HZ3 LYS 34 -15.781 4.838 7.324 270 H GLN 35 HN GLN 35 -21.349 -0.690 8.379 271 HA GLN 35 HA GLN 35 -19.775 -2.477 9.942 272 HB2 GLN 35 HB2 GLN 35 -21.876 -1.397 10.762 273 HB3 GLN 35 HB1 GLN 35 -22.792 -2.385 9.637 274 HG2 GLN 35 HG2 GLN 35 -22.834 -3.283 11.926 275 HG3 GLN 35 HG1 GLN 35 -22.116 -4.401 10.770 276 HE21 GLN 35 HE21 GLN 35 -19.950 -4.867 10.885 277 HE22 GLN 35 HE22 GLN 35 -18.986 -4.483 12.271 278 H TYR 36 HN TYR 36 -21.696 -2.695 7.052 279 HA TYR 36 HA TYR 36 -21.845 -5.499 6.813 280 HB2 TYR 36 HB2 TYR 36 -23.286 -4.161 5.455 281 HB3 TYR 36 HB1 TYR 36 -21.940 -3.227 4.823 282 HD1 TYR 36 HD1 TYR 36 -23.730 -6.415 4.637 283 HD2 TYR 36 HD2 TYR 36 -20.624 -4.046 2.960 284 HE1 TYR 36 HE1 TYR 36 -23.630 -7.932 2.714 285 HE2 TYR 36 HE2 TYR 36 -20.516 -5.553 1.021 286 HH TYR 36 HH TYR 36 -22.897 -7.803 0.309 287 H ALA 37 HN ALA 37 -19.553 -3.123 5.488 288 HA ALA 37 HA ALA 37 -17.851 -5.078 4.296 289 HB1 ALA 37 HB1 ALA 37 -18.006 -2.719 3.558 290 HB2 ALA 37 HB2 ALA 37 -16.349 -3.229 3.882 291 HB3 ALA 37 HB3 ALA 37 -17.210 -2.223 5.049 292 H ASN 38 HN ASN 38 -17.856 -3.298 7.326 293 HA ASN 38 HA ASN 38 -15.364 -4.025 8.358 294 HB2 ASN 38 HB2 ASN 38 -16.858 -2.308 9.392 295 HB3 ASN 38 HB1 ASN 38 -17.968 -3.580 9.882 296 HD21 ASN 38 HD21 ASN 38 -15.158 -1.787 10.735 297 HD22 ASN 38 HD22 ASN 38 -14.783 -2.688 12.224 298 H ASP 39 HN ASP 39 -18.471 -5.700 8.554 299 HA ASP 39 HA ASP 39 -17.568 -7.759 10.280 300 HB2 ASP 39 HB2 ASP 39 -19.979 -6.991 9.763 301 HB3 ASP 39 HB1 ASP 39 -19.873 -8.057 8.369 302 H ASN 40 HN ASN 40 -17.140 -7.227 6.917 303 HA ASN 40 HA ASN 40 -16.490 -10.052 6.462 304 HB2 ASN 40 HB2 ASN 40 -17.021 -7.766 4.578 305 HB3 ASN 40 HB1 ASN 40 -16.165 -9.199 4.034 306 HD21 ASN 40 HD21 ASN 40 -19.224 -7.881 5.033 307 HD22 ASN 40 HD22 ASN 40 -20.190 -9.299 4.601 308 H GLY 41 HN GLY 41 -15.014 -7.211 7.392 309 HA2 GLY 41 HA2 GLY 41 -12.759 -6.961 7.904 310 HA3 GLY 41 HA1 GLY 41 -12.406 -8.369 6.918 311 H VAL 42 HN VAL 42 -14.317 -5.760 5.591 312 HA VAL 42 HA VAL 42 -12.002 -5.007 3.968 313 HB VAL 42 HB VAL 42 -14.931 -4.813 3.243 314 HG11 VAL 42 HG11 VAL 42 -12.436 -4.234 1.639 315 HG12 VAL 42 HG12 VAL 42 -13.560 -3.033 2.269 316 HG13 VAL 42 HG13 VAL 42 -14.086 -4.167 1.020 317 HG21 VAL 42 HG21 VAL 42 -12.750 -6.701 2.369 318 HG22 VAL 42 HG22 VAL 42 -14.306 -6.545 1.550 319 HG23 VAL 42 HG23 VAL 42 -14.239 -7.098 3.228 320 H ASP 43 HN ASP 43 -11.210 -3.112 4.370 321 HA ASP 43 HA ASP 43 -12.977 -0.849 4.813 322 HB2 ASP 43 HB2 ASP 43 -12.110 -1.833 7.081 323 HB3 ASP 43 HB1 ASP 43 -10.579 -1.094 6.618 324 H GLY 44 HN GLY 44 -11.986 1.145 4.185 325 HA2 GLY 44 HA2 GLY 44 -9.399 1.464 3.299 326 HA3 GLY 44 HA1 GLY 44 -10.294 0.810 1.932 327 H GLU 45 HN GLU 45 -9.559 2.977 1.086 328 HA GLU 45 HA GLU 45 -10.702 5.403 1.922 329 HB2 GLU 45 HB2 GLU 45 -9.317 4.385 -0.436 330 HB3 GLU 45 HB1 GLU 45 -10.549 5.571 -0.849 331 HG2 GLU 45 HG2 GLU 45 -8.409 6.027 1.216 332 HG3 GLU 45 HG1 GLU 45 -8.277 6.510 -0.476 333 H TRP 46 HN TRP 46 -12.630 6.369 1.522 334 HA TRP 46 HA TRP 46 -14.656 4.655 0.256 335 HB2 TRP 46 HB2 TRP 46 -14.788 6.367 2.699 336 HB3 TRP 46 HB1 TRP 46 -16.226 6.281 1.699 337 HD1 TRP 46 HD1 TRP 46 -13.712 3.783 3.261 338 HE1 TRP 46 HE1 TRP 46 -14.993 1.725 4.102 339 HE3 TRP 46 HE3 TRP 46 -18.485 5.101 1.840 340 HZ2 TRP 46 HZ2 TRP 46 -17.622 0.778 4.159 341 HZ3 TRP 46 HZ3 TRP 46 -20.310 3.550 2.353 342 HH2 TRP 46 HH2 TRP 46 -19.888 1.424 3.484 343 H THR 47 HN THR 47 -15.169 5.319 -1.672 344 HA THR 47 HA THR 47 -15.228 8.204 -2.229 345 HB THR 47 HB THR 47 -15.070 7.319 -4.697 346 HG1 THR 47 HG1 THR 47 -14.158 5.146 -3.126 347 HG21 THR 47 HG21 THR 47 -12.678 7.321 -2.856 348 HG22 THR 47 HG22 THR 47 -13.407 8.747 -3.591 349 HG23 THR 47 HG23 THR 47 -12.638 7.528 -4.608 350 H TYR 48 HN TYR 48 -17.025 8.996 -3.466 351 HA TYR 48 HA TYR 48 -19.265 7.121 -3.652 352 HB2 TYR 48 HB2 TYR 48 -19.731 8.225 -1.638 353 HB3 TYR 48 HB1 TYR 48 -19.181 9.759 -2.232 354 HD1 TYR 48 HD1 TYR 48 -20.852 11.350 -2.556 355 HD2 TYR 48 HD2 TYR 48 -21.788 7.231 -3.111 356 HE1 TYR 48 HE1 TYR 48 -23.172 11.954 -3.109 357 HE2 TYR 48 HE2 TYR 48 -24.112 7.827 -3.646 358 HH TYR 48 HH TYR 48 -25.656 9.494 -3.548 359 H ASP 49 HN ASP 49 -20.415 7.263 -5.512 360 HA ASP 49 HA ASP 49 -19.860 9.601 -7.268 361 HB2 ASP 49 HB2 ASP 49 -19.000 7.426 -8.249 362 HB3 ASP 49 HB1 ASP 49 -20.640 6.817 -8.241 363 H ASP 50 HN ASP 50 -21.587 10.931 -7.020 364 HA ASP 50 HA ASP 50 -24.083 9.981 -5.954 365 HB2 ASP 50 HB2 ASP 50 -24.782 12.334 -6.058 366 HB3 ASP 50 HB1 ASP 50 -23.075 12.351 -5.590 367 H ALA 51 HN ALA 51 -22.887 10.393 -9.182 368 HA ALA 51 HA ALA 51 -25.421 10.669 -10.448 369 HB1 ALA 51 HB1 ALA 51 -24.239 10.237 -12.525 370 HB2 ALA 51 HB2 ALA 51 -22.826 9.677 -11.632 371 HB3 ALA 51 HB3 ALA 51 -23.323 11.366 -11.524 372 H THR 52 HN THR 52 -23.437 7.918 -9.520 373 HA THR 52 HA THR 52 -25.466 6.108 -10.636 374 HB THR 52 HB THR 52 -23.707 4.335 -10.157 375 HG1 THR 52 HG1 THR 52 -21.998 6.615 -9.919 376 HG21 THR 52 HG21 THR 52 -22.368 4.909 -12.140 377 HG22 THR 52 HG22 THR 52 -22.976 6.562 -12.075 378 HG23 THR 52 HG23 THR 52 -24.079 5.230 -12.419 379 H LYS 53 HN LYS 53 -24.800 7.558 -7.749 380 HA LYS 53 HA LYS 53 -25.231 7.126 -5.524 381 HB2 LYS 53 HB2 LYS 53 -27.364 5.446 -6.833 382 HB3 LYS 53 HB1 LYS 53 -27.226 5.602 -5.103 383 HG2 LYS 53 HG2 LYS 53 -27.561 7.927 -6.948 384 HG3 LYS 53 HG1 LYS 53 -28.880 7.127 -6.098 385 HD2 LYS 53 HD2 LYS 53 -27.772 7.597 -3.981 386 HD3 LYS 53 HD1 LYS 53 -26.486 8.445 -4.831 387 HE2 LYS 53 HE2 LYS 53 -28.125 10.069 -5.661 388 HE3 LYS 53 HE1 LYS 53 -29.396 9.224 -4.781 389 HZ1 LYS 53 HZ1 LYS 53 -28.388 9.764 -2.720 390 HZ2 LYS 53 HZ2 LYS 53 -28.454 11.212 -3.620 391 HZ3 LYS 53 HZ3 LYS 53 -26.995 10.366 -3.473 392 H THR 54 HN THR 54 -23.055 5.928 -6.229 393 HA THR 54 HA THR 54 -23.223 3.240 -5.069 394 HB THR 54 HB THR 54 -21.263 4.059 -7.225 395 HG1 THR 54 HG1 THR 54 -23.723 3.752 -7.671 396 HG21 THR 54 HG21 THR 54 -21.998 1.347 -6.072 397 HG22 THR 54 HG22 THR 54 -20.505 2.231 -5.746 398 HG23 THR 54 HG23 THR 54 -20.837 1.635 -7.373 399 H TYR 55 HN TYR 55 -21.965 2.916 -3.375 400 HA TYR 55 HA TYR 55 -19.783 4.800 -2.819 401 HB2 TYR 55 HB2 TYR 55 -21.586 3.270 -1.056 402 HB3 TYR 55 HB1 TYR 55 -19.891 3.155 -0.613 403 HD1 TYR 55 HD1 TYR 55 -22.790 4.870 0.054 404 HD2 TYR 55 HD2 TYR 55 -18.683 5.607 -0.774 405 HE1 TYR 55 HE1 TYR 55 -22.971 7.071 1.137 406 HE2 TYR 55 HE2 TYR 55 -18.850 7.804 0.314 407 HH TYR 55 HH TYR 55 -20.854 9.496 0.729 408 H THR 56 HN THR 56 -17.721 4.133 -2.945 409 HA THR 56 HA THR 56 -17.316 1.266 -3.493 410 HB THR 56 HB THR 56 -15.669 3.563 -4.590 411 HG1 THR 56 HG1 THR 56 -17.975 2.975 -5.393 412 HG21 THR 56 HG21 THR 56 -14.389 1.477 -4.278 413 HG22 THR 56 HG22 THR 56 -14.621 1.838 -5.989 414 HG23 THR 56 HG23 THR 56 -15.601 0.600 -5.208 415 H VAL 57 HN VAL 57 -16.121 0.208 -2.061 416 HA VAL 57 HA VAL 57 -14.319 1.772 -0.332 417 HB VAL 57 HB VAL 57 -16.061 0.630 1.032 418 HG11 VAL 57 HG11 VAL 57 -14.930 -1.914 -0.116 419 HG12 VAL 57 HG12 VAL 57 -16.592 -1.333 -0.237 420 HG13 VAL 57 HG13 VAL 57 -15.947 -1.840 1.316 421 HG21 VAL 57 HG21 VAL 57 -13.857 1.060 1.959 422 HG22 VAL 57 HG22 VAL 57 -13.304 -0.516 1.392 423 HG23 VAL 57 HG23 VAL 57 -14.558 -0.415 2.626 424 H THR 58 HN THR 58 -12.323 1.630 -0.961 425 HA THR 58 HA THR 58 -11.482 -0.757 -2.455 426 HB THR 58 HB THR 58 -10.154 1.959 -2.457 427 HG1 THR 58 HG1 THR 58 -12.503 1.297 -3.487 428 HG21 THR 58 HG21 THR 58 -8.785 0.019 -3.188 429 HG22 THR 58 HG22 THR 58 -9.084 1.174 -4.487 430 HG23 THR 58 HG23 THR 58 -9.993 -0.338 -4.420 431 H GLU 59 HN GLU 59 -10.058 -2.063 -1.551 432 HA GLU 59 HA GLU 59 -8.859 -1.398 0.984 433 HB2 GLU 59 HB2 GLU 59 -9.730 -3.706 0.175 434 HB3 GLU 59 HB1 GLU 59 -8.215 -3.818 -0.702 435 HG2 GLU 59 HG2 GLU 59 -8.597 -3.676 2.277 436 HG3 GLU 59 HG1 GLU 59 -8.104 -5.068 1.334 437 H GLY 60 HN GLY 60 -6.666 -0.780 1.280 438 HA2 GLY 60 HA2 GLY 60 -4.892 -0.982 -1.032 439 HA3 GLY 60 HA1 GLY 60 -5.198 0.638 -0.408 440 H SER 61 HN SER 61 -3.377 -2.168 -0.113 441 HA SER 61 HA SER 61 -2.175 -1.133 2.355 442 HB2 SER 61 HB2 SER 61 -1.592 -3.678 2.691 443 HB3 SER 61 HB1 SER 61 -3.195 -3.086 3.135 444 HG SER 61 HG SER 61 -4.052 -3.985 1.317 445 H GLY 62 HN GLY 62 -0.118 -0.577 2.128 446 HA2 GLY 62 HA2 GLY 62 1.273 -1.108 -0.336 447 HA3 GLY 62 HA1 GLY 62 1.880 -0.190 1.033 448 H GLY 63 HN GLY 63 0.754 -3.551 0.941 449 HA2 GLY 63 HA2 GLY 63 3.273 -4.370 2.177 450 HA3 GLY 63 HA1 GLY 63 1.830 -5.365 1.998 451 H ALA 64 HN ALA 64 1.614 -4.505 -0.833 452 HA ALA 64 HA ALA 64 2.185 -5.160 -2.916 453 HB1 ALA 64 HB1 ALA 64 4.320 -4.068 -2.496 454 HB2 ALA 64 HB2 ALA 64 4.536 -5.510 -3.485 455 HB3 ALA 64 HB3 ALA 64 4.950 -5.546 -1.771 456 H GLY 65 HN GLY 65 4.296 -7.329 -1.032 457 HA2 GLY 65 HA2 GLY 65 2.612 -9.571 -1.150 458 HA3 GLY 65 HA1 GLY 65 3.674 -9.613 -2.550 459 H GLY 66 HN GLY 66 3.746 -11.614 -0.695 460 HA2 GLY 66 HA2 GLY 66 6.260 -11.091 0.771 461 HA3 GLY 66 HA1 GLY 66 5.032 -12.225 1.322 462 H GLN 67 HN GLN 67 5.722 -11.988 -2.036 463 HA GLN 67 HA GLN 67 6.650 -14.735 -2.041 464 HB2 GLN 67 HB2 GLN 67 4.913 -13.993 -3.639 465 HB3 GLN 67 HB1 GLN 67 6.072 -12.838 -4.347 466 HG2 GLN 67 HG2 GLN 67 5.812 -14.877 -5.687 467 HG3 GLN 67 HG1 GLN 67 7.462 -14.657 -5.106 468 HE21 GLN 67 HE21 GLN 67 4.531 -16.535 -4.796 469 HE22 GLN 67 HE22 GLN 67 5.252 -17.854 -3.937 470 H GLY 68 HN GLY 68 8.686 -15.392 -2.496 471 HA2 GLY 68 HA2 GLY 68 10.734 -13.295 -2.707 472 HA3 GLY 68 HA1 GLY 68 11.010 -14.955 -2.197 473 H MET 69 HN MET 69 12.683 -15.316 -3.710 474 HA MET 69 HA MET 69 11.706 -16.011 -6.337 475 HB2 MET 69 HB2 MET 69 13.368 -14.735 -7.575 476 HB3 MET 69 HB1 MET 69 12.342 -13.651 -6.650 477 HG2 MET 69 HG2 MET 69 14.071 -13.379 -4.985 478 HG3 MET 69 HG1 MET 69 15.095 -14.543 -5.821 479 HE1 MET 69 HE1 MET 69 13.358 -11.055 -5.989 480 HE2 MET 69 HE2 MET 69 12.824 -11.765 -7.511 481 HE3 MET 69 HE3 MET 69 13.949 -10.406 -7.519 482 H ILE 70 HN ILE 70 13.082 -17.435 -7.453 483 HA ILE 70 HA ILE 70 15.262 -18.564 -5.814 484 HB ILE 70 HB ILE 70 13.726 -20.126 -7.929 485 HG12 ILE 70 HG12 ILE 70 13.134 -20.067 -4.952 486 HG13 ILE 70 HG11 ILE 70 12.142 -19.315 -6.198 487 HG21 ILE 70 HG21 ILE 70 15.948 -21.001 -7.150 488 HG22 ILE 70 HG22 ILE 70 14.599 -22.098 -6.852 489 HG23 ILE 70 HG23 ILE 70 15.266 -21.152 -5.524 490 HD11 ILE 70 HD11 ILE 70 12.685 -22.261 -5.896 491 HD12 ILE 70 HD12 ILE 70 11.729 -21.524 -7.183 492 HD13 ILE 70 HD13 ILE 70 11.183 -21.422 -5.509 493 H GLN 71 HN GLN 71 15.282 -16.375 -7.711 494 HA GLN 71 HA GLN 71 16.537 -17.408 -10.128 495 HB2 GLN 71 HB2 GLN 71 15.865 -14.570 -9.323 496 HB3 GLN 71 HB1 GLN 71 16.475 -15.073 -10.896 497 HG2 GLN 71 HG2 GLN 71 14.446 -16.460 -11.186 498 HG3 GLN 71 HG1 GLN 71 13.829 -15.811 -9.666 499 HE21 GLN 71 HE21 GLN 71 13.168 -13.670 -9.568 500 HE22 GLN 71 HE22 GLN 71 12.861 -12.736 -10.987 501 H GLU 72 HN GLU 72 17.832 -17.444 -7.381 502 HA GLU 72 HA GLU 72 19.976 -15.546 -7.545 503 HB2 GLU 72 HB2 GLU 72 19.712 -18.029 -5.834 504 HB3 GLU 72 HB1 GLU 72 20.967 -16.809 -5.666 505 HG2 GLU 72 HG2 GLU 72 19.017 -15.159 -5.348 506 HG3 GLU 72 HG1 GLU 72 18.048 -16.600 -5.055 507 HA PRO 73 HA PRO 73 22.356 -17.959 -10.399 508 HB2 PRO 73 HB2 PRO 73 24.621 -16.453 -10.381 509 HB3 PRO 73 HB1 PRO 73 23.104 -15.928 -11.212 510 HG2 PRO 73 HG2 PRO 73 24.213 -15.089 -8.546 511 HG3 PRO 73 HG1 PRO 73 23.394 -14.117 -9.782 512 HD2 PRO 73 HD2 PRO 73 22.191 -15.070 -7.503 513 HD3 PRO 73 HD1 PRO 73 21.316 -14.677 -9.022 514 H ALA 74 HN ALA 74 24.696 -18.730 -10.545 515 HA ALA 74 HA ALA 74 26.448 -19.936 -9.784 516 HB1 ALA 74 HB1 ALA 74 27.302 -19.526 -7.502 517 HB2 ALA 74 HB2 ALA 74 25.906 -18.486 -7.209 518 HB3 ALA 74 HB3 ALA 74 27.084 -18.056 -8.449 519 H LEU 75 HN LEU 75 26.928 -21.285 -7.503 520 HA LEU 75 HA LEU 75 25.237 -23.509 -7.693 521 HB2 LEU 75 HB2 LEU 75 27.188 -22.762 -5.533 522 HB3 LEU 75 HB1 LEU 75 26.399 -24.313 -5.638 523 HG LEU 75 HG LEU 75 28.581 -24.604 -6.489 524 HD11 LEU 75 HD11 LEU 75 26.692 -24.332 -8.816 525 HD12 LEU 75 HD12 LEU 75 26.866 -25.740 -7.770 526 HD13 LEU 75 HD13 LEU 75 28.198 -25.249 -8.815 527 HD21 LEU 75 HD21 LEU 75 29.514 -23.270 -8.330 528 HD22 LEU 75 HD22 LEU 75 29.198 -22.296 -6.892 529 HD23 LEU 75 HD23 LEU 75 28.097 -22.222 -8.270 530 HA PRO 76 HA PRO 76 21.911 -21.927 -5.085 531 HB2 PRO 76 HB2 PRO 76 20.964 -24.743 -5.352 532 HB3 PRO 76 HB1 PRO 76 20.087 -23.254 -5.724 533 HG2 PRO 76 HG2 PRO 76 20.962 -24.807 -7.696 534 HG3 PRO 76 HG1 PRO 76 21.121 -23.012 -7.808 535 HD2 PRO 76 HD2 PRO 76 23.256 -25.047 -7.048 536 HD3 PRO 76 HD1 PRO 76 23.359 -23.666 -8.167 537 HA PRO 77 HA PRO 77 23.043 -23.197 -0.981 538 HB2 PRO 77 HB2 PRO 77 20.051 -23.484 -0.708 539 HB3 PRO 77 HB1 PRO 77 21.201 -22.767 0.433 540 HG2 PRO 77 HG2 PRO 77 19.826 -21.144 -1.073 541 HG3 PRO 77 HG1 PRO 77 21.583 -20.909 -0.948 542 HD2 PRO 77 HD2 PRO 77 20.012 -22.145 -3.212 543 HD3 PRO 77 HD1 PRO 77 21.417 -21.019 -3.267 544 H GLY 78 HN GLY 78 23.773 -25.124 -0.393 545 HA2 GLY 78 HA2 GLY 78 23.523 -27.408 0.187 546 HA3 GLY 78 HA1 GLY 78 22.113 -27.497 -0.852 547 H TRP 79 HN TRP 79 23.682 -26.144 -3.093 548 HA TRP 79 HA TRP 79 24.968 -28.615 -4.036 549 HB2 TRP 79 HB2 TRP 79 24.197 -26.047 -5.448 550 HB3 TRP 79 HB1 TRP 79 25.098 -27.346 -6.226 551 HD1 TRP 79 HD1 TRP 79 21.633 -26.661 -4.672 552 HE1 TRP 79 HE1 TRP 79 19.951 -28.308 -5.690 553 HE3 TRP 79 HE3 TRP 79 24.863 -29.520 -7.443 554 HZ2 TRP 79 HZ2 TRP 79 19.972 -30.512 -7.448 555 HZ3 TRP 79 HZ3 TRP 79 23.937 -31.380 -8.767 556 HH2 TRP 79 HH2 TRP 79 21.541 -31.866 -8.769 557 H GLU 80 HN GLU 80 27.178 -28.832 -4.225 558 HA GLU 80 HA GLU 80 28.772 -26.369 -4.000 559 HB2 GLU 80 HB2 GLU 80 29.383 -29.086 -2.797 560 HB3 GLU 80 HB1 GLU 80 30.502 -27.732 -2.801 561 HG2 GLU 80 HG2 GLU 80 28.802 -26.435 -1.520 562 HG3 GLU 80 HG1 GLU 80 27.856 -27.917 -1.392 563 H MET 81 HN MET 81 30.603 -26.250 -5.279 564 HA MET 81 HA MET 81 30.812 -28.320 -7.351 565 HB2 MET 81 HB2 MET 81 29.847 -26.109 -8.110 566 HB3 MET 81 HB1 MET 81 31.411 -25.368 -7.709 567 HG2 MET 81 HG2 MET 81 31.166 -27.657 -9.647 568 HG3 MET 81 HG1 MET 81 30.964 -25.981 -10.143 569 HE1 MET 81 HE1 MET 81 34.493 -24.492 -9.207 570 HE2 MET 81 HE2 MET 81 33.114 -24.607 -8.116 571 HE3 MET 81 HE3 MET 81 32.872 -24.121 -9.793 572 H LYS 82 HN LYS 82 32.847 -29.196 -7.667 573 HA LYS 82 HA LYS 82 35.147 -27.834 -6.552 574 HB2 LYS 82 HB2 LYS 82 34.478 -30.626 -5.565 575 HB3 LYS 82 HB1 LYS 82 35.893 -29.690 -5.138 576 HG2 LYS 82 HG2 LYS 82 34.445 -28.052 -4.003 577 HG3 LYS 82 HG1 LYS 82 33.037 -29.087 -4.388 578 HD2 LYS 82 HD2 LYS 82 34.194 -30.939 -3.165 579 HD3 LYS 82 HD1 LYS 82 35.423 -29.777 -2.661 580 HE2 LYS 82 HE2 LYS 82 33.629 -28.418 -1.613 581 HE3 LYS 82 HE1 LYS 82 32.475 -29.680 -2.032 582 HZ1 LYS 82 HZ1 LYS 82 33.119 -30.012 0.205 583 HZ2 LYS 82 HZ2 LYS 82 34.763 -29.879 -0.159 584 HZ3 LYS 82 HZ3 LYS 82 33.891 -31.229 -0.695 585 H TYR 83 HN TYR 83 37.175 -28.838 -7.260 586 HA TYR 83 HA TYR 83 36.792 -30.408 -9.736 587 HB2 TYR 83 HB2 TYR 83 39.083 -28.559 -8.921 588 HB3 TYR 83 HB1 TYR 83 39.023 -29.481 -10.446 589 HD1 TYR 83 HD1 TYR 83 37.735 -26.585 -8.601 590 HD2 TYR 83 HD2 TYR 83 37.493 -28.795 -12.226 591 HE1 TYR 83 HE1 TYR 83 36.536 -24.716 -9.664 592 HE2 TYR 83 HE2 TYR 83 36.303 -26.933 -13.296 593 HH TYR 83 HH TYR 83 34.836 -25.004 -12.504 594 H THR 84 HN THR 84 38.223 -32.160 -10.153 595 HA THR 84 HA THR 84 39.210 -33.481 -7.783 596 HB THR 84 HB THR 84 39.674 -35.375 -9.201 597 HG1 THR 84 HG1 THR 84 39.648 -35.193 -11.473 598 HG21 THR 84 HG21 THR 84 37.177 -34.008 -10.196 599 HG22 THR 84 HG22 THR 84 37.303 -35.038 -8.770 600 HG23 THR 84 HG23 THR 84 37.553 -35.721 -10.375 601 H SER 85 HN SER 85 41.535 -34.738 -8.607 602 HA SER 85 HA SER 85 43.425 -32.550 -8.430 603 HB2 SER 85 HB2 SER 85 45.085 -34.459 -8.184 604 HB3 SER 85 HB1 SER 85 43.836 -34.353 -6.942 605 HG SER 85 HG SER 85 43.025 -36.195 -7.583 606 H GLU 86 HN GLU 86 41.898 -33.645 -10.949 607 HA GLU 86 HA GLU 86 44.261 -33.632 -12.744 608 HB2 GLU 86 HB2 GLU 86 43.127 -35.859 -12.587 609 HB3 GLU 86 HB1 GLU 86 41.626 -35.107 -13.104 610 HG2 GLU 86 HG2 GLU 86 42.419 -34.752 -15.273 611 HG3 GLU 86 HG1 GLU 86 44.098 -35.030 -14.801 612 H GLY 87 HN GLY 87 41.806 -31.827 -11.642 613 HA2 GLY 87 HA2 GLY 87 41.011 -29.808 -12.475 614 HA3 GLY 87 HA1 GLY 87 41.696 -30.221 -14.042 615 H VAL 88 HN VAL 88 39.847 -32.750 -12.803 616 HA VAL 88 HA VAL 88 37.769 -32.298 -14.758 617 HB VAL 88 HB VAL 88 38.173 -34.531 -12.756 618 HG11 VAL 88 HG11 VAL 88 36.179 -34.341 -15.016 619 HG12 VAL 88 HG12 VAL 88 35.801 -34.277 -13.295 620 HG13 VAL 88 HG13 VAL 88 36.459 -35.754 -13.997 621 HG21 VAL 88 HG21 VAL 88 38.805 -35.828 -14.758 622 HG22 VAL 88 HG22 VAL 88 39.884 -34.467 -14.457 623 HG23 VAL 88 HG23 VAL 88 38.666 -34.360 -15.727 624 H ARG 89 HN ARG 89 35.637 -31.888 -14.331 625 HA ARG 89 HA ARG 89 35.140 -30.474 -11.823 626 HB2 ARG 89 HB2 ARG 89 34.758 -29.562 -14.203 627 HB3 ARG 89 HB1 ARG 89 33.355 -30.611 -14.237 628 HG2 ARG 89 HG2 ARG 89 32.554 -29.441 -12.167 629 HG3 ARG 89 HG1 ARG 89 33.858 -28.275 -12.427 630 HD2 ARG 89 HD2 ARG 89 32.832 -28.264 -14.875 631 HD3 ARG 89 HD1 ARG 89 31.382 -28.745 -13.997 632 HE ARG 89 HE ARG 89 32.549 -26.519 -12.742 633 HH11 ARG 89 HH11 ARG 89 30.783 -27.439 -15.623 634 HH12 ARG 89 HH12 ARG 89 30.146 -25.837 -15.880 635 HH21 ARG 89 HH21 ARG 89 31.721 -24.413 -13.085 636 HH22 ARG 89 HH22 ARG 89 30.708 -24.108 -14.473 637 H TYR 90 HN TYR 90 33.794 -31.275 -10.277 638 HA TYR 90 HA TYR 90 31.666 -33.087 -11.112 639 HB2 TYR 90 HB2 TYR 90 32.134 -34.750 -9.441 640 HB3 TYR 90 HB1 TYR 90 33.604 -34.487 -10.357 641 HD1 TYR 90 HD1 TYR 90 35.462 -33.145 -9.317 642 HD2 TYR 90 HD2 TYR 90 32.082 -34.450 -7.086 643 HE1 TYR 90 HE1 TYR 90 36.685 -32.722 -7.228 644 HE2 TYR 90 HE2 TYR 90 33.300 -34.036 -4.989 645 HH TYR 90 HH TYR 90 36.186 -32.260 -4.870 646 H PHE 91 HN PHE 91 29.946 -33.285 -9.339 647 HA PHE 91 HA PHE 91 29.901 -30.766 -7.821 648 HB2 PHE 91 HB2 PHE 91 27.715 -32.127 -9.359 649 HB3 PHE 91 HB1 PHE 91 27.327 -31.075 -8.011 650 HD1 PHE 91 HD1 PHE 91 26.904 -28.825 -8.493 651 HD2 PHE 91 HD2 PHE 91 29.428 -31.081 -11.076 652 HE1 PHE 91 HE1 PHE 91 27.088 -26.897 -9.999 653 HE2 PHE 91 HE2 PHE 91 29.603 -29.150 -12.589 654 HZ PHE 91 HZ PHE 91 28.346 -26.993 -11.970 655 H VAL 92 HN VAL 92 28.710 -30.758 -5.839 656 HA VAL 92 HA VAL 92 28.531 -33.423 -4.590 657 HB VAL 92 HB VAL 92 29.606 -30.917 -3.274 658 HG11 VAL 92 HG11 VAL 92 28.459 -32.331 -1.679 659 HG12 VAL 92 HG12 VAL 92 30.200 -32.422 -1.411 660 HG13 VAL 92 HG13 VAL 92 29.361 -33.739 -2.231 661 HG21 VAL 92 HG21 VAL 92 31.173 -31.823 -4.918 662 HG22 VAL 92 HG22 VAL 92 31.085 -33.403 -4.137 663 HG23 VAL 92 HG23 VAL 92 31.774 -32.026 -3.275 664 H ASP 93 HN ASP 93 26.559 -33.816 -3.772 665 HA ASP 93 HA ASP 93 24.688 -31.588 -3.338 666 HB2 ASP 93 HB2 ASP 93 24.418 -34.559 -3.592 667 HB3 ASP 93 HB1 ASP 93 23.336 -33.788 -2.438 668 H HIS 94 HN HIS 94 25.305 -30.515 -1.447 669 HA HIS 94 HA HIS 94 26.430 -31.858 0.807 670 HB2 HIS 94 HB2 HIS 94 26.918 -29.483 0.078 671 HB3 HIS 94 HB1 HIS 94 25.324 -29.033 0.667 672 HD1 HIS 94 HD1 HIS 94 28.749 -29.167 1.669 673 HD2 HIS 94 HD2 HIS 94 25.072 -29.626 3.550 674 HE1 HIS 94 HE1 HIS 94 29.195 -28.811 4.130 675 HE2 HIS 94 HE2 HIS 94 26.914 -28.847 5.209 676 H ASN 95 HN ASN 95 23.266 -31.386 -0.283 677 HA ASN 95 HA ASN 95 21.986 -31.141 2.284 678 HB2 ASN 95 HB2 ASN 95 19.868 -31.407 0.989 679 HB3 ASN 95 HB1 ASN 95 20.904 -30.146 0.329 680 HD21 ASN 95 HD21 ASN 95 21.953 -30.498 -1.631 681 HD22 ASN 95 HD22 ASN 95 21.459 -31.741 -2.739 682 H THR 96 HN THR 96 22.535 -33.765 -0.048 683 HA THR 96 HA THR 96 21.451 -35.654 1.902 684 HB THR 96 HB THR 96 21.739 -37.295 -0.056 685 HG1 THR 96 HG1 THR 96 22.796 -36.417 -1.672 686 HG21 THR 96 HG21 THR 96 19.817 -34.985 -0.367 687 HG22 THR 96 HG22 THR 96 19.568 -36.392 0.666 688 HG23 THR 96 HG23 THR 96 19.647 -36.587 -1.084 689 H ARG 97 HN ARG 97 24.355 -34.387 0.858 690 HA ARG 97 HA ARG 97 26.547 -34.856 1.238 691 HB2 ARG 97 HB2 ARG 97 25.367 -36.792 3.220 692 HB3 ARG 97 HB1 ARG 97 27.090 -36.451 3.080 693 HG2 ARG 97 HG2 ARG 97 26.441 -34.015 3.340 694 HG3 ARG 97 HG1 ARG 97 24.883 -34.615 3.908 695 HD2 ARG 97 HD2 ARG 97 25.941 -35.808 5.702 696 HD3 ARG 97 HD1 ARG 97 27.541 -35.395 5.092 697 HE ARG 97 HE ARG 97 25.670 -33.297 5.986 698 HH11 ARG 97 HH11 ARG 97 28.786 -34.908 6.123 699 HH12 ARG 97 HH12 ARG 97 29.493 -33.731 7.198 700 HH21 ARG 97 HH21 ARG 97 26.571 -31.756 7.409 701 HH22 ARG 97 HH22 ARG 97 28.209 -31.941 7.958 702 H THR 98 HN THR 98 25.872 -35.674 -0.966 703 HA THR 98 HA THR 98 27.111 -38.312 -1.342 704 HB THR 98 HB THR 98 25.365 -38.712 -3.208 705 HG1 THR 98 HG1 THR 98 24.262 -36.839 -3.358 706 HG21 THR 98 HG21 THR 98 23.721 -39.686 -1.629 707 HG22 THR 98 HG22 THR 98 24.453 -38.768 -0.313 708 HG23 THR 98 HG23 THR 98 25.378 -40.032 -1.123 709 H THR 99 HN THR 99 27.974 -38.587 -3.573 710 HA THR 99 HA THR 99 28.682 -35.975 -4.742 711 HB THR 99 HB THR 99 30.285 -37.546 -6.128 712 HG1 THR 99 HG1 THR 99 29.815 -39.213 -3.856 713 HG21 THR 99 HG21 THR 99 31.963 -37.543 -4.251 714 HG22 THR 99 HG22 THR 99 30.674 -37.085 -3.140 715 HG23 THR 99 HG23 THR 99 31.157 -35.979 -4.428 716 H THR 100 HN THR 100 28.353 -35.550 -6.988 717 HA THR 100 HA THR 100 26.964 -37.562 -8.555 718 HB THR 100 HB THR 100 25.134 -36.322 -7.462 719 HG1 THR 100 HG1 THR 100 24.023 -36.317 -9.283 720 HG21 THR 100 HG21 THR 100 26.234 -34.167 -7.112 721 HG22 THR 100 HG22 THR 100 24.727 -33.961 -8.009 722 HG23 THR 100 HG23 THR 100 26.272 -33.898 -8.855 723 H PHE 101 HN PHE 101 26.963 -37.027 -10.861 724 HA PHE 101 HA PHE 101 29.109 -35.101 -11.487 725 HB2 PHE 101 HB2 PHE 101 29.509 -37.768 -11.579 726 HB3 PHE 101 HB1 PHE 101 28.816 -37.503 -13.234 727 HD1 PHE 101 HD1 PHE 101 29.895 -35.273 -14.348 728 HD2 PHE 101 HD2 PHE 101 31.774 -37.794 -11.481 729 HE1 PHE 101 HE1 PHE 101 32.096 -34.524 -15.128 730 HE2 PHE 101 HE2 PHE 101 33.984 -37.046 -12.263 731 HZ PHE 101 HZ PHE 101 34.142 -35.412 -14.097 732 H LYS 102 HN LYS 102 27.851 -33.477 -12.298 733 HA LYS 102 HA LYS 102 26.458 -34.069 -14.785 734 HB2 LYS 102 HB2 LYS 102 24.574 -32.573 -14.061 735 HB3 LYS 102 HB1 LYS 102 24.651 -34.121 -13.240 736 HG2 LYS 102 HG2 LYS 102 25.626 -33.083 -11.288 737 HG3 LYS 102 HG1 LYS 102 25.681 -31.525 -12.117 738 HD2 LYS 102 HD2 LYS 102 23.232 -33.083 -11.301 739 HD3 LYS 102 HD1 LYS 102 23.774 -31.527 -10.668 740 HE2 LYS 102 HE2 LYS 102 23.461 -30.534 -12.893 741 HE3 LYS 102 HE1 LYS 102 22.866 -32.087 -13.482 742 HZ1 LYS 102 HZ1 LYS 102 21.091 -31.919 -11.774 743 HZ2 LYS 102 HZ2 LYS 102 21.012 -30.723 -12.972 744 HZ3 LYS 102 HZ3 LYS 102 21.617 -30.342 -11.437 745 H ASP 103 HN ASP 103 27.453 -32.831 -16.258 746 HA ASP 103 HA ASP 103 27.984 -30.027 -15.525 747 HB2 ASP 103 HB2 ASP 103 30.099 -31.318 -15.881 748 HB3 ASP 103 HB1 ASP 103 29.576 -31.644 -17.531 749 HA PRO 104 HA PRO 104 25.110 -29.370 -18.818 750 HB2 PRO 104 HB2 PRO 104 24.903 -26.710 -18.635 751 HB3 PRO 104 HB1 PRO 104 24.357 -27.748 -17.313 752 HG2 PRO 104 HG2 PRO 104 26.894 -26.189 -17.568 753 HG3 PRO 104 HG1 PRO 104 25.838 -26.386 -16.158 754 HD2 PRO 104 HD2 PRO 104 28.158 -27.826 -16.596 755 HD3 PRO 104 HD1 PRO 104 26.818 -28.360 -15.557 756 H ARG 105 HN ARG 105 28.232 -29.169 -19.375 757 HA ARG 105 HA ARG 105 28.024 -27.355 -21.673 758 HB2 ARG 105 HB2 ARG 105 30.347 -28.399 -20.110 759 HB3 ARG 105 HB1 ARG 105 30.600 -27.928 -21.783 760 HG2 ARG 105 HG2 ARG 105 31.148 -26.139 -20.174 761 HG3 ARG 105 HG1 ARG 105 29.881 -25.677 -21.315 762 HD2 ARG 105 HD2 ARG 105 28.185 -26.165 -19.604 763 HD3 ARG 105 HD1 ARG 105 29.464 -26.598 -18.470 764 HE ARG 105 HE ARG 105 30.233 -24.192 -18.832 765 HH11 ARG 105 HH11 ARG 105 26.883 -25.171 -19.108 766 HH12 ARG 105 HH12 ARG 105 26.251 -23.649 -18.572 767 HH21 ARG 105 HH21 ARG 105 29.397 -22.162 -18.124 768 HH22 ARG 105 HH22 ARG 105 27.671 -21.953 -17.962 769 HA PRO 106 HA PRO 106 27.568 -30.737 -24.468 770 HB2 PRO 106 HB2 PRO 106 28.560 -29.636 -26.768 771 HB3 PRO 106 HB1 PRO 106 26.963 -29.172 -26.069 772 HG2 PRO 106 HG2 PRO 106 29.629 -27.794 -25.844 773 HG3 PRO 106 HG1 PRO 106 28.029 -27.101 -26.159 774 HD2 PRO 106 HD2 PRO 106 29.179 -27.029 -23.724 775 HD3 PRO 106 HD1 PRO 106 27.403 -27.177 -23.946 776 H GLY 107 HN GLY 107 28.703 -32.527 -24.971 777 HA2 GLY 107 HA2 GLY 107 30.562 -33.651 -25.922 778 HA3 GLY 107 HA1 GLY 107 31.580 -32.242 -25.554 779 H PHE 108 HN PHE 108 30.505 -32.199 -22.691 780 HA PHE 108 HA PHE 108 32.312 -34.333 -21.803 781 HB2 PHE 108 HB2 PHE 108 33.041 -32.028 -21.242 782 HB3 PHE 108 HB1 PHE 108 31.529 -31.805 -20.294 783 HD1 PHE 108 HD1 PHE 108 34.825 -33.419 -20.437 784 HD2 PHE 108 HD2 PHE 108 31.256 -32.919 -18.181 785 HE1 PHE 108 HE1 PHE 108 35.939 -34.375 -18.462 786 HE2 PHE 108 HE2 PHE 108 32.365 -33.873 -16.204 787 HZ PHE 108 HZ PHE 108 34.782 -34.575 -16.372 788 H GLU 109 HN GLU 109 30.577 -35.879 -21.968 789 HA GLU 109 HA GLU 109 29.080 -36.062 -19.492 790 HB2 GLU 109 HB2 GLU 109 27.554 -34.868 -21.070 791 HB3 GLU 109 HB1 GLU 109 27.689 -36.215 -22.187 792 HG2 GLU 109 HG2 GLU 109 25.620 -36.402 -21.018 793 HG3 GLU 109 HG1 GLU 109 26.689 -37.688 -20.462 Start of MODEL 6 1 H1 GLY 1 HT1 GLY 1 -38.885 10.548 -4.873 2 H2 GLY 1 HT2 GLY 1 -37.449 10.755 -4.007 3 H3 GLY 1 HT3 GLY 1 -38.507 12.061 -4.197 4 HA2 GLY 1 HA1 GLY 1 -38.735 11.205 -1.985 5 HA3 GLY 1 HA2 GLY 1 -40.192 10.843 -2.906 6 H SER 2 HN SER 2 -40.251 9.251 -1.017 7 HA SER 2 HA SER 2 -40.198 7.118 -0.258 8 HB2 SER 2 HB2 SER 2 -39.422 6.503 -3.124 9 HB3 SER 2 HB1 SER 2 -39.987 5.320 -1.946 10 HG SER 2 HG SER 2 -41.847 7.037 -1.835 11 H HIS 3 HN HIS 3 -38.481 4.942 -1.019 12 HA HIS 3 HA HIS 3 -36.056 5.799 0.358 13 HB2 HIS 3 HB2 HIS 3 -36.997 3.057 -0.545 14 HB3 HIS 3 HB1 HIS 3 -35.497 3.350 0.325 15 HD1 HIS 3 HD1 HIS 3 -35.812 2.525 2.638 16 HD2 HIS 3 HD2 HIS 3 -39.213 4.475 1.222 17 HE1 HIS 3 HE1 HIS 3 -37.444 2.533 4.549 18 HE2 HIS 3 HE2 HIS 3 -39.568 3.483 3.591 19 H MET 4 HN MET 4 -33.904 5.420 -0.583 20 HA MET 4 HA MET 4 -33.984 5.403 -3.530 21 HB2 MET 4 HB2 MET 4 -31.951 6.766 -1.744 22 HB3 MET 4 HB1 MET 4 -31.930 6.764 -3.493 23 HG2 MET 4 HG2 MET 4 -34.077 7.972 -3.502 24 HG3 MET 4 HG1 MET 4 -34.015 8.026 -1.742 25 HE1 MET 4 HE1 MET 4 -30.982 8.377 -4.223 26 HE2 MET 4 HE2 MET 4 -30.936 10.121 -4.474 27 HE3 MET 4 HE3 MET 4 -32.299 9.173 -5.074 28 H GLN 5 HN GLN 5 -32.681 3.982 -4.608 29 HA GLN 5 HA GLN 5 -31.497 1.875 -3.073 30 HB2 GLN 5 HB2 GLN 5 -32.677 1.418 -5.174 31 HB3 GLN 5 HB1 GLN 5 -31.473 2.346 -6.054 32 HG2 GLN 5 HG2 GLN 5 -29.750 0.739 -5.209 33 HG3 GLN 5 HG1 GLN 5 -31.075 -0.243 -4.592 34 HE21 GLN 5 HE21 GLN 5 -32.424 -1.322 -6.029 35 HE22 GLN 5 HE22 GLN 5 -31.983 -1.554 -7.707 36 H TYR 6 HN TYR 6 -29.445 1.713 -2.429 37 HA TYR 6 HA TYR 6 -27.424 3.349 -3.835 38 HB2 TYR 6 HB2 TYR 6 -27.682 2.741 -0.858 39 HB3 TYR 6 HB1 TYR 6 -26.152 3.266 -1.551 40 HD1 TYR 6 HD1 TYR 6 -25.801 5.559 -2.128 41 HD2 TYR 6 HD2 TYR 6 -29.660 4.270 -0.880 42 HE1 TYR 6 HE1 TYR 6 -26.496 7.901 -1.872 43 HE2 TYR 6 HE2 TYR 6 -30.361 6.611 -0.626 44 HH TYR 6 HH TYR 6 -28.473 9.246 -1.782 45 H LYS 7 HN LYS 7 -25.394 2.323 -4.127 46 HA LYS 7 HA LYS 7 -25.471 -0.572 -3.737 47 HB2 LYS 7 HB2 LYS 7 -24.240 -0.746 -5.979 48 HB3 LYS 7 HB1 LYS 7 -25.970 -0.357 -6.049 49 HG2 LYS 7 HG2 LYS 7 -23.835 1.757 -6.166 50 HG3 LYS 7 HG1 LYS 7 -24.420 0.908 -7.598 51 HD2 LYS 7 HD2 LYS 7 -26.216 2.383 -5.682 52 HD3 LYS 7 HD1 LYS 7 -25.512 3.123 -7.116 53 HE2 LYS 7 HE2 LYS 7 -27.214 0.642 -7.197 54 HE3 LYS 7 HE1 LYS 7 -27.866 2.274 -7.356 55 HZ1 LYS 7 HZ1 LYS 7 -27.536 1.469 -9.527 56 HZ2 LYS 7 HZ2 LYS 7 -25.983 0.884 -9.180 57 HZ3 LYS 7 HZ3 LYS 7 -26.265 2.552 -9.252 58 H LEU 8 HN LEU 8 -23.473 -1.654 -3.605 59 HA LEU 8 HA LEU 8 -21.204 0.113 -2.937 60 HB2 LEU 8 HB2 LEU 8 -22.395 -0.796 -0.873 61 HB3 LEU 8 HB1 LEU 8 -21.893 -2.385 -1.399 62 HG LEU 8 HG LEU 8 -19.505 -1.563 -1.263 63 HD11 LEU 8 HD11 LEU 8 -19.228 0.338 0.409 64 HD12 LEU 8 HD12 LEU 8 -20.894 0.775 0.021 65 HD13 LEU 8 HD13 LEU 8 -19.660 0.783 -1.237 66 HD21 LEU 8 HD21 LEU 8 -21.319 -1.806 1.101 67 HD22 LEU 8 HD22 LEU 8 -19.563 -1.690 1.273 68 HD23 LEU 8 HD23 LEU 8 -20.279 -3.035 0.380 69 H ILE 9 HN ILE 9 -19.199 -0.652 -3.454 70 HA ILE 9 HA ILE 9 -19.062 -3.282 -4.760 71 HB ILE 9 HB ILE 9 -17.739 -0.710 -5.673 72 HG12 ILE 9 HG12 ILE 9 -19.688 -2.594 -7.085 73 HG13 ILE 9 HG11 ILE 9 -20.131 -0.989 -6.391 74 HG21 ILE 9 HG21 ILE 9 -17.363 -3.509 -6.747 75 HG22 ILE 9 HG22 ILE 9 -16.177 -2.583 -5.827 76 HG23 ILE 9 HG23 ILE 9 -16.675 -2.032 -7.426 77 HD11 ILE 9 HD11 ILE 9 -18.223 -1.521 -8.691 78 HD12 ILE 9 HD12 ILE 9 -18.565 0.062 -7.992 79 HD13 ILE 9 HD13 ILE 9 -19.850 -0.842 -8.796 80 H LEU 10 HN LEU 10 -17.676 -4.583 -3.705 81 HA LEU 10 HA LEU 10 -15.736 -3.331 -1.907 82 HB2 LEU 10 HB2 LEU 10 -16.339 -6.279 -2.160 83 HB3 LEU 10 HB1 LEU 10 -15.320 -5.525 -0.965 84 HG LEU 10 HG LEU 10 -17.169 -5.953 0.271 85 HD11 LEU 10 HD11 LEU 10 -17.929 -3.285 -0.836 86 HD12 LEU 10 HD12 LEU 10 -16.704 -3.581 0.410 87 HD13 LEU 10 HD13 LEU 10 -18.396 -3.973 0.722 88 HD21 LEU 10 HD21 LEU 10 -18.463 -6.816 -1.695 89 HD22 LEU 10 HD22 LEU 10 -19.060 -5.170 -1.922 90 HD23 LEU 10 HD23 LEU 10 -19.412 -6.038 -0.432 91 H ASN 11 HN ASN 11 -13.879 -2.830 -2.808 92 HA ASN 11 HA ASN 11 -12.814 -4.661 -4.856 93 HB2 ASN 11 HB2 ASN 11 -13.209 -2.098 -5.282 94 HB3 ASN 11 HB1 ASN 11 -11.745 -1.896 -4.326 95 HD21 ASN 11 HD21 ASN 11 -12.099 -1.182 -7.036 96 HD22 ASN 11 HD22 ASN 11 -11.005 -2.123 -7.990 97 H GLY 12 HN GLY 12 -12.022 -6.113 -3.321 98 HA2 GLY 12 HA2 GLY 12 -9.556 -5.146 -1.998 99 HA3 GLY 12 HA1 GLY 12 -10.689 -6.213 -1.127 100 H LYS 13 HN LYS 13 -8.828 -7.601 -0.939 101 HA LYS 13 HA LYS 13 -8.002 -8.948 -3.368 102 HB2 LYS 13 HB2 LYS 13 -7.001 -9.296 -0.533 103 HB3 LYS 13 HB1 LYS 13 -6.338 -10.113 -1.942 104 HG2 LYS 13 HG2 LYS 13 -5.780 -7.930 -2.915 105 HG3 LYS 13 HG1 LYS 13 -6.395 -7.141 -1.460 106 HD2 LYS 13 HD2 LYS 13 -4.008 -7.300 -1.293 107 HD3 LYS 13 HD1 LYS 13 -4.722 -8.427 -0.140 108 HE2 LYS 13 HE2 LYS 13 -4.391 -10.250 -1.774 109 HE3 LYS 13 HE1 LYS 13 -3.591 -9.109 -2.849 110 HZ1 LYS 13 HZ1 LYS 13 -1.971 -8.712 -1.035 111 HZ2 LYS 13 HZ2 LYS 13 -1.933 -10.291 -1.662 112 HZ3 LYS 13 HZ3 LYS 13 -2.686 -9.987 -0.170 113 H THR 14 HN THR 14 -9.250 -10.187 -0.182 114 HA THR 14 HA THR 14 -10.011 -12.651 -1.562 115 HB THR 14 HB THR 14 -10.373 -12.098 1.385 116 HG1 THR 14 HG1 THR 14 -8.087 -13.357 1.069 117 HG21 THR 14 HG21 THR 14 -10.045 -14.513 1.571 118 HG22 THR 14 HG22 THR 14 -9.736 -14.629 -0.159 119 HG23 THR 14 HG23 THR 14 -11.335 -14.165 0.419 120 H LEU 15 HN LEU 15 -11.327 -9.739 -1.192 121 HA LEU 15 HA LEU 15 -14.056 -10.762 -1.080 122 HB2 LEU 15 HB2 LEU 15 -12.947 -9.395 1.038 123 HB3 LEU 15 HB1 LEU 15 -13.720 -8.114 0.139 124 HG LEU 15 HG LEU 15 -15.247 -8.822 1.795 125 HD11 LEU 15 HD11 LEU 15 -16.267 -8.372 -0.332 126 HD12 LEU 15 HD12 LEU 15 -17.126 -9.690 0.465 127 HD13 LEU 15 HD13 LEU 15 -16.004 -10.034 -0.850 128 HD21 LEU 15 HD21 LEU 15 -14.976 -11.669 0.831 129 HD22 LEU 15 HD22 LEU 15 -15.911 -11.085 2.205 130 HD23 LEU 15 HD23 LEU 15 -14.150 -11.013 2.239 131 H LYS 16 HN LYS 16 -14.392 -10.499 -3.184 132 HA LYS 16 HA LYS 16 -14.376 -7.741 -4.209 133 HB2 LYS 16 HB2 LYS 16 -13.609 -10.269 -5.683 134 HB3 LYS 16 HB1 LYS 16 -13.786 -8.695 -6.434 135 HG2 LYS 16 HG2 LYS 16 -11.816 -7.950 -5.637 136 HG3 LYS 16 HG1 LYS 16 -11.832 -8.954 -4.179 137 HD2 LYS 16 HD2 LYS 16 -11.308 -10.878 -5.547 138 HD3 LYS 16 HD1 LYS 16 -11.478 -9.883 -6.991 139 HE2 LYS 16 HE2 LYS 16 -9.395 -9.454 -4.871 140 HE3 LYS 16 HE1 LYS 16 -9.120 -10.301 -6.394 141 HZ1 LYS 16 HZ1 LYS 16 -9.918 -8.208 -7.509 142 HZ2 LYS 16 HZ2 LYS 16 -8.412 -8.103 -6.745 143 HZ3 LYS 16 HZ3 LYS 16 -9.779 -7.446 -6.000 144 H GLY 17 HN GLY 17 -16.412 -7.166 -4.700 145 HA2 GLY 17 HA2 GLY 17 -18.195 -8.634 -6.197 146 HA3 GLY 17 HA1 GLY 17 -18.559 -9.021 -4.521 147 H GLU 18 HN GLU 18 -20.643 -8.022 -5.318 148 HA GLU 18 HA GLU 18 -20.603 -5.177 -4.601 149 HB2 GLU 18 HB2 GLU 18 -22.103 -6.357 -6.953 150 HB3 GLU 18 HB1 GLU 18 -22.278 -4.710 -6.369 151 HG2 GLU 18 HG2 GLU 18 -20.078 -4.148 -7.027 152 HG3 GLU 18 HG1 GLU 18 -19.668 -5.837 -7.335 153 H THR 19 HN THR 19 -22.860 -4.391 -4.126 154 HA THR 19 HA THR 19 -24.903 -6.269 -3.504 155 HB THR 19 HB THR 19 -23.360 -6.783 -1.635 156 HG1 THR 19 HG1 THR 19 -25.273 -7.132 -0.788 157 HG21 THR 19 HG21 THR 19 -23.787 -3.878 -0.874 158 HG22 THR 19 HG22 THR 19 -22.270 -4.577 -1.438 159 HG23 THR 19 HG23 THR 19 -22.953 -5.075 0.116 160 H THR 20 HN THR 20 -26.796 -5.159 -2.515 161 HA THR 20 HA THR 20 -26.668 -2.247 -2.839 162 HB THR 20 HB THR 20 -28.926 -2.309 -3.920 163 HG1 THR 20 HG1 THR 20 -28.607 -4.964 -3.437 164 HG21 THR 20 HG21 THR 20 -26.630 -3.636 -5.373 165 HG22 THR 20 HG22 THR 20 -27.031 -1.919 -5.356 166 HG23 THR 20 HG23 THR 20 -28.095 -3.063 -6.171 167 H THR 21 HN THR 21 -28.385 -1.069 -1.806 168 HA THR 21 HA THR 21 -30.215 -2.432 -0.062 169 HB THR 21 HB THR 21 -27.990 -2.385 1.254 170 HG1 THR 21 HG1 THR 21 -29.509 -2.693 2.702 171 HG21 THR 21 HG21 THR 21 -27.312 -0.069 0.673 172 HG22 THR 21 HG22 THR 21 -27.515 -0.231 2.418 173 HG23 THR 21 HG23 THR 21 -28.765 0.559 1.455 174 H GLU 22 HN GLU 22 -31.675 -0.883 0.977 175 HA GLU 22 HA GLU 22 -31.852 1.566 -0.633 176 HB2 GLU 22 HB2 GLU 22 -34.247 1.625 0.271 177 HB3 GLU 22 HB1 GLU 22 -33.911 0.276 -0.809 178 HG2 GLU 22 HG2 GLU 22 -35.210 -0.606 0.925 179 HG3 GLU 22 HG1 GLU 22 -33.519 -1.122 1.283 180 H ALA 23 HN ALA 23 -32.058 3.576 0.273 181 HA ALA 23 HA ALA 23 -32.151 3.925 3.170 182 HB1 ALA 23 HB1 ALA 23 -29.765 3.519 2.855 183 HB2 ALA 23 HB2 ALA 23 -30.031 5.225 3.227 184 HB3 ALA 23 HB3 ALA 23 -29.703 4.725 1.570 185 H VAL 24 HN VAL 24 -32.501 6.247 3.698 186 HA VAL 24 HA VAL 24 -33.665 7.646 1.421 187 HB VAL 24 HB VAL 24 -34.583 9.213 3.125 188 HG11 VAL 24 HG11 VAL 24 -36.222 7.618 4.016 189 HG12 VAL 24 HG12 VAL 24 -35.165 6.284 3.551 190 HG13 VAL 24 HG13 VAL 24 -35.881 7.316 2.313 191 HG21 VAL 24 HG21 VAL 24 -33.358 7.260 5.064 192 HG22 VAL 24 HG22 VAL 24 -34.493 8.538 5.487 193 HG23 VAL 24 HG23 VAL 24 -32.898 8.949 4.855 194 H ASP 25 HN ASP 25 -30.702 7.681 2.997 195 HA ASP 25 HA ASP 25 -30.062 10.264 1.831 196 HB2 ASP 25 HB2 ASP 25 -29.615 9.628 4.756 197 HB3 ASP 25 HB1 ASP 25 -28.746 10.898 3.907 198 H ALA 26 HN ALA 26 -27.755 10.587 1.560 199 HA ALA 26 HA ALA 26 -26.460 8.158 0.795 200 HB1 ALA 26 HB1 ALA 26 -26.162 10.242 -0.464 201 HB2 ALA 26 HB2 ALA 26 -24.615 9.606 0.093 202 HB3 ALA 26 HB3 ALA 26 -25.362 10.967 0.929 203 H ALA 27 HN ALA 27 -26.102 10.434 3.456 204 HA ALA 27 HA ALA 27 -23.702 9.359 4.509 205 HB1 ALA 27 HB1 ALA 27 -24.324 10.589 6.576 206 HB2 ALA 27 HB2 ALA 27 -25.885 10.960 5.843 207 HB3 ALA 27 HB3 ALA 27 -24.398 11.582 5.121 208 H THR 28 HN THR 28 -27.052 8.488 4.849 209 HA THR 28 HA THR 28 -26.717 6.824 7.149 210 HB THR 28 HB THR 28 -28.961 6.586 5.146 211 HG1 THR 28 HG1 THR 28 -29.479 8.308 7.172 212 HG21 THR 28 HG21 THR 28 -28.945 4.958 6.989 213 HG22 THR 28 HG22 THR 28 -30.279 6.096 7.184 214 HG23 THR 28 HG23 THR 28 -28.822 6.272 8.162 215 H ALA 29 HN ALA 29 -26.313 6.388 3.731 216 HA ALA 29 HA ALA 29 -26.603 3.529 3.703 217 HB1 ALA 29 HB1 ALA 29 -25.253 5.370 1.723 218 HB2 ALA 29 HB2 ALA 29 -26.937 4.849 1.669 219 HB3 ALA 29 HB3 ALA 29 -25.644 3.671 1.455 220 H GLU 30 HN GLU 30 -24.056 5.860 4.116 221 HA GLU 30 HA GLU 30 -21.782 4.287 3.978 222 HB2 GLU 30 HB2 GLU 30 -22.024 6.842 4.344 223 HB3 GLU 30 HB1 GLU 30 -22.216 6.439 6.042 224 HG2 GLU 30 HG2 GLU 30 -20.015 5.165 5.809 225 HG3 GLU 30 HG1 GLU 30 -19.819 6.078 4.315 226 H LYS 31 HN LYS 31 -23.402 5.308 6.932 227 HA LYS 31 HA LYS 31 -22.093 3.860 8.789 228 HB2 LYS 31 HB2 LYS 31 -25.060 4.379 8.919 229 HB3 LYS 31 HB1 LYS 31 -23.947 4.202 10.272 230 HG2 LYS 31 HG2 LYS 31 -24.126 6.467 8.306 231 HG3 LYS 31 HG1 LYS 31 -24.407 6.504 10.046 232 HD2 LYS 31 HD2 LYS 31 -22.072 6.080 10.475 233 HD3 LYS 31 HD1 LYS 31 -21.756 5.893 8.749 234 HE2 LYS 31 HE2 LYS 31 -22.509 8.240 8.424 235 HE3 LYS 31 HE1 LYS 31 -22.628 8.400 10.175 236 HZ1 LYS 31 HZ1 LYS 31 -20.547 9.261 9.519 237 HZ2 LYS 31 HZ2 LYS 31 -20.184 7.899 8.569 238 HZ3 LYS 31 HZ3 LYS 31 -20.231 7.768 10.263 239 H VAL 32 HN VAL 32 -24.848 2.667 6.883 240 HA VAL 32 HA VAL 32 -25.085 0.229 8.380 241 HB VAL 32 HB VAL 32 -26.145 0.876 5.621 242 HG11 VAL 32 HG11 VAL 32 -26.092 -1.516 6.025 243 HG12 VAL 32 HG12 VAL 32 -27.755 -0.928 6.048 244 HG13 VAL 32 HG13 VAL 32 -26.929 -1.299 7.562 245 HG21 VAL 32 HG21 VAL 32 -26.976 2.450 7.277 246 HG22 VAL 32 HG22 VAL 32 -27.477 1.119 8.320 247 HG23 VAL 32 HG23 VAL 32 -28.263 1.364 6.761 248 H PHE 33 HN PHE 33 -23.723 1.095 5.213 249 HA PHE 33 HA PHE 33 -22.863 -1.557 4.616 250 HB2 PHE 33 HB2 PHE 33 -22.379 1.129 3.399 251 HB3 PHE 33 HB1 PHE 33 -21.290 -0.179 2.986 252 HD1 PHE 33 HD1 PHE 33 -23.234 -2.443 2.963 253 HD2 PHE 33 HD2 PHE 33 -23.506 1.500 1.386 254 HE1 PHE 33 HE1 PHE 33 -24.796 -3.244 1.244 255 HE2 PHE 33 HE2 PHE 33 -25.076 0.706 -0.339 256 HZ PHE 33 HZ PHE 33 -25.721 -1.671 -0.419 257 H LYS 34 HN LYS 34 -21.517 0.980 6.556 258 HA LYS 34 HA LYS 34 -18.817 0.195 6.438 259 HB2 LYS 34 HB2 LYS 34 -20.338 1.538 8.693 260 HB3 LYS 34 HB1 LYS 34 -18.601 1.437 8.623 261 HG2 LYS 34 HG2 LYS 34 -19.174 2.550 6.238 262 HG3 LYS 34 HG1 LYS 34 -20.366 3.277 7.339 263 HD2 LYS 34 HD2 LYS 34 -18.394 4.572 7.451 264 HD3 LYS 34 HD1 LYS 34 -18.500 3.683 8.945 265 HE2 LYS 34 HE2 LYS 34 -16.899 2.054 8.089 266 HE3 LYS 34 HE1 LYS 34 -16.819 2.919 6.554 267 HZ1 LYS 34 HZ1 LYS 34 -14.958 3.356 8.167 268 HZ2 LYS 34 HZ2 LYS 34 -16.081 4.188 9.133 269 HZ3 LYS 34 HZ3 LYS 34 -15.742 4.734 7.565 270 H GLN 35 HN GLN 35 -21.508 -0.793 8.439 271 HA GLN 35 HA GLN 35 -20.009 -2.569 10.067 272 HB2 GLN 35 HB2 GLN 35 -22.155 -1.527 10.800 273 HB3 GLN 35 HB1 GLN 35 -23.008 -2.384 9.541 274 HG2 GLN 35 HG2 GLN 35 -21.607 -3.825 11.801 275 HG3 GLN 35 HG1 GLN 35 -23.264 -3.256 11.884 276 HE21 GLN 35 HE21 GLN 35 -22.039 -5.963 11.914 277 HE22 GLN 35 HE22 GLN 35 -22.901 -6.844 10.698 278 H TYR 36 HN TYR 36 -21.769 -2.751 7.057 279 HA TYR 36 HA TYR 36 -21.812 -5.558 6.740 280 HB2 TYR 36 HB2 TYR 36 -23.236 -4.255 5.320 281 HB3 TYR 36 HB1 TYR 36 -21.887 -3.276 4.761 282 HD1 TYR 36 HD1 TYR 36 -23.401 -6.657 4.530 283 HD2 TYR 36 HD2 TYR 36 -20.581 -3.918 2.939 284 HE1 TYR 36 HE1 TYR 36 -23.079 -8.124 2.583 285 HE2 TYR 36 HE2 TYR 36 -20.250 -5.364 0.985 286 HH TYR 36 HH TYR 36 -22.272 -8.142 0.402 287 H ALA 37 HN ALA 37 -19.572 -3.096 5.456 288 HA ALA 37 HA ALA 37 -17.797 -4.964 4.276 289 HB1 ALA 37 HB1 ALA 37 -16.260 -3.067 4.061 290 HB2 ALA 37 HB2 ALA 37 -17.267 -2.124 5.160 291 HB3 ALA 37 HB3 ALA 37 -17.899 -2.609 3.587 292 H ASN 38 HN ASN 38 -18.053 -3.513 7.448 293 HA ASN 38 HA ASN 38 -15.526 -4.248 8.466 294 HB2 ASN 38 HB2 ASN 38 -17.075 -2.607 9.571 295 HB3 ASN 38 HB1 ASN 38 -18.123 -3.952 10.024 296 HD21 ASN 38 HD21 ASN 38 -17.474 -5.354 11.685 297 HD22 ASN 38 HD22 ASN 38 -16.103 -4.979 12.757 298 H ASP 39 HN ASP 39 -18.629 -5.933 8.379 299 HA ASP 39 HA ASP 39 -17.837 -8.194 9.880 300 HB2 ASP 39 HB2 ASP 39 -20.179 -7.729 9.540 301 HB3 ASP 39 HB1 ASP 39 -19.996 -7.842 7.791 302 H ASN 40 HN ASN 40 -17.299 -7.286 6.572 303 HA ASN 40 HA ASN 40 -16.516 -10.000 5.833 304 HB2 ASN 40 HB2 ASN 40 -17.112 -7.503 4.296 305 HB3 ASN 40 HB1 ASN 40 -16.091 -8.735 3.567 306 HD21 ASN 40 HD21 ASN 40 -19.295 -7.888 4.587 307 HD22 ASN 40 HD22 ASN 40 -20.103 -9.310 3.904 308 H GLY 41 HN GLY 41 -15.175 -7.327 7.222 309 HA2 GLY 41 HA2 GLY 41 -12.987 -7.061 7.924 310 HA3 GLY 41 HA1 GLY 41 -12.524 -8.395 6.890 311 H VAL 42 HN VAL 42 -14.317 -5.929 5.308 312 HA VAL 42 HA VAL 42 -11.868 -5.126 3.943 313 HB VAL 42 HB VAL 42 -14.750 -4.623 3.155 314 HG11 VAL 42 HG11 VAL 42 -13.766 -3.995 0.985 315 HG12 VAL 42 HG12 VAL 42 -12.152 -4.237 1.653 316 HG13 VAL 42 HG13 VAL 42 -13.180 -2.949 2.281 317 HG21 VAL 42 HG21 VAL 42 -14.269 -6.330 1.418 318 HG22 VAL 42 HG22 VAL 42 -14.273 -6.972 3.063 319 HG23 VAL 42 HG23 VAL 42 -12.741 -6.666 2.234 320 H ASP 43 HN ASP 43 -10.962 -3.273 4.371 321 HA ASP 43 HA ASP 43 -12.604 -0.976 5.106 322 HB2 ASP 43 HB2 ASP 43 -11.765 -1.995 7.243 323 HB3 ASP 43 HB1 ASP 43 -10.118 -1.728 6.674 324 H GLY 44 HN GLY 44 -11.831 0.957 4.294 325 HA2 GLY 44 HA2 GLY 44 -9.237 1.489 3.411 326 HA3 GLY 44 HA1 GLY 44 -10.131 0.811 2.054 327 H GLU 45 HN GLU 45 -9.576 3.083 1.254 328 HA GLU 45 HA GLU 45 -10.977 5.319 2.288 329 HB2 GLU 45 HB2 GLU 45 -9.811 4.748 -0.429 330 HB3 GLU 45 HB1 GLU 45 -10.626 6.257 -0.049 331 HG2 GLU 45 HG2 GLU 45 -8.996 6.685 1.723 332 HG3 GLU 45 HG1 GLU 45 -8.172 5.177 1.312 333 H TRP 46 HN TRP 46 -12.827 6.342 1.514 334 HA TRP 46 HA TRP 46 -14.711 4.473 0.254 335 HB2 TRP 46 HB2 TRP 46 -15.077 6.358 2.558 336 HB3 TRP 46 HB1 TRP 46 -16.445 6.053 1.497 337 HD1 TRP 46 HD1 TRP 46 -13.784 3.767 3.167 338 HE1 TRP 46 HE1 TRP 46 -14.969 1.746 4.222 339 HE3 TRP 46 HE3 TRP 46 -18.682 4.936 2.017 340 HZ2 TRP 46 HZ2 TRP 46 -17.567 0.791 4.530 341 HZ3 TRP 46 HZ3 TRP 46 -20.432 3.400 2.766 342 HH2 TRP 46 HH2 TRP 46 -19.886 1.362 3.998 343 H THR 47 HN THR 47 -15.255 5.043 -1.714 344 HA THR 47 HA THR 47 -15.196 7.888 -2.447 345 HB THR 47 HB THR 47 -15.180 6.926 -4.832 346 HG1 THR 47 HG1 THR 47 -13.979 4.635 -3.793 347 HG21 THR 47 HG21 THR 47 -12.812 6.463 -3.018 348 HG22 THR 47 HG22 THR 47 -13.248 7.988 -3.785 349 HG23 THR 47 HG23 THR 47 -12.751 6.616 -4.774 350 H TYR 48 HN TYR 48 -16.904 8.595 -3.997 351 HA TYR 48 HA TYR 48 -19.330 7.014 -3.983 352 HB2 TYR 48 HB2 TYR 48 -19.819 8.055 -1.939 353 HB3 TYR 48 HB1 TYR 48 -19.092 9.578 -2.396 354 HD1 TYR 48 HD1 TYR 48 -20.405 11.283 -3.424 355 HD2 TYR 48 HD2 TYR 48 -22.103 7.399 -2.886 356 HE1 TYR 48 HE1 TYR 48 -22.619 12.157 -4.028 357 HE2 TYR 48 HE2 TYR 48 -24.304 8.277 -3.494 358 HH TYR 48 HH TYR 48 -25.506 10.403 -3.522 359 H ASP 49 HN ASP 49 -20.743 7.544 -5.628 360 HA ASP 49 HA ASP 49 -19.919 9.818 -7.354 361 HB2 ASP 49 HB2 ASP 49 -19.289 7.686 -8.500 362 HB3 ASP 49 HB1 ASP 49 -20.924 7.108 -8.347 363 H ASP 50 HN ASP 50 -21.689 11.013 -8.244 364 HA ASP 50 HA ASP 50 -24.058 10.710 -6.526 365 HB2 ASP 50 HB2 ASP 50 -22.983 12.961 -6.712 366 HB3 ASP 50 HB1 ASP 50 -23.363 12.964 -8.433 367 H ALA 51 HN ALA 51 -23.105 10.478 -9.872 368 HA ALA 51 HA ALA 51 -25.727 10.545 -10.951 369 HB1 ALA 51 HB1 ALA 51 -24.708 9.737 -13.007 370 HB2 ALA 51 HB2 ALA 51 -23.226 9.349 -12.135 371 HB3 ALA 51 HB3 ALA 51 -23.738 11.028 -12.296 372 H THR 52 HN THR 52 -23.692 7.996 -9.673 373 HA THR 52 HA THR 52 -25.762 6.041 -10.381 374 HB THR 52 HB THR 52 -23.930 4.363 -9.825 375 HG1 THR 52 HG1 THR 52 -22.312 6.728 -10.035 376 HG21 THR 52 HG21 THR 52 -23.495 6.301 -12.106 377 HG22 THR 52 HG22 THR 52 -24.555 4.891 -12.125 378 HG23 THR 52 HG23 THR 52 -22.806 4.685 -11.995 379 H LYS 53 HN LYS 53 -24.478 7.646 -7.624 380 HA LYS 53 HA LYS 53 -24.843 7.455 -5.359 381 HB2 LYS 53 HB2 LYS 53 -27.125 5.885 -6.446 382 HB3 LYS 53 HB1 LYS 53 -26.703 5.610 -4.769 383 HG2 LYS 53 HG2 LYS 53 -28.438 7.306 -4.984 384 HG3 LYS 53 HG1 LYS 53 -26.969 7.949 -4.255 385 HD2 LYS 53 HD2 LYS 53 -26.341 8.868 -6.492 386 HD3 LYS 53 HD1 LYS 53 -27.915 8.342 -7.093 387 HE2 LYS 53 HE2 LYS 53 -29.035 9.746 -5.463 388 HE3 LYS 53 HE1 LYS 53 -27.480 10.245 -4.801 389 HZ1 LYS 53 HZ1 LYS 53 -28.448 11.887 -6.310 390 HZ2 LYS 53 HZ2 LYS 53 -28.393 10.764 -7.581 391 HZ3 LYS 53 HZ3 LYS 53 -26.953 11.320 -6.874 392 H THR 54 HN THR 54 -23.287 5.401 -7.100 393 HA THR 54 HA THR 54 -23.103 3.095 -5.472 394 HB THR 54 HB THR 54 -21.053 4.042 -7.481 395 HG1 THR 54 HG1 THR 54 -22.324 2.852 -9.004 396 HG21 THR 54 HG21 THR 54 -21.879 1.257 -6.593 397 HG22 THR 54 HG22 THR 54 -20.434 2.106 -6.040 398 HG23 THR 54 HG23 THR 54 -20.591 1.649 -7.737 399 H TYR 55 HN TYR 55 -22.061 2.880 -3.603 400 HA TYR 55 HA TYR 55 -19.866 4.704 -2.922 401 HB2 TYR 55 HB2 TYR 55 -21.647 2.920 -1.282 402 HB3 TYR 55 HB1 TYR 55 -20.028 3.246 -0.698 403 HD1 TYR 55 HD1 TYR 55 -23.255 4.834 -1.590 404 HD2 TYR 55 HD2 TYR 55 -19.469 5.285 0.282 405 HE1 TYR 55 HE1 TYR 55 -24.009 6.947 -0.581 406 HE2 TYR 55 HE2 TYR 55 -20.205 7.405 1.278 407 HH TYR 55 HH TYR 55 -23.338 8.333 1.514 408 H THR 56 HN THR 56 -17.760 3.972 -2.817 409 HA THR 56 HA THR 56 -17.369 1.090 -3.272 410 HB THR 56 HB THR 56 -15.865 3.319 -4.660 411 HG1 THR 56 HG1 THR 56 -18.153 2.129 -5.254 412 HG21 THR 56 HG21 THR 56 -14.764 1.478 -5.911 413 HG22 THR 56 HG22 THR 56 -15.575 0.311 -4.871 414 HG23 THR 56 HG23 THR 56 -14.390 1.423 -4.188 415 H VAL 57 HN VAL 57 -15.918 0.124 -2.022 416 HA VAL 57 HA VAL 57 -14.209 1.847 -0.357 417 HB VAL 57 HB VAL 57 -15.789 0.564 1.068 418 HG11 VAL 57 HG11 VAL 57 -16.243 -1.429 -0.156 419 HG12 VAL 57 HG12 VAL 57 -15.430 -1.902 1.329 420 HG13 VAL 57 HG13 VAL 57 -14.534 -1.869 -0.185 421 HG21 VAL 57 HG21 VAL 57 -12.942 -0.372 1.323 422 HG22 VAL 57 HG22 VAL 57 -14.155 -0.373 2.604 423 HG23 VAL 57 HG23 VAL 57 -13.587 1.153 1.923 424 H THR 58 HN THR 58 -12.200 1.874 -0.993 425 HA THR 58 HA THR 58 -11.207 -0.351 -2.637 426 HB THR 58 HB THR 58 -9.958 2.391 -2.393 427 HG1 THR 58 HG1 THR 58 -12.339 1.817 -3.369 428 HG21 THR 58 HG21 THR 58 -9.863 0.294 -4.577 429 HG22 THR 58 HG22 THR 58 -8.592 0.575 -3.385 430 HG23 THR 58 HG23 THR 58 -8.991 1.829 -4.561 431 H GLU 59 HN GLU 59 -9.720 -1.672 -1.858 432 HA GLU 59 HA GLU 59 -8.655 -1.206 0.784 433 HB2 GLU 59 HB2 GLU 59 -9.570 -3.407 -0.124 434 HB3 GLU 59 HB1 GLU 59 -8.080 -3.551 -1.037 435 HG2 GLU 59 HG2 GLU 59 -8.288 -3.436 1.966 436 HG3 GLU 59 HG1 GLU 59 -8.112 -4.895 1.007 437 H GLY 60 HN GLY 60 -7.232 0.619 0.348 438 HA2 GLY 60 HA2 GLY 60 -4.965 1.161 0.519 439 HA3 GLY 60 HA1 GLY 60 -4.552 -0.390 -0.189 440 H SER 61 HN SER 61 -3.487 2.239 -0.737 441 HA SER 61 HA SER 61 -4.248 2.591 -3.553 442 HB2 SER 61 HB2 SER 61 -2.451 4.310 -1.811 443 HB3 SER 61 HB1 SER 61 -2.955 4.676 -3.462 444 HG SER 61 HG SER 61 -4.386 5.760 -2.241 445 H GLY 62 HN GLY 62 -1.325 2.316 -1.514 446 HA2 GLY 62 HA2 GLY 62 0.442 0.824 -1.871 447 HA3 GLY 62 HA1 GLY 62 -0.182 0.497 -3.477 448 H GLY 63 HN GLY 63 2.380 1.898 -1.892 449 HA2 GLY 63 HA2 GLY 63 2.779 4.059 -3.791 450 HA3 GLY 63 HA1 GLY 63 3.863 3.602 -2.484 451 H ALA 64 HN ALA 64 2.953 0.905 -4.146 452 HA ALA 64 HA ALA 64 3.848 -0.468 -5.696 453 HB1 ALA 64 HB1 ALA 64 3.624 1.365 -7.287 454 HB2 ALA 64 HB2 ALA 64 5.092 0.434 -7.595 455 HB3 ALA 64 HB3 ALA 64 5.193 1.999 -6.790 456 H GLY 65 HN GLY 65 6.062 -1.202 -6.590 457 HA2 GLY 65 HA2 GLY 65 8.044 -0.955 -4.417 458 HA3 GLY 65 HA1 GLY 65 7.705 -2.469 -5.246 459 H GLY 66 HN GLY 66 10.274 -1.690 -5.176 460 HA2 GLY 66 HA2 GLY 66 11.037 -0.023 -7.378 461 HA3 GLY 66 HA1 GLY 66 12.102 -1.051 -6.429 462 H GLN 67 HN GLN 67 10.735 -3.501 -6.914 463 HA GLN 67 HA GLN 67 10.676 -5.246 -8.354 464 HB2 GLN 67 HB2 GLN 67 10.315 -3.066 -10.442 465 HB3 GLN 67 HB1 GLN 67 10.172 -4.814 -10.766 466 HG2 GLN 67 HG2 GLN 67 8.330 -4.908 -9.110 467 HG3 GLN 67 HG1 GLN 67 8.437 -3.156 -8.937 468 HE21 GLN 67 HE21 GLN 67 6.348 -2.871 -9.667 469 HE22 GLN 67 HE22 GLN 67 5.899 -3.077 -11.332 470 H GLY 68 HN GLY 68 11.783 -5.978 -10.578 471 HA2 GLY 68 HA2 GLY 68 13.734 -5.852 -11.943 472 HA3 GLY 68 HA1 GLY 68 14.504 -4.880 -10.700 473 H MET 69 HN MET 69 16.123 -6.659 -11.484 474 HA MET 69 HA MET 69 16.239 -8.598 -9.330 475 HB2 MET 69 HB2 MET 69 15.072 -9.832 -11.113 476 HB3 MET 69 HB1 MET 69 16.389 -9.483 -12.224 477 HG2 MET 69 HG2 MET 69 16.580 -11.739 -11.410 478 HG3 MET 69 HG1 MET 69 17.914 -10.767 -10.794 479 HE1 MET 69 HE1 MET 69 18.343 -12.832 -9.107 480 HE2 MET 69 HE2 MET 69 16.904 -13.669 -9.690 481 HE3 MET 69 HE3 MET 69 17.139 -13.418 -7.960 482 H ILE 70 HN ILE 70 18.231 -8.289 -8.494 483 HA ILE 70 HA ILE 70 20.474 -7.739 -10.308 484 HB ILE 70 HB ILE 70 19.876 -6.130 -7.791 485 HG12 ILE 70 HG12 ILE 70 18.474 -5.510 -9.746 486 HG13 ILE 70 HG11 ILE 70 19.554 -4.219 -9.234 487 HG21 ILE 70 HG21 ILE 70 22.170 -5.773 -9.739 488 HG22 ILE 70 HG22 ILE 70 22.309 -6.518 -8.144 489 HG23 ILE 70 HG23 ILE 70 21.855 -4.817 -8.293 490 HD11 ILE 70 HD11 ILE 70 21.041 -4.682 -11.081 491 HD12 ILE 70 HD12 ILE 70 19.401 -4.426 -11.677 492 HD13 ILE 70 HD13 ILE 70 20.053 -6.061 -11.563 493 H GLN 71 HN GLN 71 21.320 -9.845 -9.884 494 HA GLN 71 HA GLN 71 22.223 -10.230 -7.106 495 HB2 GLN 71 HB2 GLN 71 21.974 -12.634 -7.385 496 HB3 GLN 71 HB1 GLN 71 20.443 -11.825 -7.670 497 HG2 GLN 71 HG2 GLN 71 20.676 -12.081 -10.037 498 HG3 GLN 71 HG1 GLN 71 22.311 -12.717 -9.856 499 HE21 GLN 71 HE21 GLN 71 21.643 -14.320 -7.527 500 HE22 GLN 71 HE22 GLN 71 20.720 -15.672 -8.108 501 H GLU 72 HN GLU 72 23.248 -9.261 -9.851 502 HA GLU 72 HA GLU 72 25.508 -10.980 -10.350 503 HB2 GLU 72 HB2 GLU 72 24.794 -8.248 -11.461 504 HB3 GLU 72 HB1 GLU 72 26.121 -9.251 -12.027 505 HG2 GLU 72 HG2 GLU 72 24.282 -9.446 -13.543 506 HG3 GLU 72 HG1 GLU 72 24.494 -10.979 -12.706 507 HA PRO 73 HA PRO 73 28.342 -8.883 -7.654 508 HB2 PRO 73 HB2 PRO 73 30.706 -9.283 -8.909 509 HB3 PRO 73 HB1 PRO 73 29.813 -10.623 -8.098 510 HG2 PRO 73 HG2 PRO 73 29.896 -9.877 -11.016 511 HG3 PRO 73 HG1 PRO 73 30.021 -11.483 -10.269 512 HD2 PRO 73 HD2 PRO 73 27.717 -10.545 -11.359 513 HD3 PRO 73 HD1 PRO 73 27.742 -11.662 -9.953 514 H ALA 74 HN ALA 74 30.077 -7.216 -7.671 515 HA ALA 74 HA ALA 74 30.529 -5.568 -9.876 516 HB1 ALA 74 HB1 ALA 74 28.432 -4.467 -8.005 517 HB2 ALA 74 HB2 ALA 74 28.154 -4.998 -9.663 518 HB3 ALA 74 HB3 ALA 74 29.188 -3.606 -9.347 519 H LEU 75 HN LEU 75 31.229 -3.258 -9.043 520 HA LEU 75 HA LEU 75 33.171 -3.752 -6.960 521 HB2 LEU 75 HB2 LEU 75 32.696 -1.403 -8.797 522 HB3 LEU 75 HB1 LEU 75 33.929 -1.415 -7.562 523 HG LEU 75 HG LEU 75 35.013 -1.882 -9.604 524 HD11 LEU 75 HD11 LEU 75 35.786 -3.222 -7.740 525 HD12 LEU 75 HD12 LEU 75 35.944 -4.107 -9.257 526 HD13 LEU 75 HD13 LEU 75 34.626 -4.488 -8.150 527 HD21 LEU 75 HD21 LEU 75 33.090 -2.489 -10.954 528 HD22 LEU 75 HD22 LEU 75 32.953 -4.027 -10.104 529 HD23 LEU 75 HD23 LEU 75 34.360 -3.703 -11.114 530 HA PRO 76 HA PRO 76 30.883 -1.769 -3.600 531 HB2 PRO 76 HB2 PRO 76 33.428 -0.200 -3.210 532 HB3 PRO 76 HB1 PRO 76 32.441 -1.004 -1.980 533 HG2 PRO 76 HG2 PRO 76 34.691 -2.135 -2.795 534 HG3 PRO 76 HG1 PRO 76 33.206 -3.138 -2.582 535 HD2 PRO 76 HD2 PRO 76 34.497 -2.153 -5.101 536 HD3 PRO 76 HD1 PRO 76 33.684 -3.684 -4.771 537 HA PRO 77 HA PRO 77 29.365 1.998 -5.405 538 HB2 PRO 77 HB2 PRO 77 28.434 3.372 -3.246 539 HB3 PRO 77 HB1 PRO 77 27.623 1.925 -3.868 540 HG2 PRO 77 HG2 PRO 77 29.613 2.174 -1.648 541 HG3 PRO 77 HG1 PRO 77 28.029 1.361 -1.614 542 HD2 PRO 77 HD2 PRO 77 30.261 -0.090 -1.962 543 HD3 PRO 77 HD1 PRO 77 28.784 -0.449 -2.933 544 H GLY 78 HN GLY 78 30.340 3.833 -6.085 545 HA2 GLY 78 HA2 GLY 78 31.678 5.760 -5.927 546 HA3 GLY 78 HA1 GLY 78 32.182 5.252 -4.323 547 H TRP 79 HN TRP 79 32.831 2.501 -5.500 548 HA TRP 79 HA TRP 79 35.536 3.237 -6.405 549 HB2 TRP 79 HB2 TRP 79 34.311 0.618 -5.485 550 HB3 TRP 79 HB1 TRP 79 35.927 0.725 -6.159 551 HD1 TRP 79 HD1 TRP 79 33.911 2.088 -3.140 552 HE1 TRP 79 HE1 TRP 79 35.564 2.489 -1.207 553 HE3 TRP 79 HE3 TRP 79 38.294 1.026 -5.571 554 HZ2 TRP 79 HZ2 TRP 79 38.353 2.383 -0.778 555 HZ3 TRP 79 HZ3 TRP 79 40.404 1.203 -4.329 556 HH2 TRP 79 HH2 TRP 79 40.436 1.869 -1.980 557 H GLU 80 HN GLU 80 36.365 2.690 -8.424 558 HA GLU 80 HA GLU 80 34.621 1.233 -10.277 559 HB2 GLU 80 HB2 GLU 80 34.297 3.602 -10.787 560 HB3 GLU 80 HB1 GLU 80 36.028 3.872 -10.758 561 HG2 GLU 80 HG2 GLU 80 35.345 3.866 -13.018 562 HG3 GLU 80 HG1 GLU 80 36.242 2.378 -12.731 563 H MET 81 HN MET 81 35.751 0.136 -11.949 564 HA MET 81 HA MET 81 38.652 -0.125 -11.501 565 HB2 MET 81 HB2 MET 81 37.265 -1.964 -10.415 566 HB3 MET 81 HB1 MET 81 36.821 -2.477 -12.059 567 HG2 MET 81 HG2 MET 81 39.679 -2.260 -11.145 568 HG3 MET 81 HG1 MET 81 38.715 -3.711 -10.900 569 HE1 MET 81 HE1 MET 81 37.891 -4.708 -14.625 570 HE2 MET 81 HE2 MET 81 36.932 -3.647 -13.591 571 HE3 MET 81 HE3 MET 81 37.647 -5.118 -12.929 572 H LYS 82 HN LYS 82 39.808 0.068 -13.373 573 HA LYS 82 HA LYS 82 38.635 -0.732 -15.896 574 HB2 LYS 82 HB2 LYS 82 39.571 2.142 -15.547 575 HB3 LYS 82 HB1 LYS 82 39.005 1.416 -17.034 576 HG2 LYS 82 HG2 LYS 82 36.770 1.154 -16.075 577 HG3 LYS 82 HG1 LYS 82 37.355 1.893 -14.554 578 HD2 LYS 82 HD2 LYS 82 37.993 3.906 -15.933 579 HD3 LYS 82 HD1 LYS 82 37.115 3.169 -17.278 580 HE2 LYS 82 HE2 LYS 82 35.936 3.832 -14.576 581 HE3 LYS 82 HE1 LYS 82 35.747 4.804 -16.034 582 HZ1 LYS 82 HZ1 LYS 82 33.929 3.089 -15.342 583 HZ2 LYS 82 HZ2 LYS 82 34.960 1.971 -16.086 584 HZ3 LYS 82 HZ3 LYS 82 34.340 3.271 -16.979 585 H TYR 83 HN TYR 83 40.280 -0.786 -17.624 586 HA TYR 83 HA TYR 83 42.954 -1.238 -16.458 587 HB2 TYR 83 HB2 TYR 83 41.743 -2.268 -19.066 588 HB3 TYR 83 HB1 TYR 83 43.372 -2.672 -18.465 589 HD1 TYR 83 HD1 TYR 83 43.615 -4.169 -16.519 590 HD2 TYR 83 HD2 TYR 83 39.784 -3.330 -18.180 591 HE1 TYR 83 HE1 TYR 83 42.676 -6.085 -15.304 592 HE2 TYR 83 HE2 TYR 83 38.841 -5.248 -16.959 593 HH TYR 83 HH TYR 83 39.506 -7.293 -15.930 594 H THR 84 HN THR 84 44.811 -0.409 -17.506 595 HA THR 84 HA THR 84 44.430 2.019 -19.005 596 HB THR 84 HB THR 84 46.826 2.260 -18.980 597 HG1 THR 84 HG1 THR 84 48.206 0.605 -18.592 598 HG21 THR 84 HG21 THR 84 45.966 1.018 -16.373 599 HG22 THR 84 HG22 THR 84 45.687 2.691 -16.858 600 HG23 THR 84 HG23 THR 84 47.332 2.108 -16.614 601 H SER 85 HN SER 85 46.288 2.127 -20.967 602 HA SER 85 HA SER 85 45.063 0.800 -23.099 603 HB2 SER 85 HB2 SER 85 47.700 1.483 -23.871 604 HB3 SER 85 HB1 SER 85 46.219 2.394 -24.158 605 HG SER 85 HG SER 85 48.250 2.851 -22.372 606 H GLU 86 HN GLU 86 47.978 -0.027 -21.270 607 HA GLU 86 HA GLU 86 48.500 -2.397 -22.935 608 HB2 GLU 86 HB2 GLU 86 49.811 -1.322 -20.416 609 HB3 GLU 86 HB1 GLU 86 50.326 -2.795 -21.228 610 HG2 GLU 86 HG2 GLU 86 50.927 -1.556 -23.196 611 HG3 GLU 86 HG1 GLU 86 50.260 -0.071 -22.509 612 H GLY 87 HN GLY 87 46.147 -1.839 -20.856 613 HA2 GLY 87 HA2 GLY 87 44.717 -3.318 -19.820 614 HA3 GLY 87 HA1 GLY 87 45.841 -4.609 -20.210 615 H VAL 88 HN VAL 88 46.937 -1.808 -18.429 616 HA VAL 88 HA VAL 88 47.541 -3.500 -16.156 617 HB VAL 88 HB VAL 88 48.096 -0.575 -16.674 618 HG11 VAL 88 HG11 VAL 88 47.811 -0.905 -14.284 619 HG12 VAL 88 HG12 VAL 88 49.509 -0.628 -14.668 620 HG13 VAL 88 HG13 VAL 88 48.937 -2.260 -14.322 621 HG21 VAL 88 HG21 VAL 88 49.865 -3.009 -16.646 622 HG22 VAL 88 HG22 VAL 88 50.453 -1.352 -16.748 623 HG23 VAL 88 HG23 VAL 88 49.446 -2.010 -18.037 624 H ARG 89 HN ARG 89 46.577 -3.385 -14.168 625 HA ARG 89 HA ARG 89 43.861 -2.391 -14.188 626 HB2 ARG 89 HB2 ARG 89 44.673 -4.678 -13.346 627 HB3 ARG 89 HB1 ARG 89 45.236 -3.818 -11.926 628 HG2 ARG 89 HG2 ARG 89 42.960 -3.050 -11.478 629 HG3 ARG 89 HG1 ARG 89 42.386 -3.937 -12.894 630 HD2 ARG 89 HD2 ARG 89 43.280 -6.022 -11.869 631 HD3 ARG 89 HD1 ARG 89 43.674 -5.088 -10.424 632 HE ARG 89 HE ARG 89 40.924 -4.825 -11.176 633 HH11 ARG 89 HH11 ARG 89 43.229 -6.858 -9.474 634 HH12 ARG 89 HH12 ARG 89 41.999 -7.628 -8.505 635 HH21 ARG 89 HH21 ARG 89 39.327 -5.839 -9.867 636 HH22 ARG 89 HH22 ARG 89 39.795 -7.050 -8.714 637 H TYR 90 HN TYR 90 43.273 -0.467 -13.394 638 HA TYR 90 HA TYR 90 44.671 0.497 -11.011 639 HB2 TYR 90 HB2 TYR 90 44.721 2.785 -11.771 640 HB3 TYR 90 HB1 TYR 90 45.493 1.786 -12.984 641 HD1 TYR 90 HD1 TYR 90 44.305 1.316 -15.137 642 HD2 TYR 90 HD2 TYR 90 42.801 4.074 -12.273 643 HE1 TYR 90 HE1 TYR 90 42.809 2.263 -16.842 644 HE2 TYR 90 HE2 TYR 90 41.300 5.031 -13.965 645 HH TYR 90 HH TYR 90 41.000 5.185 -16.295 646 H PHE 91 HN PHE 91 43.271 1.968 -9.681 647 HA PHE 91 HA PHE 91 40.429 1.407 -10.182 648 HB2 PHE 91 HB2 PHE 91 42.007 1.413 -7.624 649 HB3 PHE 91 HB1 PHE 91 40.277 1.709 -7.612 650 HD1 PHE 91 HD1 PHE 91 38.777 -0.113 -7.536 651 HD2 PHE 91 HD2 PHE 91 42.803 -0.739 -8.783 652 HE1 PHE 91 HE1 PHE 91 38.386 -2.532 -7.568 653 HE2 PHE 91 HE2 PHE 91 42.412 -3.167 -8.810 654 HZ PHE 91 HZ PHE 91 40.120 -4.053 -8.143 655 H VAL 92 HN VAL 92 38.921 2.999 -9.644 656 HA VAL 92 HA VAL 92 40.054 5.723 -9.477 657 HB VAL 92 HB VAL 92 37.423 4.863 -10.685 658 HG11 VAL 92 HG11 VAL 92 37.334 7.146 -11.601 659 HG12 VAL 92 HG12 VAL 92 38.776 7.551 -10.666 660 HG13 VAL 92 HG13 VAL 92 37.282 7.115 -9.838 661 HG21 VAL 92 HG21 VAL 92 39.939 5.748 -12.068 662 HG22 VAL 92 HG22 VAL 92 38.413 5.327 -12.844 663 HG23 VAL 92 HG23 VAL 92 39.341 4.092 -11.993 664 H ASP 93 HN ASP 93 39.874 6.388 -7.409 665 HA ASP 93 HA ASP 93 37.626 5.618 -5.712 666 HB2 ASP 93 HB2 ASP 93 40.125 7.260 -5.328 667 HB3 ASP 93 HB1 ASP 93 38.737 7.656 -4.322 668 H HIS 94 HN HIS 94 35.711 6.494 -6.652 669 HA HIS 94 HA HIS 94 35.646 9.198 -7.606 670 HB2 HIS 94 HB2 HIS 94 33.434 7.226 -7.017 671 HB3 HIS 94 HB1 HIS 94 33.126 8.861 -7.569 672 HD1 HIS 94 HD1 HIS 94 33.832 9.481 -9.973 673 HD2 HIS 94 HD2 HIS 94 34.259 5.441 -9.051 674 HE1 HIS 94 HE1 HIS 94 34.052 8.298 -12.177 675 HE2 HIS 94 HE2 HIS 94 34.094 5.851 -11.600 676 H ASN 95 HN ASN 95 35.537 7.843 -4.523 677 HA ASN 95 HA ASN 95 33.768 9.726 -3.291 678 HB2 ASN 95 HB2 ASN 95 34.574 8.745 -1.145 679 HB3 ASN 95 HB1 ASN 95 34.058 7.509 -2.291 680 HD21 ASN 95 HD21 ASN 95 35.549 6.109 -3.148 681 HD22 ASN 95 HD22 ASN 95 37.186 6.001 -2.581 682 H THR 96 HN THR 96 37.267 9.490 -3.714 683 HA THR 96 HA THR 96 37.520 12.133 -2.449 684 HB THR 96 HB THR 96 40.047 11.426 -2.417 685 HG1 THR 96 HG1 THR 96 38.939 8.846 -2.147 686 HG21 THR 96 HG21 THR 96 39.753 10.421 -0.204 687 HG22 THR 96 HG22 THR 96 38.038 10.177 -0.536 688 HG23 THR 96 HG23 THR 96 38.688 11.810 -0.408 689 H ARG 97 HN ARG 97 37.324 10.675 -5.342 690 HA ARG 97 HA ARG 97 37.739 11.233 -7.498 691 HB2 ARG 97 HB2 ARG 97 38.218 13.962 -6.308 692 HB3 ARG 97 HB1 ARG 97 38.093 13.624 -8.033 693 HG2 ARG 97 HG2 ARG 97 35.849 12.686 -7.632 694 HG3 ARG 97 HG1 ARG 97 35.967 13.214 -5.950 695 HD2 ARG 97 HD2 ARG 97 35.975 14.951 -8.421 696 HD3 ARG 97 HD1 ARG 97 34.745 14.890 -7.157 697 HE ARG 97 HE ARG 97 37.347 15.591 -6.161 698 HH11 ARG 97 HH11 ARG 97 34.400 16.853 -7.580 699 HH12 ARG 97 HH12 ARG 97 34.688 18.483 -7.047 700 HH21 ARG 97 HH21 ARG 97 37.744 17.704 -5.481 701 HH22 ARG 97 HH22 ARG 97 36.616 18.974 -5.859 702 H THR 98 HN THR 98 39.487 9.791 -7.283 703 HA THR 98 HA THR 98 41.960 10.954 -8.224 704 HB THR 98 HB THR 98 42.148 11.161 -5.706 705 HG1 THR 98 HG1 THR 98 44.287 10.177 -5.706 706 HG21 THR 98 HG21 THR 98 40.966 9.093 -5.079 707 HG22 THR 98 HG22 THR 98 42.602 9.114 -4.412 708 HG23 THR 98 HG23 THR 98 42.239 8.134 -5.833 709 H THR 99 HN THR 99 43.659 9.082 -8.322 710 HA THR 99 HA THR 99 42.293 6.575 -9.100 711 HB THR 99 HB THR 99 44.286 6.374 -10.782 712 HG1 THR 99 HG1 THR 99 44.221 9.181 -10.892 713 HG21 THR 99 HG21 THR 99 42.046 8.395 -11.236 714 HG22 THR 99 HG22 THR 99 41.975 6.666 -11.587 715 HG23 THR 99 HG23 THR 99 43.048 7.716 -12.515 716 H THR 100 HN THR 100 43.455 4.633 -8.555 717 HA THR 100 HA THR 100 46.013 4.921 -7.216 718 HB THR 100 HB THR 100 44.392 5.382 -5.428 719 HG1 THR 100 HG1 THR 100 45.791 4.393 -4.214 720 HG21 THR 100 HG21 THR 100 43.383 2.587 -5.972 721 HG22 THR 100 HG22 THR 100 42.486 4.082 -6.252 722 HG23 THR 100 HG23 THR 100 42.905 3.598 -4.608 723 H PHE 101 HN PHE 101 46.991 2.871 -6.684 724 HA PHE 101 HA PHE 101 46.044 0.717 -8.449 725 HB2 PHE 101 HB2 PHE 101 48.815 1.608 -7.625 726 HB3 PHE 101 HB1 PHE 101 48.502 -0.059 -8.265 727 HD1 PHE 101 HD1 PHE 101 48.195 -0.419 -10.564 728 HD2 PHE 101 HD2 PHE 101 48.353 3.569 -9.086 729 HE1 PHE 101 HE1 PHE 101 48.341 0.417 -12.863 730 HE2 PHE 101 HE2 PHE 101 48.507 4.416 -11.396 731 HZ PHE 101 HZ PHE 101 48.503 2.842 -13.287 732 H LYS 102 HN LYS 102 44.877 -0.597 -7.145 733 HA LYS 102 HA LYS 102 46.325 -1.758 -4.882 734 HB2 LYS 102 HB2 LYS 102 43.405 -1.002 -4.860 735 HB3 LYS 102 HB1 LYS 102 44.224 -1.912 -3.611 736 HG2 LYS 102 HG2 LYS 102 45.709 0.041 -3.225 737 HG3 LYS 102 HG1 LYS 102 44.735 0.947 -4.381 738 HD2 LYS 102 HD2 LYS 102 44.087 1.349 -2.018 739 HD3 LYS 102 HD1 LYS 102 42.771 0.705 -3.007 740 HE2 LYS 102 HE2 LYS 102 42.800 -0.440 -0.891 741 HE3 LYS 102 HE1 LYS 102 43.288 -1.549 -2.170 742 HZ1 LYS 102 HZ1 LYS 102 45.132 -0.128 -0.327 743 HZ2 LYS 102 HZ2 LYS 102 45.593 -1.237 -1.528 744 HZ3 LYS 102 HZ3 LYS 102 44.683 -1.755 -0.192 745 H ASP 103 HN ASP 103 46.842 -3.612 -5.940 746 HA ASP 103 HA ASP 103 44.562 -5.311 -6.713 747 HB2 ASP 103 HB2 ASP 103 45.997 -4.662 -8.674 748 HB3 ASP 103 HB1 ASP 103 47.352 -5.478 -7.900 749 HA PRO 104 HA PRO 104 45.857 -7.906 -3.394 750 HB2 PRO 104 HB2 PRO 104 44.929 -10.318 -4.381 751 HB3 PRO 104 HB1 PRO 104 43.896 -9.127 -3.579 752 HG2 PRO 104 HG2 PRO 104 44.331 -9.603 -6.505 753 HG3 PRO 104 HG1 PRO 104 42.825 -9.259 -5.633 754 HD2 PRO 104 HD2 PRO 104 44.078 -7.358 -7.025 755 HD3 PRO 104 HD1 PRO 104 43.289 -6.990 -5.475 756 H ARG 105 HN ARG 105 47.011 -8.351 -6.631 757 HA ARG 105 HA ARG 105 48.932 -10.385 -5.750 758 HB2 ARG 105 HB2 ARG 105 48.028 -9.398 -8.424 759 HB3 ARG 105 HB1 ARG 105 49.616 -10.126 -8.288 760 HG2 ARG 105 HG2 ARG 105 47.951 -11.736 -9.025 761 HG3 ARG 105 HG1 ARG 105 48.636 -12.188 -7.460 762 HD2 ARG 105 HD2 ARG 105 46.644 -11.241 -6.357 763 HD3 ARG 105 HD1 ARG 105 45.967 -10.862 -7.941 764 HE ARG 105 HE ARG 105 46.437 -13.501 -8.136 765 HH11 ARG 105 HH11 ARG 105 44.793 -11.596 -5.694 766 HH12 ARG 105 HH12 ARG 105 43.712 -12.877 -5.240 767 HH21 ARG 105 HH21 ARG 105 45.023 -15.179 -7.544 768 HH22 ARG 105 HH22 ARG 105 43.822 -14.909 -6.315 769 HA PRO 106 HA PRO 106 51.698 -6.810 -5.366 770 HB2 PRO 106 HB2 PRO 106 53.585 -7.955 -3.795 771 HB3 PRO 106 HB1 PRO 106 52.002 -7.392 -3.141 772 HG2 PRO 106 HG2 PRO 106 52.938 -10.158 -3.792 773 HG3 PRO 106 HG1 PRO 106 51.895 -9.595 -2.475 774 HD2 PRO 106 HD2 PRO 106 51.028 -10.803 -4.827 775 HD3 PRO 106 HD1 PRO 106 50.009 -9.803 -3.734 776 H GLY 107 HN GLY 107 52.933 -6.320 -7.053 777 HA2 GLY 107 HA2 GLY 107 54.708 -6.400 -8.524 778 HA3 GLY 107 HA1 GLY 107 55.234 -7.923 -7.768 779 H PHE 108 HN PHE 108 52.529 -9.113 -8.188 780 HA PHE 108 HA PHE 108 51.366 -10.374 -9.742 781 HB2 PHE 108 HB2 PHE 108 51.436 -7.922 -10.872 782 HB3 PHE 108 HB1 PHE 108 52.411 -8.829 -12.081 783 HD1 PHE 108 HD1 PHE 108 49.101 -8.627 -10.412 784 HD2 PHE 108 HD2 PHE 108 51.386 -10.311 -13.599 785 HE1 PHE 108 HE1 PHE 108 47.041 -9.440 -11.465 786 HE2 PHE 108 HE2 PHE 108 49.316 -11.127 -14.652 787 HZ PHE 108 HZ PHE 108 47.140 -10.685 -13.586 788 H GLU 109 HN GLU 109 54.507 -10.362 -9.345 789 HA GLU 109 HA GLU 109 54.971 -12.826 -10.685 790 HB2 GLU 109 HB2 GLU 109 55.283 -11.317 -12.600 791 HB3 GLU 109 HB1 GLU 109 56.437 -10.370 -11.675 792 HG2 GLU 109 HG2 GLU 109 57.567 -11.806 -13.250 793 HG3 GLU 109 HG1 GLU 109 57.954 -12.282 -11.600 Start of MODEL 7 1 H1 GLY 1 HT1 GLY 1 -38.641 7.226 -4.680 2 H2 GLY 1 HT2 GLY 1 -39.187 6.579 -6.151 3 H3 GLY 1 HT3 GLY 1 -38.262 5.629 -5.096 4 HA2 GLY 1 HA1 GLY 1 -40.971 6.685 -4.504 5 HA3 GLY 1 HA2 GLY 1 -40.621 5.036 -5.007 6 H SER 2 HN SER 2 -40.481 7.356 -2.426 7 HA SER 2 HA SER 2 -40.336 7.145 -0.171 8 HB2 SER 2 HB2 SER 2 -41.747 5.161 -0.328 9 HB3 SER 2 HB1 SER 2 -40.349 4.168 -0.733 10 HG SER 2 HG SER 2 -41.190 5.164 1.722 11 H HIS 3 HN HIS 3 -38.258 4.630 -1.622 12 HA HIS 3 HA HIS 3 -36.024 5.655 0.009 13 HB2 HIS 3 HB2 HIS 3 -36.412 2.891 -1.175 14 HB3 HIS 3 HB1 HIS 3 -34.974 3.429 -0.323 15 HD1 HIS 3 HD1 HIS 3 -34.915 2.890 2.085 16 HD2 HIS 3 HD2 HIS 3 -38.801 2.946 0.614 17 HE1 HIS 3 HE1 HIS 3 -36.361 2.103 3.976 18 HE2 HIS 3 HE2 HIS 3 -38.664 1.896 2.970 19 H MET 4 HN MET 4 -33.862 5.295 -1.070 20 HA MET 4 HA MET 4 -34.010 5.471 -3.995 21 HB2 MET 4 HB2 MET 4 -32.084 7.104 -3.877 22 HB3 MET 4 HB1 MET 4 -33.621 7.734 -3.308 23 HG2 MET 4 HG2 MET 4 -32.902 7.321 -0.989 24 HG3 MET 4 HG1 MET 4 -31.336 6.784 -1.593 25 HE1 MET 4 HE1 MET 4 -33.510 9.657 -3.094 26 HE2 MET 4 HE2 MET 4 -32.927 11.071 -2.215 27 HE3 MET 4 HE3 MET 4 -33.840 9.822 -1.368 28 H GLN 5 HN GLN 5 -32.490 4.242 -5.036 29 HA GLN 5 HA GLN 5 -31.365 2.139 -3.495 30 HB2 GLN 5 HB2 GLN 5 -32.233 1.752 -5.755 31 HB3 GLN 5 HB1 GLN 5 -30.992 2.807 -6.421 32 HG2 GLN 5 HG2 GLN 5 -29.272 1.256 -5.554 33 HG3 GLN 5 HG1 GLN 5 -30.561 0.170 -5.040 34 HE21 GLN 5 HE21 GLN 5 -31.759 -0.923 -6.567 35 HE22 GLN 5 HE22 GLN 5 -31.217 -1.096 -8.228 36 H TYR 6 HN TYR 6 -29.398 1.819 -2.753 37 HA TYR 6 HA TYR 6 -27.194 3.473 -3.780 38 HB2 TYR 6 HB2 TYR 6 -27.972 2.972 -0.915 39 HB3 TYR 6 HB1 TYR 6 -26.266 3.165 -1.301 40 HD1 TYR 6 HD1 TYR 6 -25.461 5.329 -2.211 41 HD2 TYR 6 HD2 TYR 6 -29.474 4.823 -0.897 42 HE1 TYR 6 HE1 TYR 6 -25.732 7.776 -2.112 43 HE2 TYR 6 HE2 TYR 6 -29.757 7.262 -0.791 44 HH TYR 6 HH TYR 6 -27.520 9.429 -2.176 45 H LYS 7 HN LYS 7 -25.215 2.366 -3.976 46 HA LYS 7 HA LYS 7 -25.270 -0.468 -3.245 47 HB2 LYS 7 HB2 LYS 7 -24.054 -0.920 -5.468 48 HB3 LYS 7 HB1 LYS 7 -25.813 -0.645 -5.535 49 HG2 LYS 7 HG2 LYS 7 -25.524 1.531 -6.388 50 HG3 LYS 7 HG1 LYS 7 -23.795 1.534 -6.037 51 HD2 LYS 7 HD2 LYS 7 -24.192 1.180 -8.416 52 HD3 LYS 7 HD1 LYS 7 -23.464 -0.253 -7.690 53 HE2 LYS 7 HE2 LYS 7 -25.199 -0.971 -9.168 54 HE3 LYS 7 HE1 LYS 7 -25.754 -1.234 -7.516 55 HZ1 LYS 7 HZ1 LYS 7 -26.493 1.085 -9.226 56 HZ2 LYS 7 HZ2 LYS 7 -27.076 0.774 -7.665 57 HZ3 LYS 7 HZ3 LYS 7 -27.474 -0.268 -8.940 58 H LEU 8 HN LEU 8 -23.246 -1.500 -3.139 59 HA LEU 8 HA LEU 8 -20.919 0.298 -2.868 60 HB2 LEU 8 HB2 LEU 8 -21.845 -0.159 -0.585 61 HB3 LEU 8 HB1 LEU 8 -21.724 -1.865 -0.915 62 HG LEU 8 HG LEU 8 -19.196 -1.348 -1.301 63 HD11 LEU 8 HD11 LEU 8 -19.988 0.907 0.535 64 HD12 LEU 8 HD12 LEU 8 -19.372 1.079 -1.109 65 HD13 LEU 8 HD13 LEU 8 -18.342 0.403 0.150 66 HD21 LEU 8 HD21 LEU 8 -18.871 -1.670 1.170 67 HD22 LEU 8 HD22 LEU 8 -19.884 -2.850 0.339 68 HD23 LEU 8 HD23 LEU 8 -20.626 -1.577 1.300 69 H ILE 9 HN ILE 9 -19.043 -0.544 -3.609 70 HA ILE 9 HA ILE 9 -19.128 -3.326 -4.577 71 HB ILE 9 HB ILE 9 -17.694 -0.956 -5.826 72 HG12 ILE 9 HG12 ILE 9 -19.823 -2.809 -6.996 73 HG13 ILE 9 HG11 ILE 9 -20.177 -1.164 -6.346 74 HG21 ILE 9 HG21 ILE 9 -16.271 -2.918 -5.904 75 HG22 ILE 9 HG22 ILE 9 -16.900 -2.556 -7.513 76 HG23 ILE 9 HG23 ILE 9 -17.595 -3.877 -6.573 77 HD11 ILE 9 HD11 ILE 9 -19.994 -1.136 -8.769 78 HD12 ILE 9 HD12 ILE 9 -18.378 -1.838 -8.690 79 HD13 ILE 9 HD13 ILE 9 -18.671 -0.221 -8.046 80 H LEU 10 HN LEU 10 -17.684 -4.620 -3.621 81 HA LEU 10 HA LEU 10 -15.684 -3.356 -1.915 82 HB2 LEU 10 HB2 LEU 10 -16.428 -6.273 -2.092 83 HB3 LEU 10 HB1 LEU 10 -15.250 -5.595 -1.005 84 HG LEU 10 HG LEU 10 -17.060 -5.919 0.365 85 HD11 LEU 10 HD11 LEU 10 -16.255 -3.597 0.484 86 HD12 LEU 10 HD12 LEU 10 -17.910 -3.840 1.038 87 HD13 LEU 10 HD13 LEU 10 -17.612 -3.128 -0.547 88 HD21 LEU 10 HD21 LEU 10 -18.957 -4.822 -1.705 89 HD22 LEU 10 HD22 LEU 10 -19.370 -5.589 -0.174 90 HD23 LEU 10 HD23 LEU 10 -18.631 -6.539 -1.460 91 H ASN 11 HN ASN 11 -13.899 -2.873 -2.869 92 HA ASN 11 HA ASN 11 -12.827 -4.660 -4.952 93 HB2 ASN 11 HB2 ASN 11 -12.313 -1.763 -4.273 94 HB3 ASN 11 HB1 ASN 11 -11.187 -2.691 -5.240 95 HD21 ASN 11 HD21 ASN 11 -11.517 -2.831 -7.326 96 HD22 ASN 11 HD22 ASN 11 -12.899 -2.207 -8.136 97 H GLY 12 HN GLY 12 -12.091 -6.209 -3.402 98 HA2 GLY 12 HA2 GLY 12 -9.464 -5.464 -2.400 99 HA3 GLY 12 HA1 GLY 12 -10.629 -5.988 -1.181 100 H LYS 13 HN LYS 13 -8.102 -7.130 -2.256 101 HA LYS 13 HA LYS 13 -8.356 -9.368 -3.812 102 HB2 LYS 13 HB2 LYS 13 -6.527 -8.973 -1.432 103 HB3 LYS 13 HB1 LYS 13 -6.302 -10.161 -2.711 104 HG2 LYS 13 HG2 LYS 13 -5.820 -8.524 -4.310 105 HG3 LYS 13 HG1 LYS 13 -6.485 -7.229 -3.315 106 HD2 LYS 13 HD2 LYS 13 -4.074 -7.096 -3.298 107 HD3 LYS 13 HD1 LYS 13 -4.646 -7.576 -1.701 108 HE2 LYS 13 HE2 LYS 13 -2.739 -8.905 -2.240 109 HE3 LYS 13 HE1 LYS 13 -4.166 -9.935 -2.307 110 HZ1 LYS 13 HZ1 LYS 13 -2.828 -8.709 -4.662 111 HZ2 LYS 13 HZ2 LYS 13 -4.167 -9.753 -4.701 112 HZ3 LYS 13 HZ3 LYS 13 -2.663 -10.324 -4.167 113 H THR 14 HN THR 14 -9.309 -8.970 -0.472 114 HA THR 14 HA THR 14 -9.623 -11.859 -0.105 115 HB THR 14 HB THR 14 -10.259 -9.593 1.798 116 HG1 THR 14 HG1 THR 14 -8.100 -9.528 1.684 117 HG21 THR 14 HG21 THR 14 -10.221 -11.331 3.529 118 HG22 THR 14 HG22 THR 14 -9.943 -12.559 2.297 119 HG23 THR 14 HG23 THR 14 -11.467 -11.671 2.326 120 H LEU 15 HN LEU 15 -11.535 -9.101 -0.966 121 HA LEU 15 HA LEU 15 -13.931 -10.721 -1.121 122 HB2 LEU 15 HB2 LEU 15 -13.516 -8.964 1.063 123 HB3 LEU 15 HB1 LEU 15 -14.707 -8.210 0.032 124 HG LEU 15 HG LEU 15 -15.946 -9.417 1.601 125 HD11 LEU 15 HD11 LEU 15 -17.002 -11.226 0.321 126 HD12 LEU 15 HD12 LEU 15 -15.688 -11.119 -0.851 127 HD13 LEU 15 HD13 LEU 15 -16.774 -9.752 -0.619 128 HD21 LEU 15 HD21 LEU 15 -15.533 -11.713 2.243 129 HD22 LEU 15 HD22 LEU 15 -14.086 -10.740 2.508 130 HD23 LEU 15 HD23 LEU 15 -14.184 -11.809 1.109 131 H LYS 16 HN LYS 16 -14.142 -10.431 -3.299 132 HA LYS 16 HA LYS 16 -14.463 -7.631 -4.185 133 HB2 LYS 16 HB2 LYS 16 -13.942 -9.992 -6.004 134 HB3 LYS 16 HB1 LYS 16 -13.923 -8.295 -6.437 135 HG2 LYS 16 HG2 LYS 16 -11.735 -8.343 -6.179 136 HG3 LYS 16 HG1 LYS 16 -11.942 -8.590 -4.434 137 HD2 LYS 16 HD2 LYS 16 -12.149 -11.033 -4.929 138 HD3 LYS 16 HD1 LYS 16 -11.761 -10.645 -6.606 139 HE2 LYS 16 HE2 LYS 16 -9.606 -9.823 -5.990 140 HE3 LYS 16 HE1 LYS 16 -9.984 -10.009 -4.275 141 HZ1 LYS 16 HZ1 LYS 16 -9.959 -12.340 -4.469 142 HZ2 LYS 16 HZ2 LYS 16 -8.588 -11.815 -5.315 143 HZ3 LYS 16 HZ3 LYS 16 -9.972 -12.299 -6.161 144 H GLY 17 HN GLY 17 -16.466 -7.053 -4.659 145 HA2 GLY 17 HA2 GLY 17 -18.443 -8.521 -5.928 146 HA3 GLY 17 HA1 GLY 17 -18.641 -8.832 -4.205 147 H GLU 18 HN GLU 18 -20.739 -7.799 -4.725 148 HA GLU 18 HA GLU 18 -20.678 -5.080 -3.859 149 HB2 GLU 18 HB2 GLU 18 -21.866 -4.161 -5.846 150 HB3 GLU 18 HB1 GLU 18 -20.213 -4.644 -6.194 151 HG2 GLU 18 HG2 GLU 18 -22.364 -6.615 -6.682 152 HG3 GLU 18 HG1 GLU 18 -22.228 -5.249 -7.792 153 H THR 19 HN THR 19 -22.800 -4.254 -3.418 154 HA THR 19 HA THR 19 -25.052 -6.050 -3.695 155 HB THR 19 HB THR 19 -23.918 -6.835 -1.603 156 HG1 THR 19 HG1 THR 19 -25.869 -6.812 -0.398 157 HG21 THR 19 HG21 THR 19 -23.001 -4.725 -0.764 158 HG22 THR 19 HG22 THR 19 -24.132 -5.380 0.422 159 HG23 THR 19 HG23 THR 19 -24.627 -4.049 -0.622 160 H THR 20 HN THR 20 -27.019 -4.948 -2.508 161 HA THR 20 HA THR 20 -26.805 -2.044 -2.835 162 HB THR 20 HB THR 20 -29.102 -2.127 -3.922 163 HG1 THR 20 HG1 THR 20 -29.882 -4.125 -3.814 164 HG21 THR 20 HG21 THR 20 -27.142 -1.587 -5.266 165 HG22 THR 20 HG22 THR 20 -28.202 -2.655 -6.185 166 HG23 THR 20 HG23 THR 20 -26.745 -3.299 -5.427 167 H THR 21 HN THR 21 -28.497 -0.814 -1.845 168 HA THR 21 HA THR 21 -30.326 -2.185 -0.069 169 HB THR 21 HB THR 21 -28.173 -1.884 1.280 170 HG1 THR 21 HG1 THR 21 -29.362 -1.406 3.092 171 HG21 THR 21 HG21 THR 21 -27.848 0.409 2.258 172 HG22 THR 21 HG22 THR 21 -29.010 1.034 1.087 173 HG23 THR 21 HG23 THR 21 -27.481 0.348 0.533 174 H GLU 22 HN GLU 22 -32.063 -0.840 0.590 175 HA GLU 22 HA GLU 22 -32.368 1.525 -1.125 176 HB2 GLU 22 HB2 GLU 22 -34.404 -0.038 0.487 177 HB3 GLU 22 HB1 GLU 22 -34.769 1.324 -0.563 178 HG2 GLU 22 HG2 GLU 22 -33.479 -1.229 -1.517 179 HG3 GLU 22 HG1 GLU 22 -35.250 -0.919 -1.546 180 H ALA 23 HN ALA 23 -31.662 3.370 -0.127 181 HA ALA 23 HA ALA 23 -32.176 3.582 2.796 182 HB1 ALA 23 HB1 ALA 23 -30.266 5.036 3.003 183 HB2 ALA 23 HB2 ALA 23 -30.040 5.082 1.258 184 HB3 ALA 23 HB3 ALA 23 -29.756 3.581 2.143 185 H VAL 24 HN VAL 24 -32.781 5.736 3.602 186 HA VAL 24 HA VAL 24 -34.247 7.289 1.587 187 HB VAL 24 HB VAL 24 -35.499 8.241 3.499 188 HG11 VAL 24 HG11 VAL 24 -36.753 6.177 4.052 189 HG12 VAL 24 HG12 VAL 24 -35.465 5.235 3.300 190 HG13 VAL 24 HG13 VAL 24 -36.422 6.350 2.328 191 HG21 VAL 24 HG21 VAL 24 -33.930 6.245 5.130 192 HG22 VAL 24 HG22 VAL 24 -35.295 7.197 5.712 193 HG23 VAL 24 HG23 VAL 24 -33.801 8.002 5.230 194 H ASP 25 HN ASP 25 -31.289 7.419 2.731 195 HA ASP 25 HA ASP 25 -31.018 10.239 2.438 196 HB2 ASP 25 HB2 ASP 25 -31.597 9.529 5.010 197 HB3 ASP 25 HB1 ASP 25 -29.840 9.426 5.025 198 H ALA 26 HN ALA 26 -28.615 10.828 2.728 199 HA ALA 26 HA ALA 26 -27.159 8.847 1.232 200 HB1 ALA 26 HB1 ALA 26 -26.212 11.538 2.215 201 HB2 ALA 26 HB2 ALA 26 -27.038 11.251 0.684 202 HB3 ALA 26 HB3 ALA 26 -25.451 10.538 0.975 203 H ALA 27 HN ALA 27 -26.469 10.601 4.271 204 HA ALA 27 HA ALA 27 -24.174 9.146 4.948 205 HB1 ALA 27 HB1 ALA 27 -24.761 11.293 5.967 206 HB2 ALA 27 HB2 ALA 27 -24.444 10.059 7.188 207 HB3 ALA 27 HB3 ALA 27 -26.103 10.521 6.813 208 H THR 28 HN THR 28 -27.516 8.343 5.296 209 HA THR 28 HA THR 28 -27.281 6.388 7.334 210 HB THR 28 HB THR 28 -29.352 6.399 5.127 211 HG1 THR 28 HG1 THR 28 -29.800 7.662 7.601 212 HG21 THR 28 HG21 THR 28 -29.470 5.489 8.013 213 HG22 THR 28 HG22 THR 28 -29.329 4.421 6.616 214 HG23 THR 28 HG23 THR 28 -30.784 5.394 6.841 215 H ALA 29 HN ALA 29 -26.569 6.348 3.926 216 HA ALA 29 HA ALA 29 -26.714 3.484 3.625 217 HB1 ALA 29 HB1 ALA 29 -25.812 3.852 1.415 218 HB2 ALA 29 HB2 ALA 29 -25.383 5.511 1.827 219 HB3 ALA 29 HB3 ALA 29 -27.080 5.038 1.730 220 H GLU 30 HN GLU 30 -24.287 5.907 4.275 221 HA GLU 30 HA GLU 30 -21.972 4.326 4.044 222 HB2 GLU 30 HB2 GLU 30 -22.251 6.910 4.365 223 HB3 GLU 30 HB1 GLU 30 -22.269 6.517 6.076 224 HG2 GLU 30 HG2 GLU 30 -20.074 5.245 5.578 225 HG3 GLU 30 HG1 GLU 30 -20.046 6.238 4.120 226 H LYS 31 HN LYS 31 -23.694 5.345 6.967 227 HA LYS 31 HA LYS 31 -22.347 3.967 8.876 228 HB2 LYS 31 HB2 LYS 31 -25.329 4.423 8.849 229 HB3 LYS 31 HB1 LYS 31 -24.337 4.129 10.267 230 HG2 LYS 31 HG2 LYS 31 -24.110 6.518 8.444 231 HG3 LYS 31 HG1 LYS 31 -24.923 6.490 10.010 232 HD2 LYS 31 HD2 LYS 31 -22.002 5.854 9.591 233 HD3 LYS 31 HD1 LYS 31 -22.615 7.433 10.078 234 HE2 LYS 31 HE2 LYS 31 -22.988 4.855 11.601 235 HE3 LYS 31 HE1 LYS 31 -21.819 6.114 11.993 236 HZ1 LYS 31 HZ1 LYS 31 -24.771 6.443 11.978 237 HZ2 LYS 31 HZ2 LYS 31 -23.651 7.657 12.344 238 HZ3 LYS 31 HZ3 LYS 31 -23.800 6.302 13.356 239 H VAL 32 HN VAL 32 -24.975 2.648 6.879 240 HA VAL 32 HA VAL 32 -25.090 0.200 8.386 241 HB VAL 32 HB VAL 32 -26.263 0.851 5.672 242 HG11 VAL 32 HG11 VAL 32 -26.915 -1.426 7.538 243 HG12 VAL 32 HG12 VAL 32 -25.971 -1.564 6.056 244 HG13 VAL 32 HG13 VAL 32 -27.671 -1.096 5.978 245 HG21 VAL 32 HG21 VAL 32 -28.369 1.128 6.899 246 HG22 VAL 32 HG22 VAL 32 -27.147 2.292 7.411 247 HG23 VAL 32 HG23 VAL 32 -27.506 0.889 8.419 248 H PHE 33 HN PHE 33 -23.872 1.071 5.146 249 HA PHE 33 HA PHE 33 -22.917 -1.519 4.532 250 HB2 PHE 33 HB2 PHE 33 -22.398 1.204 3.422 251 HB3 PHE 33 HB1 PHE 33 -21.358 -0.120 2.948 252 HD1 PHE 33 HD1 PHE 33 -23.587 1.698 1.485 253 HD2 PHE 33 HD2 PHE 33 -23.337 -2.340 2.818 254 HE1 PHE 33 HE1 PHE 33 -25.212 1.035 -0.238 255 HE2 PHE 33 HE2 PHE 33 -24.961 -3.011 1.089 256 HZ PHE 33 HZ PHE 33 -25.905 -1.329 -0.446 257 H LYS 34 HN LYS 34 -21.620 0.975 6.543 258 HA LYS 34 HA LYS 34 -18.899 0.166 6.399 259 HB2 LYS 34 HB2 LYS 34 -20.484 1.818 8.358 260 HB3 LYS 34 HB1 LYS 34 -18.796 1.478 8.628 261 HG2 LYS 34 HG2 LYS 34 -18.507 2.419 6.209 262 HG3 LYS 34 HG1 LYS 34 -20.077 3.160 6.532 263 HD2 LYS 34 HD2 LYS 34 -18.432 4.767 7.168 264 HD3 LYS 34 HD1 LYS 34 -19.105 4.085 8.645 265 HE2 LYS 34 HE2 LYS 34 -17.190 2.542 8.780 266 HE3 LYS 34 HE1 LYS 34 -16.496 3.322 7.357 267 HZ1 LYS 34 HZ1 LYS 34 -16.530 5.429 8.622 268 HZ2 LYS 34 HZ2 LYS 34 -15.518 4.256 9.306 269 HZ3 LYS 34 HZ3 LYS 34 -17.031 4.569 9.997 270 H GLN 35 HN GLN 35 -21.584 -0.563 8.562 271 HA GLN 35 HA GLN 35 -20.207 -2.348 10.245 272 HB2 GLN 35 HB2 GLN 35 -22.320 -1.540 11.012 273 HB3 GLN 35 HB1 GLN 35 -23.123 -1.985 9.536 274 HG2 GLN 35 HG2 GLN 35 -22.289 -4.411 10.425 275 HG3 GLN 35 HG1 GLN 35 -22.626 -3.534 11.912 276 HE21 GLN 35 HE21 GLN 35 -24.708 -2.943 12.412 277 HE22 GLN 35 HE22 GLN 35 -26.084 -3.523 11.527 278 H TYR 36 HN TYR 36 -21.788 -2.623 7.158 279 HA TYR 36 HA TYR 36 -21.837 -5.432 6.882 280 HB2 TYR 36 HB2 TYR 36 -23.225 -4.155 5.451 281 HB3 TYR 36 HB1 TYR 36 -21.908 -3.093 4.993 282 HD1 TYR 36 HD1 TYR 36 -20.887 -3.377 3.005 283 HD2 TYR 36 HD2 TYR 36 -22.965 -6.675 4.666 284 HE1 TYR 36 HE1 TYR 36 -20.509 -4.623 0.927 285 HE2 TYR 36 HE2 TYR 36 -22.584 -7.964 2.603 286 HH TYR 36 HH TYR 36 -20.387 -6.987 0.206 287 H ALA 37 HN ALA 37 -19.553 -2.990 5.619 288 HA ALA 37 HA ALA 37 -17.740 -4.874 4.520 289 HB1 ALA 37 HB1 ALA 37 -16.206 -2.994 4.312 290 HB2 ALA 37 HB2 ALA 37 -17.217 -2.033 5.390 291 HB3 ALA 37 HB3 ALA 37 -17.832 -2.526 3.815 292 H ASN 38 HN ASN 38 -18.126 -3.449 7.665 293 HA ASN 38 HA ASN 38 -15.594 -4.071 8.751 294 HB2 ASN 38 HB2 ASN 38 -17.191 -2.459 9.791 295 HB3 ASN 38 HB1 ASN 38 -18.246 -3.807 10.221 296 HD21 ASN 38 HD21 ASN 38 -17.713 -5.123 11.962 297 HD22 ASN 38 HD22 ASN 38 -16.382 -4.738 13.080 298 H ASP 39 HN ASP 39 -18.397 -6.003 8.163 299 HA ASP 39 HA ASP 39 -17.649 -8.118 9.958 300 HB2 ASP 39 HB2 ASP 39 -19.924 -7.546 8.220 301 HB3 ASP 39 HB1 ASP 39 -19.467 -9.247 8.231 302 H ASN 40 HN ASN 40 -17.058 -7.412 6.564 303 HA ASN 40 HA ASN 40 -16.066 -10.136 6.205 304 HB2 ASN 40 HB2 ASN 40 -15.606 -9.236 3.794 305 HB3 ASN 40 HB1 ASN 40 -17.235 -9.679 4.272 306 HD21 ASN 40 HD21 ASN 40 -18.811 -8.146 4.353 307 HD22 ASN 40 HD22 ASN 40 -18.545 -6.475 3.842 308 H GLY 41 HN GLY 41 -14.964 -7.208 7.242 309 HA2 GLY 41 HA2 GLY 41 -12.848 -6.675 7.989 310 HA3 GLY 41 HA1 GLY 41 -12.266 -8.180 7.302 311 H VAL 42 HN VAL 42 -13.962 -5.715 5.440 312 HA VAL 42 HA VAL 42 -11.479 -5.289 3.958 313 HB VAL 42 HB VAL 42 -14.342 -4.838 3.102 314 HG11 VAL 42 HG11 VAL 42 -13.352 -4.327 0.879 315 HG12 VAL 42 HG12 VAL 42 -11.747 -4.396 1.608 316 HG13 VAL 42 HG13 VAL 42 -12.891 -3.157 2.117 317 HG21 VAL 42 HG21 VAL 42 -12.274 -6.894 2.349 318 HG22 VAL 42 HG22 VAL 42 -13.769 -6.630 1.448 319 HG23 VAL 42 HG23 VAL 42 -13.833 -7.168 3.133 320 H ASP 43 HN ASP 43 -10.471 -3.444 4.213 321 HA ASP 43 HA ASP 43 -12.040 -1.066 4.886 322 HB2 ASP 43 HB2 ASP 43 -10.976 -1.982 6.989 323 HB3 ASP 43 HB1 ASP 43 -9.402 -1.700 6.246 324 H GLY 44 HN GLY 44 -11.322 0.819 3.908 325 HA2 GLY 44 HA2 GLY 44 -8.814 1.240 2.779 326 HA3 GLY 44 HA1 GLY 44 -9.832 0.529 1.532 327 H GLU 45 HN GLU 45 -9.315 2.713 0.576 328 HA GLU 45 HA GLU 45 -10.369 5.109 1.616 329 HB2 GLU 45 HB2 GLU 45 -8.832 4.398 -0.539 330 HB3 GLU 45 HB1 GLU 45 -10.346 4.836 -1.320 331 HG2 GLU 45 HG2 GLU 45 -8.843 6.597 0.607 332 HG3 GLU 45 HG1 GLU 45 -8.701 6.688 -1.146 333 H TRP 46 HN TRP 46 -12.303 6.206 1.176 334 HA TRP 46 HA TRP 46 -14.509 4.457 0.287 335 HB2 TRP 46 HB2 TRP 46 -14.330 6.331 2.598 336 HB3 TRP 46 HB1 TRP 46 -15.858 6.276 1.742 337 HD1 TRP 46 HD1 TRP 46 -13.375 3.784 3.366 338 HE1 TRP 46 HE1 TRP 46 -14.714 1.878 4.457 339 HE3 TRP 46 HE3 TRP 46 -18.135 5.202 1.991 340 HZ2 TRP 46 HZ2 TRP 46 -17.409 1.102 4.722 341 HZ3 TRP 46 HZ3 TRP 46 -20.019 3.824 2.727 342 HH2 TRP 46 HH2 TRP 46 -19.661 1.804 4.054 343 H THR 47 HN THR 47 -14.845 5.025 -1.735 344 HA THR 47 HA THR 47 -14.887 7.866 -2.463 345 HB THR 47 HB THR 47 -14.828 6.906 -4.850 346 HG1 THR 47 HG1 THR 47 -13.967 4.605 -3.400 347 HG21 THR 47 HG21 THR 47 -12.395 6.635 -4.778 348 HG22 THR 47 HG22 THR 47 -12.465 6.479 -3.022 349 HG23 THR 47 HG23 THR 47 -12.917 8.000 -3.792 350 H TYR 48 HN TYR 48 -16.565 8.505 -4.106 351 HA TYR 48 HA TYR 48 -18.975 6.893 -4.071 352 HB2 TYR 48 HB2 TYR 48 -19.446 7.996 -2.045 353 HB3 TYR 48 HB1 TYR 48 -18.836 9.533 -2.596 354 HD1 TYR 48 HD1 TYR 48 -21.714 7.184 -2.725 355 HD2 TYR 48 HD2 TYR 48 -20.244 11.025 -3.879 356 HE1 TYR 48 HE1 TYR 48 -23.980 7.878 -3.324 357 HE2 TYR 48 HE2 TYR 48 -22.529 11.714 -4.479 358 HH TYR 48 HH TYR 48 -25.272 9.928 -3.568 359 H ASP 49 HN ASP 49 -20.393 7.364 -5.736 360 HA ASP 49 HA ASP 49 -19.645 9.638 -7.484 361 HB2 ASP 49 HB2 ASP 49 -18.883 7.352 -8.432 362 HB3 ASP 49 HB1 ASP 49 -20.591 6.996 -8.635 363 H ASP 50 HN ASP 50 -21.456 10.591 -8.587 364 HA ASP 50 HA ASP 50 -23.898 10.200 -6.989 365 HB2 ASP 50 HB2 ASP 50 -22.952 12.517 -7.208 366 HB3 ASP 50 HB1 ASP 50 -23.258 12.435 -8.940 367 H ALA 51 HN ALA 51 -22.642 9.550 -10.110 368 HA ALA 51 HA ALA 51 -25.112 9.678 -11.541 369 HB1 ALA 51 HB1 ALA 51 -23.932 8.578 -13.341 370 HB2 ALA 51 HB2 ALA 51 -22.603 8.166 -12.254 371 HB3 ALA 51 HB3 ALA 51 -22.931 9.853 -12.647 372 H THR 52 HN THR 52 -23.394 7.120 -9.831 373 HA THR 52 HA THR 52 -25.647 5.338 -10.438 374 HB THR 52 HB THR 52 -23.996 3.485 -9.952 375 HG1 THR 52 HG1 THR 52 -22.120 4.107 -9.227 376 HG21 THR 52 HG21 THR 52 -24.647 4.141 -12.247 377 HG22 THR 52 HG22 THR 52 -22.976 3.585 -12.158 378 HG23 THR 52 HG23 THR 52 -23.325 5.310 -12.270 379 H LYS 53 HN LYS 53 -24.674 7.220 -7.989 380 HA LYS 53 HA LYS 53 -24.805 7.176 -5.667 381 HB2 LYS 53 HB2 LYS 53 -27.108 5.594 -6.680 382 HB3 LYS 53 HB1 LYS 53 -26.757 5.469 -4.964 383 HG2 LYS 53 HG2 LYS 53 -28.457 7.190 -5.577 384 HG3 LYS 53 HG1 LYS 53 -27.096 7.791 -4.632 385 HD2 LYS 53 HD2 LYS 53 -26.091 8.752 -6.591 386 HD3 LYS 53 HD1 LYS 53 -27.303 8.004 -7.635 387 HE2 LYS 53 HE2 LYS 53 -27.985 9.962 -5.456 388 HE3 LYS 53 HE1 LYS 53 -27.632 10.453 -7.114 389 HZ1 LYS 53 HZ1 LYS 53 -30.041 10.135 -6.560 390 HZ2 LYS 53 HZ2 LYS 53 -29.731 8.469 -6.440 391 HZ3 LYS 53 HZ3 LYS 53 -29.483 9.278 -7.913 392 H THR 54 HN THR 54 -22.720 5.738 -6.427 393 HA THR 54 HA THR 54 -22.935 3.161 -5.061 394 HB THR 54 HB THR 54 -20.858 3.902 -7.124 395 HG1 THR 54 HG1 THR 54 -23.483 3.320 -7.442 396 HG21 THR 54 HG21 THR 54 -21.796 1.215 -6.056 397 HG22 THR 54 HG22 THR 54 -20.291 2.019 -5.602 398 HG23 THR 54 HG23 THR 54 -20.532 1.467 -7.261 399 H TYR 55 HN TYR 55 -21.936 3.041 -3.188 400 HA TYR 55 HA TYR 55 -19.681 4.792 -2.557 401 HB2 TYR 55 HB2 TYR 55 -21.268 2.796 -0.890 402 HB3 TYR 55 HB1 TYR 55 -19.714 3.419 -0.350 403 HD1 TYR 55 HD1 TYR 55 -23.198 4.323 -1.098 404 HD2 TYR 55 HD2 TYR 55 -19.490 5.682 0.499 405 HE1 TYR 55 HE1 TYR 55 -24.334 6.278 -0.124 406 HE2 TYR 55 HE2 TYR 55 -20.615 7.626 1.471 407 HH TYR 55 HH TYR 55 -23.987 7.893 1.714 408 H THR 56 HN THR 56 -17.586 4.078 -2.709 409 HA THR 56 HA THR 56 -17.251 1.213 -3.323 410 HB THR 56 HB THR 56 -15.731 3.470 -4.646 411 HG1 THR 56 HG1 THR 56 -18.158 2.546 -5.138 412 HG21 THR 56 HG21 THR 56 -15.739 0.481 -5.116 413 HG22 THR 56 HG22 THR 56 -14.389 1.452 -4.524 414 HG23 THR 56 HG23 THR 56 -14.967 1.656 -6.181 415 H VAL 57 HN VAL 57 -15.822 0.176 -2.131 416 HA VAL 57 HA VAL 57 -13.822 1.746 -0.646 417 HB VAL 57 HB VAL 57 -15.482 0.732 0.929 418 HG11 VAL 57 HG11 VAL 57 -16.167 -1.273 -0.164 419 HG12 VAL 57 HG12 VAL 57 -15.350 -1.743 1.324 420 HG13 VAL 57 HG13 VAL 57 -14.512 -1.878 -0.219 421 HG21 VAL 57 HG21 VAL 57 -12.725 -0.466 1.124 422 HG22 VAL 57 HG22 VAL 57 -13.862 -0.243 2.454 423 HG23 VAL 57 HG23 VAL 57 -13.181 1.160 1.631 424 H THR 58 HN THR 58 -11.874 1.444 -1.410 425 HA THR 58 HA THR 58 -11.327 -1.075 -2.825 426 HB THR 58 HB THR 58 -9.933 1.481 -3.534 427 HG1 THR 58 HG1 THR 58 -12.601 0.743 -4.084 428 HG21 THR 58 HG21 THR 58 -10.871 -0.778 -5.328 429 HG22 THR 58 HG22 THR 58 -9.302 -0.786 -4.507 430 HG23 THR 58 HG23 THR 58 -9.672 0.478 -5.677 431 H GLU 59 HN GLU 59 -9.673 -2.233 -2.186 432 HA GLU 59 HA GLU 59 -7.970 -1.289 -0.045 433 HB2 GLU 59 HB2 GLU 59 -7.927 -3.924 -1.563 434 HB3 GLU 59 HB1 GLU 59 -6.904 -3.560 -0.211 435 HG2 GLU 59 HG2 GLU 59 -9.062 -3.255 1.142 436 HG3 GLU 59 HG1 GLU 59 -9.856 -4.069 -0.207 437 H GLY 60 HN GLY 60 -5.596 -1.225 -0.195 438 HA2 GLY 60 HA2 GLY 60 -3.871 -1.663 -2.128 439 HA3 GLY 60 HA1 GLY 60 -4.746 -0.322 -2.857 440 H SER 61 HN SER 61 -2.110 0.020 -2.486 441 HA SER 61 HA SER 61 -1.848 1.556 0.012 442 HB2 SER 61 HB2 SER 61 -0.165 -0.223 -0.406 443 HB3 SER 61 HB1 SER 61 0.322 0.613 -1.881 444 HG SER 61 HG SER 61 1.243 0.994 0.537 445 H GLY 62 HN GLY 62 -1.593 1.742 -3.481 446 HA2 GLY 62 HA2 GLY 62 -1.916 3.601 -4.827 447 HA3 GLY 62 HA1 GLY 62 -2.005 4.597 -3.383 448 H GLY 63 HN GLY 63 0.283 4.527 -2.160 449 HA2 GLY 63 HA2 GLY 63 2.097 5.823 -3.952 450 HA3 GLY 63 HA1 GLY 63 2.389 5.477 -2.252 451 H ALA 64 HN ALA 64 2.113 2.711 -2.272 452 HA ALA 64 HA ALA 64 4.589 1.927 -3.544 453 HB1 ALA 64 HB1 ALA 64 2.686 0.335 -1.816 454 HB2 ALA 64 HB2 ALA 64 4.129 1.186 -1.261 455 HB3 ALA 64 HB3 ALA 64 4.282 -0.191 -2.350 456 H GLY 65 HN GLY 65 4.356 1.678 -5.709 457 HA2 GLY 65 HA2 GLY 65 2.624 -0.478 -6.617 458 HA3 GLY 65 HA1 GLY 65 2.271 1.116 -7.274 459 H GLY 66 HN GLY 66 5.446 -0.210 -6.494 460 HA2 GLY 66 HA2 GLY 66 6.317 0.404 -9.205 461 HA3 GLY 66 HA1 GLY 66 7.343 -0.082 -7.863 462 H GLN 67 HN GLN 67 5.418 -2.331 -7.319 463 HA GLN 67 HA GLN 67 5.124 -4.520 -7.823 464 HB2 GLN 67 HB2 GLN 67 5.609 -3.567 -10.665 465 HB3 GLN 67 HB1 GLN 67 5.096 -5.213 -10.225 466 HG2 GLN 67 HG2 GLN 67 3.073 -4.264 -9.185 467 HG3 GLN 67 HG1 GLN 67 3.562 -2.659 -9.731 468 HE21 GLN 67 HE21 GLN 67 1.200 -4.291 -10.391 469 HE22 GLN 67 HE22 GLN 67 1.204 -4.436 -12.114 470 H GLY 68 HN GLY 68 6.402 -6.216 -9.619 471 HA2 GLY 68 HA2 GLY 68 8.958 -6.280 -10.165 472 HA3 GLY 68 HA1 GLY 68 9.062 -6.258 -8.409 473 H MET 69 HN MET 69 9.305 -8.256 -7.528 474 HA MET 69 HA MET 69 7.629 -10.417 -8.496 475 HB2 MET 69 HB2 MET 69 9.777 -10.469 -9.864 476 HB3 MET 69 HB1 MET 69 10.631 -10.823 -8.367 477 HG2 MET 69 HG2 MET 69 9.315 -12.876 -8.113 478 HG3 MET 69 HG1 MET 69 8.467 -12.511 -9.615 479 HE1 MET 69 HE1 MET 69 12.976 -13.473 -9.349 480 HE2 MET 69 HE2 MET 69 11.882 -13.447 -7.964 481 HE3 MET 69 HE3 MET 69 12.279 -11.948 -8.801 482 H ILE 70 HN ILE 70 7.942 -12.384 -7.029 483 HA ILE 70 HA ILE 70 8.790 -11.605 -4.356 484 HB ILE 70 HB ILE 70 6.018 -12.694 -4.940 485 HG12 ILE 70 HG12 ILE 70 6.879 -10.078 -3.685 486 HG13 ILE 70 HG11 ILE 70 6.288 -10.269 -5.334 487 HG21 ILE 70 HG21 ILE 70 7.052 -13.687 -2.890 488 HG22 ILE 70 HG22 ILE 70 5.631 -12.702 -2.542 489 HG23 ILE 70 HG23 ILE 70 7.242 -12.058 -2.239 490 HD11 ILE 70 HD11 ILE 70 4.730 -10.817 -2.815 491 HD12 ILE 70 HD12 ILE 70 4.137 -11.043 -4.462 492 HD13 ILE 70 HD13 ILE 70 4.540 -9.426 -3.886 493 H GLN 71 HN GLN 71 10.440 -13.136 -4.371 494 HA GLN 71 HA GLN 71 9.590 -15.937 -4.690 495 HB2 GLN 71 HB2 GLN 71 11.869 -16.448 -5.479 496 HB3 GLN 71 HB1 GLN 71 11.040 -15.335 -6.550 497 HG2 GLN 71 HG2 GLN 71 12.279 -13.482 -5.696 498 HG3 GLN 71 HG1 GLN 71 13.002 -14.480 -4.436 499 HE21 GLN 71 HE21 GLN 71 13.438 -16.749 -6.182 500 HE22 GLN 71 HE22 GLN 71 14.757 -16.321 -7.214 501 H GLU 72 HN GLU 72 10.193 -13.760 -2.569 502 HA GLU 72 HA GLU 72 12.158 -14.979 -0.881 503 HB2 GLU 72 HB2 GLU 72 10.158 -12.763 -0.340 504 HB3 GLU 72 HB1 GLU 72 11.442 -13.241 0.758 505 HG2 GLU 72 HG2 GLU 72 12.432 -11.463 -0.250 506 HG3 GLU 72 HG1 GLU 72 12.971 -12.752 -1.318 507 HA PRO 73 HA PRO 73 9.692 -17.920 1.273 508 HB2 PRO 73 HB2 PRO 73 10.618 -17.564 3.854 509 HB3 PRO 73 HB1 PRO 73 11.455 -18.524 2.596 510 HG2 PRO 73 HG2 PRO 73 11.957 -15.696 3.479 511 HG3 PRO 73 HG1 PRO 73 13.124 -16.968 3.065 512 HD2 PRO 73 HD2 PRO 73 12.535 -14.990 1.358 513 HD3 PRO 73 HD1 PRO 73 12.852 -16.662 0.788 514 H ALA 74 HN ALA 74 8.530 -18.156 3.494 515 HA ALA 74 HA ALA 74 7.046 -15.690 4.021 516 HB1 ALA 74 HB1 ALA 74 5.806 -18.415 3.683 517 HB2 ALA 74 HB2 ALA 74 5.730 -17.103 2.505 518 HB3 ALA 74 HB3 ALA 74 4.948 -16.927 4.076 519 H LEU 75 HN LEU 75 5.419 -16.342 5.985 520 HA LEU 75 HA LEU 75 7.232 -16.845 8.174 521 HB2 LEU 75 HB2 LEU 75 4.485 -15.769 7.894 522 HB3 LEU 75 HB1 LEU 75 4.910 -16.488 9.428 523 HG LEU 75 HG LEU 75 5.222 -14.069 9.468 524 HD11 LEU 75 HD11 LEU 75 7.812 -15.609 9.522 525 HD12 LEU 75 HD12 LEU 75 6.677 -15.411 10.860 526 HD13 LEU 75 HD13 LEU 75 7.554 -14.016 10.230 527 HD21 LEU 75 HD21 LEU 75 5.678 -13.706 7.106 528 HD22 LEU 75 HD22 LEU 75 7.221 -14.548 7.268 529 HD23 LEU 75 HD23 LEU 75 6.960 -13.018 8.107 530 HA PRO 76 HA PRO 76 5.995 -21.143 8.650 531 HB2 PRO 76 HB2 PRO 76 6.894 -20.713 11.470 532 HB3 PRO 76 HB1 PRO 76 7.450 -21.937 10.321 533 HG2 PRO 76 HG2 PRO 76 9.022 -19.896 10.961 534 HG3 PRO 76 HG1 PRO 76 8.906 -20.468 9.257 535 HD2 PRO 76 HD2 PRO 76 7.554 -18.050 10.526 536 HD3 PRO 76 HD1 PRO 76 8.387 -18.194 8.965 537 HA PRO 77 HA PRO 77 2.006 -20.856 10.589 538 HB2 PRO 77 HB2 PRO 77 1.705 -23.265 11.820 539 HB3 PRO 77 HB1 PRO 77 1.624 -23.079 10.064 540 HG2 PRO 77 HG2 PRO 77 3.950 -23.862 11.774 541 HG3 PRO 77 HG1 PRO 77 3.318 -24.687 10.327 542 HD2 PRO 77 HD2 PRO 77 5.441 -23.066 10.088 543 HD3 PRO 77 HD1 PRO 77 4.121 -23.016 8.863 544 H GLY 78 HN GLY 78 1.375 -19.827 12.361 545 HA2 GLY 78 HA2 GLY 78 1.228 -19.498 14.709 546 HA3 GLY 78 HA1 GLY 78 2.739 -20.373 14.904 547 H TRP 79 HN TRP 79 4.053 -18.784 12.726 548 HA TRP 79 HA TRP 79 4.745 -16.468 14.392 549 HB2 TRP 79 HB2 TRP 79 5.929 -17.555 11.814 550 HB3 TRP 79 HB1 TRP 79 6.472 -16.069 12.577 551 HD1 TRP 79 HD1 TRP 79 6.406 -19.872 13.204 552 HE1 TRP 79 HE1 TRP 79 8.291 -20.445 14.859 553 HE3 TRP 79 HE3 TRP 79 7.946 -15.129 14.345 554 HZ2 TRP 79 HZ2 TRP 79 10.180 -19.062 16.442 555 HZ3 TRP 79 HZ3 TRP 79 9.792 -14.840 15.937 556 HH2 TRP 79 HH2 TRP 79 10.889 -16.768 16.964 557 H GLU 80 HN GLU 80 3.774 -14.489 14.052 558 HA GLU 80 HA GLU 80 2.506 -14.086 11.427 559 HB2 GLU 80 HB2 GLU 80 1.843 -12.736 14.056 560 HB3 GLU 80 HB1 GLU 80 0.979 -12.510 12.543 561 HG2 GLU 80 HG2 GLU 80 0.620 -15.076 12.679 562 HG3 GLU 80 HG1 GLU 80 1.006 -14.855 14.385 563 H MET 81 HN MET 81 2.649 -12.067 10.426 564 HA MET 81 HA MET 81 4.888 -10.401 11.356 565 HB2 MET 81 HB2 MET 81 5.850 -11.350 9.511 566 HB3 MET 81 HB1 MET 81 4.299 -11.561 8.677 567 HG2 MET 81 HG2 MET 81 4.263 -9.219 8.133 568 HG3 MET 81 HG1 MET 81 5.739 -8.938 9.049 569 HE1 MET 81 HE1 MET 81 6.505 -8.604 5.089 570 HE2 MET 81 HE2 MET 81 6.367 -7.683 6.589 571 HE3 MET 81 HE3 MET 81 4.924 -8.355 5.830 572 H LYS 82 HN LYS 82 4.451 -8.228 11.547 573 HA LYS 82 HA LYS 82 2.134 -7.106 10.208 574 HB2 LYS 82 HB2 LYS 82 2.305 -6.958 13.240 575 HB3 LYS 82 HB1 LYS 82 1.051 -6.273 12.233 576 HG2 LYS 82 HG2 LYS 82 0.399 -8.601 11.567 577 HG3 LYS 82 HG1 LYS 82 1.571 -9.201 12.780 578 HD2 LYS 82 HD2 LYS 82 0.344 -7.941 14.522 579 HD3 LYS 82 HD1 LYS 82 -0.824 -7.419 13.308 580 HE2 LYS 82 HE2 LYS 82 -1.901 -9.222 14.279 581 HE3 LYS 82 HE1 LYS 82 -1.133 -9.956 12.876 582 HZ1 LYS 82 HZ1 LYS 82 -0.758 -11.363 14.718 583 HZ2 LYS 82 HZ2 LYS 82 -0.227 -10.073 15.687 584 HZ3 LYS 82 HZ3 LYS 82 0.715 -10.594 14.382 585 H TYR 83 HN TYR 83 2.104 -4.698 10.397 586 HA TYR 83 HA TYR 83 4.868 -3.693 10.802 587 HB2 TYR 83 HB2 TYR 83 2.644 -2.706 8.982 588 HB3 TYR 83 HB1 TYR 83 4.158 -1.811 9.249 589 HD1 TYR 83 HD1 TYR 83 6.241 -2.630 8.303 590 HD2 TYR 83 HD2 TYR 83 2.575 -4.679 7.601 591 HE1 TYR 83 HE1 TYR 83 7.263 -3.795 6.395 592 HE2 TYR 83 HE2 TYR 83 3.593 -5.860 5.699 593 HH TYR 83 HH TYR 83 5.426 -5.533 4.114 594 H THR 84 HN THR 84 5.117 -1.482 11.547 595 HA THR 84 HA THR 84 2.910 -0.563 13.256 596 HB THR 84 HB THR 84 4.450 0.623 14.581 597 HG1 THR 84 HG1 THR 84 6.243 1.522 13.817 598 HG21 THR 84 HG21 THR 84 4.818 -1.727 14.943 599 HG22 THR 84 HG22 THR 84 6.361 -0.885 15.042 600 HG23 THR 84 HG23 THR 84 5.946 -1.805 13.593 601 H SER 85 HN SER 85 3.022 2.078 13.321 602 HA SER 85 HA SER 85 2.356 2.790 10.607 603 HB2 SER 85 HB2 SER 85 1.814 5.041 11.772 604 HB3 SER 85 HB1 SER 85 0.816 3.635 12.139 605 HG SER 85 HG SER 85 3.090 4.159 13.721 606 H GLU 86 HN GLU 86 5.247 2.541 11.889 607 HA GLU 86 HA GLU 86 6.273 5.103 10.769 608 HB2 GLU 86 HB2 GLU 86 7.720 3.177 12.630 609 HB3 GLU 86 HB1 GLU 86 8.300 4.751 12.109 610 HG2 GLU 86 HG2 GLU 86 7.562 5.116 14.275 611 HG3 GLU 86 HG1 GLU 86 6.207 5.671 13.291 612 H GLY 87 HN GLY 87 5.695 2.026 9.923 613 HA2 GLY 87 HA2 GLY 87 6.395 0.955 7.970 614 HA3 GLY 87 HA1 GLY 87 7.787 2.026 7.910 615 H VAL 88 HN VAL 88 7.430 0.751 10.991 616 HA VAL 88 HA VAL 88 9.774 -0.889 10.630 617 HB VAL 88 HB VAL 88 8.176 -0.282 13.126 618 HG11 VAL 88 HG11 VAL 88 10.872 -1.605 12.842 619 HG12 VAL 88 HG12 VAL 88 9.376 -2.404 13.324 620 HG13 VAL 88 HG13 VAL 88 10.089 -1.167 14.359 621 HG21 VAL 88 HG21 VAL 88 9.981 1.244 13.680 622 HG22 VAL 88 HG22 VAL 88 9.288 1.672 12.114 623 HG23 VAL 88 HG23 VAL 88 10.827 0.815 12.193 624 H ARG 89 HN ARG 89 9.922 -3.049 10.856 625 HA ARG 89 HA ARG 89 7.437 -4.571 10.539 626 HB2 ARG 89 HB2 ARG 89 9.264 -4.662 8.814 627 HB3 ARG 89 HB1 ARG 89 10.306 -5.385 10.023 628 HG2 ARG 89 HG2 ARG 89 8.791 -7.305 10.169 629 HG3 ARG 89 HG1 ARG 89 7.772 -6.580 8.917 630 HD2 ARG 89 HD2 ARG 89 9.801 -6.531 7.438 631 HD3 ARG 89 HD1 ARG 89 10.640 -7.479 8.664 632 HE ARG 89 HE ARG 89 8.169 -8.653 7.785 633 HH11 ARG 89 HH11 ARG 89 11.622 -8.421 7.230 634 HH12 ARG 89 HH12 ARG 89 11.684 -9.852 6.257 635 HH21 ARG 89 HH21 ARG 89 8.256 -10.563 6.531 636 HH22 ARG 89 HH22 ARG 89 9.770 -11.066 5.845 637 H TYR 90 HN TYR 90 6.698 -5.622 12.335 638 HA TYR 90 HA TYR 90 8.735 -6.692 14.169 639 HB2 TYR 90 HB2 TYR 90 7.419 -6.243 16.121 640 HB3 TYR 90 HB1 TYR 90 7.586 -4.750 15.236 641 HD1 TYR 90 HD1 TYR 90 5.626 -3.915 13.887 642 HD2 TYR 90 HD2 TYR 90 5.292 -7.115 16.669 643 HE1 TYR 90 HE1 TYR 90 3.184 -3.634 13.904 644 HE2 TYR 90 HE2 TYR 90 2.849 -6.837 16.701 645 HH TYR 90 HH TYR 90 1.198 -4.987 14.393 646 H PHE 91 HN PHE 91 7.979 -8.699 15.360 647 HA PHE 91 HA PHE 91 5.994 -10.096 13.708 648 HB2 PHE 91 HB2 PHE 91 8.637 -11.170 14.717 649 HB3 PHE 91 HB1 PHE 91 7.352 -12.188 14.078 650 HD1 PHE 91 HD1 PHE 91 6.920 -12.370 11.765 651 HD2 PHE 91 HD2 PHE 91 9.768 -9.509 13.164 652 HE1 PHE 91 HE1 PHE 91 7.695 -12.005 9.468 653 HE2 PHE 91 HE2 PHE 91 10.517 -9.143 10.866 654 HZ PHE 91 HZ PHE 91 9.492 -10.393 9.013 655 H VAL 92 HN VAL 92 4.888 -11.804 14.668 656 HA VAL 92 HA VAL 92 4.611 -11.492 17.590 657 HB VAL 92 HB VAL 92 2.461 -12.184 15.574 658 HG11 VAL 92 HG11 VAL 92 2.281 -11.636 18.529 659 HG12 VAL 92 HG12 VAL 92 1.971 -13.170 17.712 660 HG13 VAL 92 HG13 VAL 92 0.901 -11.794 17.440 661 HG21 VAL 92 HG21 VAL 92 1.550 -9.983 15.985 662 HG22 VAL 92 HG22 VAL 92 3.193 -9.859 15.360 663 HG23 VAL 92 HG23 VAL 92 2.878 -9.611 17.077 664 H ASP 93 HN ASP 93 5.659 -13.260 18.386 665 HA ASP 93 HA ASP 93 5.398 -15.862 17.090 666 HB2 ASP 93 HB2 ASP 93 7.494 -15.384 18.241 667 HB3 ASP 93 HB1 ASP 93 6.649 -15.025 19.744 668 H HIS 94 HN HIS 94 3.716 -17.296 17.555 669 HA HIS 94 HA HIS 94 1.705 -16.231 19.334 670 HB2 HIS 94 HB2 HIS 94 1.343 -17.142 16.953 671 HB3 HIS 94 HB1 HIS 94 1.383 -18.729 17.713 672 HD1 HIS 94 HD1 HIS 94 -0.960 -19.501 17.880 673 HD2 HIS 94 HD2 HIS 94 -0.581 -15.467 18.805 674 HE1 HIS 94 HE1 HIS 94 -3.257 -18.738 18.561 675 HE2 HIS 94 HE2 HIS 94 -3.035 -16.247 18.906 676 H ASN 95 HN ASN 95 4.179 -18.580 19.664 677 HA ASN 95 HA ASN 95 2.569 -20.143 21.529 678 HB2 ASN 95 HB2 ASN 95 4.400 -21.713 21.690 679 HB3 ASN 95 HB1 ASN 95 4.153 -21.324 19.996 680 HD21 ASN 95 HD21 ASN 95 5.760 -20.387 18.854 681 HD22 ASN 95 HD22 ASN 95 7.338 -20.072 19.486 682 H THR 96 HN THR 96 5.267 -17.838 21.652 683 HA THR 96 HA THR 96 5.296 -18.047 24.557 684 HB THR 96 HB THR 96 7.021 -16.212 24.422 685 HG1 THR 96 HG1 THR 96 6.753 -16.709 21.611 686 HG21 THR 96 HG21 THR 96 7.655 -18.696 22.816 687 HG22 THR 96 HG22 THR 96 7.661 -18.580 24.576 688 HG23 THR 96 HG23 THR 96 8.814 -17.644 23.626 689 H ARG 97 HN ARG 97 3.833 -16.196 22.080 690 HA ARG 97 HA ARG 97 2.281 -14.518 22.080 691 HB2 ARG 97 HB2 ARG 97 2.060 -15.121 25.036 692 HB3 ARG 97 HB1 ARG 97 0.924 -14.161 24.087 693 HG2 ARG 97 HG2 ARG 97 0.363 -16.070 22.740 694 HG3 ARG 97 HG1 ARG 97 1.587 -17.034 23.563 695 HD2 ARG 97 HD2 ARG 97 -0.867 -15.830 24.820 696 HD3 ARG 97 HD1 ARG 97 -0.665 -17.524 24.390 697 HE ARG 97 HE ARG 97 1.355 -16.537 26.195 698 HH11 ARG 97 HH11 ARG 97 -1.846 -17.939 25.935 699 HH12 ARG 97 HH12 ARG 97 -1.845 -18.554 27.556 700 HH21 ARG 97 HH21 ARG 97 1.383 -17.368 28.309 701 HH22 ARG 97 HH22 ARG 97 0.009 -18.247 28.918 702 H THR 98 HN THR 98 4.785 -13.888 22.066 703 HA THR 98 HA THR 98 4.940 -11.351 23.553 704 HB THR 98 HB THR 98 7.397 -13.102 23.138 705 HG1 THR 98 HG1 THR 98 5.479 -13.706 24.732 706 HG21 THR 98 HG21 THR 98 6.854 -10.646 24.831 707 HG22 THR 98 HG22 THR 98 7.981 -10.776 23.478 708 HG23 THR 98 HG23 THR 98 8.300 -11.640 24.981 709 H THR 99 HN THR 99 5.852 -9.619 22.270 710 HA THR 99 HA THR 99 6.037 -10.229 19.421 711 HB THR 99 HB THR 99 6.429 -7.605 19.423 712 HG1 THR 99 HG1 THR 99 4.855 -7.444 21.667 713 HG21 THR 99 HG21 THR 99 4.386 -8.606 18.503 714 HG22 THR 99 HG22 THR 99 3.932 -7.249 19.542 715 HG23 THR 99 HG23 THR 99 3.766 -8.902 20.128 716 H THR 100 HN THR 100 7.911 -9.898 18.156 717 HA THR 100 HA THR 100 10.311 -8.920 19.437 718 HB THR 100 HB THR 100 10.265 -11.335 20.039 719 HG1 THR 100 HG1 THR 100 12.247 -9.976 19.321 720 HG21 THR 100 HG21 THR 100 9.092 -12.198 18.073 721 HG22 THR 100 HG22 THR 100 10.643 -13.008 18.283 722 HG23 THR 100 HG23 THR 100 10.465 -11.757 17.056 723 H PHE 101 HN PHE 101 12.011 -8.487 17.948 724 HA PHE 101 HA PHE 101 11.070 -8.124 15.189 725 HB2 PHE 101 HB2 PHE 101 13.434 -6.929 16.700 726 HB3 PHE 101 HB1 PHE 101 13.048 -6.607 14.958 727 HD1 PHE 101 HD1 PHE 101 11.611 -4.888 14.407 728 HD2 PHE 101 HD2 PHE 101 11.647 -6.309 18.418 729 HE1 PHE 101 HE1 PHE 101 10.156 -3.025 15.077 730 HE2 PHE 101 HE2 PHE 101 10.184 -4.450 19.094 731 HZ PHE 101 HZ PHE 101 9.437 -2.804 17.418 732 H LYS 102 HN LYS 102 11.486 -9.983 14.083 733 HA LYS 102 HA LYS 102 14.239 -10.998 14.161 734 HB2 LYS 102 HB2 LYS 102 12.578 -12.355 15.554 735 HB3 LYS 102 HB1 LYS 102 11.850 -12.827 14.023 736 HG2 LYS 102 HG2 LYS 102 13.377 -14.534 14.786 737 HG3 LYS 102 HG1 LYS 102 13.996 -13.785 13.312 738 HD2 LYS 102 HD2 LYS 102 15.787 -14.095 14.946 739 HD3 LYS 102 HD1 LYS 102 15.491 -12.382 14.653 740 HE2 LYS 102 HE2 LYS 102 14.162 -12.269 16.708 741 HE3 LYS 102 HE1 LYS 102 14.477 -13.977 17.003 742 HZ1 LYS 102 HZ1 LYS 102 16.819 -13.509 17.209 743 HZ2 LYS 102 HZ2 LYS 102 15.955 -12.503 18.269 744 HZ3 LYS 102 HZ3 LYS 102 16.569 -11.874 16.827 745 H ASP 103 HN ASP 103 14.943 -10.448 12.186 746 HA ASP 103 HA ASP 103 13.211 -10.925 9.872 747 HB2 ASP 103 HB2 ASP 103 14.309 -8.688 10.136 748 HB3 ASP 103 HB1 ASP 103 15.870 -9.479 9.957 749 HA PRO 104 HA PRO 104 15.358 -14.659 8.920 750 HB2 PRO 104 HB2 PRO 104 14.761 -14.828 6.251 751 HB3 PRO 104 HB1 PRO 104 13.588 -15.194 7.525 752 HG2 PRO 104 HG2 PRO 104 13.953 -12.674 5.945 753 HG3 PRO 104 HG1 PRO 104 12.452 -13.523 6.363 754 HD2 PRO 104 HD2 PRO 104 13.268 -11.345 7.711 755 HD3 PRO 104 HD1 PRO 104 12.447 -12.688 8.537 756 H ARG 105 HN ARG 105 16.190 -11.666 7.292 757 HA ARG 105 HA ARG 105 18.410 -12.933 5.888 758 HB2 ARG 105 HB2 ARG 105 17.402 -10.095 5.959 759 HB3 ARG 105 HB1 ARG 105 18.958 -10.498 5.260 760 HG2 ARG 105 HG2 ARG 105 17.460 -10.344 3.466 761 HG3 ARG 105 HG1 ARG 105 17.721 -12.074 3.711 762 HD2 ARG 105 HD2 ARG 105 15.325 -11.519 3.305 763 HD3 ARG 105 HD1 ARG 105 15.601 -12.257 4.887 764 HE ARG 105 HE ARG 105 15.280 -10.144 5.916 765 HH11 ARG 105 HH11 ARG 105 14.591 -10.146 2.464 766 HH12 ARG 105 HH12 ARG 105 13.691 -8.660 2.533 767 HH21 ARG 105 HH21 ARG 105 14.100 -8.228 6.009 768 HH22 ARG 105 HH22 ARG 105 13.445 -7.530 4.548 769 HA PRO 106 HA PRO 106 20.962 -12.189 9.467 770 HB2 PRO 106 HB2 PRO 106 23.369 -12.947 8.479 771 HB3 PRO 106 HB1 PRO 106 22.070 -14.138 8.874 772 HG2 PRO 106 HG2 PRO 106 22.872 -12.982 6.217 773 HG3 PRO 106 HG1 PRO 106 22.460 -14.657 6.638 774 HD2 PRO 106 HD2 PRO 106 20.720 -12.923 5.438 775 HD3 PRO 106 HD1 PRO 106 20.203 -14.272 6.507 776 H GLY 107 HN GLY 107 21.441 -10.178 10.074 777 HA2 GLY 107 HA2 GLY 107 22.615 -8.212 10.236 778 HA3 GLY 107 HA1 GLY 107 23.606 -8.732 8.857 779 H PHE 108 HN PHE 108 21.010 -9.101 7.270 780 HA PHE 108 HA PHE 108 20.234 -7.875 5.442 781 HB2 PHE 108 HB2 PHE 108 18.561 -6.125 6.148 782 HB3 PHE 108 HB1 PHE 108 18.334 -7.725 6.929 783 HD1 PHE 108 HD1 PHE 108 18.687 -7.967 9.321 784 HD2 PHE 108 HD2 PHE 108 19.260 -4.210 7.393 785 HE1 PHE 108 HE1 PHE 108 18.640 -6.834 11.503 786 HE2 PHE 108 HE2 PHE 108 19.218 -3.083 9.570 787 HZ PHE 108 HZ PHE 108 18.907 -4.392 11.630 788 H GLU 109 HN GLU 109 22.851 -7.198 5.954 789 HA GLU 109 HA GLU 109 22.975 -4.542 4.806 790 HB2 GLU 109 HB2 GLU 109 23.160 -4.063 7.196 791 HB3 GLU 109 HB1 GLU 109 24.416 -5.276 7.383 792 HG2 GLU 109 HG2 GLU 109 25.479 -3.168 7.384 793 HG3 GLU 109 HG1 GLU 109 25.830 -3.913 5.828 Start of MODEL 8 1 H1 GLY 1 HT1 GLY 1 -42.483 9.679 1.569 2 H2 GLY 1 HT2 GLY 1 -42.144 10.391 3.065 3 H3 GLY 1 HT3 GLY 1 -42.164 8.703 2.920 4 HA2 GLY 1 HA1 GLY 1 -40.237 10.548 1.631 5 HA3 GLY 1 HA2 GLY 1 -39.901 9.521 3.020 6 H SER 2 HN SER 2 -39.046 9.734 0.031 7 HA SER 2 HA SER 2 -39.638 7.025 -0.860 8 HB2 SER 2 HB2 SER 2 -38.043 9.249 -2.159 9 HB3 SER 2 HB1 SER 2 -38.412 7.699 -2.910 10 HG SER 2 HG SER 2 -40.212 9.771 -2.164 11 H HIS 3 HN HIS 3 -38.028 5.463 -1.281 12 HA HIS 3 HA HIS 3 -35.570 5.935 0.258 13 HB2 HIS 3 HB2 HIS 3 -35.437 3.444 0.572 14 HB3 HIS 3 HB1 HIS 3 -36.817 4.186 1.365 15 HD1 HIS 3 HD1 HIS 3 -36.768 1.181 0.817 16 HD2 HIS 3 HD2 HIS 3 -38.494 3.969 -1.752 17 HE1 HIS 3 HE1 HIS 3 -38.481 -0.080 -0.518 18 HE2 HIS 3 HE2 HIS 3 -39.695 1.679 -1.843 19 H MET 4 HN MET 4 -33.593 5.640 -0.792 20 HA MET 4 HA MET 4 -33.843 5.052 -3.665 21 HB2 MET 4 HB2 MET 4 -31.637 6.592 -2.253 22 HB3 MET 4 HB1 MET 4 -31.765 6.330 -3.982 23 HG2 MET 4 HG2 MET 4 -33.936 7.566 -3.939 24 HG3 MET 4 HG1 MET 4 -33.602 7.967 -2.257 25 HE1 MET 4 HE1 MET 4 -31.103 7.670 -5.271 26 HE2 MET 4 HE2 MET 4 -31.001 9.345 -5.812 27 HE3 MET 4 HE3 MET 4 -32.507 8.448 -6.003 28 H GLN 5 HN GLN 5 -32.628 3.467 -4.589 29 HA GLN 5 HA GLN 5 -31.409 1.570 -2.809 30 HB2 GLN 5 HB2 GLN 5 -32.880 0.885 -4.684 31 HB3 GLN 5 HB1 GLN 5 -31.711 1.536 -5.817 32 HG2 GLN 5 HG2 GLN 5 -30.080 -0.112 -5.139 33 HG3 GLN 5 HG1 GLN 5 -31.188 -0.743 -3.922 34 HE21 GLN 5 HE21 GLN 5 -30.484 -0.502 -7.312 35 HE22 GLN 5 HE22 GLN 5 -31.609 -1.742 -7.841 36 H TYR 6 HN TYR 6 -29.334 1.597 -2.273 37 HA TYR 6 HA TYR 6 -27.470 3.131 -3.968 38 HB2 TYR 6 HB2 TYR 6 -27.404 2.447 -1.007 39 HB3 TYR 6 HB1 TYR 6 -25.927 2.887 -1.847 40 HD1 TYR 6 HD1 TYR 6 -25.463 5.170 -2.379 41 HD2 TYR 6 HD2 TYR 6 -29.283 4.084 -0.851 42 HE1 TYR 6 HE1 TYR 6 -25.986 7.539 -2.026 43 HE2 TYR 6 HE2 TYR 6 -29.819 6.460 -0.495 44 HH TYR 6 HH TYR 6 -28.643 8.591 -0.182 45 H LYS 7 HN LYS 7 -25.379 2.252 -4.382 46 HA LYS 7 HA LYS 7 -25.357 -0.693 -4.392 47 HB2 LYS 7 HB2 LYS 7 -25.624 0.134 -6.695 48 HB3 LYS 7 HB1 LYS 7 -24.321 1.287 -6.444 49 HG2 LYS 7 HG2 LYS 7 -22.692 -0.467 -6.427 50 HG3 LYS 7 HG1 LYS 7 -23.943 -1.709 -6.408 51 HD2 LYS 7 HD2 LYS 7 -24.678 -0.987 -8.630 52 HD3 LYS 7 HD1 LYS 7 -23.394 0.230 -8.649 53 HE2 LYS 7 HE2 LYS 7 -21.704 -1.437 -8.608 54 HE3 LYS 7 HE1 LYS 7 -22.877 -2.702 -8.251 55 HZ1 LYS 7 HZ1 LYS 7 -22.275 -2.865 -10.523 56 HZ2 LYS 7 HZ2 LYS 7 -22.568 -1.221 -10.807 57 HZ3 LYS 7 HZ3 LYS 7 -23.857 -2.263 -10.473 58 H LEU 8 HN LEU 8 -23.563 -1.689 -3.580 59 HA LEU 8 HA LEU 8 -21.239 0.055 -3.031 60 HB2 LEU 8 HB2 LEU 8 -22.416 -0.829 -0.967 61 HB3 LEU 8 HB1 LEU 8 -21.962 -2.432 -1.486 62 HG LEU 8 HG LEU 8 -19.560 -1.722 -1.348 63 HD11 LEU 8 HD11 LEU 8 -19.593 0.629 -1.411 64 HD12 LEU 8 HD12 LEU 8 -19.193 0.227 0.256 65 HD13 LEU 8 HD13 LEU 8 -20.831 0.733 -0.163 66 HD21 LEU 8 HD21 LEU 8 -21.373 -1.784 1.032 67 HD22 LEU 8 HD22 LEU 8 -19.615 -1.777 1.184 68 HD23 LEU 8 HD23 LEU 8 -20.424 -3.099 0.339 69 H ILE 9 HN ILE 9 -19.229 -0.656 -3.549 70 HA ILE 9 HA ILE 9 -19.036 -3.275 -4.875 71 HB ILE 9 HB ILE 9 -17.671 -0.698 -5.725 72 HG12 ILE 9 HG12 ILE 9 -19.578 -2.517 -7.265 73 HG13 ILE 9 HG11 ILE 9 -20.077 -0.978 -6.469 74 HG21 ILE 9 HG21 ILE 9 -16.529 -1.962 -7.428 75 HG22 ILE 9 HG22 ILE 9 -17.326 -3.452 -6.922 76 HG23 ILE 9 HG23 ILE 9 -16.168 -2.664 -5.851 77 HD11 ILE 9 HD11 ILE 9 -19.721 -0.693 -8.868 78 HD12 ILE 9 HD12 ILE 9 -18.065 -1.275 -8.714 79 HD13 ILE 9 HD13 ILE 9 -18.539 0.240 -7.946 80 H LEU 10 HN LEU 10 -17.753 -4.561 -3.702 81 HA LEU 10 HA LEU 10 -15.857 -3.307 -1.867 82 HB2 LEU 10 HB2 LEU 10 -16.454 -6.253 -2.116 83 HB3 LEU 10 HB1 LEU 10 -15.461 -5.506 -0.905 84 HG LEU 10 HG LEU 10 -17.359 -5.942 0.280 85 HD11 LEU 10 HD11 LEU 10 -16.846 -3.561 0.426 86 HD12 LEU 10 HD12 LEU 10 -18.542 -3.937 0.722 87 HD13 LEU 10 HD13 LEU 10 -18.054 -3.258 -0.832 88 HD21 LEU 10 HD21 LEU 10 -19.168 -5.084 -1.955 89 HD22 LEU 10 HD22 LEU 10 -19.589 -5.981 -0.496 90 HD23 LEU 10 HD23 LEU 10 -18.614 -6.744 -1.752 91 H ASN 11 HN ASN 11 -14.001 -2.782 -2.723 92 HA ASN 11 HA ASN 11 -12.870 -4.534 -4.802 93 HB2 ASN 11 HB2 ASN 11 -13.243 -2.017 -5.187 94 HB3 ASN 11 HB1 ASN 11 -11.917 -1.763 -4.062 95 HD21 ASN 11 HD21 ASN 11 -12.186 -1.116 -6.899 96 HD22 ASN 11 HD22 ASN 11 -10.860 -1.880 -7.697 97 H GLY 12 HN GLY 12 -12.107 -6.111 -3.402 98 HA2 GLY 12 HA2 GLY 12 -9.854 -5.194 -1.725 99 HA3 GLY 12 HA1 GLY 12 -10.947 -6.489 -1.199 100 H LYS 13 HN LYS 13 -8.715 -7.391 -0.958 101 HA LYS 13 HA LYS 13 -7.390 -8.271 -3.330 102 HB2 LYS 13 HB2 LYS 13 -6.020 -9.609 -1.551 103 HB3 LYS 13 HB1 LYS 13 -5.893 -7.856 -1.594 104 HG2 LYS 13 HG2 LYS 13 -7.878 -7.985 0.071 105 HG3 LYS 13 HG1 LYS 13 -7.236 -9.601 0.387 106 HD2 LYS 13 HD2 LYS 13 -5.031 -8.615 0.856 107 HD3 LYS 13 HD1 LYS 13 -5.700 -7.007 0.568 108 HE2 LYS 13 HE2 LYS 13 -5.688 -7.267 2.906 109 HE3 LYS 13 HE1 LYS 13 -7.360 -7.523 2.418 110 HZ1 LYS 13 HZ1 LYS 13 -5.378 -9.626 3.118 111 HZ2 LYS 13 HZ2 LYS 13 -6.930 -9.937 2.515 112 HZ3 LYS 13 HZ3 LYS 13 -6.747 -9.178 4.017 113 H THR 14 HN THR 14 -8.793 -10.132 -0.628 114 HA THR 14 HA THR 14 -9.100 -12.422 -2.409 115 HB THR 14 HB THR 14 -9.964 -12.312 0.476 116 HG1 THR 14 HG1 THR 14 -7.644 -13.291 0.646 117 HG21 THR 14 HG21 THR 14 -8.841 -14.549 -1.216 118 HG22 THR 14 HG22 THR 14 -10.550 -14.299 -0.865 119 HG23 THR 14 HG23 THR 14 -9.430 -14.678 0.442 120 H LEU 15 HN LEU 15 -11.026 -9.887 -1.020 121 HA LEU 15 HA LEU 15 -13.472 -11.272 -1.848 122 HB2 LEU 15 HB2 LEU 15 -12.819 -9.637 0.541 123 HB3 LEU 15 HB1 LEU 15 -14.458 -9.637 -0.050 124 HG LEU 15 HG LEU 15 -12.928 -12.118 0.733 125 HD11 LEU 15 HD11 LEU 15 -15.033 -10.602 2.250 126 HD12 LEU 15 HD12 LEU 15 -13.310 -10.611 2.624 127 HD13 LEU 15 HD13 LEU 15 -14.247 -12.098 2.746 128 HD21 LEU 15 HD21 LEU 15 -14.718 -12.448 -0.912 129 HD22 LEU 15 HD22 LEU 15 -15.854 -11.676 0.194 130 HD23 LEU 15 HD23 LEU 15 -15.081 -13.198 0.642 131 H LYS 16 HN LYS 16 -13.963 -10.349 -3.762 132 HA LYS 16 HA LYS 16 -14.496 -7.469 -3.686 133 HB2 LYS 16 HB2 LYS 16 -13.834 -8.464 -6.370 134 HB3 LYS 16 HB1 LYS 16 -13.337 -6.971 -5.601 135 HG2 LYS 16 HG2 LYS 16 -11.347 -8.042 -5.972 136 HG3 LYS 16 HG1 LYS 16 -11.667 -8.517 -4.296 137 HD2 LYS 16 HD2 LYS 16 -12.625 -10.612 -5.153 138 HD3 LYS 16 HD1 LYS 16 -12.255 -10.064 -6.788 139 HE2 LYS 16 HE2 LYS 16 -9.864 -10.003 -6.190 140 HE3 LYS 16 HE1 LYS 16 -10.273 -10.678 -4.609 141 HZ1 LYS 16 HZ1 LYS 16 -9.603 -12.469 -5.978 142 HZ2 LYS 16 HZ2 LYS 16 -10.582 -11.957 -7.267 143 HZ3 LYS 16 HZ3 LYS 16 -11.294 -12.577 -5.861 144 H GLY 17 HN GLY 17 -16.386 -6.870 -4.715 145 HA2 GLY 17 HA2 GLY 17 -17.983 -8.420 -6.335 146 HA3 GLY 17 HA1 GLY 17 -18.411 -8.875 -4.691 147 H GLU 18 HN GLU 18 -20.550 -8.001 -5.275 148 HA GLU 18 HA GLU 18 -20.648 -5.124 -4.719 149 HB2 GLU 18 HB2 GLU 18 -22.424 -6.462 -6.775 150 HB3 GLU 18 HB1 GLU 18 -22.340 -4.749 -6.404 151 HG2 GLU 18 HG2 GLU 18 -20.155 -4.587 -7.378 152 HG3 GLU 18 HG1 GLU 18 -20.094 -6.334 -7.623 153 H THR 19 HN THR 19 -22.805 -4.432 -4.020 154 HA THR 19 HA THR 19 -24.780 -6.366 -3.300 155 HB THR 19 HB THR 19 -23.233 -6.744 -1.424 156 HG1 THR 19 HG1 THR 19 -25.005 -6.998 -0.301 157 HG21 THR 19 HG21 THR 19 -22.134 -4.553 -1.354 158 HG22 THR 19 HG22 THR 19 -22.828 -4.932 0.226 159 HG23 THR 19 HG23 THR 19 -23.648 -3.799 -0.849 160 H THR 20 HN THR 20 -26.555 -5.168 -1.961 161 HA THR 20 HA THR 20 -26.701 -2.356 -2.773 162 HB THR 20 HB THR 20 -29.080 -2.779 -3.562 163 HG1 THR 20 HG1 THR 20 -28.718 -5.127 -2.639 164 HG21 THR 20 HG21 THR 20 -26.790 -3.979 -5.136 165 HG22 THR 20 HG22 THR 20 -27.360 -2.310 -5.211 166 HG23 THR 20 HG23 THR 20 -28.377 -3.624 -5.813 167 H THR 21 HN THR 21 -28.256 -1.112 -1.621 168 HA THR 21 HA THR 21 -29.857 -2.376 0.429 169 HB THR 21 HB THR 21 -27.503 -2.003 1.472 170 HG1 THR 21 HG1 THR 21 -29.462 -0.629 2.951 171 HG21 THR 21 HG21 THR 21 -27.195 0.298 2.421 172 HG22 THR 21 HG22 THR 21 -28.568 0.847 1.461 173 HG23 THR 21 HG23 THR 21 -27.102 0.295 0.652 174 H GLU 22 HN GLU 22 -31.368 -0.875 1.387 175 HA GLU 22 HA GLU 22 -31.861 1.426 -0.387 176 HB2 GLU 22 HB2 GLU 22 -34.153 1.342 0.471 177 HB3 GLU 22 HB1 GLU 22 -33.693 -0.264 -0.079 178 HG2 GLU 22 HG2 GLU 22 -33.199 -0.911 2.236 179 HG3 GLU 22 HG1 GLU 22 -33.769 0.708 2.778 180 H ALA 23 HN ALA 23 -31.909 3.519 0.369 181 HA ALA 23 HA ALA 23 -31.948 4.021 3.254 182 HB1 ALA 23 HB1 ALA 23 -29.860 5.284 3.270 183 HB2 ALA 23 HB2 ALA 23 -29.600 4.921 1.563 184 HB3 ALA 23 HB3 ALA 23 -29.554 3.625 2.755 185 H VAL 24 HN VAL 24 -32.521 6.223 3.737 186 HA VAL 24 HA VAL 24 -33.610 7.697 1.472 187 HB VAL 24 HB VAL 24 -34.697 9.106 3.233 188 HG11 VAL 24 HG11 VAL 24 -35.858 7.203 2.225 189 HG12 VAL 24 HG12 VAL 24 -36.318 7.405 3.912 190 HG13 VAL 24 HG13 VAL 24 -35.188 6.134 3.456 191 HG21 VAL 24 HG21 VAL 24 -34.673 8.306 5.552 192 HG22 VAL 24 HG22 VAL 24 -33.057 8.770 5.014 193 HG23 VAL 24 HG23 VAL 24 -33.499 7.067 5.114 194 H ASP 25 HN ASP 25 -30.746 7.670 3.173 195 HA ASP 25 HA ASP 25 -30.154 10.426 2.418 196 HB2 ASP 25 HB2 ASP 25 -29.423 9.281 5.137 197 HB3 ASP 25 HB1 ASP 25 -28.913 10.840 4.511 198 H ALA 26 HN ALA 26 -27.828 10.801 2.211 199 HA ALA 26 HA ALA 26 -26.468 8.510 1.145 200 HB1 ALA 26 HB1 ALA 26 -26.208 10.776 0.186 201 HB2 ALA 26 HB2 ALA 26 -24.658 10.071 0.656 202 HB3 ALA 26 HB3 ALA 26 -25.420 11.291 1.678 203 H ALA 27 HN ALA 27 -26.099 10.594 3.979 204 HA ALA 27 HA ALA 27 -23.822 9.442 5.095 205 HB1 ALA 27 HB1 ALA 27 -24.770 11.549 5.880 206 HB2 ALA 27 HB2 ALA 27 -24.574 10.416 7.218 207 HB3 ALA 27 HB3 ALA 27 -26.169 10.691 6.521 208 H THR 28 HN THR 28 -27.225 8.572 5.452 209 HA THR 28 HA THR 28 -26.851 6.573 7.417 210 HB THR 28 HB THR 28 -29.106 6.623 5.408 211 HG1 THR 28 HG1 THR 28 -30.039 8.025 7.196 212 HG21 THR 28 HG21 THR 28 -28.967 5.822 8.328 213 HG22 THR 28 HG22 THR 28 -29.031 4.705 6.965 214 HG23 THR 28 HG23 THR 28 -30.407 5.759 7.312 215 H ALA 29 HN ALA 29 -26.406 6.552 3.977 216 HA ALA 29 HA ALA 29 -26.762 3.709 3.622 217 HB1 ALA 29 HB1 ALA 29 -25.408 5.692 1.786 218 HB2 ALA 29 HB2 ALA 29 -27.135 5.335 1.777 219 HB3 ALA 29 HB3 ALA 29 -25.973 4.075 1.366 220 H GLU 30 HN GLU 30 -24.156 5.997 4.059 221 HA GLU 30 HA GLU 30 -21.947 4.314 3.743 222 HB2 GLU 30 HB2 GLU 30 -22.060 6.888 4.053 223 HB3 GLU 30 HB1 GLU 30 -22.125 6.524 5.767 224 HG2 GLU 30 HG2 GLU 30 -19.987 5.288 5.541 225 HG3 GLU 30 HG1 GLU 30 -19.909 5.861 3.877 226 H LYS 31 HN LYS 31 -23.620 5.325 6.705 227 HA LYS 31 HA LYS 31 -22.248 3.920 8.602 228 HB2 LYS 31 HB2 LYS 31 -25.238 4.356 8.659 229 HB3 LYS 31 HB1 LYS 31 -24.174 4.138 10.040 230 HG2 LYS 31 HG2 LYS 31 -24.067 6.454 8.123 231 HG3 LYS 31 HG1 LYS 31 -24.839 6.474 9.709 232 HD2 LYS 31 HD2 LYS 31 -22.701 6.021 10.773 233 HD3 LYS 31 HD1 LYS 31 -21.920 5.941 9.192 234 HE2 LYS 31 HE2 LYS 31 -21.562 8.116 10.271 235 HE3 LYS 31 HE1 LYS 31 -22.481 8.269 8.772 236 HZ1 LYS 31 HZ1 LYS 31 -24.521 8.389 10.108 237 HZ2 LYS 31 HZ2 LYS 31 -23.446 9.643 10.484 238 HZ3 LYS 31 HZ3 LYS 31 -23.597 8.315 11.533 239 H VAL 32 HN VAL 32 -24.978 2.681 6.658 240 HA VAL 32 HA VAL 32 -25.153 0.228 8.117 241 HB VAL 32 HB VAL 32 -26.246 0.898 5.371 242 HG11 VAL 32 HG11 VAL 32 -26.121 -1.497 5.695 243 HG12 VAL 32 HG12 VAL 32 -27.802 -0.975 5.785 244 HG13 VAL 32 HG13 VAL 32 -26.917 -1.357 7.261 245 HG21 VAL 32 HG21 VAL 32 -28.373 1.286 6.540 246 HG22 VAL 32 HG22 VAL 32 -27.115 2.403 7.067 247 HG23 VAL 32 HG23 VAL 32 -27.561 1.032 8.084 248 H PHE 33 HN PHE 33 -23.839 1.129 4.957 249 HA PHE 33 HA PHE 33 -22.923 -1.473 4.319 250 HB2 PHE 33 HB2 PHE 33 -22.489 1.236 3.170 251 HB3 PHE 33 HB1 PHE 33 -21.345 -0.019 2.751 252 HD1 PHE 33 HD1 PHE 33 -23.369 -2.307 2.754 253 HD2 PHE 33 HD2 PHE 33 -23.423 1.587 1.048 254 HE1 PHE 33 HE1 PHE 33 -24.879 -3.109 0.990 255 HE2 PHE 33 HE2 PHE 33 -24.940 0.795 -0.723 256 HZ PHE 33 HZ PHE 33 -25.672 -1.554 -0.750 257 H LYS 34 HN LYS 34 -21.587 1.007 6.333 258 HA LYS 34 HA LYS 34 -18.884 0.153 6.122 259 HB2 LYS 34 HB2 LYS 34 -20.373 1.843 8.118 260 HB3 LYS 34 HB1 LYS 34 -18.680 1.485 8.320 261 HG2 LYS 34 HG2 LYS 34 -18.456 2.427 5.902 262 HG3 LYS 34 HG1 LYS 34 -20.022 3.155 6.248 263 HD2 LYS 34 HD2 LYS 34 -18.425 4.801 6.826 264 HD3 LYS 34 HD1 LYS 34 -18.998 4.103 8.341 265 HE2 LYS 34 HE2 LYS 34 -16.560 4.372 8.321 266 HE3 LYS 34 HE1 LYS 34 -17.043 2.678 8.477 267 HZ1 LYS 34 HZ1 LYS 34 -16.259 3.978 5.924 268 HZ2 LYS 34 HZ2 LYS 34 -16.501 2.322 6.203 269 HZ3 LYS 34 HZ3 LYS 34 -15.180 3.110 6.908 270 H GLN 35 HN GLN 35 -21.521 -0.500 8.395 271 HA GLN 35 HA GLN 35 -20.100 -2.360 9.968 272 HB2 GLN 35 HB2 GLN 35 -22.255 -1.372 10.675 273 HB3 GLN 35 HB1 GLN 35 -23.077 -2.254 9.401 274 HG2 GLN 35 HG2 GLN 35 -23.375 -3.342 11.544 275 HG3 GLN 35 HG1 GLN 35 -22.467 -4.368 10.434 276 HE21 GLN 35 HE21 GLN 35 -22.335 -2.440 13.318 277 HE22 GLN 35 HE22 GLN 35 -20.811 -3.026 13.887 278 H TYR 36 HN TYR 36 -21.819 -2.589 6.937 279 HA TYR 36 HA TYR 36 -21.930 -5.400 6.700 280 HB2 TYR 36 HB2 TYR 36 -23.315 -4.089 5.257 281 HB3 TYR 36 HB1 TYR 36 -21.943 -3.150 4.686 282 HD1 TYR 36 HD1 TYR 36 -23.633 -6.424 4.450 283 HD2 TYR 36 HD2 TYR 36 -20.548 -3.929 2.941 284 HE1 TYR 36 HE1 TYR 36 -23.346 -7.941 2.535 285 HE2 TYR 36 HE2 TYR 36 -20.259 -5.417 1.019 286 HH TYR 36 HH TYR 36 -20.673 -7.771 0.449 287 H ALA 37 HN ALA 37 -19.618 -3.005 5.442 288 HA ALA 37 HA ALA 37 -17.868 -4.919 4.273 289 HB1 ALA 37 HB1 ALA 37 -16.291 -3.050 4.071 290 HB2 ALA 37 HB2 ALA 37 -17.302 -2.077 5.139 291 HB3 ALA 37 HB3 ALA 37 -17.913 -2.572 3.560 292 H ASN 38 HN ASN 38 -18.119 -3.389 7.396 293 HA ASN 38 HA ASN 38 -15.669 -4.102 8.549 294 HB2 ASN 38 HB2 ASN 38 -17.204 -2.504 9.635 295 HB3 ASN 38 HB1 ASN 38 -18.392 -3.786 9.875 296 HD21 ASN 38 HD21 ASN 38 -18.173 -5.191 11.580 297 HD22 ASN 38 HD22 ASN 38 -16.909 -5.022 12.821 298 H ASP 39 HN ASP 39 -18.757 -5.852 8.489 299 HA ASP 39 HA ASP 39 -17.853 -8.061 10.015 300 HB2 ASP 39 HB2 ASP 39 -20.240 -7.456 9.693 301 HB3 ASP 39 HB1 ASP 39 -20.121 -7.972 8.013 302 H ASN 40 HN ASN 40 -17.438 -7.207 6.702 303 HA ASN 40 HA ASN 40 -16.827 -9.928 5.888 304 HB2 ASN 40 HB2 ASN 40 -17.181 -7.323 4.469 305 HB3 ASN 40 HB1 ASN 40 -16.244 -8.592 3.689 306 HD21 ASN 40 HD21 ASN 40 -19.398 -7.539 4.692 307 HD22 ASN 40 HD22 ASN 40 -20.284 -8.854 3.910 308 H GLY 41 HN GLY 41 -15.250 -7.153 7.100 309 HA2 GLY 41 HA2 GLY 41 -13.019 -7.102 7.841 310 HA3 GLY 41 HA1 GLY 41 -12.671 -8.490 6.823 311 H VAL 42 HN VAL 42 -14.377 -5.957 5.269 312 HA VAL 42 HA VAL 42 -11.926 -5.223 3.872 313 HB VAL 42 HB VAL 42 -14.792 -4.757 3.010 314 HG11 VAL 42 HG11 VAL 42 -12.143 -4.484 1.576 315 HG12 VAL 42 HG12 VAL 42 -13.220 -3.173 2.048 316 HG13 VAL 42 HG13 VAL 42 -13.722 -4.323 0.806 317 HG21 VAL 42 HG21 VAL 42 -12.816 -6.925 2.318 318 HG22 VAL 42 HG22 VAL 42 -14.259 -6.584 1.359 319 HG23 VAL 42 HG23 VAL 42 -14.420 -7.108 3.042 320 H ASP 43 HN ASP 43 -11.073 -3.322 4.250 321 HA ASP 43 HA ASP 43 -12.776 -1.052 4.888 322 HB2 ASP 43 HB2 ASP 43 -12.009 -2.135 7.075 323 HB3 ASP 43 HB1 ASP 43 -10.382 -1.630 6.634 324 H GLY 44 HN GLY 44 -11.923 0.903 4.185 325 HA2 GLY 44 HA2 GLY 44 -9.285 1.412 3.461 326 HA3 GLY 44 HA1 GLY 44 -10.103 0.752 2.046 327 H GLU 45 HN GLU 45 -9.484 3.022 1.296 328 HA GLU 45 HA GLU 45 -10.835 5.283 2.303 329 HB2 GLU 45 HB2 GLU 45 -9.766 4.718 -0.469 330 HB3 GLU 45 HB1 GLU 45 -10.367 6.286 0.061 331 HG2 GLU 45 HG2 GLU 45 -8.651 6.231 1.875 332 HG3 GLU 45 HG1 GLU 45 -7.980 4.792 1.113 333 H TRP 46 HN TRP 46 -12.642 6.410 1.388 334 HA TRP 46 HA TRP 46 -14.632 4.525 0.296 335 HB2 TRP 46 HB2 TRP 46 -14.825 6.429 2.582 336 HB3 TRP 46 HB1 TRP 46 -16.241 6.289 1.554 337 HD1 TRP 46 HD1 TRP 46 -13.828 3.902 3.439 338 HE1 TRP 46 HE1 TRP 46 -15.163 1.912 4.327 339 HE3 TRP 46 HE3 TRP 46 -18.503 5.154 1.658 340 HZ2 TRP 46 HZ2 TRP 46 -17.794 1.015 4.317 341 HZ3 TRP 46 HZ3 TRP 46 -20.373 3.664 2.207 342 HH2 TRP 46 HH2 TRP 46 -20.020 1.629 3.508 343 H THR 47 HN THR 47 -14.922 5.015 -1.764 344 HA THR 47 HA THR 47 -14.973 7.832 -2.576 345 HB THR 47 HB THR 47 -14.984 6.772 -4.927 346 HG1 THR 47 HG1 THR 47 -13.739 4.603 -4.565 347 HG21 THR 47 HG21 THR 47 -13.028 7.905 -3.991 348 HG22 THR 47 HG22 THR 47 -12.545 6.482 -4.914 349 HG23 THR 47 HG23 THR 47 -12.560 6.425 -3.153 350 H TYR 48 HN TYR 48 -16.686 8.554 -4.018 351 HA TYR 48 HA TYR 48 -19.061 6.934 -4.231 352 HB2 TYR 48 HB2 TYR 48 -19.351 7.736 -1.972 353 HB3 TYR 48 HB1 TYR 48 -18.997 9.362 -2.432 354 HD1 TYR 48 HD1 TYR 48 -20.797 10.817 -2.641 355 HD2 TYR 48 HD2 TYR 48 -21.412 6.661 -3.330 356 HE1 TYR 48 HE1 TYR 48 -23.191 11.234 -2.978 357 HE2 TYR 48 HE2 TYR 48 -23.813 7.073 -3.667 358 HH TYR 48 HH TYR 48 -25.099 10.058 -4.242 359 H ASP 49 HN ASP 49 -20.675 7.897 -5.572 360 HA ASP 49 HA ASP 49 -19.868 10.401 -6.915 361 HB2 ASP 49 HB2 ASP 49 -19.270 8.301 -8.308 362 HB3 ASP 49 HB1 ASP 49 -21.009 8.130 -8.554 363 H ASP 50 HN ASP 50 -21.642 11.706 -7.522 364 HA ASP 50 HA ASP 50 -24.094 10.917 -6.097 365 HB2 ASP 50 HB2 ASP 50 -23.019 13.144 -5.597 366 HB3 ASP 50 HB1 ASP 50 -23.393 13.638 -7.244 367 H ALA 51 HN ALA 51 -22.984 10.556 -9.149 368 HA ALA 51 HA ALA 51 -25.505 11.163 -10.433 369 HB1 ALA 51 HB1 ALA 51 -24.467 10.362 -12.480 370 HB2 ALA 51 HB2 ALA 51 -23.070 9.791 -11.568 371 HB3 ALA 51 HB3 ALA 51 -23.424 11.516 -11.655 372 H THR 52 HN THR 52 -23.754 8.216 -9.441 373 HA THR 52 HA THR 52 -26.122 6.690 -10.252 374 HB THR 52 HB THR 52 -24.544 4.713 -10.194 375 HG1 THR 52 HG1 THR 52 -22.601 5.082 -9.462 376 HG21 THR 52 HG21 THR 52 -25.195 5.808 -12.299 377 HG22 THR 52 HG22 THR 52 -23.523 5.252 -12.360 378 HG23 THR 52 HG23 THR 52 -23.873 6.962 -12.108 379 H LYS 53 HN LYS 53 -24.755 7.883 -7.474 380 HA LYS 53 HA LYS 53 -25.031 7.444 -5.221 381 HB2 LYS 53 HB2 LYS 53 -27.291 5.837 -6.384 382 HB3 LYS 53 HB1 LYS 53 -26.928 5.741 -4.672 383 HG2 LYS 53 HG2 LYS 53 -28.727 7.328 -5.156 384 HG3 LYS 53 HG1 LYS 53 -27.336 8.107 -4.410 385 HD2 LYS 53 HD2 LYS 53 -27.281 8.080 -7.336 386 HD3 LYS 53 HD1 LYS 53 -28.618 8.998 -6.640 387 HE2 LYS 53 HE2 LYS 53 -25.782 9.348 -5.724 388 HE3 LYS 53 HE1 LYS 53 -26.451 10.257 -7.076 389 HZ1 LYS 53 HZ1 LYS 53 -26.604 11.524 -5.043 390 HZ2 LYS 53 HZ2 LYS 53 -27.468 10.278 -4.285 391 HZ3 LYS 53 HZ3 LYS 53 -28.164 11.121 -5.582 392 H THR 54 HN THR 54 -23.163 5.871 -6.841 393 HA THR 54 HA THR 54 -23.234 3.255 -5.550 394 HB THR 54 HB THR 54 -21.172 4.135 -7.559 395 HG1 THR 54 HG1 THR 54 -23.907 3.594 -7.922 396 HG21 THR 54 HG21 THR 54 -20.995 1.802 -8.061 397 HG22 THR 54 HG22 THR 54 -22.504 1.433 -7.228 398 HG23 THR 54 HG23 THR 54 -21.070 1.883 -6.297 399 H TYR 55 HN TYR 55 -22.043 2.854 -3.796 400 HA TYR 55 HA TYR 55 -19.814 4.650 -3.125 401 HB2 TYR 55 HB2 TYR 55 -21.500 2.803 -1.431 402 HB3 TYR 55 HB1 TYR 55 -19.891 3.263 -0.901 403 HD1 TYR 55 HD1 TYR 55 -23.311 4.405 -1.494 404 HD2 TYR 55 HD2 TYR 55 -19.426 5.552 -0.199 405 HE1 TYR 55 HE1 TYR 55 -24.241 6.476 -0.559 406 HE2 TYR 55 HE2 TYR 55 -20.347 7.628 0.740 407 HH TYR 55 HH TYR 55 -23.733 8.164 1.048 408 H THR 56 HN THR 56 -17.760 3.792 -2.632 409 HA THR 56 HA THR 56 -17.361 0.962 -3.257 410 HB THR 56 HB THR 56 -15.859 3.209 -4.616 411 HG1 THR 56 HG1 THR 56 -18.118 1.974 -5.215 412 HG21 THR 56 HG21 THR 56 -14.335 1.381 -4.182 413 HG22 THR 56 HG22 THR 56 -14.787 1.338 -5.889 414 HG23 THR 56 HG23 THR 56 -15.521 0.206 -4.752 415 H VAL 57 HN VAL 57 -16.018 0.020 -1.892 416 HA VAL 57 HA VAL 57 -14.243 1.742 -0.287 417 HB VAL 57 HB VAL 57 -15.850 0.523 1.171 418 HG11 VAL 57 HG11 VAL 57 -14.645 -1.943 -0.055 419 HG12 VAL 57 HG12 VAL 57 -16.350 -1.488 0.029 420 HG13 VAL 57 HG13 VAL 57 -15.485 -1.954 1.489 421 HG21 VAL 57 HG21 VAL 57 -13.644 1.108 2.020 422 HG22 VAL 57 HG22 VAL 57 -13.010 -0.437 1.459 423 HG23 VAL 57 HG23 VAL 57 -14.224 -0.396 2.736 424 H THR 58 HN THR 58 -12.238 1.687 -0.935 425 HA THR 58 HA THR 58 -11.361 -0.596 -2.565 426 HB THR 58 HB THR 58 -10.146 2.162 -2.456 427 HG1 THR 58 HG1 THR 58 -12.485 1.689 -3.308 428 HG21 THR 58 HG21 THR 58 -8.677 0.389 -3.335 429 HG22 THR 58 HG22 THR 58 -9.142 1.536 -4.589 430 HG23 THR 58 HG23 THR 58 -9.920 -0.044 -4.509 431 H GLU 59 HN GLU 59 -9.881 -1.917 -1.814 432 HA GLU 59 HA GLU 59 -8.323 -1.203 0.554 433 HB2 GLU 59 HB2 GLU 59 -9.629 -3.446 0.090 434 HB3 GLU 59 HB1 GLU 59 -8.196 -3.860 -0.837 435 HG2 GLU 59 HG2 GLU 59 -8.380 -3.301 2.102 436 HG3 GLU 59 HG1 GLU 59 -8.020 -4.831 1.317 437 H GLY 60 HN GLY 60 -6.313 -0.239 0.106 438 HA2 GLY 60 HA2 GLY 60 -4.095 -0.631 -0.838 439 HA3 GLY 60 HA1 GLY 60 -4.891 -1.212 -2.299 440 H SER 61 HN SER 61 -3.442 1.417 -0.833 441 HA SER 61 HA SER 61 -4.673 3.270 -2.753 442 HB2 SER 61 HB2 SER 61 -3.776 3.911 0.065 443 HB3 SER 61 HB1 SER 61 -4.488 5.048 -1.081 444 HG SER 61 HG SER 61 -6.369 4.387 -0.481 445 H GLY 62 HN GLY 62 -3.266 5.241 -3.089 446 HA2 GLY 62 HA2 GLY 62 -1.128 6.262 -3.066 447 HA3 GLY 62 HA1 GLY 62 -0.411 4.693 -2.732 448 H GLY 63 HN GLY 63 0.683 6.268 -4.651 449 HA2 GLY 63 HA2 GLY 63 0.007 4.761 -7.095 450 HA3 GLY 63 HA1 GLY 63 0.322 6.491 -7.147 451 H ALA 64 HN ALA 64 2.193 5.127 -4.785 452 HA ALA 64 HA ALA 64 4.344 4.477 -4.549 453 HB1 ALA 64 HB1 ALA 64 5.598 3.487 -6.394 454 HB2 ALA 64 HB2 ALA 64 4.331 3.964 -7.522 455 HB3 ALA 64 HB3 ALA 64 3.989 2.784 -6.255 456 H GLY 65 HN GLY 65 4.277 6.183 -7.698 457 HA2 GLY 65 HA2 GLY 65 5.080 8.657 -7.025 458 HA3 GLY 65 HA1 GLY 65 6.585 7.753 -6.903 459 H GLY 66 HN GLY 66 7.007 9.492 -8.660 460 HA2 GLY 66 HA2 GLY 66 6.101 8.497 -11.287 461 HA3 GLY 66 HA1 GLY 66 6.621 10.144 -10.966 462 H GLN 67 HN GLN 67 8.968 9.585 -9.509 463 HA GLN 67 HA GLN 67 10.606 8.069 -11.426 464 HB2 GLN 67 HB2 GLN 67 10.789 10.485 -11.969 465 HB3 GLN 67 HB1 GLN 67 11.336 10.798 -10.302 466 HG2 GLN 67 HG2 GLN 67 13.269 9.313 -10.725 467 HG3 GLN 67 HG1 GLN 67 12.751 9.152 -12.401 468 HE21 GLN 67 HE21 GLN 67 15.229 10.229 -11.333 469 HE22 GLN 67 HE22 GLN 67 15.348 11.852 -11.917 470 H GLY 68 HN GLY 68 11.269 6.418 -10.224 471 HA2 GLY 68 HA2 GLY 68 13.033 6.913 -8.008 472 HA3 GLY 68 HA1 GLY 68 11.509 6.185 -7.524 473 H MET 69 HN MET 69 13.649 5.697 -10.316 474 HA MET 69 HA MET 69 14.209 2.991 -9.430 475 HB2 MET 69 HB2 MET 69 12.140 2.695 -10.698 476 HB3 MET 69 HB1 MET 69 12.839 3.541 -12.072 477 HG2 MET 69 HG2 MET 69 12.830 1.149 -12.435 478 HG3 MET 69 HG1 MET 69 14.478 1.769 -12.351 479 HE1 MET 69 HE1 MET 69 13.651 -1.292 -12.155 480 HE2 MET 69 HE2 MET 69 14.696 -1.856 -10.853 481 HE3 MET 69 HE3 MET 69 15.330 -0.754 -12.079 482 H ILE 70 HN ILE 70 16.310 3.838 -9.235 483 HA ILE 70 HA ILE 70 17.786 3.803 -11.749 484 HB ILE 70 HB ILE 70 18.139 6.010 -9.684 485 HG12 ILE 70 HG12 ILE 70 17.333 6.173 -12.595 486 HG13 ILE 70 HG11 ILE 70 16.237 6.341 -11.230 487 HG21 ILE 70 HG21 ILE 70 19.703 5.580 -12.251 488 HG22 ILE 70 HG22 ILE 70 20.293 5.176 -10.640 489 HG23 ILE 70 HG23 ILE 70 19.951 6.856 -11.057 490 HD11 ILE 70 HD11 ILE 70 17.447 8.343 -10.513 491 HD12 ILE 70 HD12 ILE 70 16.826 8.508 -12.154 492 HD13 ILE 70 HD13 ILE 70 18.538 8.178 -11.889 493 H GLN 71 HN GLN 71 18.746 1.810 -11.170 494 HA GLN 71 HA GLN 71 20.438 1.922 -8.772 495 HB2 GLN 71 HB2 GLN 71 20.014 -0.398 -8.321 496 HB3 GLN 71 HB1 GLN 71 18.466 0.419 -8.484 497 HG2 GLN 71 HG2 GLN 71 18.308 -0.430 -10.802 498 HG3 GLN 71 HG1 GLN 71 19.809 -1.320 -10.545 499 HE21 GLN 71 HE21 GLN 71 17.226 -2.398 -11.208 500 HE22 GLN 71 HE22 GLN 71 16.755 -3.443 -9.902 501 H GLU 72 HN GLU 72 20.681 2.240 -11.829 502 HA GLU 72 HA GLU 72 22.683 0.192 -12.391 503 HB2 GLU 72 HB2 GLU 72 21.511 2.305 -14.204 504 HB3 GLU 72 HB1 GLU 72 22.622 1.036 -14.702 505 HG2 GLU 72 HG2 GLU 72 20.899 -0.626 -13.920 506 HG3 GLU 72 HG1 GLU 72 19.789 0.730 -13.735 507 HA PRO 73 HA PRO 73 26.032 2.871 -11.436 508 HB2 PRO 73 HB2 PRO 73 27.968 1.873 -13.074 509 HB3 PRO 73 HB1 PRO 73 27.392 1.012 -11.597 510 HG2 PRO 73 HG2 PRO 73 26.596 0.598 -14.473 511 HG3 PRO 73 HG1 PRO 73 26.993 -0.612 -13.235 512 HD2 PRO 73 HD2 PRO 73 24.447 -0.006 -13.896 513 HD3 PRO 73 HD1 PRO 73 24.917 -0.438 -12.220 514 H ALA 74 HN ALA 74 27.806 4.141 -12.514 515 HA ALA 74 HA ALA 74 27.334 5.044 -15.193 516 HB1 ALA 74 HB1 ALA 74 25.639 6.352 -14.017 517 HB2 ALA 74 HB2 ALA 74 26.932 7.398 -14.598 518 HB3 ALA 74 HB3 ALA 74 26.860 6.949 -12.894 519 H LEU 75 HN LEU 75 28.846 7.143 -15.482 520 HA LEU 75 HA LEU 75 31.448 6.303 -14.462 521 HB2 LEU 75 HB2 LEU 75 30.674 8.139 -16.729 522 HB3 LEU 75 HB1 LEU 75 32.322 7.939 -16.186 523 HG LEU 75 HG LEU 75 32.072 6.599 -18.110 524 HD11 LEU 75 HD11 LEU 75 31.868 4.805 -15.698 525 HD12 LEU 75 HD12 LEU 75 33.343 5.541 -16.328 526 HD13 LEU 75 HD13 LEU 75 32.481 4.335 -17.284 527 HD21 LEU 75 HD21 LEU 75 29.637 6.497 -18.190 528 HD22 LEU 75 HD22 LEU 75 29.635 5.365 -16.837 529 HD23 LEU 75 HD23 LEU 75 30.351 4.895 -18.380 530 HA PRO 76 HA PRO 76 31.633 9.812 -11.716 531 HB2 PRO 76 HB2 PRO 76 34.556 9.933 -12.139 532 HB3 PRO 76 HB1 PRO 76 33.689 9.548 -10.648 533 HG2 PRO 76 HG2 PRO 76 35.054 7.661 -11.964 534 HG3 PRO 76 HG1 PRO 76 33.453 7.298 -11.215 535 HD2 PRO 76 HD2 PRO 76 34.050 7.946 -14.133 536 HD3 PRO 76 HD1 PRO 76 33.097 6.610 -13.453 537 HA PRO 77 HA PRO 77 31.657 13.564 -14.075 538 HB2 PRO 77 HB2 PRO 77 33.224 14.598 -11.718 539 HB3 PRO 77 HB1 PRO 77 31.858 15.356 -12.558 540 HG2 PRO 77 HG2 PRO 77 31.368 14.148 -10.301 541 HG3 PRO 77 HG1 PRO 77 30.330 13.801 -11.700 542 HD2 PRO 77 HD2 PRO 77 32.566 12.117 -10.560 543 HD3 PRO 77 HD1 PRO 77 30.928 11.618 -11.131 544 H GLY 78 HN GLY 78 32.907 14.023 -15.736 545 HA2 GLY 78 HA2 GLY 78 34.861 14.840 -16.772 546 HA3 GLY 78 HA1 GLY 78 35.781 14.375 -15.353 547 H TRP 79 HN TRP 79 34.517 11.589 -15.480 548 HA TRP 79 HA TRP 79 36.492 10.523 -17.375 549 HB2 TRP 79 HB2 TRP 79 34.679 9.169 -15.352 550 HB3 TRP 79 HB1 TRP 79 35.718 8.285 -16.455 551 HD1 TRP 79 HD1 TRP 79 35.943 10.689 -13.441 552 HE1 TRP 79 HE1 TRP 79 38.255 10.366 -12.344 553 HE3 TRP 79 HE3 TRP 79 38.005 7.435 -16.810 554 HZ2 TRP 79 HZ2 TRP 79 40.637 8.904 -12.844 555 HZ3 TRP 79 HZ3 TRP 79 40.280 6.622 -16.428 556 HH2 TRP 79 HH2 TRP 79 41.572 7.338 -14.489 557 H GLU 80 HN GLU 80 35.974 9.489 -19.293 558 HA GLU 80 HA GLU 80 33.130 9.096 -19.893 559 HB2 GLU 80 HB2 GLU 80 35.211 10.304 -21.731 560 HB3 GLU 80 HB1 GLU 80 33.576 9.879 -22.220 561 HG2 GLU 80 HG2 GLU 80 32.679 11.522 -20.668 562 HG3 GLU 80 HG1 GLU 80 34.311 11.926 -20.131 563 H MET 81 HN MET 81 32.680 7.153 -20.686 564 HA MET 81 HA MET 81 34.873 5.370 -21.425 565 HB2 MET 81 HB2 MET 81 33.442 4.341 -19.849 566 HB3 MET 81 HB1 MET 81 31.979 4.909 -20.688 567 HG2 MET 81 HG2 MET 81 32.292 3.348 -22.447 568 HG3 MET 81 HG1 MET 81 33.897 2.912 -21.868 569 HE1 MET 81 HE1 MET 81 32.744 0.352 -22.314 570 HE2 MET 81 HE2 MET 81 31.154 1.076 -22.569 571 HE3 MET 81 HE3 MET 81 31.358 -0.208 -21.375 572 H LYS 82 HN LYS 82 35.163 4.638 -23.534 573 HA LYS 82 HA LYS 82 33.165 5.343 -25.538 574 HB2 LYS 82 HB2 LYS 82 35.991 6.398 -25.830 575 HB3 LYS 82 HB1 LYS 82 34.644 6.680 -26.915 576 HG2 LYS 82 HG2 LYS 82 34.171 7.601 -24.164 577 HG3 LYS 82 HG1 LYS 82 35.518 8.416 -25.008 578 HD2 LYS 82 HD2 LYS 82 33.944 8.863 -26.891 579 HD3 LYS 82 HD1 LYS 82 32.637 8.196 -25.903 580 HE2 LYS 82 HE2 LYS 82 32.641 10.604 -25.698 581 HE3 LYS 82 HE1 LYS 82 33.135 9.888 -24.170 582 HZ1 LYS 82 HZ1 LYS 82 34.774 11.329 -26.154 583 HZ2 LYS 82 HZ2 LYS 82 35.492 10.270 -25.052 584 HZ3 LYS 82 HZ3 LYS 82 34.627 11.612 -24.487 585 H TYR 83 HN TYR 83 33.623 4.333 -27.621 586 HA TYR 83 HA TYR 83 35.494 2.046 -27.403 587 HB2 TYR 83 HB2 TYR 83 32.839 2.283 -28.875 588 HB3 TYR 83 HB1 TYR 83 33.985 0.949 -29.152 589 HD1 TYR 83 HD1 TYR 83 34.428 -0.662 -27.290 590 HD2 TYR 83 HD2 TYR 83 31.362 2.282 -27.046 591 HE1 TYR 83 HE1 TYR 83 33.320 -1.971 -25.524 592 HE2 TYR 83 HE2 TYR 83 30.254 0.988 -25.273 593 HH TYR 83 HH TYR 83 31.743 -1.644 -23.680 594 H THR 84 HN THR 84 36.854 1.638 -29.170 595 HA THR 84 HA THR 84 37.113 3.742 -31.135 596 HB THR 84 HB THR 84 38.990 2.456 -32.038 597 HG1 THR 84 HG1 THR 84 39.519 0.471 -30.747 598 HG21 THR 84 HG21 THR 84 39.437 3.856 -30.089 599 HG22 THR 84 HG22 THR 84 40.460 2.424 -30.090 600 HG23 THR 84 HG23 THR 84 39.062 2.506 -29.022 601 H SER 85 HN SER 85 37.666 2.608 -33.485 602 HA SER 85 HA SER 85 35.208 2.069 -34.641 603 HB2 SER 85 HB2 SER 85 36.717 1.233 -36.578 604 HB3 SER 85 HB1 SER 85 36.862 2.913 -36.057 605 HG SER 85 HG SER 85 38.919 2.027 -36.208 606 H GLU 86 HN GLU 86 37.813 -0.226 -33.845 607 HA GLU 86 HA GLU 86 36.160 -2.508 -34.663 608 HB2 GLU 86 HB2 GLU 86 38.915 -2.317 -33.415 609 HB3 GLU 86 HB1 GLU 86 38.129 -3.844 -33.802 610 HG2 GLU 86 HG2 GLU 86 37.997 -3.112 -36.163 611 HG3 GLU 86 HG1 GLU 86 38.926 -1.675 -35.726 612 H GLY 87 HN GLY 87 35.794 -0.638 -32.109 613 HA2 GLY 87 HA2 GLY 87 34.456 -1.063 -30.260 614 HA3 GLY 87 HA1 GLY 87 34.605 -2.780 -30.580 615 H VAL 88 HN VAL 88 37.499 -0.847 -30.287 616 HA VAL 88 HA VAL 88 38.259 -2.372 -27.948 617 HB VAL 88 HB VAL 88 39.724 -0.176 -29.427 618 HG11 VAL 88 HG11 VAL 88 40.699 -1.984 -27.227 619 HG12 VAL 88 HG12 VAL 88 40.427 -0.247 -27.109 620 HG13 VAL 88 HG13 VAL 88 41.696 -0.870 -28.162 621 HG21 VAL 88 HG21 VAL 88 41.085 -1.939 -30.354 622 HG22 VAL 88 HG22 VAL 88 39.388 -2.291 -30.681 623 HG23 VAL 88 HG23 VAL 88 40.232 -3.149 -29.395 624 H ARG 89 HN ARG 89 37.961 -1.766 -25.929 625 HA ARG 89 HA ARG 89 36.532 0.635 -25.311 626 HB2 ARG 89 HB2 ARG 89 36.231 -1.596 -24.188 627 HB3 ARG 89 HB1 ARG 89 37.784 -1.356 -23.414 628 HG2 ARG 89 HG2 ARG 89 36.887 0.697 -22.350 629 HG3 ARG 89 HG1 ARG 89 35.312 0.322 -23.051 630 HD2 ARG 89 HD2 ARG 89 35.628 -1.976 -21.892 631 HD3 ARG 89 HD1 ARG 89 36.834 -1.132 -20.923 632 HE ARG 89 HE ARG 89 34.522 0.401 -20.874 633 HH11 ARG 89 HH11 ARG 89 35.659 -2.705 -19.697 634 HH12 ARG 89 HH12 ARG 89 34.400 -2.833 -18.504 635 HH21 ARG 89 HH21 ARG 89 32.885 0.215 -19.278 636 HH22 ARG 89 HH22 ARG 89 32.859 -1.188 -18.246 637 H TYR 90 HN TYR 90 37.447 2.582 -24.996 638 HA TYR 90 HA TYR 90 39.977 2.633 -23.532 639 HB2 TYR 90 HB2 TYR 90 40.931 4.368 -24.881 640 HB3 TYR 90 HB1 TYR 90 40.457 3.057 -25.934 641 HD1 TYR 90 HD1 TYR 90 38.323 3.318 -27.281 642 HD2 TYR 90 HD2 TYR 90 40.192 6.563 -25.280 643 HE1 TYR 90 HE1 TYR 90 37.028 4.893 -28.653 644 HE2 TYR 90 HE2 TYR 90 38.914 8.159 -26.649 645 HH TYR 90 HH TYR 90 36.234 7.291 -28.439 646 H PHE 91 HN PHE 91 40.289 4.691 -22.306 647 HA PHE 91 HA PHE 91 37.664 5.864 -21.687 648 HB2 PHE 91 HB2 PHE 91 39.915 5.068 -19.874 649 HB3 PHE 91 HB1 PHE 91 38.833 6.370 -19.407 650 HD1 PHE 91 HD1 PHE 91 36.933 5.827 -18.180 651 HD2 PHE 91 HD2 PHE 91 38.687 2.874 -20.698 652 HE1 PHE 91 HE1 PHE 91 35.326 4.177 -17.360 653 HE2 PHE 91 HE2 PHE 91 37.063 1.215 -19.882 654 HZ PHE 91 HZ PHE 91 35.346 1.907 -18.192 655 H VAL 92 HN VAL 92 37.517 8.031 -21.275 656 HA VAL 92 HA VAL 92 39.762 9.613 -22.332 657 HB VAL 92 HB VAL 92 36.798 10.196 -22.474 658 HG11 VAL 92 HG11 VAL 92 38.171 12.230 -22.312 659 HG12 VAL 92 HG12 VAL 92 37.384 12.079 -23.884 660 HG13 VAL 92 HG13 VAL 92 39.101 11.700 -23.715 661 HG21 VAL 92 HG21 VAL 92 36.976 9.783 -24.847 662 HG22 VAL 92 HG22 VAL 92 37.515 8.361 -23.953 663 HG23 VAL 92 HG23 VAL 92 38.697 9.441 -24.689 664 H ASP 93 HN ASP 93 40.762 10.646 -20.705 665 HA ASP 93 HA ASP 93 39.308 11.558 -18.341 666 HB2 ASP 93 HB2 ASP 93 42.196 11.775 -19.244 667 HB3 ASP 93 HB1 ASP 93 41.589 12.747 -17.915 668 H HIS 94 HN HIS 94 37.803 13.096 -19.068 669 HA HIS 94 HA HIS 94 38.536 15.079 -21.025 670 HB2 HIS 94 HB2 HIS 94 36.180 13.953 -20.547 671 HB3 HIS 94 HB1 HIS 94 36.026 15.280 -19.402 672 HD1 HIS 94 HD1 HIS 94 34.294 14.882 -22.056 673 HD2 HIS 94 HD2 HIS 94 37.559 17.420 -21.592 674 HE1 HIS 94 HE1 HIS 94 34.028 16.667 -23.810 675 HE2 HIS 94 HE2 HIS 94 36.108 18.080 -23.634 676 H ASN 95 HN ASN 95 39.496 14.815 -18.014 677 HA ASN 95 HA ASN 95 38.968 17.542 -17.134 678 HB2 ASN 95 HB2 ASN 95 40.205 16.880 -15.049 679 HB3 ASN 95 HB1 ASN 95 38.800 15.868 -15.374 680 HD21 ASN 95 HD21 ASN 95 39.089 13.721 -15.926 681 HD22 ASN 95 HD22 ASN 95 40.614 12.915 -15.764 682 H THR 96 HN THR 96 41.848 15.486 -17.761 683 HA THR 96 HA THR 96 43.408 17.938 -18.059 684 HB THR 96 HB THR 96 45.364 16.279 -18.029 685 HG1 THR 96 HG1 THR 96 44.347 14.338 -18.372 686 HG21 THR 96 HG21 THR 96 43.586 16.525 -15.588 687 HG22 THR 96 HG22 THR 96 44.793 17.698 -16.112 688 HG23 THR 96 HG23 THR 96 45.302 16.101 -15.570 689 H ARG 97 HN ARG 97 41.666 16.093 -20.032 690 HA ARG 97 HA ARG 97 41.612 15.680 -22.273 691 HB2 ARG 97 HB2 ARG 97 43.592 17.915 -22.164 692 HB3 ARG 97 HB1 ARG 97 43.268 17.090 -23.686 693 HG2 ARG 97 HG2 ARG 97 40.912 17.621 -23.490 694 HG3 ARG 97 HG1 ARG 97 41.202 18.412 -21.942 695 HD2 ARG 97 HD2 ARG 97 41.007 19.997 -23.832 696 HD3 ARG 97 HD1 ARG 97 42.559 20.089 -23.005 697 HE ARG 97 HE ARG 97 42.809 18.310 -25.154 698 HH11 ARG 97 HH11 ARG 97 42.288 21.707 -24.572 699 HH12 ARG 97 HH12 ARG 97 43.067 22.227 -26.034 700 HH21 ARG 97 HH21 ARG 97 43.817 18.946 -27.090 701 HH22 ARG 97 HH22 ARG 97 43.914 20.641 -27.504 702 H THR 98 HN THR 98 42.285 13.609 -21.783 703 HA THR 98 HA THR 98 44.749 12.814 -23.072 704 HB THR 98 HB THR 98 45.182 11.332 -20.870 705 HG1 THR 98 HG1 THR 98 43.716 12.131 -19.471 706 HG21 THR 98 HG21 THR 98 46.884 12.764 -21.919 707 HG22 THR 98 HG22 THR 98 46.899 12.978 -20.165 708 HG23 THR 98 HG23 THR 98 46.146 14.195 -21.197 709 H THR 99 HN THR 99 44.833 10.442 -23.374 710 HA THR 99 HA THR 99 42.214 9.138 -22.920 711 HB THR 99 HB THR 99 42.873 7.791 -25.066 712 HG1 THR 99 HG1 THR 99 44.133 9.224 -26.517 713 HG21 THR 99 HG21 THR 99 42.056 10.726 -25.255 714 HG22 THR 99 HG22 THR 99 40.958 9.360 -25.052 715 HG23 THR 99 HG23 THR 99 41.864 9.551 -26.557 716 H THR 100 HN THR 100 42.328 7.065 -21.984 717 HA THR 100 HA THR 100 44.961 5.810 -21.846 718 HB THR 100 HB THR 100 44.808 7.199 -19.816 719 HG1 THR 100 HG1 THR 100 45.923 5.611 -19.008 720 HG21 THR 100 HG21 THR 100 43.185 6.530 -18.042 721 HG22 THR 100 HG22 THR 100 42.370 5.515 -19.235 722 HG23 THR 100 HG23 THR 100 42.428 7.263 -19.457 723 H PHE 101 HN PHE 101 44.894 3.591 -21.091 724 HA PHE 101 HA PHE 101 42.330 2.315 -21.737 725 HB2 PHE 101 HB2 PHE 101 45.189 1.451 -22.169 726 HB3 PHE 101 HB1 PHE 101 43.841 0.239 -22.111 727 HD1 PHE 101 HD1 PHE 101 42.441 -0.061 -23.949 728 HD2 PHE 101 HD2 PHE 101 45.142 3.219 -23.916 729 HE1 PHE 101 HE1 PHE 101 41.959 0.350 -26.318 730 HE2 PHE 101 HE2 PHE 101 44.665 3.649 -26.294 731 HZ PHE 101 HZ PHE 101 43.072 2.211 -27.497 732 H LYS 102 HN LYS 102 41.370 2.091 -19.776 733 HA LYS 102 HA LYS 102 42.758 0.376 -17.861 734 HB2 LYS 102 HB2 LYS 102 42.609 3.077 -17.431 735 HB3 LYS 102 HB1 LYS 102 41.151 2.514 -16.626 736 HG2 LYS 102 HG2 LYS 102 43.927 1.479 -16.091 737 HG3 LYS 102 HG1 LYS 102 43.086 2.687 -15.122 738 HD2 LYS 102 HD2 LYS 102 42.073 -0.111 -15.609 739 HD3 LYS 102 HD1 LYS 102 42.991 0.376 -14.185 740 HE2 LYS 102 HE2 LYS 102 41.260 1.956 -13.571 741 HE3 LYS 102 HE1 LYS 102 40.356 1.576 -15.036 742 HZ1 LYS 102 HZ1 LYS 102 39.459 0.416 -13.122 743 HZ2 LYS 102 HZ2 LYS 102 40.958 -0.323 -12.829 744 HZ3 LYS 102 HZ3 LYS 102 40.092 -0.689 -14.238 745 H ASP 103 HN ASP 103 41.511 -1.342 -17.729 746 HA ASP 103 HA ASP 103 38.592 -1.027 -17.787 747 HB2 ASP 103 HB2 ASP 103 39.592 -2.583 -19.456 748 HB3 ASP 103 HB1 ASP 103 40.252 -3.544 -18.137 749 HA PRO 104 HA PRO 104 38.195 -1.739 -13.438 750 HB2 PRO 104 HB2 PRO 104 36.145 -3.719 -13.687 751 HB3 PRO 104 HB1 PRO 104 35.932 -2.007 -13.320 752 HG2 PRO 104 HG2 PRO 104 35.660 -3.440 -15.888 753 HG3 PRO 104 HG1 PRO 104 34.886 -1.940 -15.347 754 HD2 PRO 104 HD2 PRO 104 36.839 -1.957 -17.196 755 HD3 PRO 104 HD1 PRO 104 36.678 -0.636 -16.020 756 H ARG 105 HN ARG 105 38.268 -4.576 -15.577 757 HA ARG 105 HA ARG 105 39.623 -6.045 -13.428 758 HB2 ARG 105 HB2 ARG 105 37.795 -6.926 -15.612 759 HB3 ARG 105 HB1 ARG 105 39.038 -8.041 -15.068 760 HG2 ARG 105 HG2 ARG 105 36.922 -8.444 -13.937 761 HG3 ARG 105 HG1 ARG 105 38.173 -7.931 -12.796 762 HD2 ARG 105 HD2 ARG 105 37.225 -5.577 -13.088 763 HD3 ARG 105 HD1 ARG 105 35.843 -6.356 -13.863 764 HE ARG 105 HE ARG 105 35.911 -7.712 -11.598 765 HH11 ARG 105 HH11 ARG 105 36.370 -4.290 -12.095 766 HH12 ARG 105 HH12 ARG 105 35.711 -3.828 -10.556 767 HH21 ARG 105 HH21 ARG 105 35.065 -7.146 -9.559 768 HH22 ARG 105 HH22 ARG 105 34.936 -5.466 -9.118 769 HA PRO 106 HA PRO 106 43.054 -5.424 -16.289 770 HB2 PRO 106 HB2 PRO 106 45.076 -6.006 -14.616 771 HB3 PRO 106 HB1 PRO 106 44.125 -4.477 -14.452 772 HG2 PRO 106 HG2 PRO 106 43.913 -7.040 -12.897 773 HG3 PRO 106 HG1 PRO 106 43.861 -5.366 -12.318 774 HD2 PRO 106 HD2 PRO 106 41.644 -6.934 -12.755 775 HD3 PRO 106 HD1 PRO 106 41.648 -5.135 -12.786 776 H GLY 107 HN GLY 107 43.806 -6.797 -17.755 777 HA2 GLY 107 HA2 GLY 107 44.959 -8.632 -18.571 778 HA3 GLY 107 HA1 GLY 107 44.858 -9.396 -16.970 779 H PHE 108 HN PHE 108 41.912 -8.996 -16.857 780 HA PHE 108 HA PHE 108 40.144 -10.491 -17.066 781 HB2 PHE 108 HB2 PHE 108 39.158 -10.465 -19.373 782 HB3 PHE 108 HB1 PHE 108 39.559 -8.839 -18.724 783 HD1 PHE 108 HD1 PHE 108 41.214 -7.482 -19.795 784 HD2 PHE 108 HD2 PHE 108 40.483 -11.444 -21.199 785 HE1 PHE 108 HE1 PHE 108 42.499 -6.997 -21.834 786 HE2 PHE 108 HE2 PHE 108 41.771 -10.959 -23.231 787 HZ PHE 108 HZ PHE 108 42.741 -8.753 -23.578 788 H GLU 109 HN GLU 109 42.701 -11.844 -17.085 789 HA GLU 109 HA GLU 109 43.573 -13.907 -17.310 790 HB2 GLU 109 HB2 GLU 109 41.576 -14.752 -16.284 791 HB3 GLU 109 HB1 GLU 109 40.659 -14.578 -17.770 792 HG2 GLU 109 HG2 GLU 109 42.098 -16.379 -18.771 793 HG3 GLU 109 HG1 GLU 109 42.788 -16.637 -17.165 Start of MODEL 9 1 H1 GLY 1 HT1 GLY 1 -39.973 7.682 4.338 2 H2 GLY 1 HT2 GLY 1 -40.230 9.204 5.036 3 H3 GLY 1 HT3 GLY 1 -38.723 8.831 4.355 4 HA2 GLY 1 HA1 GLY 1 -41.298 9.140 2.916 5 HA3 GLY 1 HA2 GLY 1 -39.943 10.259 2.870 6 H SER 2 HN SER 2 -40.858 6.915 2.131 7 HA SER 2 HA SER 2 -40.382 5.567 0.373 8 HB2 SER 2 HB2 SER 2 -40.811 7.631 -0.990 9 HB3 SER 2 HB1 SER 2 -39.084 7.968 -0.943 10 HG SER 2 HG SER 2 -38.824 6.585 -2.496 11 H HIS 3 HN HIS 3 -38.378 4.886 -1.080 12 HA HIS 3 HA HIS 3 -35.989 4.926 0.652 13 HB2 HIS 3 HB2 HIS 3 -37.068 2.642 -1.027 14 HB3 HIS 3 HB1 HIS 3 -35.492 2.642 -0.252 15 HD1 HIS 3 HD1 HIS 3 -37.206 0.386 0.522 16 HD2 HIS 3 HD2 HIS 3 -37.455 4.070 2.452 17 HE1 HIS 3 HE1 HIS 3 -38.218 -0.085 2.779 18 HE2 HIS 3 HE2 HIS 3 -38.550 2.177 3.831 19 H MET 4 HN MET 4 -33.938 4.578 -0.543 20 HA MET 4 HA MET 4 -34.067 5.103 -3.419 21 HB2 MET 4 HB2 MET 4 -32.278 6.552 -1.449 22 HB3 MET 4 HB1 MET 4 -32.081 6.617 -3.191 23 HG2 MET 4 HG2 MET 4 -34.373 7.566 -3.347 24 HG3 MET 4 HG1 MET 4 -34.412 7.632 -1.588 25 HE1 MET 4 HE1 MET 4 -31.307 8.287 -3.924 26 HE2 MET 4 HE2 MET 4 -31.456 10.023 -4.203 27 HE3 MET 4 HE3 MET 4 -32.674 8.917 -4.840 28 H GLN 5 HN GLN 5 -32.611 3.883 -4.574 29 HA GLN 5 HA GLN 5 -31.377 1.731 -3.125 30 HB2 GLN 5 HB2 GLN 5 -32.566 1.414 -5.289 31 HB3 GLN 5 HB1 GLN 5 -31.285 2.318 -6.083 32 HG2 GLN 5 HG2 GLN 5 -30.906 -0.028 -6.394 33 HG3 GLN 5 HG1 GLN 5 -29.663 0.620 -5.331 34 HE21 GLN 5 HE21 GLN 5 -32.553 -1.310 -5.532 35 HE22 GLN 5 HE22 GLN 5 -32.335 -2.138 -4.003 36 H TYR 6 HN TYR 6 -29.308 1.426 -2.698 37 HA TYR 6 HA TYR 6 -27.307 3.218 -3.898 38 HB2 TYR 6 HB2 TYR 6 -27.723 2.534 -0.993 39 HB3 TYR 6 HB1 TYR 6 -26.075 2.782 -1.560 40 HD1 TYR 6 HD1 TYR 6 -29.320 4.372 -0.911 41 HD2 TYR 6 HD2 TYR 6 -25.328 4.991 -2.244 42 HE1 TYR 6 HE1 TYR 6 -29.603 6.797 -0.633 43 HE2 TYR 6 HE2 TYR 6 -25.601 7.415 -1.964 44 HH TYR 6 HH TYR 6 -27.362 9.068 -1.861 45 H LYS 7 HN LYS 7 -25.161 2.260 -4.042 46 HA LYS 7 HA LYS 7 -25.163 -0.677 -3.896 47 HB2 LYS 7 HB2 LYS 7 -25.684 -0.303 -6.231 48 HB3 LYS 7 HB1 LYS 7 -24.398 0.910 -6.385 49 HG2 LYS 7 HG2 LYS 7 -22.790 -0.970 -5.804 50 HG3 LYS 7 HG1 LYS 7 -24.144 -2.070 -6.074 51 HD2 LYS 7 HD2 LYS 7 -23.349 -0.050 -8.140 52 HD3 LYS 7 HD1 LYS 7 -22.517 -1.601 -8.013 53 HE2 LYS 7 HE2 LYS 7 -24.884 -2.626 -8.089 54 HE3 LYS 7 HE1 LYS 7 -25.384 -1.049 -8.707 55 HZ1 LYS 7 HZ1 LYS 7 -23.222 -2.706 -9.893 56 HZ2 LYS 7 HZ2 LYS 7 -23.879 -1.274 -10.540 57 HZ3 LYS 7 HZ3 LYS 7 -24.820 -2.677 -10.456 58 H LEU 8 HN LEU 8 -23.321 -1.474 -3.040 59 HA LEU 8 HA LEU 8 -20.947 0.294 -3.023 60 HB2 LEU 8 HB2 LEU 8 -21.870 -0.218 -0.744 61 HB3 LEU 8 HB1 LEU 8 -21.664 -1.907 -1.082 62 HG LEU 8 HG LEU 8 -19.165 -1.334 -1.410 63 HD11 LEU 8 HD11 LEU 8 -19.326 1.067 -1.379 64 HD12 LEU 8 HD12 LEU 8 -18.414 0.517 0.024 65 HD13 LEU 8 HD13 LEU 8 -20.089 1.032 0.211 66 HD21 LEU 8 HD21 LEU 8 -18.945 -1.370 1.166 67 HD22 LEU 8 HD22 LEU 8 -19.660 -2.746 0.324 68 HD23 LEU 8 HD23 LEU 8 -20.695 -1.565 1.121 69 H ILE 9 HN ILE 9 -18.999 -0.511 -3.633 70 HA ILE 9 HA ILE 9 -18.989 -3.252 -4.709 71 HB ILE 9 HB ILE 9 -17.559 -0.809 -5.806 72 HG12 ILE 9 HG12 ILE 9 -19.580 -2.696 -7.104 73 HG13 ILE 9 HG11 ILE 9 -19.984 -1.053 -6.476 74 HG21 ILE 9 HG21 ILE 9 -16.060 -2.696 -5.879 75 HG22 ILE 9 HG22 ILE 9 -16.645 -2.351 -7.508 76 HG23 ILE 9 HG23 ILE 9 -17.312 -3.710 -6.601 77 HD11 ILE 9 HD11 ILE 9 -19.703 -0.975 -8.875 78 HD12 ILE 9 HD12 ILE 9 -18.122 -1.751 -8.763 79 HD13 ILE 9 HD13 ILE 9 -18.352 -0.126 -8.118 80 H LEU 10 HN LEU 10 -17.549 -4.559 -3.775 81 HA LEU 10 HA LEU 10 -15.659 -3.333 -1.926 82 HB2 LEU 10 HB2 LEU 10 -16.351 -6.255 -2.195 83 HB3 LEU 10 HB1 LEU 10 -15.276 -5.569 -1.009 84 HG LEU 10 HG LEU 10 -17.149 -5.910 0.237 85 HD11 LEU 10 HD11 LEU 10 -17.824 -3.201 -0.805 86 HD12 LEU 10 HD12 LEU 10 -16.493 -3.535 0.313 87 HD13 LEU 10 HD13 LEU 10 -18.157 -3.867 0.795 88 HD21 LEU 10 HD21 LEU 10 -18.538 -6.663 -1.693 89 HD22 LEU 10 HD22 LEU 10 -18.955 -4.972 -1.975 90 HD23 LEU 10 HD23 LEU 10 -19.417 -5.752 -0.467 91 H ASN 11 HN ASN 11 -13.865 -2.758 -2.888 92 HA ASN 11 HA ASN 11 -12.648 -4.569 -4.842 93 HB2 ASN 11 HB2 ASN 11 -12.079 -1.691 -4.096 94 HB3 ASN 11 HB1 ASN 11 -10.949 -2.644 -5.029 95 HD21 ASN 11 HD21 ASN 11 -11.111 -1.369 -6.836 96 HD22 ASN 11 HD22 ASN 11 -12.532 -1.320 -7.812 97 H GLY 12 HN GLY 12 -12.066 -6.163 -3.394 98 HA2 GLY 12 HA2 GLY 12 -9.729 -5.451 -1.735 99 HA3 GLY 12 HA1 GLY 12 -10.979 -6.549 -1.118 100 H LYS 13 HN LYS 13 -8.979 -7.847 -0.895 101 HA LYS 13 HA LYS 13 -8.051 -9.109 -3.322 102 HB2 LYS 13 HB2 LYS 13 -7.261 -9.596 -0.437 103 HB3 LYS 13 HB1 LYS 13 -6.546 -10.410 -1.820 104 HG2 LYS 13 HG2 LYS 13 -5.701 -8.326 -2.676 105 HG3 LYS 13 HG1 LYS 13 -6.523 -7.427 -1.399 106 HD2 LYS 13 HD2 LYS 13 -5.146 -8.520 0.287 107 HD3 LYS 13 HD1 LYS 13 -4.368 -9.491 -0.962 108 HE2 LYS 13 HE2 LYS 13 -3.000 -7.564 -0.218 109 HE3 LYS 13 HE1 LYS 13 -3.364 -7.542 -1.941 110 HZ1 LYS 13 HZ1 LYS 13 -5.132 -6.076 -0.100 111 HZ2 LYS 13 HZ2 LYS 13 -4.731 -5.754 -1.721 112 HZ3 LYS 13 HZ3 LYS 13 -3.617 -5.413 -0.495 113 H THR 14 HN THR 14 -9.591 -10.417 -0.292 114 HA THR 14 HA THR 14 -10.409 -12.749 -1.870 115 HB THR 14 HB THR 14 -11.056 -13.616 0.465 116 HG1 THR 14 HG1 THR 14 -9.935 -12.547 2.171 117 HG21 THR 14 HG21 THR 14 -8.154 -13.041 -0.154 118 HG22 THR 14 HG22 THR 14 -9.088 -14.419 -0.735 119 HG23 THR 14 HG23 THR 14 -8.740 -14.256 0.985 120 H LEU 15 HN LEU 15 -11.585 -9.840 -1.321 121 HA LEU 15 HA LEU 15 -14.352 -10.758 -1.340 122 HB2 LEU 15 HB2 LEU 15 -13.271 -9.524 0.855 123 HB3 LEU 15 HB1 LEU 15 -13.917 -8.160 -0.020 124 HG LEU 15 HG LEU 15 -15.566 -8.806 1.540 125 HD11 LEU 15 HD11 LEU 15 -16.282 -9.931 -1.149 126 HD12 LEU 15 HD12 LEU 15 -16.477 -8.264 -0.612 127 HD13 LEU 15 HD13 LEU 15 -17.432 -9.549 0.130 128 HD21 LEU 15 HD21 LEU 15 -14.616 -11.053 1.988 129 HD22 LEU 15 HD22 LEU 15 -15.391 -11.637 0.516 130 HD23 LEU 15 HD23 LEU 15 -16.374 -11.036 1.849 131 H LYS 16 HN LYS 16 -14.623 -10.412 -3.463 132 HA LYS 16 HA LYS 16 -14.508 -7.619 -4.367 133 HB2 LYS 16 HB2 LYS 16 -13.662 -10.091 -5.902 134 HB3 LYS 16 HB1 LYS 16 -13.811 -8.488 -6.605 135 HG2 LYS 16 HG2 LYS 16 -11.924 -7.704 -5.540 136 HG3 LYS 16 HG1 LYS 16 -12.006 -8.895 -4.238 137 HD2 LYS 16 HD2 LYS 16 -10.179 -9.187 -5.910 138 HD3 LYS 16 HD1 LYS 16 -11.205 -10.604 -5.685 139 HE2 LYS 16 HE2 LYS 16 -10.878 -10.405 -8.020 140 HE3 LYS 16 HE1 LYS 16 -12.498 -9.782 -7.714 141 HZ1 LYS 16 HZ1 LYS 16 -10.037 -8.238 -8.263 142 HZ2 LYS 16 HZ2 LYS 16 -11.449 -7.513 -7.670 143 HZ3 LYS 16 HZ3 LYS 16 -11.461 -8.284 -9.182 144 H GLY 17 HN GLY 17 -16.551 -7.009 -4.766 145 HA2 GLY 17 HA2 GLY 17 -18.342 -8.275 -6.435 146 HA3 GLY 17 HA1 GLY 17 -18.718 -8.860 -4.820 147 H GLU 18 HN GLU 18 -20.810 -7.772 -5.264 148 HA GLU 18 HA GLU 18 -20.706 -4.956 -4.471 149 HB2 GLU 18 HB2 GLU 18 -22.480 -6.007 -6.689 150 HB3 GLU 18 HB1 GLU 18 -22.408 -4.351 -6.112 151 HG2 GLU 18 HG2 GLU 18 -20.275 -4.014 -7.062 152 HG3 GLU 18 HG1 GLU 18 -20.060 -5.741 -7.368 153 H THR 19 HN THR 19 -22.866 -4.158 -3.790 154 HA THR 19 HA THR 19 -24.982 -6.025 -3.319 155 HB THR 19 HB THR 19 -23.530 -6.656 -1.437 156 HG1 THR 19 HG1 THR 19 -25.679 -5.158 -0.344 157 HG21 THR 19 HG21 THR 19 -23.074 -5.043 0.371 158 HG22 THR 19 HG22 THR 19 -23.846 -3.769 -0.572 159 HG23 THR 19 HG23 THR 19 -22.349 -4.507 -1.148 160 H THR 20 HN THR 20 -26.910 -4.973 -2.649 161 HA THR 20 HA THR 20 -26.781 -2.030 -2.850 162 HB THR 20 HB THR 20 -29.119 -2.209 -3.804 163 HG1 THR 20 HG1 THR 20 -28.430 -4.990 -3.872 164 HG21 THR 20 HG21 THR 20 -26.895 -3.605 -5.314 165 HG22 THR 20 HG22 THR 20 -27.229 -1.872 -5.311 166 HG23 THR 20 HG23 THR 20 -28.378 -2.994 -6.046 167 H THR 21 HN THR 21 -28.635 -0.904 -1.778 168 HA THR 21 HA THR 21 -30.097 -2.300 0.267 169 HB THR 21 HB THR 21 -27.821 -1.914 1.343 170 HG1 THR 21 HG1 THR 21 -29.186 -2.134 2.956 171 HG21 THR 21 HG21 THR 21 -27.314 0.331 0.456 172 HG22 THR 21 HG22 THR 21 -27.421 0.408 2.219 173 HG23 THR 21 HG23 THR 21 -28.764 0.974 1.226 174 H GLU 22 HN GLU 22 -31.696 -0.918 1.269 175 HA GLU 22 HA GLU 22 -32.383 1.338 -0.487 176 HB2 GLU 22 HB2 GLU 22 -34.124 -0.063 1.563 177 HB3 GLU 22 HB1 GLU 22 -34.650 1.065 0.332 178 HG2 GLU 22 HG2 GLU 22 -34.196 -0.535 -1.428 179 HG3 GLU 22 HG1 GLU 22 -33.476 -1.667 -0.221 180 H ALA 23 HN ALA 23 -31.554 3.213 0.286 181 HA ALA 23 HA ALA 23 -32.083 3.788 3.146 182 HB1 ALA 23 HB1 ALA 23 -29.971 5.001 3.329 183 HB2 ALA 23 HB2 ALA 23 -29.574 4.619 1.656 184 HB3 ALA 23 HB3 ALA 23 -29.662 3.328 2.854 185 H VAL 24 HN VAL 24 -32.575 6.066 3.587 186 HA VAL 24 HA VAL 24 -33.502 7.465 1.237 187 HB VAL 24 HB VAL 24 -35.113 6.961 2.997 188 HG11 VAL 24 HG11 VAL 24 -34.899 7.958 5.231 189 HG12 VAL 24 HG12 VAL 24 -33.301 8.569 4.804 190 HG13 VAL 24 HG13 VAL 24 -33.586 6.830 4.893 191 HG21 VAL 24 HG21 VAL 24 -35.950 9.196 3.409 192 HG22 VAL 24 HG22 VAL 24 -35.396 8.989 1.747 193 HG23 VAL 24 HG23 VAL 24 -34.397 9.853 2.910 194 H ASP 25 HN ASP 25 -30.704 7.396 2.847 195 HA ASP 25 HA ASP 25 -30.135 10.196 2.440 196 HB2 ASP 25 HB2 ASP 25 -30.879 10.355 4.706 197 HB3 ASP 25 HB1 ASP 25 -29.959 8.940 5.183 198 H ALA 26 HN ALA 26 -27.848 10.686 2.604 199 HA ALA 26 HA ALA 26 -26.341 8.574 1.348 200 HB1 ALA 26 HB1 ALA 26 -25.476 11.370 2.085 201 HB2 ALA 26 HB2 ALA 26 -26.201 10.897 0.546 202 HB3 ALA 26 HB3 ALA 26 -24.623 10.260 1.015 203 H ALA 27 HN ALA 27 -26.243 10.328 4.427 204 HA ALA 27 HA ALA 27 -23.797 9.102 5.311 205 HB1 ALA 27 HB1 ALA 27 -24.345 10.075 7.498 206 HB2 ALA 27 HB2 ALA 27 -25.938 10.528 6.894 207 HB3 ALA 27 HB3 ALA 27 -24.490 11.266 6.205 208 H THR 28 HN THR 28 -27.232 8.506 5.677 209 HA THR 28 HA THR 28 -27.063 6.364 7.512 210 HB THR 28 HB THR 28 -29.160 6.691 5.347 211 HG1 THR 28 HG1 THR 28 -28.693 8.518 6.960 212 HG21 THR 28 HG21 THR 28 -29.245 5.315 8.042 213 HG22 THR 28 HG22 THR 28 -29.206 4.510 6.475 214 HG23 THR 28 HG23 THR 28 -30.608 5.481 6.934 215 H ALA 29 HN ALA 29 -26.443 6.557 4.081 216 HA ALA 29 HA ALA 29 -26.683 3.727 3.591 217 HB1 ALA 29 HB1 ALA 29 -25.767 4.238 1.393 218 HB2 ALA 29 HB2 ALA 29 -25.372 5.873 1.923 219 HB3 ALA 29 HB3 ALA 29 -27.057 5.371 1.801 220 H GLU 30 HN GLU 30 -24.151 6.064 4.260 221 HA GLU 30 HA GLU 30 -21.903 4.408 3.916 222 HB2 GLU 30 HB2 GLU 30 -22.069 6.986 4.351 223 HB3 GLU 30 HB1 GLU 30 -22.079 6.519 6.044 224 HG2 GLU 30 HG2 GLU 30 -19.942 5.274 5.612 225 HG3 GLU 30 HG1 GLU 30 -19.924 6.060 4.031 226 H LYS 31 HN LYS 31 -23.747 5.232 6.839 227 HA LYS 31 HA LYS 31 -22.311 3.720 8.651 228 HB2 LYS 31 HB2 LYS 31 -25.193 4.563 8.654 229 HB3 LYS 31 HB1 LYS 31 -24.458 3.710 10.005 230 HG2 LYS 31 HG2 LYS 31 -23.662 6.398 8.905 231 HG3 LYS 31 HG1 LYS 31 -24.423 6.061 10.458 232 HD2 LYS 31 HD2 LYS 31 -21.659 5.198 9.605 233 HD3 LYS 31 HD1 LYS 31 -22.045 6.478 10.758 234 HE2 LYS 31 HE2 LYS 31 -23.031 4.853 12.263 235 HE3 LYS 31 HE1 LYS 31 -22.757 3.564 11.092 236 HZ1 LYS 31 HZ1 LYS 31 -20.368 3.972 11.303 237 HZ2 LYS 31 HZ2 LYS 31 -21.058 3.541 12.786 238 HZ3 LYS 31 HZ3 LYS 31 -20.663 5.162 12.472 239 H VAL 32 HN VAL 32 -25.112 2.659 6.720 240 HA VAL 32 HA VAL 32 -25.320 0.115 7.962 241 HB VAL 32 HB VAL 32 -26.281 0.994 5.231 242 HG11 VAL 32 HG11 VAL 32 -27.001 -1.442 6.868 243 HG12 VAL 32 HG12 VAL 32 -26.142 -1.422 5.328 244 HG13 VAL 32 HG13 VAL 32 -27.834 -0.926 5.399 245 HG21 VAL 32 HG21 VAL 32 -28.453 1.251 6.327 246 HG22 VAL 32 HG22 VAL 32 -27.231 2.308 7.038 247 HG23 VAL 32 HG23 VAL 32 -27.716 0.833 7.874 248 H PHE 33 HN PHE 33 -23.819 1.178 4.919 249 HA PHE 33 HA PHE 33 -22.902 -1.424 4.203 250 HB2 PHE 33 HB2 PHE 33 -22.424 1.334 3.172 251 HB3 PHE 33 HB1 PHE 33 -21.323 0.067 2.693 252 HD1 PHE 33 HD1 PHE 33 -23.470 1.829 1.137 253 HD2 PHE 33 HD2 PHE 33 -23.311 -2.181 2.539 254 HE1 PHE 33 HE1 PHE 33 -25.075 1.160 -0.605 255 HE2 PHE 33 HE2 PHE 33 -24.920 -2.858 0.808 256 HZ PHE 33 HZ PHE 33 -25.724 -1.144 -0.855 257 H LYS 34 HN LYS 34 -21.584 1.001 6.318 258 HA LYS 34 HA LYS 34 -18.887 0.064 6.087 259 HB2 LYS 34 HB2 LYS 34 -20.295 1.874 8.039 260 HB3 LYS 34 HB1 LYS 34 -18.611 1.481 8.220 261 HG2 LYS 34 HG2 LYS 34 -18.330 2.361 5.834 262 HG3 LYS 34 HG1 LYS 34 -19.944 3.032 6.027 263 HD2 LYS 34 HD2 LYS 34 -18.342 4.755 6.575 264 HD3 LYS 34 HD1 LYS 34 -19.165 4.237 8.043 265 HE2 LYS 34 HE2 LYS 34 -17.292 2.844 8.658 266 HE3 LYS 34 HE1 LYS 34 -16.466 3.258 7.155 267 HZ1 LYS 34 HZ1 LYS 34 -16.159 5.451 7.854 268 HZ2 LYS 34 HZ2 LYS 34 -15.793 4.520 9.225 269 HZ3 LYS 34 HZ3 LYS 34 -17.286 5.315 9.111 270 H GLN 35 HN GLN 35 -21.585 -0.396 8.297 271 HA GLN 35 HA GLN 35 -20.382 -2.180 10.096 272 HB2 GLN 35 HB2 GLN 35 -22.839 -0.976 9.823 273 HB3 GLN 35 HB1 GLN 35 -23.223 -2.608 9.339 274 HG2 GLN 35 HG2 GLN 35 -22.237 -1.680 12.036 275 HG3 GLN 35 HG1 GLN 35 -23.777 -2.419 11.626 276 HE21 GLN 35 HE21 GLN 35 -20.430 -2.977 12.287 277 HE22 GLN 35 HE22 GLN 35 -20.526 -4.704 12.387 278 H TYR 36 HN TYR 36 -22.063 -2.507 7.056 279 HA TYR 36 HA TYR 36 -22.022 -5.287 6.727 280 HB2 TYR 36 HB2 TYR 36 -23.360 -4.019 5.221 281 HB3 TYR 36 HB1 TYR 36 -22.015 -2.974 4.797 282 HD1 TYR 36 HD1 TYR 36 -20.899 -3.308 2.891 283 HD2 TYR 36 HD2 TYR 36 -23.032 -6.570 4.536 284 HE1 TYR 36 HE1 TYR 36 -20.344 -4.623 0.903 285 HE2 TYR 36 HE2 TYR 36 -22.483 -7.938 2.565 286 HH TYR 36 HH TYR 36 -20.134 -7.027 0.299 287 H ALA 37 HN ALA 37 -19.725 -2.866 5.445 288 HA ALA 37 HA ALA 37 -17.884 -4.691 4.374 289 HB1 ALA 37 HB1 ALA 37 -17.323 -1.921 5.443 290 HB2 ALA 37 HB2 ALA 37 -17.920 -2.294 3.825 291 HB3 ALA 37 HB3 ALA 37 -16.314 -2.832 4.318 292 H ASN 38 HN ASN 38 -18.397 -3.546 7.586 293 HA ASN 38 HA ASN 38 -15.907 -4.307 8.710 294 HB2 ASN 38 HB2 ASN 38 -17.439 -2.677 9.824 295 HB3 ASN 38 HB1 ASN 38 -18.627 -3.953 10.057 296 HD21 ASN 38 HD21 ASN 38 -15.774 -2.451 11.294 297 HD22 ASN 38 HD22 ASN 38 -15.565 -3.519 12.696 298 H ASP 39 HN ASP 39 -18.790 -6.047 7.902 299 HA ASP 39 HA ASP 39 -18.271 -8.322 9.566 300 HB2 ASP 39 HB2 ASP 39 -20.542 -7.922 8.909 301 HB3 ASP 39 HB1 ASP 39 -20.104 -7.883 7.205 302 H ASN 40 HN ASN 40 -17.325 -7.310 6.355 303 HA ASN 40 HA ASN 40 -16.240 -9.981 5.834 304 HB2 ASN 40 HB2 ASN 40 -15.821 -8.975 3.480 305 HB3 ASN 40 HB1 ASN 40 -17.458 -9.422 3.932 306 HD21 ASN 40 HD21 ASN 40 -19.023 -7.901 4.070 307 HD22 ASN 40 HD22 ASN 40 -18.747 -6.212 3.617 308 H GLY 41 HN GLY 41 -15.314 -7.276 7.280 309 HA2 GLY 41 HA2 GLY 41 -13.279 -6.505 7.986 310 HA3 GLY 41 HA1 GLY 41 -12.590 -7.978 7.328 311 H VAL 42 HN VAL 42 -14.305 -5.504 5.463 312 HA VAL 42 HA VAL 42 -11.775 -4.950 4.094 313 HB VAL 42 HB VAL 42 -14.614 -4.711 3.071 314 HG11 VAL 42 HG11 VAL 42 -13.599 -4.061 0.938 315 HG12 VAL 42 HG12 VAL 42 -11.999 -4.122 1.676 316 HG13 VAL 42 HG13 VAL 42 -13.165 -2.917 2.213 317 HG21 VAL 42 HG21 VAL 42 -12.333 -6.573 2.430 318 HG22 VAL 42 HG22 VAL 42 -13.798 -6.440 1.455 319 HG23 VAL 42 HG23 VAL 42 -13.904 -6.991 3.130 320 H ASP 43 HN ASP 43 -10.909 -3.169 4.835 321 HA ASP 43 HA ASP 43 -12.625 -0.800 5.036 322 HB2 ASP 43 HB2 ASP 43 -11.441 -0.001 7.033 323 HB3 ASP 43 HB1 ASP 43 -12.046 -1.625 7.360 324 H GLY 44 HN GLY 44 -11.732 1.092 4.202 325 HA2 GLY 44 HA2 GLY 44 -9.066 1.520 3.512 326 HA3 GLY 44 HA1 GLY 44 -9.853 0.753 2.136 327 H GLU 45 HN GLU 45 -9.174 2.958 1.255 328 HA GLU 45 HA GLU 45 -10.528 5.312 1.990 329 HB2 GLU 45 HB2 GLU 45 -8.994 4.392 -0.377 330 HB3 GLU 45 HB1 GLU 45 -10.110 5.720 -0.648 331 HG2 GLU 45 HG2 GLU 45 -7.956 6.626 -0.182 332 HG3 GLU 45 HG1 GLU 45 -9.006 6.964 1.191 333 H TRP 46 HN TRP 46 -12.357 6.299 1.200 334 HA TRP 46 HA TRP 46 -14.269 4.500 -0.146 335 HB2 TRP 46 HB2 TRP 46 -14.655 6.408 2.142 336 HB3 TRP 46 HB1 TRP 46 -15.974 6.200 1.008 337 HD1 TRP 46 HD1 TRP 46 -13.600 3.653 2.731 338 HE1 TRP 46 HE1 TRP 46 -15.028 1.795 3.783 339 HE3 TRP 46 HE3 TRP 46 -18.306 5.391 1.535 340 HZ2 TRP 46 HZ2 TRP 46 -17.742 1.153 4.088 341 HZ3 TRP 46 HZ3 TRP 46 -20.240 4.077 2.269 342 HH2 TRP 46 HH2 TRP 46 -19.963 2.003 3.515 343 H THR 47 HN THR 47 -15.434 5.244 -1.824 344 HA THR 47 HA THR 47 -15.203 8.060 -2.621 345 HB THR 47 HB THR 47 -15.136 7.101 -5.050 346 HG1 THR 47 HG1 THR 47 -13.546 5.068 -4.486 347 HG21 THR 47 HG21 THR 47 -12.709 7.201 -5.052 348 HG22 THR 47 HG22 THR 47 -12.677 6.951 -3.308 349 HG23 THR 47 HG23 THR 47 -13.355 8.437 -3.971 350 H TYR 48 HN TYR 48 -16.935 8.703 -4.155 351 HA TYR 48 HA TYR 48 -19.209 6.895 -4.221 352 HB2 TYR 48 HB2 TYR 48 -19.696 8.027 -2.218 353 HB3 TYR 48 HB1 TYR 48 -19.206 9.566 -2.848 354 HD1 TYR 48 HD1 TYR 48 -21.770 6.900 -3.456 355 HD2 TYR 48 HD2 TYR 48 -20.868 11.065 -3.493 356 HE1 TYR 48 HE1 TYR 48 -24.110 7.400 -4.000 357 HE2 TYR 48 HE2 TYR 48 -23.213 11.570 -4.033 358 HH TYR 48 HH TYR 48 -25.151 10.538 -4.991 359 H ASP 49 HN ASP 49 -20.349 7.010 -6.056 360 HA ASP 49 HA ASP 49 -19.862 9.350 -7.827 361 HB2 ASP 49 HB2 ASP 49 -19.126 7.213 -8.933 362 HB3 ASP 49 HB1 ASP 49 -20.720 6.551 -8.714 363 H ASP 50 HN ASP 50 -21.714 10.477 -8.496 364 HA ASP 50 HA ASP 50 -23.997 9.905 -6.743 365 HB2 ASP 50 HB2 ASP 50 -23.080 12.235 -6.829 366 HB3 ASP 50 HB1 ASP 50 -23.564 12.319 -8.522 367 H ALA 51 HN ALA 51 -23.141 9.743 -10.095 368 HA ALA 51 HA ALA 51 -25.794 9.768 -11.124 369 HB1 ALA 51 HB1 ALA 51 -23.343 8.541 -12.385 370 HB2 ALA 51 HB2 ALA 51 -23.764 10.251 -12.470 371 HB3 ALA 51 HB3 ALA 51 -24.825 9.049 -13.200 372 H THR 52 HN THR 52 -23.703 7.272 -9.835 373 HA THR 52 HA THR 52 -25.737 5.258 -10.508 374 HB THR 52 HB THR 52 -23.863 3.630 -9.911 375 HG1 THR 52 HG1 THR 52 -22.239 5.943 -10.324 376 HG21 THR 52 HG21 THR 52 -22.758 3.944 -12.120 377 HG22 THR 52 HG22 THR 52 -23.581 5.498 -12.266 378 HG23 THR 52 HG23 THR 52 -24.519 4.006 -12.211 379 H LYS 53 HN LYS 53 -24.749 7.093 -7.882 380 HA LYS 53 HA LYS 53 -24.973 6.936 -5.591 381 HB2 LYS 53 HB2 LYS 53 -27.137 5.046 -6.509 382 HB3 LYS 53 HB1 LYS 53 -26.830 5.335 -4.805 383 HG2 LYS 53 HG2 LYS 53 -28.609 6.749 -5.427 384 HG3 LYS 53 HG1 LYS 53 -27.193 7.776 -5.222 385 HD2 LYS 53 HD2 LYS 53 -26.867 7.731 -7.684 386 HD3 LYS 53 HD1 LYS 53 -28.371 6.822 -7.836 387 HE2 LYS 53 HE2 LYS 53 -28.813 9.151 -8.255 388 HE3 LYS 53 HE1 LYS 53 -29.568 8.683 -6.730 389 HZ1 LYS 53 HZ1 LYS 53 -27.011 10.165 -7.061 390 HZ2 LYS 53 HZ2 LYS 53 -27.635 9.647 -5.581 391 HZ3 LYS 53 HZ3 LYS 53 -28.478 10.800 -6.489 392 H THR 54 HN THR 54 -23.010 5.400 -6.848 393 HA THR 54 HA THR 54 -22.915 2.902 -5.347 394 HB THR 54 HB THR 54 -21.209 3.773 -7.702 395 HG1 THR 54 HG1 THR 54 -23.683 2.991 -7.694 396 HG21 THR 54 HG21 THR 54 -20.002 2.188 -6.273 397 HG22 THR 54 HG22 THR 54 -20.544 1.366 -7.740 398 HG23 THR 54 HG23 THR 54 -21.410 1.127 -6.223 399 H TYR 55 HN TYR 55 -21.913 3.011 -3.487 400 HA TYR 55 HA TYR 55 -19.625 4.743 -3.029 401 HB2 TYR 55 HB2 TYR 55 -21.117 2.801 -1.224 402 HB3 TYR 55 HB1 TYR 55 -19.568 3.502 -0.762 403 HD1 TYR 55 HD1 TYR 55 -19.373 5.950 -0.356 404 HD2 TYR 55 HD2 TYR 55 -23.122 4.101 -1.165 405 HE1 TYR 55 HE1 TYR 55 -20.534 7.932 0.513 406 HE2 TYR 55 HE2 TYR 55 -24.288 6.083 -0.301 407 HH TYR 55 HH TYR 55 -22.786 9.028 0.224 408 H THR 56 HN THR 56 -17.508 4.033 -2.946 409 HA THR 56 HA THR 56 -17.112 1.154 -3.428 410 HB THR 56 HB THR 56 -15.511 3.389 -4.710 411 HG1 THR 56 HG1 THR 56 -17.854 2.510 -5.369 412 HG21 THR 56 HG21 THR 56 -14.169 1.356 -4.303 413 HG22 THR 56 HG22 THR 56 -14.475 1.587 -6.025 414 HG23 THR 56 HG23 THR 56 -15.397 0.387 -5.120 415 H VAL 57 HN VAL 57 -15.647 0.158 -2.193 416 HA VAL 57 HA VAL 57 -13.962 1.843 -0.462 417 HB VAL 57 HB VAL 57 -15.625 0.678 0.951 418 HG11 VAL 57 HG11 VAL 57 -15.444 -1.806 1.250 419 HG12 VAL 57 HG12 VAL 57 -14.498 -1.851 -0.233 420 HG13 VAL 57 HG13 VAL 57 -16.172 -1.295 -0.267 421 HG21 VAL 57 HG21 VAL 57 -12.838 -0.428 1.280 422 HG22 VAL 57 HG22 VAL 57 -14.072 -0.330 2.537 423 HG23 VAL 57 HG23 VAL 57 -13.401 1.145 1.840 424 H THR 58 HN THR 58 -11.916 1.720 -0.940 425 HA THR 58 HA THR 58 -10.986 -0.557 -2.556 426 HB THR 58 HB THR 58 -9.553 2.070 -2.193 427 HG1 THR 58 HG1 THR 58 -11.917 1.704 -3.320 428 HG21 THR 58 HG21 THR 58 -8.246 0.236 -3.165 429 HG22 THR 58 HG22 THR 58 -8.566 1.487 -4.367 430 HG23 THR 58 HG23 THR 58 -9.494 -0.013 -4.386 431 H GLU 59 HN GLU 59 -9.811 -2.034 -1.590 432 HA GLU 59 HA GLU 59 -8.693 -1.584 1.029 433 HB2 GLU 59 HB2 GLU 59 -9.828 -3.726 0.213 434 HB3 GLU 59 HB1 GLU 59 -8.375 -4.017 -0.726 435 HG2 GLU 59 HG2 GLU 59 -8.183 -3.667 2.227 436 HG3 GLU 59 HG1 GLU 59 -8.714 -5.191 1.548 437 H GLY 60 HN GLY 60 -6.722 -0.475 1.118 438 HA2 GLY 60 HA2 GLY 60 -4.465 -1.596 -0.297 439 HA3 GLY 60 HA1 GLY 60 -4.939 0.004 -0.864 440 H SER 61 HN SER 61 -2.555 -1.056 0.625 441 HA SER 61 HA SER 61 -2.626 0.873 2.848 442 HB2 SER 61 HB2 SER 61 -0.820 -0.699 3.850 443 HB3 SER 61 HB1 SER 61 -2.498 -1.248 3.907 444 HG SER 61 HG SER 61 -2.088 -2.752 2.429 445 H GLY 62 HN GLY 62 -1.003 2.340 2.939 446 HA2 GLY 62 HA2 GLY 62 1.045 2.164 0.808 447 HA3 GLY 62 HA1 GLY 62 0.358 3.671 1.401 448 H GLY 63 HN GLY 63 0.454 3.117 4.169 449 HA2 GLY 63 HA2 GLY 63 3.329 3.458 4.615 450 HA3 GLY 63 HA1 GLY 63 2.044 3.850 5.749 451 H ALA 64 HN ALA 64 2.153 0.825 4.064 452 HA ALA 64 HA ALA 64 2.560 -1.326 4.656 453 HB1 ALA 64 HB1 ALA 64 4.105 -1.876 6.428 454 HB2 ALA 64 HB2 ALA 64 4.023 -0.231 7.054 455 HB3 ALA 64 HB3 ALA 64 4.745 -0.537 5.472 456 H GLY 65 HN GLY 65 1.846 -2.992 6.171 457 HA2 GLY 65 HA2 GLY 65 0.283 -2.228 8.458 458 HA3 GLY 65 HA1 GLY 65 -0.722 -2.652 7.081 459 H GLY 66 HN GLY 66 1.008 -3.808 9.733 460 HA2 GLY 66 HA2 GLY 66 0.653 -6.586 8.776 461 HA3 GLY 66 HA1 GLY 66 2.073 -6.096 9.687 462 H GLN 67 HN GLN 67 -0.124 -4.279 11.070 463 HA GLN 67 HA GLN 67 -1.301 -4.260 12.976 464 HB2 GLN 67 HB2 GLN 67 -1.958 -7.048 12.014 465 HB3 GLN 67 HB1 GLN 67 -2.572 -6.435 13.571 466 HG2 GLN 67 HG2 GLN 67 -4.288 -6.020 12.047 467 HG3 GLN 67 HG1 GLN 67 -3.482 -4.468 12.235 468 HE21 GLN 67 HE21 GLN 67 -4.170 -3.661 10.292 469 HE22 GLN 67 HE22 GLN 67 -3.597 -4.249 8.770 470 H GLY 68 HN GLY 68 -0.025 -7.619 13.115 471 HA2 GLY 68 HA2 GLY 68 2.091 -7.736 14.527 472 HA3 GLY 68 HA1 GLY 68 1.144 -6.877 15.731 473 H MET 69 HN MET 69 -1.296 -8.400 15.081 474 HA MET 69 HA MET 69 -0.570 -10.780 16.619 475 HB2 MET 69 HB2 MET 69 -2.985 -10.897 17.186 476 HB3 MET 69 HB1 MET 69 -2.220 -9.396 17.692 477 HG2 MET 69 HG2 MET 69 -3.168 -8.259 15.744 478 HG3 MET 69 HG1 MET 69 -3.950 -9.763 15.255 479 HE1 MET 69 HE1 MET 69 -6.291 -8.453 15.152 480 HE2 MET 69 HE2 MET 69 -5.476 -6.974 15.659 481 HE3 MET 69 HE3 MET 69 -6.933 -7.511 16.497 482 H ILE 70 HN ILE 70 -0.881 -12.829 15.827 483 HA ILE 70 HA ILE 70 -2.385 -13.122 13.326 484 HB ILE 70 HB ILE 70 0.390 -14.290 13.754 485 HG12 ILE 70 HG12 ILE 70 0.335 -11.873 13.137 486 HG13 ILE 70 HG11 ILE 70 1.116 -12.891 11.932 487 HG21 ILE 70 HG21 ILE 70 0.196 -15.285 11.550 488 HG22 ILE 70 HG22 ILE 70 -1.394 -14.564 11.314 489 HG23 ILE 70 HG23 ILE 70 -1.171 -15.826 12.526 490 HD11 ILE 70 HD11 ILE 70 -0.936 -12.842 10.586 491 HD12 ILE 70 HD12 ILE 70 -0.275 -11.231 10.861 492 HD13 ILE 70 HD13 ILE 70 -1.680 -11.776 11.778 493 H GLN 71 HN GLN 71 -0.619 -14.920 15.877 494 HA GLN 71 HA GLN 71 -2.575 -17.096 15.571 495 HB2 GLN 71 HB2 GLN 71 0.090 -17.022 16.994 496 HB3 GLN 71 HB1 GLN 71 -0.983 -18.415 16.971 497 HG2 GLN 71 HG2 GLN 71 -0.779 -18.423 14.481 498 HG3 GLN 71 HG1 GLN 71 0.441 -17.159 14.639 499 HE21 GLN 71 HE21 GLN 71 -0.316 -20.506 15.194 500 HE22 GLN 71 HE22 GLN 71 1.309 -21.034 15.477 501 H GLU 72 HN GLU 72 -2.933 -14.462 17.021 502 HA GLU 72 HA GLU 72 -3.313 -15.428 19.754 503 HB2 GLU 72 HB2 GLU 72 -3.341 -12.637 18.612 504 HB3 GLU 72 HB1 GLU 72 -3.725 -13.016 20.287 505 HG2 GLU 72 HG2 GLU 72 -1.501 -13.916 20.622 506 HG3 GLU 72 HG1 GLU 72 -1.112 -13.631 18.927 507 HA PRO 73 HA PRO 73 -7.658 -15.770 18.798 508 HB2 PRO 73 HB2 PRO 73 -8.482 -16.609 21.249 509 HB3 PRO 73 HB1 PRO 73 -7.639 -17.685 20.077 510 HG2 PRO 73 HG2 PRO 73 -6.568 -16.310 22.510 511 HG3 PRO 73 HG1 PRO 73 -6.173 -17.906 21.850 512 HD2 PRO 73 HD2 PRO 73 -4.630 -15.635 21.542 513 HD3 PRO 73 HD1 PRO 73 -4.568 -17.068 20.464 514 H ALA 74 HN ALA 74 -9.730 -15.224 20.102 515 HA ALA 74 HA ALA 74 -9.371 -12.748 21.588 516 HB1 ALA 74 HB1 ALA 74 -11.084 -11.593 20.304 517 HB2 ALA 74 HB2 ALA 74 -11.270 -13.003 19.264 518 HB3 ALA 74 HB3 ALA 74 -9.759 -12.096 19.252 519 H LEU 75 HN LEU 75 -10.657 -12.600 23.317 520 HA LEU 75 HA LEU 75 -12.621 -14.708 23.734 521 HB2 LEU 75 HB2 LEU 75 -11.298 -12.739 25.556 522 HB3 LEU 75 HB1 LEU 75 -12.753 -13.558 26.061 523 HG LEU 75 HG LEU 75 -10.879 -14.717 26.981 524 HD11 LEU 75 HD11 LEU 75 -12.738 -16.107 26.219 525 HD12 LEU 75 HD12 LEU 75 -11.197 -16.955 26.077 526 HD13 LEU 75 HD13 LEU 75 -11.964 -16.273 24.643 527 HD21 LEU 75 HD21 LEU 75 -9.119 -15.703 25.604 528 HD22 LEU 75 HD22 LEU 75 -9.148 -13.947 25.449 529 HD23 LEU 75 HD23 LEU 75 -9.825 -14.959 24.171 530 HA PRO 76 HA PRO 76 -15.911 -11.937 22.518 531 HB2 PRO 76 HB2 PRO 76 -17.651 -13.720 24.154 532 HB3 PRO 76 HB1 PRO 76 -17.798 -13.314 22.442 533 HG2 PRO 76 HG2 PRO 76 -16.992 -15.742 23.180 534 HG3 PRO 76 HG1 PRO 76 -16.208 -14.892 21.795 535 HD2 PRO 76 HD2 PRO 76 -15.203 -15.146 24.657 536 HD3 PRO 76 HD1 PRO 76 -14.326 -15.378 23.129 537 HA PRO 77 HA PRO 77 -16.335 -9.023 25.803 538 HB2 PRO 77 HB2 PRO 77 -19.165 -9.014 24.762 539 HB3 PRO 77 HB1 PRO 77 -18.164 -7.633 25.239 540 HG2 PRO 77 HG2 PRO 77 -18.371 -8.163 22.691 541 HG3 PRO 77 HG1 PRO 77 -16.755 -7.877 23.374 542 HD2 PRO 77 HD2 PRO 77 -18.036 -10.497 22.605 543 HD3 PRO 77 HD1 PRO 77 -16.335 -9.940 22.395 544 H GLY 78 HN GLY 78 -16.629 -9.350 27.909 545 HA2 GLY 78 HA2 GLY 78 -17.889 -9.965 29.822 546 HA3 GLY 78 HA1 GLY 78 -18.911 -10.949 28.790 547 H TRP 79 HN TRP 79 -16.460 -12.231 27.537 548 HA TRP 79 HA TRP 79 -16.161 -14.285 29.617 549 HB2 TRP 79 HB2 TRP 79 -15.367 -14.227 26.689 550 HB3 TRP 79 HB1 TRP 79 -14.987 -15.566 27.764 551 HD1 TRP 79 HD1 TRP 79 -17.995 -13.826 26.095 552 HE1 TRP 79 HE1 TRP 79 -19.969 -15.469 26.053 553 HE3 TRP 79 HE3 TRP 79 -15.942 -17.634 28.838 554 HZ2 TRP 79 HZ2 TRP 79 -20.579 -18.044 27.056 555 HZ3 TRP 79 HZ3 TRP 79 -17.285 -19.648 29.248 556 HH2 TRP 79 HH2 TRP 79 -19.554 -19.856 28.379 557 H GLU 80 HN GLU 80 -14.234 -14.812 30.631 558 HA GLU 80 HA GLU 80 -11.816 -13.346 29.818 559 HB2 GLU 80 HB2 GLU 80 -12.840 -13.947 32.592 560 HB3 GLU 80 HB1 GLU 80 -11.157 -13.553 32.283 561 HG2 GLU 80 HG2 GLU 80 -11.914 -11.399 31.287 562 HG3 GLU 80 HG1 GLU 80 -13.556 -11.805 31.789 563 H MET 81 HN MET 81 -9.846 -14.462 30.065 564 HA MET 81 HA MET 81 -10.100 -17.361 30.523 565 HB2 MET 81 HB2 MET 81 -9.977 -16.802 28.080 566 HB3 MET 81 HB1 MET 81 -8.382 -16.066 28.387 567 HG2 MET 81 HG2 MET 81 -8.960 -18.922 29.086 568 HG3 MET 81 HG1 MET 81 -8.495 -18.452 27.454 569 HE1 MET 81 HE1 MET 81 -6.468 -16.066 28.030 570 HE2 MET 81 HE2 MET 81 -6.145 -17.339 26.854 571 HE3 MET 81 HE3 MET 81 -4.930 -16.928 28.065 572 H LYS 82 HN LYS 82 -8.456 -18.258 31.763 573 HA LYS 82 HA LYS 82 -6.139 -16.646 32.428 574 HB2 LYS 82 HB2 LYS 82 -8.089 -17.424 34.622 575 HB3 LYS 82 HB1 LYS 82 -6.543 -16.645 34.861 576 HG2 LYS 82 HG2 LYS 82 -7.302 -14.628 33.858 577 HG3 LYS 82 HG1 LYS 82 -8.811 -15.409 33.301 578 HD2 LYS 82 HD2 LYS 82 -9.247 -15.850 35.801 579 HD3 LYS 82 HD1 LYS 82 -7.980 -14.655 36.102 580 HE2 LYS 82 HE2 LYS 82 -10.436 -14.158 34.417 581 HE3 LYS 82 HE1 LYS 82 -10.287 -13.718 36.115 582 HZ1 LYS 82 HZ1 LYS 82 -8.354 -12.749 34.094 583 HZ2 LYS 82 HZ2 LYS 82 -8.685 -12.115 35.632 584 HZ3 LYS 82 HZ3 LYS 82 -9.820 -11.938 34.379 585 H TYR 83 HN TYR 83 -4.543 -17.870 33.702 586 HA TYR 83 HA TYR 83 -4.860 -20.786 33.290 587 HB2 TYR 83 HB2 TYR 83 -2.424 -18.992 33.159 588 HB3 TYR 83 HB1 TYR 83 -2.261 -20.741 33.461 589 HD1 TYR 83 HD1 TYR 83 -1.919 -22.105 31.608 590 HD2 TYR 83 HD2 TYR 83 -3.957 -18.404 31.082 591 HE1 TYR 83 HE1 TYR 83 -2.038 -22.513 29.185 592 HE2 TYR 83 HE2 TYR 83 -4.074 -18.801 28.661 593 HH TYR 83 HH TYR 83 -2.979 -20.078 26.944 594 H THR 84 HN THR 84 -4.058 -22.227 34.876 595 HA THR 84 HA THR 84 -4.014 -21.142 37.577 596 HB THR 84 HB THR 84 -4.019 -23.484 38.326 597 HG1 THR 84 HG1 THR 84 -4.519 -24.736 36.024 598 HG21 THR 84 HG21 THR 84 -6.176 -22.474 37.893 599 HG22 THR 84 HG22 THR 84 -6.204 -24.174 37.430 600 HG23 THR 84 HG23 THR 84 -6.076 -22.927 36.191 601 H SER 85 HN SER 85 -2.367 -22.884 38.907 602 HA SER 85 HA SER 85 0.159 -21.737 38.613 603 HB2 SER 85 HB2 SER 85 -0.229 -24.346 39.939 604 HB3 SER 85 HB1 SER 85 0.794 -23.011 40.430 605 HG SER 85 HG SER 85 -1.141 -21.830 40.882 606 H GLU 86 HN GLU 86 -0.957 -24.980 37.729 607 HA GLU 86 HA GLU 86 1.664 -25.688 36.614 608 HB2 GLU 86 HB2 GLU 86 -0.973 -27.202 36.551 609 HB3 GLU 86 HB1 GLU 86 0.601 -27.866 36.141 610 HG2 GLU 86 HG2 GLU 86 -0.346 -26.942 38.842 611 HG3 GLU 86 HG1 GLU 86 -0.002 -28.593 38.331 612 H GLY 87 HN GLY 87 -0.500 -23.667 35.438 613 HA2 GLY 87 HA2 GLY 87 -0.593 -22.809 33.284 614 HA3 GLY 87 HA1 GLY 87 0.265 -24.227 32.712 615 H VAL 88 HN VAL 88 -2.550 -24.781 34.630 616 HA VAL 88 HA VAL 88 -3.894 -25.941 32.348 617 HB VAL 88 HB VAL 88 -4.769 -25.725 35.236 618 HG11 VAL 88 HG11 VAL 88 -6.508 -27.340 34.668 619 HG12 VAL 88 HG12 VAL 88 -6.005 -27.294 32.978 620 HG13 VAL 88 HG13 VAL 88 -6.693 -25.855 33.732 621 HG21 VAL 88 HG21 VAL 88 -4.199 -28.056 35.419 622 HG22 VAL 88 HG22 VAL 88 -2.796 -27.181 34.800 623 HG23 VAL 88 HG23 VAL 88 -3.796 -28.132 33.706 624 H ARG 89 HN ARG 89 -5.306 -24.940 31.120 625 HA ARG 89 HA ARG 89 -6.015 -22.197 31.709 626 HB2 ARG 89 HB2 ARG 89 -5.243 -22.778 29.472 627 HB3 ARG 89 HB1 ARG 89 -6.540 -23.950 29.304 628 HG2 ARG 89 HG2 ARG 89 -8.187 -22.161 29.352 629 HG3 ARG 89 HG1 ARG 89 -6.900 -20.971 29.576 630 HD2 ARG 89 HD2 ARG 89 -5.981 -21.457 27.423 631 HD3 ARG 89 HD1 ARG 89 -7.052 -22.841 27.219 632 HE ARG 89 HE ARG 89 -8.686 -20.649 27.561 633 HH11 ARG 89 HH11 ARG 89 -6.224 -21.639 25.274 634 HH12 ARG 89 HH12 ARG 89 -6.966 -20.810 23.928 635 HH21 ARG 89 HH21 ARG 89 -9.654 -19.560 25.794 636 HH22 ARG 89 HH22 ARG 89 -8.898 -19.604 24.236 637 H TYR 90 HN TYR 90 -7.924 -21.476 32.382 638 HA TYR 90 HA TYR 90 -10.276 -23.207 32.150 639 HB2 TYR 90 HB2 TYR 90 -10.943 -22.820 34.449 640 HB3 TYR 90 HB1 TYR 90 -9.330 -23.505 34.434 641 HD1 TYR 90 HD1 TYR 90 -7.353 -21.981 34.862 642 HD2 TYR 90 HD2 TYR 90 -11.386 -20.761 35.489 643 HE1 TYR 90 HE1 TYR 90 -6.576 -20.169 36.339 644 HE2 TYR 90 HE2 TYR 90 -10.616 -18.947 36.955 645 HH TYR 90 HH TYR 90 -7.331 -18.027 37.154 646 H PHE 91 HN PHE 91 -12.355 -21.861 32.513 647 HA PHE 91 HA PHE 91 -11.842 -19.205 31.369 648 HB2 PHE 91 HB2 PHE 91 -14.246 -20.961 30.831 649 HB3 PHE 91 HB1 PHE 91 -13.893 -19.417 30.071 650 HD1 PHE 91 HD1 PHE 91 -11.857 -19.223 28.507 651 HD2 PHE 91 HD2 PHE 91 -13.309 -22.948 30.014 652 HE1 PHE 91 HE1 PHE 91 -10.648 -20.410 26.739 653 HE2 PHE 91 HE2 PHE 91 -12.080 -24.132 28.250 654 HZ PHE 91 HZ PHE 91 -10.634 -22.697 26.582 655 H VAL 92 HN VAL 92 -13.301 -17.514 31.874 656 HA VAL 92 HA VAL 92 -14.855 -17.893 34.347 657 HB VAL 92 HB VAL 92 -12.955 -15.586 33.862 658 HG11 VAL 92 HG11 VAL 92 -14.550 -16.347 36.305 659 HG12 VAL 92 HG12 VAL 92 -14.835 -14.960 35.253 660 HG13 VAL 92 HG13 VAL 92 -13.364 -15.047 36.220 661 HG21 VAL 92 HG21 VAL 92 -11.617 -17.539 34.237 662 HG22 VAL 92 HG22 VAL 92 -12.604 -18.006 35.619 663 HG23 VAL 92 HG23 VAL 92 -11.601 -16.557 35.701 664 H ASP 93 HN ASP 93 -16.840 -16.926 34.241 665 HA ASP 93 HA ASP 93 -17.390 -15.096 32.003 666 HB2 ASP 93 HB2 ASP 93 -19.064 -16.835 33.745 667 HB3 ASP 93 HB1 ASP 93 -19.737 -15.228 33.475 668 H HIS 94 HN HIS 94 -17.198 -12.881 32.338 669 HA HIS 94 HA HIS 94 -16.602 -11.907 34.975 670 HB2 HIS 94 HB2 HIS 94 -15.445 -11.084 32.942 671 HB3 HIS 94 HB1 HIS 94 -16.962 -10.396 32.373 672 HD1 HIS 94 HD1 HIS 94 -14.015 -9.687 34.372 673 HD2 HIS 94 HD2 HIS 94 -17.879 -8.184 34.048 674 HE1 HIS 94 HE1 HIS 94 -13.949 -7.416 35.470 675 HE2 HIS 94 HE2 HIS 94 -16.333 -6.594 35.405 676 H ASN 95 HN ASN 95 -19.436 -12.226 33.103 677 HA ASN 95 HA ASN 95 -20.852 -9.983 34.228 678 HB2 ASN 95 HB2 ASN 95 -22.823 -11.023 33.029 679 HB3 ASN 95 HB1 ASN 95 -21.464 -10.617 31.982 680 HD21 ASN 95 HD21 ASN 95 -20.229 -12.272 31.094 681 HD22 ASN 95 HD22 ASN 95 -20.759 -13.927 31.091 682 H THR 96 HN THR 96 -20.998 -13.525 34.585 683 HA THR 96 HA THR 96 -22.779 -13.204 36.857 684 HB THR 96 HB THR 96 -22.679 -15.760 36.889 685 HG1 THR 96 HG1 THR 96 -21.865 -15.733 34.236 686 HG21 THR 96 HG21 THR 96 -24.554 -14.519 35.904 687 HG22 THR 96 HG22 THR 96 -24.203 -15.986 34.992 688 HG23 THR 96 HG23 THR 96 -23.685 -14.419 34.371 689 H ARG 97 HN ARG 97 -19.476 -13.418 36.206 690 HA ARG 97 HA ARG 97 -17.607 -13.388 37.541 691 HB2 ARG 97 HB2 ARG 97 -19.370 -13.316 39.975 692 HB3 ARG 97 HB1 ARG 97 -17.766 -12.628 39.759 693 HG2 ARG 97 HG2 ARG 97 -18.603 -10.865 38.428 694 HG3 ARG 97 HG1 ARG 97 -20.179 -11.648 38.283 695 HD2 ARG 97 HD2 ARG 97 -18.947 -10.462 40.755 696 HD3 ARG 97 HD1 ARG 97 -20.390 -9.906 39.909 697 HE ARG 97 HE ARG 97 -21.265 -12.252 40.544 698 HH11 ARG 97 HH11 ARG 97 -19.255 -10.197 42.536 699 HH12 ARG 97 HH12 ARG 97 -19.720 -10.976 44.022 700 HH21 ARG 97 HH21 ARG 97 -21.849 -13.295 42.466 701 HH22 ARG 97 HH22 ARG 97 -21.139 -12.789 43.975 702 H THR 98 HN THR 98 -18.710 -15.737 36.693 703 HA THR 98 HA THR 98 -18.320 -17.587 38.968 704 HB THR 98 HB THR 98 -20.613 -17.686 37.825 705 HG1 THR 98 HG1 THR 98 -19.245 -20.146 37.489 706 HG21 THR 98 HG21 THR 98 -18.982 -18.926 35.592 707 HG22 THR 98 HG22 THR 98 -19.831 -17.382 35.496 708 HG23 THR 98 HG23 THR 98 -20.741 -18.887 35.683 709 H THR 99 HN THR 99 -17.307 -19.681 38.405 710 HA THR 99 HA THR 99 -15.326 -19.358 36.236 711 HB THR 99 HB THR 99 -14.095 -21.213 37.579 712 HG1 THR 99 HG1 THR 99 -15.042 -20.535 39.968 713 HG21 THR 99 HG21 THR 99 -14.458 -18.447 38.812 714 HG22 THR 99 HG22 THR 99 -13.245 -18.899 37.615 715 HG23 THR 99 HG23 THR 99 -13.168 -19.565 39.249 716 H THR 100 HN THR 100 -15.127 -21.141 34.756 717 HA THR 100 HA THR 100 -16.900 -23.408 35.207 718 HB THR 100 HB THR 100 -18.264 -21.790 33.913 719 HG1 THR 100 HG1 THR 100 -18.990 -23.305 32.476 720 HG21 THR 100 HG21 THR 100 -16.481 -20.658 32.660 721 HG22 THR 100 HG22 THR 100 -17.720 -21.298 31.574 722 HG23 THR 100 HG23 THR 100 -16.180 -22.143 31.753 723 H PHE 101 HN PHE 101 -16.089 -25.285 34.492 724 HA PHE 101 HA PHE 101 -13.531 -25.149 33.046 725 HB2 PHE 101 HB2 PHE 101 -14.207 -26.422 35.475 726 HB3 PHE 101 HB1 PHE 101 -14.027 -27.737 34.238 727 HD1 PHE 101 HD1 PHE 101 -11.916 -27.191 32.609 728 HD2 PHE 101 HD2 PHE 101 -12.307 -25.997 36.676 729 HE1 PHE 101 HE1 PHE 101 -9.469 -27.058 32.800 730 HE2 PHE 101 HE2 PHE 101 -9.857 -25.868 36.876 731 HZ PHE 101 HZ PHE 101 -8.436 -26.401 34.936 732 H LYS 102 HN LYS 102 -14.222 -25.257 30.965 733 HA LYS 102 HA LYS 102 -15.484 -27.766 30.147 734 HB2 LYS 102 HB2 LYS 102 -15.839 -24.986 29.016 735 HB3 LYS 102 HB1 LYS 102 -16.449 -26.444 28.279 736 HG2 LYS 102 HG2 LYS 102 -17.818 -26.855 30.305 737 HG3 LYS 102 HG1 LYS 102 -17.257 -25.306 30.937 738 HD2 LYS 102 HD2 LYS 102 -19.418 -24.985 29.925 739 HD3 LYS 102 HD1 LYS 102 -18.195 -24.198 28.926 740 HE2 LYS 102 HE2 LYS 102 -18.198 -26.080 27.394 741 HE3 LYS 102 HE1 LYS 102 -19.367 -26.931 28.404 742 HZ1 LYS 102 HZ1 LYS 102 -20.946 -25.121 27.974 743 HZ2 LYS 102 HZ2 LYS 102 -20.461 -25.900 26.547 744 HZ3 LYS 102 HZ3 LYS 102 -19.817 -24.382 26.946 745 H ASP 103 HN ASP 103 -14.477 -28.823 28.449 746 HA ASP 103 HA ASP 103 -11.927 -27.715 27.638 747 HB2 ASP 103 HB2 ASP 103 -11.492 -29.965 26.747 748 HB3 ASP 103 HB1 ASP 103 -11.882 -29.984 28.451 749 HA PRO 104 HA PRO 104 -13.859 -26.570 23.760 750 HB2 PRO 104 HB2 PRO 104 -11.823 -24.971 22.930 751 HB3 PRO 104 HB1 PRO 104 -13.002 -24.426 24.131 752 HG2 PRO 104 HG2 PRO 104 -10.230 -25.460 24.518 753 HG3 PRO 104 HG1 PRO 104 -11.055 -24.132 25.347 754 HD2 PRO 104 HD2 PRO 104 -10.745 -26.624 26.417 755 HD3 PRO 104 HD1 PRO 104 -12.088 -25.540 26.834 756 H ARG 105 HN ARG 105 -11.099 -28.394 24.460 757 HA ARG 105 HA ARG 105 -10.702 -29.052 21.616 758 HB2 ARG 105 HB2 ARG 105 -8.766 -29.582 23.875 759 HB3 ARG 105 HB1 ARG 105 -8.485 -29.853 22.163 760 HG2 ARG 105 HG2 ARG 105 -7.414 -27.894 22.290 761 HG3 ARG 105 HG1 ARG 105 -9.042 -27.212 22.152 762 HD2 ARG 105 HD2 ARG 105 -7.868 -26.150 24.019 763 HD3 ARG 105 HD1 ARG 105 -9.200 -27.142 24.617 764 HE ARG 105 HE ARG 105 -6.488 -28.270 24.569 765 HH11 ARG 105 HH11 ARG 105 -9.223 -27.102 26.420 766 HH12 ARG 105 HH12 ARG 105 -8.659 -27.769 27.915 767 HH21 ARG 105 HH21 ARG 105 -5.732 -29.148 26.527 768 HH22 ARG 105 HH22 ARG 105 -6.684 -28.959 27.971 769 HA PRO 106 HA PRO 106 -12.940 -32.778 23.025 770 HB2 PRO 106 HB2 PRO 106 -12.010 -33.554 20.282 771 HB3 PRO 106 HB1 PRO 106 -13.621 -33.786 21.058 772 HG2 PRO 106 HG2 PRO 106 -13.249 -31.866 19.256 773 HG3 PRO 106 HG1 PRO 106 -14.236 -31.574 20.699 774 HD2 PRO 106 HD2 PRO 106 -11.479 -30.644 20.052 775 HD3 PRO 106 HD1 PRO 106 -12.784 -29.832 20.988 776 H GLY 107 HN GLY 107 -11.898 -34.149 24.346 777 HA2 GLY 107 HA2 GLY 107 -10.474 -35.931 24.845 778 HA3 GLY 107 HA1 GLY 107 -9.560 -35.605 23.355 779 H PHE 108 HN PHE 108 -9.335 -32.701 24.082 780 HA PHE 108 HA PHE 108 -7.533 -31.436 24.815 781 HB2 PHE 108 HB2 PHE 108 -7.605 -31.090 27.301 782 HB3 PHE 108 HB1 PHE 108 -9.203 -30.953 26.499 783 HD1 PHE 108 HD1 PHE 108 -10.909 -32.632 26.904 784 HD2 PHE 108 HD2 PHE 108 -7.135 -32.875 28.864 785 HE1 PHE 108 HE1 PHE 108 -11.845 -34.239 28.507 786 HE2 PHE 108 HE2 PHE 108 -8.070 -34.489 30.469 787 HZ PHE 108 HZ PHE 108 -10.397 -35.167 30.305 788 H GLU 109 HN GLU 109 -6.487 -33.775 23.939 789 HA GLU 109 HA GLU 109 -4.573 -34.985 23.930 790 HB2 GLU 109 HB2 GLU 109 -3.740 -32.896 25.940 791 HB3 GLU 109 HB1 GLU 109 -2.656 -34.100 25.265 792 HG2 GLU 109 HG2 GLU 109 -4.105 -31.951 23.724 793 HG3 GLU 109 HG1 GLU 109 -2.393 -31.982 24.134 Start of MODEL 10 1 H1 GLY 1 HT1 GLY 1 -42.954 5.607 2.776 2 H2 GLY 1 HT2 GLY 1 -42.361 7.179 2.585 3 H3 GLY 1 HT3 GLY 1 -41.491 6.052 3.503 4 HA2 GLY 1 HA1 GLY 1 -41.123 4.695 1.527 5 HA3 GLY 1 HA2 GLY 1 -41.989 5.898 0.582 6 H SER 2 HN SER 2 -40.548 6.844 -0.668 7 HA SER 2 HA SER 2 -38.792 8.093 -1.375 8 HB2 SER 2 HB2 SER 2 -38.511 8.729 1.570 9 HB3 SER 2 HB1 SER 2 -37.701 9.591 0.261 10 HG SER 2 HG SER 2 -39.919 9.934 -0.574 11 H HIS 3 HN HIS 3 -38.381 5.282 -0.736 12 HA HIS 3 HA HIS 3 -35.704 5.038 0.312 13 HB2 HIS 3 HB2 HIS 3 -37.676 3.137 -0.922 14 HB3 HIS 3 HB1 HIS 3 -35.976 2.693 -0.905 15 HD1 HIS 3 HD1 HIS 3 -36.625 0.694 0.641 16 HD2 HIS 3 HD2 HIS 3 -37.240 4.474 2.300 17 HE1 HIS 3 HE1 HIS 3 -36.913 0.321 3.112 18 HE2 HIS 3 HE2 HIS 3 -37.282 2.606 4.103 19 H MET 4 HN MET 4 -33.787 4.732 -0.958 20 HA MET 4 HA MET 4 -34.167 4.838 -3.867 21 HB2 MET 4 HB2 MET 4 -33.301 7.064 -2.671 22 HB3 MET 4 HB1 MET 4 -31.782 6.179 -2.673 23 HG2 MET 4 HG2 MET 4 -31.820 5.981 -5.064 24 HG3 MET 4 HG1 MET 4 -33.412 6.736 -5.134 25 HE1 MET 4 HE1 MET 4 -33.179 9.035 -2.996 26 HE2 MET 4 HE2 MET 4 -33.867 9.294 -4.598 27 HE3 MET 4 HE3 MET 4 -32.635 10.396 -3.981 28 H GLN 5 HN GLN 5 -32.146 4.039 -4.973 29 HA GLN 5 HA GLN 5 -31.271 1.666 -3.517 30 HB2 GLN 5 HB2 GLN 5 -32.327 1.399 -5.757 31 HB3 GLN 5 HB1 GLN 5 -30.984 2.289 -6.458 32 HG2 GLN 5 HG2 GLN 5 -29.479 0.525 -5.443 33 HG3 GLN 5 HG1 GLN 5 -30.946 -0.406 -5.149 34 HE21 GLN 5 HE21 GLN 5 -32.144 -1.186 -6.927 35 HE22 GLN 5 HE22 GLN 5 -31.421 -1.316 -8.519 36 H TYR 6 HN TYR 6 -29.438 1.981 -2.412 37 HA TYR 6 HA TYR 6 -27.297 3.479 -3.756 38 HB2 TYR 6 HB2 TYR 6 -27.681 2.780 -0.817 39 HB3 TYR 6 HB1 TYR 6 -26.131 3.339 -1.424 40 HD1 TYR 6 HD1 TYR 6 -25.953 5.663 -2.371 41 HD2 TYR 6 HD2 TYR 6 -29.471 4.265 -0.415 42 HE1 TYR 6 HE1 TYR 6 -26.712 7.979 -2.087 43 HE2 TYR 6 HE2 TYR 6 -30.231 6.589 -0.119 44 HH TYR 6 HH TYR 6 -29.290 8.861 -0.054 45 H LYS 7 HN LYS 7 -25.438 2.446 -4.379 46 HA LYS 7 HA LYS 7 -25.491 -0.464 -4.001 47 HB2 LYS 7 HB2 LYS 7 -24.055 -0.437 -6.158 48 HB3 LYS 7 HB1 LYS 7 -25.801 -0.137 -6.315 49 HG2 LYS 7 HG2 LYS 7 -25.379 2.254 -6.416 50 HG3 LYS 7 HG1 LYS 7 -23.649 1.968 -6.256 51 HD2 LYS 7 HD2 LYS 7 -24.037 2.272 -8.563 52 HD3 LYS 7 HD1 LYS 7 -23.833 0.536 -8.340 53 HE2 LYS 7 HE2 LYS 7 -25.678 0.824 -9.807 54 HE3 LYS 7 HE1 LYS 7 -26.339 0.357 -8.240 55 HZ1 LYS 7 HZ1 LYS 7 -27.581 2.173 -9.290 56 HZ2 LYS 7 HZ2 LYS 7 -26.191 3.146 -9.258 57 HZ3 LYS 7 HZ3 LYS 7 -26.903 2.652 -7.811 58 H LEU 8 HN LEU 8 -23.558 -1.562 -3.743 59 HA LEU 8 HA LEU 8 -21.305 0.124 -2.859 60 HB2 LEU 8 HB2 LEU 8 -22.513 -0.764 -0.868 61 HB3 LEU 8 HB1 LEU 8 -22.251 -2.387 -1.464 62 HG LEU 8 HG LEU 8 -19.790 -2.002 -1.260 63 HD11 LEU 8 HD11 LEU 8 -20.714 0.564 0.031 64 HD12 LEU 8 HD12 LEU 8 -19.541 0.351 -1.274 65 HD13 LEU 8 HD13 LEU 8 -19.145 -0.172 0.357 66 HD21 LEU 8 HD21 LEU 8 -19.844 -2.173 1.233 67 HD22 LEU 8 HD22 LEU 8 -20.922 -3.277 0.374 68 HD23 LEU 8 HD23 LEU 8 -21.576 -1.830 1.141 69 H ILE 9 HN ILE 9 -19.328 -0.510 -3.507 70 HA ILE 9 HA ILE 9 -19.124 -3.107 -4.882 71 HB ILE 9 HB ILE 9 -17.793 -0.490 -5.651 72 HG12 ILE 9 HG12 ILE 9 -19.666 -2.303 -7.235 73 HG13 ILE 9 HG11 ILE 9 -20.182 -0.776 -6.428 74 HG21 ILE 9 HG21 ILE 9 -16.217 -2.332 -5.875 75 HG22 ILE 9 HG22 ILE 9 -16.716 -1.741 -7.460 76 HG23 ILE 9 HG23 ILE 9 -17.391 -3.241 -6.824 77 HD11 ILE 9 HD11 ILE 9 -18.115 -1.003 -8.640 78 HD12 ILE 9 HD12 ILE 9 -18.702 0.485 -7.896 79 HD13 ILE 9 HD13 ILE 9 -19.799 -0.514 -8.852 80 H LEU 10 HN LEU 10 -17.798 -4.429 -3.811 81 HA LEU 10 HA LEU 10 -15.890 -3.255 -1.929 82 HB2 LEU 10 HB2 LEU 10 -16.539 -6.180 -2.299 83 HB3 LEU 10 HB1 LEU 10 -15.522 -5.497 -1.062 84 HG LEU 10 HG LEU 10 -17.452 -6.033 0.072 85 HD11 LEU 10 HD11 LEU 10 -17.942 -3.183 -0.671 86 HD12 LEU 10 HD12 LEU 10 -16.782 -3.748 0.543 87 HD13 LEU 10 HD13 LEU 10 -18.510 -4.021 0.777 88 HD21 LEU 10 HD21 LEU 10 -18.795 -6.522 -1.974 89 HD22 LEU 10 HD22 LEU 10 -19.204 -4.807 -2.034 90 HD23 LEU 10 HD23 LEU 10 -19.693 -5.778 -0.651 91 H ASN 11 HN ASN 11 -13.894 -2.890 -2.662 92 HA ASN 11 HA ASN 11 -12.881 -4.813 -4.637 93 HB2 ASN 11 HB2 ASN 11 -13.233 -2.271 -5.272 94 HB3 ASN 11 HB1 ASN 11 -11.711 -2.066 -4.412 95 HD21 ASN 11 HD21 ASN 11 -12.302 -1.674 -7.212 96 HD22 ASN 11 HD22 ASN 11 -11.248 -2.718 -8.089 97 H GLY 12 HN GLY 12 -12.274 -6.080 -2.854 98 HA2 GLY 12 HA2 GLY 12 -9.587 -5.299 -1.916 99 HA3 GLY 12 HA1 GLY 12 -10.755 -5.993 -0.775 100 H LYS 13 HN LYS 13 -8.255 -7.038 -1.454 101 HA LYS 13 HA LYS 13 -8.021 -8.966 -3.382 102 HB2 LYS 13 HB2 LYS 13 -6.966 -9.498 -0.619 103 HB3 LYS 13 HB1 LYS 13 -6.176 -9.765 -2.169 104 HG2 LYS 13 HG2 LYS 13 -5.787 -7.420 -2.439 105 HG3 LYS 13 HG1 LYS 13 -6.753 -7.049 -1.006 106 HD2 LYS 13 HD2 LYS 13 -5.003 -8.695 0.119 107 HD3 LYS 13 HD1 LYS 13 -4.004 -8.144 -1.229 108 HE2 LYS 13 HE2 LYS 13 -3.600 -6.720 0.658 109 HE3 LYS 13 HE1 LYS 13 -4.490 -5.801 -0.558 110 HZ1 LYS 13 HZ1 LYS 13 -5.634 -7.051 1.889 111 HZ2 LYS 13 HZ2 LYS 13 -6.540 -6.244 0.703 112 HZ3 LYS 13 HZ3 LYS 13 -5.397 -5.394 1.625 113 H THR 14 HN THR 14 -9.559 -9.237 -0.215 114 HA THR 14 HA THR 14 -10.149 -12.078 -0.694 115 HB THR 14 HB THR 14 -10.723 -10.573 1.853 116 HG1 THR 14 HG1 THR 14 -8.294 -11.960 1.489 117 HG21 THR 14 HG21 THR 14 -9.978 -13.446 1.296 118 HG22 THR 14 HG22 THR 14 -11.606 -12.857 1.636 119 HG23 THR 14 HG23 THR 14 -10.355 -12.763 2.877 120 H LEU 15 HN LEU 15 -11.599 -9.300 -1.522 121 HA LEU 15 HA LEU 15 -14.232 -10.398 -1.520 122 HB2 LEU 15 HB2 LEU 15 -13.568 -9.005 0.772 123 HB3 LEU 15 HB1 LEU 15 -14.380 -7.800 -0.195 124 HG LEU 15 HG LEU 15 -16.040 -8.719 1.172 125 HD11 LEU 15 HD11 LEU 15 -16.779 -8.511 -1.107 126 HD12 LEU 15 HD12 LEU 15 -17.529 -9.924 -0.364 127 HD13 LEU 15 HD13 LEU 15 -16.177 -10.124 -1.478 128 HD21 LEU 15 HD21 LEU 15 -16.420 -11.150 1.375 129 HD22 LEU 15 HD22 LEU 15 -14.860 -10.631 2.011 130 HD23 LEU 15 HD23 LEU 15 -14.949 -11.431 0.444 131 H LYS 16 HN LYS 16 -14.288 -10.031 -3.671 132 HA LYS 16 HA LYS 16 -14.438 -7.215 -4.482 133 HB2 LYS 16 HB2 LYS 16 -13.132 -9.540 -5.919 134 HB3 LYS 16 HB1 LYS 16 -13.598 -8.067 -6.758 135 HG2 LYS 16 HG2 LYS 16 -12.039 -6.770 -5.545 136 HG3 LYS 16 HG1 LYS 16 -11.744 -8.049 -4.367 137 HD2 LYS 16 HD2 LYS 16 -9.969 -7.679 -6.039 138 HD3 LYS 16 HD1 LYS 16 -10.581 -9.332 -5.964 139 HE2 LYS 16 HE2 LYS 16 -10.249 -8.645 -8.275 140 HE3 LYS 16 HE1 LYS 16 -11.966 -8.860 -7.949 141 HZ1 LYS 16 HZ1 LYS 16 -10.723 -6.192 -7.737 142 HZ2 LYS 16 HZ2 LYS 16 -12.348 -6.590 -8.009 143 HZ3 LYS 16 HZ3 LYS 16 -11.204 -6.803 -9.238 144 H GLY 17 HN GLY 17 -16.468 -6.789 -4.940 145 HA2 GLY 17 HA2 GLY 17 -18.086 -8.061 -6.775 146 HA3 GLY 17 HA1 GLY 17 -18.487 -8.768 -5.211 147 H GLU 18 HN GLU 18 -20.643 -7.695 -5.808 148 HA GLU 18 HA GLU 18 -20.606 -5.018 -4.615 149 HB2 GLU 18 HB2 GLU 18 -22.351 -5.612 -6.999 150 HB3 GLU 18 HB1 GLU 18 -22.061 -4.062 -6.237 151 HG2 GLU 18 HG2 GLU 18 -20.768 -3.810 -8.071 152 HG3 GLU 18 HG1 GLU 18 -19.582 -4.561 -7.001 153 H THR 19 HN THR 19 -22.763 -4.257 -4.020 154 HA THR 19 HA THR 19 -24.886 -6.173 -3.708 155 HB THR 19 HB THR 19 -23.436 -6.733 -1.768 156 HG1 THR 19 HG1 THR 19 -25.361 -7.164 -1.008 157 HG21 THR 19 HG21 THR 19 -23.986 -3.856 -0.977 158 HG22 THR 19 HG22 THR 19 -22.408 -4.560 -1.338 159 HG23 THR 19 HG23 THR 19 -23.294 -5.072 0.100 160 H THR 20 HN THR 20 -26.655 -4.966 -2.205 161 HA THR 20 HA THR 20 -26.658 -2.122 -2.877 162 HB THR 20 HB THR 20 -29.022 -2.338 -3.726 163 HG1 THR 20 HG1 THR 20 -28.896 -4.728 -2.892 164 HG21 THR 20 HG21 THR 20 -26.791 -3.631 -5.306 165 HG22 THR 20 HG22 THR 20 -27.282 -1.938 -5.347 166 HG23 THR 20 HG23 THR 20 -28.351 -3.177 -6.001 167 H THR 21 HN THR 21 -28.345 -0.896 -1.787 168 HA THR 21 HA THR 21 -29.884 -2.262 0.268 169 HB THR 21 HB THR 21 -27.601 -1.717 1.323 170 HG1 THR 21 HG1 THR 21 -29.773 -1.993 2.381 171 HG21 THR 21 HG21 THR 21 -27.423 0.657 2.174 172 HG22 THR 21 HG22 THR 21 -28.759 1.096 1.110 173 HG23 THR 21 HG23 THR 21 -27.233 0.541 0.421 174 H GLU 22 HN GLU 22 -31.502 -0.860 1.246 175 HA GLU 22 HA GLU 22 -32.163 1.423 -0.503 176 HB2 GLU 22 HB2 GLU 22 -33.973 -0.174 1.332 177 HB3 GLU 22 HB1 GLU 22 -34.477 1.094 0.238 178 HG2 GLU 22 HG2 GLU 22 -34.037 -0.268 -1.691 179 HG3 GLU 22 HG1 GLU 22 -33.244 -1.517 -0.657 180 H ALA 23 HN ALA 23 -31.846 3.390 0.375 181 HA ALA 23 HA ALA 23 -32.372 3.730 3.256 182 HB1 ALA 23 HB1 ALA 23 -29.830 4.729 1.937 183 HB2 ALA 23 HB2 ALA 23 -29.934 3.358 3.042 184 HB3 ALA 23 HB3 ALA 23 -30.311 4.984 3.616 185 H VAL 24 HN VAL 24 -32.744 6.041 3.814 186 HA VAL 24 HA VAL 24 -33.822 7.464 1.487 187 HB VAL 24 HB VAL 24 -35.064 8.843 3.109 188 HG11 VAL 24 HG11 VAL 24 -36.088 6.839 2.188 189 HG12 VAL 24 HG12 VAL 24 -36.611 7.091 3.853 190 HG13 VAL 24 HG13 VAL 24 -35.393 5.868 3.487 191 HG21 VAL 24 HG21 VAL 24 -33.891 6.995 5.186 192 HG22 VAL 24 HG22 VAL 24 -35.129 8.221 5.466 193 HG23 VAL 24 HG23 VAL 24 -33.500 8.703 4.991 194 H ASP 25 HN ASP 25 -30.961 7.393 2.842 195 HA ASP 25 HA ASP 25 -30.349 10.118 2.124 196 HB2 ASP 25 HB2 ASP 25 -30.985 10.133 4.618 197 HB3 ASP 25 HB1 ASP 25 -29.509 9.210 4.880 198 H ALA 26 HN ALA 26 -28.014 10.426 1.962 199 HA ALA 26 HA ALA 26 -26.759 8.028 0.969 200 HB1 ALA 26 HB1 ALA 26 -24.953 9.535 0.259 201 HB2 ALA 26 HB2 ALA 26 -25.722 10.859 1.138 202 HB3 ALA 26 HB3 ALA 26 -26.533 10.133 -0.248 203 H ALA 27 HN ALA 27 -26.359 10.250 3.675 204 HA ALA 27 HA ALA 27 -23.875 9.220 4.577 205 HB1 ALA 27 HB1 ALA 27 -25.989 10.666 6.171 206 HB2 ALA 27 HB2 ALA 27 -24.748 11.449 5.193 207 HB3 ALA 27 HB3 ALA 27 -24.284 10.484 6.594 208 H THR 28 HN THR 28 -27.216 8.408 5.194 209 HA THR 28 HA THR 28 -26.762 6.705 7.422 210 HB THR 28 HB THR 28 -29.077 6.472 5.498 211 HG1 THR 28 HG1 THR 28 -28.856 8.263 7.722 212 HG21 THR 28 HG21 THR 28 -28.835 6.018 8.486 213 HG22 THR 28 HG22 THR 28 -28.926 4.754 7.260 214 HG23 THR 28 HG23 THR 28 -30.306 5.820 7.528 215 H ALA 29 HN ALA 29 -26.511 6.286 3.991 216 HA ALA 29 HA ALA 29 -26.748 3.416 3.991 217 HB1 ALA 29 HB1 ALA 29 -26.025 3.578 1.655 218 HB2 ALA 29 HB2 ALA 29 -25.664 5.289 1.885 219 HB3 ALA 29 HB3 ALA 29 -27.328 4.717 1.999 220 H GLU 30 HN GLU 30 -24.234 5.837 4.070 221 HA GLU 30 HA GLU 30 -21.981 4.218 3.757 222 HB2 GLU 30 HB2 GLU 30 -22.171 6.812 3.840 223 HB3 GLU 30 HB1 GLU 30 -22.099 6.611 5.581 224 HG2 GLU 30 HG2 GLU 30 -19.967 5.188 5.019 225 HG3 GLU 30 HG1 GLU 30 -19.988 6.187 3.566 226 H LYS 31 HN LYS 31 -23.666 5.288 6.696 227 HA LYS 31 HA LYS 31 -21.903 4.132 8.546 228 HB2 LYS 31 HB2 LYS 31 -24.839 4.595 9.026 229 HB3 LYS 31 HB1 LYS 31 -23.542 4.592 10.214 230 HG2 LYS 31 HG2 LYS 31 -24.115 6.653 8.101 231 HG3 LYS 31 HG1 LYS 31 -24.144 6.851 9.855 232 HD2 LYS 31 HD2 LYS 31 -21.754 6.609 9.978 233 HD3 LYS 31 HD1 LYS 31 -21.663 6.189 8.266 234 HE2 LYS 31 HE2 LYS 31 -22.632 8.455 7.768 235 HE3 LYS 31 HE1 LYS 31 -22.425 8.845 9.471 236 HZ1 LYS 31 HZ1 LYS 31 -20.068 8.560 9.261 237 HZ2 LYS 31 HZ2 LYS 31 -20.592 9.630 8.054 238 HZ3 LYS 31 HZ3 LYS 31 -20.216 8.026 7.657 239 H VAL 32 HN VAL 32 -24.801 2.834 6.989 240 HA VAL 32 HA VAL 32 -24.857 0.447 8.565 241 HB VAL 32 HB VAL 32 -26.179 1.037 5.908 242 HG11 VAL 32 HG11 VAL 32 -27.650 -0.846 6.409 243 HG12 VAL 32 HG12 VAL 32 -26.733 -1.185 7.876 244 HG13 VAL 32 HG13 VAL 32 -25.969 -1.373 6.298 245 HG21 VAL 32 HG21 VAL 32 -26.890 2.539 7.693 246 HG22 VAL 32 HG22 VAL 32 -27.259 1.153 8.721 247 HG23 VAL 32 HG23 VAL 32 -28.184 1.429 7.244 248 H PHE 33 HN PHE 33 -23.762 1.188 5.271 249 HA PHE 33 HA PHE 33 -22.965 -1.498 4.729 250 HB2 PHE 33 HB2 PHE 33 -22.779 1.088 3.299 251 HB3 PHE 33 HB1 PHE 33 -21.537 -0.089 2.910 252 HD1 PHE 33 HD1 PHE 33 -23.534 -2.487 3.440 253 HD2 PHE 33 HD2 PHE 33 -23.662 1.044 1.063 254 HE1 PHE 33 HE1 PHE 33 -25.056 -3.608 1.860 255 HE2 PHE 33 HE2 PHE 33 -25.198 -0.067 -0.513 256 HZ PHE 33 HZ PHE 33 -25.891 -2.395 -0.130 257 H LYS 34 HN LYS 34 -21.330 1.192 6.276 258 HA LYS 34 HA LYS 34 -18.727 0.116 5.925 259 HB2 LYS 34 HB2 LYS 34 -19.933 2.297 7.524 260 HB3 LYS 34 HB1 LYS 34 -18.389 1.691 8.071 261 HG2 LYS 34 HG2 LYS 34 -17.341 2.248 5.994 262 HG3 LYS 34 HG1 LYS 34 -18.912 2.585 5.254 263 HD2 LYS 34 HD2 LYS 34 -17.711 4.676 5.820 264 HD3 LYS 34 HD1 LYS 34 -19.215 4.499 6.719 265 HE2 LYS 34 HE2 LYS 34 -17.973 3.785 8.688 266 HE3 LYS 34 HE1 LYS 34 -16.455 3.910 7.789 267 HZ1 LYS 34 HZ1 LYS 34 -16.785 6.257 7.538 268 HZ2 LYS 34 HZ2 LYS 34 -16.918 5.868 9.184 269 HZ3 LYS 34 HZ3 LYS 34 -18.311 6.182 8.268 270 H GLN 35 HN GLN 35 -21.245 -0.343 8.292 271 HA GLN 35 HA GLN 35 -19.623 -1.921 10.037 272 HB2 GLN 35 HB2 GLN 35 -21.633 -0.715 10.851 273 HB3 GLN 35 HB1 GLN 35 -22.653 -1.657 9.792 274 HG2 GLN 35 HG2 GLN 35 -21.102 -2.834 12.113 275 HG3 GLN 35 HG1 GLN 35 -22.761 -2.270 12.195 276 HE21 GLN 35 HE21 GLN 35 -21.543 -4.935 12.563 277 HE22 GLN 35 HE22 GLN 35 -22.387 -5.983 11.478 278 H TYR 36 HN TYR 36 -21.668 -2.391 7.277 279 HA TYR 36 HA TYR 36 -21.823 -5.202 7.276 280 HB2 TYR 36 HB2 TYR 36 -23.349 -4.031 5.886 281 HB3 TYR 36 HB1 TYR 36 -22.072 -3.093 5.134 282 HD1 TYR 36 HD1 TYR 36 -23.588 -6.481 5.283 283 HD2 TYR 36 HD2 TYR 36 -20.970 -3.844 3.219 284 HE1 TYR 36 HE1 TYR 36 -23.475 -8.071 3.408 285 HE2 TYR 36 HE2 TYR 36 -20.842 -5.404 1.342 286 HH TYR 36 HH TYR 36 -22.961 -8.075 1.029 287 H ALA 37 HN ALA 37 -19.647 -2.964 5.575 288 HA ALA 37 HA ALA 37 -18.015 -4.951 4.399 289 HB1 ALA 37 HB1 ALA 37 -18.087 -2.653 3.585 290 HB2 ALA 37 HB2 ALA 37 -16.432 -3.114 4.009 291 HB3 ALA 37 HB3 ALA 37 -17.369 -2.082 5.093 292 H ASN 38 HN ASN 38 -18.039 -3.336 7.485 293 HA ASN 38 HA ASN 38 -15.515 -4.027 8.484 294 HB2 ASN 38 HB2 ASN 38 -16.980 -2.436 9.667 295 HB3 ASN 38 HB1 ASN 38 -18.144 -3.720 9.983 296 HD21 ASN 38 HD21 ASN 38 -17.673 -5.327 11.528 297 HD22 ASN 38 HD22 ASN 38 -16.390 -5.084 12.744 298 H ASP 39 HN ASP 39 -18.611 -5.759 8.709 299 HA ASP 39 HA ASP 39 -17.546 -7.975 10.132 300 HB2 ASP 39 HB2 ASP 39 -20.104 -7.607 8.576 301 HB3 ASP 39 HB1 ASP 39 -19.716 -9.088 9.443 302 H ASN 40 HN ASN 40 -17.255 -7.063 6.912 303 HA ASN 40 HA ASN 40 -16.806 -9.799 5.996 304 HB2 ASN 40 HB2 ASN 40 -17.280 -7.186 4.615 305 HB3 ASN 40 HB1 ASN 40 -16.404 -8.451 3.766 306 HD21 ASN 40 HD21 ASN 40 -19.471 -7.459 5.086 307 HD22 ASN 40 HD22 ASN 40 -20.422 -8.752 4.329 308 H GLY 41 HN GLY 41 -15.134 -7.387 7.461 309 HA2 GLY 41 HA2 GLY 41 -12.882 -7.242 7.949 310 HA3 GLY 41 HA1 GLY 41 -12.609 -8.599 6.869 311 H VAL 42 HN VAL 42 -14.317 -5.910 5.528 312 HA VAL 42 HA VAL 42 -11.926 -5.274 3.974 313 HB VAL 42 HB VAL 42 -14.831 -4.672 3.329 314 HG11 VAL 42 HG11 VAL 42 -13.303 -3.069 2.321 315 HG12 VAL 42 HG12 VAL 42 -13.921 -4.165 1.080 316 HG13 VAL 42 HG13 VAL 42 -12.293 -4.380 1.721 317 HG21 VAL 42 HG21 VAL 42 -12.948 -6.789 2.313 318 HG22 VAL 42 HG22 VAL 42 -14.534 -6.441 1.629 319 HG23 VAL 42 HG23 VAL 42 -14.400 -7.052 3.281 320 H ASP 43 HN ASP 43 -10.895 -3.510 4.434 321 HA ASP 43 HA ASP 43 -12.369 -1.143 5.353 322 HB2 ASP 43 HB2 ASP 43 -11.405 -2.248 7.375 323 HB3 ASP 43 HB1 ASP 43 -9.802 -2.121 6.655 324 H GLY 44 HN GLY 44 -11.809 0.618 4.112 325 HA2 GLY 44 HA2 GLY 44 -9.171 1.191 3.300 326 HA3 GLY 44 HA1 GLY 44 -10.031 0.414 1.978 327 H GLU 45 HN GLU 45 -9.484 2.627 1.050 328 HA GLU 45 HA GLU 45 -10.775 4.967 1.924 329 HB2 GLU 45 HB2 GLU 45 -9.607 4.061 -0.682 330 HB3 GLU 45 HB1 GLU 45 -10.548 5.546 -0.638 331 HG2 GLU 45 HG2 GLU 45 -8.053 4.928 0.926 332 HG3 GLU 45 HG1 GLU 45 -8.224 6.066 -0.411 333 H TRP 46 HN TRP 46 -12.653 5.975 1.303 334 HA TRP 46 HA TRP 46 -14.660 4.206 0.083 335 HB2 TRP 46 HB2 TRP 46 -14.784 5.815 2.568 336 HB3 TRP 46 HB1 TRP 46 -16.202 5.913 1.537 337 HD1 TRP 46 HD1 TRP 46 -13.932 3.077 2.903 338 HE1 TRP 46 HE1 TRP 46 -15.409 1.097 3.590 339 HE3 TRP 46 HE3 TRP 46 -18.562 4.997 1.694 340 HZ2 TRP 46 HZ2 TRP 46 -18.125 0.432 3.629 341 HZ3 TRP 46 HZ3 TRP 46 -20.531 3.603 2.125 342 HH2 TRP 46 HH2 TRP 46 -20.310 1.366 3.063 343 H THR 47 HN THR 47 -15.158 4.878 -1.862 344 HA THR 47 HA THR 47 -15.137 7.761 -2.439 345 HB THR 47 HB THR 47 -15.178 6.895 -4.883 346 HG1 THR 47 HG1 THR 47 -13.994 4.595 -3.701 347 HG21 THR 47 HG21 THR 47 -13.245 7.990 -3.833 348 HG22 THR 47 HG22 THR 47 -12.745 6.688 -4.915 349 HG23 THR 47 HG23 THR 47 -12.734 6.439 -3.168 350 H TYR 48 HN TYR 48 -16.859 8.634 -3.746 351 HA TYR 48 HA TYR 48 -19.261 7.057 -4.040 352 HB2 TYR 48 HB2 TYR 48 -19.673 7.755 -1.835 353 HB3 TYR 48 HB1 TYR 48 -18.992 9.333 -2.091 354 HD1 TYR 48 HD1 TYR 48 -20.487 11.141 -2.305 355 HD2 TYR 48 HD2 TYR 48 -21.810 7.209 -3.298 356 HE1 TYR 48 HE1 TYR 48 -22.754 12.003 -2.704 357 HE2 TYR 48 HE2 TYR 48 -24.074 8.073 -3.704 358 HH TYR 48 HH TYR 48 -25.460 9.970 -3.068 359 H ASP 49 HN ASP 49 -20.812 8.026 -5.415 360 HA ASP 49 HA ASP 49 -20.120 10.612 -6.658 361 HB2 ASP 49 HB2 ASP 49 -19.132 8.789 -8.107 362 HB3 ASP 49 HB1 ASP 49 -20.764 8.193 -8.393 363 H ASP 50 HN ASP 50 -21.984 11.826 -6.991 364 HA ASP 50 HA ASP 50 -24.366 10.676 -5.791 365 HB2 ASP 50 HB2 ASP 50 -25.302 13.092 -6.246 366 HB3 ASP 50 HB1 ASP 50 -23.956 12.952 -5.105 367 H ALA 51 HN ALA 51 -23.189 10.836 -8.978 368 HA ALA 51 HA ALA 51 -25.768 11.101 -10.213 369 HB1 ALA 51 HB1 ALA 51 -24.649 10.673 -12.307 370 HB2 ALA 51 HB2 ALA 51 -23.197 10.137 -11.458 371 HB3 ALA 51 HB3 ALA 51 -23.711 11.821 -11.352 372 H THR 52 HN THR 52 -23.655 8.378 -9.377 373 HA THR 52 HA THR 52 -25.725 6.552 -10.388 374 HB THR 52 HB THR 52 -23.907 4.803 -10.094 375 HG1 THR 52 HG1 THR 52 -21.878 6.584 -10.279 376 HG21 THR 52 HG21 THR 52 -24.479 5.803 -12.285 377 HG22 THR 52 HG22 THR 52 -22.763 5.412 -12.161 378 HG23 THR 52 HG23 THR 52 -23.304 7.082 -11.988 379 H LYS 53 HN LYS 53 -24.700 7.886 -7.490 380 HA LYS 53 HA LYS 53 -25.063 7.439 -5.266 381 HB2 LYS 53 HB2 LYS 53 -27.118 5.530 -6.417 382 HB3 LYS 53 HB1 LYS 53 -26.927 5.847 -4.704 383 HG2 LYS 53 HG2 LYS 53 -28.748 7.163 -5.425 384 HG3 LYS 53 HG1 LYS 53 -27.394 8.268 -5.188 385 HD2 LYS 53 HD2 LYS 53 -26.984 8.304 -7.585 386 HD3 LYS 53 HD1 LYS 53 -28.290 7.149 -7.844 387 HE2 LYS 53 HE2 LYS 53 -29.111 9.345 -8.338 388 HE3 LYS 53 HE1 LYS 53 -29.866 8.783 -6.848 389 HZ1 LYS 53 HZ1 LYS 53 -27.553 10.636 -7.005 390 HZ2 LYS 53 HZ2 LYS 53 -28.316 10.125 -5.581 391 HZ3 LYS 53 HZ3 LYS 53 -29.152 11.084 -6.690 392 H THR 54 HN THR 54 -22.960 6.120 -6.580 393 HA THR 54 HA THR 54 -22.974 3.395 -5.513 394 HB THR 54 HB THR 54 -20.880 4.598 -7.328 395 HG1 THR 54 HG1 THR 54 -22.485 4.678 -8.722 396 HG21 THR 54 HG21 THR 54 -20.287 2.470 -6.211 397 HG22 THR 54 HG22 THR 54 -20.482 2.241 -7.948 398 HG23 THR 54 HG23 THR 54 -21.758 1.723 -6.844 399 H TYR 55 HN TYR 55 -21.844 2.886 -3.755 400 HA TYR 55 HA TYR 55 -19.618 4.632 -2.945 401 HB2 TYR 55 HB2 TYR 55 -21.440 2.857 -1.310 402 HB3 TYR 55 HB1 TYR 55 -19.868 3.349 -0.703 403 HD1 TYR 55 HD1 TYR 55 -23.202 4.529 -1.722 404 HD2 TYR 55 HD2 TYR 55 -19.517 5.578 0.143 405 HE1 TYR 55 HE1 TYR 55 -24.212 6.623 -0.923 406 HE2 TYR 55 HE2 TYR 55 -20.517 7.680 0.941 407 HH TYR 55 HH TYR 55 -23.903 8.302 0.734 408 H THR 56 HN THR 56 -17.597 3.780 -2.804 409 HA THR 56 HA THR 56 -17.356 0.876 -3.206 410 HB THR 56 HB THR 56 -15.779 3.001 -4.682 411 HG1 THR 56 HG1 THR 56 -18.072 1.845 -5.246 412 HG21 THR 56 HG21 THR 56 -14.312 1.131 -4.119 413 HG22 THR 56 HG22 THR 56 -14.685 1.094 -5.843 414 HG23 THR 56 HG23 THR 56 -15.495 -0.016 -4.737 415 H VAL 57 HN VAL 57 -15.872 -0.128 -2.001 416 HA VAL 57 HA VAL 57 -14.059 1.561 -0.409 417 HB VAL 57 HB VAL 57 -15.661 0.468 1.123 418 HG11 VAL 57 HG11 VAL 57 -14.686 -2.126 -0.056 419 HG12 VAL 57 HG12 VAL 57 -16.343 -1.516 -0.010 420 HG13 VAL 57 HG13 VAL 57 -15.543 -2.007 1.476 421 HG21 VAL 57 HG21 VAL 57 -12.888 -0.705 1.302 422 HG22 VAL 57 HG22 VAL 57 -14.049 -0.585 2.624 423 HG23 VAL 57 HG23 VAL 57 -13.397 0.879 1.890 424 H THR 58 HN THR 58 -12.020 1.349 -0.905 425 HA THR 58 HA THR 58 -11.224 -1.013 -2.477 426 HB THR 58 HB THR 58 -9.910 1.696 -2.658 427 HG1 THR 58 HG1 THR 58 -12.204 0.682 -3.986 428 HG21 THR 58 HG21 THR 58 -10.050 -0.659 -4.559 429 HG22 THR 58 HG22 THR 58 -8.654 -0.178 -3.593 430 HG23 THR 58 HG23 THR 58 -9.239 0.876 -4.880 431 H GLU 59 HN GLU 59 -9.473 -2.136 -1.867 432 HA GLU 59 HA GLU 59 -8.169 -1.385 0.629 433 HB2 GLU 59 HB2 GLU 59 -7.822 -3.886 -1.057 434 HB3 GLU 59 HB1 GLU 59 -7.077 -3.611 0.490 435 HG2 GLU 59 HG2 GLU 59 -9.455 -3.411 1.415 436 HG3 GLU 59 HG1 GLU 59 -9.949 -4.148 -0.111 437 H GLY 60 HN GLY 60 -5.811 -1.359 0.858 438 HA2 GLY 60 HA2 GLY 60 -4.499 -0.428 -1.619 439 HA3 GLY 60 HA1 GLY 60 -3.968 -0.052 0.021 440 H SER 61 HN SER 61 -3.445 -2.014 -2.628 441 HA SER 61 HA SER 61 -2.604 -4.341 -1.127 442 HB2 SER 61 HB2 SER 61 -3.764 -4.265 -3.473 443 HB3 SER 61 HB1 SER 61 -2.129 -4.001 -4.064 444 HG SER 61 HG SER 61 -1.508 -5.975 -3.268 445 H GLY 62 HN GLY 62 -0.863 -2.663 -3.768 446 HA2 GLY 62 HA2 GLY 62 1.607 -3.136 -2.232 447 HA3 GLY 62 HA1 GLY 62 1.518 -2.971 -3.978 448 H GLY 63 HN GLY 63 0.971 -1.157 -0.972 449 HA2 GLY 63 HA2 GLY 63 2.075 1.197 -2.379 450 HA3 GLY 63 HA1 GLY 63 0.688 1.322 -1.308 451 H ALA 64 HN ALA 64 2.241 -0.843 0.346 452 HA ALA 64 HA ALA 64 4.296 0.830 1.533 453 HB1 ALA 64 HB1 ALA 64 2.238 1.567 2.634 454 HB2 ALA 64 HB2 ALA 64 3.319 0.748 3.764 455 HB3 ALA 64 HB3 ALA 64 1.908 -0.095 3.122 456 H GLY 65 HN GLY 65 5.750 -0.294 2.844 457 HA2 GLY 65 HA2 GLY 65 6.018 -2.428 4.183 458 HA3 GLY 65 HA1 GLY 65 5.474 -3.231 2.715 459 H GLY 66 HN GLY 66 8.148 -2.102 4.453 460 HA2 GLY 66 HA2 GLY 66 9.919 -1.945 2.148 461 HA3 GLY 66 HA1 GLY 66 10.368 -1.727 3.834 462 H GLN 67 HN GLN 67 8.703 -4.337 4.180 463 HA GLN 67 HA GLN 67 8.966 -6.582 4.253 464 HB2 GLN 67 HB2 GLN 67 11.073 -6.170 2.109 465 HB3 GLN 67 HB1 GLN 67 10.395 -7.738 2.614 466 HG2 GLN 67 HG2 GLN 67 8.823 -5.456 1.408 467 HG3 GLN 67 HG1 GLN 67 9.393 -6.880 0.540 468 HE21 GLN 67 HE21 GLN 67 8.866 -8.748 2.658 469 HE22 GLN 67 HE22 GLN 67 7.145 -8.918 2.749 470 H GLY 68 HN GLY 68 11.165 -4.432 5.294 471 HA2 GLY 68 HA2 GLY 68 12.455 -4.609 7.208 472 HA3 GLY 68 HA1 GLY 68 12.236 -6.348 7.169 473 H MET 69 HN MET 69 13.261 -6.792 4.553 474 HA MET 69 HA MET 69 15.194 -7.209 3.428 475 HB2 MET 69 HB2 MET 69 16.427 -4.930 4.993 476 HB3 MET 69 HB1 MET 69 17.055 -5.657 3.524 477 HG2 MET 69 HG2 MET 69 14.473 -4.126 3.743 478 HG3 MET 69 HG1 MET 69 15.992 -3.485 3.125 479 HE1 MET 69 HE1 MET 69 17.063 -4.144 0.824 480 HE2 MET 69 HE2 MET 69 16.487 -5.472 -0.187 481 HE3 MET 69 HE3 MET 69 17.185 -5.804 1.401 482 H ILE 70 HN ILE 70 15.748 -9.223 4.194 483 HA ILE 70 HA ILE 70 17.434 -9.308 6.601 484 HB ILE 70 HB ILE 70 15.162 -11.258 6.068 485 HG12 ILE 70 HG12 ILE 70 15.406 -9.163 8.242 486 HG13 ILE 70 HG11 ILE 70 14.407 -9.007 6.800 487 HG21 ILE 70 HG21 ILE 70 15.666 -12.238 8.234 488 HG22 ILE 70 HG22 ILE 70 16.955 -11.070 8.511 489 HG23 ILE 70 HG23 ILE 70 17.120 -12.278 7.233 490 HD11 ILE 70 HD11 ILE 70 13.091 -9.656 8.742 491 HD12 ILE 70 HD12 ILE 70 14.088 -11.098 8.941 492 HD13 ILE 70 HD13 ILE 70 13.073 -10.919 7.510 493 H GLN 71 HN GLN 71 16.921 -10.266 3.409 494 HA GLN 71 HA GLN 71 18.562 -12.699 3.650 495 HB2 GLN 71 HB2 GLN 71 17.155 -11.730 1.159 496 HB3 GLN 71 HB1 GLN 71 17.753 -13.349 1.507 497 HG2 GLN 71 HG2 GLN 71 15.697 -13.868 2.134 498 HG3 GLN 71 HG1 GLN 71 15.943 -12.833 3.539 499 HE21 GLN 71 HE21 GLN 71 16.104 -10.431 1.718 500 HE22 GLN 71 HE22 GLN 71 14.457 -10.097 1.313 501 H GLU 72 HN GLU 72 19.454 -9.895 3.841 502 HA GLU 72 HA GLU 72 20.952 -9.536 1.355 503 HB2 GLU 72 HB2 GLU 72 20.991 -7.469 3.501 504 HB3 GLU 72 HB1 GLU 72 21.022 -7.269 1.759 505 HG2 GLU 72 HG2 GLU 72 18.657 -7.720 3.549 506 HG3 GLU 72 HG1 GLU 72 18.973 -6.378 2.462 507 HA PRO 73 HA PRO 73 24.652 -10.687 3.553 508 HB2 PRO 73 HB2 PRO 73 26.486 -9.784 1.755 509 HB3 PRO 73 HB1 PRO 73 25.524 -11.283 1.505 510 HG2 PRO 73 HG2 PRO 73 25.141 -8.544 0.333 511 HG3 PRO 73 HG1 PRO 73 24.896 -10.132 -0.413 512 HD2 PRO 73 HD2 PRO 73 22.877 -8.535 0.560 513 HD3 PRO 73 HD1 PRO 73 22.764 -10.316 0.388 514 H ALA 74 HN ALA 74 26.876 -9.633 3.981 515 HA ALA 74 HA ALA 74 28.092 -8.053 5.030 516 HB1 ALA 74 HB1 ALA 74 27.941 -5.737 4.274 517 HB2 ALA 74 HB2 ALA 74 26.436 -6.109 3.435 518 HB3 ALA 74 HB3 ALA 74 27.944 -6.855 2.909 519 H LEU 75 HN LEU 75 27.576 -5.641 6.125 520 HA LEU 75 HA LEU 75 25.882 -6.348 8.319 521 HB2 LEU 75 HB2 LEU 75 27.644 -4.026 7.730 522 HB3 LEU 75 HB1 LEU 75 26.443 -3.880 8.988 523 HG LEU 75 HG LEU 75 28.678 -4.470 9.852 524 HD11 LEU 75 HD11 LEU 75 26.728 -5.089 11.128 525 HD12 LEU 75 HD12 LEU 75 27.953 -6.353 11.259 526 HD13 LEU 75 HD13 LEU 75 26.557 -6.580 10.204 527 HD21 LEU 75 HD21 LEU 75 29.567 -6.718 9.469 528 HD22 LEU 75 HD22 LEU 75 29.464 -5.797 7.969 529 HD23 LEU 75 HD23 LEU 75 28.261 -7.037 8.325 530 HA PRO 76 HA PRO 76 22.223 -4.435 6.587 531 HB2 PRO 76 HB2 PRO 76 21.089 -4.462 9.280 532 HB3 PRO 76 HB1 PRO 76 20.558 -5.382 7.878 533 HG2 PRO 76 HG2 PRO 76 21.752 -6.508 10.065 534 HG3 PRO 76 HG1 PRO 76 21.832 -7.201 8.404 535 HD2 PRO 76 HD2 PRO 76 23.956 -5.674 9.931 536 HD3 PRO 76 HD1 PRO 76 24.120 -6.979 8.744 537 HA PRO 77 HA PRO 77 22.324 -0.169 7.535 538 HB2 PRO 77 HB2 PRO 77 19.759 0.569 8.046 539 HB3 PRO 77 HB1 PRO 77 20.313 0.111 6.427 540 HG2 PRO 77 HG2 PRO 77 18.954 -1.567 8.506 541 HG3 PRO 77 HG1 PRO 77 18.520 -1.372 6.791 542 HD2 PRO 77 HD2 PRO 77 19.934 -3.501 7.627 543 HD3 PRO 77 HD1 PRO 77 20.349 -2.706 6.078 544 H GLY 78 HN GLY 78 22.998 0.949 9.243 545 HA2 GLY 78 HA2 GLY 78 23.103 1.744 11.418 546 HA3 GLY 78 HA1 GLY 78 21.683 0.785 11.788 547 H TRP 79 HN TRP 79 23.442 -1.587 10.601 548 HA TRP 79 HA TRP 79 24.461 -2.300 13.258 549 HB2 TRP 79 HB2 TRP 79 24.155 -3.882 10.694 550 HB3 TRP 79 HB1 TRP 79 25.021 -4.512 12.087 551 HD1 TRP 79 HD1 TRP 79 21.471 -3.466 11.023 552 HE1 TRP 79 HE1 TRP 79 19.783 -4.600 12.603 553 HE3 TRP 79 HE3 TRP 79 24.753 -5.564 14.333 554 HZ2 TRP 79 HZ2 TRP 79 19.850 -6.174 14.966 555 HZ3 TRP 79 HZ3 TRP 79 23.875 -6.857 16.220 556 HH2 TRP 79 HH2 TRP 79 21.478 -7.165 16.541 557 H GLU 80 HN GLU 80 26.621 -2.476 13.791 558 HA GLU 80 HA GLU 80 28.553 -1.768 11.685 559 HB2 GLU 80 HB2 GLU 80 28.386 -0.829 14.546 560 HB3 GLU 80 HB1 GLU 80 29.844 -0.660 13.585 561 HG2 GLU 80 HG2 GLU 80 27.203 0.477 12.730 562 HG3 GLU 80 HG1 GLU 80 28.347 1.359 13.742 563 H MET 81 HN MET 81 30.255 -3.062 11.493 564 HA MET 81 HA MET 81 30.768 -5.048 13.591 565 HB2 MET 81 HB2 MET 81 30.341 -6.056 11.417 566 HB3 MET 81 HB1 MET 81 31.592 -5.037 10.677 567 HG2 MET 81 HG2 MET 81 33.253 -6.191 12.198 568 HG3 MET 81 HG1 MET 81 31.955 -7.294 12.641 569 HE1 MET 81 HE1 MET 81 33.595 -9.291 11.889 570 HE2 MET 81 HE2 MET 81 34.823 -8.152 11.338 571 HE3 MET 81 HE3 MET 81 34.265 -9.435 10.263 572 H LYS 82 HN LYS 82 32.592 -4.729 14.826 573 HA LYS 82 HA LYS 82 34.674 -2.982 13.767 574 HB2 LYS 82 HB2 LYS 82 33.140 -2.283 16.294 575 HB3 LYS 82 HB1 LYS 82 34.616 -1.497 15.777 576 HG2 LYS 82 HG2 LYS 82 33.547 -0.221 14.236 577 HG3 LYS 82 HG1 LYS 82 32.469 -1.561 13.760 578 HD2 LYS 82 HD2 LYS 82 31.191 0.235 14.745 579 HD3 LYS 82 HD1 LYS 82 31.137 -1.189 15.785 580 HE2 LYS 82 HE2 LYS 82 31.408 0.881 17.046 581 HE3 LYS 82 HE1 LYS 82 32.781 -0.194 17.263 582 HZ1 LYS 82 HZ1 LYS 82 32.699 2.113 15.391 583 HZ2 LYS 82 HZ2 LYS 82 34.046 1.129 15.709 584 HZ3 LYS 82 HZ3 LYS 82 33.424 2.137 16.924 585 H TYR 83 HN TYR 83 36.634 -3.014 15.081 586 HA TYR 83 HA TYR 83 36.785 -5.506 16.652 587 HB2 TYR 83 HB2 TYR 83 39.027 -3.937 15.305 588 HB3 TYR 83 HB1 TYR 83 39.202 -5.524 16.103 589 HD1 TYR 83 HD1 TYR 83 37.957 -7.487 15.082 590 HD2 TYR 83 HD2 TYR 83 38.462 -3.797 13.027 591 HE1 TYR 83 HE1 TYR 83 37.521 -8.625 12.947 592 HE2 TYR 83 HE2 TYR 83 38.027 -4.924 10.883 593 HH TYR 83 HH TYR 83 36.689 -7.983 10.646 594 H THR 84 HN THR 84 37.889 -5.503 18.635 595 HA THR 84 HA THR 84 37.937 -2.969 20.023 596 HB THR 84 HB THR 84 38.404 -4.199 22.021 597 HG1 THR 84 HG1 THR 84 39.215 -6.279 22.005 598 HG21 THR 84 HG21 THR 84 36.711 -5.963 22.039 599 HG22 THR 84 HG22 THR 84 36.639 -5.916 20.277 600 HG23 THR 84 HG23 THR 84 36.134 -4.513 21.222 601 H SER 85 HN SER 85 40.111 -2.846 21.564 602 HA SER 85 HA SER 85 42.218 -2.339 19.664 603 HB2 SER 85 HB2 SER 85 43.458 -1.552 21.716 604 HB3 SER 85 HB1 SER 85 41.908 -0.753 21.451 605 HG SER 85 HG SER 85 42.442 -2.894 23.252 606 H GLU 86 HN GLU 86 41.273 -5.161 20.674 607 HA GLU 86 HA GLU 86 43.960 -6.207 21.397 608 HB2 GLU 86 HB2 GLU 86 41.322 -7.576 22.003 609 HB3 GLU 86 HB1 GLU 86 42.885 -7.891 22.738 610 HG2 GLU 86 HG2 GLU 86 41.184 -5.433 23.145 611 HG3 GLU 86 HG1 GLU 86 41.366 -6.773 24.272 612 H GLY 87 HN GLY 87 41.817 -5.903 18.928 613 HA2 GLY 87 HA2 GLY 87 41.901 -6.923 16.835 614 HA3 GLY 87 HA1 GLY 87 42.892 -8.197 17.529 615 H VAL 88 HN VAL 88 39.895 -7.394 19.080 616 HA VAL 88 HA VAL 88 38.809 -9.975 18.176 617 HB VAL 88 HB VAL 88 38.098 -8.446 20.691 618 HG11 VAL 88 HG11 VAL 88 37.336 -11.196 19.721 619 HG12 VAL 88 HG12 VAL 88 36.269 -9.810 19.933 620 HG13 VAL 88 HG13 VAL 88 37.009 -10.577 21.339 621 HG21 VAL 88 HG21 VAL 88 39.382 -10.140 21.890 622 HG22 VAL 88 HG22 VAL 88 40.409 -9.274 20.748 623 HG23 VAL 88 HG23 VAL 88 39.838 -10.898 20.363 624 H ARG 89 HN ARG 89 37.068 -9.968 16.948 625 HA ARG 89 HA ARG 89 35.761 -7.665 16.075 626 HB2 ARG 89 HB2 ARG 89 35.119 -9.116 14.491 627 HB3 ARG 89 HB1 ARG 89 36.064 -10.313 15.321 628 HG2 ARG 89 HG2 ARG 89 34.008 -10.903 16.629 629 HG3 ARG 89 HG1 ARG 89 33.112 -9.818 15.555 630 HD2 ARG 89 HD2 ARG 89 33.153 -11.269 13.858 631 HD3 ARG 89 HD1 ARG 89 34.815 -11.739 14.170 632 HE ARG 89 HE ARG 89 34.094 -13.468 15.522 633 HH11 ARG 89 HH11 ARG 89 31.342 -11.497 14.602 634 HH12 ARG 89 HH12 ARG 89 30.165 -12.636 15.177 635 HH21 ARG 89 HH21 ARG 89 32.578 -14.970 16.266 636 HH22 ARG 89 HH22 ARG 89 30.878 -14.621 16.136 637 H TYR 90 HN TYR 90 33.846 -6.723 16.662 638 HA TYR 90 HA TYR 90 31.903 -8.236 18.204 639 HB2 TYR 90 HB2 TYR 90 31.643 -6.609 19.960 640 HB3 TYR 90 HB1 TYR 90 33.328 -7.071 19.901 641 HD1 TYR 90 HD1 TYR 90 35.013 -5.481 19.002 642 HD2 TYR 90 HD2 TYR 90 30.958 -4.351 19.582 643 HE1 TYR 90 HE1 TYR 90 35.674 -3.113 18.915 644 HE2 TYR 90 HE2 TYR 90 31.603 -1.979 19.496 645 HH TYR 90 HH TYR 90 34.752 -0.954 18.519 646 H PHE 91 HN PHE 91 29.739 -7.058 18.215 647 HA PHE 91 HA PHE 91 29.618 -5.253 15.906 648 HB2 PHE 91 HB2 PHE 91 27.574 -7.331 16.718 649 HB3 PHE 91 HB1 PHE 91 27.374 -6.166 15.426 650 HD1 PHE 91 HD1 PHE 91 28.990 -9.321 16.381 651 HD2 PHE 91 HD2 PHE 91 28.661 -6.321 13.351 652 HE1 PHE 91 HE1 PHE 91 30.008 -10.838 14.758 653 HE2 PHE 91 HE2 PHE 91 29.680 -7.861 11.740 654 HZ PHE 91 HZ PHE 91 30.349 -10.114 12.435 655 H VAL 92 HN VAL 92 28.068 -3.619 15.949 656 HA VAL 92 HA VAL 92 27.187 -2.915 18.673 657 HB VAL 92 HB VAL 92 27.606 -1.064 16.313 658 HG11 VAL 92 HG11 VAL 92 27.117 -0.413 19.213 659 HG12 VAL 92 HG12 VAL 92 25.932 -0.253 17.909 660 HG13 VAL 92 HG13 VAL 92 27.389 0.745 17.913 661 HG21 VAL 92 HG21 VAL 92 29.552 -0.239 17.511 662 HG22 VAL 92 HG22 VAL 92 29.721 -1.939 17.074 663 HG23 VAL 92 HG23 VAL 92 29.327 -1.489 18.733 664 H ASP 93 HN ASP 93 25.031 -3.215 18.975 665 HA ASP 93 HA ASP 93 23.283 -3.214 16.627 666 HB2 ASP 93 HB2 ASP 93 22.584 -4.851 18.234 667 HB3 ASP 93 HB1 ASP 93 22.700 -3.722 19.571 668 H HIS 94 HN HIS 94 21.967 -1.490 16.089 669 HA HIS 94 HA HIS 94 22.621 0.987 17.427 670 HB2 HIS 94 HB2 HIS 94 21.562 2.064 15.487 671 HB3 HIS 94 HB1 HIS 94 22.754 0.870 14.990 672 HD1 HIS 94 HD1 HIS 94 21.839 -1.358 13.937 673 HD2 HIS 94 HD2 HIS 94 18.961 1.565 14.626 674 HE1 HIS 94 HE1 HIS 94 19.807 -2.100 12.657 675 HE2 HIS 94 HE2 HIS 94 18.029 -0.413 13.235 676 H ASN 95 HN ASN 95 19.932 -1.237 17.417 677 HA ASN 95 HA ASN 95 17.989 0.859 17.886 678 HB2 ASN 95 HB2 ASN 95 16.321 -0.712 17.539 679 HB3 ASN 95 HB1 ASN 95 17.641 -1.478 16.668 680 HD21 ASN 95 HD21 ASN 95 18.581 -3.339 17.516 681 HD22 ASN 95 HD22 ASN 95 17.822 -4.243 18.777 682 H THR 96 HN THR 96 19.689 -1.554 19.823 683 HA THR 96 HA THR 96 18.356 -0.489 22.223 684 HB THR 96 HB THR 96 19.439 -2.352 23.442 685 HG1 THR 96 HG1 THR 96 20.359 -3.108 20.842 686 HG21 THR 96 HG21 THR 96 17.181 -2.635 22.438 687 HG22 THR 96 HG22 THR 96 18.080 -4.145 22.594 688 HG23 THR 96 HG23 THR 96 17.946 -3.360 21.022 689 H ARG 97 HN ARG 97 21.089 -0.166 20.363 690 HA ARG 97 HA ARG 97 23.132 0.785 20.574 691 HB2 ARG 97 HB2 ARG 97 21.699 2.202 22.809 692 HB3 ARG 97 HB1 ARG 97 23.367 2.561 22.377 693 HG2 ARG 97 HG2 ARG 97 22.422 2.855 19.994 694 HG3 ARG 97 HG1 ARG 97 20.869 3.024 20.809 695 HD2 ARG 97 HD2 ARG 97 21.891 5.200 20.448 696 HD3 ARG 97 HD1 ARG 97 21.795 4.830 22.168 697 HE ARG 97 HE ARG 97 24.291 3.965 21.387 698 HH11 ARG 97 HH11 ARG 97 22.561 6.998 21.341 699 HH12 ARG 97 HH12 ARG 97 23.994 7.972 21.510 700 HH21 ARG 97 HH21 ARG 97 26.188 5.219 21.621 701 HH22 ARG 97 HH22 ARG 97 26.073 6.949 21.652 702 H THR 98 HN THR 98 23.906 -1.289 21.034 703 HA THR 98 HA THR 98 25.150 -1.497 23.671 704 HB THR 98 HB THR 98 22.945 -2.835 23.585 705 HG1 THR 98 HG1 THR 98 24.014 -4.636 24.661 706 HG21 THR 98 HG21 THR 98 23.062 -5.043 22.492 707 HG22 THR 98 HG22 THR 98 24.640 -4.630 21.822 708 HG23 THR 98 HG23 THR 98 23.207 -3.743 21.304 709 H THR 99 HN THR 99 26.735 -3.351 23.685 710 HA THR 99 HA THR 99 28.014 -3.606 21.026 711 HB THR 99 HB THR 99 30.162 -3.988 22.407 712 HG1 THR 99 HG1 THR 99 28.970 -4.313 24.417 713 HG21 THR 99 HG21 THR 99 30.578 -1.578 22.715 714 HG22 THR 99 HG22 THR 99 28.844 -1.259 22.727 715 HG23 THR 99 HG23 THR 99 29.623 -1.800 21.242 716 H THR 100 HN THR 100 27.466 -5.675 20.324 717 HA THR 100 HA THR 100 27.339 -7.754 22.391 718 HB THR 100 HB THR 100 25.049 -7.090 21.689 719 HG1 THR 100 HG1 THR 100 24.673 -9.116 22.137 720 HG21 THR 100 HG21 THR 100 26.006 -8.007 18.972 721 HG22 THR 100 HG22 THR 100 25.290 -6.450 19.401 722 HG23 THR 100 HG23 THR 100 24.300 -7.906 19.402 723 H PHE 101 HN PHE 101 27.811 -9.876 21.728 724 HA PHE 101 HA PHE 101 29.528 -10.021 19.341 725 HB2 PHE 101 HB2 PHE 101 29.457 -11.638 21.911 726 HB3 PHE 101 HB1 PHE 101 30.420 -12.120 20.457 727 HD1 PHE 101 HD1 PHE 101 32.532 -11.256 20.123 728 HD2 PHE 101 HD2 PHE 101 29.988 -9.384 22.978 729 HE1 PHE 101 HE1 PHE 101 34.414 -9.864 20.882 730 HE2 PHE 101 HE2 PHE 101 31.866 -7.987 23.738 731 HZ PHE 101 HZ PHE 101 34.076 -8.225 22.689 732 H LYS 102 HN LYS 102 28.012 -10.591 17.761 733 HA LYS 102 HA LYS 102 26.474 -13.029 18.285 734 HB2 LYS 102 HB2 LYS 102 25.951 -10.723 16.418 735 HB3 LYS 102 HB1 LYS 102 25.055 -12.225 16.373 736 HG2 LYS 102 HG2 LYS 102 24.438 -11.836 18.770 737 HG3 LYS 102 HG1 LYS 102 25.176 -10.241 18.626 738 HD2 LYS 102 HD2 LYS 102 22.823 -9.989 18.291 739 HD3 LYS 102 HD1 LYS 102 23.611 -9.780 16.725 740 HE2 LYS 102 HE2 LYS 102 21.671 -11.156 16.419 741 HE3 LYS 102 HE1 LYS 102 23.108 -12.154 16.215 742 HZ1 LYS 102 HZ1 LYS 102 21.361 -12.047 18.620 743 HZ2 LYS 102 HZ2 LYS 102 22.813 -12.916 18.531 744 HZ3 LYS 102 HZ3 LYS 102 21.512 -13.339 17.530 745 H ASP 103 HN ASP 103 26.890 -14.783 17.141 746 HA ASP 103 HA ASP 103 28.805 -14.653 14.990 747 HB2 ASP 103 HB2 ASP 103 28.783 -17.134 15.385 748 HB3 ASP 103 HB1 ASP 103 29.333 -16.184 16.741 749 HA PRO 104 HA PRO 104 25.532 -15.100 11.962 750 HB2 PRO 104 HB2 PRO 104 27.179 -16.031 9.927 751 HB3 PRO 104 HB1 PRO 104 26.941 -14.318 10.300 752 HG2 PRO 104 HG2 PRO 104 29.187 -16.133 11.066 753 HG3 PRO 104 HG1 PRO 104 29.222 -14.419 10.614 754 HD2 PRO 104 HD2 PRO 104 29.436 -15.232 13.176 755 HD3 PRO 104 HD1 PRO 104 28.624 -13.717 12.726 756 H ARG 105 HN ARG 105 27.900 -17.584 12.650 757 HA ARG 105 HA ARG 105 25.985 -19.652 11.813 758 HB2 ARG 105 HB2 ARG 105 28.975 -19.882 12.217 759 HB3 ARG 105 HB1 ARG 105 27.905 -21.160 11.655 760 HG2 ARG 105 HG2 ARG 105 28.439 -18.572 10.206 761 HG3 ARG 105 HG1 ARG 105 29.171 -20.140 9.828 762 HD2 ARG 105 HD2 ARG 105 26.205 -19.605 9.828 763 HD3 ARG 105 HD1 ARG 105 27.219 -19.529 8.388 764 HE ARG 105 HE ARG 105 27.711 -22.002 9.453 765 HH11 ARG 105 HH11 ARG 105 24.802 -20.293 8.484 766 HH12 ARG 105 HH12 ARG 105 23.979 -21.739 7.979 767 HH21 ARG 105 HH21 ARG 105 26.605 -23.900 8.801 768 HH22 ARG 105 HH22 ARG 105 25.008 -23.775 8.114 769 HA PRO 106 HA PRO 106 25.380 -19.817 16.326 770 HB2 PRO 106 HB2 PRO 106 24.098 -22.372 15.423 771 HB3 PRO 106 HB1 PRO 106 23.512 -21.143 16.609 772 HG2 PRO 106 HG2 PRO 106 22.527 -21.246 14.131 773 HG3 PRO 106 HG1 PRO 106 22.829 -19.695 14.936 774 HD2 PRO 106 HD2 PRO 106 24.329 -21.028 12.736 775 HD3 PRO 106 HD1 PRO 106 24.099 -19.280 13.088 776 H GLY 107 HN GLY 107 27.089 -20.379 17.497 777 HA2 GLY 107 HA2 GLY 107 28.322 -21.874 18.786 778 HA3 GLY 107 HA1 GLY 107 27.810 -23.206 17.723 779 H PHE 108 HN PHE 108 28.609 -21.719 15.267 780 HA PHE 108 HA PHE 108 30.440 -21.810 13.838 781 HB2 PHE 108 HB2 PHE 108 30.743 -19.730 15.489 782 HB3 PHE 108 HB1 PHE 108 32.159 -20.694 16.039 783 HD1 PHE 108 HD1 PHE 108 34.110 -20.876 14.694 784 HD2 PHE 108 HD2 PHE 108 30.634 -18.954 13.151 785 HE1 PHE 108 HE1 PHE 108 35.424 -20.021 12.810 786 HE2 PHE 108 HE2 PHE 108 31.955 -18.089 11.265 787 HZ PHE 108 HZ PHE 108 34.367 -18.598 11.117 788 H GLU 109 HN GLU 109 30.006 -24.213 15.100 789 HA GLU 109 HA GLU 109 30.946 -26.260 15.366 790 HB2 GLU 109 HB2 GLU 109 32.455 -25.610 13.506 791 HB3 GLU 109 HB1 GLU 109 33.565 -24.907 14.672 792 HG2 GLU 109 HG2 GLU 109 34.379 -27.059 13.990 793 HG3 GLU 109 HG1 GLU 109 33.885 -27.133 15.679 Start of MODEL 11 1 H1 GLY 1 HT1 GLY 1 -43.115 8.376 0.435 2 H2 GLY 1 HT2 GLY 1 -43.718 8.269 2.018 3 H3 GLY 1 HT3 GLY 1 -43.936 6.979 0.937 4 HA2 GLY 1 HA1 GLY 1 -41.360 7.923 2.060 5 HA3 GLY 1 HA2 GLY 1 -42.195 6.434 2.484 6 H SER 2 HN SER 2 -39.973 7.918 0.397 7 HA SER 2 HA SER 2 -39.989 5.566 -1.371 8 HB2 SER 2 HB2 SER 2 -38.673 7.043 -2.940 9 HB3 SER 2 HB1 SER 2 -40.330 7.577 -2.647 10 HG SER 2 HG SER 2 -37.933 8.614 -1.545 11 H HIS 3 HN HIS 3 -38.305 4.211 -1.295 12 HA HIS 3 HA HIS 3 -36.048 4.877 0.441 13 HB2 HIS 3 HB2 HIS 3 -36.829 2.304 -0.967 14 HB3 HIS 3 HB1 HIS 3 -35.393 2.482 0.028 15 HD1 HIS 3 HD1 HIS 3 -36.970 0.339 1.067 16 HD2 HIS 3 HD2 HIS 3 -38.029 4.272 1.956 17 HE1 HIS 3 HE1 HIS 3 -38.369 0.221 3.148 18 HE2 HIS 3 HE2 HIS 3 -39.106 2.584 3.605 19 H MET 4 HN MET 4 -33.892 5.070 -0.372 20 HA MET 4 HA MET 4 -33.757 5.398 -3.285 21 HB2 MET 4 HB2 MET 4 -31.703 6.330 -1.265 22 HB3 MET 4 HB1 MET 4 -31.849 6.813 -2.948 23 HG2 MET 4 HG2 MET 4 -33.836 7.452 -0.781 24 HG3 MET 4 HG1 MET 4 -32.607 8.550 -1.400 25 HE1 MET 4 HE1 MET 4 -32.592 9.579 -3.786 26 HE2 MET 4 HE2 MET 4 -33.768 9.211 -5.046 27 HE3 MET 4 HE3 MET 4 -32.623 7.976 -4.518 28 H GLN 5 HN GLN 5 -32.391 4.155 -4.509 29 HA GLN 5 HA GLN 5 -31.229 1.876 -3.127 30 HB2 GLN 5 HB2 GLN 5 -32.626 1.477 -5.119 31 HB3 GLN 5 HB1 GLN 5 -31.487 2.395 -6.093 32 HG2 GLN 5 HG2 GLN 5 -29.729 0.752 -5.452 33 HG3 GLN 5 HG1 GLN 5 -30.987 -0.206 -4.678 34 HE21 GLN 5 HE21 GLN 5 -29.612 0.854 -7.669 35 HE22 GLN 5 HE22 GLN 5 -30.495 -0.265 -8.693 36 H TYR 6 HN TYR 6 -29.166 1.847 -2.571 37 HA TYR 6 HA TYR 6 -27.260 3.419 -4.198 38 HB2 TYR 6 HB2 TYR 6 -27.221 2.810 -1.201 39 HB3 TYR 6 HB1 TYR 6 -25.806 3.412 -2.046 40 HD1 TYR 6 HD1 TYR 6 -25.796 5.728 -2.929 41 HD2 TYR 6 HD2 TYR 6 -29.058 4.216 -0.654 42 HE1 TYR 6 HE1 TYR 6 -26.572 8.026 -2.524 43 HE2 TYR 6 HE2 TYR 6 -29.842 6.507 -0.241 44 HH TYR 6 HH TYR 6 -28.550 9.213 -1.920 45 H LYS 7 HN LYS 7 -25.348 2.349 -4.793 46 HA LYS 7 HA LYS 7 -25.350 -0.539 -4.216 47 HB2 LYS 7 HB2 LYS 7 -24.003 -0.705 -6.397 48 HB3 LYS 7 HB1 LYS 7 -25.736 -0.356 -6.543 49 HG2 LYS 7 HG2 LYS 7 -25.251 1.987 -6.882 50 HG3 LYS 7 HG1 LYS 7 -23.532 1.683 -6.690 51 HD2 LYS 7 HD2 LYS 7 -25.306 0.553 -8.853 52 HD3 LYS 7 HD1 LYS 7 -24.128 1.854 -9.049 53 HE2 LYS 7 HE2 LYS 7 -22.329 0.314 -8.431 54 HE3 LYS 7 HE1 LYS 7 -23.502 -0.988 -8.241 55 HZ1 LYS 7 HZ1 LYS 7 -22.802 0.442 -10.748 56 HZ2 LYS 7 HZ2 LYS 7 -24.073 -0.677 -10.619 57 HZ3 LYS 7 HZ3 LYS 7 -22.473 -1.177 -10.369 58 H LEU 8 HN LEU 8 -23.393 -1.556 -3.822 59 HA LEU 8 HA LEU 8 -21.101 0.240 -3.288 60 HB2 LEU 8 HB2 LEU 8 -22.279 -0.294 -1.144 61 HB3 LEU 8 HB1 LEU 8 -22.079 -1.983 -1.495 62 HG LEU 8 HG LEU 8 -19.540 -1.471 -1.510 63 HD11 LEU 8 HD11 LEU 8 -18.898 0.316 0.034 64 HD12 LEU 8 HD12 LEU 8 -20.573 0.862 0.093 65 HD13 LEU 8 HD13 LEU 8 -19.675 0.941 -1.420 66 HD21 LEU 8 HD21 LEU 8 -21.284 -1.573 0.916 67 HD22 LEU 8 HD22 LEU 8 -19.529 -1.740 0.979 68 HD23 LEU 8 HD23 LEU 8 -20.498 -2.914 0.084 69 H ILE 9 HN ILE 9 -19.092 -0.611 -3.635 70 HA ILE 9 HA ILE 9 -19.000 -3.342 -4.717 71 HB ILE 9 HB ILE 9 -17.483 -0.963 -5.850 72 HG12 ILE 9 HG12 ILE 9 -19.610 -2.717 -7.163 73 HG13 ILE 9 HG11 ILE 9 -19.933 -1.072 -6.502 74 HG21 ILE 9 HG21 ILE 9 -17.422 -3.903 -6.519 75 HG22 ILE 9 HG22 ILE 9 -16.086 -2.894 -5.954 76 HG23 ILE 9 HG23 ILE 9 -16.764 -2.649 -7.567 77 HD11 ILE 9 HD11 ILE 9 -19.639 -0.995 -8.907 78 HD12 ILE 9 HD12 ILE 9 -18.070 -1.792 -8.782 79 HD13 ILE 9 HD13 ILE 9 -18.293 -0.173 -8.118 80 H LEU 10 HN LEU 10 -17.549 -4.559 -3.693 81 HA LEU 10 HA LEU 10 -15.735 -3.195 -1.843 82 HB2 LEU 10 HB2 LEU 10 -16.325 -6.155 -1.996 83 HB3 LEU 10 HB1 LEU 10 -15.344 -5.359 -0.793 84 HG LEU 10 HG LEU 10 -17.262 -5.743 0.380 85 HD11 LEU 10 HD11 LEU 10 -16.743 -3.356 0.440 86 HD12 LEU 10 HD12 LEU 10 -18.445 -3.718 0.726 87 HD13 LEU 10 HD13 LEU 10 -17.931 -3.098 -0.845 88 HD21 LEU 10 HD21 LEU 10 -19.495 -5.725 -0.444 89 HD22 LEU 10 HD22 LEU 10 -18.507 -6.658 -1.571 90 HD23 LEU 10 HD23 LEU 10 -18.987 -5.006 -1.965 91 H ASN 11 HN ASN 11 -14.108 -2.521 -3.207 92 HA ASN 11 HA ASN 11 -12.828 -4.533 -4.929 93 HB2 ASN 11 HB2 ASN 11 -11.816 -1.703 -4.435 94 HB3 ASN 11 HB1 ASN 11 -11.461 -2.757 -5.785 95 HD21 ASN 11 HD21 ASN 11 -12.016 -1.297 -7.316 96 HD22 ASN 11 HD22 ASN 11 -13.645 -0.784 -7.590 97 H GLY 12 HN GLY 12 -12.175 -5.911 -3.293 98 HA2 GLY 12 HA2 GLY 12 -9.559 -5.190 -2.231 99 HA3 GLY 12 HA1 GLY 12 -10.786 -5.692 -1.064 100 H LYS 13 HN LYS 13 -8.197 -6.899 -2.343 101 HA LYS 13 HA LYS 13 -8.893 -9.229 -3.693 102 HB2 LYS 13 HB2 LYS 13 -6.606 -8.838 -1.750 103 HB3 LYS 13 HB1 LYS 13 -6.727 -10.130 -2.940 104 HG2 LYS 13 HG2 LYS 13 -6.749 -8.402 -4.726 105 HG3 LYS 13 HG1 LYS 13 -6.474 -7.179 -3.486 106 HD2 LYS 13 HD2 LYS 13 -4.654 -9.499 -4.125 107 HD3 LYS 13 HD1 LYS 13 -4.387 -7.814 -4.581 108 HE2 LYS 13 HE2 LYS 13 -4.231 -7.172 -2.256 109 HE3 LYS 13 HE1 LYS 13 -4.629 -8.811 -1.747 110 HZ1 LYS 13 HZ1 LYS 13 -2.587 -9.555 -2.901 111 HZ2 LYS 13 HZ2 LYS 13 -2.287 -8.533 -1.588 112 HZ3 LYS 13 HZ3 LYS 13 -2.176 -7.928 -3.169 113 H THR 14 HN THR 14 -9.397 -8.421 -0.386 114 HA THR 14 HA THR 14 -9.521 -11.121 0.628 115 HB THR 14 HB THR 14 -10.769 -8.702 1.929 116 HG1 THR 14 HG1 THR 14 -8.792 -7.860 1.581 117 HG21 THR 14 HG21 THR 14 -11.097 -10.839 3.041 118 HG22 THR 14 HG22 THR 14 -10.005 -9.836 3.993 119 HG23 THR 14 HG23 THR 14 -9.364 -11.153 3.010 120 H LEU 15 HN LEU 15 -11.748 -8.840 -0.840 121 HA LEU 15 HA LEU 15 -13.813 -10.802 -1.024 122 HB2 LEU 15 HB2 LEU 15 -13.849 -9.304 1.292 123 HB3 LEU 15 HB1 LEU 15 -14.923 -8.410 0.246 124 HG LEU 15 HG LEU 15 -16.325 -9.834 1.444 125 HD11 LEU 15 HD11 LEU 15 -15.706 -11.280 -1.117 126 HD12 LEU 15 HD12 LEU 15 -16.797 -9.910 -0.933 127 HD13 LEU 15 HD13 LEU 15 -17.180 -11.450 -0.165 128 HD21 LEU 15 HD21 LEU 15 -14.716 -11.224 2.507 129 HD22 LEU 15 HD22 LEU 15 -14.268 -11.976 0.979 130 HD23 LEU 15 HD23 LEU 15 -15.863 -12.276 1.674 131 H LYS 16 HN LYS 16 -13.815 -10.429 -3.225 132 HA LYS 16 HA LYS 16 -14.500 -7.712 -4.073 133 HB2 LYS 16 HB2 LYS 16 -13.304 -10.044 -5.532 134 HB3 LYS 16 HB1 LYS 16 -14.146 -8.790 -6.431 135 HG2 LYS 16 HG2 LYS 16 -11.736 -8.404 -4.656 136 HG3 LYS 16 HG1 LYS 16 -11.783 -8.301 -6.402 137 HD2 LYS 16 HD2 LYS 16 -13.073 -6.453 -4.466 138 HD3 LYS 16 HD1 LYS 16 -11.741 -6.138 -5.578 139 HE2 LYS 16 HE2 LYS 16 -14.526 -6.868 -6.448 140 HE3 LYS 16 HE1 LYS 16 -13.919 -5.218 -6.362 141 HZ1 LYS 16 HZ1 LYS 16 -12.753 -7.372 -8.046 142 HZ2 LYS 16 HZ2 LYS 16 -12.253 -5.750 -7.998 143 HZ3 LYS 16 HZ3 LYS 16 -13.791 -6.150 -8.597 144 H GLY 17 HN GLY 17 -16.493 -7.238 -4.524 145 HA2 GLY 17 HA2 GLY 17 -18.334 -8.778 -5.904 146 HA3 GLY 17 HA1 GLY 17 -18.608 -9.068 -4.189 147 H GLU 18 HN GLU 18 -20.642 -7.965 -5.505 148 HA GLU 18 HA GLU 18 -20.592 -5.192 -4.550 149 HB2 GLU 18 HB2 GLU 18 -22.001 -6.049 -7.090 150 HB3 GLU 18 HB1 GLU 18 -21.868 -4.419 -6.451 151 HG2 GLU 18 HG2 GLU 18 -20.293 -4.352 -8.092 152 HG3 GLU 18 HG1 GLU 18 -19.305 -4.842 -6.720 153 H THR 19 HN THR 19 -22.775 -4.325 -4.143 154 HA THR 19 HA THR 19 -24.958 -6.169 -3.886 155 HB THR 19 HB THR 19 -23.552 -6.757 -1.901 156 HG1 THR 19 HG1 THR 19 -25.331 -7.036 -0.740 157 HG21 THR 19 HG21 THR 19 -23.501 -5.119 -0.009 158 HG22 THR 19 HG22 THR 19 -24.167 -3.896 -1.093 159 HG23 THR 19 HG23 THR 19 -22.570 -4.576 -1.409 160 H THR 20 HN THR 20 -26.768 -5.014 -2.530 161 HA THR 20 HA THR 20 -26.731 -2.118 -3.022 162 HB THR 20 HB THR 20 -29.162 -2.355 -3.787 163 HG1 THR 20 HG1 THR 20 -28.308 -5.070 -3.990 164 HG21 THR 20 HG21 THR 20 -27.419 -1.802 -5.404 165 HG22 THR 20 HG22 THR 20 -28.547 -2.954 -6.121 166 HG23 THR 20 HG23 THR 20 -26.979 -3.508 -5.539 167 H THR 21 HN THR 21 -28.489 -0.988 -1.811 168 HA THR 21 HA THR 21 -29.819 -2.469 0.285 169 HB THR 21 HB THR 21 -27.470 -1.961 1.203 170 HG1 THR 21 HG1 THR 21 -29.233 -0.673 2.905 171 HG21 THR 21 HG21 THR 21 -27.185 0.342 0.381 172 HG22 THR 21 HG22 THR 21 -27.234 0.370 2.148 173 HG23 THR 21 HG23 THR 21 -28.653 0.846 1.219 174 H GLU 22 HN GLU 22 -31.383 -1.172 1.425 175 HA GLU 22 HA GLU 22 -32.293 1.124 -0.162 176 HB2 GLU 22 HB2 GLU 22 -33.697 -0.346 2.090 177 HB3 GLU 22 HB1 GLU 22 -34.415 0.852 1.031 178 HG2 GLU 22 HG2 GLU 22 -34.393 -0.624 -0.832 179 HG3 GLU 22 HG1 GLU 22 -33.330 -1.793 0.041 180 H ALA 23 HN ALA 23 -31.781 3.116 0.527 181 HA ALA 23 HA ALA 23 -31.757 3.617 3.439 182 HB1 ALA 23 HB1 ALA 23 -29.738 5.007 3.238 183 HB2 ALA 23 HB2 ALA 23 -29.600 4.584 1.533 184 HB3 ALA 23 HB3 ALA 23 -29.403 3.340 2.769 185 H VAL 24 HN VAL 24 -32.282 5.857 3.964 186 HA VAL 24 HA VAL 24 -33.610 7.232 1.734 187 HB VAL 24 HB VAL 24 -34.876 8.455 3.544 188 HG11 VAL 24 HG11 VAL 24 -35.866 6.608 2.294 189 HG12 VAL 24 HG12 VAL 24 -36.404 6.575 3.972 190 HG13 VAL 24 HG13 VAL 24 -35.162 5.448 3.418 191 HG21 VAL 24 HG21 VAL 24 -33.334 8.035 5.394 192 HG22 VAL 24 HG22 VAL 24 -33.677 6.308 5.293 193 HG23 VAL 24 HG23 VAL 24 -34.951 7.434 5.762 194 H ASP 25 HN ASP 25 -30.726 7.351 2.977 195 HA ASP 25 HA ASP 25 -30.338 10.148 2.499 196 HB2 ASP 25 HB2 ASP 25 -30.996 10.211 4.869 197 HB3 ASP 25 HB1 ASP 25 -29.755 9.025 5.243 198 H ALA 26 HN ALA 26 -28.026 10.670 2.476 199 HA ALA 26 HA ALA 26 -26.575 8.527 1.234 200 HB1 ALA 26 HB1 ALA 26 -24.851 10.201 0.823 201 HB2 ALA 26 HB2 ALA 26 -25.664 11.327 1.909 202 HB3 ALA 26 HB3 ALA 26 -26.443 10.839 0.404 203 H ALA 27 HN ALA 27 -26.136 10.439 4.206 204 HA ALA 27 HA ALA 27 -23.693 9.156 4.950 205 HB1 ALA 27 HB1 ALA 27 -24.295 11.399 5.773 206 HB2 ALA 27 HB2 ALA 27 -23.961 10.277 7.092 207 HB3 ALA 27 HB3 ALA 27 -25.627 10.691 6.690 208 H THR 28 HN THR 28 -27.051 8.509 5.339 209 HA THR 28 HA THR 28 -26.819 6.602 7.447 210 HB THR 28 HB THR 28 -29.069 6.753 5.423 211 HG1 THR 28 HG1 THR 28 -28.718 8.809 6.398 212 HG21 THR 28 HG21 THR 28 -30.408 5.874 7.318 213 HG22 THR 28 HG22 THR 28 -28.938 5.780 8.290 214 HG23 THR 28 HG23 THR 28 -29.112 4.766 6.859 215 H ALA 29 HN ALA 29 -26.395 6.481 3.999 216 HA ALA 29 HA ALA 29 -26.723 3.624 3.759 217 HB1 ALA 29 HB1 ALA 29 -25.464 5.621 1.872 218 HB2 ALA 29 HB2 ALA 29 -27.138 5.061 1.828 219 HB3 ALA 29 HB3 ALA 29 -25.823 3.934 1.497 220 H GLU 30 HN GLU 30 -24.133 5.945 4.133 221 HA GLU 30 HA GLU 30 -21.913 4.277 3.907 222 HB2 GLU 30 HB2 GLU 30 -22.060 6.865 4.196 223 HB3 GLU 30 HB1 GLU 30 -22.103 6.507 5.912 224 HG2 GLU 30 HG2 GLU 30 -19.962 5.103 5.391 225 HG3 GLU 30 HG1 GLU 30 -19.877 6.165 3.984 226 H LYS 31 HN LYS 31 -23.528 5.379 6.880 227 HA LYS 31 HA LYS 31 -22.228 3.898 8.759 228 HB2 LYS 31 HB2 LYS 31 -25.181 4.535 8.764 229 HB3 LYS 31 HB1 LYS 31 -24.229 4.089 10.168 230 HG2 LYS 31 HG2 LYS 31 -23.697 6.539 8.505 231 HG3 LYS 31 HG1 LYS 31 -24.721 6.528 9.938 232 HD2 LYS 31 HD2 LYS 31 -22.656 7.258 10.732 233 HD3 LYS 31 HD1 LYS 31 -22.683 5.545 11.146 234 HE2 LYS 31 HE2 LYS 31 -21.314 5.037 9.206 235 HE3 LYS 31 HE1 LYS 31 -21.333 6.736 8.730 236 HZ1 LYS 31 HZ1 LYS 31 -20.156 7.294 10.751 237 HZ2 LYS 31 HZ2 LYS 31 -19.287 6.127 9.886 238 HZ3 LYS 31 HZ3 LYS 31 -20.182 5.674 11.253 239 H VAL 32 HN VAL 32 -24.956 2.784 6.768 240 HA VAL 32 HA VAL 32 -25.242 0.299 8.155 241 HB VAL 32 HB VAL 32 -26.272 1.145 5.442 242 HG11 VAL 32 HG11 VAL 32 -27.036 -1.241 7.135 243 HG12 VAL 32 HG12 VAL 32 -26.160 -1.289 5.606 244 HG13 VAL 32 HG13 VAL 32 -27.837 -0.743 5.644 245 HG21 VAL 32 HG21 VAL 32 -27.619 1.049 8.141 246 HG22 VAL 32 HG22 VAL 32 -28.406 1.450 6.614 247 HG23 VAL 32 HG23 VAL 32 -27.147 2.502 7.258 248 H PHE 33 HN PHE 33 -23.899 1.177 4.969 249 HA PHE 33 HA PHE 33 -23.046 -1.470 4.355 250 HB2 PHE 33 HB2 PHE 33 -22.576 1.217 3.164 251 HB3 PHE 33 HB1 PHE 33 -21.413 -0.034 2.793 252 HD1 PHE 33 HD1 PHE 33 -23.394 -2.351 2.798 253 HD2 PHE 33 HD2 PHE 33 -23.485 1.514 1.025 254 HE1 PHE 33 HE1 PHE 33 -24.858 -3.208 1.022 255 HE2 PHE 33 HE2 PHE 33 -24.962 0.665 -0.753 256 HZ PHE 33 HZ PHE 33 -25.649 -1.695 -0.758 257 H LYS 34 HN LYS 34 -21.594 1.075 6.246 258 HA LYS 34 HA LYS 34 -18.946 0.076 6.088 259 HB2 LYS 34 HB2 LYS 34 -20.382 1.874 8.018 260 HB3 LYS 34 HB1 LYS 34 -18.723 1.424 8.292 261 HG2 LYS 34 HG2 LYS 34 -18.404 2.264 5.830 262 HG3 LYS 34 HG1 LYS 34 -19.892 3.146 6.168 263 HD2 LYS 34 HD2 LYS 34 -18.053 4.601 6.705 264 HD3 LYS 34 HD1 LYS 34 -18.812 4.073 8.212 265 HE2 LYS 34 HE2 LYS 34 -17.089 2.412 8.549 266 HE3 LYS 34 HE1 LYS 34 -16.371 2.804 6.987 267 HZ1 LYS 34 HZ1 LYS 34 -15.804 4.982 7.804 268 HZ2 LYS 34 HZ2 LYS 34 -15.183 3.811 8.856 269 HZ3 LYS 34 HZ3 LYS 34 -16.575 4.685 9.277 270 H GLN 35 HN GLN 35 -21.646 -0.458 8.295 271 HA GLN 35 HA GLN 35 -20.337 -2.275 10.019 272 HB2 GLN 35 HB2 GLN 35 -22.472 -1.196 10.593 273 HB3 GLN 35 HB1 GLN 35 -23.272 -2.045 9.281 274 HG2 GLN 35 HG2 GLN 35 -23.857 -3.229 11.189 275 HG3 GLN 35 HG1 GLN 35 -22.575 -4.184 10.452 276 HE21 GLN 35 HE21 GLN 35 -23.517 -4.046 13.226 277 HE22 GLN 35 HE22 GLN 35 -22.123 -3.663 14.174 278 H TYR 36 HN TYR 36 -21.879 -2.514 6.920 279 HA TYR 36 HA TYR 36 -22.034 -5.342 6.722 280 HB2 TYR 36 HB2 TYR 36 -23.454 -4.109 5.281 281 HB3 TYR 36 HB1 TYR 36 -22.157 -3.037 4.792 282 HD1 TYR 36 HD1 TYR 36 -23.152 -6.639 4.528 283 HD2 TYR 36 HD2 TYR 36 -21.163 -3.318 2.809 284 HE1 TYR 36 HE1 TYR 36 -22.771 -7.940 2.478 285 HE2 TYR 36 HE2 TYR 36 -20.774 -4.581 0.740 286 HH TYR 36 HH TYR 36 -20.624 -6.931 0.039 287 H ALA 37 HN ALA 37 -19.766 -2.944 5.392 288 HA ALA 37 HA ALA 37 -17.978 -4.818 4.253 289 HB1 ALA 37 HB1 ALA 37 -16.459 -2.917 4.036 290 HB2 ALA 37 HB2 ALA 37 -17.455 -1.979 5.148 291 HB3 ALA 37 HB3 ALA 37 -18.099 -2.453 3.574 292 H ASN 38 HN ASN 38 -18.174 -3.240 7.381 293 HA ASN 38 HA ASN 38 -15.664 -3.987 8.408 294 HB2 ASN 38 HB2 ASN 38 -17.224 -2.267 9.442 295 HB3 ASN 38 HB1 ASN 38 -18.245 -3.597 9.980 296 HD21 ASN 38 HD21 ASN 38 -15.511 -1.661 10.714 297 HD22 ASN 38 HD22 ASN 38 -14.980 -2.542 12.161 298 H ASP 39 HN ASP 39 -18.777 -5.625 8.375 299 HA ASP 39 HA ASP 39 -18.041 -7.786 10.041 300 HB2 ASP 39 HB2 ASP 39 -20.366 -7.267 9.653 301 HB3 ASP 39 HB1 ASP 39 -20.184 -7.544 7.924 302 H ASN 40 HN ASN 40 -17.467 -7.106 6.693 303 HA ASN 40 HA ASN 40 -16.753 -9.852 6.062 304 HB2 ASN 40 HB2 ASN 40 -17.107 -7.343 4.467 305 HB3 ASN 40 HB1 ASN 40 -16.111 -8.642 3.814 306 HD21 ASN 40 HD21 ASN 40 -19.332 -7.607 4.616 307 HD22 ASN 40 HD22 ASN 40 -20.159 -8.995 3.902 308 H GLY 41 HN GLY 41 -15.298 -6.999 7.212 309 HA2 GLY 41 HA2 GLY 41 -13.102 -6.874 8.035 310 HA3 GLY 41 HA1 GLY 41 -12.675 -8.262 7.047 311 H VAL 42 HN VAL 42 -14.412 -5.937 5.280 312 HA VAL 42 HA VAL 42 -11.952 -5.172 3.937 313 HB VAL 42 HB VAL 42 -14.822 -4.740 3.060 314 HG11 VAL 42 HG11 VAL 42 -12.180 -4.378 1.632 315 HG12 VAL 42 HG12 VAL 42 -13.337 -3.118 2.051 316 HG13 VAL 42 HG13 VAL 42 -13.757 -4.331 0.841 317 HG21 VAL 42 HG21 VAL 42 -14.290 -6.588 1.464 318 HG22 VAL 42 HG22 VAL 42 -14.361 -7.078 3.161 319 HG23 VAL 42 HG23 VAL 42 -12.797 -6.858 2.367 320 H ASP 43 HN ASP 43 -11.065 -3.343 4.453 321 HA ASP 43 HA ASP 43 -12.743 -1.009 4.962 322 HB2 ASP 43 HB2 ASP 43 -12.060 -1.961 7.201 323 HB3 ASP 43 HB1 ASP 43 -10.383 -1.697 6.740 324 H GLY 44 HN GLY 44 -11.867 0.881 4.099 325 HA2 GLY 44 HA2 GLY 44 -9.213 1.292 3.379 326 HA3 GLY 44 HA1 GLY 44 -10.010 0.531 2.004 327 H GLU 45 HN GLU 45 -9.331 2.693 1.094 328 HA GLU 45 HA GLU 45 -10.477 5.117 1.840 329 HB2 GLU 45 HB2 GLU 45 -9.957 5.899 -0.378 330 HB3 GLU 45 HB1 GLU 45 -8.681 4.805 0.122 331 HG2 GLU 45 HG2 GLU 45 -9.557 3.053 -1.250 332 HG3 GLU 45 HG1 GLU 45 -10.959 4.032 -1.677 333 H TRP 46 HN TRP 46 -12.380 6.161 1.342 334 HA TRP 46 HA TRP 46 -14.459 4.479 0.109 335 HB2 TRP 46 HB2 TRP 46 -14.578 6.278 2.491 336 HB3 TRP 46 HB1 TRP 46 -15.985 6.239 1.445 337 HD1 TRP 46 HD1 TRP 46 -13.677 3.596 3.111 338 HE1 TRP 46 HE1 TRP 46 -15.141 1.700 4.029 339 HE3 TRP 46 HE3 TRP 46 -18.333 5.295 1.642 340 HZ2 TRP 46 HZ2 TRP 46 -17.855 1.009 4.135 341 HZ3 TRP 46 HZ3 TRP 46 -20.291 3.928 2.215 342 HH2 TRP 46 HH2 TRP 46 -20.056 1.827 3.434 343 H THR 47 HN THR 47 -15.182 5.154 -1.743 344 HA THR 47 HA THR 47 -15.036 8.015 -2.402 345 HB THR 47 HB THR 47 -14.837 7.136 -4.844 346 HG1 THR 47 HG1 THR 47 -13.314 5.052 -4.236 347 HG21 THR 47 HG21 THR 47 -12.496 6.891 -2.952 348 HG22 THR 47 HG22 THR 47 -13.078 8.390 -3.676 349 HG23 THR 47 HG23 THR 47 -12.400 7.123 -4.698 350 H TYR 48 HN TYR 48 -16.649 8.702 -4.018 351 HA TYR 48 HA TYR 48 -18.938 6.965 -4.336 352 HB2 TYR 48 HB2 TYR 48 -19.496 7.825 -2.173 353 HB3 TYR 48 HB1 TYR 48 -19.111 9.467 -2.626 354 HD1 TYR 48 HD1 TYR 48 -20.756 10.860 -3.620 355 HD2 TYR 48 HD2 TYR 48 -21.586 6.698 -3.160 356 HE1 TYR 48 HE1 TYR 48 -23.105 11.258 -4.212 357 HE2 TYR 48 HE2 TYR 48 -23.926 7.101 -3.755 358 HH TYR 48 HH TYR 48 -25.541 8.882 -3.793 359 H ASP 49 HN ASP 49 -20.477 7.746 -5.846 360 HA ASP 49 HA ASP 49 -19.635 10.137 -7.358 361 HB2 ASP 49 HB2 ASP 49 -18.701 8.362 -8.748 362 HB3 ASP 49 HB1 ASP 49 -20.203 7.459 -8.727 363 H ASP 50 HN ASP 50 -21.350 11.344 -8.170 364 HA ASP 50 HA ASP 50 -23.849 10.830 -6.748 365 HB2 ASP 50 HB2 ASP 50 -22.976 13.133 -6.779 366 HB3 ASP 50 HB1 ASP 50 -22.969 13.126 -8.541 367 H ALA 51 HN ALA 51 -22.652 10.589 -9.998 368 HA ALA 51 HA ALA 51 -25.215 10.575 -11.253 369 HB1 ALA 51 HB1 ALA 51 -24.019 9.939 -13.264 370 HB2 ALA 51 HB2 ALA 51 -22.569 9.601 -12.318 371 HB3 ALA 51 HB3 ALA 51 -23.182 11.251 -12.434 372 H THR 52 HN THR 52 -23.072 8.066 -10.000 373 HA THR 52 HA THR 52 -24.914 6.032 -11.024 374 HB THR 52 HB THR 52 -23.088 4.433 -10.317 375 HG1 THR 52 HG1 THR 52 -21.470 6.773 -10.219 376 HG21 THR 52 HG21 THR 52 -21.653 4.978 -12.249 377 HG22 THR 52 HG22 THR 52 -22.412 6.567 -12.351 378 HG23 THR 52 HG23 THR 52 -23.367 5.114 -12.649 379 H LYS 53 HN LYS 53 -24.299 7.655 -8.119 380 HA LYS 53 HA LYS 53 -24.884 7.310 -5.905 381 HB2 LYS 53 HB2 LYS 53 -26.859 5.449 -7.233 382 HB3 LYS 53 HB1 LYS 53 -26.826 5.702 -5.502 383 HG2 LYS 53 HG2 LYS 53 -28.528 7.062 -6.428 384 HG3 LYS 53 HG1 LYS 53 -27.205 8.124 -5.939 385 HD2 LYS 53 HD2 LYS 53 -28.102 8.746 -8.106 386 HD3 LYS 53 HD1 LYS 53 -26.433 8.232 -8.252 387 HE2 LYS 53 HE2 LYS 53 -27.624 7.281 -10.074 388 HE3 LYS 53 HE1 LYS 53 -27.302 5.979 -8.936 389 HZ1 LYS 53 HZ1 LYS 53 -29.576 6.210 -8.112 390 HZ2 LYS 53 HZ2 LYS 53 -29.542 5.853 -9.770 391 HZ3 LYS 53 HZ3 LYS 53 -29.874 7.434 -9.251 392 H THR 54 HN THR 54 -22.729 5.805 -7.050 393 HA THR 54 HA THR 54 -22.882 3.200 -5.760 394 HB THR 54 HB THR 54 -20.637 4.223 -7.498 395 HG1 THR 54 HG1 THR 54 -22.163 4.191 -8.991 396 HG21 THR 54 HG21 THR 54 -20.186 1.827 -7.830 397 HG22 THR 54 HG22 THR 54 -21.574 1.411 -6.823 398 HG23 THR 54 HG23 THR 54 -20.177 2.218 -6.107 399 H TYR 55 HN TYR 55 -22.026 2.948 -3.818 400 HA TYR 55 HA TYR 55 -19.893 4.723 -2.855 401 HB2 TYR 55 HB2 TYR 55 -21.666 2.688 -1.446 402 HB3 TYR 55 HB1 TYR 55 -20.168 3.254 -0.715 403 HD1 TYR 55 HD1 TYR 55 -23.532 4.355 -1.840 404 HD2 TYR 55 HD2 TYR 55 -19.984 5.360 0.275 405 HE1 TYR 55 HE1 TYR 55 -24.644 6.340 -0.928 406 HE2 TYR 55 HE2 TYR 55 -21.086 7.357 1.187 407 HH TYR 55 HH TYR 55 -22.942 8.825 0.667 408 H THR 56 HN THR 56 -17.790 4.014 -2.738 409 HA THR 56 HA THR 56 -17.345 1.147 -3.254 410 HB THR 56 HB THR 56 -15.845 3.417 -4.569 411 HG1 THR 56 HG1 THR 56 -18.090 2.046 -5.245 412 HG21 THR 56 HG21 THR 56 -15.558 0.428 -4.916 413 HG22 THR 56 HG22 THR 56 -14.402 1.473 -4.089 414 HG23 THR 56 HG23 THR 56 -14.687 1.663 -5.821 415 H VAL 57 HN VAL 57 -15.895 0.177 -2.019 416 HA VAL 57 HA VAL 57 -14.097 1.862 -0.406 417 HB VAL 57 HB VAL 57 -15.765 0.743 1.078 418 HG11 VAL 57 HG11 VAL 57 -14.619 -1.815 -0.023 419 HG12 VAL 57 HG12 VAL 57 -16.301 -1.277 -0.073 420 HG13 VAL 57 HG13 VAL 57 -15.558 -1.713 1.461 421 HG21 VAL 57 HG21 VAL 57 -14.167 -0.247 2.643 422 HG22 VAL 57 HG22 VAL 57 -13.580 1.265 1.949 423 HG23 VAL 57 HG23 VAL 57 -12.948 -0.275 1.367 424 H THR 58 HN THR 58 -12.001 1.542 -0.767 425 HA THR 58 HA THR 58 -11.287 -0.784 -2.449 426 HB THR 58 HB THR 58 -9.892 1.895 -2.505 427 HG1 THR 58 HG1 THR 58 -12.364 1.255 -3.423 428 HG21 THR 58 HG21 THR 58 -10.050 -0.391 -4.488 429 HG22 THR 58 HG22 THR 58 -8.672 -0.012 -3.456 430 HG23 THR 58 HG23 THR 58 -9.161 1.114 -4.721 431 H GLU 59 HN GLU 59 -9.802 -2.128 -1.648 432 HA GLU 59 HA GLU 59 -8.224 -1.438 0.682 433 HB2 GLU 59 HB2 GLU 59 -8.007 -3.855 -1.145 434 HB3 GLU 59 HB1 GLU 59 -7.084 -3.635 0.310 435 HG2 GLU 59 HG2 GLU 59 -9.326 -3.575 1.541 436 HG3 GLU 59 HG1 GLU 59 -10.010 -4.206 0.045 437 H GLY 60 HN GLY 60 -6.736 0.221 0.215 438 HA2 GLY 60 HA2 GLY 60 -5.636 0.668 -2.356 439 HA3 GLY 60 HA1 GLY 60 -5.022 1.330 -0.842 440 H SER 61 HN SER 61 -4.413 -0.702 -3.416 441 HA SER 61 HA SER 61 -2.703 -2.611 -2.268 442 HB2 SER 61 HB2 SER 61 -2.597 -1.438 -5.060 443 HB3 SER 61 HB1 SER 61 -1.869 -2.957 -4.543 444 HG SER 61 HG SER 61 -3.845 -3.402 -5.513 445 H GLY 62 HN GLY 62 -1.242 -1.817 -0.861 446 HA2 GLY 62 HA2 GLY 62 0.689 0.174 -1.871 447 HA3 GLY 62 HA1 GLY 62 0.298 -0.063 -0.173 448 H GLY 63 HN GLY 63 1.459 -1.934 -2.952 449 HA2 GLY 63 HA2 GLY 63 2.969 -3.673 -1.178 450 HA3 GLY 63 HA1 GLY 63 2.820 -3.826 -2.921 451 H ALA 64 HN ALA 64 3.694 -0.850 -1.355 452 HA ALA 64 HA ALA 64 5.534 0.466 -1.399 453 HB1 ALA 64 HB1 ALA 64 6.488 -1.339 -0.064 454 HB2 ALA 64 HB2 ALA 64 7.706 -0.580 -1.089 455 HB3 ALA 64 HB3 ALA 64 7.028 -2.144 -1.537 456 H GLY 65 HN GLY 65 4.316 -0.587 -3.990 457 HA2 GLY 65 HA2 GLY 65 6.196 0.744 -5.714 458 HA3 GLY 65 HA1 GLY 65 6.078 -0.982 -6.022 459 H GLY 66 HN GLY 66 5.443 1.020 -7.878 460 HA2 GLY 66 HA2 GLY 66 2.530 1.170 -7.969 461 HA3 GLY 66 HA1 GLY 66 3.653 1.977 -9.053 462 H GLN 67 HN GLN 67 3.697 -1.424 -8.218 463 HA GLN 67 HA GLN 67 3.983 -2.319 -10.853 464 HB2 GLN 67 HB2 GLN 67 3.004 -3.799 -8.390 465 HB3 GLN 67 HB1 GLN 67 3.445 -4.577 -9.932 466 HG2 GLN 67 HG2 GLN 67 5.284 -2.990 -8.134 467 HG3 GLN 67 HG1 GLN 67 5.252 -4.743 -8.328 468 HE21 GLN 67 HE21 GLN 67 7.423 -2.818 -8.811 469 HE22 GLN 67 HE22 GLN 67 7.886 -3.039 -10.470 470 H GLY 68 HN GLY 68 2.476 -1.723 -12.309 471 HA2 GLY 68 HA2 GLY 68 0.339 -3.137 -13.031 472 HA3 GLY 68 HA1 GLY 68 -0.346 -2.139 -11.754 473 H MET 69 HN MET 69 -0.941 -2.156 -14.665 474 HA MET 69 HA MET 69 -1.262 -0.703 -16.396 475 HB2 MET 69 HB2 MET 69 -1.092 1.321 -14.148 476 HB3 MET 69 HB1 MET 69 -1.726 1.647 -15.755 477 HG2 MET 69 HG2 MET 69 -3.502 0.007 -15.382 478 HG3 MET 69 HG1 MET 69 -2.874 -0.300 -13.765 479 HE1 MET 69 HE1 MET 69 -5.261 0.165 -12.733 480 HE2 MET 69 HE2 MET 69 -5.894 0.462 -14.350 481 HE3 MET 69 HE3 MET 69 -6.202 1.619 -13.058 482 H ILE 70 HN ILE 70 1.238 -1.502 -16.535 483 HA ILE 70 HA ILE 70 2.973 0.877 -16.538 484 HB ILE 70 HB ILE 70 3.919 -2.015 -16.670 485 HG12 ILE 70 HG12 ILE 70 3.952 -0.117 -14.312 486 HG13 ILE 70 HG11 ILE 70 2.838 -1.468 -14.501 487 HG21 ILE 70 HG21 ILE 70 5.521 0.497 -16.106 488 HG22 ILE 70 HG22 ILE 70 5.443 -0.302 -17.678 489 HG23 ILE 70 HG23 ILE 70 6.139 -1.145 -16.291 490 HD11 ILE 70 HD11 ILE 70 5.836 -1.672 -14.274 491 HD12 ILE 70 HD12 ILE 70 4.719 -3.025 -14.456 492 HD13 ILE 70 HD13 ILE 70 4.668 -2.029 -13.001 493 H GLN 71 HN GLN 71 1.684 1.370 -18.470 494 HA GLN 71 HA GLN 71 2.923 0.149 -20.840 495 HB2 GLN 71 HB2 GLN 71 0.050 0.961 -20.429 496 HB3 GLN 71 HB1 GLN 71 0.740 0.618 -22.001 497 HG2 GLN 71 HG2 GLN 71 1.237 -1.650 -21.321 498 HG3 GLN 71 HG1 GLN 71 0.598 -1.316 -19.713 499 HE21 GLN 71 HE21 GLN 71 -0.197 -1.808 -23.063 500 HE22 GLN 71 HE22 GLN 71 -1.892 -2.049 -22.829 501 H GLU 72 HN GLU 72 3.287 2.651 -19.121 502 HA GLU 72 HA GLU 72 2.890 4.698 -21.187 503 HB2 GLU 72 HB2 GLU 72 3.425 4.950 -18.223 504 HB3 GLU 72 HB1 GLU 72 3.335 6.318 -19.328 505 HG2 GLU 72 HG2 GLU 72 1.021 5.749 -19.841 506 HG3 GLU 72 HG1 GLU 72 1.120 4.365 -18.751 507 HA PRO 73 HA PRO 73 7.234 4.407 -22.008 508 HB2 PRO 73 HB2 PRO 73 7.557 6.644 -23.495 509 HB3 PRO 73 HB1 PRO 73 6.666 5.204 -24.119 510 HG2 PRO 73 HG2 PRO 73 5.576 7.724 -22.876 511 HG3 PRO 73 HG1 PRO 73 5.047 6.893 -24.352 512 HD2 PRO 73 HD2 PRO 73 3.764 6.600 -21.991 513 HD3 PRO 73 HD1 PRO 73 3.897 5.257 -23.175 514 H ALA 74 HN ALA 74 9.199 5.704 -21.845 515 HA ALA 74 HA ALA 74 9.339 8.141 -20.462 516 HB1 ALA 74 HB1 ALA 74 8.620 6.806 -18.523 517 HB2 ALA 74 HB2 ALA 74 10.269 7.397 -18.319 518 HB3 ALA 74 HB3 ALA 74 9.984 5.716 -18.771 519 H LEU 75 HN LEU 75 11.710 8.527 -19.723 520 HA LEU 75 HA LEU 75 13.384 7.690 -21.901 521 HB2 LEU 75 HB2 LEU 75 13.809 9.467 -19.518 522 HB3 LEU 75 HB1 LEU 75 15.148 9.013 -20.540 523 HG LEU 75 HG LEU 75 14.409 11.185 -21.206 524 HD11 LEU 75 HD11 LEU 75 13.440 9.129 -23.177 525 HD12 LEU 75 HD12 LEU 75 15.088 9.736 -23.018 526 HD13 LEU 75 HD13 LEU 75 13.797 10.816 -23.545 527 HD21 LEU 75 HD21 LEU 75 12.157 11.141 -20.282 528 HD22 LEU 75 HD22 LEU 75 11.655 10.003 -21.532 529 HD23 LEU 75 HD23 LEU 75 12.131 11.643 -21.973 530 HA PRO 76 HA PRO 76 15.252 4.222 -19.825 531 HB2 PRO 76 HB2 PRO 76 17.777 4.755 -21.261 532 HB3 PRO 76 HB1 PRO 76 16.703 3.363 -21.438 533 HG2 PRO 76 HG2 PRO 76 16.926 5.182 -23.391 534 HG3 PRO 76 HG1 PRO 76 15.332 4.449 -22.972 535 HD2 PRO 76 HD2 PRO 76 16.441 7.151 -22.097 536 HD3 PRO 76 HD1 PRO 76 14.855 6.762 -22.801 537 HA PRO 77 HA PRO 77 17.533 5.714 -16.295 538 HB2 PRO 77 HB2 PRO 77 19.051 3.164 -16.807 539 HB3 PRO 77 HB1 PRO 77 18.487 3.824 -15.264 540 HG2 PRO 77 HG2 PRO 77 17.069 1.918 -16.358 541 HG3 PRO 77 HG1 PRO 77 16.240 3.375 -15.765 542 HD2 PRO 77 HD2 PRO 77 16.905 2.617 -18.610 543 HD3 PRO 77 HD1 PRO 77 15.413 3.375 -17.935 544 H GLY 78 HN GLY 78 19.051 7.204 -16.295 545 HA2 GLY 78 HA2 GLY 78 21.260 7.999 -16.602 546 HA3 GLY 78 HA1 GLY 78 21.500 6.804 -17.869 547 H TRP 79 HN TRP 79 18.922 7.534 -19.194 548 HA TRP 79 HA TRP 79 19.934 9.923 -20.606 549 HB2 TRP 79 HB2 TRP 79 17.683 7.977 -21.255 550 HB3 TRP 79 HB1 TRP 79 18.097 9.360 -22.247 551 HD1 TRP 79 HD1 TRP 79 19.479 5.924 -21.182 552 HE1 TRP 79 HE1 TRP 79 21.183 5.159 -22.947 553 HE3 TRP 79 HE3 TRP 79 19.649 10.166 -24.067 554 HZ2 TRP 79 HZ2 TRP 79 22.419 6.203 -25.259 555 HZ3 TRP 79 HZ3 TRP 79 21.113 10.179 -26.035 556 HH2 TRP 79 HH2 TRP 79 22.468 8.243 -26.620 557 H GLU 80 HN GLU 80 18.716 11.872 -20.684 558 HA GLU 80 HA GLU 80 16.051 11.806 -19.498 559 HB2 GLU 80 HB2 GLU 80 18.054 12.645 -17.915 560 HB3 GLU 80 HB1 GLU 80 17.711 14.151 -18.759 561 HG2 GLU 80 HG2 GLU 80 15.258 13.686 -18.152 562 HG3 GLU 80 HG1 GLU 80 15.918 12.549 -16.980 563 H MET 81 HN MET 81 14.811 13.744 -19.987 564 HA MET 81 HA MET 81 15.668 14.981 -22.512 565 HB2 MET 81 HB2 MET 81 13.949 13.208 -22.833 566 HB3 MET 81 HB1 MET 81 12.865 14.108 -21.747 567 HG2 MET 81 HG2 MET 81 13.965 15.331 -24.262 568 HG3 MET 81 HG1 MET 81 12.520 14.326 -24.269 569 HE1 MET 81 HE1 MET 81 10.992 17.861 -24.692 570 HE2 MET 81 HE2 MET 81 11.062 16.206 -25.303 571 HE3 MET 81 HE3 MET 81 12.485 17.244 -25.393 572 H LYS 82 HN LYS 82 15.430 17.181 -22.613 573 HA LYS 82 HA LYS 82 13.756 18.575 -20.692 574 HB2 LYS 82 HB2 LYS 82 16.738 19.127 -20.812 575 HB3 LYS 82 HB1 LYS 82 15.574 20.085 -19.930 576 HG2 LYS 82 HG2 LYS 82 15.139 18.193 -18.436 577 HG3 LYS 82 HG1 LYS 82 16.332 17.216 -19.354 578 HD2 LYS 82 HD2 LYS 82 18.069 18.868 -18.798 579 HD3 LYS 82 HD1 LYS 82 16.895 19.803 -17.874 580 HE2 LYS 82 HE2 LYS 82 17.779 16.977 -17.273 581 HE3 LYS 82 HE1 LYS 82 18.304 18.427 -16.422 582 HZ1 LYS 82 HZ1 LYS 82 16.631 17.519 -15.104 583 HZ2 LYS 82 HZ2 LYS 82 15.636 17.156 -16.422 584 HZ3 LYS 82 HZ3 LYS 82 15.840 18.773 -15.940 585 H TYR 83 HN TYR 83 13.430 20.813 -21.273 586 HA TYR 83 HA TYR 83 14.043 21.389 -24.104 587 HB2 TYR 83 HB2 TYR 83 11.933 22.516 -22.214 588 HB3 TYR 83 HB1 TYR 83 12.290 23.235 -23.804 589 HD1 TYR 83 HD1 TYR 83 11.679 22.065 -25.846 590 HD2 TYR 83 HD2 TYR 83 10.699 20.438 -22.034 591 HE1 TYR 83 HE1 TYR 83 10.055 20.558 -26.912 592 HE2 TYR 83 HE2 TYR 83 9.072 18.930 -23.099 593 HH TYR 83 HH TYR 83 7.751 18.772 -25.133 594 H THR 84 HN THR 84 15.063 23.326 -24.696 595 HA THR 84 HA THR 84 16.641 24.622 -22.658 596 HB THR 84 HB THR 84 17.634 25.945 -24.399 597 HG1 THR 84 HG1 THR 84 16.701 25.982 -26.531 598 HG21 THR 84 HG21 THR 84 17.001 23.215 -25.518 599 HG22 THR 84 HG22 THR 84 18.346 23.630 -24.454 600 HG23 THR 84 HG23 THR 84 18.282 24.285 -26.088 601 H SER 85 HN SER 85 16.638 27.245 -22.951 602 HA SER 85 HA SER 85 14.085 28.062 -21.931 603 HB2 SER 85 HB2 SER 85 15.337 30.367 -22.010 604 HB3 SER 85 HB1 SER 85 15.837 29.130 -20.855 605 HG SER 85 HG SER 85 17.624 30.005 -21.986 606 H GLU 86 HN GLU 86 14.655 27.310 -24.871 607 HA GLU 86 HA GLU 86 13.319 29.635 -26.140 608 HB2 GLU 86 HB2 GLU 86 15.729 29.345 -26.799 609 HB3 GLU 86 HB1 GLU 86 15.333 27.737 -27.387 610 HG2 GLU 86 HG2 GLU 86 13.873 28.670 -29.066 611 HG3 GLU 86 HG1 GLU 86 14.163 30.299 -28.446 612 H GLY 87 HN GLY 87 13.005 26.562 -25.069 613 HA2 GLY 87 HA2 GLY 87 11.244 25.087 -25.359 614 HA3 GLY 87 HA1 GLY 87 10.738 26.012 -26.763 615 H VAL 88 HN VAL 88 14.028 24.930 -26.617 616 HA VAL 88 HA VAL 88 13.463 23.119 -28.844 617 HB VAL 88 HB VAL 88 16.107 24.221 -27.877 618 HG11 VAL 88 HG11 VAL 88 15.450 22.573 -30.314 619 HG12 VAL 88 HG12 VAL 88 16.435 22.073 -28.939 620 HG13 VAL 88 HG13 VAL 88 17.001 23.357 -30.009 621 HG21 VAL 88 HG21 VAL 88 16.007 25.532 -29.981 622 HG22 VAL 88 HG22 VAL 88 14.753 25.963 -28.819 623 HG23 VAL 88 HG23 VAL 88 14.357 24.958 -30.214 624 H ARG 89 HN ARG 89 14.097 20.984 -28.880 625 HA ARG 89 HA ARG 89 14.189 19.696 -26.276 626 HB2 ARG 89 HB2 ARG 89 12.639 18.896 -27.980 627 HB3 ARG 89 HB1 ARG 89 13.959 18.631 -29.100 628 HG2 ARG 89 HG2 ARG 89 14.852 16.904 -27.543 629 HG3 ARG 89 HG1 ARG 89 13.386 17.098 -26.577 630 HD2 ARG 89 HD2 ARG 89 12.092 16.622 -28.701 631 HD3 ARG 89 HD1 ARG 89 13.628 16.143 -29.417 632 HE ARG 89 HE ARG 89 13.231 14.763 -26.992 633 HH11 ARG 89 HH11 ARG 89 12.159 14.835 -30.319 634 HH12 ARG 89 HH12 ARG 89 11.603 13.191 -30.313 635 HH21 ARG 89 HH21 ARG 89 12.493 12.572 -26.989 636 HH22 ARG 89 HH22 ARG 89 11.768 11.920 -28.423 637 H TYR 90 HN TYR 90 16.039 19.025 -25.329 638 HA TYR 90 HA TYR 90 18.159 18.058 -27.101 639 HB2 TYR 90 HB2 TYR 90 19.919 19.054 -25.750 640 HB3 TYR 90 HB1 TYR 90 18.843 20.294 -26.360 641 HD1 TYR 90 HD1 TYR 90 17.144 21.299 -24.729 642 HD2 TYR 90 HD2 TYR 90 20.404 18.881 -23.473 643 HE1 TYR 90 HE1 TYR 90 16.991 22.270 -22.470 644 HE2 TYR 90 HE2 TYR 90 20.252 19.837 -21.213 645 HH TYR 90 HH TYR 90 19.411 21.914 -20.153 646 H PHE 91 HN PHE 91 19.630 16.448 -26.033 647 HA PHE 91 HA PHE 91 18.149 15.035 -23.922 648 HB2 PHE 91 HB2 PHE 91 19.924 13.948 -26.111 649 HB3 PHE 91 HB1 PHE 91 19.435 13.005 -24.721 650 HD1 PHE 91 HD1 PHE 91 17.085 12.221 -24.460 651 HD2 PHE 91 HD2 PHE 91 18.341 14.553 -27.820 652 HE1 PHE 91 HE1 PHE 91 15.024 11.635 -25.650 653 HE2 PHE 91 HE2 PHE 91 16.269 13.956 -28.998 654 HZ PHE 91 HZ PHE 91 14.549 12.412 -27.750 655 H VAL 92 HN VAL 92 19.198 14.291 -22.141 656 HA VAL 92 HA VAL 92 21.938 15.321 -21.764 657 HB VAL 92 HB VAL 92 19.862 14.859 -19.615 658 HG11 VAL 92 HG11 VAL 92 21.389 16.177 -18.211 659 HG12 VAL 92 HG12 VAL 92 22.540 16.242 -19.544 660 HG13 VAL 92 HG13 VAL 92 22.141 14.693 -18.799 661 HG21 VAL 92 HG21 VAL 92 20.704 17.444 -20.912 662 HG22 VAL 92 HG22 VAL 92 19.661 17.302 -19.501 663 HG23 VAL 92 HG23 VAL 92 19.130 16.669 -21.057 664 H ASP 93 HN ASP 93 23.443 13.761 -21.559 665 HA ASP 93 HA ASP 93 22.601 11.071 -20.724 666 HB2 ASP 93 HB2 ASP 93 24.115 11.163 -22.640 667 HB3 ASP 93 HB1 ASP 93 25.288 12.099 -21.744 668 H HIS 94 HN HIS 94 22.650 10.613 -18.541 669 HA HIS 94 HA HIS 94 23.867 12.533 -16.751 670 HB2 HIS 94 HB2 HIS 94 22.092 10.149 -16.345 671 HB3 HIS 94 HB1 HIS 94 22.983 10.813 -14.990 672 HD1 HIS 94 HD1 HIS 94 22.158 12.942 -13.949 673 HD2 HIS 94 HD2 HIS 94 20.093 11.924 -17.420 674 HE1 HIS 94 HE1 HIS 94 20.172 14.486 -14.038 675 HE2 HIS 94 HE2 HIS 94 18.830 13.712 -16.025 676 H ASN 95 HN ASN 95 25.109 9.883 -18.313 677 HA ASN 95 HA ASN 95 26.716 9.049 -16.026 678 HB2 ASN 95 HB2 ASN 95 26.718 7.004 -17.032 679 HB3 ASN 95 HB1 ASN 95 25.663 7.691 -18.257 680 HD21 ASN 95 HD21 ASN 95 26.522 8.336 -20.225 681 HD22 ASN 95 HD22 ASN 95 28.076 7.772 -20.760 682 H THR 96 HN THR 96 27.130 10.687 -19.153 683 HA THR 96 HA THR 96 29.924 11.179 -18.408 684 HB THR 96 HB THR 96 30.188 11.922 -20.794 685 HG1 THR 96 HG1 THR 96 28.322 12.302 -21.759 686 HG21 THR 96 HG21 THR 96 29.081 9.136 -20.468 687 HG22 THR 96 HG22 THR 96 30.730 9.616 -20.060 688 HG23 THR 96 HG23 THR 96 30.174 9.688 -21.735 689 H ARG 97 HN ARG 97 26.906 12.632 -18.325 690 HA ARG 97 HA ARG 97 26.171 14.714 -17.722 691 HB2 ARG 97 HB2 ARG 97 29.085 15.219 -17.110 692 HB3 ARG 97 HB1 ARG 97 27.742 16.247 -16.614 693 HG2 ARG 97 HG2 ARG 97 26.792 14.332 -15.375 694 HG3 ARG 97 HG1 ARG 97 28.222 13.401 -15.820 695 HD2 ARG 97 HD2 ARG 97 28.328 14.394 -13.529 696 HD3 ARG 97 HD1 ARG 97 29.651 14.886 -14.586 697 HE ARG 97 HE ARG 97 28.298 16.978 -14.961 698 HH11 ARG 97 HH11 ARG 97 27.954 15.101 -12.015 699 HH12 ARG 97 HH12 ARG 97 27.476 16.468 -11.054 700 HH21 ARG 97 HH21 ARG 97 27.702 18.777 -13.671 701 HH22 ARG 97 HH22 ARG 97 27.347 18.543 -11.990 702 H THR 98 HN THR 98 26.976 14.087 -20.318 703 HA THR 98 HA THR 98 27.735 16.677 -21.476 704 HB THR 98 HB THR 98 27.818 15.270 -23.638 705 HG1 THR 98 HG1 THR 98 26.643 13.495 -22.663 706 HG21 THR 98 HG21 THR 98 29.865 16.004 -22.485 707 HG22 THR 98 HG22 THR 98 30.060 14.358 -23.094 708 HG23 THR 98 HG23 THR 98 29.738 14.633 -21.383 709 H THR 99 HN THR 99 26.445 17.535 -23.287 710 HA THR 99 HA THR 99 23.636 16.608 -23.219 711 HB THR 99 HB THR 99 23.242 19.001 -24.209 712 HG1 THR 99 HG1 THR 99 24.944 20.454 -23.287 713 HG21 THR 99 HG21 THR 99 22.510 18.380 -21.927 714 HG22 THR 99 HG22 THR 99 23.212 20.000 -21.905 715 HG23 THR 99 HG23 THR 99 24.148 18.625 -21.322 716 H THR 100 HN THR 100 23.344 15.283 -25.006 717 HA THR 100 HA THR 100 24.732 15.988 -27.480 718 HB THR 100 HB THR 100 24.855 13.596 -26.559 719 HG1 THR 100 HG1 THR 100 25.513 13.543 -28.580 720 HG21 THR 100 HG21 THR 100 22.017 13.573 -27.595 721 HG22 THR 100 HG22 THR 100 22.565 13.155 -25.971 722 HG23 THR 100 HG23 THR 100 22.982 12.120 -27.333 723 H PHE 101 HN PHE 101 23.608 16.215 -29.431 724 HA PHE 101 HA PHE 101 20.747 16.817 -29.092 725 HB2 PHE 101 HB2 PHE 101 22.441 18.754 -29.580 726 HB3 PHE 101 HB1 PHE 101 22.414 18.080 -31.268 727 HD1 PHE 101 HD1 PHE 101 20.050 17.760 -32.303 728 HD2 PHE 101 HD2 PHE 101 20.847 20.258 -28.955 729 HE1 PHE 101 HE1 PHE 101 17.939 18.960 -32.700 730 HE2 PHE 101 HE2 PHE 101 18.730 21.450 -29.331 731 HZ PHE 101 HZ PHE 101 17.277 20.811 -31.212 732 H LYS 102 HN LYS 102 19.674 15.153 -29.971 733 HA LYS 102 HA LYS 102 20.417 14.353 -32.693 734 HB2 LYS 102 HB2 LYS 102 21.162 12.654 -30.941 735 HB3 LYS 102 HB1 LYS 102 19.455 12.361 -30.636 736 HG2 LYS 102 HG2 LYS 102 19.233 11.856 -33.101 737 HG3 LYS 102 HG1 LYS 102 20.996 11.871 -33.168 738 HD2 LYS 102 HD2 LYS 102 20.348 9.609 -32.901 739 HD3 LYS 102 HD1 LYS 102 20.963 10.139 -31.334 740 HE2 LYS 102 HE2 LYS 102 18.734 10.403 -30.485 741 HE3 LYS 102 HE1 LYS 102 18.045 10.096 -32.080 742 HZ1 LYS 102 HZ1 LYS 102 19.064 7.847 -31.961 743 HZ2 LYS 102 HZ2 LYS 102 17.851 8.114 -30.808 744 HZ3 LYS 102 HZ3 LYS 102 19.479 8.161 -30.343 745 H ASP 103 HN ASP 103 18.785 15.349 -33.714 746 HA ASP 103 HA ASP 103 16.052 14.553 -32.932 747 HB2 ASP 103 HB2 ASP 103 16.528 17.032 -32.773 748 HB3 ASP 103 HB1 ASP 103 16.818 17.023 -34.511 749 HA PRO 104 HA PRO 104 16.062 12.239 -36.697 750 HB2 PRO 104 HB2 PRO 104 13.331 12.238 -37.141 751 HB3 PRO 104 HB1 PRO 104 14.149 11.134 -36.031 752 HG2 PRO 104 HG2 PRO 104 12.707 13.691 -35.442 753 HG3 PRO 104 HG1 PRO 104 12.697 12.160 -34.546 754 HD2 PRO 104 HD2 PRO 104 14.146 14.244 -33.710 755 HD3 PRO 104 HD1 PRO 104 14.746 12.579 -33.556 756 H ARG 105 HN ARG 105 14.733 15.464 -36.522 757 HA ARG 105 HA ARG 105 14.667 15.547 -39.465 758 HB2 ARG 105 HB2 ARG 105 13.411 17.470 -37.498 759 HB3 ARG 105 HB1 ARG 105 13.360 17.635 -39.244 760 HG2 ARG 105 HG2 ARG 105 11.266 16.761 -38.637 761 HG3 ARG 105 HG1 ARG 105 12.169 15.394 -39.300 762 HD2 ARG 105 HD2 ARG 105 12.767 14.769 -36.947 763 HD3 ARG 105 HD1 ARG 105 11.668 16.028 -36.391 764 HE ARG 105 HE ARG 105 10.672 13.860 -38.100 765 HH11 ARG 105 HH11 ARG 105 10.663 15.652 -35.101 766 HH12 ARG 105 HH12 ARG 105 9.270 14.827 -34.450 767 HH21 ARG 105 HH21 ARG 105 8.843 12.739 -37.240 768 HH22 ARG 105 HH22 ARG 105 8.255 13.152 -35.657 769 HA PRO 106 HA PRO 106 18.549 17.679 -38.704 770 HB2 PRO 106 HB2 PRO 106 19.315 18.036 -41.287 771 HB3 PRO 106 HB1 PRO 106 19.458 16.452 -40.435 772 HG2 PRO 106 HG2 PRO 106 17.394 17.392 -42.394 773 HG3 PRO 106 HG1 PRO 106 18.155 15.800 -42.229 774 HD2 PRO 106 HD2 PRO 106 15.651 16.421 -41.305 775 HD3 PRO 106 HD1 PRO 106 16.687 15.123 -40.617 776 H GLY 107 HN GLY 107 18.850 19.768 -38.281 777 HA2 GLY 107 HA2 GLY 107 18.849 22.054 -38.605 778 HA3 GLY 107 HA1 GLY 107 17.959 21.810 -40.124 779 H PHE 108 HN PHE 108 15.938 20.158 -38.481 780 HA PHE 108 HA PHE 108 13.731 20.643 -37.948 781 HB2 PHE 108 HB2 PHE 108 13.579 21.742 -35.630 782 HB3 PHE 108 HB1 PHE 108 14.536 20.225 -35.748 783 HD1 PHE 108 HD1 PHE 108 16.961 20.293 -35.443 784 HD2 PHE 108 HD2 PHE 108 14.624 23.844 -35.140 785 HE1 PHE 108 HE1 PHE 108 18.843 21.439 -34.357 786 HE2 PHE 108 HE2 PHE 108 16.509 24.990 -34.058 787 HZ PHE 108 HZ PHE 108 18.627 23.786 -33.667 788 H GLU 109 HN GLU 109 14.433 22.356 -39.915 789 HA GLU 109 HA GLU 109 12.869 24.725 -39.225 790 HB2 GLU 109 HB2 GLU 109 15.287 25.371 -39.123 791 HB3 GLU 109 HB1 GLU 109 15.462 24.883 -40.801 792 HG2 GLU 109 HG2 GLU 109 15.251 27.272 -40.663 793 HG3 GLU 109 HG1 GLU 109 13.829 26.599 -41.455 Start of MODEL 12 1 H1 GLY 1 HT1 GLY 1 -42.576 7.068 -3.530 2 H2 GLY 1 HT2 GLY 1 -42.588 6.702 -5.187 3 H3 GLY 1 HT3 GLY 1 -42.048 8.217 -4.658 4 HA2 GLY 1 HA1 GLY 1 -40.727 5.626 -4.097 5 HA3 GLY 1 HA2 GLY 1 -40.181 6.821 -5.269 6 H SER 2 HN SER 2 -40.293 5.908 -1.952 7 HA SER 2 HA SER 2 -39.149 8.439 -1.069 8 HB2 SER 2 HB2 SER 2 -39.317 7.325 1.218 9 HB3 SER 2 HB1 SER 2 -40.846 7.612 0.382 10 HG SER 2 HG SER 2 -40.936 5.526 1.097 11 H HIS 3 HN HIS 3 -38.357 5.009 -0.466 12 HA HIS 3 HA HIS 3 -35.742 5.507 0.349 13 HB2 HIS 3 HB2 HIS 3 -35.340 3.054 -0.046 14 HB3 HIS 3 HB1 HIS 3 -36.764 3.395 0.922 15 HD1 HIS 3 HD1 HIS 3 -37.162 0.794 0.097 16 HD2 HIS 3 HD2 HIS 3 -37.746 3.826 -2.708 17 HE1 HIS 3 HE1 HIS 3 -38.566 -0.223 -1.731 18 HE2 HIS 3 HE2 HIS 3 -38.902 1.614 -3.419 19 H MET 4 HN MET 4 -33.700 5.329 -0.711 20 HA MET 4 HA MET 4 -33.864 5.547 -3.640 21 HB2 MET 4 HB2 MET 4 -31.817 6.853 -1.822 22 HB3 MET 4 HB1 MET 4 -31.914 7.028 -3.567 23 HG2 MET 4 HG2 MET 4 -34.100 8.112 -3.329 24 HG3 MET 4 HG1 MET 4 -33.968 7.965 -1.577 25 HE1 MET 4 HE1 MET 4 -31.101 10.530 -4.128 26 HE2 MET 4 HE2 MET 4 -32.534 9.758 -4.808 27 HE3 MET 4 HE3 MET 4 -31.202 8.771 -4.207 28 H GLN 5 HN GLN 5 -32.520 4.284 -4.837 29 HA GLN 5 HA GLN 5 -31.340 2.039 -3.545 30 HB2 GLN 5 HB2 GLN 5 -32.398 1.768 -5.698 31 HB3 GLN 5 HB1 GLN 5 -31.325 2.952 -6.424 32 HG2 GLN 5 HG2 GLN 5 -29.423 1.399 -5.896 33 HG3 GLN 5 HG1 GLN 5 -30.631 0.186 -5.465 34 HE21 GLN 5 HE21 GLN 5 -31.941 -0.697 -7.089 35 HE22 GLN 5 HE22 GLN 5 -31.520 -0.552 -8.790 36 H TYR 6 HN TYR 6 -29.426 2.041 -2.592 37 HA TYR 6 HA TYR 6 -27.280 3.692 -3.771 38 HB2 TYR 6 HB2 TYR 6 -27.750 2.851 -0.885 39 HB3 TYR 6 HB1 TYR 6 -26.152 3.343 -1.428 40 HD1 TYR 6 HD1 TYR 6 -25.730 5.690 -2.037 41 HD2 TYR 6 HD2 TYR 6 -29.545 4.435 -0.627 42 HE1 TYR 6 HE1 TYR 6 -26.362 8.038 -1.663 43 HE2 TYR 6 HE2 TYR 6 -30.178 6.777 -0.246 44 HH TYR 6 HH TYR 6 -29.154 8.938 0.102 45 H LYS 7 HN LYS 7 -25.277 2.668 -4.168 46 HA LYS 7 HA LYS 7 -25.436 -0.265 -4.023 47 HB2 LYS 7 HB2 LYS 7 -23.724 1.149 -6.034 48 HB3 LYS 7 HB1 LYS 7 -24.439 -0.474 -6.160 49 HG2 LYS 7 HG2 LYS 7 -26.672 0.857 -6.180 50 HG3 LYS 7 HG1 LYS 7 -25.641 2.210 -6.643 51 HD2 LYS 7 HD2 LYS 7 -24.777 0.870 -8.519 52 HD3 LYS 7 HD1 LYS 7 -25.897 -0.424 -8.078 53 HE2 LYS 7 HE2 LYS 7 -27.738 1.329 -8.299 54 HE3 LYS 7 HE1 LYS 7 -26.532 2.337 -9.094 55 HZ1 LYS 7 HZ1 LYS 7 -26.251 0.591 -10.764 56 HZ2 LYS 7 HZ2 LYS 7 -27.856 1.125 -10.694 57 HZ3 LYS 7 HZ3 LYS 7 -27.428 -0.355 -9.987 58 H LEU 8 HN LEU 8 -23.407 -1.404 -4.023 59 HA LEU 8 HA LEU 8 -21.129 0.106 -2.966 60 HB2 LEU 8 HB2 LEU 8 -22.501 -0.680 -0.999 61 HB3 LEU 8 HB1 LEU 8 -22.208 -2.317 -1.536 62 HG LEU 8 HG LEU 8 -19.749 -1.853 -1.277 63 HD11 LEU 8 HD11 LEU 8 -19.294 -0.019 0.442 64 HD12 LEU 8 HD12 LEU 8 -20.844 0.665 -0.047 65 HD13 LEU 8 HD13 LEU 8 -19.545 0.484 -1.225 66 HD21 LEU 8 HD21 LEU 8 -21.690 -1.869 0.987 67 HD22 LEU 8 HD22 LEU 8 -19.949 -1.965 1.251 68 HD23 LEU 8 HD23 LEU 8 -20.769 -3.212 0.309 69 H ILE 9 HN ILE 9 -19.322 -0.560 -3.930 70 HA ILE 9 HA ILE 9 -19.179 -3.334 -4.863 71 HB ILE 9 HB ILE 9 -17.991 -0.841 -6.064 72 HG12 ILE 9 HG12 ILE 9 -18.907 -1.586 -8.095 73 HG13 ILE 9 HG11 ILE 9 -19.231 -3.233 -7.512 74 HG21 ILE 9 HG21 ILE 9 -16.992 -3.648 -6.524 75 HG22 ILE 9 HG22 ILE 9 -16.103 -2.329 -5.767 76 HG23 ILE 9 HG23 ILE 9 -16.535 -2.234 -7.474 77 HD11 ILE 9 HD11 ILE 9 -21.003 -2.283 -6.071 78 HD12 ILE 9 HD12 ILE 9 -21.276 -1.926 -7.779 79 HD13 ILE 9 HD13 ILE 9 -20.656 -0.673 -6.702 80 H LEU 10 HN LEU 10 -17.795 -4.611 -3.796 81 HA LEU 10 HA LEU 10 -15.954 -3.311 -1.927 82 HB2 LEU 10 HB2 LEU 10 -16.709 -6.233 -2.057 83 HB3 LEU 10 HB1 LEU 10 -15.655 -5.511 -0.876 84 HG LEU 10 HG LEU 10 -17.604 -5.810 0.286 85 HD11 LEU 10 HD11 LEU 10 -18.569 -3.686 0.747 86 HD12 LEU 10 HD12 LEU 10 -17.936 -3.032 -0.760 87 HD13 LEU 10 HD13 LEU 10 -16.826 -3.536 0.522 88 HD21 LEU 10 HD21 LEU 10 -18.956 -6.477 -1.682 89 HD22 LEU 10 HD22 LEU 10 -19.256 -4.767 -2.001 90 HD23 LEU 10 HD23 LEU 10 -19.832 -5.501 -0.506 91 H ASN 11 HN ASN 11 -14.038 -2.892 -2.725 92 HA ASN 11 HA ASN 11 -12.885 -4.744 -4.704 93 HB2 ASN 11 HB2 ASN 11 -13.160 -2.209 -5.160 94 HB3 ASN 11 HB1 ASN 11 -11.832 -1.996 -4.030 95 HD21 ASN 11 HD21 ASN 11 -12.034 -1.414 -6.901 96 HD22 ASN 11 HD22 ASN 11 -10.745 -2.290 -7.648 97 H GLY 12 HN GLY 12 -12.183 -6.273 -3.243 98 HA2 GLY 12 HA2 GLY 12 -9.754 -5.487 -1.782 99 HA3 GLY 12 HA1 GLY 12 -10.981 -6.478 -0.960 100 H LYS 13 HN LYS 13 -8.113 -6.728 -2.307 101 HA LYS 13 HA LYS 13 -8.011 -8.550 -4.304 102 HB2 LYS 13 HB2 LYS 13 -6.155 -8.456 -1.919 103 HB3 LYS 13 HB1 LYS 13 -5.785 -9.170 -3.482 104 HG2 LYS 13 HG2 LYS 13 -6.027 -6.946 -4.517 105 HG3 LYS 13 HG1 LYS 13 -6.299 -6.258 -2.914 106 HD2 LYS 13 HD2 LYS 13 -4.093 -7.059 -2.208 107 HD3 LYS 13 HD1 LYS 13 -3.829 -7.733 -3.818 108 HE2 LYS 13 HE2 LYS 13 -4.113 -5.444 -4.750 109 HE3 LYS 13 HE1 LYS 13 -4.179 -4.828 -3.099 110 HZ1 LYS 13 HZ1 LYS 13 -1.954 -4.664 -4.118 111 HZ2 LYS 13 HZ2 LYS 13 -1.896 -6.352 -4.238 112 HZ3 LYS 13 HZ3 LYS 13 -1.954 -5.613 -2.713 113 H THR 14 HN THR 14 -8.791 -9.276 -0.960 114 HA THR 14 HA THR 14 -8.595 -12.149 -1.520 115 HB THR 14 HB THR 14 -9.270 -12.314 0.952 116 HG1 THR 14 HG1 THR 14 -8.316 -10.041 1.791 117 HG21 THR 14 HG21 THR 14 -6.665 -10.986 0.188 118 HG22 THR 14 HG22 THR 14 -6.997 -12.720 0.163 119 HG23 THR 14 HG23 THR 14 -6.970 -11.846 1.694 120 H LEU 15 HN LEU 15 -10.990 -9.719 -0.580 121 HA LEU 15 HA LEU 15 -13.093 -11.579 -1.434 122 HB2 LEU 15 HB2 LEU 15 -12.962 -11.408 1.057 123 HB3 LEU 15 HB1 LEU 15 -13.176 -9.682 0.924 124 HG LEU 15 HG LEU 15 -15.172 -11.233 1.577 125 HD11 LEU 15 HD11 LEU 15 -16.721 -9.598 0.431 126 HD12 LEU 15 HD12 LEU 15 -15.279 -8.890 -0.302 127 HD13 LEU 15 HD13 LEU 15 -15.467 -8.892 1.454 128 HD21 LEU 15 HD21 LEU 15 -15.028 -12.701 -0.346 129 HD22 LEU 15 HD22 LEU 15 -15.246 -11.327 -1.428 130 HD23 LEU 15 HD23 LEU 15 -16.555 -11.818 -0.356 131 H LYS 16 HN LYS 16 -13.833 -10.735 -3.289 132 HA LYS 16 HA LYS 16 -14.386 -7.843 -3.352 133 HB2 LYS 16 HB2 LYS 16 -14.266 -9.543 -5.835 134 HB3 LYS 16 HB1 LYS 16 -14.110 -7.803 -5.713 135 HG2 LYS 16 HG2 LYS 16 -11.977 -8.382 -6.185 136 HG3 LYS 16 HG1 LYS 16 -11.870 -8.444 -4.415 137 HD2 LYS 16 HD2 LYS 16 -12.340 -10.876 -4.570 138 HD3 LYS 16 HD1 LYS 16 -12.354 -10.702 -6.322 139 HE2 LYS 16 HE2 LYS 16 -9.983 -9.920 -4.679 140 HE3 LYS 16 HE1 LYS 16 -10.211 -11.564 -5.268 141 HZ1 LYS 16 HZ1 LYS 16 -10.307 -10.671 -7.537 142 HZ2 LYS 16 HZ2 LYS 16 -8.833 -10.330 -6.779 143 HZ3 LYS 16 HZ3 LYS 16 -9.999 -9.110 -6.940 144 H GLY 17 HN GLY 17 -16.392 -7.250 -4.503 145 HA2 GLY 17 HA2 GLY 17 -18.390 -9.040 -5.194 146 HA3 GLY 17 HA1 GLY 17 -18.559 -8.754 -3.467 147 H GLU 18 HN GLU 18 -20.680 -7.989 -4.433 148 HA GLU 18 HA GLU 18 -20.709 -5.150 -4.320 149 HB2 GLU 18 HB2 GLU 18 -21.918 -4.958 -6.620 150 HB3 GLU 18 HB1 GLU 18 -20.161 -4.991 -6.577 151 HG2 GLU 18 HG2 GLU 18 -20.109 -7.264 -7.269 152 HG3 GLU 18 HG1 GLU 18 -21.852 -7.426 -7.084 153 H THR 19 HN THR 19 -22.817 -4.277 -4.150 154 HA THR 19 HA THR 19 -25.120 -5.977 -4.211 155 HB THR 19 HB THR 19 -24.045 -6.838 -2.150 156 HG1 THR 19 HG1 THR 19 -25.921 -6.428 -0.771 157 HG21 THR 19 HG21 THR 19 -24.424 -3.998 -1.139 158 HG22 THR 19 HG22 THR 19 -22.878 -4.792 -1.432 159 HG23 THR 19 HG23 THR 19 -23.935 -5.372 -0.142 160 H THR 20 HN THR 20 -26.942 -4.766 -2.784 161 HA THR 20 HA THR 20 -26.700 -1.881 -3.157 162 HB THR 20 HB THR 20 -28.992 -1.833 -4.192 163 HG1 THR 20 HG1 THR 20 -28.783 -4.386 -5.195 164 HG21 THR 20 HG21 THR 20 -28.229 -2.561 -6.480 165 HG22 THR 20 HG22 THR 20 -26.759 -3.179 -5.722 166 HG23 THR 20 HG23 THR 20 -27.125 -1.456 -5.662 167 H THR 21 HN THR 21 -28.400 -0.661 -2.065 168 HA THR 21 HA THR 21 -30.097 -2.117 -0.215 169 HB THR 21 HB THR 21 -27.881 -1.750 1.020 170 HG1 THR 21 HG1 THR 21 -29.367 -2.083 2.499 171 HG21 THR 21 HG21 THR 21 -27.644 0.548 2.024 172 HG22 THR 21 HG22 THR 21 -28.893 1.117 0.917 173 HG23 THR 21 HG23 THR 21 -27.358 0.529 0.278 174 H GLU 22 HN GLU 22 -31.690 -0.730 0.806 175 HA GLU 22 HA GLU 22 -32.260 1.621 -0.878 176 HB2 GLU 22 HB2 GLU 22 -34.637 1.247 -0.133 177 HB3 GLU 22 HB1 GLU 22 -33.995 -0.117 -1.047 178 HG2 GLU 22 HG2 GLU 22 -33.577 -1.331 1.032 179 HG3 GLU 22 HG1 GLU 22 -34.253 0.059 1.963 180 H ALA 23 HN ALA 23 -31.656 3.464 0.108 181 HA ALA 23 HA ALA 23 -32.432 3.841 2.936 182 HB1 ALA 23 HB1 ALA 23 -29.682 4.490 1.824 183 HB2 ALA 23 HB2 ALA 23 -30.060 3.197 2.963 184 HB3 ALA 23 HB3 ALA 23 -30.255 4.882 3.444 185 H VAL 24 HN VAL 24 -32.550 6.195 3.511 186 HA VAL 24 HA VAL 24 -33.090 7.796 1.109 187 HB VAL 24 HB VAL 24 -34.505 9.210 2.578 188 HG11 VAL 24 HG11 VAL 24 -35.500 7.448 1.231 189 HG12 VAL 24 HG12 VAL 24 -36.347 7.607 2.769 190 HG13 VAL 24 HG13 VAL 24 -35.212 6.281 2.522 191 HG21 VAL 24 HG21 VAL 24 -33.981 7.055 4.621 192 HG22 VAL 24 HG22 VAL 24 -35.156 8.362 4.781 193 HG23 VAL 24 HG23 VAL 24 -33.432 8.728 4.713 194 H ASP 25 HN ASP 25 -30.531 7.421 2.932 195 HA ASP 25 HA ASP 25 -29.809 10.231 2.840 196 HB2 ASP 25 HB2 ASP 25 -29.659 8.598 5.376 197 HB3 ASP 25 HB1 ASP 25 -28.726 10.066 5.126 198 H ALA 26 HN ALA 26 -27.617 10.555 2.451 199 HA ALA 26 HA ALA 26 -26.078 8.431 1.455 200 HB1 ALA 26 HB1 ALA 26 -25.180 11.162 2.386 201 HB2 ALA 26 HB2 ALA 26 -25.752 10.760 0.766 202 HB3 ALA 26 HB3 ALA 26 -24.246 10.064 1.369 203 H ALA 27 HN ALA 27 -25.986 10.156 4.551 204 HA ALA 27 HA ALA 27 -23.753 8.841 5.635 205 HB1 ALA 27 HB1 ALA 27 -24.567 9.614 7.811 206 HB2 ALA 27 HB2 ALA 27 -26.119 10.030 7.079 207 HB3 ALA 27 HB3 ALA 27 -24.658 10.887 6.594 208 H THR 28 HN THR 28 -27.196 8.041 5.702 209 HA THR 28 HA THR 28 -26.977 5.846 7.483 210 HB THR 28 HB THR 28 -29.069 6.197 5.317 211 HG1 THR 28 HG1 THR 28 -30.211 7.359 6.901 212 HG21 THR 28 HG21 THR 28 -29.037 3.978 6.404 213 HG22 THR 28 HG22 THR 28 -30.483 4.892 6.833 214 HG23 THR 28 HG23 THR 28 -29.150 4.762 7.980 215 H ALA 29 HN ALA 29 -26.495 6.148 4.012 216 HA ALA 29 HA ALA 29 -26.609 3.340 3.450 217 HB1 ALA 29 HB1 ALA 29 -26.996 5.029 1.706 218 HB2 ALA 29 HB2 ALA 29 -25.664 3.955 1.278 219 HB3 ALA 29 HB3 ALA 29 -25.330 5.581 1.874 220 H GLU 30 HN GLU 30 -24.172 5.709 4.237 221 HA GLU 30 HA GLU 30 -21.887 4.087 3.943 222 HB2 GLU 30 HB2 GLU 30 -22.151 6.681 4.304 223 HB3 GLU 30 HB1 GLU 30 -22.117 6.248 6.004 224 HG2 GLU 30 HG2 GLU 30 -19.947 5.047 5.540 225 HG3 GLU 30 HG1 GLU 30 -19.970 5.847 3.968 226 H LYS 31 HN LYS 31 -23.679 5.084 6.856 227 HA LYS 31 HA LYS 31 -22.309 3.689 8.759 228 HB2 LYS 31 HB2 LYS 31 -25.266 4.259 8.717 229 HB3 LYS 31 HB1 LYS 31 -24.377 3.749 10.133 230 HG2 LYS 31 HG2 LYS 31 -23.160 5.760 10.187 231 HG3 LYS 31 HG1 LYS 31 -23.716 6.233 8.585 232 HD2 LYS 31 HD2 LYS 31 -24.921 7.490 10.256 233 HD3 LYS 31 HD1 LYS 31 -26.019 6.349 9.479 234 HE2 LYS 31 HE2 LYS 31 -26.397 6.355 11.866 235 HE3 LYS 31 HE1 LYS 31 -25.728 4.803 11.368 236 HZ1 LYS 31 HZ1 LYS 31 -24.727 5.694 13.416 237 HZ2 LYS 31 HZ2 LYS 31 -24.131 7.020 12.540 238 HZ3 LYS 31 HZ3 LYS 31 -23.590 5.453 12.182 239 H VAL 32 HN VAL 32 -25.034 2.399 6.849 240 HA VAL 32 HA VAL 32 -25.121 -0.060 8.326 241 HB VAL 32 HB VAL 32 -26.325 0.626 5.638 242 HG11 VAL 32 HG11 VAL 32 -26.893 -1.689 7.493 243 HG12 VAL 32 HG12 VAL 32 -26.106 -1.785 5.918 244 HG13 VAL 32 HG13 VAL 32 -27.796 -1.299 6.029 245 HG21 VAL 32 HG21 VAL 32 -27.567 0.586 8.383 246 HG22 VAL 32 HG22 VAL 32 -28.406 0.917 6.868 247 HG23 VAL 32 HG23 VAL 32 -27.167 2.029 7.452 248 H PHE 33 HN PHE 33 -23.864 0.911 5.144 249 HA PHE 33 HA PHE 33 -22.942 -1.710 4.495 250 HB2 PHE 33 HB2 PHE 33 -22.565 1.000 3.316 251 HB3 PHE 33 HB1 PHE 33 -21.456 -0.267 2.854 252 HD1 PHE 33 HD1 PHE 33 -23.561 -2.522 2.969 253 HD2 PHE 33 HD2 PHE 33 -23.532 1.345 1.203 254 HE1 PHE 33 HE1 PHE 33 -25.148 -3.295 1.254 255 HE2 PHE 33 HE2 PHE 33 -25.124 0.588 -0.509 256 HZ PHE 33 HZ PHE 33 -25.939 -1.742 -0.491 257 H LYS 34 HN LYS 34 -21.545 0.915 6.338 258 HA LYS 34 HA LYS 34 -18.863 0.089 6.125 259 HB2 LYS 34 HB2 LYS 34 -20.355 1.732 8.143 260 HB3 LYS 34 HB1 LYS 34 -18.680 1.342 8.397 261 HG2 LYS 34 HG2 LYS 34 -18.321 2.351 6.049 262 HG3 LYS 34 HG1 LYS 34 -19.917 3.065 6.291 263 HD2 LYS 34 HD2 LYS 34 -18.344 4.701 7.043 264 HD3 LYS 34 HD1 LYS 34 -19.061 3.974 8.484 265 HE2 LYS 34 HE2 LYS 34 -17.108 2.446 8.625 266 HE3 LYS 34 HE1 LYS 34 -16.377 3.314 7.276 267 HZ1 LYS 34 HZ1 LYS 34 -17.074 4.453 9.926 268 HZ2 LYS 34 HZ2 LYS 34 -16.430 5.334 8.626 269 HZ3 LYS 34 HZ3 LYS 34 -15.513 4.110 9.357 270 H GLN 35 HN GLN 35 -21.367 -0.649 8.525 271 HA GLN 35 HA GLN 35 -19.768 -2.358 10.085 272 HB2 GLN 35 HB2 GLN 35 -22.008 -1.289 10.731 273 HB3 GLN 35 HB1 GLN 35 -22.797 -2.468 9.713 274 HG2 GLN 35 HG2 GLN 35 -21.195 -3.160 12.192 275 HG3 GLN 35 HG1 GLN 35 -22.931 -2.951 12.125 276 HE21 GLN 35 HE21 GLN 35 -23.322 -4.231 9.591 277 HE22 GLN 35 HE22 GLN 35 -23.067 -5.920 9.848 278 H TYR 36 HN TYR 36 -21.647 -2.728 7.192 279 HA TYR 36 HA TYR 36 -21.676 -5.545 6.986 280 HB2 TYR 36 HB2 TYR 36 -23.195 -4.267 5.646 281 HB3 TYR 36 HB1 TYR 36 -21.890 -3.303 4.981 282 HD1 TYR 36 HD1 TYR 36 -23.324 -6.754 4.958 283 HD2 TYR 36 HD2 TYR 36 -20.833 -3.904 3.029 284 HE1 TYR 36 HE1 TYR 36 -23.190 -8.213 2.979 285 HE2 TYR 36 HE2 TYR 36 -20.691 -5.341 1.046 286 HH TYR 36 HH TYR 36 -22.730 -8.049 0.601 287 H ALA 37 HN ALA 37 -19.597 -3.105 5.448 288 HA ALA 37 HA ALA 37 -17.835 -4.951 4.234 289 HB1 ALA 37 HB1 ALA 37 -16.428 -2.994 3.803 290 HB2 ALA 37 HB2 ALA 37 -17.367 -2.054 4.963 291 HB3 ALA 37 HB3 ALA 37 -18.124 -2.628 3.480 292 H ASN 38 HN ASN 38 -17.768 -3.197 7.275 293 HA ASN 38 HA ASN 38 -15.130 -3.812 8.042 294 HB2 ASN 38 HB2 ASN 38 -16.615 -2.033 9.112 295 HB3 ASN 38 HB1 ASN 38 -17.498 -3.337 9.897 296 HD21 ASN 38 HD21 ASN 38 -14.693 -1.312 10.043 297 HD22 ASN 38 HD22 ASN 38 -13.985 -2.044 11.500 298 H ASP 39 HN ASP 39 -18.162 -5.546 8.410 299 HA ASP 39 HA ASP 39 -17.219 -7.522 10.191 300 HB2 ASP 39 HB2 ASP 39 -19.631 -7.055 9.707 301 HB3 ASP 39 HB1 ASP 39 -19.416 -7.813 8.129 302 H ASN 40 HN ASN 40 -17.281 -7.326 6.650 303 HA ASN 40 HA ASN 40 -16.212 -9.959 6.273 304 HB2 ASN 40 HB2 ASN 40 -16.246 -7.634 4.327 305 HB3 ASN 40 HB1 ASN 40 -16.030 -9.329 3.928 306 HD21 ASN 40 HD21 ASN 40 -18.032 -7.254 3.206 307 HD22 ASN 40 HD22 ASN 40 -19.572 -8.028 3.556 308 H GLY 41 HN GLY 41 -14.886 -7.058 7.305 309 HA2 GLY 41 HA2 GLY 41 -12.655 -6.788 7.990 310 HA3 GLY 41 HA1 GLY 41 -12.181 -8.074 6.891 311 H VAL 42 HN VAL 42 -14.238 -5.838 5.385 312 HA VAL 42 HA VAL 42 -11.953 -4.731 3.970 313 HB VAL 42 HB VAL 42 -14.885 -4.601 3.232 314 HG11 VAL 42 HG11 VAL 42 -14.062 -3.897 1.049 315 HG12 VAL 42 HG12 VAL 42 -12.396 -4.048 1.605 316 HG13 VAL 42 HG13 VAL 42 -13.442 -2.809 2.295 317 HG21 VAL 42 HG21 VAL 42 -14.207 -6.322 1.535 318 HG22 VAL 42 HG22 VAL 42 -14.201 -6.882 3.210 319 HG23 VAL 42 HG23 VAL 42 -12.680 -6.477 2.407 320 H ASP 43 HN ASP 43 -11.217 -3.083 5.052 321 HA ASP 43 HA ASP 43 -13.036 -0.816 5.502 322 HB2 ASP 43 HB2 ASP 43 -12.317 -1.975 7.669 323 HB3 ASP 43 HB1 ASP 43 -10.690 -1.391 7.324 324 H GLY 44 HN GLY 44 -12.436 0.480 3.815 325 HA2 GLY 44 HA2 GLY 44 -9.637 1.292 3.679 326 HA3 GLY 44 HA1 GLY 44 -10.351 0.606 2.225 327 H GLU 45 HN GLU 45 -9.665 2.835 1.485 328 HA GLU 45 HA GLU 45 -11.079 5.124 2.363 329 HB2 GLU 45 HB2 GLU 45 -9.142 4.480 0.305 330 HB3 GLU 45 HB1 GLU 45 -10.362 5.597 -0.291 331 HG2 GLU 45 HG2 GLU 45 -8.779 6.001 2.233 332 HG3 GLU 45 HG1 GLU 45 -8.355 6.695 0.671 333 H TRP 46 HN TRP 46 -12.773 6.251 1.377 334 HA TRP 46 HA TRP 46 -14.583 4.458 -0.111 335 HB2 TRP 46 HB2 TRP 46 -15.170 6.499 2.029 336 HB3 TRP 46 HB1 TRP 46 -16.405 6.076 0.858 337 HD1 TRP 46 HD1 TRP 46 -13.918 3.890 2.880 338 HE1 TRP 46 HE1 TRP 46 -15.225 2.012 4.037 339 HE3 TRP 46 HE3 TRP 46 -18.706 5.120 1.405 340 HZ2 TRP 46 HZ2 TRP 46 -17.873 1.159 4.294 341 HZ3 TRP 46 HZ3 TRP 46 -20.549 3.698 2.177 342 HH2 TRP 46 HH2 TRP 46 -20.141 1.761 3.589 343 H THR 47 HN THR 47 -15.343 5.069 -2.003 344 HA THR 47 HA THR 47 -15.033 7.889 -2.805 345 HB THR 47 HB THR 47 -15.046 6.042 -5.073 346 HG1 THR 47 HG1 THR 47 -13.485 5.424 -2.925 347 HG21 THR 47 HG21 THR 47 -13.105 7.394 -5.726 348 HG22 THR 47 HG22 THR 47 -13.081 8.139 -4.127 349 HG23 THR 47 HG23 THR 47 -14.446 8.413 -5.208 350 H TYR 48 HN TYR 48 -16.847 8.788 -3.860 351 HA TYR 48 HA TYR 48 -19.106 6.974 -4.281 352 HB2 TYR 48 HB2 TYR 48 -19.551 7.767 -2.114 353 HB3 TYR 48 HB1 TYR 48 -19.015 9.371 -2.471 354 HD1 TYR 48 HD1 TYR 48 -20.649 11.031 -2.740 355 HD2 TYR 48 HD2 TYR 48 -21.667 6.962 -3.495 356 HE1 TYR 48 HE1 TYR 48 -22.970 11.691 -3.165 357 HE2 TYR 48 HE2 TYR 48 -23.995 7.622 -3.917 358 HH TYR 48 HH TYR 48 -25.533 9.456 -3.365 359 H ASP 49 HN ASP 49 -20.789 7.831 -5.598 360 HA ASP 49 HA ASP 49 -20.084 10.210 -7.198 361 HB2 ASP 49 HB2 ASP 49 -19.324 8.474 -8.726 362 HB3 ASP 49 HB1 ASP 49 -20.768 7.522 -8.480 363 H ASP 50 HN ASP 50 -21.893 11.465 -7.633 364 HA ASP 50 HA ASP 50 -24.232 10.594 -6.082 365 HB2 ASP 50 HB2 ASP 50 -23.235 12.877 -5.686 366 HB3 ASP 50 HB1 ASP 50 -23.730 13.317 -7.322 367 H ALA 51 HN ALA 51 -23.196 10.743 -9.301 368 HA ALA 51 HA ALA 51 -25.739 11.192 -10.513 369 HB1 ALA 51 HB1 ALA 51 -24.650 10.494 -12.587 370 HB2 ALA 51 HB2 ALA 51 -23.251 9.944 -11.663 371 HB3 ALA 51 HB3 ALA 51 -23.664 11.657 -11.698 372 H THR 52 HN THR 52 -23.960 8.329 -9.491 373 HA THR 52 HA THR 52 -26.238 6.696 -10.377 374 HB THR 52 HB THR 52 -24.571 4.780 -10.212 375 HG1 THR 52 HG1 THR 52 -22.674 6.916 -10.301 376 HG21 THR 52 HG21 THR 52 -24.054 6.997 -12.211 377 HG22 THR 52 HG22 THR 52 -25.277 5.734 -12.360 378 HG23 THR 52 HG23 THR 52 -23.564 5.315 -12.400 379 H LYS 53 HN LYS 53 -24.800 7.840 -7.527 380 HA LYS 53 HA LYS 53 -25.114 7.378 -5.295 381 HB2 LYS 53 HB2 LYS 53 -27.416 6.020 -6.555 382 HB3 LYS 53 HB1 LYS 53 -26.989 5.460 -4.946 383 HG2 LYS 53 HG2 LYS 53 -28.696 7.206 -4.895 384 HG3 LYS 53 HG1 LYS 53 -27.224 7.681 -4.054 385 HD2 LYS 53 HD2 LYS 53 -26.538 8.975 -6.026 386 HD3 LYS 53 HD1 LYS 53 -28.046 8.532 -6.828 387 HE2 LYS 53 HE2 LYS 53 -29.322 9.643 -5.093 388 HE3 LYS 53 HE1 LYS 53 -27.837 10.034 -4.229 389 HZ1 LYS 53 HZ1 LYS 53 -28.484 10.987 -6.963 390 HZ2 LYS 53 HZ2 LYS 53 -27.155 11.449 -6.007 391 HZ3 LYS 53 HZ3 LYS 53 -28.724 11.887 -5.548 392 H THR 54 HN THR 54 -23.381 5.739 -7.093 393 HA THR 54 HA THR 54 -23.232 3.164 -5.795 394 HB THR 54 HB THR 54 -21.199 4.290 -7.722 395 HG1 THR 54 HG1 THR 54 -22.845 4.477 -9.071 396 HG21 THR 54 HG21 THR 54 -22.270 1.478 -7.542 397 HG22 THR 54 HG22 THR 54 -20.942 2.017 -6.515 398 HG23 THR 54 HG23 THR 54 -20.760 2.023 -8.271 399 H TYR 55 HN TYR 55 -22.090 2.829 -3.963 400 HA TYR 55 HA TYR 55 -19.880 4.664 -3.326 401 HB2 TYR 55 HB2 TYR 55 -21.550 2.850 -1.577 402 HB3 TYR 55 HB1 TYR 55 -19.968 3.384 -1.049 403 HD1 TYR 55 HD1 TYR 55 -23.397 4.479 -1.866 404 HD2 TYR 55 HD2 TYR 55 -19.629 5.586 -0.232 405 HE1 TYR 55 HE1 TYR 55 -24.408 6.504 -0.907 406 HE2 TYR 55 HE2 TYR 55 -20.628 7.610 0.722 407 HH TYR 55 HH TYR 55 -22.544 9.065 0.345 408 H THR 56 HN THR 56 -17.825 3.912 -3.178 409 HA THR 56 HA THR 56 -17.439 1.029 -3.605 410 HB THR 56 HB THR 56 -15.747 3.190 -4.873 411 HG1 THR 56 HG1 THR 56 -18.167 2.301 -5.579 412 HG21 THR 56 HG21 THR 56 -14.560 1.081 -4.532 413 HG22 THR 56 HG22 THR 56 -14.891 1.320 -6.248 414 HG23 THR 56 HG23 THR 56 -15.873 0.199 -5.310 415 H VAL 57 HN VAL 57 -16.070 0.099 -2.226 416 HA VAL 57 HA VAL 57 -14.385 1.872 -0.584 417 HB VAL 57 HB VAL 57 -16.061 0.743 0.855 418 HG11 VAL 57 HG11 VAL 57 -15.819 -1.716 1.280 419 HG12 VAL 57 HG12 VAL 57 -14.858 -1.811 -0.191 420 HG13 VAL 57 HG13 VAL 57 -16.546 -1.300 -0.263 421 HG21 VAL 57 HG21 VAL 57 -13.272 -0.300 1.289 422 HG22 VAL 57 HG22 VAL 57 -14.533 -0.148 2.513 423 HG23 VAL 57 HG23 VAL 57 -13.861 1.296 1.754 424 H THR 58 HN THR 58 -12.324 1.743 -0.982 425 HA THR 58 HA THR 58 -11.378 -0.577 -2.522 426 HB THR 58 HB THR 58 -10.056 2.131 -2.318 427 HG1 THR 58 HG1 THR 58 -12.354 1.725 -3.360 428 HG21 THR 58 HG21 THR 58 -8.634 0.269 -3.088 429 HG22 THR 58 HG22 THR 58 -8.938 1.435 -4.376 430 HG23 THR 58 HG23 THR 58 -9.809 -0.100 -4.351 431 H GLU 59 HN GLU 59 -10.045 -1.941 -1.597 432 HA GLU 59 HA GLU 59 -8.929 -1.440 1.011 433 HB2 GLU 59 HB2 GLU 59 -9.822 -3.672 0.080 434 HB3 GLU 59 HB1 GLU 59 -8.320 -3.775 -0.822 435 HG2 GLU 59 HG2 GLU 59 -8.599 -3.726 2.182 436 HG3 GLU 59 HG1 GLU 59 -8.287 -5.138 1.187 437 H GLY 60 HN GLY 60 -6.886 -0.477 1.326 438 HA2 GLY 60 HA2 GLY 60 -5.176 -0.317 -1.080 439 HA3 GLY 60 HA1 GLY 60 -5.326 0.985 0.094 440 H SER 61 HN SER 61 -3.608 -1.748 -0.811 441 HA SER 61 HA SER 61 -2.457 -2.205 1.812 442 HB2 SER 61 HB2 SER 61 -2.875 -4.158 0.426 443 HB3 SER 61 HB1 SER 61 -1.918 -3.477 -0.887 444 HG SER 61 HG SER 61 -0.278 -3.458 1.098 445 H GLY 62 HN GLY 62 -1.945 -0.140 -0.791 446 HA2 GLY 62 HA2 GLY 62 -0.168 1.571 -0.120 447 HA3 GLY 62 HA1 GLY 62 0.907 0.177 -0.129 448 H GLY 63 HN GLY 63 1.958 1.796 -1.717 449 HA2 GLY 63 HA2 GLY 63 0.713 1.656 -4.378 450 HA3 GLY 63 HA1 GLY 63 2.033 2.723 -3.914 451 H ALA 64 HN ALA 64 3.671 0.811 -2.657 452 HA ALA 64 HA ALA 64 4.262 -1.139 -4.764 453 HB1 ALA 64 HB1 ALA 64 6.621 -0.557 -4.796 454 HB2 ALA 64 HB2 ALA 64 6.339 0.724 -3.618 455 HB3 ALA 64 HB3 ALA 64 5.644 0.846 -5.234 456 H GLY 65 HN GLY 65 5.186 0.101 -1.577 457 HA2 GLY 65 HA2 GLY 65 4.947 -1.245 0.384 458 HA3 GLY 65 HA1 GLY 65 5.214 -2.674 -0.606 459 H GLY 66 HN GLY 66 6.768 -3.247 1.038 460 HA2 GLY 66 HA2 GLY 66 9.173 -1.610 1.206 461 HA3 GLY 66 HA1 GLY 66 8.809 -3.024 2.176 462 H GLN 67 HN GLN 67 8.610 -2.979 -1.324 463 HA GLN 67 HA GLN 67 10.528 -5.144 -1.483 464 HB2 GLN 67 HB2 GLN 67 9.214 -3.614 -3.763 465 HB3 GLN 67 HB1 GLN 67 10.012 -5.203 -3.854 466 HG2 GLN 67 HG2 GLN 67 7.471 -4.579 -2.353 467 HG3 GLN 67 HG1 GLN 67 7.586 -5.396 -3.908 468 HE21 GLN 67 HE21 GLN 67 6.465 -6.286 -1.352 469 HE22 GLN 67 HE22 GLN 67 7.283 -7.770 -0.984 470 H GLY 68 HN GLY 68 12.620 -4.535 -1.167 471 HA2 GLY 68 HA2 GLY 68 13.766 -2.657 -3.036 472 HA3 GLY 68 HA1 GLY 68 13.765 -2.090 -1.377 473 H MET 69 HN MET 69 15.961 -2.867 -3.298 474 HA MET 69 HA MET 69 17.366 -4.733 -1.483 475 HB2 MET 69 HB2 MET 69 18.537 -5.654 -3.437 476 HB3 MET 69 HB1 MET 69 16.794 -5.860 -3.597 477 HG2 MET 69 HG2 MET 69 16.678 -3.971 -5.106 478 HG3 MET 69 HG1 MET 69 18.402 -3.669 -4.899 479 HE1 MET 69 HE1 MET 69 20.005 -6.783 -6.617 480 HE2 MET 69 HE2 MET 69 19.572 -6.668 -4.912 481 HE3 MET 69 HE3 MET 69 20.292 -5.284 -5.734 482 H ILE 70 HN ILE 70 17.164 -1.700 -2.144 483 HA ILE 70 HA ILE 70 20.019 -1.172 -1.982 484 HB ILE 70 HB ILE 70 18.238 0.126 -4.076 485 HG12 ILE 70 HG12 ILE 70 20.764 -1.518 -4.381 486 HG13 ILE 70 HG11 ILE 70 19.127 -2.075 -4.719 487 HG21 ILE 70 HG21 ILE 70 20.170 1.505 -4.705 488 HG22 ILE 70 HG22 ILE 70 21.116 0.801 -3.397 489 HG23 ILE 70 HG23 ILE 70 19.714 1.806 -3.024 490 HD11 ILE 70 HD11 ILE 70 18.935 -0.363 -6.478 491 HD12 ILE 70 HD12 ILE 70 20.252 -1.496 -6.780 492 HD13 ILE 70 HD13 ILE 70 20.602 0.120 -6.164 493 H GLN 71 HN GLN 71 19.888 -0.250 0.083 494 HA GLN 71 HA GLN 71 17.909 1.889 0.394 495 HB2 GLN 71 HB2 GLN 71 17.839 1.426 2.749 496 HB3 GLN 71 HB1 GLN 71 17.597 -0.084 1.886 497 HG2 GLN 71 HG2 GLN 71 19.917 -0.702 2.283 498 HG3 GLN 71 HG1 GLN 71 20.193 0.829 3.114 499 HE21 GLN 71 HE21 GLN 71 19.285 1.161 5.142 500 HE22 GLN 71 HE22 GLN 71 18.734 -0.155 6.122 501 H GLU 72 HN GLU 72 20.898 1.563 -0.396 502 HA GLU 72 HA GLU 72 22.345 3.185 1.417 503 HB2 GLU 72 HB2 GLU 72 24.100 3.240 -0.221 504 HB3 GLU 72 HB1 GLU 72 23.421 1.625 -0.197 505 HG2 GLU 72 HG2 GLU 72 22.226 2.035 -2.240 506 HG3 GLU 72 HG1 GLU 72 22.714 3.724 -2.222 507 HA PRO 73 HA PRO 73 20.891 7.153 -0.045 508 HB2 PRO 73 HB2 PRO 73 22.142 8.709 1.735 509 HB3 PRO 73 HB1 PRO 73 20.950 7.485 2.327 510 HG2 PRO 73 HG2 PRO 73 23.953 7.289 2.153 511 HG3 PRO 73 HG1 PRO 73 22.899 6.949 3.542 512 HD2 PRO 73 HD2 PRO 73 23.819 5.008 1.835 513 HD3 PRO 73 HD1 PRO 73 22.261 4.893 2.720 514 H ALA 74 HN ALA 74 21.744 9.060 -1.071 515 HA ALA 74 HA ALA 74 24.363 8.675 -2.294 516 HB1 ALA 74 HB1 ALA 74 23.659 10.353 -3.901 517 HB2 ALA 74 HB2 ALA 74 22.194 10.655 -2.965 518 HB3 ALA 74 HB3 ALA 74 22.434 9.092 -3.746 519 H LEU 75 HN LEU 75 25.424 10.938 -2.848 520 HA LEU 75 HA LEU 75 26.355 11.939 -0.369 521 HB2 LEU 75 HB2 LEU 75 26.797 12.870 -3.195 522 HB3 LEU 75 HB1 LEU 75 27.518 13.665 -1.821 523 HG LEU 75 HG LEU 75 29.173 12.263 -2.747 524 HD11 LEU 75 HD11 LEU 75 29.686 10.757 -0.920 525 HD12 LEU 75 HD12 LEU 75 28.019 10.850 -0.350 526 HD13 LEU 75 HD13 LEU 75 29.048 12.283 -0.309 527 HD21 LEU 75 HD21 LEU 75 28.863 9.864 -3.119 528 HD22 LEU 75 HD22 LEU 75 27.735 10.820 -4.077 529 HD23 LEU 75 HD23 LEU 75 27.176 10.003 -2.618 530 HA PRO 76 HA PRO 76 23.289 15.199 0.139 531 HB2 PRO 76 HB2 PRO 76 25.249 16.492 1.949 532 HB3 PRO 76 HB1 PRO 76 23.633 15.901 2.341 533 HG2 PRO 76 HG2 PRO 76 25.815 14.656 3.255 534 HG3 PRO 76 HG1 PRO 76 24.370 13.725 2.701 535 HD2 PRO 76 HD2 PRO 76 26.949 14.283 1.173 536 HD3 PRO 76 HD1 PRO 76 26.067 12.752 1.372 537 HA PRO 77 HA PRO 77 24.558 18.366 -2.729 538 HB2 PRO 77 HB2 PRO 77 23.065 20.097 -0.765 539 HB3 PRO 77 HB1 PRO 77 22.980 20.105 -2.535 540 HG2 PRO 77 HG2 PRO 77 21.069 18.896 -1.231 541 HG3 PRO 77 HG1 PRO 77 21.835 18.066 -2.605 542 HD2 PRO 77 HD2 PRO 77 22.258 17.600 0.350 543 HD3 PRO 77 HD1 PRO 77 22.109 16.409 -0.996 544 H GLY 78 HN GLY 78 26.430 19.405 -2.867 545 HA2 GLY 78 HA2 GLY 78 28.073 20.952 -2.131 546 HA3 GLY 78 HA1 GLY 78 27.479 20.780 -0.488 547 H TRP 79 HN TRP 79 27.552 17.765 -0.742 548 HA TRP 79 HA TRP 79 30.423 17.457 -0.155 549 HB2 TRP 79 HB2 TRP 79 28.051 15.593 0.159 550 HB3 TRP 79 HB1 TRP 79 29.705 15.058 0.383 551 HD1 TRP 79 HD1 TRP 79 27.177 17.547 1.929 552 HE1 TRP 79 HE1 TRP 79 27.793 17.881 4.413 553 HE3 TRP 79 HE3 TRP 79 31.504 14.804 2.066 554 HZ2 TRP 79 HZ2 TRP 79 29.842 17.077 6.184 555 HZ3 TRP 79 HZ3 TRP 79 32.727 14.641 4.192 556 HH2 TRP 79 HH2 TRP 79 31.922 15.754 6.207 557 H GLU 80 HN GLU 80 31.843 16.315 -1.485 558 HA GLU 80 HA GLU 80 30.667 15.056 -3.863 559 HB2 GLU 80 HB2 GLU 80 32.793 17.074 -3.642 560 HB3 GLU 80 HB1 GLU 80 33.173 15.725 -4.699 561 HG2 GLU 80 HG2 GLU 80 30.752 17.499 -4.917 562 HG3 GLU 80 HG1 GLU 80 32.194 17.572 -5.934 563 H MET 81 HN MET 81 31.564 13.203 -4.598 564 HA MET 81 HA MET 81 33.419 11.876 -2.744 565 HB2 MET 81 HB2 MET 81 31.174 10.849 -2.708 566 HB3 MET 81 HB1 MET 81 31.249 10.631 -4.474 567 HG2 MET 81 HG2 MET 81 33.182 9.140 -4.163 568 HG3 MET 81 HG1 MET 81 33.027 9.322 -2.417 569 HE1 MET 81 HE1 MET 81 30.059 9.045 -5.034 570 HE2 MET 81 HE2 MET 81 29.860 7.294 -5.097 571 HE3 MET 81 HE3 MET 81 31.343 8.034 -5.700 572 H LYS 82 HN LYS 82 35.405 11.652 -3.684 573 HA LYS 82 HA LYS 82 35.475 11.051 -6.540 574 HB2 LYS 82 HB2 LYS 82 37.310 13.172 -5.419 575 HB3 LYS 82 HB1 LYS 82 37.028 12.764 -7.099 576 HG2 LYS 82 HG2 LYS 82 34.705 13.644 -6.878 577 HG3 LYS 82 HG1 LYS 82 35.132 14.156 -5.215 578 HD2 LYS 82 HD2 LYS 82 36.929 15.555 -6.111 579 HD3 LYS 82 HD1 LYS 82 36.518 15.049 -7.750 580 HE2 LYS 82 HE2 LYS 82 34.625 16.482 -5.892 581 HE3 LYS 82 HE1 LYS 82 35.627 17.290 -7.093 582 HZ1 LYS 82 HZ1 LYS 82 33.592 17.015 -8.134 583 HZ2 LYS 82 HZ2 LYS 82 33.353 15.451 -7.529 584 HZ3 LYS 82 HZ3 LYS 82 34.510 15.725 -8.747 585 H TYR 83 HN TYR 83 37.534 10.129 -7.228 586 HA TYR 83 HA TYR 83 39.015 8.937 -4.968 587 HB2 TYR 83 HB2 TYR 83 38.414 7.610 -7.649 588 HB3 TYR 83 HB1 TYR 83 39.203 6.840 -6.246 589 HD1 TYR 83 HD1 TYR 83 37.845 6.223 -4.273 590 HD2 TYR 83 HD2 TYR 83 36.032 7.838 -7.771 591 HE1 TYR 83 HE1 TYR 83 35.646 5.431 -3.500 592 HE2 TYR 83 HE2 TYR 83 33.833 7.053 -7.001 593 HH TYR 83 HH TYR 83 32.915 5.321 -5.509 594 H THR 84 HN THR 84 41.257 8.557 -5.330 595 HA THR 84 HA THR 84 42.424 10.226 -7.399 596 HB THR 84 HB THR 84 44.555 9.842 -6.360 597 HG1 THR 84 HG1 THR 84 44.868 8.236 -4.807 598 HG21 THR 84 HG21 THR 84 42.421 10.073 -4.238 599 HG22 THR 84 HG22 THR 84 43.192 11.390 -5.121 600 HG23 THR 84 HG23 THR 84 44.132 10.421 -3.989 601 H SER 85 HN SER 85 44.427 9.095 -8.556 602 HA SER 85 HA SER 85 43.233 6.971 -10.078 603 HB2 SER 85 HB2 SER 85 45.941 8.135 -10.396 604 HB3 SER 85 HB1 SER 85 45.021 7.268 -11.608 605 HG SER 85 HG SER 85 43.552 9.305 -10.705 606 H GLU 86 HN GLU 86 44.294 6.610 -7.231 607 HA GLU 86 HA GLU 86 45.976 4.222 -7.785 608 HB2 GLU 86 HB2 GLU 86 46.132 6.127 -5.426 609 HB3 GLU 86 HB1 GLU 86 47.074 4.650 -5.585 610 HG2 GLU 86 HG2 GLU 86 48.250 5.547 -7.480 611 HG3 GLU 86 HG1 GLU 86 47.194 6.958 -7.514 612 H GLY 87 HN GLY 87 43.003 5.191 -6.894 613 HA2 GLY 87 HA2 GLY 87 41.309 3.857 -6.023 614 HA3 GLY 87 HA1 GLY 87 42.526 2.786 -5.346 615 H VAL 88 HN VAL 88 43.127 6.047 -4.643 616 HA VAL 88 HA VAL 88 42.340 5.617 -1.877 617 HB VAL 88 HB VAL 88 43.846 7.922 -3.135 618 HG11 VAL 88 HG11 VAL 88 44.443 8.538 -0.852 619 HG12 VAL 88 HG12 VAL 88 43.440 7.227 -0.227 620 HG13 VAL 88 HG13 VAL 88 42.696 8.576 -1.084 621 HG21 VAL 88 HG21 VAL 88 45.835 6.924 -2.115 622 HG22 VAL 88 HG22 VAL 88 45.087 5.823 -3.271 623 HG23 VAL 88 HG23 VAL 88 44.866 5.568 -1.541 624 H ARG 89 HN ARG 89 40.579 6.456 -1.006 625 HA ARG 89 HA ARG 89 38.814 8.067 -2.689 626 HB2 ARG 89 HB2 ARG 89 38.152 5.900 -1.487 627 HB3 ARG 89 HB1 ARG 89 38.187 6.840 -0.007 628 HG2 ARG 89 HG2 ARG 89 36.457 8.319 -0.915 629 HG3 ARG 89 HG1 ARG 89 36.419 7.346 -2.388 630 HD2 ARG 89 HD2 ARG 89 36.062 5.397 -0.599 631 HD3 ARG 89 HD1 ARG 89 35.387 6.734 0.329 632 HE ARG 89 HE ARG 89 34.283 6.804 -2.237 633 HH11 ARG 89 HH11 ARG 89 34.175 4.842 0.675 634 HH12 ARG 89 HH12 ARG 89 32.618 4.173 0.295 635 HH21 ARG 89 HH21 ARG 89 32.236 5.897 -2.739 636 HH22 ARG 89 HH22 ARG 89 31.526 4.750 -1.645 637 H TYR 90 HN TYR 90 38.606 10.229 -2.371 638 HA TYR 90 HA TYR 90 39.084 11.208 0.349 639 HB2 TYR 90 HB2 TYR 90 40.200 13.202 -0.409 640 HB3 TYR 90 HB1 TYR 90 41.042 11.811 -1.039 641 HD1 TYR 90 HD1 TYR 90 40.696 11.191 -3.464 642 HD2 TYR 90 HD2 TYR 90 39.443 14.918 -1.843 643 HE1 TYR 90 HE1 TYR 90 40.530 12.107 -5.734 644 HE2 TYR 90 HE2 TYR 90 39.283 15.858 -4.115 645 HH TYR 90 HH TYR 90 39.292 13.952 -6.884 646 H PHE 91 HN PHE 91 37.847 13.178 0.888 647 HA PHE 91 HA PHE 91 35.504 13.465 -0.868 648 HB2 PHE 91 HB2 PHE 91 35.574 13.321 2.149 649 HB3 PHE 91 HB1 PHE 91 34.237 14.038 1.274 650 HD1 PHE 91 HD1 PHE 91 32.461 12.746 0.633 651 HD2 PHE 91 HD2 PHE 91 36.185 10.832 1.422 652 HE1 PHE 91 HE1 PHE 91 31.397 10.548 0.343 653 HE2 PHE 91 HE2 PHE 91 35.123 8.640 1.128 654 HZ PHE 91 HZ PHE 91 32.732 8.495 0.586 655 H VAL 92 HN VAL 92 34.643 15.522 -1.055 656 HA VAL 92 HA VAL 92 36.478 17.658 -0.204 657 HB VAL 92 HB VAL 92 34.677 17.653 -2.631 658 HG11 VAL 92 HG11 VAL 92 35.087 19.884 -1.747 659 HG12 VAL 92 HG12 VAL 92 35.914 19.658 -3.287 660 HG13 VAL 92 HG13 VAL 92 36.825 19.594 -1.777 661 HG21 VAL 92 HG21 VAL 92 37.665 17.264 -2.468 662 HG22 VAL 92 HG22 VAL 92 36.722 17.426 -3.950 663 HG23 VAL 92 HG23 VAL 92 36.473 16.035 -2.898 664 H ASP 93 HN ASP 93 35.620 18.779 1.435 665 HA ASP 93 HA ASP 93 32.730 19.099 1.727 666 HB2 ASP 93 HB2 ASP 93 35.141 19.898 3.352 667 HB3 ASP 93 HB1 ASP 93 33.667 20.847 3.528 668 H HIS 94 HN HIS 94 32.109 20.278 -0.170 669 HA HIS 94 HA HIS 94 33.578 22.616 -0.935 670 HB2 HIS 94 HB2 HIS 94 32.213 21.099 -2.474 671 HB3 HIS 94 HB1 HIS 94 30.791 21.939 -1.868 672 HD1 HIS 94 HD1 HIS 94 30.550 22.605 -4.475 673 HD2 HIS 94 HD2 HIS 94 33.759 24.307 -2.446 674 HE1 HIS 94 HE1 HIS 94 31.282 24.564 -5.881 675 HE2 HIS 94 HE2 HIS 94 33.340 25.458 -4.723 676 H ASN 95 HN ASN 95 31.515 22.097 1.572 677 HA ASN 95 HA ASN 95 30.071 24.571 1.540 678 HB2 ASN 95 HB2 ASN 95 29.540 23.998 3.929 679 HB3 ASN 95 HB1 ASN 95 29.142 22.711 2.796 680 HD21 ASN 95 HD21 ASN 95 30.284 20.778 2.869 681 HD22 ASN 95 HD22 ASN 95 31.349 20.369 4.176 682 H THR 96 HN THR 96 32.916 23.399 3.313 683 HA THR 96 HA THR 96 33.541 26.157 4.069 684 HB THR 96 HB THR 96 35.344 24.825 5.463 685 HG1 THR 96 HG1 THR 96 33.323 22.851 5.450 686 HG21 THR 96 HG21 THR 96 32.402 24.873 6.166 687 HG22 THR 96 HG22 THR 96 33.566 26.167 6.452 688 HG23 THR 96 HG23 THR 96 33.720 24.638 7.315 689 H ARG 97 HN ARG 97 34.286 23.891 1.779 690 HA ARG 97 HA ARG 97 35.831 23.711 0.138 691 HB2 ARG 97 HB2 ARG 97 36.339 26.495 1.056 692 HB3 ARG 97 HB1 ARG 97 37.483 25.746 -0.051 693 HG2 ARG 97 HG2 ARG 97 35.667 25.276 -1.610 694 HG3 ARG 97 HG1 ARG 97 34.530 26.042 -0.503 695 HD2 ARG 97 HD2 ARG 97 36.915 27.461 -1.661 696 HD3 ARG 97 HD1 ARG 97 35.316 27.489 -2.405 697 HE ARG 97 HE ARG 97 34.667 28.363 -0.025 698 HH11 ARG 97 HH11 ARG 97 37.580 29.103 -1.822 699 HH12 ARG 97 HH12 ARG 97 37.681 30.735 -1.223 700 HH21 ARG 97 HH21 ARG 97 34.834 30.490 0.814 701 HH22 ARG 97 HH22 ARG 97 36.135 31.512 0.284 702 H THR 98 HN THR 98 36.575 21.958 1.354 703 HA THR 98 HA THR 98 39.415 22.104 1.896 704 HB THR 98 HB THR 98 38.370 22.791 4.093 705 HG1 THR 98 HG1 THR 98 39.740 21.462 5.261 706 HG21 THR 98 HG21 THR 98 37.255 21.050 5.448 707 HG22 THR 98 HG22 THR 98 37.295 19.959 4.062 708 HG23 THR 98 HG23 THR 98 36.328 21.430 3.992 709 H THR 99 HN THR 99 40.155 19.812 2.618 710 HA THR 99 HA THR 99 38.479 17.803 1.230 711 HB THR 99 HB THR 99 40.710 16.668 0.625 712 HG1 THR 99 HG1 THR 99 41.802 18.241 2.180 713 HG21 THR 99 HG21 THR 99 40.123 19.402 -0.593 714 HG22 THR 99 HG22 THR 99 39.412 17.873 -1.112 715 HG23 THR 99 HG23 THR 99 41.140 18.173 -1.343 716 H THR 100 HN THR 100 38.418 15.721 2.211 717 HA THR 100 HA THR 100 40.032 15.295 4.585 718 HB THR 100 HB THR 100 38.050 16.476 5.466 719 HG1 THR 100 HG1 THR 100 37.730 15.057 7.100 720 HG21 THR 100 HG21 THR 100 36.497 14.187 4.244 721 HG22 THR 100 HG22 THR 100 36.396 15.889 3.794 722 HG23 THR 100 HG23 THR 100 35.827 15.361 5.378 723 H PHE 101 HN PHE 101 39.922 13.082 5.352 724 HA PHE 101 HA PHE 101 39.023 11.207 3.258 725 HB2 PHE 101 HB2 PHE 101 41.408 11.117 5.134 726 HB3 PHE 101 HB1 PHE 101 40.801 9.656 4.253 727 HD1 PHE 101 HD1 PHE 101 41.664 9.180 2.206 728 HD2 PHE 101 HD2 PHE 101 41.958 13.173 3.633 729 HE1 PHE 101 HE1 PHE 101 43.014 9.770 0.246 730 HE2 PHE 101 HE2 PHE 101 43.312 13.779 1.667 731 HZ PHE 101 HZ PHE 101 43.841 12.076 -0.030 732 H LYS 102 HN LYS 102 37.023 10.705 4.091 733 HA LYS 102 HA LYS 102 37.077 9.141 6.544 734 HB2 LYS 102 HB2 LYS 102 36.412 11.439 7.204 735 HB3 LYS 102 HB1 LYS 102 35.051 11.335 6.097 736 HG2 LYS 102 HG2 LYS 102 34.096 9.531 7.384 737 HG3 LYS 102 HG1 LYS 102 35.501 9.520 8.453 738 HD2 LYS 102 HD2 LYS 102 33.707 10.708 9.535 739 HD3 LYS 102 HD1 LYS 102 34.968 11.858 9.090 740 HE2 LYS 102 HE2 LYS 102 33.683 12.531 7.134 741 HE3 LYS 102 HE1 LYS 102 32.439 11.346 7.531 742 HZ1 LYS 102 HZ1 LYS 102 32.179 12.550 9.686 743 HZ2 LYS 102 HZ2 LYS 102 31.674 13.409 8.319 744 HZ3 LYS 102 HZ3 LYS 102 33.158 13.786 9.058 745 H ASP 103 HN ASP 103 36.123 7.267 6.167 746 HA ASP 103 HA ASP 103 34.084 7.116 4.051 747 HB2 ASP 103 HB2 ASP 103 36.227 5.705 3.866 748 HB3 ASP 103 HB1 ASP 103 35.581 4.766 5.210 749 HA PRO 104 HA PRO 104 31.306 6.454 7.466 750 HB2 PRO 104 HB2 PRO 104 29.047 6.035 6.048 751 HB3 PRO 104 HB1 PRO 104 29.803 7.631 6.117 752 HG2 PRO 104 HG2 PRO 104 29.969 5.552 3.972 753 HG3 PRO 104 HG1 PRO 104 29.734 7.302 3.816 754 HD2 PRO 104 HD2 PRO 104 32.146 6.076 3.469 755 HD3 PRO 104 HD1 PRO 104 31.980 7.746 4.046 756 H ARG 105 HN ARG 105 32.323 3.996 5.328 757 HA ARG 105 HA ARG 105 30.634 2.002 6.698 758 HB2 ARG 105 HB2 ARG 105 31.872 2.095 3.990 759 HB3 ARG 105 HB1 ARG 105 31.650 0.526 4.746 760 HG2 ARG 105 HG2 ARG 105 29.809 1.134 3.240 761 HG3 ARG 105 HG1 ARG 105 29.266 0.891 4.897 762 HD2 ARG 105 HD2 ARG 105 29.399 3.373 5.206 763 HD3 ARG 105 HD1 ARG 105 29.722 3.509 3.476 764 HE ARG 105 HE ARG 105 27.515 2.549 3.084 765 HH11 ARG 105 HH11 ARG 105 28.175 3.786 6.304 766 HH12 ARG 105 HH12 ARG 105 26.504 4.038 6.686 767 HH21 ARG 105 HH21 ARG 105 25.327 2.875 3.591 768 HH22 ARG 105 HH22 ARG 105 24.870 3.513 5.142 769 HA PRO 106 HA PRO 106 34.523 1.130 8.926 770 HB2 PRO 106 HB2 PRO 106 32.726 -0.964 10.071 771 HB3 PRO 106 HB1 PRO 106 33.803 0.207 10.919 772 HG2 PRO 106 HG2 PRO 106 31.133 0.510 10.850 773 HG3 PRO 106 HG1 PRO 106 32.222 1.885 10.796 774 HD2 PRO 106 HD2 PRO 106 30.616 0.697 8.674 775 HD3 PRO 106 HD1 PRO 106 31.121 2.391 8.908 776 H GLY 107 HN GLY 107 36.004 -0.053 7.874 777 HA2 GLY 107 HA2 GLY 107 37.023 -2.100 7.344 778 HA3 GLY 107 HA1 GLY 107 35.422 -2.869 7.294 779 H PHE 108 HN PHE 108 34.288 -0.810 5.488 780 HA PHE 108 HA PHE 108 33.735 -0.991 3.218 781 HB2 PHE 108 HB2 PHE 108 35.426 0.252 1.848 782 HB3 PHE 108 HB1 PHE 108 34.966 1.085 3.371 783 HD1 PHE 108 HD1 PHE 108 36.613 1.358 5.154 784 HD2 PHE 108 HD2 PHE 108 37.633 -0.646 1.530 785 HE1 PHE 108 HE1 PHE 108 39.000 1.580 5.704 786 HE2 PHE 108 HE2 PHE 108 40.016 -0.421 2.083 787 HZ PHE 108 HZ PHE 108 40.707 0.692 4.165 788 H GLU 109 HN GLU 109 34.540 -3.526 4.013 789 HA GLU 109 HA GLU 109 35.426 -4.584 1.470 790 HB2 GLU 109 HB2 GLU 109 37.545 -4.266 2.661 791 HB3 GLU 109 HB1 GLU 109 36.932 -5.165 4.038 792 HG2 GLU 109 HG2 GLU 109 38.429 -6.542 2.768 793 HG3 GLU 109 HG1 GLU 109 36.790 -7.176 2.635 Start of MODEL 13 1 H1 GLY 1 HT1 GLY 1 -40.551 8.933 3.556 2 H2 GLY 1 HT2 GLY 1 -40.555 10.574 3.132 3 H3 GLY 1 HT3 GLY 1 -39.190 9.618 2.813 4 HA2 GLY 1 HA1 GLY 1 -41.863 9.265 1.574 5 HA3 GLY 1 HA2 GLY 1 -40.481 10.034 0.803 6 H SER 2 HN SER 2 -40.262 8.571 -0.851 7 HA SER 2 HA SER 2 -40.139 5.745 -0.409 8 HB2 SER 2 HB2 SER 2 -39.188 7.314 -2.820 9 HB3 SER 2 HB1 SER 2 -39.617 5.603 -2.763 10 HG SER 2 HG SER 2 -41.777 6.356 -2.114 11 H HIS 3 HN HIS 3 -38.075 4.616 -1.487 12 HA HIS 3 HA HIS 3 -35.781 5.686 0.018 13 HB2 HIS 3 HB2 HIS 3 -36.071 2.903 -1.135 14 HB3 HIS 3 HB1 HIS 3 -34.864 3.457 0.019 15 HD1 HIS 3 HD1 HIS 3 -37.558 1.333 -0.014 16 HD2 HIS 3 HD2 HIS 3 -36.563 4.538 2.445 17 HE1 HIS 3 HE1 HIS 3 -38.851 0.983 2.116 18 HE2 HIS 3 HE2 HIS 3 -38.366 3.018 3.521 19 H MET 4 HN MET 4 -33.624 5.077 -1.047 20 HA MET 4 HA MET 4 -33.831 5.325 -3.975 21 HB2 MET 4 HB2 MET 4 -32.705 7.291 -2.348 22 HB3 MET 4 HB1 MET 4 -31.327 6.330 -2.881 23 HG2 MET 4 HG2 MET 4 -31.636 8.148 -4.392 24 HG3 MET 4 HG1 MET 4 -32.028 6.636 -5.209 25 HE1 MET 4 HE1 MET 4 -32.794 9.524 -6.290 26 HE2 MET 4 HE2 MET 4 -34.466 9.303 -6.802 27 HE3 MET 4 HE3 MET 4 -33.266 8.062 -7.160 28 H GLN 5 HN GLN 5 -32.144 4.212 -5.093 29 HA GLN 5 HA GLN 5 -31.392 1.826 -3.624 30 HB2 GLN 5 HB2 GLN 5 -32.426 1.578 -5.844 31 HB3 GLN 5 HB1 GLN 5 -31.093 2.469 -6.564 32 HG2 GLN 5 HG2 GLN 5 -29.546 0.701 -5.767 33 HG3 GLN 5 HG1 GLN 5 -30.945 -0.208 -5.200 34 HE21 GLN 5 HE21 GLN 5 -29.165 0.903 -7.961 35 HE22 GLN 5 HE22 GLN 5 -29.961 -0.133 -9.135 36 H TYR 6 HN TYR 6 -29.605 2.130 -2.432 37 HA TYR 6 HA TYR 6 -27.382 3.588 -3.640 38 HB2 TYR 6 HB2 TYR 6 -27.865 2.679 -0.784 39 HB3 TYR 6 HB1 TYR 6 -26.254 3.145 -1.308 40 HD1 TYR 6 HD1 TYR 6 -25.786 5.468 -1.985 41 HD2 TYR 6 HD2 TYR 6 -29.607 4.342 -0.479 42 HE1 TYR 6 HE1 TYR 6 -26.340 7.837 -1.646 43 HE2 TYR 6 HE2 TYR 6 -30.161 6.708 -0.123 44 HH TYR 6 HH TYR 6 -29.013 8.857 0.182 45 H LYS 7 HN LYS 7 -25.377 2.684 -3.968 46 HA LYS 7 HA LYS 7 -25.424 -0.255 -4.287 47 HB2 LYS 7 HB2 LYS 7 -25.714 1.406 -6.346 48 HB3 LYS 7 HB1 LYS 7 -23.967 1.544 -6.197 49 HG2 LYS 7 HG2 LYS 7 -25.474 -1.010 -6.678 50 HG3 LYS 7 HG1 LYS 7 -24.649 -0.051 -7.903 51 HD2 LYS 7 HD2 LYS 7 -22.521 -0.447 -6.805 52 HD3 LYS 7 HD1 LYS 7 -23.337 -1.391 -5.552 53 HE2 LYS 7 HE2 LYS 7 -23.206 -2.035 -8.495 54 HE3 LYS 7 HE1 LYS 7 -22.359 -2.875 -7.196 55 HZ1 LYS 7 HZ1 LYS 7 -24.235 -4.176 -7.717 56 HZ2 LYS 7 HZ2 LYS 7 -25.277 -2.843 -7.743 57 HZ3 LYS 7 HZ3 LYS 7 -24.636 -3.383 -6.273 58 H LEU 8 HN LEU 8 -23.473 -1.328 -3.903 59 HA LEU 8 HA LEU 8 -21.117 0.310 -3.234 60 HB2 LEU 8 HB2 LEU 8 -22.284 -0.160 -1.080 61 HB3 LEU 8 HB1 LEU 8 -22.239 -1.858 -1.452 62 HG LEU 8 HG LEU 8 -19.659 -1.531 -1.520 63 HD11 LEU 8 HD11 LEU 8 -19.640 0.890 -1.383 64 HD12 LEU 8 HD12 LEU 8 -18.862 0.183 0.033 65 HD13 LEU 8 HD13 LEU 8 -20.497 0.829 0.157 66 HD21 LEU 8 HD21 LEU 8 -19.634 -1.829 0.992 67 HD22 LEU 8 HD22 LEU 8 -20.614 -2.961 0.059 68 HD23 LEU 8 HD23 LEU 8 -21.387 -1.632 0.919 69 H ILE 9 HN ILE 9 -19.172 -0.619 -3.639 70 HA ILE 9 HA ILE 9 -19.181 -3.365 -4.693 71 HB ILE 9 HB ILE 9 -17.619 -1.018 -5.799 72 HG12 ILE 9 HG12 ILE 9 -19.668 -2.814 -7.167 73 HG13 ILE 9 HG11 ILE 9 -20.027 -1.157 -6.555 74 HG21 ILE 9 HG21 ILE 9 -17.468 -3.937 -6.536 75 HG22 ILE 9 HG22 ILE 9 -16.202 -2.971 -5.774 76 HG23 ILE 9 HG23 ILE 9 -16.701 -2.623 -7.430 77 HD11 ILE 9 HD11 ILE 9 -18.049 -1.894 -8.733 78 HD12 ILE 9 HD12 ILE 9 -18.356 -0.265 -8.131 79 HD13 ILE 9 HD13 ILE 9 -19.634 -1.153 -8.963 80 H LEU 10 HN LEU 10 -17.744 -4.663 -3.670 81 HA LEU 10 HA LEU 10 -15.951 -3.347 -1.772 82 HB2 LEU 10 HB2 LEU 10 -16.603 -6.286 -1.994 83 HB3 LEU 10 HB1 LEU 10 -15.552 -5.569 -0.800 84 HG LEU 10 HG LEU 10 -17.477 -5.919 0.398 85 HD11 LEU 10 HD11 LEU 10 -16.777 -3.602 0.628 86 HD12 LEU 10 HD12 LEU 10 -18.502 -3.840 0.909 87 HD13 LEU 10 HD13 LEU 10 -17.956 -3.146 -0.614 88 HD21 LEU 10 HD21 LEU 10 -19.732 -5.648 -0.369 89 HD22 LEU 10 HD22 LEU 10 -18.844 -6.614 -1.547 90 HD23 LEU 10 HD23 LEU 10 -19.176 -4.914 -1.870 91 H ASN 11 HN ASN 11 -14.231 -2.682 -2.873 92 HA ASN 11 HA ASN 11 -12.978 -4.495 -4.767 93 HB2 ASN 11 HB2 ASN 11 -11.794 -1.864 -3.867 94 HB3 ASN 11 HB1 ASN 11 -11.594 -2.686 -5.410 95 HD21 ASN 11 HD21 ASN 11 -13.571 -0.584 -3.531 96 HD22 ASN 11 HD22 ASN 11 -14.624 -0.111 -4.813 97 H GLY 12 HN GLY 12 -12.423 -6.148 -3.347 98 HA2 GLY 12 HA2 GLY 12 -10.110 -5.527 -1.622 99 HA3 GLY 12 HA1 GLY 12 -11.384 -6.629 -1.071 100 H LYS 13 HN LYS 13 -8.355 -6.593 -2.211 101 HA LYS 13 HA LYS 13 -8.034 -8.191 -4.356 102 HB2 LYS 13 HB2 LYS 13 -6.428 -8.265 -1.805 103 HB3 LYS 13 HB1 LYS 13 -5.881 -8.870 -3.363 104 HG2 LYS 13 HG2 LYS 13 -6.662 -6.010 -2.844 105 HG3 LYS 13 HG1 LYS 13 -5.015 -6.616 -2.775 106 HD2 LYS 13 HD2 LYS 13 -5.327 -7.424 -5.138 107 HD3 LYS 13 HD1 LYS 13 -6.839 -6.518 -5.161 108 HE2 LYS 13 HE2 LYS 13 -5.615 -4.455 -4.681 109 HE3 LYS 13 HE1 LYS 13 -4.101 -5.359 -4.648 110 HZ1 LYS 13 HZ1 LYS 13 -4.698 -6.044 -7.002 111 HZ2 LYS 13 HZ2 LYS 13 -4.197 -4.442 -6.772 112 HZ3 LYS 13 HZ3 LYS 13 -5.845 -4.790 -6.966 113 H THR 14 HN THR 14 -8.746 -9.366 -1.087 114 HA THR 14 HA THR 14 -8.460 -12.119 -1.961 115 HB THR 14 HB THR 14 -9.392 -11.024 0.707 116 HG1 THR 14 HG1 THR 14 -6.862 -11.924 -0.263 117 HG21 THR 14 HG21 THR 14 -8.980 -13.265 1.577 118 HG22 THR 14 HG22 THR 14 -8.508 -13.819 -0.029 119 HG23 THR 14 HG23 THR 14 -10.174 -13.331 0.279 120 H LEU 15 HN LEU 15 -11.148 -9.967 -1.002 121 HA LEU 15 HA LEU 15 -12.996 -11.830 -2.314 122 HB2 LEU 15 HB2 LEU 15 -13.103 -12.048 0.135 123 HB3 LEU 15 HB1 LEU 15 -13.392 -10.332 0.257 124 HG LEU 15 HG LEU 15 -15.462 -10.729 -1.166 125 HD11 LEU 15 HD11 LEU 15 -15.028 -13.538 -0.166 126 HD12 LEU 15 HD12 LEU 15 -14.836 -13.021 -1.840 127 HD13 LEU 15 HD13 LEU 15 -16.420 -12.939 -1.071 128 HD21 LEU 15 HD21 LEU 15 -15.278 -10.149 1.217 129 HD22 LEU 15 HD22 LEU 15 -15.325 -11.867 1.604 130 HD23 LEU 15 HD23 LEU 15 -16.716 -11.099 0.834 131 H LYS 16 HN LYS 16 -13.855 -10.797 -4.014 132 HA LYS 16 HA LYS 16 -14.462 -7.921 -3.732 133 HB2 LYS 16 HB2 LYS 16 -14.048 -9.349 -6.370 134 HB3 LYS 16 HB1 LYS 16 -14.145 -7.619 -6.103 135 HG2 LYS 16 HG2 LYS 16 -11.909 -7.741 -6.309 136 HG3 LYS 16 HG1 LYS 16 -11.961 -8.208 -4.610 137 HD2 LYS 16 HD2 LYS 16 -10.557 -9.627 -6.045 138 HD3 LYS 16 HD1 LYS 16 -11.824 -10.526 -5.206 139 HE2 LYS 16 HE2 LYS 16 -13.167 -10.548 -7.228 140 HE3 LYS 16 HE1 LYS 16 -11.982 -9.546 -8.060 141 HZ1 LYS 16 HZ1 LYS 16 -11.424 -12.282 -7.025 142 HZ2 LYS 16 HZ2 LYS 16 -10.399 -11.322 -7.981 143 HZ3 LYS 16 HZ3 LYS 16 -11.841 -11.922 -8.629 144 H GLY 17 HN GLY 17 -16.441 -7.205 -4.592 145 HA2 GLY 17 HA2 GLY 17 -18.345 -8.800 -5.839 146 HA3 GLY 17 HA1 GLY 17 -18.598 -8.957 -4.105 147 H GLU 18 HN GLU 18 -20.723 -7.966 -4.906 148 HA GLU 18 HA GLU 18 -20.664 -5.218 -4.155 149 HB2 GLU 18 HB2 GLU 18 -21.845 -4.396 -6.258 150 HB3 GLU 18 HB1 GLU 18 -20.122 -4.688 -6.378 151 HG2 GLU 18 HG2 GLU 18 -21.013 -5.509 -8.359 152 HG3 GLU 18 HG1 GLU 18 -20.719 -6.938 -7.379 153 H THR 19 HN THR 19 -22.754 -4.292 -3.828 154 HA THR 19 HA THR 19 -25.051 -6.043 -3.969 155 HB THR 19 HB THR 19 -23.904 -6.785 -1.885 156 HG1 THR 19 HG1 THR 19 -25.995 -7.138 -1.591 157 HG21 THR 19 HG21 THR 19 -24.372 -3.913 -1.034 158 HG22 THR 19 HG22 THR 19 -22.822 -4.752 -1.147 159 HG23 THR 19 HG23 THR 19 -23.998 -5.219 0.086 160 H THR 20 HN THR 20 -26.863 -4.832 -2.523 161 HA THR 20 HA THR 20 -26.752 -1.946 -3.008 162 HB THR 20 HB THR 20 -29.075 -2.068 -3.959 163 HG1 THR 20 HG1 THR 20 -29.235 -4.397 -3.208 164 HG21 THR 20 HG21 THR 20 -28.362 -2.835 -6.241 165 HG22 THR 20 HG22 THR 20 -26.842 -3.366 -5.526 166 HG23 THR 20 HG23 THR 20 -27.277 -1.657 -5.505 167 H THR 21 HN THR 21 -28.578 -0.802 -1.902 168 HA THR 21 HA THR 21 -30.188 -2.353 -0.058 169 HB THR 21 HB THR 21 -27.983 -1.985 1.166 170 HG1 THR 21 HG1 THR 21 -29.083 -1.627 3.073 171 HG21 THR 21 HG21 THR 21 -28.993 0.881 1.149 172 HG22 THR 21 HG22 THR 21 -27.472 0.312 0.464 173 HG23 THR 21 HG23 THR 21 -27.720 0.287 2.213 174 H GLU 22 HN GLU 22 -31.819 -1.047 1.014 175 HA GLU 22 HA GLU 22 -32.611 1.253 -0.634 176 HB2 GLU 22 HB2 GLU 22 -34.127 -0.438 1.366 177 HB3 GLU 22 HB1 GLU 22 -34.809 0.961 0.554 178 HG2 GLU 22 HG2 GLU 22 -33.731 -1.469 -0.884 179 HG3 GLU 22 HG1 GLU 22 -35.461 -1.234 -0.422 180 H ALA 23 HN ALA 23 -31.576 3.047 0.176 181 HA ALA 23 HA ALA 23 -32.056 3.604 3.050 182 HB1 ALA 23 HB1 ALA 23 -29.551 4.418 1.552 183 HB2 ALA 23 HB2 ALA 23 -29.659 3.046 2.654 184 HB3 ALA 23 HB3 ALA 23 -29.900 4.684 3.259 185 H VAL 24 HN VAL 24 -32.231 5.940 3.555 186 HA VAL 24 HA VAL 24 -33.278 7.400 1.232 187 HB VAL 24 HB VAL 24 -34.583 8.710 2.850 188 HG11 VAL 24 HG11 VAL 24 -35.575 6.755 1.838 189 HG12 VAL 24 HG12 VAL 24 -36.126 6.917 3.504 190 HG13 VAL 24 HG13 VAL 24 -34.890 5.726 3.096 191 HG21 VAL 24 HG21 VAL 24 -34.703 8.036 5.190 192 HG22 VAL 24 HG22 VAL 24 -33.065 8.539 4.770 193 HG23 VAL 24 HG23 VAL 24 -33.451 6.824 4.917 194 H ASP 25 HN ASP 25 -30.427 7.322 2.686 195 HA ASP 25 HA ASP 25 -29.862 10.072 2.158 196 HB2 ASP 25 HB2 ASP 25 -30.807 10.234 4.436 197 HB3 ASP 25 HB1 ASP 25 -29.566 9.125 5.013 198 H ALA 26 HN ALA 26 -27.572 10.591 2.428 199 HA ALA 26 HA ALA 26 -25.932 8.483 1.434 200 HB1 ALA 26 HB1 ALA 26 -24.188 10.174 1.329 201 HB2 ALA 26 HB2 ALA 26 -25.149 11.254 2.340 202 HB3 ALA 26 HB3 ALA 26 -25.710 10.832 0.720 203 H ALA 27 HN ALA 27 -26.080 10.267 4.510 204 HA ALA 27 HA ALA 27 -23.762 9.094 5.644 205 HB1 ALA 27 HB1 ALA 27 -24.778 11.179 6.470 206 HB2 ALA 27 HB2 ALA 27 -24.555 9.989 7.752 207 HB3 ALA 27 HB3 ALA 27 -26.157 10.256 7.064 208 H THR 28 HN THR 28 -27.171 8.243 5.667 209 HA THR 28 HA THR 28 -27.032 6.093 7.503 210 HB THR 28 HB THR 28 -28.962 6.302 5.177 211 HG1 THR 28 HG1 THR 28 -29.092 7.528 7.764 212 HG21 THR 28 HG21 THR 28 -29.042 4.185 6.427 213 HG22 THR 28 HG22 THR 28 -30.501 5.137 6.707 214 HG23 THR 28 HG23 THR 28 -29.237 5.076 7.936 215 H ALA 29 HN ALA 29 -26.326 6.335 4.075 216 HA ALA 29 HA ALA 29 -26.410 3.515 3.548 217 HB1 ALA 29 HB1 ALA 29 -25.102 5.738 1.977 218 HB2 ALA 29 HB2 ALA 29 -26.759 5.174 1.769 219 HB3 ALA 29 HB3 ALA 29 -25.409 4.100 1.396 220 H GLU 30 HN GLU 30 -23.947 5.911 4.294 221 HA GLU 30 HA GLU 30 -21.688 4.267 4.046 222 HB2 GLU 30 HB2 GLU 30 -21.973 6.881 4.481 223 HB3 GLU 30 HB1 GLU 30 -21.820 6.372 6.156 224 HG2 GLU 30 HG2 GLU 30 -19.682 5.197 5.485 225 HG3 GLU 30 HG1 GLU 30 -19.811 6.075 3.959 226 H LYS 31 HN LYS 31 -23.422 5.272 6.981 227 HA LYS 31 HA LYS 31 -22.124 3.802 8.869 228 HB2 LYS 31 HB2 LYS 31 -25.057 4.503 8.739 229 HB3 LYS 31 HB1 LYS 31 -24.279 3.817 10.160 230 HG2 LYS 31 HG2 LYS 31 -23.577 6.433 8.853 231 HG3 LYS 31 HG1 LYS 31 -24.507 6.230 10.340 232 HD2 LYS 31 HD2 LYS 31 -22.456 4.955 11.209 233 HD3 LYS 31 HD1 LYS 31 -21.598 5.672 9.844 234 HE2 LYS 31 HE2 LYS 31 -21.250 7.076 11.745 235 HE3 LYS 31 HE1 LYS 31 -22.347 7.913 10.654 236 HZ1 LYS 31 HZ1 LYS 31 -24.210 7.211 12.031 237 HZ2 LYS 31 HZ2 LYS 31 -23.076 8.075 12.958 238 HZ3 LYS 31 HZ3 LYS 31 -23.153 6.387 13.071 239 H VAL 32 HN VAL 32 -24.869 2.629 6.894 240 HA VAL 32 HA VAL 32 -25.049 0.132 8.267 241 HB VAL 32 HB VAL 32 -26.110 0.952 5.563 242 HG11 VAL 32 HG11 VAL 32 -25.874 -1.490 5.739 243 HG12 VAL 32 HG12 VAL 32 -27.563 -0.989 5.689 244 HG13 VAL 32 HG13 VAL 32 -26.832 -1.464 7.220 245 HG21 VAL 32 HG21 VAL 32 -27.043 2.239 7.414 246 HG22 VAL 32 HG22 VAL 32 -27.451 0.747 8.261 247 HG23 VAL 32 HG23 VAL 32 -28.255 1.149 6.743 248 H PHE 33 HN PHE 33 -23.628 1.086 5.148 249 HA PHE 33 HA PHE 33 -22.765 -1.555 4.516 250 HB2 PHE 33 HB2 PHE 33 -22.279 1.146 3.330 251 HB3 PHE 33 HB1 PHE 33 -21.256 -0.190 2.850 252 HD1 PHE 33 HD1 PHE 33 -23.455 1.600 1.360 253 HD2 PHE 33 HD2 PHE 33 -23.306 -2.373 2.883 254 HE1 PHE 33 HE1 PHE 33 -25.185 0.917 -0.255 255 HE2 PHE 33 HE2 PHE 33 -25.038 -3.061 1.278 256 HZ PHE 33 HZ PHE 33 -25.885 -1.409 -0.415 257 H LYS 34 HN LYS 34 -21.399 0.977 6.462 258 HA LYS 34 HA LYS 34 -18.709 0.103 6.268 259 HB2 LYS 34 HB2 LYS 34 -20.201 1.796 8.249 260 HB3 LYS 34 HB1 LYS 34 -18.527 1.395 8.511 261 HG2 LYS 34 HG2 LYS 34 -18.223 2.315 6.093 262 HG3 LYS 34 HG1 LYS 34 -19.760 3.125 6.430 263 HD2 LYS 34 HD2 LYS 34 -17.987 4.650 7.018 264 HD3 LYS 34 HD1 LYS 34 -18.743 4.066 8.503 265 HE2 LYS 34 HE2 LYS 34 -16.957 2.574 8.949 266 HE3 LYS 34 HE1 LYS 34 -16.290 2.774 7.332 267 HZ1 LYS 34 HZ1 LYS 34 -16.318 4.801 9.505 268 HZ2 LYS 34 HZ2 LYS 34 -15.800 5.106 7.917 269 HZ3 LYS 34 HZ3 LYS 34 -14.967 3.990 8.885 270 H GLN 35 HN GLN 35 -21.331 -0.561 8.533 271 HA GLN 35 HA GLN 35 -19.982 -2.378 10.206 272 HB2 GLN 35 HB2 GLN 35 -22.384 -1.220 10.277 273 HB3 GLN 35 HB1 GLN 35 -22.896 -2.658 9.468 274 HG2 GLN 35 HG2 GLN 35 -21.641 -2.651 12.227 275 HG3 GLN 35 HG1 GLN 35 -23.356 -2.699 11.868 276 HE21 GLN 35 HE21 GLN 35 -20.401 -4.532 11.858 277 HE22 GLN 35 HE22 GLN 35 -21.142 -6.059 11.520 278 H TYR 36 HN TYR 36 -21.884 -2.656 7.335 279 HA TYR 36 HA TYR 36 -21.895 -5.409 6.929 280 HB2 TYR 36 HB2 TYR 36 -23.324 -4.099 5.584 281 HB3 TYR 36 HB1 TYR 36 -22.019 -3.037 5.093 282 HD1 TYR 36 HD1 TYR 36 -21.194 -3.274 2.930 283 HD2 TYR 36 HD2 TYR 36 -23.004 -6.592 4.851 284 HE1 TYR 36 HE1 TYR 36 -20.945 -4.592 0.870 285 HE2 TYR 36 HE2 TYR 36 -22.761 -7.940 2.811 286 HH TYR 36 HH TYR 36 -20.833 -6.911 0.172 287 H ALA 37 HN ALA 37 -19.600 -3.007 5.636 288 HA ALA 37 HA ALA 37 -17.913 -4.941 4.418 289 HB1 ALA 37 HB1 ALA 37 -16.366 -3.101 4.068 290 HB2 ALA 37 HB2 ALA 37 -17.242 -2.114 5.237 291 HB3 ALA 37 HB3 ALA 37 -18.014 -2.570 3.718 292 H ASN 38 HN ASN 38 -17.999 -3.414 7.560 293 HA ASN 38 HA ASN 38 -15.419 -4.079 8.450 294 HB2 ASN 38 HB2 ASN 38 -16.912 -2.435 9.625 295 HB3 ASN 38 HB1 ASN 38 -17.947 -3.766 10.131 296 HD21 ASN 38 HD21 ASN 38 -15.154 -1.904 10.867 297 HD22 ASN 38 HD22 ASN 38 -14.617 -2.851 12.276 298 H ASP 39 HN ASP 39 -18.472 -5.843 8.600 299 HA ASP 39 HA ASP 39 -17.534 -8.001 10.163 300 HB2 ASP 39 HB2 ASP 39 -19.927 -7.515 9.850 301 HB3 ASP 39 HB1 ASP 39 -19.796 -7.952 8.151 302 H ASN 40 HN ASN 40 -17.193 -7.232 6.812 303 HA ASN 40 HA ASN 40 -16.413 -9.951 6.109 304 HB2 ASN 40 HB2 ASN 40 -17.050 -7.486 4.534 305 HB3 ASN 40 HB1 ASN 40 -16.060 -8.740 3.804 306 HD21 ASN 40 HD21 ASN 40 -19.237 -7.858 4.878 307 HD22 ASN 40 HD22 ASN 40 -20.052 -9.285 4.226 308 H GLY 41 HN GLY 41 -15.048 -7.281 7.440 309 HA2 GLY 41 HA2 GLY 41 -12.849 -6.972 8.069 310 HA3 GLY 41 HA1 GLY 41 -12.388 -8.295 7.009 311 H VAL 42 HN VAL 42 -14.291 -5.879 5.492 312 HA VAL 42 HA VAL 42 -11.943 -5.096 3.988 313 HB VAL 42 HB VAL 42 -14.871 -4.497 3.447 314 HG11 VAL 42 HG11 VAL 42 -13.453 -2.751 2.530 315 HG12 VAL 42 HG12 VAL 42 -13.996 -3.795 1.211 316 HG13 VAL 42 HG13 VAL 42 -12.358 -3.952 1.849 317 HG21 VAL 42 HG21 VAL 42 -14.595 -6.110 1.618 318 HG22 VAL 42 HG22 VAL 42 -14.301 -6.859 3.191 319 HG23 VAL 42 HG23 VAL 42 -12.942 -6.425 2.151 320 H ASP 43 HN ASP 43 -10.934 -3.284 4.314 321 HA ASP 43 HA ASP 43 -12.321 -0.954 5.399 322 HB2 ASP 43 HB2 ASP 43 -11.243 -2.103 7.346 323 HB3 ASP 43 HB1 ASP 43 -9.692 -1.987 6.524 324 H GLY 44 HN GLY 44 -11.593 0.952 4.427 325 HA2 GLY 44 HA2 GLY 44 -9.129 1.332 3.199 326 HA3 GLY 44 HA1 GLY 44 -10.200 0.649 1.979 327 H GLU 45 HN GLU 45 -9.612 2.852 1.034 328 HA GLU 45 HA GLU 45 -10.841 5.177 2.167 329 HB2 GLU 45 HB2 GLU 45 -8.997 4.622 0.102 330 HB3 GLU 45 HB1 GLU 45 -10.351 5.451 -0.650 331 HG2 GLU 45 HG2 GLU 45 -8.826 6.450 1.747 332 HG3 GLU 45 HG1 GLU 45 -8.562 6.977 0.085 333 H TRP 46 HN TRP 46 -12.585 6.356 1.259 334 HA TRP 46 HA TRP 46 -14.566 4.586 -0.015 335 HB2 TRP 46 HB2 TRP 46 -14.885 6.550 2.243 336 HB3 TRP 46 HB1 TRP 46 -16.247 6.235 1.181 337 HD1 TRP 46 HD1 TRP 46 -13.665 3.989 3.005 338 HE1 TRP 46 HE1 TRP 46 -14.901 2.042 4.123 339 HE3 TRP 46 HE3 TRP 46 -18.503 5.153 1.669 340 HZ2 TRP 46 HZ2 TRP 46 -17.519 1.119 4.417 341 HZ3 TRP 46 HZ3 TRP 46 -20.297 3.674 2.444 342 HH2 TRP 46 HH2 TRP 46 -19.815 1.692 3.784 343 H THR 47 HN THR 47 -15.727 5.317 -1.676 344 HA THR 47 HA THR 47 -15.422 8.106 -2.532 345 HB THR 47 HB THR 47 -15.432 6.780 -4.937 346 HG1 THR 47 HG1 THR 47 -14.240 5.162 -2.978 347 HG21 THR 47 HG21 THR 47 -14.016 8.687 -4.288 348 HG22 THR 47 HG22 THR 47 -13.095 7.422 -5.100 349 HG23 THR 47 HG23 THR 47 -12.995 7.593 -3.350 350 H TYR 48 HN TYR 48 -17.054 8.610 -4.345 351 HA TYR 48 HA TYR 48 -19.431 6.994 -4.341 352 HB2 TYR 48 HB2 TYR 48 -20.009 7.951 -2.285 353 HB3 TYR 48 HB1 TYR 48 -19.297 9.502 -2.659 354 HD1 TYR 48 HD1 TYR 48 -22.246 7.359 -3.003 355 HD2 TYR 48 HD2 TYR 48 -20.623 11.202 -3.915 356 HE1 TYR 48 HE1 TYR 48 -24.498 8.193 -3.532 357 HE2 TYR 48 HE2 TYR 48 -22.866 12.028 -4.438 358 HH TYR 48 HH TYR 48 -25.035 11.185 -5.097 359 H ASP 49 HN ASP 49 -20.978 7.685 -5.909 360 HA ASP 49 HA ASP 49 -19.966 9.849 -7.673 361 HB2 ASP 49 HB2 ASP 49 -20.221 8.633 -9.653 362 HB3 ASP 49 HB1 ASP 49 -19.796 7.303 -8.597 363 H ASP 50 HN ASP 50 -21.705 10.926 -8.880 364 HA ASP 50 HA ASP 50 -24.007 11.168 -7.072 365 HB2 ASP 50 HB2 ASP 50 -22.779 13.227 -7.623 366 HB3 ASP 50 HB1 ASP 50 -23.043 12.937 -9.341 367 H ALA 51 HN ALA 51 -23.362 9.736 -10.121 368 HA ALA 51 HA ALA 51 -26.067 10.211 -11.075 369 HB1 ALA 51 HB1 ALA 51 -24.391 10.356 -12.755 370 HB2 ALA 51 HB2 ALA 51 -25.341 8.905 -13.075 371 HB3 ALA 51 HB3 ALA 51 -23.740 8.773 -12.350 372 H THR 52 HN THR 52 -24.098 7.348 -10.124 373 HA THR 52 HA THR 52 -26.604 5.830 -10.167 374 HB THR 52 HB THR 52 -25.031 3.821 -10.032 375 HG1 THR 52 HG1 THR 52 -23.218 5.699 -9.719 376 HG21 THR 52 HG21 THR 52 -26.183 4.409 -12.087 377 HG22 THR 52 HG22 THR 52 -24.521 3.946 -12.456 378 HG23 THR 52 HG23 THR 52 -24.975 5.651 -12.437 379 H LYS 53 HN LYS 53 -24.654 7.385 -7.979 380 HA LYS 53 HA LYS 53 -24.500 7.382 -5.683 381 HB2 LYS 53 HB2 LYS 53 -27.015 5.749 -6.049 382 HB3 LYS 53 HB1 LYS 53 -26.343 6.049 -4.456 383 HG2 LYS 53 HG2 LYS 53 -28.078 7.647 -4.876 384 HG3 LYS 53 HG1 LYS 53 -26.527 8.480 -4.860 385 HD2 LYS 53 HD2 LYS 53 -26.522 8.473 -7.324 386 HD3 LYS 53 HD1 LYS 53 -28.102 7.687 -7.316 387 HE2 LYS 53 HE2 LYS 53 -29.059 9.589 -6.141 388 HE3 LYS 53 HE1 LYS 53 -27.483 10.373 -6.106 389 HZ1 LYS 53 HZ1 LYS 53 -28.859 11.259 -7.873 390 HZ2 LYS 53 HZ2 LYS 53 -29.053 9.718 -8.546 391 HZ3 LYS 53 HZ3 LYS 53 -27.522 10.449 -8.534 392 H THR 54 HN THR 54 -22.951 5.614 -7.200 393 HA THR 54 HA THR 54 -22.885 3.056 -5.854 394 HB THR 54 HB THR 54 -20.958 4.203 -7.893 395 HG1 THR 54 HG1 THR 54 -22.672 3.901 -9.126 396 HG21 THR 54 HG21 THR 54 -21.406 1.266 -7.449 397 HG22 THR 54 HG22 THR 54 -20.338 2.136 -6.341 398 HG23 THR 54 HG23 THR 54 -19.976 2.101 -8.069 399 H TYR 55 HN TYR 55 -22.117 3.027 -3.841 400 HA TYR 55 HA TYR 55 -19.914 4.738 -3.023 401 HB2 TYR 55 HB2 TYR 55 -21.675 2.787 -1.520 402 HB3 TYR 55 HB1 TYR 55 -20.108 3.231 -0.863 403 HD1 TYR 55 HD1 TYR 55 -19.716 5.322 0.133 404 HD2 TYR 55 HD2 TYR 55 -23.432 4.579 -1.815 405 HE1 TYR 55 HE1 TYR 55 -20.650 7.362 1.130 406 HE2 TYR 55 HE2 TYR 55 -24.367 6.617 -0.811 407 HH TYR 55 HH TYR 55 -22.410 8.941 0.783 408 H THR 56 HN THR 56 -17.851 4.178 -3.108 409 HA THR 56 HA THR 56 -17.253 1.343 -3.593 410 HB THR 56 HB THR 56 -15.030 2.686 -4.527 411 HG1 THR 56 HG1 THR 56 -15.674 4.697 -4.720 412 HG21 THR 56 HG21 THR 56 -16.075 0.878 -5.741 413 HG22 THR 56 HG22 THR 56 -15.944 2.272 -6.809 414 HG23 THR 56 HG23 THR 56 -17.498 1.867 -6.083 415 H VAL 57 HN VAL 57 -16.126 0.359 -2.090 416 HA VAL 57 HA VAL 57 -14.369 1.966 -0.346 417 HB VAL 57 HB VAL 57 -16.125 0.822 0.998 418 HG11 VAL 57 HG11 VAL 57 -15.960 -1.668 1.303 419 HG12 VAL 57 HG12 VAL 57 -14.985 -1.714 -0.160 420 HG13 VAL 57 HG13 VAL 57 -16.657 -1.150 -0.227 421 HG21 VAL 57 HG21 VAL 57 -13.992 1.261 2.028 422 HG22 VAL 57 HG22 VAL 57 -13.335 -0.247 1.395 423 HG23 VAL 57 HG23 VAL 57 -14.619 -0.282 2.604 424 H THR 58 HN THR 58 -12.362 1.827 -0.954 425 HA THR 58 HA THR 58 -11.545 -0.516 -2.528 426 HB THR 58 HB THR 58 -10.158 2.166 -2.406 427 HG1 THR 58 HG1 THR 58 -11.913 2.807 -3.440 428 HG21 THR 58 HG21 THR 58 -10.062 -0.119 -4.385 429 HG22 THR 58 HG22 THR 58 -8.787 0.341 -3.256 430 HG23 THR 58 HG23 THR 58 -9.232 1.425 -4.573 431 H GLU 59 HN GLU 59 -10.467 -1.975 -1.454 432 HA GLU 59 HA GLU 59 -8.978 -1.464 0.935 433 HB2 GLU 59 HB2 GLU 59 -10.117 -3.666 0.260 434 HB3 GLU 59 HB1 GLU 59 -8.790 -3.881 -0.867 435 HG2 GLU 59 HG2 GLU 59 -8.396 -3.634 2.096 436 HG3 GLU 59 HG1 GLU 59 -8.637 -5.163 1.270 437 H GLY 60 HN GLY 60 -7.104 -0.177 0.689 438 HA2 GLY 60 HA2 GLY 60 -5.259 -1.094 -1.413 439 HA3 GLY 60 HA1 GLY 60 -5.642 0.616 -1.279 440 H SER 61 HN SER 61 -3.722 -1.923 -0.204 441 HA SER 61 HA SER 61 -2.319 -0.082 1.604 442 HB2 SER 61 HB2 SER 61 -3.492 -2.050 2.742 443 HB3 SER 61 HB1 SER 61 -2.360 -3.101 1.895 444 HG SER 61 HG SER 61 -1.709 -1.032 3.730 445 H GLY 62 HN GLY 62 -1.968 -3.054 -0.324 446 HA2 GLY 62 HA2 GLY 62 -0.503 -3.558 -2.011 447 HA3 GLY 62 HA1 GLY 62 -0.004 -1.878 -2.007 448 H GLY 63 HN GLY 63 2.038 -3.246 -2.518 449 HA2 GLY 63 HA2 GLY 63 3.473 -3.572 0.037 450 HA3 GLY 63 HA1 GLY 63 3.686 -4.712 -1.287 451 H ALA 64 HN ALA 64 3.239 -1.349 -1.955 452 HA ALA 64 HA ALA 64 5.944 -1.256 -3.054 453 HB1 ALA 64 HB1 ALA 64 3.691 0.723 -3.391 454 HB2 ALA 64 HB2 ALA 64 4.062 -0.593 -4.502 455 HB3 ALA 64 HB3 ALA 64 5.224 0.711 -4.264 456 H GLY 65 HN GLY 65 7.470 0.242 -2.433 457 HA2 GLY 65 HA2 GLY 65 8.453 1.909 -1.164 458 HA3 GLY 65 HA1 GLY 65 6.863 2.307 -0.522 459 H GLY 66 HN GLY 66 8.314 -0.881 -0.414 460 HA2 GLY 66 HA2 GLY 66 8.030 -0.943 2.459 461 HA3 GLY 66 HA1 GLY 66 8.589 -2.260 1.432 462 H GLN 67 HN GLN 67 10.538 -0.416 0.172 463 HA GLN 67 HA GLN 67 12.701 0.204 0.335 464 HB2 GLN 67 HB2 GLN 67 11.675 1.794 2.054 465 HB3 GLN 67 HB1 GLN 67 12.240 0.653 3.300 466 HG2 GLN 67 HG2 GLN 67 14.527 1.009 2.655 467 HG3 GLN 67 HG1 GLN 67 14.032 2.007 1.286 468 HE21 GLN 67 HE21 GLN 67 15.763 2.693 3.508 469 HE22 GLN 67 HE22 GLN 67 15.042 4.068 4.276 470 H GLY 68 HN GLY 68 13.482 -1.831 -0.152 471 HA2 GLY 68 HA2 GLY 68 14.381 -3.391 2.190 472 HA3 GLY 68 HA1 GLY 68 13.725 -4.166 0.756 473 H MET 69 HN MET 69 16.136 -4.927 1.658 474 HA MET 69 HA MET 69 18.132 -3.578 -0.041 475 HB2 MET 69 HB2 MET 69 18.635 -5.617 2.158 476 HB3 MET 69 HB1 MET 69 19.850 -4.740 1.246 477 HG2 MET 69 HG2 MET 69 19.210 -2.665 2.225 478 HG3 MET 69 HG1 MET 69 17.816 -3.405 3.009 479 HE1 MET 69 HE1 MET 69 18.632 -2.241 5.305 480 HE2 MET 69 HE2 MET 69 20.031 -1.577 4.458 481 HE3 MET 69 HE3 MET 69 20.254 -2.462 5.967 482 H ILE 70 HN ILE 70 18.428 -4.507 -1.997 483 HA ILE 70 HA ILE 70 17.981 -7.413 -2.219 484 HB ILE 70 HB ILE 70 17.315 -5.355 -4.364 485 HG12 ILE 70 HG12 ILE 70 15.463 -7.048 -2.671 486 HG13 ILE 70 HG11 ILE 70 15.757 -5.328 -2.429 487 HG21 ILE 70 HG21 ILE 70 18.055 -7.566 -5.244 488 HG22 ILE 70 HG22 ILE 70 16.372 -7.193 -5.629 489 HG23 ILE 70 HG23 ILE 70 16.747 -8.326 -4.334 490 HD11 ILE 70 HD11 ILE 70 13.668 -5.693 -3.594 491 HD12 ILE 70 HD12 ILE 70 14.506 -6.596 -4.857 492 HD13 ILE 70 HD13 ILE 70 14.820 -4.873 -4.649 493 H GLN 71 HN GLN 71 19.790 -4.622 -3.275 494 HA GLN 71 HA GLN 71 21.488 -6.074 -5.099 495 HB2 GLN 71 HB2 GLN 71 20.788 -3.535 -5.094 496 HB3 GLN 71 HB1 GLN 71 22.177 -3.359 -4.027 497 HG2 GLN 71 HG2 GLN 71 22.789 -2.887 -6.321 498 HG3 GLN 71 HG1 GLN 71 23.623 -4.323 -5.728 499 HE21 GLN 71 HE21 GLN 71 23.999 -5.059 -7.826 500 HE22 GLN 71 HE22 GLN 71 22.739 -5.733 -8.800 501 H GLU 72 HN GLU 72 21.382 -6.889 -2.257 502 HA GLU 72 HA GLU 72 23.607 -6.091 -0.775 503 HB2 GLU 72 HB2 GLU 72 22.096 -8.699 -0.788 504 HB3 GLU 72 HB1 GLU 72 23.337 -8.299 0.390 505 HG2 GLU 72 HG2 GLU 72 20.680 -6.957 -0.013 506 HG3 GLU 72 HG1 GLU 72 21.254 -7.840 1.398 507 HA PRO 73 HA PRO 73 26.966 -8.053 -2.909 508 HB2 PRO 73 HB2 PRO 73 28.860 -7.806 -1.000 509 HB3 PRO 73 HB1 PRO 73 28.254 -6.388 -1.930 510 HG2 PRO 73 HG2 PRO 73 27.502 -7.315 0.832 511 HG3 PRO 73 HG1 PRO 73 27.826 -5.667 0.256 512 HD2 PRO 73 HD2 PRO 73 25.313 -6.686 0.596 513 HD3 PRO 73 HD1 PRO 73 25.712 -5.429 -0.621 514 H ALA 74 HN ALA 74 28.645 -9.753 -2.446 515 HA ALA 74 HA ALA 74 28.310 -11.545 -0.305 516 HB1 ALA 74 HB1 ALA 74 26.239 -12.151 -1.406 517 HB2 ALA 74 HB2 ALA 74 27.396 -13.476 -1.557 518 HB3 ALA 74 HB3 ALA 74 27.092 -12.407 -2.927 519 H LEU 75 HN LEU 75 29.678 -13.429 -0.486 520 HA LEU 75 HA LEU 75 32.018 -12.907 -2.133 521 HB2 LEU 75 HB2 LEU 75 31.480 -14.819 0.129 522 HB3 LEU 75 HB1 LEU 75 32.927 -14.913 -0.844 523 HG LEU 75 HG LEU 75 33.468 -13.775 1.183 524 HD11 LEU 75 HD11 LEU 75 34.300 -11.638 0.330 525 HD12 LEU 75 HD12 LEU 75 33.258 -11.795 -1.085 526 HD13 LEU 75 HD13 LEU 75 34.566 -12.948 -0.823 527 HD21 LEU 75 HD21 LEU 75 31.226 -13.029 1.816 528 HD22 LEU 75 HD22 LEU 75 31.264 -11.818 0.532 529 HD23 LEU 75 HD23 LEU 75 32.388 -11.704 1.884 530 HA PRO 76 HA PRO 76 30.963 -16.092 -5.143 531 HB2 PRO 76 HB2 PRO 76 33.781 -17.044 -4.903 532 HB3 PRO 76 HB1 PRO 76 32.895 -16.602 -6.363 533 HG2 PRO 76 HG2 PRO 76 34.793 -15.010 -5.333 534 HG3 PRO 76 HG1 PRO 76 33.309 -14.341 -6.100 535 HD2 PRO 76 HD2 PRO 76 34.041 -14.514 -3.208 536 HD3 PRO 76 HD1 PRO 76 33.085 -13.308 -4.063 537 HA PRO 77 HA PRO 77 29.890 -19.561 -2.629 538 HB2 PRO 77 HB2 PRO 77 30.457 -21.006 -5.208 539 HB3 PRO 77 HB1 PRO 77 29.083 -21.207 -4.108 540 HG2 PRO 77 HG2 PRO 77 28.722 -19.801 -6.273 541 HG3 PRO 77 HG1 PRO 77 28.157 -19.139 -4.721 542 HD2 PRO 77 HD2 PRO 77 30.642 -18.411 -6.290 543 HD3 PRO 77 HD1 PRO 77 29.470 -17.343 -5.427 544 H GLY 78 HN GLY 78 31.132 -20.545 -1.209 545 HA2 GLY 78 HA2 GLY 78 32.749 -22.122 -0.519 546 HA3 GLY 78 HA1 GLY 78 33.494 -22.030 -2.106 547 H TRP 79 HN TRP 79 33.464 -18.969 -1.855 548 HA TRP 79 HA TRP 79 36.064 -18.829 -0.507 549 HB2 TRP 79 HB2 TRP 79 34.520 -16.823 -2.181 550 HB3 TRP 79 HB1 TRP 79 36.034 -16.441 -1.379 551 HD1 TRP 79 HD1 TRP 79 34.654 -18.726 -4.174 552 HE1 TRP 79 HE1 TRP 79 36.595 -19.311 -5.761 553 HE3 TRP 79 HE3 TRP 79 38.496 -16.554 -1.579 554 HZ2 TRP 79 HZ2 TRP 79 39.380 -18.890 -5.892 555 HZ3 TRP 79 HZ3 TRP 79 40.769 -16.689 -2.511 556 HH2 TRP 79 HH2 TRP 79 41.199 -17.832 -4.624 557 H GLU 80 HN GLU 80 36.361 -17.983 1.509 558 HA GLU 80 HA GLU 80 34.081 -16.658 2.806 559 HB2 GLU 80 HB2 GLU 80 36.369 -18.314 3.870 560 HB3 GLU 80 HB1 GLU 80 35.386 -17.312 4.922 561 HG2 GLU 80 HG2 GLU 80 34.136 -19.377 3.154 562 HG3 GLU 80 HG1 GLU 80 34.831 -19.805 4.716 563 H MET 81 HN MET 81 34.370 -14.690 3.739 564 HA MET 81 HA MET 81 37.012 -13.442 3.443 565 HB2 MET 81 HB2 MET 81 35.119 -12.533 2.029 566 HB3 MET 81 HB1 MET 81 34.332 -12.027 3.543 567 HG2 MET 81 HG2 MET 81 37.094 -11.131 2.768 568 HG3 MET 81 HG1 MET 81 35.647 -10.282 2.243 569 HE1 MET 81 HE1 MET 81 33.881 -9.190 3.999 570 HE2 MET 81 HE2 MET 81 34.119 -9.243 5.745 571 HE3 MET 81 HE3 MET 81 33.801 -10.733 4.855 572 H LYS 82 HN LYS 82 37.928 -12.568 5.302 573 HA LYS 82 HA LYS 82 36.324 -12.255 7.677 574 HB2 LYS 82 HB2 LYS 82 38.382 -14.485 7.502 575 HB3 LYS 82 HB1 LYS 82 37.881 -13.787 9.026 576 HG2 LYS 82 HG2 LYS 82 35.772 -14.688 8.938 577 HG3 LYS 82 HG1 LYS 82 35.785 -14.770 7.151 578 HD2 LYS 82 HD2 LYS 82 37.159 -16.688 7.159 579 HD3 LYS 82 HD1 LYS 82 37.588 -16.485 8.858 580 HE2 LYS 82 HE2 LYS 82 35.896 -18.307 8.283 581 HE3 LYS 82 HE1 LYS 82 35.486 -17.207 9.590 582 HZ1 LYS 82 HZ1 LYS 82 33.554 -17.068 8.472 583 HZ2 LYS 82 HZ2 LYS 82 34.225 -17.545 6.991 584 HZ3 LYS 82 HZ3 LYS 82 34.388 -15.943 7.518 585 H TYR 83 HN TYR 83 37.526 -11.231 9.442 586 HA TYR 83 HA TYR 83 39.861 -9.738 8.398 587 HB2 TYR 83 HB2 TYR 83 37.797 -8.907 10.488 588 HB3 TYR 83 HB1 TYR 83 39.213 -7.932 10.014 589 HD1 TYR 83 HD1 TYR 83 39.275 -6.880 7.787 590 HD2 TYR 83 HD2 TYR 83 35.840 -8.991 9.142 591 HE1 TYR 83 HE1 TYR 83 37.943 -5.860 5.989 592 HE2 TYR 83 HE2 TYR 83 34.499 -7.978 7.346 593 HH TYR 83 HH TYR 83 35.799 -6.521 4.703 594 H THR 84 HN THR 84 41.519 -9.184 9.939 595 HA THR 84 HA THR 84 41.848 -11.167 12.059 596 HB THR 84 HB THR 84 44.144 -10.468 12.219 597 HG1 THR 84 HG1 THR 84 44.822 -8.601 10.869 598 HG21 THR 84 HG21 THR 84 43.334 -10.411 9.307 599 HG22 THR 84 HG22 THR 84 43.730 -11.837 10.262 600 HG23 THR 84 HG23 THR 84 44.977 -10.645 9.905 601 H SER 85 HN SER 85 42.758 -10.199 14.210 602 HA SER 85 HA SER 85 40.769 -8.369 15.153 603 HB2 SER 85 HB2 SER 85 42.168 -8.643 17.328 604 HB3 SER 85 HB1 SER 85 41.308 -10.044 16.683 605 HG SER 85 HG SER 85 43.148 -10.958 16.124 606 H GLU 86 HN GLU 86 43.060 -7.497 13.282 607 HA GLU 86 HA GLU 86 43.929 -5.138 14.858 608 HB2 GLU 86 HB2 GLU 86 45.735 -6.869 14.238 609 HB3 GLU 86 HB1 GLU 86 45.488 -6.367 12.570 610 HG2 GLU 86 HG2 GLU 86 47.345 -5.165 13.369 611 HG3 GLU 86 HG1 GLU 86 45.996 -4.031 13.307 612 H GLY 87 HN GLY 87 41.965 -6.221 12.459 613 HA2 GLY 87 HA2 GLY 87 40.662 -4.840 11.080 614 HA3 GLY 87 HA1 GLY 87 41.893 -3.596 11.190 615 H VAL 88 HN VAL 88 43.313 -6.568 10.481 616 HA VAL 88 HA VAL 88 43.756 -5.728 7.729 617 HB VAL 88 HB VAL 88 44.941 -8.068 9.245 618 HG11 VAL 88 HG11 VAL 88 46.649 -8.053 7.459 619 HG12 VAL 88 HG12 VAL 88 45.711 -6.826 6.607 620 HG13 VAL 88 HG13 VAL 88 45.036 -8.436 6.856 621 HG21 VAL 88 HG21 VAL 88 45.613 -6.018 10.299 622 HG22 VAL 88 HG22 VAL 88 46.007 -5.297 8.742 623 HG23 VAL 88 HG23 VAL 88 46.977 -6.635 9.362 624 H ARG 89 HN ARG 89 43.254 -7.063 5.921 625 HA ARG 89 HA ARG 89 40.945 -8.818 6.426 626 HB2 ARG 89 HB2 ARG 89 40.818 -6.676 4.993 627 HB3 ARG 89 HB1 ARG 89 41.703 -7.591 3.786 628 HG2 ARG 89 HG2 ARG 89 39.916 -9.254 3.731 629 HG3 ARG 89 HG1 ARG 89 39.022 -8.320 4.936 630 HD2 ARG 89 HD2 ARG 89 39.178 -6.371 3.314 631 HD3 ARG 89 HD1 ARG 89 39.722 -7.544 2.119 632 HE ARG 89 HE ARG 89 37.378 -8.559 3.123 633 HH11 ARG 89 HH11 ARG 89 38.383 -5.626 1.492 634 HH12 ARG 89 HH12 ARG 89 36.812 -5.336 0.793 635 HH21 ARG 89 HH21 ARG 89 35.306 -8.161 2.178 636 HH22 ARG 89 HH22 ARG 89 35.095 -6.767 1.174 637 H TYR 90 HN TYR 90 40.943 -10.911 5.739 638 HA TYR 90 HA TYR 90 42.976 -11.763 3.831 639 HB2 TYR 90 HB2 TYR 90 43.805 -13.580 5.185 640 HB3 TYR 90 HB1 TYR 90 43.949 -12.096 6.105 641 HD1 TYR 90 HD1 TYR 90 42.290 -11.638 7.944 642 HD2 TYR 90 HD2 TYR 90 42.589 -15.423 6.037 643 HE1 TYR 90 HE1 TYR 90 41.161 -12.681 9.860 644 HE2 TYR 90 HE2 TYR 90 41.456 -16.480 7.945 645 HH TYR 90 HH TYR 90 39.928 -14.655 10.435 646 H PHE 91 HN PHE 91 42.438 -14.021 2.972 647 HA PHE 91 HA PHE 91 39.531 -14.410 3.136 648 HB2 PHE 91 HB2 PHE 91 41.359 -14.444 0.772 649 HB3 PHE 91 HB1 PHE 91 39.934 -15.474 0.769 650 HD1 PHE 91 HD1 PHE 91 37.983 -14.611 -0.125 651 HD2 PHE 91 HD2 PHE 91 40.862 -11.943 1.534 652 HE1 PHE 91 HE1 PHE 91 36.622 -12.695 -0.835 653 HE2 PHE 91 HE2 PHE 91 39.490 -10.031 0.829 654 HZ PHE 91 HZ PHE 91 37.301 -10.438 -0.322 655 H VAL 92 HN VAL 92 38.729 -16.534 2.867 656 HA VAL 92 HA VAL 92 40.657 -18.629 3.627 657 HB VAL 92 HB VAL 92 37.864 -18.252 4.732 658 HG11 VAL 92 HG11 VAL 92 39.953 -20.289 5.490 659 HG12 VAL 92 HG12 VAL 92 38.496 -20.613 4.550 660 HG13 VAL 92 HG13 VAL 92 38.364 -20.086 6.231 661 HG21 VAL 92 HG21 VAL 92 38.948 -17.757 6.853 662 HG22 VAL 92 HG22 VAL 92 39.427 -16.601 5.608 663 HG23 VAL 92 HG23 VAL 92 40.529 -17.893 6.084 664 H ASP 93 HN ASP 93 40.626 -20.296 2.220 665 HA ASP 93 HA ASP 93 38.372 -20.539 0.347 666 HB2 ASP 93 HB2 ASP 93 41.179 -21.533 0.422 667 HB3 ASP 93 HB1 ASP 93 40.008 -22.690 -0.201 668 H HIS 94 HN HIS 94 36.591 -21.568 1.255 669 HA HIS 94 HA HIS 94 36.854 -23.335 3.485 670 HB2 HIS 94 HB2 HIS 94 34.893 -21.806 2.993 671 HB3 HIS 94 HB1 HIS 94 34.398 -22.962 1.761 672 HD1 HIS 94 HD1 HIS 94 32.410 -24.115 2.698 673 HD2 HIS 94 HD2 HIS 94 35.458 -23.712 5.503 674 HE1 HIS 94 HE1 HIS 94 31.618 -25.336 4.748 675 HE2 HIS 94 HE2 HIS 94 33.380 -24.893 6.501 676 H ASN 95 HN ASN 95 37.608 -23.951 0.400 677 HA ASN 95 HA ASN 95 36.428 -26.614 0.260 678 HB2 ASN 95 HB2 ASN 95 37.555 -26.740 -1.986 679 HB3 ASN 95 HB1 ASN 95 36.419 -25.399 -1.846 680 HD21 ASN 95 HD21 ASN 95 37.187 -23.309 -1.847 681 HD22 ASN 95 HD22 ASN 95 38.825 -22.906 -2.262 682 H THR 96 HN THR 96 39.715 -25.188 0.249 683 HA THR 96 HA THR 96 40.751 -27.815 0.962 684 HB THR 96 HB THR 96 43.009 -26.682 0.604 685 HG1 THR 96 HG1 THR 96 41.750 -24.789 -1.002 686 HG21 THR 96 HG21 THR 96 41.994 -28.188 -1.042 687 HG22 THR 96 HG22 THR 96 42.850 -26.864 -1.832 688 HG23 THR 96 HG23 THR 96 41.091 -26.837 -1.726 689 H ARG 97 HN ARG 97 39.801 -24.952 2.422 690 HA ARG 97 HA ARG 97 39.766 -24.309 4.624 691 HB2 ARG 97 HB2 ARG 97 41.312 -26.845 5.198 692 HB3 ARG 97 HB1 ARG 97 40.436 -25.854 6.362 693 HG2 ARG 97 HG2 ARG 97 38.337 -26.415 5.369 694 HG3 ARG 97 HG1 ARG 97 39.148 -27.216 4.025 695 HD2 ARG 97 HD2 ARG 97 38.202 -28.730 5.818 696 HD3 ARG 97 HD1 ARG 97 39.893 -28.989 5.387 697 HE ARG 97 HE ARG 97 39.849 -27.210 7.519 698 HH11 ARG 97 HH11 ARG 97 38.952 -30.527 6.893 699 HH12 ARG 97 HH12 ARG 97 39.320 -31.067 8.506 700 HH21 ARG 97 HH21 ARG 97 40.297 -27.907 9.644 701 HH22 ARG 97 HH22 ARG 97 40.057 -29.568 10.066 702 H THR 98 HN THR 98 41.760 -23.600 2.772 703 HA THR 98 HA THR 98 44.180 -23.280 4.390 704 HB THR 98 HB THR 98 45.090 -22.312 2.176 705 HG1 THR 98 HG1 THR 98 43.226 -23.771 0.761 706 HG21 THR 98 HG21 THR 98 44.191 -25.204 2.266 707 HG22 THR 98 HG22 THR 98 45.673 -24.570 2.982 708 HG23 THR 98 HG23 THR 98 45.464 -24.563 1.226 709 H THR 99 HN THR 99 45.196 -21.126 4.555 710 HA THR 99 HA THR 99 43.178 -18.962 4.525 711 HB THR 99 HB THR 99 44.985 -17.853 6.076 712 HG1 THR 99 HG1 THR 99 46.652 -19.066 6.501 713 HG21 THR 99 HG21 THR 99 42.802 -18.587 6.965 714 HG22 THR 99 HG22 THR 99 44.078 -19.069 8.089 715 HG23 THR 99 HG23 THR 99 43.364 -20.259 7.003 716 H THR 100 HN THR 100 43.410 -17.800 2.607 717 HA THR 100 HA THR 100 46.160 -17.374 1.663 718 HB THR 100 HB THR 100 44.667 -18.680 0.107 719 HG1 THR 100 HG1 THR 100 45.415 -17.492 -1.708 720 HG21 THR 100 HG21 THR 100 42.537 -17.645 0.271 721 HG22 THR 100 HG22 THR 100 43.151 -17.190 -1.316 722 HG23 THR 100 HG23 THR 100 43.215 -16.036 0.014 723 H PHE 101 HN PHE 101 46.588 -15.341 0.592 724 HA PHE 101 HA PHE 101 45.022 -13.160 1.798 725 HB2 PHE 101 HB2 PHE 101 47.790 -13.737 2.027 726 HB3 PHE 101 HB1 PHE 101 47.644 -12.290 0.939 727 HD1 PHE 101 HD1 PHE 101 46.444 -10.281 1.790 728 HD2 PHE 101 HD2 PHE 101 47.420 -13.550 4.322 729 HE1 PHE 101 HE1 PHE 101 46.131 -8.833 3.762 730 HE2 PHE 101 HE2 PHE 101 47.103 -12.117 6.293 731 HZ PHE 101 HZ PHE 101 46.441 -9.746 6.003 732 H LYS 102 HN LYS 102 43.660 -12.603 0.178 733 HA LYS 102 HA LYS 102 44.901 -11.589 -2.267 734 HB2 LYS 102 HB2 LYS 102 43.930 -13.865 -2.723 735 HB3 LYS 102 HB1 LYS 102 42.350 -13.221 -2.290 736 HG2 LYS 102 HG2 LYS 102 42.390 -11.702 -4.132 737 HG3 LYS 102 HG1 LYS 102 44.065 -12.117 -4.498 738 HD2 LYS 102 HD2 LYS 102 42.728 -13.284 -6.067 739 HD3 LYS 102 HD1 LYS 102 43.275 -14.476 -4.890 740 HE2 LYS 102 HE2 LYS 102 40.973 -14.894 -5.337 741 HE3 LYS 102 HE1 LYS 102 41.088 -14.212 -3.716 742 HZ1 LYS 102 HZ1 LYS 102 40.499 -12.542 -6.089 743 HZ2 LYS 102 HZ2 LYS 102 40.272 -12.160 -4.454 744 HZ3 LYS 102 HZ3 LYS 102 39.278 -13.311 -5.204 745 H ASP 103 HN ASP 103 44.583 -9.483 -1.920 746 HA ASP 103 HA ASP 103 42.022 -8.586 -0.801 747 HB2 ASP 103 HB2 ASP 103 44.162 -7.846 0.268 748 HB3 ASP 103 HB1 ASP 103 44.574 -7.014 -1.227 749 HA PRO 104 HA PRO 104 40.473 -7.058 -4.669 750 HB2 PRO 104 HB2 PRO 104 39.719 -4.573 -3.240 751 HB3 PRO 104 HB1 PRO 104 38.680 -5.698 -4.114 752 HG2 PRO 104 HG2 PRO 104 38.815 -5.495 -1.383 753 HG3 PRO 104 HG1 PRO 104 38.268 -6.940 -2.246 754 HD2 PRO 104 HD2 PRO 104 40.731 -6.486 -0.736 755 HD3 PRO 104 HD1 PRO 104 40.014 -8.009 -1.283 756 H ARG 105 HN ARG 105 42.586 -5.123 -2.643 757 HA ARG 105 HA ARG 105 43.348 -3.384 -4.866 758 HB2 ARG 105 HB2 ARG 105 43.776 -3.449 -1.951 759 HB3 ARG 105 HB1 ARG 105 45.142 -2.888 -2.889 760 HG2 ARG 105 HG2 ARG 105 43.835 -1.025 -2.131 761 HG3 ARG 105 HG1 ARG 105 43.732 -1.147 -3.892 762 HD2 ARG 105 HD2 ARG 105 41.525 -2.074 -3.762 763 HD3 ARG 105 HD1 ARG 105 41.647 -2.250 -2.011 764 HE ARG 105 HE ARG 105 42.029 0.421 -2.454 765 HH11 ARG 105 HH11 ARG 105 39.473 -1.837 -3.299 766 HH12 ARG 105 HH12 ARG 105 38.215 -0.645 -3.202 767 HH21 ARG 105 HH21 ARG 105 40.393 1.978 -2.344 768 HH22 ARG 105 HH22 ARG 105 38.748 1.547 -2.694 769 HA PRO 106 HA PRO 106 46.590 -6.524 -5.593 770 HB2 PRO 106 HB2 PRO 106 47.066 -5.332 -8.186 771 HB3 PRO 106 HB1 PRO 106 46.367 -6.948 -7.793 772 HG2 PRO 106 HG2 PRO 106 44.979 -4.819 -8.905 773 HG3 PRO 106 HG1 PRO 106 44.251 -6.195 -8.067 774 HD2 PRO 106 HD2 PRO 106 44.707 -3.412 -7.124 775 HD3 PRO 106 HD1 PRO 106 43.420 -4.590 -6.697 776 H GLY 107 HN GLY 107 48.638 -6.267 -4.958 777 HA2 GLY 107 HA2 GLY 107 50.739 -5.390 -4.742 778 HA3 GLY 107 HA1 GLY 107 50.348 -4.306 -6.092 779 H PHE 108 HN PHE 108 48.283 -3.969 -3.292 780 HA PHE 108 HA PHE 108 49.054 -1.287 -2.946 781 HB2 PHE 108 HB2 PHE 108 47.706 -1.212 -0.916 782 HB3 PHE 108 HB1 PHE 108 46.814 -2.098 -2.195 783 HD1 PHE 108 HD1 PHE 108 46.569 -4.549 -2.007 784 HD2 PHE 108 HD2 PHE 108 48.359 -2.281 1.121 785 HE1 PHE 108 HE1 PHE 108 46.243 -6.430 -0.456 786 HE2 PHE 108 HE2 PHE 108 48.035 -4.156 2.669 787 HZ PHE 108 HZ PHE 108 47.003 -6.197 1.936 788 H GLU 109 HN GLU 109 50.146 -4.237 -1.500 789 HA GLU 109 HA GLU 109 51.985 -4.778 -0.299 790 HB2 GLU 109 HB2 GLU 109 53.074 -3.183 -1.938 791 HB3 GLU 109 HB1 GLU 109 52.922 -1.937 -0.713 792 HG2 GLU 109 HG2 GLU 109 55.157 -2.913 -0.775 793 HG3 GLU 109 HG1 GLU 109 54.368 -3.167 0.783 Start of MODEL 14 1 H1 GLY 1 HT1 GLY 1 -42.229 8.914 2.188 2 H2 GLY 1 HT2 GLY 1 -43.491 8.583 1.109 3 H3 GLY 1 HT3 GLY 1 -43.168 10.184 1.561 4 HA2 GLY 1 HA1 GLY 1 -42.321 9.846 -0.624 5 HA3 GLY 1 HA2 GLY 1 -40.976 10.039 0.491 6 H SER 2 HN SER 2 -39.954 8.972 -1.462 7 HA SER 2 HA SER 2 -40.334 6.060 -1.445 8 HB2 SER 2 HB2 SER 2 -38.796 7.752 -3.427 9 HB3 SER 2 HB1 SER 2 -39.216 6.047 -3.595 10 HG SER 2 HG SER 2 -41.348 6.599 -3.838 11 H HIS 3 HN HIS 3 -38.041 5.027 -2.142 12 HA HIS 3 HA HIS 3 -36.106 5.985 -0.134 13 HB2 HIS 3 HB2 HIS 3 -35.288 3.679 0.063 14 HB3 HIS 3 HB1 HIS 3 -37.026 3.704 0.346 15 HD1 HIS 3 HD1 HIS 3 -34.531 2.778 -2.364 16 HD2 HIS 3 HD2 HIS 3 -38.467 2.029 -1.260 17 HE1 HIS 3 HE1 HIS 3 -35.330 0.973 -3.920 18 HE2 HIS 3 HE2 HIS 3 -37.626 0.367 -3.066 19 H MET 4 HN MET 4 -33.790 5.513 -0.709 20 HA MET 4 HA MET 4 -33.392 5.801 -3.619 21 HB2 MET 4 HB2 MET 4 -31.502 6.631 -1.389 22 HB3 MET 4 HB1 MET 4 -31.240 6.872 -3.104 23 HG2 MET 4 HG2 MET 4 -33.212 8.344 -3.183 24 HG3 MET 4 HG1 MET 4 -33.387 8.154 -1.441 25 HE1 MET 4 HE1 MET 4 -31.131 9.571 -4.342 26 HE2 MET 4 HE2 MET 4 -30.080 8.420 -3.519 27 HE3 MET 4 HE3 MET 4 -29.731 10.145 -3.435 28 H GLN 5 HN GLN 5 -32.117 4.337 -4.669 29 HA GLN 5 HA GLN 5 -31.313 2.004 -3.104 30 HB2 GLN 5 HB2 GLN 5 -32.613 1.600 -5.136 31 HB3 GLN 5 HB1 GLN 5 -31.406 2.446 -6.098 32 HG2 GLN 5 HG2 GLN 5 -29.746 0.716 -5.342 33 HG3 GLN 5 HG1 GLN 5 -31.104 -0.168 -4.644 34 HE21 GLN 5 HE21 GLN 5 -32.601 -1.151 -5.988 35 HE22 GLN 5 HE22 GLN 5 -32.290 -1.401 -7.699 36 H TYR 6 HN TYR 6 -29.293 1.888 -2.381 37 HA TYR 6 HA TYR 6 -27.235 3.380 -3.852 38 HB2 TYR 6 HB2 TYR 6 -27.343 2.560 -0.929 39 HB3 TYR 6 HB1 TYR 6 -25.831 3.050 -1.686 40 HD1 TYR 6 HD1 TYR 6 -25.500 5.371 -2.393 41 HD2 TYR 6 HD2 TYR 6 -29.102 4.169 -0.454 42 HE1 TYR 6 HE1 TYR 6 -26.057 7.729 -1.974 43 HE2 TYR 6 HE2 TYR 6 -29.658 6.525 -0.033 44 HH TYR 6 HH TYR 6 -28.449 8.702 0.177 45 H LYS 7 HN LYS 7 -25.057 2.322 -3.847 46 HA LYS 7 HA LYS 7 -25.238 -0.576 -3.977 47 HB2 LYS 7 HB2 LYS 7 -25.858 -0.078 -6.234 48 HB3 LYS 7 HB1 LYS 7 -24.616 1.168 -6.388 49 HG2 LYS 7 HG2 LYS 7 -22.884 -0.512 -6.440 50 HG3 LYS 7 HG1 LYS 7 -24.063 -1.792 -6.137 51 HD2 LYS 7 HD2 LYS 7 -24.059 0.029 -8.540 52 HD3 LYS 7 HD1 LYS 7 -23.446 -1.628 -8.517 53 HE2 LYS 7 HE2 LYS 7 -25.722 -2.368 -7.780 54 HE3 LYS 7 HE1 LYS 7 -26.284 -0.717 -8.045 55 HZ1 LYS 7 HZ1 LYS 7 -26.756 -2.124 -9.937 56 HZ2 LYS 7 HZ2 LYS 7 -25.113 -2.508 -10.107 57 HZ3 LYS 7 HZ3 LYS 7 -25.646 -0.916 -10.371 58 H LEU 8 HN LEU 8 -23.381 -1.587 -3.430 59 HA LEU 8 HA LEU 8 -21.020 0.149 -2.996 60 HB2 LEU 8 HB2 LEU 8 -22.231 -0.663 -0.892 61 HB3 LEU 8 HB1 LEU 8 -21.747 -2.276 -1.344 62 HG LEU 8 HG LEU 8 -19.356 -1.503 -1.230 63 HD11 LEU 8 HD11 LEU 8 -20.704 0.927 -0.071 64 HD12 LEU 8 HD12 LEU 8 -19.471 0.858 -1.332 65 HD13 LEU 8 HD13 LEU 8 -19.049 0.480 0.333 66 HD21 LEU 8 HD21 LEU 8 -20.149 -2.857 0.491 67 HD22 LEU 8 HD22 LEU 8 -21.201 -1.592 1.116 68 HD23 LEU 8 HD23 LEU 8 -19.452 -1.463 1.314 69 H ILE 9 HN ILE 9 -19.043 -0.641 -3.597 70 HA ILE 9 HA ILE 9 -18.947 -3.367 -4.726 71 HB ILE 9 HB ILE 9 -17.236 -1.016 -5.609 72 HG12 ILE 9 HG12 ILE 9 -19.460 -2.267 -7.262 73 HG13 ILE 9 HG11 ILE 9 -19.708 -0.834 -6.209 74 HG21 ILE 9 HG21 ILE 9 -17.619 -3.761 -6.765 75 HG22 ILE 9 HG22 ILE 9 -16.178 -3.170 -5.930 76 HG23 ILE 9 HG23 ILE 9 -16.654 -2.478 -7.482 77 HD11 ILE 9 HD11 ILE 9 -19.320 -0.257 -8.581 78 HD12 ILE 9 HD12 ILE 9 -17.721 -1.000 -8.480 79 HD13 ILE 9 HD13 ILE 9 -18.096 0.423 -7.509 80 H LEU 10 HN LEU 10 -17.637 -4.681 -3.636 81 HA LEU 10 HA LEU 10 -15.748 -3.445 -1.778 82 HB2 LEU 10 HB2 LEU 10 -16.509 -6.357 -1.921 83 HB3 LEU 10 HB1 LEU 10 -15.475 -5.620 -0.727 84 HG LEU 10 HG LEU 10 -17.399 -5.849 0.461 85 HD11 LEU 10 HD11 LEU 10 -16.752 -3.521 0.497 86 HD12 LEU 10 HD12 LEU 10 -18.479 -3.765 0.756 87 HD13 LEU 10 HD13 LEU 10 -17.900 -3.200 -0.814 88 HD21 LEU 10 HD21 LEU 10 -18.689 -6.710 -1.512 89 HD22 LEU 10 HD22 LEU 10 -19.121 -5.035 -1.863 90 HD23 LEU 10 HD23 LEU 10 -19.626 -5.778 -0.347 91 H ASN 11 HN ASN 11 -13.985 -2.916 -2.845 92 HA ASN 11 HA ASN 11 -12.810 -4.890 -4.663 93 HB2 ASN 11 HB2 ASN 11 -11.560 -2.200 -4.129 94 HB3 ASN 11 HB1 ASN 11 -11.550 -3.147 -5.607 95 HD21 ASN 11 HD21 ASN 11 -13.348 -0.932 -3.646 96 HD22 ASN 11 HD22 ASN 11 -14.479 -0.478 -4.869 97 H GLY 12 HN GLY 12 -12.163 -6.368 -3.086 98 HA2 GLY 12 HA2 GLY 12 -9.648 -5.639 -1.781 99 HA3 GLY 12 HA1 GLY 12 -10.948 -6.239 -0.730 100 H LYS 13 HN LYS 13 -8.223 -7.258 -1.963 101 HA LYS 13 HA LYS 13 -8.605 -9.393 -3.649 102 HB2 LYS 13 HB2 LYS 13 -6.600 -9.172 -1.402 103 HB3 LYS 13 HB1 LYS 13 -6.489 -10.299 -2.746 104 HG2 LYS 13 HG2 LYS 13 -6.327 -8.418 -4.301 105 HG3 LYS 13 HG1 LYS 13 -6.425 -7.295 -2.945 106 HD2 LYS 13 HD2 LYS 13 -4.263 -9.353 -3.385 107 HD3 LYS 13 HD1 LYS 13 -4.111 -7.623 -3.681 108 HE2 LYS 13 HE2 LYS 13 -3.167 -7.755 -1.605 109 HE3 LYS 13 HE1 LYS 13 -4.844 -7.465 -1.156 110 HZ1 LYS 13 HZ1 LYS 13 -4.128 -9.216 0.197 111 HZ2 LYS 13 HZ2 LYS 13 -3.332 -10.008 -1.070 112 HZ3 LYS 13 HZ3 LYS 13 -5.026 -9.986 -1.021 113 H THR 14 HN THR 14 -9.171 -9.279 -0.193 114 HA THR 14 HA THR 14 -9.445 -12.155 0.054 115 HB THR 14 HB THR 14 -10.222 -10.084 2.113 116 HG1 THR 14 HG1 THR 14 -7.848 -10.772 2.738 117 HG21 THR 14 HG21 THR 14 -10.871 -12.400 2.594 118 HG22 THR 14 HG22 THR 14 -9.601 -11.864 3.693 119 HG23 THR 14 HG23 THR 14 -9.207 -12.928 2.343 120 H LEU 15 HN LEU 15 -11.547 -9.550 -0.767 121 HA LEU 15 HA LEU 15 -13.810 -11.304 -0.876 122 HB2 LEU 15 HB2 LEU 15 -13.772 -10.573 1.525 123 HB3 LEU 15 HB1 LEU 15 -13.889 -8.919 0.984 124 HG LEU 15 HG LEU 15 -16.008 -10.143 1.831 125 HD11 LEU 15 HD11 LEU 15 -17.363 -8.891 0.070 126 HD12 LEU 15 HD12 LEU 15 -15.797 -8.408 -0.596 127 HD13 LEU 15 HD13 LEU 15 -16.233 -7.959 1.056 128 HD21 LEU 15 HD21 LEU 15 -17.270 -11.215 0.013 129 HD22 LEU 15 HD22 LEU 15 -15.814 -12.109 0.448 130 HD23 LEU 15 HD23 LEU 15 -15.836 -11.115 -1.007 131 H LYS 16 HN LYS 16 -14.273 -10.862 -2.924 132 HA LYS 16 HA LYS 16 -14.508 -8.043 -3.751 133 HB2 LYS 16 HB2 LYS 16 -13.669 -10.450 -5.389 134 HB3 LYS 16 HB1 LYS 16 -13.950 -8.842 -6.043 135 HG2 LYS 16 HG2 LYS 16 -11.988 -8.052 -5.298 136 HG3 LYS 16 HG1 LYS 16 -12.036 -8.984 -3.806 137 HD2 LYS 16 HD2 LYS 16 -11.212 -9.849 -6.545 138 HD3 LYS 16 HD1 LYS 16 -10.222 -9.775 -5.087 139 HE2 LYS 16 HE2 LYS 16 -11.539 -11.565 -4.084 140 HE3 LYS 16 HE1 LYS 16 -12.554 -11.646 -5.522 141 HZ1 LYS 16 HZ1 LYS 16 -10.851 -13.376 -5.498 142 HZ2 LYS 16 HZ2 LYS 16 -9.636 -12.200 -5.443 143 HZ3 LYS 16 HZ3 LYS 16 -10.634 -12.328 -6.810 144 H GLY 17 HN GLY 17 -16.444 -7.434 -4.414 145 HA2 GLY 17 HA2 GLY 17 -18.255 -8.879 -5.919 146 HA3 GLY 17 HA1 GLY 17 -18.684 -9.168 -4.237 147 H GLU 18 HN GLU 18 -20.681 -8.092 -5.158 148 HA GLU 18 HA GLU 18 -20.515 -5.234 -4.519 149 HB2 GLU 18 HB2 GLU 18 -21.855 -6.438 -6.939 150 HB3 GLU 18 HB1 GLU 18 -22.296 -4.864 -6.313 151 HG2 GLU 18 HG2 GLU 18 -20.062 -4.031 -6.720 152 HG3 GLU 18 HG1 GLU 18 -19.550 -5.626 -7.271 153 H THR 19 HN THR 19 -22.664 -4.313 -3.985 154 HA THR 19 HA THR 19 -24.816 -6.121 -3.448 155 HB THR 19 HB THR 19 -23.344 -6.639 -1.523 156 HG1 THR 19 HG1 THR 19 -25.033 -6.662 -0.156 157 HG21 THR 19 HG21 THR 19 -23.797 -3.734 -0.755 158 HG22 THR 19 HG22 THR 19 -22.259 -4.414 -1.291 159 HG23 THR 19 HG23 THR 19 -22.981 -4.945 0.230 160 H THR 20 HN THR 20 -26.643 -4.948 -2.324 161 HA THR 20 HA THR 20 -26.574 -2.060 -2.861 162 HB THR 20 HB THR 20 -28.911 -2.310 -3.835 163 HG1 THR 20 HG1 THR 20 -28.955 -4.597 -2.987 164 HG21 THR 20 HG21 THR 20 -27.103 -1.856 -5.376 165 HG22 THR 20 HG22 THR 20 -28.117 -3.114 -6.084 166 HG23 THR 20 HG23 THR 20 -26.581 -3.540 -5.328 167 H THR 21 HN THR 21 -28.371 -0.911 -1.824 168 HA THR 21 HA THR 21 -30.023 -2.337 0.036 169 HB THR 21 HB THR 21 -27.821 -2.051 1.294 170 HG1 THR 21 HG1 THR 21 -29.878 -0.632 2.614 171 HG21 THR 21 HG21 THR 21 -28.725 0.857 1.297 172 HG22 THR 21 HG22 THR 21 -27.236 0.243 0.573 173 HG23 THR 21 HG23 THR 21 -27.456 0.198 2.327 174 H GLU 22 HN GLU 22 -31.842 -1.151 0.594 175 HA GLU 22 HA GLU 22 -32.142 1.403 -0.795 176 HB2 GLU 22 HB2 GLU 22 -34.298 -0.052 0.754 177 HB3 GLU 22 HB1 GLU 22 -34.499 1.108 -0.547 178 HG2 GLU 22 HG2 GLU 22 -35.053 -0.832 -1.625 179 HG3 GLU 22 HG1 GLU 22 -33.290 -0.780 -1.985 180 H ALA 23 HN ALA 23 -31.902 3.279 0.245 181 HA ALA 23 HA ALA 23 -32.682 3.462 3.075 182 HB1 ALA 23 HB1 ALA 23 -29.971 4.376 2.076 183 HB2 ALA 23 HB2 ALA 23 -30.263 2.962 3.090 184 HB3 ALA 23 HB3 ALA 23 -30.606 4.579 3.709 185 H VAL 24 HN VAL 24 -33.001 5.740 3.753 186 HA VAL 24 HA VAL 24 -33.665 7.402 1.430 187 HB VAL 24 HB VAL 24 -35.084 8.698 3.013 188 HG11 VAL 24 HG11 VAL 24 -35.649 5.737 2.885 189 HG12 VAL 24 HG12 VAL 24 -36.033 6.921 1.637 190 HG13 VAL 24 HG13 VAL 24 -36.836 7.000 3.205 191 HG21 VAL 24 HG21 VAL 24 -34.348 6.505 4.947 192 HG22 VAL 24 HG22 VAL 24 -35.584 7.736 5.210 193 HG23 VAL 24 HG23 VAL 24 -33.887 8.202 5.075 194 H ASP 25 HN ASP 25 -31.080 7.143 3.362 195 HA ASP 25 HA ASP 25 -30.565 10.030 3.246 196 HB2 ASP 25 HB2 ASP 25 -29.530 8.330 5.515 197 HB3 ASP 25 HB1 ASP 25 -29.517 10.082 5.379 198 H ALA 26 HN ALA 26 -28.423 10.563 2.653 199 HA ALA 26 HA ALA 26 -26.915 8.530 1.351 200 HB1 ALA 26 HB1 ALA 26 -26.926 10.891 0.597 201 HB2 ALA 26 HB2 ALA 26 -25.295 10.278 0.870 202 HB3 ALA 26 HB3 ALA 26 -26.048 11.340 2.060 203 H ALA 27 HN ALA 27 -26.691 10.190 4.428 204 HA ALA 27 HA ALA 27 -24.141 9.166 5.157 205 HB1 ALA 27 HB1 ALA 27 -26.303 10.314 6.912 206 HB2 ALA 27 HB2 ALA 27 -25.051 11.245 6.087 207 HB3 ALA 27 HB3 ALA 27 -24.609 10.094 7.349 208 H THR 28 HN THR 28 -27.469 8.156 5.774 209 HA THR 28 HA THR 28 -26.854 6.159 7.668 210 HB THR 28 HB THR 28 -29.231 6.121 5.787 211 HG1 THR 28 HG1 THR 28 -30.202 7.559 7.150 212 HG21 THR 28 HG21 THR 28 -28.795 5.046 8.585 213 HG22 THR 28 HG22 THR 28 -28.960 4.093 7.110 214 HG23 THR 28 HG23 THR 28 -30.330 5.026 7.717 215 H ALA 29 HN ALA 29 -26.831 6.129 4.156 216 HA ALA 29 HA ALA 29 -26.767 3.278 3.885 217 HB1 ALA 29 HB1 ALA 29 -27.514 4.660 2.034 218 HB2 ALA 29 HB2 ALA 29 -26.083 3.745 1.557 219 HB3 ALA 29 HB3 ALA 29 -25.942 5.455 1.964 220 H GLU 30 HN GLU 30 -24.458 5.860 4.168 221 HA GLU 30 HA GLU 30 -22.088 4.467 3.608 222 HB2 GLU 30 HB2 GLU 30 -22.576 7.019 3.951 223 HB3 GLU 30 HB1 GLU 30 -22.281 6.660 5.639 224 HG2 GLU 30 HG2 GLU 30 -20.054 5.776 5.024 225 HG3 GLU 30 HG1 GLU 30 -20.357 6.325 3.375 226 H LYS 31 HN LYS 31 -23.509 5.365 6.733 227 HA LYS 31 HA LYS 31 -21.790 4.007 8.395 228 HB2 LYS 31 HB2 LYS 31 -24.712 4.543 8.890 229 HB3 LYS 31 HB1 LYS 31 -23.505 4.189 10.114 230 HG2 LYS 31 HG2 LYS 31 -23.646 6.617 8.348 231 HG3 LYS 31 HG1 LYS 31 -23.920 6.538 10.089 232 HD2 LYS 31 HD2 LYS 31 -21.596 5.900 10.444 233 HD3 LYS 31 HD1 LYS 31 -21.309 5.922 8.702 234 HE2 LYS 31 HE2 LYS 31 -20.486 7.966 9.705 235 HE3 LYS 31 HE1 LYS 31 -21.872 8.323 8.681 236 HZ1 LYS 31 HZ1 LYS 31 -23.275 8.472 10.599 237 HZ2 LYS 31 HZ2 LYS 31 -21.929 9.483 10.836 238 HZ3 LYS 31 HZ3 LYS 31 -22.015 7.980 11.619 239 H VAL 32 HN VAL 32 -24.801 2.774 6.938 240 HA VAL 32 HA VAL 32 -24.785 0.334 8.411 241 HB VAL 32 HB VAL 32 -26.187 1.033 5.823 242 HG11 VAL 32 HG11 VAL 32 -25.886 -1.397 6.057 243 HG12 VAL 32 HG12 VAL 32 -27.578 -0.931 6.223 244 HG13 VAL 32 HG13 VAL 32 -26.626 -1.329 7.656 245 HG21 VAL 32 HG21 VAL 32 -27.178 0.915 8.673 246 HG22 VAL 32 HG22 VAL 32 -28.171 1.246 7.255 247 HG23 VAL 32 HG23 VAL 32 -26.905 2.379 7.728 248 H PHE 33 HN PHE 33 -23.682 1.249 5.172 249 HA PHE 33 HA PHE 33 -22.879 -1.394 4.440 250 HB2 PHE 33 HB2 PHE 33 -22.631 1.298 3.234 251 HB3 PHE 33 HB1 PHE 33 -21.392 0.153 2.787 252 HD1 PHE 33 HD1 PHE 33 -23.489 1.477 1.026 253 HD2 PHE 33 HD2 PHE 33 -23.374 -2.271 3.032 254 HE1 PHE 33 HE1 PHE 33 -25.001 0.532 -0.668 255 HE2 PHE 33 HE2 PHE 33 -24.891 -3.225 1.347 256 HZ PHE 33 HZ PHE 33 -25.703 -1.823 -0.510 257 H LYS 34 HN LYS 34 -21.360 1.050 6.373 258 HA LYS 34 HA LYS 34 -18.694 0.078 5.902 259 HB2 LYS 34 HB2 LYS 34 -19.894 1.999 7.892 260 HB3 LYS 34 HB1 LYS 34 -18.236 1.513 8.026 261 HG2 LYS 34 HG2 LYS 34 -17.984 2.367 5.605 262 HG3 LYS 34 HG1 LYS 34 -19.548 3.137 5.875 263 HD2 LYS 34 HD2 LYS 34 -17.667 4.687 6.307 264 HD3 LYS 34 HD1 LYS 34 -18.615 4.374 7.769 265 HE2 LYS 34 HE2 LYS 34 -16.164 4.353 8.154 266 HE3 LYS 34 HE1 LYS 34 -16.936 2.823 8.565 267 HZ1 LYS 34 HZ1 LYS 34 -16.174 1.917 6.458 268 HZ2 LYS 34 HZ2 LYS 34 -14.862 2.505 7.350 269 HZ3 LYS 34 HZ3 LYS 34 -15.463 3.402 6.051 270 H GLN 35 HN GLN 35 -21.252 -0.415 8.247 271 HA GLN 35 HA GLN 35 -19.722 -2.201 9.867 272 HB2 GLN 35 HB2 GLN 35 -21.748 -1.022 10.723 273 HB3 GLN 35 HB1 GLN 35 -22.741 -1.991 9.641 274 HG2 GLN 35 HG2 GLN 35 -22.726 -2.835 11.954 275 HG3 GLN 35 HG1 GLN 35 -22.118 -4.013 10.792 276 HE21 GLN 35 HE21 GLN 35 -20.930 -5.152 12.294 277 HE22 GLN 35 HE22 GLN 35 -19.485 -4.532 13.011 278 H TYR 36 HN TYR 36 -21.738 -2.451 7.038 279 HA TYR 36 HA TYR 36 -21.950 -5.259 6.888 280 HB2 TYR 36 HB2 TYR 36 -23.347 -3.981 5.438 281 HB3 TYR 36 HB1 TYR 36 -21.985 -3.064 4.812 282 HD1 TYR 36 HD1 TYR 36 -20.726 -3.851 2.945 283 HD2 TYR 36 HD2 TYR 36 -23.627 -6.346 4.786 284 HE1 TYR 36 HE1 TYR 36 -20.557 -5.430 1.065 285 HE2 TYR 36 HE2 TYR 36 -23.482 -7.929 2.928 286 HH TYR 36 HH TYR 36 -21.005 -7.751 0.556 287 H ALA 37 HN ALA 37 -19.642 -2.980 5.448 288 HA ALA 37 HA ALA 37 -17.955 -4.919 4.275 289 HB1 ALA 37 HB1 ALA 37 -17.365 -2.084 5.151 290 HB2 ALA 37 HB2 ALA 37 -17.930 -2.598 3.563 291 HB3 ALA 37 HB3 ALA 37 -16.324 -3.067 4.122 292 H ASN 38 HN ASN 38 -18.167 -3.497 7.459 293 HA ASN 38 HA ASN 38 -15.692 -4.245 8.540 294 HB2 ASN 38 HB2 ASN 38 -17.192 -2.716 9.759 295 HB3 ASN 38 HB1 ASN 38 -18.407 -3.983 9.899 296 HD21 ASN 38 HD21 ASN 38 -15.604 -2.574 11.332 297 HD22 ASN 38 HD22 ASN 38 -15.443 -3.736 12.669 298 H ASP 39 HN ASP 39 -18.730 -6.019 8.276 299 HA ASP 39 HA ASP 39 -17.913 -8.275 9.770 300 HB2 ASP 39 HB2 ASP 39 -20.267 -7.793 9.349 301 HB3 ASP 39 HB1 ASP 39 -20.028 -8.030 7.621 302 H ASN 40 HN ASN 40 -17.166 -7.247 6.596 303 HA ASN 40 HA ASN 40 -16.272 -9.942 5.840 304 HB2 ASN 40 HB2 ASN 40 -16.844 -7.483 4.175 305 HB3 ASN 40 HB1 ASN 40 -15.949 -8.860 3.542 306 HD21 ASN 40 HD21 ASN 40 -19.068 -7.657 4.507 307 HD22 ASN 40 HD22 ASN 40 -19.987 -9.070 3.975 308 H GLY 41 HN GLY 41 -15.114 -7.396 7.432 309 HA2 GLY 41 HA2 GLY 41 -12.985 -6.773 8.031 310 HA3 GLY 41 HA1 GLY 41 -12.398 -8.136 7.093 311 H VAL 42 HN VAL 42 -14.358 -5.735 5.507 312 HA VAL 42 HA VAL 42 -11.961 -4.825 4.089 313 HB VAL 42 HB VAL 42 -14.850 -4.833 3.171 314 HG11 VAL 42 HG11 VAL 42 -13.519 -2.981 2.262 315 HG12 VAL 42 HG12 VAL 42 -13.943 -4.152 1.010 316 HG13 VAL 42 HG13 VAL 42 -12.314 -4.129 1.686 317 HG21 VAL 42 HG21 VAL 42 -12.496 -6.569 2.421 318 HG22 VAL 42 HG22 VAL 42 -14.058 -6.573 1.596 319 HG23 VAL 42 HG23 VAL 42 -13.950 -7.070 3.285 320 H ASP 43 HN ASP 43 -11.319 -2.864 4.492 321 HA ASP 43 HA ASP 43 -13.220 -0.718 4.833 322 HB2 ASP 43 HB2 ASP 43 -12.895 -1.557 7.185 323 HB3 ASP 43 HB1 ASP 43 -11.181 -1.188 7.028 324 H GLY 44 HN GLY 44 -12.394 0.288 3.055 325 HA2 GLY 44 HA2 GLY 44 -9.578 1.109 3.189 326 HA3 GLY 44 HA1 GLY 44 -10.299 0.517 1.702 327 H GLU 45 HN GLU 45 -9.457 2.656 0.987 328 HA GLU 45 HA GLU 45 -10.498 5.111 1.836 329 HB2 GLU 45 HB2 GLU 45 -9.657 4.257 -0.944 330 HB3 GLU 45 HB1 GLU 45 -9.867 5.921 -0.412 331 HG2 GLU 45 HG2 GLU 45 -8.033 5.752 1.098 332 HG3 GLU 45 HG1 GLU 45 -7.924 4.012 0.858 333 H TRP 46 HN TRP 46 -12.387 6.097 1.550 334 HA TRP 46 HA TRP 46 -14.474 4.610 0.118 335 HB2 TRP 46 HB2 TRP 46 -14.572 6.331 2.562 336 HB3 TRP 46 HB1 TRP 46 -15.961 6.388 1.494 337 HD1 TRP 46 HD1 TRP 46 -13.792 3.623 3.158 338 HE1 TRP 46 HE1 TRP 46 -15.314 1.694 3.887 339 HE3 TRP 46 HE3 TRP 46 -18.333 5.463 1.568 340 HZ2 TRP 46 HZ2 TRP 46 -18.028 1.038 3.834 341 HZ3 TRP 46 HZ3 TRP 46 -20.334 4.104 1.992 342 HH2 TRP 46 HH2 TRP 46 -20.180 1.935 3.084 343 H THR 47 HN THR 47 -14.939 5.298 -1.818 344 HA THR 47 HA THR 47 -14.850 8.188 -2.397 345 HB THR 47 HB THR 47 -14.577 7.430 -4.822 346 HG1 THR 47 HG1 THR 47 -14.139 5.350 -5.239 347 HG21 THR 47 HG21 THR 47 -12.406 6.790 -2.823 348 HG22 THR 47 HG22 THR 47 -12.695 8.338 -3.620 349 HG23 THR 47 HG23 THR 47 -12.153 6.951 -4.560 350 H TYR 48 HN TYR 48 -16.473 8.878 -4.103 351 HA TYR 48 HA TYR 48 -18.844 7.197 -4.216 352 HB2 TYR 48 HB2 TYR 48 -19.256 8.341 -2.144 353 HB3 TYR 48 HB1 TYR 48 -18.889 9.897 -2.830 354 HD1 TYR 48 HD1 TYR 48 -21.402 7.137 -2.785 355 HD2 TYR 48 HD2 TYR 48 -20.567 11.148 -4.008 356 HE1 TYR 48 HE1 TYR 48 -23.759 7.468 -3.330 357 HE2 TYR 48 HE2 TYR 48 -22.939 11.466 -4.535 358 HH TYR 48 HH TYR 48 -24.902 10.099 -5.114 359 H ASP 49 HN ASP 49 -20.492 8.024 -5.648 360 HA ASP 49 HA ASP 49 -19.598 10.053 -7.592 361 HB2 ASP 49 HB2 ASP 49 -18.834 7.933 -8.626 362 HB3 ASP 49 HB1 ASP 49 -20.434 7.240 -8.473 363 H ASP 50 HN ASP 50 -21.342 11.320 -8.252 364 HA ASP 50 HA ASP 50 -23.765 10.885 -6.680 365 HB2 ASP 50 HB2 ASP 50 -24.313 13.180 -7.235 366 HB3 ASP 50 HB1 ASP 50 -22.555 13.186 -7.031 367 H ALA 51 HN ALA 51 -22.776 10.434 -9.979 368 HA ALA 51 HA ALA 51 -25.443 10.530 -11.037 369 HB1 ALA 51 HB1 ALA 51 -23.537 11.083 -12.440 370 HB2 ALA 51 HB2 ALA 51 -24.442 9.726 -13.115 371 HB3 ALA 51 HB3 ALA 51 -22.921 9.441 -12.271 372 H THR 52 HN THR 52 -23.261 7.966 -9.960 373 HA THR 52 HA THR 52 -25.227 5.955 -10.731 374 HB THR 52 HB THR 52 -23.385 4.351 -9.944 375 HG1 THR 52 HG1 THR 52 -21.881 6.785 -10.077 376 HG21 THR 52 HG21 THR 52 -22.080 4.690 -12.026 377 HG22 THR 52 HG22 THR 52 -22.866 6.255 -12.241 378 HG23 THR 52 HG23 THR 52 -23.820 4.774 -12.309 379 H LYS 53 HN LYS 53 -24.317 7.690 -7.967 380 HA LYS 53 HA LYS 53 -24.932 7.601 -5.743 381 HB2 LYS 53 HB2 LYS 53 -26.850 5.411 -6.545 382 HB3 LYS 53 HB1 LYS 53 -26.915 6.383 -5.086 383 HG2 LYS 53 HG2 LYS 53 -27.372 7.317 -7.904 384 HG3 LYS 53 HG1 LYS 53 -28.576 7.156 -6.624 385 HD2 LYS 53 HD2 LYS 53 -27.442 8.910 -5.347 386 HD3 LYS 53 HD1 LYS 53 -26.227 9.053 -6.622 387 HE2 LYS 53 HE2 LYS 53 -28.137 9.577 -8.189 388 HE3 LYS 53 HE1 LYS 53 -29.162 9.708 -6.762 389 HZ1 LYS 53 HZ1 LYS 53 -26.798 11.371 -7.430 390 HZ2 LYS 53 HZ2 LYS 53 -27.578 11.409 -5.927 391 HZ3 LYS 53 HZ3 LYS 53 -28.417 11.878 -7.328 392 H THR 54 HN THR 54 -23.136 5.553 -7.185 393 HA THR 54 HA THR 54 -23.151 3.297 -5.403 394 HB THR 54 HB THR 54 -21.173 4.013 -7.588 395 HG1 THR 54 HG1 THR 54 -23.687 3.341 -7.816 396 HG21 THR 54 HG21 THR 54 -20.636 1.585 -7.551 397 HG22 THR 54 HG22 THR 54 -21.671 1.395 -6.138 398 HG23 THR 54 HG23 THR 54 -20.220 2.389 -6.035 399 H TYR 55 HN TYR 55 -21.907 2.964 -3.680 400 HA TYR 55 HA TYR 55 -19.820 4.923 -3.010 401 HB2 TYR 55 HB2 TYR 55 -21.350 2.915 -1.344 402 HB3 TYR 55 HB1 TYR 55 -19.799 3.520 -0.801 403 HD1 TYR 55 HD1 TYR 55 -19.574 5.729 0.087 404 HD2 TYR 55 HD2 TYR 55 -23.297 4.445 -1.524 405 HE1 TYR 55 HE1 TYR 55 -20.678 7.684 1.091 406 HE2 TYR 55 HE2 TYR 55 -24.407 6.399 -0.520 407 HH TYR 55 HH TYR 55 -23.967 7.945 1.465 408 H THR 56 HN THR 56 -17.700 4.323 -3.078 409 HA THR 56 HA THR 56 -17.217 1.518 -3.845 410 HB THR 56 HB THR 56 -15.657 3.925 -4.821 411 HG1 THR 56 HG1 THR 56 -18.027 3.457 -5.495 412 HG21 THR 56 HG21 THR 56 -14.789 2.345 -6.499 413 HG22 THR 56 HG22 THR 56 -15.706 1.044 -5.738 414 HG23 THR 56 HG23 THR 56 -14.389 1.826 -4.861 415 H VAL 57 HN VAL 57 -16.162 0.489 -2.268 416 HA VAL 57 HA VAL 57 -14.290 2.031 -0.594 417 HB VAL 57 HB VAL 57 -16.036 0.942 0.799 418 HG11 VAL 57 HG11 VAL 57 -15.944 -1.566 1.073 419 HG12 VAL 57 HG12 VAL 57 -15.024 -1.614 -0.427 420 HG13 VAL 57 HG13 VAL 57 -16.675 -0.997 -0.423 421 HG21 VAL 57 HG21 VAL 57 -14.549 -0.170 2.374 422 HG22 VAL 57 HG22 VAL 57 -13.801 1.283 1.712 423 HG23 VAL 57 HG23 VAL 57 -13.307 -0.308 1.130 424 H THR 58 HN THR 58 -12.269 1.840 -1.193 425 HA THR 58 HA THR 58 -11.500 -0.582 -2.706 426 HB THR 58 HB THR 58 -10.077 2.066 -2.836 427 HG1 THR 58 HG1 THR 58 -12.335 2.292 -3.397 428 HG21 THR 58 HG21 THR 58 -10.300 -0.276 -4.740 429 HG22 THR 58 HG22 THR 58 -8.896 0.138 -3.759 430 HG23 THR 58 HG23 THR 58 -9.411 1.216 -5.056 431 H GLU 59 HN GLU 59 -10.126 -1.895 -1.788 432 HA GLU 59 HA GLU 59 -8.683 -1.236 0.602 433 HB2 GLU 59 HB2 GLU 59 -8.546 -3.655 -1.212 434 HB3 GLU 59 HB1 GLU 59 -7.532 -3.474 0.195 435 HG2 GLU 59 HG2 GLU 59 -10.533 -3.444 0.310 436 HG3 GLU 59 HG1 GLU 59 -9.542 -4.881 0.551 437 H GLY 60 HN GLY 60 -6.304 -1.158 0.795 438 HA2 GLY 60 HA2 GLY 60 -4.368 -1.280 -1.047 439 HA3 GLY 60 HA1 GLY 60 -5.153 0.226 -1.508 440 H SER 61 HN SER 61 -2.528 -0.726 -0.138 441 HA SER 61 HA SER 61 -2.229 1.632 1.470 442 HB2 SER 61 HB2 SER 61 -1.377 0.232 3.463 443 HB3 SER 61 HB1 SER 61 -3.124 0.318 3.239 444 HG SER 61 HG SER 61 -3.034 -1.775 3.212 445 H GLY 62 HN GLY 62 -0.871 -1.481 0.488 446 HA2 GLY 62 HA2 GLY 62 1.804 -0.284 0.428 447 HA3 GLY 62 HA1 GLY 62 1.438 -2.000 0.328 448 H GLY 63 HN GLY 63 0.553 0.943 -1.495 449 HA2 GLY 63 HA2 GLY 63 0.700 -0.625 -3.962 450 HA3 GLY 63 HA1 GLY 63 0.038 0.997 -3.798 451 H ALA 64 HN ALA 64 2.982 0.601 -2.213 452 HA ALA 64 HA ALA 64 4.611 1.403 -4.480 453 HB1 ALA 64 HB1 ALA 64 3.669 3.509 -3.615 454 HB2 ALA 64 HB2 ALA 64 5.419 3.428 -3.406 455 HB3 ALA 64 HB3 ALA 64 4.353 3.141 -2.031 456 H GLY 65 HN GLY 65 6.939 1.973 -3.408 457 HA2 GLY 65 HA2 GLY 65 7.568 -0.407 -1.810 458 HA3 GLY 65 HA1 GLY 65 8.718 0.510 -2.773 459 H GLY 66 HN GLY 66 7.112 0.208 0.268 460 HA2 GLY 66 HA2 GLY 66 8.190 2.704 1.296 461 HA3 GLY 66 HA1 GLY 66 7.199 1.550 2.177 462 H GLN 67 HN GLN 67 9.988 0.538 0.422 463 HA GLN 67 HA GLN 67 11.929 0.682 2.444 464 HB2 GLN 67 HB2 GLN 67 10.710 -0.961 3.683 465 HB3 GLN 67 HB1 GLN 67 10.406 -1.940 2.224 466 HG2 GLN 67 HG2 GLN 67 12.076 -3.001 3.586 467 HG3 GLN 67 HG1 GLN 67 12.814 -2.425 2.093 468 HE21 GLN 67 HE21 GLN 67 14.869 -2.298 2.855 469 HE22 GLN 67 HE22 GLN 67 15.376 -1.172 4.072 470 H GLY 68 HN GLY 68 10.773 -1.535 -0.098 471 HA2 GLY 68 HA2 GLY 68 11.715 -1.934 -2.183 472 HA3 GLY 68 HA1 GLY 68 13.027 -0.842 -1.766 473 H MET 69 HN MET 69 12.102 -3.436 0.331 474 HA MET 69 HA MET 69 13.135 -5.319 1.044 475 HB2 MET 69 HB2 MET 69 14.326 -5.279 -1.734 476 HB3 MET 69 HB1 MET 69 14.518 -6.608 -0.596 477 HG2 MET 69 HG2 MET 69 11.894 -5.610 -1.683 478 HG3 MET 69 HG1 MET 69 12.769 -7.028 -2.258 479 HE1 MET 69 HE1 MET 69 10.526 -8.442 -1.920 480 HE2 MET 69 HE2 MET 69 9.693 -7.023 -1.285 481 HE3 MET 69 HE3 MET 69 9.655 -8.542 -0.389 482 H ILE 70 HN ILE 70 15.712 -6.287 0.620 483 HA ILE 70 HA ILE 70 17.845 -6.078 1.340 484 HB ILE 70 HB ILE 70 17.627 -3.144 0.570 485 HG12 ILE 70 HG12 ILE 70 18.432 -5.484 -1.179 486 HG13 ILE 70 HG11 ILE 70 16.876 -4.661 -1.263 487 HG21 ILE 70 HG21 ILE 70 20.063 -4.965 0.547 488 HG22 ILE 70 HG22 ILE 70 19.691 -3.823 1.841 489 HG23 ILE 70 HG23 ILE 70 20.032 -3.234 0.213 490 HD11 ILE 70 HD11 ILE 70 18.031 -2.594 -1.904 491 HD12 ILE 70 HD12 ILE 70 18.364 -3.913 -3.026 492 HD13 ILE 70 HD13 ILE 70 19.576 -3.440 -1.832 493 H GLN 71 HN GLN 71 15.987 -6.045 3.296 494 HA GLN 71 HA GLN 71 16.878 -3.944 5.157 495 HB2 GLN 71 HB2 GLN 71 14.369 -4.292 4.676 496 HB3 GLN 71 HB1 GLN 71 14.517 -5.762 5.640 497 HG2 GLN 71 HG2 GLN 71 15.283 -4.433 7.548 498 HG3 GLN 71 HG1 GLN 71 15.130 -2.964 6.586 499 HE21 GLN 71 HE21 GLN 71 13.101 -2.147 6.143 500 HE22 GLN 71 HE22 GLN 71 11.684 -2.684 6.977 501 H GLU 72 HN GLU 72 17.964 -6.679 4.275 502 HA GLU 72 HA GLU 72 18.041 -8.372 6.492 503 HB2 GLU 72 HB2 GLU 72 19.967 -9.434 5.492 504 HB3 GLU 72 HB1 GLU 72 18.795 -9.054 4.241 505 HG2 GLU 72 HG2 GLU 72 20.106 -7.160 3.525 506 HG3 GLU 72 HG1 GLU 72 21.230 -7.410 4.861 507 HA PRO 73 HA PRO 73 20.489 -5.962 9.241 508 HB2 PRO 73 HB2 PRO 73 20.835 -7.744 11.219 509 HB3 PRO 73 HB1 PRO 73 19.213 -7.044 10.854 510 HG2 PRO 73 HG2 PRO 73 20.371 -9.705 10.029 511 HG3 PRO 73 HG1 PRO 73 18.758 -9.340 10.679 512 HD2 PRO 73 HD2 PRO 73 19.270 -9.675 8.015 513 HD3 PRO 73 HD1 PRO 73 17.957 -8.625 8.642 514 H ALA 74 HN ALA 74 22.459 -6.054 10.489 515 HA ALA 74 HA ALA 74 24.457 -8.010 10.011 516 HB1 ALA 74 HB1 ALA 74 26.062 -6.549 8.851 517 HB2 ALA 74 HB2 ALA 74 24.823 -5.299 8.712 518 HB3 ALA 74 HB3 ALA 74 24.625 -6.836 7.871 519 H LEU 75 HN LEU 75 26.066 -7.833 11.580 520 HA LEU 75 HA LEU 75 25.509 -5.766 13.574 521 HB2 LEU 75 HB2 LEU 75 26.834 -8.443 13.814 522 HB3 LEU 75 HB1 LEU 75 26.928 -7.250 15.081 523 HG LEU 75 HG LEU 75 25.225 -8.815 15.667 524 HD11 LEU 75 HD11 LEU 75 24.769 -6.481 16.192 525 HD12 LEU 75 HD12 LEU 75 23.286 -7.379 15.882 526 HD13 LEU 75 HD13 LEU 75 23.932 -6.291 14.650 527 HD21 LEU 75 HD21 LEU 75 23.246 -9.209 14.261 528 HD22 LEU 75 HD22 LEU 75 24.736 -9.760 13.498 529 HD23 LEU 75 HD23 LEU 75 23.987 -8.251 12.976 530 HA PRO 76 HA PRO 76 29.401 -3.823 12.432 531 HB2 PRO 76 HB2 PRO 76 28.992 -2.444 15.050 532 HB3 PRO 76 HB1 PRO 76 29.263 -1.720 13.459 533 HG2 PRO 76 HG2 PRO 76 26.848 -1.612 14.561 534 HG3 PRO 76 HG1 PRO 76 27.035 -2.005 12.806 535 HD2 PRO 76 HD2 PRO 76 26.547 -3.925 15.120 536 HD3 PRO 76 HD1 PRO 76 25.753 -3.843 13.530 537 HA PRO 77 HA PRO 77 32.512 -6.097 14.602 538 HB2 PRO 77 HB2 PRO 77 33.850 -3.402 14.731 539 HB3 PRO 77 HB1 PRO 77 34.557 -4.970 14.305 540 HG2 PRO 77 HG2 PRO 77 33.951 -3.366 12.352 541 HG3 PRO 77 HG1 PRO 77 33.395 -5.054 12.262 542 HD2 PRO 77 HD2 PRO 77 31.805 -2.598 13.028 543 HD3 PRO 77 HD1 PRO 77 31.353 -3.962 11.938 544 H GLY 78 HN GLY 78 32.291 -6.727 16.626 545 HA2 GLY 78 HA2 GLY 78 32.658 -6.448 18.956 546 HA3 GLY 78 HA1 GLY 78 32.361 -4.727 18.783 547 H TRP 79 HN TRP 79 29.850 -5.264 17.181 548 HA TRP 79 HA TRP 79 28.117 -5.589 19.509 549 HB2 TRP 79 HB2 TRP 79 27.544 -4.927 16.611 550 HB3 TRP 79 HB1 TRP 79 26.270 -5.258 17.770 551 HD1 TRP 79 HD1 TRP 79 29.019 -2.655 17.052 552 HE1 TRP 79 HE1 TRP 79 28.409 -0.475 18.269 553 HE3 TRP 79 HE3 TRP 79 24.924 -4.285 19.684 554 HZ2 TRP 79 HZ2 TRP 79 26.482 0.434 20.108 555 HZ3 TRP 79 HZ3 TRP 79 23.777 -2.685 21.161 556 HH2 TRP 79 HH2 TRP 79 24.537 -0.381 21.363 557 H GLU 80 HN GLU 80 27.158 -7.498 20.083 558 HA GLU 80 HA GLU 80 27.056 -9.613 18.046 559 HB2 GLU 80 HB2 GLU 80 27.505 -9.913 21.025 560 HB3 GLU 80 HB1 GLU 80 27.324 -11.255 19.903 561 HG2 GLU 80 HG2 GLU 80 29.329 -10.350 18.687 562 HG3 GLU 80 HG1 GLU 80 29.562 -9.252 20.050 563 H MET 81 HN MET 81 25.179 -10.691 17.789 564 HA MET 81 HA MET 81 22.921 -9.837 19.465 565 HB2 MET 81 HB2 MET 81 22.649 -9.370 17.057 566 HB3 MET 81 HB1 MET 81 22.889 -11.103 16.708 567 HG2 MET 81 HG2 MET 81 20.862 -11.648 17.904 568 HG3 MET 81 HG1 MET 81 20.641 -9.965 18.375 569 HE1 MET 81 HE1 MET 81 20.343 -11.478 14.022 570 HE2 MET 81 HE2 MET 81 20.733 -12.508 15.402 571 HE3 MET 81 HE3 MET 81 21.878 -11.279 14.868 572 H LYS 82 HN LYS 82 21.980 -11.361 20.783 573 HA LYS 82 HA LYS 82 22.464 -14.169 20.257 574 HB2 LYS 82 HB2 LYS 82 23.442 -12.895 22.843 575 HB3 LYS 82 HB1 LYS 82 23.335 -14.620 22.552 576 HG2 LYS 82 HG2 LYS 82 25.032 -14.585 20.921 577 HG3 LYS 82 HG1 LYS 82 24.966 -12.803 20.802 578 HD2 LYS 82 HD2 LYS 82 25.894 -12.589 23.013 579 HD3 LYS 82 HD1 LYS 82 25.846 -14.339 23.252 580 HE2 LYS 82 HE2 LYS 82 27.500 -14.684 21.550 581 HE3 LYS 82 HE1 LYS 82 27.418 -12.998 21.050 582 HZ1 LYS 82 HZ1 LYS 82 29.347 -13.818 22.535 583 HZ2 LYS 82 HZ2 LYS 82 28.232 -13.645 23.807 584 HZ3 LYS 82 HZ3 LYS 82 28.640 -12.312 22.843 585 H TYR 83 HN TYR 83 21.045 -15.562 21.533 586 HA TYR 83 HA TYR 83 18.678 -14.052 22.461 587 HB2 TYR 83 HB2 TYR 83 18.774 -16.716 20.981 588 HB3 TYR 83 HB1 TYR 83 17.280 -15.933 21.565 589 HD1 TYR 83 HD1 TYR 83 19.861 -15.989 18.996 590 HD2 TYR 83 HD2 TYR 83 16.488 -13.873 20.474 591 HE1 TYR 83 HE1 TYR 83 19.702 -14.775 16.865 592 HE2 TYR 83 HE2 TYR 83 16.319 -12.645 18.354 593 HH TYR 83 HH TYR 83 18.192 -13.511 15.566 594 H THR 84 HN THR 84 17.304 -15.138 24.007 595 HA THR 84 HA THR 84 18.848 -16.781 25.874 596 HB THR 84 HB THR 84 17.289 -16.183 27.573 597 HG1 THR 84 HG1 THR 84 15.296 -15.143 27.068 598 HG21 THR 84 HG21 THR 84 17.630 -13.770 25.785 599 HG22 THR 84 HG22 THR 84 18.767 -14.339 27.007 600 HG23 THR 84 HG23 THR 84 17.187 -13.722 27.490 601 H SER 85 HN SER 85 17.404 -18.538 27.000 602 HA SER 85 HA SER 85 16.529 -20.308 24.942 603 HB2 SER 85 HB2 SER 85 17.802 -21.020 26.954 604 HB3 SER 85 HB1 SER 85 16.360 -20.686 27.881 605 HG SER 85 HG SER 85 16.952 -22.936 26.730 606 H GLU 86 HN GLU 86 14.944 -17.788 25.773 607 HA GLU 86 HA GLU 86 12.317 -19.147 26.102 608 HB2 GLU 86 HB2 GLU 86 13.105 -16.403 27.160 609 HB3 GLU 86 HB1 GLU 86 11.546 -17.189 27.384 610 HG2 GLU 86 HG2 GLU 86 12.489 -18.845 28.792 611 HG3 GLU 86 HG1 GLU 86 14.129 -18.339 28.388 612 H GLY 87 HN GLY 87 14.217 -17.694 23.949 613 HA2 GLY 87 HA2 GLY 87 13.708 -16.839 21.865 614 HA3 GLY 87 HA1 GLY 87 12.019 -16.764 22.343 615 H VAL 88 HN VAL 88 14.332 -15.298 24.429 616 HA VAL 88 HA VAL 88 13.256 -12.670 23.729 617 HB VAL 88 HB VAL 88 14.877 -13.527 26.140 618 HG11 VAL 88 HG11 VAL 88 14.380 -11.334 27.065 619 HG12 VAL 88 HG12 VAL 88 13.517 -10.892 25.592 620 HG13 VAL 88 HG13 VAL 88 15.259 -11.167 25.547 621 HG21 VAL 88 HG21 VAL 88 11.969 -12.795 25.907 622 HG22 VAL 88 HG22 VAL 88 12.819 -13.256 27.384 623 HG23 VAL 88 HG23 VAL 88 12.601 -14.428 26.088 624 H ARG 89 HN ARG 89 14.577 -10.968 23.169 625 HA ARG 89 HA ARG 89 17.136 -11.755 21.982 626 HB2 ARG 89 HB2 ARG 89 15.007 -10.388 20.961 627 HB3 ARG 89 HB1 ARG 89 16.029 -9.065 21.499 628 HG2 ARG 89 HG2 ARG 89 17.871 -9.993 20.140 629 HG3 ARG 89 HG1 ARG 89 16.758 -11.230 19.539 630 HD2 ARG 89 HD2 ARG 89 15.253 -9.192 18.935 631 HD3 ARG 89 HD1 ARG 89 16.757 -8.277 19.053 632 HE ARG 89 HE ARG 89 17.383 -10.364 17.422 633 HH11 ARG 89 HH11 ARG 89 14.973 -7.829 17.419 634 HH12 ARG 89 HH12 ARG 89 14.768 -7.859 15.688 635 HH21 ARG 89 HH21 ARG 89 17.120 -10.424 15.158 636 HH22 ARG 89 HH22 ARG 89 15.983 -9.363 14.397 637 H TYR 90 HN TYR 90 19.048 -11.007 22.805 638 HA TYR 90 HA TYR 90 18.984 -8.439 24.167 639 HB2 TYR 90 HB2 TYR 90 20.348 -9.117 26.015 640 HB3 TYR 90 HB1 TYR 90 18.961 -10.177 25.943 641 HD1 TYR 90 HD1 TYR 90 22.525 -9.999 26.074 642 HD2 TYR 90 HD2 TYR 90 19.274 -12.496 24.942 643 HE1 TYR 90 HE1 TYR 90 24.030 -11.948 26.078 644 HE2 TYR 90 HE2 TYR 90 20.758 -14.450 24.951 645 HH TYR 90 HH TYR 90 23.157 -14.937 24.704 646 H PHE 91 HN PHE 91 21.135 -7.351 24.132 647 HA PHE 91 HA PHE 91 22.751 -8.419 21.920 648 HB2 PHE 91 HB2 PHE 91 21.875 -5.597 22.446 649 HB3 PHE 91 HB1 PHE 91 23.364 -5.923 21.574 650 HD1 PHE 91 HD1 PHE 91 19.774 -7.033 21.512 651 HD2 PHE 91 HD2 PHE 91 23.270 -6.011 19.303 652 HE1 PHE 91 HE1 PHE 91 18.542 -7.348 19.417 653 HE2 PHE 91 HE2 PHE 91 22.031 -6.315 17.198 654 HZ PHE 91 HZ PHE 91 19.663 -6.989 17.252 655 H VAL 92 HN VAL 92 24.965 -8.180 22.037 656 HA VAL 92 HA VAL 92 25.955 -7.677 24.772 657 HB VAL 92 HB VAL 92 27.071 -9.583 22.703 658 HG11 VAL 92 HG11 VAL 92 28.438 -10.443 24.544 659 HG12 VAL 92 HG12 VAL 92 27.817 -9.169 25.595 660 HG13 VAL 92 HG13 VAL 92 28.797 -8.754 24.187 661 HG21 VAL 92 HG21 VAL 92 25.441 -10.153 25.173 662 HG22 VAL 92 HG22 VAL 92 26.236 -11.367 24.170 663 HG23 VAL 92 HG23 VAL 92 24.937 -10.383 23.496 664 H ASP 93 HN ASP 93 26.977 -5.753 24.787 665 HA ASP 93 HA ASP 93 28.454 -4.735 22.486 666 HB2 ASP 93 HB2 ASP 93 27.830 -3.742 25.238 667 HB3 ASP 93 HB1 ASP 93 29.426 -3.312 24.639 668 H HIS 94 HN HIS 94 29.973 -6.428 22.026 669 HA HIS 94 HA HIS 94 31.475 -7.634 24.156 670 HB2 HIS 94 HB2 HIS 94 30.751 -8.714 21.927 671 HB3 HIS 94 HB1 HIS 94 32.135 -7.882 21.232 672 HD1 HIS 94 HD1 HIS 94 33.702 -9.777 20.799 673 HD2 HIS 94 HD2 HIS 94 32.122 -9.863 24.644 674 HE1 HIS 94 HE1 HIS 94 34.936 -11.608 21.996 675 HE2 HIS 94 HE2 HIS 94 34.120 -11.486 24.380 676 H ASN 95 HN ASN 95 31.773 -4.698 22.718 677 HA ASN 95 HA ASN 95 34.638 -4.586 22.511 678 HB2 ASN 95 HB2 ASN 95 34.279 -2.103 22.311 679 HB3 ASN 95 HB1 ASN 95 33.341 -3.043 21.152 680 HD21 ASN 95 HD21 ASN 95 31.127 -3.151 21.362 681 HD22 ASN 95 HD22 ASN 95 30.227 -2.076 22.375 682 H THR 96 HN THR 96 32.224 -3.528 24.897 683 HA THR 96 HA THR 96 34.380 -3.100 26.833 684 HB THR 96 HB THR 96 32.474 -2.162 28.264 685 HG1 THR 96 HG1 THR 96 30.624 -2.827 27.316 686 HG21 THR 96 HG21 THR 96 34.059 -0.701 27.138 687 HG22 THR 96 HG22 THR 96 32.437 -0.014 27.069 688 HG23 THR 96 HG23 THR 96 33.120 -0.800 25.646 689 H ARG 97 HN ARG 97 32.094 -5.325 25.863 690 HA ARG 97 HA ARG 97 31.354 -7.322 26.606 691 HB2 ARG 97 HB2 ARG 97 33.579 -6.956 28.599 692 HB3 ARG 97 HB1 ARG 97 32.547 -8.382 28.571 693 HG2 ARG 97 HG2 ARG 97 33.179 -8.713 26.199 694 HG3 ARG 97 HG1 ARG 97 34.334 -7.392 26.367 695 HD2 ARG 97 HD2 ARG 97 35.472 -9.508 26.644 696 HD3 ARG 97 HD1 ARG 97 35.456 -8.622 28.165 697 HE ARG 97 HE ARG 97 33.392 -10.648 27.726 698 HH11 ARG 97 HH11 ARG 97 36.335 -9.653 29.322 699 HH12 ARG 97 HH12 ARG 97 36.256 -10.900 30.534 700 HH21 ARG 97 HH21 ARG 97 33.262 -12.265 29.328 701 HH22 ARG 97 HH22 ARG 97 34.486 -12.366 30.556 702 H THR 98 HN THR 98 29.564 -5.940 26.945 703 HA THR 98 HA THR 98 28.519 -6.272 29.659 704 HB THR 98 HB THR 98 27.349 -3.944 29.247 705 HG1 THR 98 HG1 THR 98 28.307 -2.639 27.838 706 HG21 THR 98 HG21 THR 98 29.180 -2.797 30.451 707 HG22 THR 98 HG22 THR 98 30.256 -4.142 30.071 708 HG23 THR 98 HG23 THR 98 28.868 -4.397 31.129 709 H THR 99 HN THR 99 26.108 -6.253 29.679 710 HA THR 99 HA THR 99 25.100 -7.112 27.029 711 HB THR 99 HB THR 99 23.245 -8.224 28.477 712 HG1 THR 99 HG1 THR 99 24.243 -6.942 30.387 713 HG21 THR 99 HG21 THR 99 25.016 -9.572 27.370 714 HG22 THR 99 HG22 THR 99 24.697 -10.203 28.989 715 HG23 THR 99 HG23 THR 99 26.128 -9.217 28.694 716 H THR 100 HN THR 100 23.127 -6.266 26.241 717 HA THR 100 HA THR 100 21.658 -4.364 27.861 718 HB THR 100 HB THR 100 23.472 -3.002 26.867 719 HG1 THR 100 HG1 THR 100 22.060 -1.411 25.984 720 HG21 THR 100 HG21 THR 100 23.487 -2.573 24.444 721 HG22 THR 100 HG22 THR 100 22.251 -3.812 24.219 722 HG23 THR 100 HG23 THR 100 23.852 -4.260 24.807 723 H PHE 101 HN PHE 101 19.637 -3.677 26.785 724 HA PHE 101 HA PHE 101 18.735 -5.703 24.851 725 HB2 PHE 101 HB2 PHE 101 17.277 -4.215 27.048 726 HB3 PHE 101 HB1 PHE 101 16.393 -5.015 25.683 727 HD1 PHE 101 HD1 PHE 101 16.048 -7.343 25.689 728 HD2 PHE 101 HD2 PHE 101 18.682 -5.598 28.537 729 HE1 PHE 101 HE1 PHE 101 16.149 -9.477 26.901 730 HE2 PHE 101 HE2 PHE 101 18.783 -7.726 29.765 731 HZ PHE 101 HZ PHE 101 17.449 -9.693 28.917 732 H LYS 102 HN LYS 102 18.772 -4.873 22.853 733 HA LYS 102 HA LYS 102 17.558 -2.252 22.405 734 HB2 LYS 102 HB2 LYS 102 20.249 -3.127 21.357 735 HB3 LYS 102 HB1 LYS 102 19.366 -1.741 20.754 736 HG2 LYS 102 HG2 LYS 102 19.546 -0.625 22.877 737 HG3 LYS 102 HG1 LYS 102 20.282 -2.057 23.600 738 HD2 LYS 102 HD2 LYS 102 21.970 -0.374 23.032 739 HD3 LYS 102 HD1 LYS 102 22.190 -1.857 22.102 740 HE2 LYS 102 HE2 LYS 102 22.479 -0.025 20.607 741 HE3 LYS 102 HE1 LYS 102 20.933 -0.787 20.235 742 HZ1 LYS 102 HZ1 LYS 102 19.827 0.963 21.501 743 HZ2 LYS 102 HZ2 LYS 102 20.739 1.606 20.230 744 HZ3 LYS 102 HZ3 LYS 102 21.323 1.695 21.819 745 H ASP 103 HN ASP 103 15.778 -3.066 21.338 746 HA ASP 103 HA ASP 103 16.277 -4.765 19.015 747 HB2 ASP 103 HB2 ASP 103 13.988 -4.353 20.799 748 HB3 ASP 103 HB1 ASP 103 13.547 -4.351 19.096 749 HA PRO 104 HA PRO 104 16.216 -1.503 16.136 750 HB2 PRO 104 HB2 PRO 104 14.578 -3.119 14.296 751 HB3 PRO 104 HB1 PRO 104 16.236 -2.575 14.102 752 HG2 PRO 104 HG2 PRO 104 15.568 -5.151 14.569 753 HG3 PRO 104 HG1 PRO 104 17.103 -4.451 15.122 754 HD2 PRO 104 HD2 PRO 104 14.629 -5.085 16.656 755 HD3 PRO 104 HD1 PRO 104 16.324 -5.152 17.169 756 H ARG 105 HN ARG 105 13.088 -2.947 16.879 757 HA ARG 105 HA ARG 105 11.759 -0.632 15.686 758 HB2 ARG 105 HB2 ARG 105 10.889 -3.411 16.273 759 HB3 ARG 105 HB1 ARG 105 9.673 -2.151 16.445 760 HG2 ARG 105 HG2 ARG 105 9.588 -3.159 14.247 761 HG3 ARG 105 HG1 ARG 105 10.050 -1.457 14.143 762 HD2 ARG 105 HD2 ARG 105 12.438 -2.197 13.979 763 HD3 ARG 105 HD1 ARG 105 11.858 -3.860 13.887 764 HE ARG 105 HE ARG 105 10.814 -1.942 11.949 765 HH11 ARG 105 HH11 ARG 105 12.950 -4.652 12.604 766 HH12 ARG 105 HH12 ARG 105 13.160 -5.050 10.932 767 HH21 ARG 105 HH21 ARG 105 11.083 -2.476 9.743 768 HH22 ARG 105 HH22 ARG 105 12.089 -3.828 9.303 769 HA PRO 106 HA PRO 106 11.183 1.016 19.792 770 HB2 PRO 106 HB2 PRO 106 9.219 2.858 19.227 771 HB3 PRO 106 HB1 PRO 106 10.976 3.126 18.935 772 HG2 PRO 106 HG2 PRO 106 8.816 2.403 17.016 773 HG3 PRO 106 HG1 PRO 106 10.238 3.414 16.774 774 HD2 PRO 106 HD2 PRO 106 9.950 0.827 15.902 775 HD3 PRO 106 HD1 PRO 106 11.507 1.644 16.216 776 H GLY 107 HN GLY 107 10.098 -0.063 21.323 777 HA2 GLY 107 HA2 GLY 107 8.307 -0.898 22.508 778 HA3 GLY 107 HA1 GLY 107 7.222 -0.354 21.210 779 H PHE 108 HN PHE 108 8.813 -1.823 19.172 780 HA PHE 108 HA PHE 108 8.708 -3.848 18.058 781 HB2 PHE 108 HB2 PHE 108 10.199 -4.305 20.201 782 HB3 PHE 108 HB1 PHE 108 8.790 -5.299 20.703 783 HD1 PHE 108 HD1 PHE 108 8.413 -7.422 19.740 784 HD2 PHE 108 HD2 PHE 108 11.411 -4.881 18.088 785 HE1 PHE 108 HE1 PHE 108 9.255 -9.292 18.391 786 HE2 PHE 108 HE2 PHE 108 12.244 -6.753 16.736 787 HZ PHE 108 HZ PHE 108 11.178 -8.958 16.880 788 H GLU 109 HN GLU 109 6.259 -2.587 18.944 789 HA GLU 109 HA GLU 109 4.033 -2.935 18.727 790 HB2 GLU 109 HB2 GLU 109 4.889 -4.645 16.977 791 HB3 GLU 109 HB1 GLU 109 4.538 -5.860 18.191 792 HG2 GLU 109 HG2 GLU 109 2.723 -5.694 16.612 793 HG3 GLU 109 HG1 GLU 109 2.191 -5.170 18.213 Start of MODEL 15 1 H1 GLY 1 HT1 GLY 1 -38.412 8.888 4.093 2 H2 GLY 1 HT2 GLY 1 -38.833 10.485 4.480 3 H3 GLY 1 HT3 GLY 1 -37.927 10.161 3.084 4 HA2 GLY 1 HA1 GLY 1 -40.722 9.291 3.561 5 HA3 GLY 1 HA2 GLY 1 -40.235 10.632 2.532 6 H SER 2 HN SER 2 -38.504 9.975 0.860 7 HA SER 2 HA SER 2 -39.603 7.653 -0.533 8 HB2 SER 2 HB2 SER 2 -39.422 9.913 -1.657 9 HB3 SER 2 HB1 SER 2 -37.672 9.723 -1.603 10 HG SER 2 HG SER 2 -38.960 9.021 -3.573 11 H HIS 3 HN HIS 3 -38.408 5.879 -1.078 12 HA HIS 3 HA HIS 3 -35.863 5.577 0.333 13 HB2 HIS 3 HB2 HIS 3 -37.625 3.536 -1.051 14 HB3 HIS 3 HB1 HIS 3 -36.121 3.157 -0.224 15 HD1 HIS 3 HD1 HIS 3 -37.287 1.626 1.487 16 HD2 HIS 3 HD2 HIS 3 -38.716 5.537 1.494 17 HE1 HIS 3 HE1 HIS 3 -38.706 1.834 3.549 18 HE2 HIS 3 HE2 HIS 3 -39.411 4.248 3.620 19 H MET 4 HN MET 4 -33.949 5.830 -0.861 20 HA MET 4 HA MET 4 -34.212 5.574 -3.773 21 HB2 MET 4 HB2 MET 4 -32.363 7.123 -4.017 22 HB3 MET 4 HB1 MET 4 -33.574 7.839 -2.968 23 HG2 MET 4 HG2 MET 4 -32.264 7.349 -1.026 24 HG3 MET 4 HG1 MET 4 -31.084 6.469 -1.998 25 HE1 MET 4 HE1 MET 4 -32.570 9.927 -1.029 26 HE2 MET 4 HE2 MET 4 -32.936 9.892 -2.754 27 HE3 MET 4 HE3 MET 4 -31.743 11.032 -2.127 28 H GLN 5 HN GLN 5 -32.881 4.201 -4.867 29 HA GLN 5 HA GLN 5 -31.676 2.093 -3.406 30 HB2 GLN 5 HB2 GLN 5 -32.701 1.719 -5.572 31 HB3 GLN 5 HB1 GLN 5 -31.550 2.804 -6.337 32 HG2 GLN 5 HG2 GLN 5 -29.729 1.259 -5.708 33 HG3 GLN 5 HG1 GLN 5 -30.937 0.149 -5.056 34 HE21 GLN 5 HE21 GLN 5 -29.592 1.576 -7.925 35 HE22 GLN 5 HE22 GLN 5 -30.316 0.467 -9.065 36 H TYR 6 HN TYR 6 -29.633 1.701 -2.861 37 HA TYR 6 HA TYR 6 -27.509 3.488 -3.850 38 HB2 TYR 6 HB2 TYR 6 -28.168 2.734 -1.026 39 HB3 TYR 6 HB1 TYR 6 -26.461 2.781 -1.451 40 HD1 TYR 6 HD1 TYR 6 -25.399 4.896 -2.083 41 HD2 TYR 6 HD2 TYR 6 -29.487 4.758 -0.890 42 HE1 TYR 6 HE1 TYR 6 -25.382 7.326 -1.742 43 HE2 TYR 6 HE2 TYR 6 -29.475 7.190 -0.559 44 HH TYR 6 HH TYR 6 -27.009 9.191 -1.712 45 H LYS 7 HN LYS 7 -25.396 2.481 -3.928 46 HA LYS 7 HA LYS 7 -25.458 -0.433 -3.850 47 HB2 LYS 7 HB2 LYS 7 -24.209 -0.444 -6.077 48 HB3 LYS 7 HB1 LYS 7 -25.942 -0.040 -6.148 49 HG2 LYS 7 HG2 LYS 7 -25.387 2.322 -6.285 50 HG3 LYS 7 HG1 LYS 7 -23.670 1.940 -6.192 51 HD2 LYS 7 HD2 LYS 7 -24.266 2.327 -8.493 52 HD3 LYS 7 HD1 LYS 7 -23.895 0.616 -8.276 53 HE2 LYS 7 HE2 LYS 7 -26.259 0.084 -8.204 54 HE3 LYS 7 HE1 LYS 7 -26.674 1.795 -8.310 55 HZ1 LYS 7 HZ1 LYS 7 -25.144 0.351 -10.413 56 HZ2 LYS 7 HZ2 LYS 7 -25.829 1.900 -10.512 57 HZ3 LYS 7 HZ3 LYS 7 -26.831 0.538 -10.441 58 H LEU 8 HN LEU 8 -23.438 -1.456 -3.730 59 HA LEU 8 HA LEU 8 -21.113 0.269 -3.178 60 HB2 LEU 8 HB2 LEU 8 -22.167 -0.211 -0.975 61 HB3 LEU 8 HB1 LEU 8 -22.149 -1.908 -1.354 62 HG LEU 8 HG LEU 8 -19.575 -1.608 -1.532 63 HD11 LEU 8 HD11 LEU 8 -20.329 0.752 0.179 64 HD12 LEU 8 HD12 LEU 8 -19.494 0.797 -1.374 65 HD13 LEU 8 HD13 LEU 8 -18.707 0.073 0.028 66 HD21 LEU 8 HD21 LEU 8 -20.402 -3.042 0.070 67 HD22 LEU 8 HD22 LEU 8 -21.263 -1.760 0.909 68 HD23 LEU 8 HD23 LEU 8 -19.502 -1.855 1.019 69 H ILE 9 HN ILE 9 -19.225 -0.572 -3.833 70 HA ILE 9 HA ILE 9 -19.184 -3.388 -4.691 71 HB ILE 9 HB ILE 9 -17.546 -1.114 -5.873 72 HG12 ILE 9 HG12 ILE 9 -19.735 -2.602 -7.347 73 HG13 ILE 9 HG11 ILE 9 -20.076 -1.130 -6.379 74 HG21 ILE 9 HG21 ILE 9 -16.484 -3.323 -5.967 75 HG22 ILE 9 HG22 ILE 9 -16.911 -2.717 -7.566 76 HG23 ILE 9 HG23 ILE 9 -17.910 -3.946 -6.798 77 HD11 ILE 9 HD11 ILE 9 -18.529 0.140 -7.785 78 HD12 ILE 9 HD12 ILE 9 -19.787 -0.625 -8.756 79 HD13 ILE 9 HD13 ILE 9 -18.164 -1.314 -8.714 80 H LEU 10 HN LEU 10 -17.736 -4.624 -3.662 81 HA LEU 10 HA LEU 10 -15.922 -3.283 -1.804 82 HB2 LEU 10 HB2 LEU 10 -16.532 -6.229 -2.047 83 HB3 LEU 10 HB1 LEU 10 -15.462 -5.516 -0.867 84 HG LEU 10 HG LEU 10 -17.371 -5.953 0.339 85 HD11 LEU 10 HD11 LEU 10 -18.364 -3.897 0.973 86 HD12 LEU 10 HD12 LEU 10 -17.848 -3.137 -0.530 87 HD13 LEU 10 HD13 LEU 10 -16.646 -3.655 0.661 88 HD21 LEU 10 HD21 LEU 10 -19.145 -4.806 -1.797 89 HD22 LEU 10 HD22 LEU 10 -19.631 -5.683 -0.346 90 HD23 LEU 10 HD23 LEU 10 -18.776 -6.522 -1.642 91 H ASN 11 HN ASN 11 -14.104 -2.659 -2.738 92 HA ASN 11 HA ASN 11 -12.904 -4.495 -4.676 93 HB2 ASN 11 HB2 ASN 11 -13.332 -1.927 -5.079 94 HB3 ASN 11 HB1 ASN 11 -11.839 -1.748 -4.165 95 HD21 ASN 11 HD21 ASN 11 -12.422 -1.146 -6.950 96 HD22 ASN 11 HD22 ASN 11 -11.318 -2.074 -7.895 97 H GLY 12 HN GLY 12 -12.182 -5.936 -3.108 98 HA2 GLY 12 HA2 GLY 12 -9.601 -5.107 -1.976 99 HA3 GLY 12 HA1 GLY 12 -10.758 -5.931 -0.911 100 H LYS 13 HN LYS 13 -8.097 -6.508 -2.606 101 HA LYS 13 HA LYS 13 -8.357 -8.393 -4.498 102 HB2 LYS 13 HB2 LYS 13 -6.301 -8.460 -2.284 103 HB3 LYS 13 HB1 LYS 13 -6.163 -9.284 -3.835 104 HG2 LYS 13 HG2 LYS 13 -6.288 -7.057 -4.948 105 HG3 LYS 13 HG1 LYS 13 -6.245 -6.308 -3.349 106 HD2 LYS 13 HD2 LYS 13 -4.020 -6.314 -4.301 107 HD3 LYS 13 HD1 LYS 13 -4.074 -7.426 -2.931 108 HE2 LYS 13 HE2 LYS 13 -2.855 -8.427 -4.758 109 HE3 LYS 13 HE1 LYS 13 -4.360 -9.302 -4.493 110 HZ1 LYS 13 HZ1 LYS 13 -3.666 -7.464 -6.699 111 HZ2 LYS 13 HZ2 LYS 13 -5.278 -7.804 -6.325 112 HZ3 LYS 13 HZ3 LYS 13 -4.238 -9.059 -6.787 113 H THR 14 HN THR 14 -8.544 -9.106 -1.022 114 HA THR 14 HA THR 14 -8.774 -11.951 -1.495 115 HB THR 14 HB THR 14 -9.421 -10.486 1.067 116 HG1 THR 14 HG1 THR 14 -7.005 -11.294 1.311 117 HG21 THR 14 HG21 THR 14 -10.003 -12.890 0.954 118 HG22 THR 14 HG22 THR 14 -8.727 -12.561 2.126 119 HG23 THR 14 HG23 THR 14 -8.324 -13.257 0.557 120 H LEU 15 HN LEU 15 -11.042 -9.292 -1.073 121 HA LEU 15 HA LEU 15 -13.245 -11.185 -1.340 122 HB2 LEU 15 HB2 LEU 15 -12.800 -9.115 0.740 123 HB3 LEU 15 HB1 LEU 15 -14.428 -9.443 0.225 124 HG LEU 15 HG LEU 15 -12.545 -11.570 1.226 125 HD11 LEU 15 HD11 LEU 15 -14.648 -10.046 2.730 126 HD12 LEU 15 HD12 LEU 15 -12.904 -9.878 2.924 127 HD13 LEU 15 HD13 LEU 15 -13.697 -11.398 3.348 128 HD21 LEU 15 HD21 LEU 15 -14.387 -12.383 -0.133 129 HD22 LEU 15 HD22 LEU 15 -15.536 -11.498 0.867 130 HD23 LEU 15 HD23 LEU 15 -14.614 -12.836 1.555 131 H LYS 16 HN LYS 16 -14.045 -10.677 -3.294 132 HA LYS 16 HA LYS 16 -14.479 -7.831 -3.890 133 HB2 LYS 16 HB2 LYS 16 -13.502 -9.976 -5.788 134 HB3 LYS 16 HB1 LYS 16 -13.938 -8.340 -6.258 135 HG2 LYS 16 HG2 LYS 16 -12.088 -7.409 -5.321 136 HG3 LYS 16 HG1 LYS 16 -11.897 -8.666 -4.109 137 HD2 LYS 16 HD2 LYS 16 -11.054 -8.613 -6.969 138 HD3 LYS 16 HD1 LYS 16 -10.111 -9.003 -5.530 139 HE2 LYS 16 HE2 LYS 16 -12.321 -10.729 -6.640 140 HE3 LYS 16 HE1 LYS 16 -10.607 -10.979 -6.964 141 HZ1 LYS 16 HZ1 LYS 16 -10.303 -11.211 -4.521 142 HZ2 LYS 16 HZ2 LYS 16 -11.264 -12.428 -5.210 143 HZ3 LYS 16 HZ3 LYS 16 -11.988 -11.168 -4.342 144 H GLY 17 HN GLY 17 -16.437 -7.303 -4.548 145 HA2 GLY 17 HA2 GLY 17 -18.285 -8.824 -5.931 146 HA3 GLY 17 HA1 GLY 17 -18.587 -9.120 -4.221 147 H GLU 18 HN GLU 18 -20.705 -8.069 -4.921 148 HA GLU 18 HA GLU 18 -20.608 -5.315 -4.081 149 HB2 GLU 18 HB2 GLU 18 -22.087 -4.676 -6.158 150 HB3 GLU 18 HB1 GLU 18 -20.341 -4.667 -6.280 151 HG2 GLU 18 HG2 GLU 18 -21.263 -5.638 -8.253 152 HG3 GLU 18 HG1 GLU 18 -20.437 -6.893 -7.342 153 H THR 19 HN THR 19 -22.805 -4.389 -3.783 154 HA THR 19 HA THR 19 -25.064 -6.162 -3.861 155 HB THR 19 HB THR 19 -23.879 -6.939 -1.800 156 HG1 THR 19 HG1 THR 19 -26.207 -5.667 -0.876 157 HG21 THR 19 HG21 THR 19 -22.875 -4.812 -1.084 158 HG22 THR 19 HG22 THR 19 -23.902 -5.466 0.198 159 HG23 THR 19 HG23 THR 19 -24.486 -4.143 -0.807 160 H THR 20 HN THR 20 -27.031 -5.029 -2.958 161 HA THR 20 HA THR 20 -26.707 -2.107 -3.046 162 HB THR 20 HB THR 20 -28.915 -1.994 -4.236 163 HG1 THR 20 HG1 THR 20 -28.905 -4.329 -5.464 164 HG21 THR 20 HG21 THR 20 -26.555 -3.275 -5.607 165 HG22 THR 20 HG22 THR 20 -27.007 -1.569 -5.602 166 HG23 THR 20 HG23 THR 20 -27.980 -2.739 -6.489 167 H THR 21 HN THR 21 -28.433 -0.892 -2.036 168 HA THR 21 HA THR 21 -30.361 -2.272 -0.402 169 HB THR 21 HB THR 21 -28.172 -2.249 0.994 170 HG1 THR 21 HG1 THR 21 -29.545 -2.443 2.588 171 HG21 THR 21 HG21 THR 21 -27.493 0.090 0.518 172 HG22 THR 21 HG22 THR 21 -27.789 -0.125 2.248 173 HG23 THR 21 HG23 THR 21 -28.994 0.674 1.236 174 H GLU 22 HN GLU 22 -31.827 -0.730 0.635 175 HA GLU 22 HA GLU 22 -31.995 1.754 -0.946 176 HB2 GLU 22 HB2 GLU 22 -34.415 1.711 -0.320 177 HB3 GLU 22 HB1 GLU 22 -33.961 0.266 -1.222 178 HG2 GLU 22 HG2 GLU 22 -33.841 -1.019 0.828 179 HG3 GLU 22 HG1 GLU 22 -34.236 0.456 1.788 180 H ALA 23 HN ALA 23 -32.089 3.727 0.058 181 HA ALA 23 HA ALA 23 -32.435 3.846 2.974 182 HB1 ALA 23 HB1 ALA 23 -30.022 3.449 2.684 183 HB2 ALA 23 HB2 ALA 23 -30.341 5.057 3.332 184 HB3 ALA 23 HB3 ALA 23 -29.918 4.862 1.633 185 H VAL 24 HN VAL 24 -32.759 6.109 3.720 186 HA VAL 24 HA VAL 24 -33.690 7.828 1.563 187 HB VAL 24 HB VAL 24 -34.777 9.154 3.363 188 HG11 VAL 24 HG11 VAL 24 -36.463 7.461 3.932 189 HG12 VAL 24 HG12 VAL 24 -35.365 6.194 3.386 190 HG13 VAL 24 HG13 VAL 24 -35.996 7.370 2.233 191 HG21 VAL 24 HG21 VAL 24 -34.872 8.195 5.629 192 HG22 VAL 24 HG22 VAL 24 -33.238 8.690 5.185 193 HG23 VAL 24 HG23 VAL 24 -33.684 6.983 5.150 194 H ASP 25 HN ASP 25 -30.877 7.548 3.351 195 HA ASP 25 HA ASP 25 -30.165 10.313 2.769 196 HB2 ASP 25 HB2 ASP 25 -29.672 9.013 5.465 197 HB3 ASP 25 HB1 ASP 25 -28.917 10.506 4.930 198 H ALA 26 HN ALA 26 -27.898 10.628 2.479 199 HA ALA 26 HA ALA 26 -26.568 8.396 1.333 200 HB1 ALA 26 HB1 ALA 26 -26.260 10.687 0.502 201 HB2 ALA 26 HB2 ALA 26 -24.721 9.950 0.943 202 HB3 ALA 26 HB3 ALA 26 -25.472 11.131 2.016 203 H ALA 27 HN ALA 27 -26.229 10.164 4.359 204 HA ALA 27 HA ALA 27 -23.874 8.892 5.251 205 HB1 ALA 27 HB1 ALA 27 -24.424 9.789 7.441 206 HB2 ALA 27 HB2 ALA 27 -26.067 10.143 6.903 207 HB3 ALA 27 HB3 ALA 27 -24.700 11.002 6.191 208 H THR 28 HN THR 28 -27.285 8.074 5.544 209 HA THR 28 HA THR 28 -26.987 6.019 7.462 210 HB THR 28 HB THR 28 -29.155 6.094 5.362 211 HG1 THR 28 HG1 THR 28 -30.192 7.421 7.157 212 HG21 THR 28 HG21 THR 28 -29.135 5.223 8.264 213 HG22 THR 28 HG22 THR 28 -29.132 4.140 6.872 214 HG23 THR 28 HG23 THR 28 -30.531 5.169 7.186 215 H ALA 29 HN ALA 29 -26.647 6.096 3.965 216 HA ALA 29 HA ALA 29 -26.717 3.251 3.593 217 HB1 ALA 29 HB1 ALA 29 -27.239 4.782 1.747 218 HB2 ALA 29 HB2 ALA 29 -25.886 3.727 1.342 219 HB3 ALA 29 HB3 ALA 29 -25.590 5.405 1.800 220 H GLU 30 HN GLU 30 -24.335 5.691 4.223 221 HA GLU 30 HA GLU 30 -22.017 4.111 3.856 222 HB2 GLU 30 HB2 GLU 30 -22.317 6.700 4.131 223 HB3 GLU 30 HB1 GLU 30 -22.222 6.340 5.846 224 HG2 GLU 30 HG2 GLU 30 -20.038 5.171 5.373 225 HG3 GLU 30 HG1 GLU 30 -20.132 5.881 3.760 226 H LYS 31 HN LYS 31 -23.760 5.117 6.794 227 HA LYS 31 HA LYS 31 -22.291 3.773 8.677 228 HB2 LYS 31 HB2 LYS 31 -25.265 4.278 8.698 229 HB3 LYS 31 HB1 LYS 31 -24.329 3.784 10.097 230 HG2 LYS 31 HG2 LYS 31 -24.172 6.373 8.582 231 HG3 LYS 31 HG1 LYS 31 -24.651 6.122 10.262 232 HD2 LYS 31 HD2 LYS 31 -21.896 5.726 9.092 233 HD3 LYS 31 HD1 LYS 31 -22.408 7.027 10.170 234 HE2 LYS 31 HE2 LYS 31 -22.768 5.478 11.963 235 HE3 LYS 31 HE1 LYS 31 -22.470 4.103 10.899 236 HZ1 LYS 31 HZ1 LYS 31 -20.480 4.384 12.031 237 HZ2 LYS 31 HZ2 LYS 31 -20.538 6.079 11.948 238 HZ3 LYS 31 HZ3 LYS 31 -20.193 5.173 10.560 239 H VAL 32 HN VAL 32 -24.979 2.457 6.755 240 HA VAL 32 HA VAL 32 -25.066 -0.010 8.201 241 HB VAL 32 HB VAL 32 -26.199 0.693 5.484 242 HG11 VAL 32 HG11 VAL 32 -26.750 -1.702 7.240 243 HG12 VAL 32 HG12 VAL 32 -25.896 -1.721 5.699 244 HG13 VAL 32 HG13 VAL 32 -27.606 -1.297 5.752 245 HG21 VAL 32 HG21 VAL 32 -27.111 1.994 7.375 246 HG22 VAL 32 HG22 VAL 32 -27.561 0.483 8.167 247 HG23 VAL 32 HG23 VAL 32 -28.310 0.934 6.635 248 H PHE 33 HN PHE 33 -23.767 0.888 5.001 249 HA PHE 33 HA PHE 33 -22.789 -1.712 4.422 250 HB2 PHE 33 HB2 PHE 33 -22.300 1.005 3.276 251 HB3 PHE 33 HB1 PHE 33 -21.276 -0.325 2.792 252 HD1 PHE 33 HD1 PHE 33 -23.281 -2.525 2.682 253 HD2 PHE 33 HD2 PHE 33 -23.514 1.517 1.375 254 HE1 PHE 33 HE1 PHE 33 -24.938 -3.175 0.987 255 HE2 PHE 33 HE2 PHE 33 -25.180 0.871 -0.323 256 HZ PHE 33 HZ PHE 33 -25.894 -1.475 -0.529 257 H LYS 34 HN LYS 34 -21.498 0.874 6.354 258 HA LYS 34 HA LYS 34 -18.780 0.085 6.178 259 HB2 LYS 34 HB2 LYS 34 -20.313 1.798 8.130 260 HB3 LYS 34 HB1 LYS 34 -18.613 1.483 8.342 261 HG2 LYS 34 HG2 LYS 34 -18.390 2.348 5.910 262 HG3 LYS 34 HG1 LYS 34 -19.991 3.035 6.197 263 HD2 LYS 34 HD2 LYS 34 -18.432 4.754 6.750 264 HD3 LYS 34 HD1 LYS 34 -19.062 4.114 8.267 265 HE2 LYS 34 HE2 LYS 34 -17.074 2.769 8.577 266 HE3 LYS 34 HE1 LYS 34 -16.454 3.286 7.009 267 HZ1 LYS 34 HZ1 LYS 34 -15.386 4.582 8.678 268 HZ2 LYS 34 HZ2 LYS 34 -16.863 4.970 9.419 269 HZ3 LYS 34 HZ3 LYS 34 -16.488 5.605 7.890 270 H GLN 35 HN GLN 35 -21.386 -0.562 8.499 271 HA GLN 35 HA GLN 35 -19.895 -2.309 10.146 272 HB2 GLN 35 HB2 GLN 35 -22.054 -1.250 10.806 273 HB3 GLN 35 HB1 GLN 35 -22.886 -2.277 9.652 274 HG2 GLN 35 HG2 GLN 35 -23.131 -3.184 11.853 275 HG3 GLN 35 HG1 GLN 35 -22.127 -4.258 10.879 276 HE21 GLN 35 HE21 GLN 35 -21.175 -5.199 12.666 277 HE22 GLN 35 HE22 GLN 35 -20.027 -4.369 13.659 278 H TYR 36 HN TYR 36 -21.644 -2.632 7.175 279 HA TYR 36 HA TYR 36 -21.770 -5.452 6.985 280 HB2 TYR 36 HB2 TYR 36 -23.222 -4.247 5.586 281 HB3 TYR 36 HB1 TYR 36 -21.957 -3.141 5.084 282 HD1 TYR 36 HD1 TYR 36 -22.838 -6.723 4.885 283 HD2 TYR 36 HD2 TYR 36 -21.081 -3.390 2.932 284 HE1 TYR 36 HE1 TYR 36 -22.527 -8.099 2.879 285 HE2 TYR 36 HE2 TYR 36 -20.767 -4.739 0.895 286 HH TYR 36 HH TYR 36 -22.262 -7.712 0.399 287 H ALA 37 HN ALA 37 -19.493 -3.056 5.664 288 HA ALA 37 HA ALA 37 -17.735 -4.972 4.500 289 HB1 ALA 37 HB1 ALA 37 -17.159 -2.113 5.287 290 HB2 ALA 37 HB2 ALA 37 -17.913 -2.606 3.773 291 HB3 ALA 37 HB3 ALA 37 -16.252 -3.090 4.130 292 H ASN 38 HN ASN 38 -18.015 -3.462 7.615 293 HA ASN 38 HA ASN 38 -15.470 -4.026 8.668 294 HB2 ASN 38 HB2 ASN 38 -17.070 -2.489 9.801 295 HB3 ASN 38 HB1 ASN 38 -18.136 -3.854 10.129 296 HD21 ASN 38 HD21 ASN 38 -15.464 -2.027 11.272 297 HD22 ASN 38 HD22 ASN 38 -15.080 -3.049 12.669 298 H ASP 39 HN ASP 39 -18.484 -5.886 8.727 299 HA ASP 39 HA ASP 39 -17.540 -8.067 10.235 300 HB2 ASP 39 HB2 ASP 39 -19.928 -7.655 9.889 301 HB3 ASP 39 HB1 ASP 39 -19.751 -7.957 8.166 302 H ASN 40 HN ASN 40 -17.051 -7.176 6.947 303 HA ASN 40 HA ASN 40 -16.206 -9.865 6.188 304 HB2 ASN 40 HB2 ASN 40 -16.842 -7.376 4.645 305 HB3 ASN 40 HB1 ASN 40 -15.835 -8.620 3.923 306 HD21 ASN 40 HD21 ASN 40 -19.012 -7.707 4.924 307 HD22 ASN 40 HD22 ASN 40 -19.844 -9.134 4.274 308 H GLY 41 HN GLY 41 -14.923 -7.131 7.548 309 HA2 GLY 41 HA2 GLY 41 -12.747 -6.661 8.132 310 HA3 GLY 41 HA1 GLY 41 -12.253 -8.105 7.258 311 H VAL 42 HN VAL 42 -14.107 -5.607 5.655 312 HA VAL 42 HA VAL 42 -11.721 -4.926 4.114 313 HB VAL 42 HB VAL 42 -14.641 -4.440 3.430 314 HG11 VAL 42 HG11 VAL 42 -13.045 -2.796 2.475 315 HG12 VAL 42 HG12 VAL 42 -13.798 -3.797 1.231 316 HG13 VAL 42 HG13 VAL 42 -12.143 -4.125 1.745 317 HG21 VAL 42 HG21 VAL 42 -14.240 -6.200 1.716 318 HG22 VAL 42 HG22 VAL 42 -14.139 -6.800 3.373 319 HG23 VAL 42 HG23 VAL 42 -12.664 -6.500 2.449 320 H ASP 43 HN ASP 43 -10.817 -3.040 4.403 321 HA ASP 43 HA ASP 43 -12.318 -0.801 5.508 322 HB2 ASP 43 HB2 ASP 43 -11.500 -2.042 7.518 323 HB3 ASP 43 HB1 ASP 43 -9.857 -1.911 6.900 324 H GLY 44 HN GLY 44 -11.867 0.475 3.732 325 HA2 GLY 44 HA2 GLY 44 -9.099 1.217 3.270 326 HA3 GLY 44 HA1 GLY 44 -9.932 0.460 1.919 327 H GLU 45 HN GLU 45 -9.407 2.570 0.914 328 HA GLU 45 HA GLU 45 -10.523 5.031 1.786 329 HB2 GLU 45 HB2 GLU 45 -9.393 3.992 -0.777 330 HB3 GLU 45 HB1 GLU 45 -10.255 5.520 -0.792 331 HG2 GLU 45 HG2 GLU 45 -8.011 5.026 1.128 332 HG3 GLU 45 HG1 GLU 45 -7.720 5.549 -0.528 333 H TRP 46 HN TRP 46 -12.361 6.110 1.142 334 HA TRP 46 HA TRP 46 -14.447 4.415 -0.074 335 HB2 TRP 46 HB2 TRP 46 -14.580 6.331 2.231 336 HB3 TRP 46 HB1 TRP 46 -15.998 6.167 1.212 337 HD1 TRP 46 HD1 TRP 46 -13.557 3.734 2.989 338 HE1 TRP 46 HE1 TRP 46 -14.914 1.847 4.076 339 HE3 TRP 46 HE3 TRP 46 -18.290 5.147 1.562 340 HZ2 TRP 46 HZ2 TRP 46 -17.589 1.060 4.315 341 HZ3 TRP 46 HZ3 TRP 46 -20.178 3.762 2.282 342 HH2 TRP 46 HH2 TRP 46 -19.840 1.758 3.621 343 H THR 47 HN THR 47 -14.939 5.016 -2.047 344 HA THR 47 HA THR 47 -14.855 7.870 -2.746 345 HB THR 47 HB THR 47 -14.898 6.935 -5.144 346 HG1 THR 47 HG1 THR 47 -14.525 4.829 -5.423 347 HG21 THR 47 HG21 THR 47 -12.922 7.951 -4.127 348 HG22 THR 47 HG22 THR 47 -12.474 6.588 -5.150 349 HG23 THR 47 HG23 THR 47 -12.492 6.406 -3.394 350 H TYR 48 HN TYR 48 -16.598 8.586 -4.295 351 HA TYR 48 HA TYR 48 -19.017 7.008 -4.252 352 HB2 TYR 48 HB2 TYR 48 -19.307 7.955 -2.096 353 HB3 TYR 48 HB1 TYR 48 -18.810 9.548 -2.605 354 HD1 TYR 48 HD1 TYR 48 -20.381 10.996 -3.821 355 HD2 TYR 48 HD2 TYR 48 -21.622 7.133 -2.477 356 HE1 TYR 48 HE1 TYR 48 -22.725 11.610 -4.199 357 HE2 TYR 48 HE2 TYR 48 -23.967 7.759 -2.850 358 HH TYR 48 HH TYR 48 -25.329 9.823 -2.996 359 H ASP 49 HN ASP 49 -20.454 7.581 -5.866 360 HA ASP 49 HA ASP 49 -19.691 9.943 -7.482 361 HB2 ASP 49 HB2 ASP 49 -20.779 8.735 -9.431 362 HB3 ASP 49 HB1 ASP 49 -19.285 7.999 -8.873 363 H ASP 50 HN ASP 50 -21.474 11.081 -8.468 364 HA ASP 50 HA ASP 50 -23.404 11.525 -6.355 365 HB2 ASP 50 HB2 ASP 50 -23.009 12.946 -9.001 366 HB3 ASP 50 HB1 ASP 50 -24.045 13.510 -7.695 367 H ALA 51 HN ALA 51 -23.767 11.005 -9.876 368 HA ALA 51 HA ALA 51 -26.583 11.034 -9.771 369 HB1 ALA 51 HB1 ALA 51 -25.293 11.604 -11.775 370 HB2 ALA 51 HB2 ALA 51 -26.525 10.381 -12.093 371 HB3 ALA 51 HB3 ALA 51 -24.831 9.911 -11.946 372 H THR 52 HN THR 52 -24.288 8.312 -9.695 373 HA THR 52 HA THR 52 -26.582 6.501 -9.813 374 HB THR 52 HB THR 52 -24.717 4.724 -10.008 375 HG1 THR 52 HG1 THR 52 -23.086 6.433 -9.402 376 HG21 THR 52 HG21 THR 52 -26.155 5.387 -11.870 377 HG22 THR 52 HG22 THR 52 -24.491 5.183 -12.425 378 HG23 THR 52 HG23 THR 52 -25.142 6.802 -12.164 379 H LYS 53 HN LYS 53 -24.632 7.902 -7.475 380 HA LYS 53 HA LYS 53 -24.406 7.578 -5.202 381 HB2 LYS 53 HB2 LYS 53 -26.932 6.017 -5.727 382 HB3 LYS 53 HB1 LYS 53 -26.265 6.197 -4.112 383 HG2 LYS 53 HG2 LYS 53 -27.864 7.853 -4.236 384 HG3 LYS 53 HG1 LYS 53 -26.371 8.719 -4.604 385 HD2 LYS 53 HD2 LYS 53 -27.988 9.429 -6.165 386 HD3 LYS 53 HD1 LYS 53 -26.891 8.368 -7.035 387 HE2 LYS 53 HE2 LYS 53 -29.163 7.875 -7.664 388 HE3 LYS 53 HE1 LYS 53 -28.510 6.527 -6.729 389 HZ1 LYS 53 HZ1 LYS 53 -30.755 7.073 -6.032 390 HZ2 LYS 53 HZ2 LYS 53 -30.292 8.673 -5.693 391 HZ3 LYS 53 HZ3 LYS 53 -29.660 7.392 -4.778 392 H THR 54 HN THR 54 -22.821 5.952 -6.831 393 HA THR 54 HA THR 54 -22.914 3.286 -5.689 394 HB THR 54 HB THR 54 -20.814 4.340 -7.593 395 HG1 THR 54 HG1 THR 54 -22.506 4.608 -8.864 396 HG21 THR 54 HG21 THR 54 -20.592 1.987 -8.209 397 HG22 THR 54 HG22 THR 54 -21.936 1.552 -7.153 398 HG23 THR 54 HG23 THR 54 -20.423 2.139 -6.458 399 H TYR 55 HN TYR 55 -22.124 3.100 -3.670 400 HA TYR 55 HA TYR 55 -19.797 4.646 -2.850 401 HB2 TYR 55 HB2 TYR 55 -21.613 2.715 -1.384 402 HB3 TYR 55 HB1 TYR 55 -20.019 3.089 -0.746 403 HD1 TYR 55 HD1 TYR 55 -23.376 4.345 -1.369 404 HD2 TYR 55 HD2 TYR 55 -19.517 5.335 0.110 405 HE1 TYR 55 HE1 TYR 55 -24.307 6.367 -0.324 406 HE2 TYR 55 HE2 TYR 55 -20.436 7.359 1.165 407 HH TYR 55 HH TYR 55 -22.433 8.888 0.795 408 H THR 56 HN THR 56 -17.750 3.917 -2.992 409 HA THR 56 HA THR 56 -17.389 1.034 -3.471 410 HB THR 56 HB THR 56 -15.855 3.274 -4.821 411 HG1 THR 56 HG1 THR 56 -18.027 2.813 -5.592 412 HG21 THR 56 HG21 THR 56 -14.792 1.456 -6.115 413 HG22 THR 56 HG22 THR 56 -15.623 0.268 -5.111 414 HG23 THR 56 HG23 THR 56 -14.417 1.335 -4.396 415 H VAL 57 HN VAL 57 -16.127 0.096 -1.999 416 HA VAL 57 HA VAL 57 -14.277 1.817 -0.477 417 HB VAL 57 HB VAL 57 -15.913 0.712 1.036 418 HG11 VAL 57 HG11 VAL 57 -14.792 -1.853 -0.085 419 HG12 VAL 57 HG12 VAL 57 -16.478 -1.333 -0.057 420 HG13 VAL 57 HG13 VAL 57 -15.665 -1.765 1.439 421 HG21 VAL 57 HG21 VAL 57 -14.301 -0.240 2.604 422 HG22 VAL 57 HG22 VAL 57 -13.678 1.229 1.854 423 HG23 VAL 57 HG23 VAL 57 -13.105 -0.350 1.315 424 H THR 58 HN THR 58 -12.293 1.703 -1.127 425 HA THR 58 HA THR 58 -11.414 -0.719 -2.553 426 HB THR 58 HB THR 58 -10.234 2.047 -2.763 427 HG1 THR 58 HG1 THR 58 -12.567 1.396 -3.580 428 HG21 THR 58 HG21 THR 58 -9.941 -0.442 -4.440 429 HG22 THR 58 HG22 THR 58 -8.702 0.314 -3.435 430 HG23 THR 58 HG23 THR 58 -9.300 1.140 -4.875 431 H GLU 59 HN GLU 59 -9.946 -1.923 -1.606 432 HA GLU 59 HA GLU 59 -8.744 -1.287 0.870 433 HB2 GLU 59 HB2 GLU 59 -8.206 -3.488 -1.132 434 HB3 GLU 59 HB1 GLU 59 -7.202 -3.299 0.269 435 HG2 GLU 59 HG2 GLU 59 -10.171 -3.690 0.409 436 HG3 GLU 59 HG1 GLU 59 -8.974 -4.975 0.566 437 H GLY 60 HN GLY 60 -6.540 -0.754 1.384 438 HA2 GLY 60 HA2 GLY 60 -5.289 0.893 -0.673 439 HA3 GLY 60 HA1 GLY 60 -4.814 0.777 1.021 440 H SER 61 HN SER 61 -2.616 0.637 0.142 441 HA SER 61 HA SER 61 -1.944 -2.157 -0.408 442 HB2 SER 61 HB2 SER 61 -0.320 -1.330 -2.210 443 HB3 SER 61 HB1 SER 61 -2.034 -1.277 -2.632 444 HG SER 61 HG SER 61 -1.525 0.724 -3.118 445 H GLY 62 HN GLY 62 -0.442 1.070 -0.108 446 HA2 GLY 62 HA2 GLY 62 1.120 1.755 1.500 447 HA3 GLY 62 HA1 GLY 62 1.139 0.114 2.138 448 H GLY 63 HN GLY 63 2.123 2.016 -0.680 449 HA2 GLY 63 HA2 GLY 63 3.919 0.080 -1.714 450 HA3 GLY 63 HA1 GLY 63 3.853 1.775 -2.161 451 H ALA 64 HN ALA 64 4.207 2.525 0.720 452 HA ALA 64 HA ALA 64 5.863 3.117 2.148 453 HB1 ALA 64 HB1 ALA 64 7.238 0.627 1.140 454 HB2 ALA 64 HB2 ALA 64 6.126 0.720 2.505 455 HB3 ALA 64 HB3 ALA 64 7.684 1.540 2.581 456 H GLY 65 HN GLY 65 8.629 3.133 1.991 457 HA2 GLY 65 HA2 GLY 65 9.894 3.665 -0.375 458 HA3 GLY 65 HA1 GLY 65 9.012 5.145 -0.029 459 H GLY 66 HN GLY 66 10.999 2.817 1.800 460 HA2 GLY 66 HA2 GLY 66 12.322 5.140 3.057 461 HA3 GLY 66 HA1 GLY 66 12.178 3.545 3.782 462 H GLN 67 HN GLN 67 13.046 3.920 0.427 463 HA GLN 67 HA GLN 67 15.625 2.690 1.027 464 HB2 GLN 67 HB2 GLN 67 14.237 3.210 -1.629 465 HB3 GLN 67 HB1 GLN 67 15.780 2.343 -1.427 466 HG2 GLN 67 HG2 GLN 67 14.631 0.616 -0.128 467 HG3 GLN 67 HG1 GLN 67 13.106 1.483 -0.318 468 HE21 GLN 67 HE21 GLN 67 13.807 -1.211 -1.153 469 HE22 GLN 67 HE22 GLN 67 13.563 -1.274 -2.865 470 H GLY 68 HN GLY 68 14.761 5.056 -1.499 471 HA2 GLY 68 HA2 GLY 68 15.551 7.258 -1.753 472 HA3 GLY 68 HA1 GLY 68 16.671 6.985 -0.419 473 H MET 69 HN MET 69 18.319 7.964 -1.809 474 HA MET 69 HA MET 69 19.611 5.916 -3.414 475 HB2 MET 69 HB2 MET 69 20.067 7.517 -5.282 476 HB3 MET 69 HB1 MET 69 18.392 7.016 -5.135 477 HG2 MET 69 HG2 MET 69 17.826 9.125 -4.080 478 HG3 MET 69 HG1 MET 69 19.514 9.628 -4.149 479 HE1 MET 69 HE1 MET 69 20.134 10.060 -7.961 480 HE2 MET 69 HE2 MET 69 20.481 8.640 -6.973 481 HE3 MET 69 HE3 MET 69 20.800 10.255 -6.340 482 H ILE 70 HN ILE 70 21.116 5.845 -1.755 483 HA ILE 70 HA ILE 70 23.072 8.036 -1.833 484 HB ILE 70 HB ILE 70 22.248 6.600 0.727 485 HG12 ILE 70 HG12 ILE 70 20.649 8.347 -0.008 486 HG13 ILE 70 HG11 ILE 70 21.450 8.752 1.507 487 HG21 ILE 70 HG21 ILE 70 24.302 8.808 0.389 488 HG22 ILE 70 HG22 ILE 70 24.693 7.100 0.599 489 HG23 ILE 70 HG23 ILE 70 23.874 7.984 1.888 490 HD11 ILE 70 HD11 ILE 70 21.266 10.702 0.085 491 HD12 ILE 70 HD12 ILE 70 22.122 9.866 -1.210 492 HD13 ILE 70 HD13 ILE 70 22.962 10.255 0.292 493 H GLN 71 HN GLN 71 24.203 6.660 -3.329 494 HA GLN 71 HA GLN 71 25.563 4.427 -1.998 495 HB2 GLN 71 HB2 GLN 71 25.585 3.311 -4.316 496 HB3 GLN 71 HB1 GLN 71 24.092 3.274 -3.393 497 HG2 GLN 71 HG2 GLN 71 23.386 3.787 -5.539 498 HG3 GLN 71 HG1 GLN 71 23.430 5.353 -4.740 499 HE21 GLN 71 HE21 GLN 71 26.270 3.624 -5.842 500 HE22 GLN 71 HE22 GLN 71 26.684 4.737 -7.105 501 H GLU 72 HN GLU 72 26.195 7.313 -2.780 502 HA GLU 72 HA GLU 72 28.619 6.750 -4.318 503 HB2 GLU 72 HB2 GLU 72 28.741 9.069 -4.960 504 HB3 GLU 72 HB1 GLU 72 27.172 8.425 -5.394 505 HG2 GLU 72 HG2 GLU 72 26.238 9.502 -3.371 506 HG3 GLU 72 HG1 GLU 72 27.812 10.240 -3.085 507 HA PRO 73 HA PRO 73 30.952 7.269 -0.660 508 HB2 PRO 73 HB2 PRO 73 33.343 8.091 -1.669 509 HB3 PRO 73 HB1 PRO 73 32.730 6.402 -1.834 510 HG2 PRO 73 HG2 PRO 73 32.622 8.662 -3.822 511 HG3 PRO 73 HG1 PRO 73 33.070 6.962 -4.075 512 HD2 PRO 73 HD2 PRO 73 30.620 7.910 -4.699 513 HD3 PRO 73 HD1 PRO 73 30.874 6.245 -4.077 514 H ALA 74 HN ALA 74 32.479 8.791 0.422 515 HA ALA 74 HA ALA 74 32.331 11.557 -0.281 516 HB1 ALA 74 HB1 ALA 74 30.162 11.302 0.801 517 HB2 ALA 74 HB2 ALA 74 31.235 12.282 1.801 518 HB3 ALA 74 HB3 ALA 74 30.937 10.595 2.218 519 H LEU 75 HN LEU 75 33.456 12.895 1.437 520 HA LEU 75 HA LEU 75 35.763 11.364 2.393 521 HB2 LEU 75 HB2 LEU 75 35.387 14.291 1.765 522 HB3 LEU 75 HB1 LEU 75 36.786 13.695 2.627 523 HG LEU 75 HG LEU 75 37.405 14.013 0.347 524 HD11 LEU 75 HD11 LEU 75 37.003 11.076 0.871 525 HD12 LEU 75 HD12 LEU 75 38.352 12.062 1.432 526 HD13 LEU 75 HD13 LEU 75 38.128 11.777 -0.295 527 HD21 LEU 75 HD21 LEU 75 36.279 12.890 -1.513 528 HD22 LEU 75 HD22 LEU 75 35.193 13.988 -0.662 529 HD23 LEU 75 HD23 LEU 75 35.073 12.249 -0.395 530 HA PRO 76 HA PRO 76 34.569 12.207 6.596 531 HB2 PRO 76 HB2 PRO 76 37.319 12.416 7.501 532 HB3 PRO 76 HB1 PRO 76 36.220 11.066 7.748 533 HG2 PRO 76 HG2 PRO 76 38.424 10.881 6.172 534 HG3 PRO 76 HG1 PRO 76 36.907 9.959 5.855 535 HD2 PRO 76 HD2 PRO 76 37.853 12.536 4.539 536 HD3 PRO 76 HD1 PRO 76 37.156 11.078 3.798 537 HA PRO 77 HA PRO 77 34.838 16.487 7.566 538 HB2 PRO 77 HB2 PRO 77 35.416 16.621 10.208 539 HB3 PRO 77 HB1 PRO 77 33.852 16.037 9.612 540 HG2 PRO 77 HG2 PRO 77 36.281 14.469 10.399 541 HG3 PRO 77 HG1 PRO 77 34.604 14.233 10.940 542 HD2 PRO 77 HD2 PRO 77 35.657 12.720 8.981 543 HD3 PRO 77 HD1 PRO 77 33.963 13.300 8.852 544 H GLY 78 HN GLY 78 36.308 17.976 7.109 545 HA2 GLY 78 HA2 GLY 78 38.326 19.123 7.161 546 HA3 GLY 78 HA1 GLY 78 38.921 17.941 8.311 547 H TRP 79 HN TRP 79 37.986 15.967 5.877 548 HA TRP 79 HA TRP 79 40.704 16.039 4.723 549 HB2 TRP 79 HB2 TRP 79 38.586 13.883 4.784 550 HB3 TRP 79 HB1 TRP 79 40.019 13.772 3.771 551 HD1 TRP 79 HD1 TRP 79 38.999 13.836 7.487 552 HE1 TRP 79 HE1 TRP 79 40.888 12.737 8.852 553 HE3 TRP 79 HE3 TRP 79 42.438 13.174 3.745 554 HZ2 TRP 79 HZ2 TRP 79 43.482 11.720 8.394 555 HZ3 TRP 79 HZ3 TRP 79 44.589 12.134 4.295 556 HH2 TRP 79 HH2 TRP 79 45.100 11.422 6.570 557 H GLU 80 HN GLU 80 40.883 17.170 2.820 558 HA GLU 80 HA GLU 80 38.631 17.055 0.943 559 HB2 GLU 80 HB2 GLU 80 40.996 18.940 1.063 560 HB3 GLU 80 HB1 GLU 80 39.732 19.008 -0.157 561 HG2 GLU 80 HG2 GLU 80 38.083 19.439 1.618 562 HG3 GLU 80 HG1 GLU 80 39.385 19.440 2.807 563 H MET 81 HN MET 81 38.971 16.364 -1.193 564 HA MET 81 HA MET 81 41.590 15.187 -1.762 565 HB2 MET 81 HB2 MET 81 40.028 13.467 -0.796 566 HB3 MET 81 HB1 MET 81 38.965 13.731 -2.200 567 HG2 MET 81 HG2 MET 81 41.832 12.900 -2.511 568 HG3 MET 81 HG1 MET 81 40.555 11.726 -2.225 569 HE1 MET 81 HE1 MET 81 38.459 11.441 -3.821 570 HE2 MET 81 HE2 MET 81 38.276 12.260 -5.371 571 HE3 MET 81 HE3 MET 81 38.134 13.174 -3.869 572 H LYS 82 HN LYS 82 42.223 15.368 -3.903 573 HA LYS 82 HA LYS 82 40.395 15.812 -6.011 574 HB2 LYS 82 HB2 LYS 82 41.606 18.154 -6.553 575 HB3 LYS 82 HB1 LYS 82 40.105 18.069 -5.648 576 HG2 LYS 82 HG2 LYS 82 41.250 18.362 -3.576 577 HG3 LYS 82 HG1 LYS 82 42.844 18.215 -4.389 578 HD2 LYS 82 HD2 LYS 82 42.381 20.245 -5.647 579 HD3 LYS 82 HD1 LYS 82 40.778 20.366 -4.914 580 HE2 LYS 82 HE2 LYS 82 41.760 20.681 -2.730 581 HE3 LYS 82 HE1 LYS 82 43.379 20.427 -3.384 582 HZ1 LYS 82 HZ1 LYS 82 43.142 22.727 -3.201 583 HZ2 LYS 82 HZ2 LYS 82 41.563 22.724 -3.812 584 HZ3 LYS 82 HZ3 LYS 82 42.870 22.415 -4.846 585 H TYR 83 HN TYR 83 41.502 16.044 -8.109 586 HA TYR 83 HA TYR 83 44.109 14.662 -7.960 587 HB2 TYR 83 HB2 TYR 83 41.943 14.668 -10.084 588 HB3 TYR 83 HB1 TYR 83 43.601 14.140 -10.452 589 HD1 TYR 83 HD1 TYR 83 43.649 11.872 -10.696 590 HD2 TYR 83 HD2 TYR 83 41.297 13.488 -7.539 591 HE1 TYR 83 HE1 TYR 83 43.109 9.600 -9.936 592 HE2 TYR 83 HE2 TYR 83 40.759 11.222 -6.765 593 HH TYR 83 HH TYR 83 42.325 8.403 -8.122 594 H THR 84 HN THR 84 45.844 15.311 -9.271 595 HA THR 84 HA THR 84 45.864 18.149 -9.878 596 HB THR 84 HB THR 84 48.229 17.993 -10.042 597 HG1 THR 84 HG1 THR 84 49.291 15.919 -10.114 598 HG21 THR 84 HG21 THR 84 47.264 16.089 -7.915 599 HG22 THR 84 HG22 THR 84 47.535 17.824 -7.758 600 HG23 THR 84 HG23 THR 84 48.902 16.738 -7.998 601 H SER 85 HN SER 85 47.439 18.552 -11.963 602 HA SER 85 HA SER 85 45.780 18.033 -14.176 603 HB2 SER 85 HB2 SER 85 47.901 18.953 -15.416 604 HB3 SER 85 HB1 SER 85 46.959 20.016 -14.366 605 HG SER 85 HG SER 85 49.504 18.894 -13.984 606 H GLU 86 HN GLU 86 48.790 16.539 -13.088 607 HA GLU 86 HA GLU 86 49.006 14.895 -15.511 608 HB2 GLU 86 HB2 GLU 86 50.637 15.234 -13.007 609 HB3 GLU 86 HB1 GLU 86 50.909 13.853 -14.058 610 HG2 GLU 86 HG2 GLU 86 52.424 15.807 -14.416 611 HG3 GLU 86 HG1 GLU 86 51.587 15.225 -15.852 612 H GLY 87 HN GLY 87 46.901 14.711 -13.112 613 HA2 GLY 87 HA2 GLY 87 45.407 12.961 -12.757 614 HA3 GLY 87 HA1 GLY 87 46.537 11.867 -13.536 615 H VAL 88 HN VAL 88 47.902 13.802 -11.060 616 HA VAL 88 HA VAL 88 48.213 11.412 -9.429 617 HB VAL 88 HB VAL 88 49.409 14.175 -9.078 618 HG11 VAL 88 HG11 VAL 88 49.235 13.003 -6.951 619 HG12 VAL 88 HG12 VAL 88 50.916 13.101 -7.474 620 HG13 VAL 88 HG13 VAL 88 50.027 11.589 -7.650 621 HG21 VAL 88 HG21 VAL 88 50.652 11.620 -10.100 622 HG22 VAL 88 HG22 VAL 88 51.472 13.168 -9.893 623 HG23 VAL 88 HG23 VAL 88 50.187 13.002 -11.088 624 H ARG 89 HN ARG 89 47.279 11.076 -7.514 625 HA ARG 89 HA ARG 89 45.136 12.887 -6.720 626 HB2 ARG 89 HB2 ARG 89 44.553 10.571 -7.017 627 HB3 ARG 89 HB1 ARG 89 45.841 10.050 -5.953 628 HG2 ARG 89 HG2 ARG 89 44.694 10.970 -4.039 629 HG3 ARG 89 HG1 ARG 89 43.451 11.657 -5.089 630 HD2 ARG 89 HD2 ARG 89 42.680 9.511 -5.739 631 HD3 ARG 89 HD1 ARG 89 44.060 8.716 -4.989 632 HE ARG 89 HE ARG 89 42.952 9.802 -2.859 633 HH11 ARG 89 HH11 ARG 89 41.349 8.296 -5.576 634 HH12 ARG 89 HH12 ARG 89 40.094 7.572 -4.610 635 HH21 ARG 89 HH21 ARG 89 41.300 8.851 -1.575 636 HH22 ARG 89 HH22 ARG 89 40.068 7.893 -2.332 637 H TYR 90 HN TYR 90 45.255 14.159 -4.932 638 HA TYR 90 HA TYR 90 47.291 13.476 -2.960 639 HB2 TYR 90 HB2 TYR 90 48.189 15.665 -2.784 640 HB3 TYR 90 HB1 TYR 90 48.208 15.242 -4.476 641 HD1 TYR 90 HD1 TYR 90 46.281 16.210 -5.948 642 HD2 TYR 90 HD2 TYR 90 47.328 17.676 -2.094 643 HE1 TYR 90 HE1 TYR 90 45.250 18.374 -6.495 644 HE2 TYR 90 HE2 TYR 90 46.305 19.839 -2.637 645 HH TYR 90 HH TYR 90 45.755 21.163 -4.632 646 H PHE 91 HN PHE 91 46.875 14.478 -0.797 647 HA PHE 91 HA PHE 91 43.997 15.026 -0.490 648 HB2 PHE 91 HB2 PHE 91 45.859 13.373 1.164 649 HB3 PHE 91 HB1 PHE 91 44.508 14.182 1.939 650 HD1 PHE 91 HD1 PHE 91 42.431 13.122 2.011 651 HD2 PHE 91 HD2 PHE 91 45.291 11.940 -0.916 652 HE1 PHE 91 HE1 PHE 91 40.969 11.277 1.322 653 HE2 PHE 91 HE2 PHE 91 43.825 10.093 -1.606 654 HZ PHE 91 HZ PHE 91 41.590 9.799 -0.448 655 H VAL 92 HN VAL 92 43.357 16.577 0.949 656 HA VAL 92 HA VAL 92 45.476 18.377 1.927 657 HB VAL 92 HB VAL 92 42.705 19.194 1.040 658 HG11 VAL 92 HG11 VAL 92 45.115 20.875 1.729 659 HG12 VAL 92 HG12 VAL 92 43.707 20.634 2.762 660 HG13 VAL 92 HG13 VAL 92 43.536 21.473 1.220 661 HG21 VAL 92 HG21 VAL 92 43.857 20.262 -0.879 662 HG22 VAL 92 HG22 VAL 92 43.905 18.500 -0.908 663 HG23 VAL 92 HG23 VAL 92 45.331 19.414 -0.413 664 H ASP 93 HN ASP 93 45.573 17.889 4.067 665 HA ASP 93 HA ASP 93 43.198 17.294 5.628 666 HB2 ASP 93 HB2 ASP 93 46.017 18.020 6.556 667 HB3 ASP 93 HB1 ASP 93 44.727 17.422 7.586 668 H HIS 94 HN HIS 94 41.792 19.075 5.454 669 HA HIS 94 HA HIS 94 42.721 21.776 5.525 670 HB2 HIS 94 HB2 HIS 94 40.658 20.856 4.326 671 HB3 HIS 94 HB1 HIS 94 39.877 20.815 5.908 672 HD1 HIS 94 HD1 HIS 94 40.403 22.957 3.058 673 HD2 HIS 94 HD2 HIS 94 39.800 23.474 7.126 674 HE1 HIS 94 HE1 HIS 94 39.686 25.360 3.326 675 HE2 HIS 94 HE2 HIS 94 39.082 25.570 5.774 676 H ASN 95 HN ASN 95 42.139 19.462 7.905 677 HA ASN 95 HA ASN 95 41.166 21.209 9.957 678 HB2 ASN 95 HB2 ASN 95 41.473 19.306 11.476 679 HB3 ASN 95 HB1 ASN 95 40.705 18.760 9.988 680 HD21 ASN 95 HD21 ASN 95 41.840 17.404 8.587 681 HD22 ASN 95 HD22 ASN 95 43.290 16.595 9.068 682 H THR 96 HN THR 96 44.333 20.049 8.913 683 HA THR 96 HA THR 96 45.573 21.761 10.955 684 HB THR 96 HB THR 96 47.681 20.437 10.236 685 HG1 THR 96 HG1 THR 96 47.228 19.131 8.622 686 HG21 THR 96 HG21 THR 96 46.601 20.174 12.414 687 HG22 THR 96 HG22 THR 96 47.150 18.615 11.795 688 HG23 THR 96 HG23 THR 96 45.442 19.048 11.710 689 H ARG 97 HN ARG 97 44.850 21.592 7.703 690 HA ARG 97 HA ARG 97 45.385 22.791 5.857 691 HB2 ARG 97 HB2 ARG 97 46.607 24.613 7.916 692 HB3 ARG 97 HB1 ARG 97 46.622 24.978 6.194 693 HG2 ARG 97 HG2 ARG 97 44.144 24.727 6.211 694 HG3 ARG 97 HG1 ARG 97 44.226 24.627 7.970 695 HD2 ARG 97 HD2 ARG 97 45.085 26.941 6.233 696 HD3 ARG 97 HD1 ARG 97 43.731 26.905 7.362 697 HE ARG 97 HE ARG 97 45.821 26.377 8.965 698 HH11 ARG 97 HH11 ARG 97 45.317 28.860 6.563 699 HH12 ARG 97 HH12 ARG 97 46.325 30.025 7.364 700 HH21 ARG 97 HH21 ARG 97 47.167 27.876 10.014 701 HH22 ARG 97 HH22 ARG 97 47.378 29.463 9.335 702 H THR 98 HN THR 98 46.575 20.909 5.402 703 HA THR 98 HA THR 98 49.393 21.422 4.873 704 HB THR 98 HB THR 98 49.802 18.961 5.752 705 HG1 THR 98 HG1 THR 98 47.543 18.693 6.334 706 HG21 THR 98 HG21 THR 98 50.963 20.924 6.656 707 HG22 THR 98 HG22 THR 98 50.460 19.856 7.971 708 HG23 THR 98 HG23 THR 98 49.549 21.327 7.628 709 H THR 99 HN THR 99 50.253 19.880 3.257 710 HA THR 99 HA THR 99 48.083 18.510 1.784 711 HB THR 99 HB THR 99 49.784 18.681 -0.187 712 HG1 THR 99 HG1 THR 99 51.598 19.661 0.270 713 HG21 THR 99 HG21 THR 99 48.462 21.181 0.955 714 HG22 THR 99 HG22 THR 99 47.741 20.048 -0.196 715 HG23 THR 99 HG23 THR 99 49.103 21.063 -0.683 716 H THR 100 HN THR 100 48.282 16.264 1.614 717 HA THR 100 HA THR 100 50.947 15.140 2.086 718 HB THR 100 HB THR 100 49.630 15.003 4.217 719 HG1 THR 100 HG1 THR 100 50.817 13.283 4.515 720 HG21 THR 100 HG21 THR 100 47.833 13.318 4.367 721 HG22 THR 100 HG22 THR 100 47.902 13.114 2.617 722 HG23 THR 100 HG23 THR 100 47.390 14.655 3.301 723 H PHE 101 HN PHE 101 51.225 12.980 1.294 724 HA PHE 101 HA PHE 101 49.411 12.383 -0.938 725 HB2 PHE 101 HB2 PHE 101 52.397 12.211 -0.663 726 HB3 PHE 101 HB1 PHE 101 51.537 11.064 -1.774 727 HD1 PHE 101 HD1 PHE 101 50.585 11.844 -3.816 728 HD2 PHE 101 HD2 PHE 101 52.340 14.599 -1.089 729 HE1 PHE 101 HE1 PHE 101 50.565 13.583 -5.567 730 HE2 PHE 101 HE2 PHE 101 52.332 16.332 -2.819 731 HZ PHE 101 HZ PHE 101 51.347 15.814 -5.075 732 H LYS 102 HN LYS 102 48.052 10.943 -0.079 733 HA LYS 102 HA LYS 102 49.190 8.364 0.687 734 HB2 LYS 102 HB2 LYS 102 47.122 9.917 2.245 735 HB3 LYS 102 HB1 LYS 102 47.254 8.168 2.372 736 HG2 LYS 102 HG2 LYS 102 49.587 8.412 3.097 737 HG3 LYS 102 HG1 LYS 102 49.421 10.163 3.006 738 HD2 LYS 102 HD2 LYS 102 47.655 8.445 4.736 739 HD3 LYS 102 HD1 LYS 102 49.187 9.109 5.304 740 HE2 LYS 102 HE2 LYS 102 48.354 11.378 4.791 741 HE3 LYS 102 HE1 LYS 102 46.804 10.680 4.314 742 HZ1 LYS 102 HZ1 LYS 102 46.459 9.896 6.532 743 HZ2 LYS 102 HZ2 LYS 102 46.853 11.547 6.623 744 HZ3 LYS 102 HZ3 LYS 102 48.015 10.373 7.013 745 H ASP 103 HN ASP 103 48.647 7.263 -1.065 746 HA ASP 103 HA ASP 103 45.893 7.480 -2.096 747 HB2 ASP 103 HB2 ASP 103 47.650 8.215 -3.674 748 HB3 ASP 103 HB1 ASP 103 48.423 6.640 -3.542 749 HA PRO 104 HA PRO 104 45.139 3.326 -0.834 750 HB2 PRO 104 HB2 PRO 104 43.454 2.987 -3.239 751 HB3 PRO 104 HB1 PRO 104 42.975 2.940 -1.543 752 HG2 PRO 104 HG2 PRO 104 42.348 4.984 -3.201 753 HG3 PRO 104 HG1 PRO 104 42.586 5.207 -1.459 754 HD2 PRO 104 HD2 PRO 104 44.371 5.900 -3.737 755 HD3 PRO 104 HD1 PRO 104 44.175 6.705 -2.169 756 H ARG 105 HN ARG 105 46.373 3.958 -4.057 757 HA ARG 105 HA ARG 105 46.664 1.177 -4.740 758 HB2 ARG 105 HB2 ARG 105 47.612 3.744 -5.932 759 HB3 ARG 105 HB1 ARG 105 48.499 2.288 -6.342 760 HG2 ARG 105 HG2 ARG 105 46.901 2.720 -8.047 761 HG3 ARG 105 HG1 ARG 105 46.383 1.280 -7.164 762 HD2 ARG 105 HD2 ARG 105 44.455 2.720 -7.610 763 HD3 ARG 105 HD1 ARG 105 44.802 2.681 -5.876 764 HE ARG 105 HE ARG 105 45.709 4.880 -6.034 765 HH11 ARG 105 HH11 ARG 105 44.176 3.768 -9.001 766 HH12 ARG 105 HH12 ARG 105 43.902 5.377 -9.607 767 HH21 ARG 105 HH21 ARG 105 45.370 6.982 -6.830 768 HH22 ARG 105 HH22 ARG 105 44.645 7.206 -8.404 769 HA PRO 106 HA PRO 106 50.148 0.336 -2.184 770 HB2 PRO 106 HB2 PRO 106 51.229 -1.820 -3.473 771 HB3 PRO 106 HB1 PRO 106 49.699 -1.910 -2.516 772 HG2 PRO 106 HG2 PRO 106 50.095 -1.647 -5.483 773 HG3 PRO 106 HG1 PRO 106 48.962 -2.674 -4.589 774 HD2 PRO 106 HD2 PRO 106 48.225 -0.339 -5.748 775 HD3 PRO 106 HD1 PRO 106 47.471 -0.958 -4.235 776 H GLY 107 HN GLY 107 51.886 1.618 -2.103 777 HA2 GLY 107 HA2 GLY 107 54.004 2.382 -2.573 778 HA3 GLY 107 HA1 GLY 107 54.054 1.273 -3.958 779 H PHE 108 HN PHE 108 51.534 2.535 -5.065 780 HA PHE 108 HA PHE 108 51.150 4.010 -6.817 781 HB2 PHE 108 HB2 PHE 108 51.046 5.452 -4.645 782 HB3 PHE 108 HB1 PHE 108 52.639 6.083 -5.197 783 HD1 PHE 108 HD1 PHE 108 52.770 7.669 -6.959 784 HD2 PHE 108 HD2 PHE 108 49.032 5.826 -6.058 785 HE1 PHE 108 HE1 PHE 108 51.621 9.279 -8.424 786 HE2 PHE 108 HE2 PHE 108 47.889 7.439 -7.522 787 HZ PHE 108 HZ PHE 108 49.176 9.162 -8.707 788 H GLU 109 HN GLU 109 52.929 2.540 -7.733 789 HA GLU 109 HA GLU 109 55.108 4.242 -8.734 790 HB2 GLU 109 HB2 GLU 109 55.831 2.416 -7.063 791 HB3 GLU 109 HB1 GLU 109 55.276 1.250 -8.253 792 HG2 GLU 109 HG2 GLU 109 57.644 1.464 -8.430 793 HG3 GLU 109 HG1 GLU 109 56.903 2.146 -9.875 Start of MODEL 16 1 H1 GLY 1 HT1 GLY 1 -42.124 7.301 -4.520 2 H2 GLY 1 HT2 GLY 1 -41.523 6.232 -5.692 3 H3 GLY 1 HT3 GLY 1 -40.579 7.539 -5.174 4 HA2 GLY 1 HA1 GLY 1 -41.440 5.323 -3.405 5 HA3 GLY 1 HA2 GLY 1 -39.879 5.380 -4.216 6 H SER 2 HN SER 2 -40.580 5.400 -1.334 7 HA SER 2 HA SER 2 -39.707 8.046 -0.506 8 HB2 SER 2 HB2 SER 2 -40.457 5.604 1.120 9 HB3 SER 2 HB1 SER 2 -40.066 7.184 1.791 10 HG SER 2 HG SER 2 -42.006 7.822 1.353 11 H HIS 3 HN HIS 3 -38.172 5.269 -1.493 12 HA HIS 3 HA HIS 3 -35.825 5.840 0.199 13 HB2 HIS 3 HB2 HIS 3 -36.647 3.151 -0.937 14 HB3 HIS 3 HB1 HIS 3 -35.165 3.463 -0.047 15 HD1 HIS 3 HD1 HIS 3 -38.052 1.778 0.503 16 HD2 HIS 3 HD2 HIS 3 -36.245 4.869 2.616 17 HE1 HIS 3 HE1 HIS 3 -38.970 1.618 2.839 18 HE2 HIS 3 HE2 HIS 3 -37.696 3.366 4.155 19 H MET 4 HN MET 4 -33.738 5.365 -0.857 20 HA MET 4 HA MET 4 -33.883 5.530 -3.798 21 HB2 MET 4 HB2 MET 4 -31.708 6.741 -2.067 22 HB3 MET 4 HB1 MET 4 -31.931 6.950 -3.797 23 HG2 MET 4 HG2 MET 4 -34.072 8.115 -3.329 24 HG3 MET 4 HG1 MET 4 -33.700 8.011 -1.610 25 HE1 MET 4 HE1 MET 4 -31.355 10.499 -4.705 26 HE2 MET 4 HE2 MET 4 -32.808 9.558 -5.047 27 HE3 MET 4 HE3 MET 4 -31.291 8.738 -4.684 28 H GLN 5 HN GLN 5 -32.528 4.099 -4.902 29 HA GLN 5 HA GLN 5 -31.498 1.949 -3.279 30 HB2 GLN 5 HB2 GLN 5 -32.792 1.403 -5.286 31 HB3 GLN 5 HB1 GLN 5 -31.612 2.234 -6.286 32 HG2 GLN 5 HG2 GLN 5 -29.936 0.600 -5.782 33 HG3 GLN 5 HG1 GLN 5 -30.978 -0.179 -4.596 34 HE21 GLN 5 HE21 GLN 5 -30.309 0.276 -7.970 35 HE22 GLN 5 HE22 GLN 5 -31.370 -0.994 -8.542 36 H TYR 6 HN TYR 6 -29.508 1.876 -2.556 37 HA TYR 6 HA TYR 6 -27.435 3.374 -4.016 38 HB2 TYR 6 HB2 TYR 6 -27.728 2.800 -1.052 39 HB3 TYR 6 HB1 TYR 6 -26.153 3.184 -1.736 40 HD1 TYR 6 HD1 TYR 6 -25.678 5.436 -2.548 41 HD2 TYR 6 HD2 TYR 6 -29.489 4.464 -0.916 42 HE1 TYR 6 HE1 TYR 6 -26.208 7.832 -2.368 43 HE2 TYR 6 HE2 TYR 6 -30.031 6.860 -0.741 44 HH TYR 6 HH TYR 6 -28.886 9.024 -0.607 45 H LYS 7 HN LYS 7 -25.304 2.380 -4.043 46 HA LYS 7 HA LYS 7 -25.374 -0.539 -3.766 47 HB2 LYS 7 HB2 LYS 7 -24.055 -0.606 -5.977 48 HB3 LYS 7 HB1 LYS 7 -25.799 -0.287 -6.085 49 HG2 LYS 7 HG2 LYS 7 -25.352 2.094 -6.314 50 HG3 LYS 7 HG1 LYS 7 -23.620 1.795 -6.205 51 HD2 LYS 7 HD2 LYS 7 -24.065 1.982 -8.510 52 HD3 LYS 7 HD1 LYS 7 -23.939 0.246 -8.215 53 HE2 LYS 7 HE2 LYS 7 -25.829 0.595 -9.619 54 HE3 LYS 7 HE1 LYS 7 -26.439 0.191 -8.012 55 HZ1 LYS 7 HZ1 LYS 7 -26.325 2.872 -9.291 56 HZ2 LYS 7 HZ2 LYS 7 -26.645 2.651 -7.644 57 HZ3 LYS 7 HZ3 LYS 7 -27.704 2.014 -8.803 58 H LEU 8 HN LEU 8 -23.326 -1.565 -3.628 59 HA LEU 8 HA LEU 8 -21.028 0.189 -3.078 60 HB2 LEU 8 HB2 LEU 8 -22.063 -0.369 -0.877 61 HB3 LEU 8 HB1 LEU 8 -21.965 -2.055 -1.286 62 HG LEU 8 HG LEU 8 -19.412 -1.645 -1.446 63 HD11 LEU 8 HD11 LEU 8 -19.468 0.778 -1.319 64 HD12 LEU 8 HD12 LEU 8 -18.628 0.118 0.085 65 HD13 LEU 8 HD13 LEU 8 -20.288 0.697 0.238 66 HD21 LEU 8 HD21 LEU 8 -20.227 -3.091 0.174 67 HD22 LEU 8 HD22 LEU 8 -21.083 -1.803 1.016 68 HD23 LEU 8 HD23 LEU 8 -19.320 -1.887 1.092 69 H ILE 9 HN ILE 9 -19.052 -0.684 -3.505 70 HA ILE 9 HA ILE 9 -19.032 -3.367 -4.710 71 HB ILE 9 HB ILE 9 -17.520 -0.924 -5.685 72 HG12 ILE 9 HG12 ILE 9 -19.604 -2.647 -7.099 73 HG13 ILE 9 HG11 ILE 9 -19.937 -1.022 -6.399 74 HG21 ILE 9 HG21 ILE 9 -16.086 -2.852 -5.831 75 HG22 ILE 9 HG22 ILE 9 -16.655 -2.431 -7.451 76 HG23 ILE 9 HG23 ILE 9 -17.372 -3.796 -6.595 77 HD11 ILE 9 HD11 ILE 9 -18.027 -1.670 -8.667 78 HD12 ILE 9 HD12 ILE 9 -18.304 -0.067 -7.986 79 HD13 ILE 9 HD13 ILE 9 -19.613 -0.910 -8.816 80 H LEU 10 HN LEU 10 -17.616 -4.705 -3.730 81 HA LEU 10 HA LEU 10 -15.737 -3.494 -1.849 82 HB2 LEU 10 HB2 LEU 10 -16.416 -6.413 -2.174 83 HB3 LEU 10 HB1 LEU 10 -15.344 -5.745 -0.973 84 HG LEU 10 HG LEU 10 -17.202 -6.112 0.277 85 HD11 LEU 10 HD11 LEU 10 -17.810 -3.374 -0.752 86 HD12 LEU 10 HD12 LEU 10 -16.614 -3.774 0.499 87 HD13 LEU 10 HD13 LEU 10 -18.331 -4.073 0.782 88 HD21 LEU 10 HD21 LEU 10 -18.613 -6.908 -1.567 89 HD22 LEU 10 HD22 LEU 10 -18.994 -5.235 -1.978 90 HD23 LEU 10 HD23 LEU 10 -19.503 -5.899 -0.428 91 H ASN 11 HN ASN 11 -13.984 -2.873 -2.842 92 HA ASN 11 HA ASN 11 -12.785 -4.606 -4.860 93 HB2 ASN 11 HB2 ASN 11 -12.109 -1.790 -3.936 94 HB3 ASN 11 HB1 ASN 11 -11.180 -2.675 -5.121 95 HD21 ASN 11 HD21 ASN 11 -11.601 -2.106 -7.093 96 HD22 ASN 11 HD22 ASN 11 -13.116 -1.568 -7.714 97 H GLY 12 HN GLY 12 -12.223 -6.250 -3.360 98 HA2 GLY 12 HA2 GLY 12 -9.664 -5.667 -2.028 99 HA3 GLY 12 HA1 GLY 12 -10.955 -6.457 -1.094 100 H LYS 13 HN LYS 13 -8.257 -7.320 -1.907 101 HA LYS 13 HA LYS 13 -8.071 -9.094 -3.974 102 HB2 LYS 13 HB2 LYS 13 -6.813 -9.396 -1.234 103 HB3 LYS 13 HB1 LYS 13 -6.264 -10.174 -2.712 104 HG2 LYS 13 HG2 LYS 13 -5.515 -8.154 -3.632 105 HG3 LYS 13 HG1 LYS 13 -6.441 -7.190 -2.479 106 HD2 LYS 13 HD2 LYS 13 -4.992 -8.055 -0.663 107 HD3 LYS 13 HD1 LYS 13 -4.030 -8.900 -1.879 108 HE2 LYS 13 HE2 LYS 13 -3.023 -6.755 -1.208 109 HE3 LYS 13 HE1 LYS 13 -3.436 -6.799 -2.921 110 HZ1 LYS 13 HZ1 LYS 13 -5.019 -5.471 -0.770 111 HZ2 LYS 13 HZ2 LYS 13 -5.460 -5.555 -2.403 112 HZ3 LYS 13 HZ3 LYS 13 -4.074 -4.699 -1.950 113 H THR 14 HN THR 14 -9.275 -9.817 -0.686 114 HA THR 14 HA THR 14 -10.048 -12.505 -1.625 115 HB THR 14 HB THR 14 -10.390 -12.922 0.870 116 HG1 THR 14 HG1 THR 14 -10.236 -11.143 2.008 117 HG21 THR 14 HG21 THR 14 -7.606 -12.275 -0.101 118 HG22 THR 14 HG22 THR 14 -8.459 -13.797 -0.362 119 HG23 THR 14 HG23 THR 14 -8.003 -13.307 1.272 120 H LEU 15 HN LEU 15 -11.405 -9.696 -1.787 121 HA LEU 15 HA LEU 15 -14.067 -10.627 -1.186 122 HB2 LEU 15 HB2 LEU 15 -12.748 -9.083 0.728 123 HB3 LEU 15 HB1 LEU 15 -13.734 -7.929 -0.132 124 HG LEU 15 HG LEU 15 -14.963 -8.628 1.765 125 HD11 LEU 15 HD11 LEU 15 -16.935 -9.637 0.794 126 HD12 LEU 15 HD12 LEU 15 -15.996 -10.135 -0.615 127 HD13 LEU 15 HD13 LEU 15 -16.247 -8.422 -0.285 128 HD21 LEU 15 HD21 LEU 15 -15.441 -10.947 2.298 129 HD22 LEU 15 HD22 LEU 15 -13.701 -10.660 2.269 130 HD23 LEU 15 HD23 LEU 15 -14.482 -11.483 0.921 131 H LYS 16 HN LYS 16 -14.491 -10.448 -3.331 132 HA LYS 16 HA LYS 16 -14.558 -7.736 -4.416 133 HB2 LYS 16 HB2 LYS 16 -13.429 -10.235 -5.642 134 HB3 LYS 16 HB1 LYS 16 -14.048 -8.955 -6.667 135 HG2 LYS 16 HG2 LYS 16 -12.442 -7.430 -5.862 136 HG3 LYS 16 HG1 LYS 16 -11.887 -8.521 -4.579 137 HD2 LYS 16 HD2 LYS 16 -11.105 -10.048 -6.318 138 HD3 LYS 16 HD1 LYS 16 -11.681 -8.905 -7.543 139 HE2 LYS 16 HE2 LYS 16 -10.142 -7.212 -6.709 140 HE3 LYS 16 HE1 LYS 16 -9.569 -8.328 -5.473 141 HZ1 LYS 16 HZ1 LYS 16 -9.333 -8.802 -8.403 142 HZ2 LYS 16 HZ2 LYS 16 -8.668 -9.752 -7.165 143 HZ3 LYS 16 HZ3 LYS 16 -8.098 -8.177 -7.423 144 H GLY 17 HN GLY 17 -16.602 -7.259 -4.733 145 HA2 GLY 17 HA2 GLY 17 -18.384 -8.639 -6.334 146 HA3 GLY 17 HA1 GLY 17 -18.717 -9.133 -4.677 147 H GLU 18 HN GLU 18 -20.832 -8.008 -5.370 148 HA GLU 18 HA GLU 18 -20.648 -5.194 -4.543 149 HB2 GLU 18 HB2 GLU 18 -22.448 -6.160 -6.776 150 HB3 GLU 18 HB1 GLU 18 -22.203 -4.499 -6.259 151 HG2 GLU 18 HG2 GLU 18 -20.000 -4.468 -7.151 152 HG3 GLU 18 HG1 GLU 18 -20.018 -6.209 -7.431 153 H THR 19 HN THR 19 -22.814 -4.318 -3.962 154 HA THR 19 HA THR 19 -24.903 -6.181 -3.305 155 HB THR 19 HB THR 19 -23.318 -6.539 -1.409 156 HG1 THR 19 HG1 THR 19 -25.195 -6.933 -0.517 157 HG21 THR 19 HG21 THR 19 -23.903 -3.622 -0.810 158 HG22 THR 19 HG22 THR 19 -22.336 -4.280 -1.290 159 HG23 THR 19 HG23 THR 19 -23.047 -4.730 0.262 160 H THR 20 HN THR 20 -26.760 -5.004 -2.280 161 HA THR 20 HA THR 20 -26.697 -2.119 -2.783 162 HB THR 20 HB THR 20 -28.999 -2.374 -3.859 163 HG1 THR 20 HG1 THR 20 -29.711 -4.361 -4.079 164 HG21 THR 20 HG21 THR 20 -26.514 -3.345 -5.283 165 HG22 THR 20 HG22 THR 20 -27.191 -1.712 -5.291 166 HG23 THR 20 HG23 THR 20 -28.034 -3.023 -6.111 167 H THR 21 HN THR 21 -28.467 -0.958 -1.836 168 HA THR 21 HA THR 21 -30.359 -2.319 -0.146 169 HB THR 21 HB THR 21 -28.241 -2.159 1.289 170 HG1 THR 21 HG1 THR 21 -30.199 -0.637 2.567 171 HG21 THR 21 HG21 THR 21 -27.479 0.092 0.641 172 HG22 THR 21 HG22 THR 21 -27.882 0.090 2.362 173 HG23 THR 21 HG23 THR 21 -29.005 0.782 1.193 174 H GLU 22 HN GLU 22 -31.945 -0.831 0.715 175 HA GLU 22 HA GLU 22 -32.085 1.629 -0.894 176 HB2 GLU 22 HB2 GLU 22 -34.550 1.510 -0.421 177 HB3 GLU 22 HB1 GLU 22 -33.972 0.097 -1.301 178 HG2 GLU 22 HG2 GLU 22 -33.809 -1.071 0.938 179 HG3 GLU 22 HG1 GLU 22 -34.749 0.314 1.599 180 H ALA 23 HN ALA 23 -31.898 3.551 0.077 181 HA ALA 23 HA ALA 23 -32.446 3.729 2.976 182 HB1 ALA 23 HB1 ALA 23 -29.910 4.789 1.693 183 HB2 ALA 23 HB2 ALA 23 -30.008 3.352 2.710 184 HB3 ALA 23 HB3 ALA 23 -30.373 4.939 3.389 185 H VAL 24 HN VAL 24 -32.854 5.964 3.670 186 HA VAL 24 HA VAL 24 -34.060 7.536 1.610 187 HB VAL 24 HB VAL 24 -35.341 7.230 3.580 188 HG11 VAL 24 HG11 VAL 24 -34.533 7.963 5.816 189 HG12 VAL 24 HG12 VAL 24 -32.937 8.220 5.115 190 HG13 VAL 24 HG13 VAL 24 -33.631 6.600 5.157 191 HG21 VAL 24 HG21 VAL 24 -34.133 9.960 3.630 192 HG22 VAL 24 HG22 VAL 24 -35.661 9.500 4.378 193 HG23 VAL 24 HG23 VAL 24 -35.475 9.429 2.626 194 H ASP 25 HN ASP 25 -31.089 7.573 3.436 195 HA ASP 25 HA ASP 25 -30.382 10.104 2.151 196 HB2 ASP 25 HB2 ASP 25 -31.065 10.547 4.564 197 HB3 ASP 25 HB1 ASP 25 -29.670 9.591 5.052 198 H ALA 26 HN ALA 26 -28.026 10.432 2.073 199 HA ALA 26 HA ALA 26 -26.751 7.981 1.299 200 HB1 ALA 26 HB1 ALA 26 -26.428 10.080 0.050 201 HB2 ALA 26 HB2 ALA 26 -24.898 9.399 0.608 202 HB3 ALA 26 HB3 ALA 26 -25.614 10.773 1.452 203 H ALA 27 HN ALA 27 -26.511 10.238 3.996 204 HA ALA 27 HA ALA 27 -24.096 9.283 5.105 205 HB1 ALA 27 HB1 ALA 27 -24.779 10.403 7.143 206 HB2 ALA 27 HB2 ALA 27 -26.441 10.508 6.564 207 HB3 ALA 27 HB3 ALA 27 -25.166 11.417 5.752 208 H THR 28 HN THR 28 -27.419 8.244 5.362 209 HA THR 28 HA THR 28 -27.021 6.344 7.454 210 HB THR 28 HB THR 28 -29.221 6.217 5.383 211 HG1 THR 28 HG1 THR 28 -28.895 8.035 7.564 212 HG21 THR 28 HG21 THR 28 -29.094 4.387 7.022 213 HG22 THR 28 HG22 THR 28 -30.538 5.369 7.287 214 HG23 THR 28 HG23 THR 28 -29.135 5.555 8.341 215 H ALA 29 HN ALA 29 -26.555 6.331 4.008 216 HA ALA 29 HA ALA 29 -26.759 3.475 3.689 217 HB1 ALA 29 HB1 ALA 29 -26.016 3.869 1.416 218 HB2 ALA 29 HB2 ALA 29 -25.600 5.536 1.814 219 HB3 ALA 29 HB3 ALA 29 -27.286 5.016 1.842 220 H GLU 30 HN GLU 30 -24.235 5.883 4.077 221 HA GLU 30 HA GLU 30 -22.036 4.209 3.636 222 HB2 GLU 30 HB2 GLU 30 -22.174 6.827 4.003 223 HB3 GLU 30 HB1 GLU 30 -21.918 6.383 5.684 224 HG2 GLU 30 HG2 GLU 30 -19.931 4.981 4.712 225 HG3 GLU 30 HG1 GLU 30 -20.062 6.134 3.384 226 H LYS 31 HN LYS 31 -23.462 5.335 6.671 227 HA LYS 31 HA LYS 31 -21.993 3.972 8.485 228 HB2 LYS 31 HB2 LYS 31 -24.868 4.802 8.595 229 HB3 LYS 31 HB1 LYS 31 -24.050 4.083 9.976 230 HG2 LYS 31 HG2 LYS 31 -23.355 6.653 8.578 231 HG3 LYS 31 HG1 LYS 31 -23.945 6.444 10.229 232 HD2 LYS 31 HD2 LYS 31 -21.901 5.258 10.824 233 HD3 LYS 31 HD1 LYS 31 -21.315 5.424 9.171 234 HE2 LYS 31 HE2 LYS 31 -20.252 7.095 10.509 235 HE3 LYS 31 HE1 LYS 31 -21.417 7.891 9.450 236 HZ1 LYS 31 HZ1 LYS 31 -21.993 7.164 12.267 237 HZ2 LYS 31 HZ2 LYS 31 -22.928 8.147 11.245 238 HZ3 LYS 31 HZ3 LYS 31 -21.415 8.684 11.785 239 H VAL 32 HN VAL 32 -24.886 2.682 6.865 240 HA VAL 32 HA VAL 32 -24.919 0.262 8.370 241 HB VAL 32 HB VAL 32 -26.136 0.842 5.657 242 HG11 VAL 32 HG11 VAL 32 -25.955 -1.535 5.966 243 HG12 VAL 32 HG12 VAL 32 -27.639 -1.049 6.174 244 HG13 VAL 32 HG13 VAL 32 -26.648 -1.415 7.586 245 HG21 VAL 32 HG21 VAL 32 -27.292 1.011 8.437 246 HG22 VAL 32 HG22 VAL 32 -28.230 1.143 6.950 247 HG23 VAL 32 HG23 VAL 32 -26.999 2.348 7.325 248 H PHE 33 HN PHE 33 -23.632 1.079 5.135 249 HA PHE 33 HA PHE 33 -22.691 -1.571 4.660 250 HB2 PHE 33 HB2 PHE 33 -22.200 1.066 3.343 251 HB3 PHE 33 HB1 PHE 33 -21.221 -0.314 2.917 252 HD1 PHE 33 HD1 PHE 33 -23.278 -2.464 3.016 253 HD2 PHE 33 HD2 PHE 33 -23.443 1.481 1.427 254 HE1 PHE 33 HE1 PHE 33 -24.993 -3.190 1.407 255 HE2 PHE 33 HE2 PHE 33 -25.157 0.764 -0.192 256 HZ PHE 33 HZ PHE 33 -25.942 -1.580 -0.214 257 H LYS 34 HN LYS 34 -21.441 1.031 6.569 258 HA LYS 34 HA LYS 34 -18.705 0.346 6.428 259 HB2 LYS 34 HB2 LYS 34 -20.291 1.707 8.607 260 HB3 LYS 34 HB1 LYS 34 -18.563 1.581 8.643 261 HG2 LYS 34 HG2 LYS 34 -18.873 2.696 6.251 262 HG3 LYS 34 HG1 LYS 34 -20.238 3.383 7.148 263 HD2 LYS 34 HD2 LYS 34 -18.519 4.801 7.717 264 HD3 LYS 34 HD1 LYS 34 -18.504 3.681 9.047 265 HE2 LYS 34 HE2 LYS 34 -16.276 3.741 8.541 266 HE3 LYS 34 HE1 LYS 34 -16.810 2.399 7.533 267 HZ1 LYS 34 HZ1 LYS 34 -16.533 5.202 6.581 268 HZ2 LYS 34 HZ2 LYS 34 -16.836 3.831 5.635 269 HZ3 LYS 34 HZ3 LYS 34 -15.335 4.018 6.398 270 H GLN 35 HN GLN 35 -21.332 -0.593 8.580 271 HA GLN 35 HA GLN 35 -19.782 -2.373 10.165 272 HB2 GLN 35 HB2 GLN 35 -21.946 -1.337 10.897 273 HB3 GLN 35 HB1 GLN 35 -22.785 -2.342 9.728 274 HG2 GLN 35 HG2 GLN 35 -22.990 -3.312 11.906 275 HG3 GLN 35 HG1 GLN 35 -21.979 -4.347 10.900 276 HE21 GLN 35 HE21 GLN 35 -22.172 -4.130 13.815 277 HE22 GLN 35 HE22 GLN 35 -20.577 -3.773 14.373 278 H TYR 36 HN TYR 36 -21.565 -2.568 7.208 279 HA TYR 36 HA TYR 36 -21.666 -5.384 6.953 280 HB2 TYR 36 HB2 TYR 36 -23.182 -4.162 5.624 281 HB3 TYR 36 HB1 TYR 36 -21.930 -3.071 5.053 282 HD1 TYR 36 HD1 TYR 36 -23.040 -6.584 4.873 283 HD2 TYR 36 HD2 TYR 36 -20.899 -3.454 2.967 284 HE1 TYR 36 HE1 TYR 36 -22.793 -7.998 2.881 285 HE2 TYR 36 HE2 TYR 36 -20.650 -4.843 0.951 286 HH TYR 36 HH TYR 36 -22.422 -7.669 0.436 287 H ALA 37 HN ALA 37 -19.459 -2.912 5.642 288 HA ALA 37 HA ALA 37 -17.729 -4.794 4.384 289 HB1 ALA 37 HB1 ALA 37 -17.880 -2.443 3.680 290 HB2 ALA 37 HB2 ALA 37 -16.219 -2.904 4.076 291 HB3 ALA 37 HB3 ALA 37 -17.167 -1.946 5.215 292 H ASN 38 HN ASN 38 -17.893 -3.280 7.533 293 HA ASN 38 HA ASN 38 -15.368 -4.031 8.537 294 HB2 ASN 38 HB2 ASN 38 -16.926 -2.427 9.684 295 HB3 ASN 38 HB1 ASN 38 -17.969 -3.786 10.098 296 HD21 ASN 38 HD21 ASN 38 -17.323 -5.228 11.741 297 HD22 ASN 38 HD22 ASN 38 -15.968 -4.865 12.826 298 H ASP 39 HN ASP 39 -18.472 -5.683 8.478 299 HA ASP 39 HA ASP 39 -17.625 -7.977 9.925 300 HB2 ASP 39 HB2 ASP 39 -19.997 -7.246 9.687 301 HB3 ASP 39 HB1 ASP 39 -19.934 -7.719 7.991 302 H ASN 40 HN ASN 40 -17.234 -6.961 6.666 303 HA ASN 40 HA ASN 40 -16.633 -9.656 5.726 304 HB2 ASN 40 HB2 ASN 40 -17.091 -7.013 4.402 305 HB3 ASN 40 HB1 ASN 40 -16.113 -8.210 3.562 306 HD21 ASN 40 HD21 ASN 40 -19.299 -7.369 4.700 307 HD22 ASN 40 HD22 ASN 40 -20.146 -8.680 3.863 308 H GLY 41 HN GLY 41 -15.069 -7.007 7.114 309 HA2 GLY 41 HA2 GLY 41 -12.865 -6.911 7.819 310 HA3 GLY 41 HA1 GLY 41 -12.522 -8.337 6.852 311 H VAL 42 HN VAL 42 -14.041 -5.472 5.454 312 HA VAL 42 HA VAL 42 -11.580 -5.109 3.926 313 HB VAL 42 HB VAL 42 -14.386 -4.212 3.197 314 HG11 VAL 42 HG11 VAL 42 -12.740 -2.724 2.262 315 HG12 VAL 42 HG12 VAL 42 -13.299 -3.795 0.974 316 HG13 VAL 42 HG13 VAL 42 -11.734 -4.076 1.742 317 HG21 VAL 42 HG21 VAL 42 -14.169 -5.974 1.453 318 HG22 VAL 42 HG22 VAL 42 -14.237 -6.600 3.103 319 HG23 VAL 42 HG23 VAL 42 -12.691 -6.518 2.249 320 H ASP 43 HN ASP 43 -10.378 -3.474 4.414 321 HA ASP 43 HA ASP 43 -11.596 -1.056 5.599 322 HB2 ASP 43 HB2 ASP 43 -8.782 -2.133 6.130 323 HB3 ASP 43 HB1 ASP 43 -9.351 -0.550 6.621 324 H GLY 44 HN GLY 44 -11.191 0.867 4.479 325 HA2 GLY 44 HA2 GLY 44 -8.969 1.311 2.836 326 HA3 GLY 44 HA1 GLY 44 -10.261 0.653 1.844 327 H GLU 45 HN GLU 45 -9.619 2.923 0.965 328 HA GLU 45 HA GLU 45 -10.834 5.147 2.236 329 HB2 GLU 45 HB2 GLU 45 -10.068 4.750 -0.661 330 HB3 GLU 45 HB1 GLU 45 -10.559 6.283 0.044 331 HG2 GLU 45 HG2 GLU 45 -8.318 6.537 0.163 332 HG3 GLU 45 HG1 GLU 45 -8.579 5.732 1.710 333 H TRP 46 HN TRP 46 -12.694 6.301 1.584 334 HA TRP 46 HA TRP 46 -14.738 4.527 0.426 335 HB2 TRP 46 HB2 TRP 46 -14.871 6.409 2.758 336 HB3 TRP 46 HB1 TRP 46 -16.325 6.166 1.804 337 HD1 TRP 46 HD1 TRP 46 -13.668 3.996 3.612 338 HE1 TRP 46 HE1 TRP 46 -14.818 1.918 4.570 339 HE3 TRP 46 HE3 TRP 46 -18.459 4.813 1.903 340 HZ2 TRP 46 HZ2 TRP 46 -17.371 0.792 4.620 341 HZ3 TRP 46 HZ3 TRP 46 -20.185 3.187 2.492 342 HH2 TRP 46 HH2 TRP 46 -19.657 1.206 3.819 343 H THR 47 HN THR 47 -15.012 5.093 -1.599 344 HA THR 47 HA THR 47 -15.032 7.944 -2.300 345 HB THR 47 HB THR 47 -14.807 7.027 -4.684 346 HG1 THR 47 HG1 THR 47 -14.102 4.702 -3.179 347 HG21 THR 47 HG21 THR 47 -12.574 6.575 -2.707 348 HG22 THR 47 HG22 THR 47 -12.967 8.101 -3.494 349 HG23 THR 47 HG23 THR 47 -12.373 6.743 -4.452 350 H TYR 48 HN TYR 48 -16.661 8.624 -3.893 351 HA TYR 48 HA TYR 48 -18.978 6.915 -4.089 352 HB2 TYR 48 HB2 TYR 48 -19.478 7.815 -1.940 353 HB3 TYR 48 HB1 TYR 48 -19.080 9.443 -2.425 354 HD1 TYR 48 HD1 TYR 48 -20.738 10.860 -3.317 355 HD2 TYR 48 HD2 TYR 48 -21.580 6.690 -2.943 356 HE1 TYR 48 HE1 TYR 48 -23.096 11.281 -3.868 357 HE2 TYR 48 HE2 TYR 48 -23.921 7.117 -3.491 358 HH TYR 48 HH TYR 48 -25.527 8.845 -3.521 359 H ASP 49 HN ASP 49 -20.534 7.636 -5.584 360 HA ASP 49 HA ASP 49 -19.725 9.936 -7.264 361 HB2 ASP 49 HB2 ASP 49 -18.914 7.913 -8.472 362 HB3 ASP 49 HB1 ASP 49 -20.504 7.194 -8.369 363 H ASP 50 HN ASP 50 -21.483 11.202 -7.885 364 HA ASP 50 HA ASP 50 -23.956 10.556 -6.451 365 HB2 ASP 50 HB2 ASP 50 -24.538 12.897 -6.785 366 HB3 ASP 50 HB1 ASP 50 -22.804 12.904 -6.418 367 H ALA 51 HN ALA 51 -22.782 10.510 -9.710 368 HA ALA 51 HA ALA 51 -25.362 10.687 -10.943 369 HB1 ALA 51 HB1 ALA 51 -24.214 10.074 -13.002 370 HB2 ALA 51 HB2 ALA 51 -22.766 9.650 -12.087 371 HB3 ALA 51 HB3 ALA 51 -23.321 11.322 -12.133 372 H THR 52 HN THR 52 -23.253 8.054 -9.917 373 HA THR 52 HA THR 52 -25.177 6.091 -10.900 374 HB THR 52 HB THR 52 -23.394 4.436 -10.215 375 HG1 THR 52 HG1 THR 52 -21.798 6.800 -9.952 376 HG21 THR 52 HG21 THR 52 -21.951 4.936 -12.128 377 HG22 THR 52 HG22 THR 52 -22.575 6.585 -12.181 378 HG23 THR 52 HG23 THR 52 -23.641 5.225 -12.535 379 H LYS 53 HN LYS 53 -24.262 7.611 -7.963 380 HA LYS 53 HA LYS 53 -24.913 7.334 -5.762 381 HB2 LYS 53 HB2 LYS 53 -26.996 5.364 -6.746 382 HB3 LYS 53 HB1 LYS 53 -27.013 6.319 -5.278 383 HG2 LYS 53 HG2 LYS 53 -27.150 7.553 -7.997 384 HG3 LYS 53 HG1 LYS 53 -28.563 7.099 -7.045 385 HD2 LYS 53 HD2 LYS 53 -26.394 8.982 -6.121 386 HD3 LYS 53 HD1 LYS 53 -27.940 9.466 -6.791 387 HE2 LYS 53 HE2 LYS 53 -29.114 8.371 -4.970 388 HE3 LYS 53 HE1 LYS 53 -27.580 7.816 -4.310 389 HZ1 LYS 53 HZ1 LYS 53 -26.980 10.253 -4.151 390 HZ2 LYS 53 HZ2 LYS 53 -28.163 9.697 -3.074 391 HZ3 LYS 53 HZ3 LYS 53 -28.617 10.586 -4.440 392 H THR 54 HN THR 54 -22.761 6.052 -6.439 393 HA THR 54 HA THR 54 -22.990 3.279 -5.515 394 HB THR 54 HB THR 54 -20.837 4.342 -7.358 395 HG1 THR 54 HG1 THR 54 -22.362 4.308 -8.810 396 HG21 THR 54 HG21 THR 54 -21.737 1.501 -6.723 397 HG22 THR 54 HG22 THR 54 -20.275 2.269 -6.103 398 HG23 THR 54 HG23 THR 54 -20.439 1.949 -7.830 399 H TYR 55 HN TYR 55 -21.989 2.886 -3.656 400 HA TYR 55 HA TYR 55 -19.811 4.633 -2.750 401 HB2 TYR 55 HB2 TYR 55 -21.560 2.623 -1.289 402 HB3 TYR 55 HB1 TYR 55 -19.991 3.081 -0.634 403 HD1 TYR 55 HD1 TYR 55 -23.361 4.363 -1.495 404 HD2 TYR 55 HD2 TYR 55 -19.624 5.184 0.380 405 HE1 TYR 55 HE1 TYR 55 -24.324 6.379 -0.459 406 HE2 TYR 55 HE2 TYR 55 -20.575 7.197 1.414 407 HH TYR 55 HH TYR 55 -22.342 8.718 1.166 408 H THR 56 HN THR 56 -17.716 3.961 -2.828 409 HA THR 56 HA THR 56 -17.257 1.106 -3.425 410 HB THR 56 HB THR 56 -15.687 3.436 -4.558 411 HG1 THR 56 HG1 THR 56 -17.998 2.588 -5.317 412 HG21 THR 56 HG21 THR 56 -14.310 1.423 -4.238 413 HG22 THR 56 HG22 THR 56 -14.601 1.714 -5.953 414 HG23 THR 56 HG23 THR 56 -15.503 0.460 -5.105 415 H VAL 57 HN VAL 57 -15.955 0.095 -2.053 416 HA VAL 57 HA VAL 57 -14.229 1.757 -0.337 417 HB VAL 57 HB VAL 57 -15.920 0.553 1.039 418 HG11 VAL 57 HG11 VAL 57 -14.722 -1.941 -0.153 419 HG12 VAL 57 HG12 VAL 57 -16.412 -1.427 -0.186 420 HG13 VAL 57 HG13 VAL 57 -15.673 -1.928 1.327 421 HG21 VAL 57 HG21 VAL 57 -13.722 1.060 1.969 422 HG22 VAL 57 HG22 VAL 57 -13.126 -0.507 1.420 423 HG23 VAL 57 HG23 VAL 57 -14.392 -0.423 2.646 424 H THR 58 HN THR 58 -12.222 1.712 -1.011 425 HA THR 58 HA THR 58 -11.366 -0.568 -2.657 426 HB THR 58 HB THR 58 -9.914 2.063 -2.388 427 HG1 THR 58 HG1 THR 58 -12.338 1.684 -3.410 428 HG21 THR 58 HG21 THR 58 -8.693 0.172 -3.407 429 HG22 THR 58 HG22 THR 58 -9.014 1.449 -4.581 430 HG23 THR 58 HG23 THR 58 -9.992 -0.021 -4.585 431 H GLU 59 HN GLU 59 -10.163 -2.040 -1.746 432 HA GLU 59 HA GLU 59 -8.955 -1.698 0.824 433 HB2 GLU 59 HB2 GLU 59 -9.945 -3.847 -0.102 434 HB3 GLU 59 HB1 GLU 59 -8.552 -3.935 -1.165 435 HG2 GLU 59 HG2 GLU 59 -7.742 -3.708 1.590 436 HG3 GLU 59 HG1 GLU 59 -8.815 -5.077 1.335 437 H GLY 60 HN GLY 60 -7.398 0.036 0.462 438 HA2 GLY 60 HA2 GLY 60 -4.959 -0.894 -0.917 439 HA3 GLY 60 HA1 GLY 60 -5.584 0.736 -1.166 440 H SER 61 HN SER 61 -3.214 -0.787 0.292 441 HA SER 61 HA SER 61 -2.936 1.297 2.302 442 HB2 SER 61 HB2 SER 61 -2.714 -1.651 2.993 443 HB3 SER 61 HB1 SER 61 -2.350 -0.308 4.078 444 HG SER 61 HG SER 61 -4.815 -0.051 2.978 445 H GLY 62 HN GLY 62 -1.704 0.370 -0.299 446 HA2 GLY 62 HA2 GLY 62 1.064 0.380 0.669 447 HA3 GLY 62 HA1 GLY 62 0.578 -0.881 -0.453 448 H GLY 63 HN GLY 63 1.005 2.612 -0.077 449 HA2 GLY 63 HA2 GLY 63 0.604 3.301 -2.782 450 HA3 GLY 63 HA1 GLY 63 1.573 4.216 -1.630 451 H ALA 64 HN ALA 64 3.261 1.940 -1.049 452 HA ALA 64 HA ALA 64 4.551 1.143 -3.507 453 HB1 ALA 64 HB1 ALA 64 6.747 2.030 -2.873 454 HB2 ALA 64 HB2 ALA 64 6.037 2.804 -1.456 455 HB3 ALA 64 HB3 ALA 64 5.583 3.338 -3.074 456 H GLY 65 HN GLY 65 5.569 -0.831 -3.214 457 HA2 GLY 65 HA2 GLY 65 6.479 -1.737 -0.684 458 HA3 GLY 65 HA1 GLY 65 4.867 -2.360 -0.996 459 H GLY 66 HN GLY 66 8.194 -2.705 -1.597 460 HA2 GLY 66 HA2 GLY 66 7.713 -4.675 -3.733 461 HA3 GLY 66 HA1 GLY 66 9.282 -4.006 -3.288 462 H GLN 67 HN GLN 67 9.015 -4.279 -0.503 463 HA GLN 67 HA GLN 67 9.446 -5.705 1.206 464 HB2 GLN 67 HB2 GLN 67 7.079 -6.442 0.480 465 HB3 GLN 67 HB1 GLN 67 7.888 -7.841 -0.270 466 HG2 GLN 67 HG2 GLN 67 8.756 -8.512 1.888 467 HG3 GLN 67 HG1 GLN 67 8.052 -7.089 2.653 468 HE21 GLN 67 HE21 GLN 67 7.601 -9.890 3.236 469 HE22 GLN 67 HE22 GLN 67 5.895 -10.154 3.037 470 H GLY 68 HN GLY 68 10.987 -5.776 -1.463 471 HA2 GLY 68 HA2 GLY 68 12.741 -7.952 -0.654 472 HA3 GLY 68 HA1 GLY 68 12.033 -8.090 -2.253 473 H MET 69 HN MET 69 14.124 -6.156 -0.208 474 HA MET 69 HA MET 69 15.730 -5.508 -2.541 475 HB2 MET 69 HB2 MET 69 14.177 -3.567 -2.279 476 HB3 MET 69 HB1 MET 69 14.808 -3.317 -0.657 477 HG2 MET 69 HG2 MET 69 17.031 -2.899 -1.570 478 HG3 MET 69 HG1 MET 69 16.417 -3.169 -3.202 479 HE1 MET 69 HE1 MET 69 17.427 -0.793 -3.951 480 HE2 MET 69 HE2 MET 69 18.042 -0.571 -2.314 481 HE3 MET 69 HE3 MET 69 17.099 0.705 -3.085 482 H ILE 70 HN ILE 70 16.864 -7.181 -1.380 483 HA ILE 70 HA ILE 70 19.152 -6.633 -0.156 484 HB ILE 70 HB ILE 70 17.652 -5.483 1.724 485 HG12 ILE 70 HG12 ILE 70 19.727 -7.529 2.592 486 HG13 ILE 70 HG11 ILE 70 20.129 -5.975 1.866 487 HG21 ILE 70 HG21 ILE 70 17.027 -7.066 3.560 488 HG22 ILE 70 HG22 ILE 70 17.360 -8.415 2.478 489 HG23 ILE 70 HG23 ILE 70 16.055 -7.288 2.105 490 HD11 ILE 70 HD11 ILE 70 19.011 -4.852 3.755 491 HD12 ILE 70 HD12 ILE 70 20.362 -5.865 4.262 492 HD13 ILE 70 HD13 ILE 70 18.704 -6.428 4.482 493 H GLN 71 HN GLN 71 17.074 -8.605 -1.340 494 HA GLN 71 HA GLN 71 17.888 -11.044 0.094 495 HB2 GLN 71 HB2 GLN 71 15.412 -10.576 -0.164 496 HB3 GLN 71 HB1 GLN 71 15.632 -10.707 -1.904 497 HG2 GLN 71 HG2 GLN 71 16.358 -13.029 -1.626 498 HG3 GLN 71 HG1 GLN 71 16.130 -12.884 0.117 499 HE21 GLN 71 HE21 GLN 71 13.754 -11.219 -0.207 500 HE22 GLN 71 HE22 GLN 71 12.479 -12.285 -0.680 501 H GLU 72 HN GLU 72 19.382 -9.369 -1.778 502 HA GLU 72 HA GLU 72 19.458 -10.840 -4.291 503 HB2 GLU 72 HB2 GLU 72 21.325 -8.584 -3.660 504 HB3 GLU 72 HB1 GLU 72 20.650 -9.052 -5.207 505 HG2 GLU 72 HG2 GLU 72 19.429 -7.401 -3.035 506 HG3 GLU 72 HG1 GLU 72 19.640 -7.023 -4.735 507 HA PRO 73 HA PRO 73 23.059 -13.124 -3.055 508 HB2 PRO 73 HB2 PRO 73 24.288 -13.634 -5.383 509 HB3 PRO 73 HB1 PRO 73 22.615 -14.259 -5.096 510 HG2 PRO 73 HG2 PRO 73 23.499 -11.753 -6.511 511 HG3 PRO 73 HG1 PRO 73 22.404 -13.024 -7.107 512 HD2 PRO 73 HD2 PRO 73 21.471 -10.735 -5.997 513 HD3 PRO 73 HD1 PRO 73 20.637 -12.308 -5.765 514 H ALA 74 HN ALA 74 25.271 -12.932 -2.675 515 HA ALA 74 HA ALA 74 26.860 -10.774 -3.649 516 HB1 ALA 74 HB1 ALA 74 25.867 -10.543 -0.811 517 HB2 ALA 74 HB2 ALA 74 25.359 -9.520 -2.155 518 HB3 ALA 74 HB3 ALA 74 27.035 -9.486 -1.603 519 H LEU 75 HN LEU 75 28.661 -10.497 -1.664 520 HA LEU 75 HA LEU 75 30.169 -12.861 -1.779 521 HB2 LEU 75 HB2 LEU 75 30.428 -10.486 0.055 522 HB3 LEU 75 HB1 LEU 75 31.581 -11.796 0.015 523 HG LEU 75 HG LEU 75 32.522 -10.034 -1.234 524 HD11 LEU 75 HD11 LEU 75 31.323 -11.996 -3.186 525 HD12 LEU 75 HD12 LEU 75 32.796 -12.234 -2.244 526 HD13 LEU 75 HD13 LEU 75 32.732 -10.973 -3.475 527 HD21 LEU 75 HD21 LEU 75 31.364 -8.962 -3.129 528 HD22 LEU 75 HD22 LEU 75 30.566 -8.675 -1.583 529 HD23 LEU 75 HD23 LEU 75 29.902 -9.856 -2.711 530 HA PRO 76 HA PRO 76 28.102 -15.276 1.393 531 HB2 PRO 76 HB2 PRO 76 30.755 -16.639 1.596 532 HB3 PRO 76 HB1 PRO 76 29.171 -17.368 1.303 533 HG2 PRO 76 HG2 PRO 76 30.924 -17.187 -0.673 534 HG3 PRO 76 HG1 PRO 76 29.187 -16.780 -0.966 535 HD2 PRO 76 HD2 PRO 76 31.522 -14.879 -0.497 536 HD3 PRO 76 HD1 PRO 76 30.236 -14.804 -1.720 537 HA PRO 77 HA PRO 77 29.266 -13.498 5.304 538 HB2 PRO 77 HB2 PRO 77 28.725 -16.324 6.204 539 HB3 PRO 77 HB1 PRO 77 28.224 -14.807 6.971 540 HG2 PRO 77 HG2 PRO 77 26.458 -16.087 5.544 541 HG3 PRO 77 HG1 PRO 77 26.673 -14.339 5.272 542 HD2 PRO 77 HD2 PRO 77 27.695 -16.645 3.606 543 HD3 PRO 77 HD1 PRO 77 26.958 -15.085 3.078 544 H GLY 78 HN GLY 78 31.284 -13.114 5.929 545 HA2 GLY 78 HA2 GLY 78 33.366 -13.789 6.869 546 HA3 GLY 78 HA1 GLY 78 33.147 -15.379 6.158 547 H TRP 79 HN TRP 79 32.455 -14.199 3.484 548 HA TRP 79 HA TRP 79 35.238 -13.750 2.655 549 HB2 TRP 79 HB2 TRP 79 32.705 -14.264 1.070 550 HB3 TRP 79 HB1 TRP 79 34.217 -13.799 0.305 551 HD1 TRP 79 HD1 TRP 79 32.632 -16.737 2.216 552 HE1 TRP 79 HE1 TRP 79 34.014 -18.851 1.744 553 HE3 TRP 79 HE3 TRP 79 36.482 -14.614 -0.408 554 HZ2 TRP 79 HZ2 TRP 79 36.448 -19.528 0.417 555 HZ3 TRP 79 HZ3 TRP 79 38.290 -16.051 -1.236 556 HH2 TRP 79 HH2 TRP 79 38.275 -18.452 -0.839 557 H GLU 80 HN GLU 80 36.019 -11.708 2.254 558 HA GLU 80 HA GLU 80 34.058 -9.630 1.557 559 HB2 GLU 80 HB2 GLU 80 36.466 -9.424 3.365 560 HB3 GLU 80 HB1 GLU 80 35.686 -8.008 2.662 561 HG2 GLU 80 HG2 GLU 80 33.570 -8.703 3.742 562 HG3 GLU 80 HG1 GLU 80 34.445 -10.029 4.518 563 H MET 81 HN MET 81 34.809 -7.992 0.126 564 HA MET 81 HA MET 81 37.185 -8.752 -1.399 565 HB2 MET 81 HB2 MET 81 35.222 -9.603 -2.587 566 HB3 MET 81 HB1 MET 81 34.501 -7.982 -2.566 567 HG2 MET 81 HG2 MET 81 37.152 -8.504 -3.881 568 HG3 MET 81 HG1 MET 81 35.635 -8.823 -4.716 569 HE1 MET 81 HE1 MET 81 33.850 -6.955 -5.297 570 HE2 MET 81 HE2 MET 81 34.032 -5.256 -4.862 571 HE3 MET 81 HE3 MET 81 33.798 -6.464 -3.600 572 H LYS 82 HN LYS 82 38.521 -7.039 -1.830 573 HA LYS 82 HA LYS 82 37.455 -4.340 -1.615 574 HB2 LYS 82 HB2 LYS 82 39.900 -5.041 0.013 575 HB3 LYS 82 HB1 LYS 82 38.895 -3.610 0.129 576 HG2 LYS 82 HG2 LYS 82 37.064 -4.989 1.035 577 HG3 LYS 82 HG1 LYS 82 38.145 -6.410 0.973 578 HD2 LYS 82 HD2 LYS 82 39.703 -5.225 2.492 579 HD3 LYS 82 HD1 LYS 82 38.548 -3.897 2.612 580 HE2 LYS 82 HE2 LYS 82 38.012 -6.764 3.400 581 HE3 LYS 82 HE1 LYS 82 38.392 -5.452 4.515 582 HZ1 LYS 82 HZ1 LYS 82 36.021 -5.572 2.730 583 HZ2 LYS 82 HZ2 LYS 82 36.379 -4.316 3.809 584 HZ3 LYS 82 HZ3 LYS 82 36.010 -5.863 4.401 585 H TYR 83 HN TYR 83 39.134 -2.710 -2.347 586 HA TYR 83 HA TYR 83 40.807 -3.960 -4.445 587 HB2 TYR 83 HB2 TYR 83 39.405 -1.253 -4.422 588 HB3 TYR 83 HB1 TYR 83 40.523 -1.787 -5.705 589 HD1 TYR 83 HD1 TYR 83 39.757 -3.188 -7.460 590 HD2 TYR 83 HD2 TYR 83 37.225 -2.437 -4.120 591 HE1 TYR 83 HE1 TYR 83 37.852 -4.168 -8.681 592 HE2 TYR 83 HE2 TYR 83 35.334 -3.426 -5.321 593 HH TYR 83 HH TYR 83 34.642 -3.858 -7.636 594 H THR 84 HN THR 84 42.870 -3.121 -4.817 595 HA THR 84 HA THR 84 44.087 -1.681 -2.620 596 HB THR 84 HB THR 84 46.204 -2.069 -3.698 597 HG1 THR 84 HG1 THR 84 44.908 -3.180 -5.966 598 HG21 THR 84 HG21 THR 84 44.398 -4.465 -4.037 599 HG22 THR 84 HG22 THR 84 45.379 -4.051 -2.631 600 HG23 THR 84 HG23 THR 84 46.158 -4.526 -4.139 601 H SER 85 HN SER 85 45.794 0.086 -3.540 602 HA SER 85 HA SER 85 44.190 2.270 -4.267 603 HB2 SER 85 HB2 SER 85 47.150 2.208 -4.333 604 HB3 SER 85 HB1 SER 85 46.120 3.591 -4.031 605 HG SER 85 HG SER 85 47.192 2.264 -2.189 606 H GLU 86 HN GLU 86 45.575 -0.037 -6.304 607 HA GLU 86 HA GLU 86 45.678 1.909 -8.552 608 HB2 GLU 86 HB2 GLU 86 47.220 -0.673 -8.162 609 HB3 GLU 86 HB1 GLU 86 47.274 0.305 -9.622 610 HG2 GLU 86 HG2 GLU 86 48.271 2.127 -8.438 611 HG3 GLU 86 HG1 GLU 86 48.055 1.302 -6.895 612 H GLY 87 HN GLY 87 43.616 -0.182 -7.291 613 HA2 GLY 87 HA2 GLY 87 41.663 -0.865 -8.443 614 HA3 GLY 87 HA1 GLY 87 42.589 -0.904 -9.934 615 H VAL 88 HN VAL 88 44.658 -2.422 -8.109 616 HA VAL 88 HA VAL 88 43.982 -5.033 -9.000 617 HB VAL 88 HB VAL 88 45.959 -4.195 -6.860 618 HG11 VAL 88 HG11 VAL 88 45.658 -6.850 -8.269 619 HG12 VAL 88 HG12 VAL 88 45.287 -6.529 -6.576 620 HG13 VAL 88 HG13 VAL 88 46.951 -6.419 -7.150 621 HG21 VAL 88 HG21 VAL 88 46.314 -4.846 -9.781 622 HG22 VAL 88 HG22 VAL 88 47.640 -4.633 -8.639 623 HG23 VAL 88 HG23 VAL 88 46.567 -3.284 -9.007 624 H ARG 89 HN ARG 89 42.857 -6.647 -7.984 625 HA ARG 89 HA ARG 89 41.488 -5.813 -5.517 626 HB2 ARG 89 HB2 ARG 89 39.968 -6.128 -7.334 627 HB3 ARG 89 HB1 ARG 89 40.639 -7.675 -7.742 628 HG2 ARG 89 HG2 ARG 89 39.806 -8.563 -5.627 629 HG3 ARG 89 HG1 ARG 89 38.992 -7.008 -5.367 630 HD2 ARG 89 HD2 ARG 89 38.168 -9.191 -6.968 631 HD3 ARG 89 HD1 ARG 89 37.375 -7.661 -6.688 632 HE ARG 89 HE ARG 89 39.413 -7.785 -8.752 633 HH11 ARG 89 HH11 ARG 89 36.036 -7.534 -7.884 634 HH12 ARG 89 HH12 ARG 89 35.546 -6.922 -9.432 635 HH21 ARG 89 HH21 ARG 89 38.786 -6.976 -10.786 636 HH22 ARG 89 HH22 ARG 89 37.107 -6.651 -11.109 637 H TYR 90 HN TYR 90 41.354 -7.130 -3.752 638 HA TYR 90 HA TYR 90 42.560 -9.790 -3.918 639 HB2 TYR 90 HB2 TYR 90 43.799 -9.464 -1.847 640 HB3 TYR 90 HB1 TYR 90 44.288 -8.258 -3.018 641 HD1 TYR 90 HD1 TYR 90 42.874 -8.842 0.259 642 HD2 TYR 90 HD2 TYR 90 43.507 -5.905 -2.753 643 HE1 TYR 90 HE1 TYR 90 42.388 -7.066 1.893 644 HE2 TYR 90 HE2 TYR 90 43.028 -4.126 -1.128 645 HH TYR 90 HH TYR 90 41.765 -3.882 1.025 646 H PHE 91 HN PHE 91 41.803 -11.237 -2.125 647 HA PHE 91 HA PHE 91 39.210 -10.293 -1.119 648 HB2 PHE 91 HB2 PHE 91 40.115 -13.091 -1.739 649 HB3 PHE 91 HB1 PHE 91 38.682 -12.743 -0.806 650 HD1 PHE 91 HD1 PHE 91 36.802 -11.339 -1.945 651 HD2 PHE 91 HD2 PHE 91 40.002 -13.198 -4.094 652 HE1 PHE 91 HE1 PHE 91 35.533 -11.130 -4.023 653 HE2 PHE 91 HE2 PHE 91 38.702 -12.990 -6.166 654 HZ PHE 91 HZ PHE 91 36.351 -12.074 -6.063 655 H VAL 92 HN VAL 92 38.602 -10.968 1.002 656 HA VAL 92 HA VAL 92 40.941 -11.455 2.732 657 HB VAL 92 HB VAL 92 38.421 -9.950 3.469 658 HG11 VAL 92 HG11 VAL 92 39.441 -11.075 5.367 659 HG12 VAL 92 HG12 VAL 92 39.652 -9.328 5.491 660 HG13 VAL 92 HG13 VAL 92 41.002 -10.344 4.983 661 HG21 VAL 92 HG21 VAL 92 39.808 -7.940 3.470 662 HG22 VAL 92 HG22 VAL 92 39.755 -8.681 1.871 663 HG23 VAL 92 HG23 VAL 92 41.178 -8.884 2.889 664 H ASP 93 HN ASP 93 40.825 -13.610 3.106 665 HA ASP 93 HA ASP 93 38.342 -15.016 3.594 666 HB2 ASP 93 HB2 ASP 93 41.252 -15.773 4.123 667 HB3 ASP 93 HB1 ASP 93 39.885 -16.848 4.404 668 H HIS 94 HN HIS 94 37.361 -13.763 5.288 669 HA HIS 94 HA HIS 94 38.804 -13.048 7.639 670 HB2 HIS 94 HB2 HIS 94 36.755 -11.879 6.682 671 HB3 HIS 94 HB1 HIS 94 35.797 -13.176 7.387 672 HD1 HIS 94 HD1 HIS 94 35.033 -12.801 9.714 673 HD2 HIS 94 HD2 HIS 94 38.309 -10.433 8.720 674 HE1 HIS 94 HE1 HIS 94 35.417 -11.295 11.700 675 HE2 HIS 94 HE2 HIS 94 37.304 -9.775 11.012 676 H ASN 95 HN ASN 95 37.348 -15.969 6.681 677 HA ASN 95 HA ASN 95 36.807 -16.876 9.357 678 HB2 ASN 95 HB2 ASN 95 36.360 -19.086 8.219 679 HB3 ASN 95 HB1 ASN 95 35.354 -17.749 7.679 680 HD21 ASN 95 HD21 ASN 95 38.708 -18.401 6.676 681 HD22 ASN 95 HD22 ASN 95 38.314 -18.724 5.020 682 H THR 96 HN THR 96 39.548 -16.811 7.316 683 HA THR 96 HA THR 96 40.924 -18.627 9.176 684 HB THR 96 HB THR 96 42.601 -18.801 7.187 685 HG1 THR 96 HG1 THR 96 41.528 -18.556 5.165 686 HG21 THR 96 HG21 THR 96 41.324 -20.702 6.253 687 HG22 THR 96 HG22 THR 96 39.891 -20.148 7.123 688 HG23 THR 96 HG23 THR 96 41.309 -20.698 8.016 689 H ARG 97 HN ARG 97 40.522 -15.497 8.315 690 HA ARG 97 HA ARG 97 41.597 -13.536 8.754 691 HB2 ARG 97 HB2 ARG 97 43.104 -15.303 10.676 692 HB3 ARG 97 HB1 ARG 97 43.229 -13.543 10.640 693 HG2 ARG 97 HG2 ARG 97 40.847 -13.370 11.031 694 HG3 ARG 97 HG1 ARG 97 40.718 -15.129 11.105 695 HD2 ARG 97 HD2 ARG 97 42.269 -13.342 12.984 696 HD3 ARG 97 HD1 ARG 97 40.816 -14.270 13.362 697 HE ARG 97 HE ARG 97 43.101 -15.816 12.439 698 HH11 ARG 97 HH11 ARG 97 41.266 -14.631 15.198 699 HH12 ARG 97 HH12 ARG 97 41.958 -15.793 16.295 700 HH21 ARG 97 HH21 ARG 97 44.009 -17.313 13.878 701 HH22 ARG 97 HH22 ARG 97 43.539 -17.297 15.556 702 H THR 98 HN THR 98 42.275 -13.928 6.549 703 HA THR 98 HA THR 98 45.117 -13.473 6.249 704 HB THR 98 HB THR 98 45.005 -15.982 6.355 705 HG1 THR 98 HG1 THR 98 45.896 -16.126 3.987 706 HG21 THR 98 HG21 THR 98 42.766 -16.277 5.350 707 HG22 THR 98 HG22 THR 98 43.983 -17.216 4.484 708 HG23 THR 98 HG23 THR 98 43.386 -15.702 3.804 709 H THR 99 HN THR 99 45.633 -13.274 3.827 710 HA THR 99 HA THR 99 43.296 -12.129 2.413 711 HB THR 99 HB THR 99 45.065 -10.510 1.394 712 HG1 THR 99 HG1 THR 99 46.924 -11.512 2.225 713 HG21 THR 99 HG21 THR 99 43.320 -9.701 2.949 714 HG22 THR 99 HG22 THR 99 44.864 -8.945 3.351 715 HG23 THR 99 HG23 THR 99 44.262 -10.284 4.326 716 H THR 100 HN THR 100 42.962 -13.757 0.859 717 HA THR 100 HA THR 100 45.251 -14.830 -0.577 718 HB THR 100 HB THR 100 43.079 -16.149 0.139 719 HG1 THR 100 HG1 THR 100 43.445 -17.505 -1.725 720 HG21 THR 100 HG21 THR 100 41.523 -16.316 -1.862 721 HG22 THR 100 HG22 THR 100 42.250 -14.807 -2.457 722 HG23 THR 100 HG23 THR 100 41.383 -14.839 -0.911 723 H PHE 101 HN PHE 101 45.264 -14.790 -2.972 724 HA PHE 101 HA PHE 101 44.341 -12.214 -3.894 725 HB2 PHE 101 HB2 PHE 101 46.432 -14.055 -4.724 726 HB3 PHE 101 HB1 PHE 101 45.463 -13.403 -6.119 727 HD1 PHE 101 HD1 PHE 101 44.906 -10.759 -5.738 728 HD2 PHE 101 HD2 PHE 101 48.266 -12.860 -4.186 729 HE1 PHE 101 HE1 PHE 101 46.165 -8.647 -5.591 730 HE2 PHE 101 HE2 PHE 101 49.532 -10.762 -4.037 731 HZ PHE 101 HZ PHE 101 48.362 -8.581 -4.692 732 H LYS 102 HN LYS 102 42.953 -11.837 -5.421 733 HA LYS 102 HA LYS 102 40.625 -13.172 -5.424 734 HB2 LYS 102 HB2 LYS 102 40.122 -11.819 -7.587 735 HB3 LYS 102 HB1 LYS 102 40.392 -10.994 -6.065 736 HG2 LYS 102 HG2 LYS 102 41.473 -9.872 -7.949 737 HG3 LYS 102 HG1 LYS 102 42.637 -10.388 -6.739 738 HD2 LYS 102 HD2 LYS 102 43.555 -10.833 -8.899 739 HD3 LYS 102 HD1 LYS 102 43.131 -12.375 -8.157 740 HE2 LYS 102 HE2 LYS 102 41.040 -12.397 -9.459 741 HE3 LYS 102 HE1 LYS 102 41.529 -10.893 -10.240 742 HZ1 LYS 102 HZ1 LYS 102 42.011 -13.005 -11.500 743 HZ2 LYS 102 HZ2 LYS 102 43.190 -13.340 -10.332 744 HZ3 LYS 102 HZ3 LYS 102 43.326 -11.958 -11.298 745 H ASP 103 HN ASP 103 39.582 -14.649 -6.427 746 HA ASP 103 HA ASP 103 40.528 -15.608 -9.023 747 HB2 ASP 103 HB2 ASP 103 40.797 -17.354 -7.228 748 HB3 ASP 103 HB1 ASP 103 39.058 -17.267 -6.952 749 HA PRO 104 HA PRO 104 36.596 -14.118 -10.495 750 HB2 PRO 104 HB2 PRO 104 36.036 -16.140 -12.343 751 HB3 PRO 104 HB1 PRO 104 37.024 -14.715 -12.685 752 HG2 PRO 104 HG2 PRO 104 37.872 -17.480 -11.938 753 HG3 PRO 104 HG1 PRO 104 38.600 -16.352 -13.098 754 HD2 PRO 104 HD2 PRO 104 39.694 -16.739 -10.697 755 HD3 PRO 104 HD1 PRO 104 39.653 -15.119 -11.429 756 H ARG 105 HN ARG 105 36.933 -17.446 -9.376 757 HA ARG 105 HA ARG 105 34.033 -17.494 -8.828 758 HB2 ARG 105 HB2 ARG 105 35.891 -19.868 -9.002 759 HB3 ARG 105 HB1 ARG 105 34.147 -19.909 -8.799 760 HG2 ARG 105 HG2 ARG 105 35.679 -19.015 -11.227 761 HG3 ARG 105 HG1 ARG 105 34.634 -20.429 -11.074 762 HD2 ARG 105 HD2 ARG 105 33.760 -17.542 -10.913 763 HD3 ARG 105 HD1 ARG 105 33.522 -18.617 -12.287 764 HE ARG 105 HE ARG 105 32.239 -19.984 -10.429 765 HH11 ARG 105 HH11 ARG 105 32.229 -16.526 -10.988 766 HH12 ARG 105 HH12 ARG 105 30.598 -16.310 -10.431 767 HH21 ARG 105 HH21 ARG 105 30.121 -19.714 -9.677 768 HH22 ARG 105 HH22 ARG 105 29.385 -18.138 -9.675 769 HA PRO 106 HA PRO 106 35.508 -16.814 -4.547 770 HB2 PRO 106 HB2 PRO 106 32.636 -17.516 -4.094 771 HB3 PRO 106 HB1 PRO 106 33.627 -16.179 -3.393 772 HG2 PRO 106 HG2 PRO 106 31.857 -15.711 -5.345 773 HG3 PRO 106 HG1 PRO 106 33.413 -14.869 -5.289 774 HD2 PRO 106 HD2 PRO 106 32.506 -17.068 -7.084 775 HD3 PRO 106 HD1 PRO 106 33.645 -15.716 -7.401 776 H GLY 107 HN GLY 107 36.557 -18.392 -3.513 777 HA2 GLY 107 HA2 GLY 107 36.721 -20.302 -2.167 778 HA3 GLY 107 HA1 GLY 107 35.164 -20.876 -2.806 779 H PHE 108 HN PHE 108 35.905 -20.480 -5.599 780 HA PHE 108 HA PHE 108 36.492 -21.969 -7.284 781 HB2 PHE 108 HB2 PHE 108 38.956 -21.890 -7.695 782 HB3 PHE 108 HB1 PHE 108 38.222 -20.284 -7.370 783 HD1 PHE 108 HD1 PHE 108 40.464 -22.912 -6.128 784 HD2 PHE 108 HD2 PHE 108 38.825 -19.053 -5.358 785 HE1 PHE 108 HE1 PHE 108 42.165 -22.535 -4.394 786 HE2 PHE 108 HE2 PHE 108 40.530 -18.675 -3.630 787 HZ PHE 108 HZ PHE 108 42.202 -20.415 -3.138 788 H GLU 109 HN GLU 109 35.853 -23.517 -4.891 789 HA GLU 109 HA GLU 109 37.072 -25.942 -5.822 790 HB2 GLU 109 HB2 GLU 109 38.780 -25.193 -4.226 791 HB3 GLU 109 HB1 GLU 109 37.572 -24.994 -2.975 792 HG2 GLU 109 HG2 GLU 109 37.182 -27.489 -3.096 793 HG3 GLU 109 HG1 GLU 109 38.597 -27.581 -4.147 Start of MODEL 17 1 H1 GLY 1 HT1 GLY 1 -43.015 3.240 -3.028 2 H2 GLY 1 HT2 GLY 1 -42.569 2.323 -4.386 3 H3 GLY 1 HT3 GLY 1 -42.458 4.017 -4.426 4 HA2 GLY 1 HA1 GLY 1 -40.869 2.274 -2.633 5 HA3 GLY 1 HA2 GLY 1 -40.283 2.954 -4.148 6 H SER 2 HN SER 2 -40.374 3.403 -0.855 7 HA SER 2 HA SER 2 -40.134 6.330 -1.084 8 HB2 SER 2 HB2 SER 2 -40.563 4.626 1.384 9 HB3 SER 2 HB1 SER 2 -40.584 6.391 1.321 10 HG SER 2 HG SER 2 -42.513 6.358 0.412 11 H HIS 3 HN HIS 3 -38.131 4.072 -1.592 12 HA HIS 3 HA HIS 3 -36.033 5.068 0.214 13 HB2 HIS 3 HB2 HIS 3 -36.415 2.311 -0.961 14 HB3 HIS 3 HB1 HIS 3 -34.896 2.839 -0.259 15 HD1 HIS 3 HD1 HIS 3 -36.850 0.506 0.783 16 HD2 HIS 3 HD2 HIS 3 -36.342 4.305 2.403 17 HE1 HIS 3 HE1 HIS 3 -37.482 0.300 3.215 18 HE2 HIS 3 HE2 HIS 3 -36.916 2.552 4.212 19 H MET 4 HN MET 4 -33.829 5.003 -0.724 20 HA MET 4 HA MET 4 -33.871 5.469 -3.630 21 HB2 MET 4 HB2 MET 4 -31.875 6.551 -1.620 22 HB3 MET 4 HB1 MET 4 -31.946 6.946 -3.327 23 HG2 MET 4 HG2 MET 4 -34.131 7.988 -3.001 24 HG3 MET 4 HG1 MET 4 -34.037 7.618 -1.280 25 HE1 MET 4 HE1 MET 4 -32.479 9.656 -4.248 26 HE2 MET 4 HE2 MET 4 -31.107 8.729 -3.637 27 HE3 MET 4 HE3 MET 4 -31.139 10.481 -3.447 28 H GLN 5 HN GLN 5 -32.407 4.340 -4.882 29 HA GLN 5 HA GLN 5 -31.344 1.961 -3.676 30 HB2 GLN 5 HB2 GLN 5 -32.431 1.856 -5.860 31 HB3 GLN 5 HB1 GLN 5 -31.238 2.962 -6.525 32 HG2 GLN 5 HG2 GLN 5 -29.481 1.305 -6.133 33 HG3 GLN 5 HG1 GLN 5 -30.682 0.188 -5.488 34 HE21 GLN 5 HE21 GLN 5 -32.116 -0.830 -6.887 35 HE22 GLN 5 HE22 GLN 5 -31.880 -0.826 -8.624 36 H TYR 6 HN TYR 6 -29.414 1.819 -2.802 37 HA TYR 6 HA TYR 6 -27.222 3.466 -3.876 38 HB2 TYR 6 HB2 TYR 6 -27.851 2.719 -1.005 39 HB3 TYR 6 HB1 TYR 6 -26.207 3.124 -1.470 40 HD1 TYR 6 HD1 TYR 6 -25.585 5.409 -1.920 41 HD2 TYR 6 HD2 TYR 6 -29.644 4.415 -1.085 42 HE1 TYR 6 HE1 TYR 6 -26.111 7.792 -1.631 43 HE2 TYR 6 HE2 TYR 6 -30.174 6.793 -0.795 44 HH TYR 6 HH TYR 6 -29.138 8.858 -0.340 45 H LYS 7 HN LYS 7 -25.285 2.382 -4.304 46 HA LYS 7 HA LYS 7 -25.293 -0.502 -3.748 47 HB2 LYS 7 HB2 LYS 7 -23.942 -0.753 -5.923 48 HB3 LYS 7 HB1 LYS 7 -25.692 -0.483 -6.070 49 HG2 LYS 7 HG2 LYS 7 -25.383 1.733 -6.767 50 HG3 LYS 7 HG1 LYS 7 -23.695 1.748 -6.262 51 HD2 LYS 7 HD2 LYS 7 -23.961 1.535 -8.720 52 HD3 LYS 7 HD1 LYS 7 -23.117 0.163 -7.997 53 HE2 LYS 7 HE2 LYS 7 -25.259 -1.091 -7.997 54 HE3 LYS 7 HE1 LYS 7 -26.016 0.268 -8.828 55 HZ1 LYS 7 HZ1 LYS 7 -23.706 -1.278 -9.887 56 HZ2 LYS 7 HZ2 LYS 7 -24.573 -0.064 -10.700 57 HZ3 LYS 7 HZ3 LYS 7 -25.320 -1.542 -10.329 58 H LEU 8 HN LEU 8 -23.251 -1.530 -3.686 59 HA LEU 8 HA LEU 8 -20.956 0.222 -3.098 60 HB2 LEU 8 HB2 LEU 8 -22.038 -0.303 -0.912 61 HB3 LEU 8 HB1 LEU 8 -21.978 -1.997 -1.315 62 HG LEU 8 HG LEU 8 -19.415 -1.664 -1.447 63 HD11 LEU 8 HD11 LEU 8 -20.231 0.719 0.208 64 HD12 LEU 8 HD12 LEU 8 -19.336 0.736 -1.311 65 HD13 LEU 8 HD13 LEU 8 -18.601 0.048 0.135 66 HD21 LEU 8 HD21 LEU 8 -21.063 -1.727 1.042 67 HD22 LEU 8 HD22 LEU 8 -19.319 -1.987 1.041 68 HD23 LEU 8 HD23 LEU 8 -20.378 -3.081 0.147 69 H ILE 9 HN ILE 9 -19.047 -0.591 -3.751 70 HA ILE 9 HA ILE 9 -19.010 -3.361 -4.771 71 HB ILE 9 HB ILE 9 -17.293 -1.047 -5.723 72 HG12 ILE 9 HG12 ILE 9 -19.493 -2.343 -7.374 73 HG13 ILE 9 HG11 ILE 9 -19.788 -0.930 -6.311 74 HG21 ILE 9 HG21 ILE 9 -16.742 -2.561 -7.582 75 HG22 ILE 9 HG22 ILE 9 -17.630 -3.841 -6.763 76 HG23 ILE 9 HG23 ILE 9 -16.188 -3.147 -6.014 77 HD11 ILE 9 HD11 ILE 9 -18.183 0.386 -7.570 78 HD12 ILE 9 HD12 ILE 9 -19.394 -0.290 -8.660 79 HD13 ILE 9 HD13 ILE 9 -17.784 -1.009 -8.573 80 H LEU 10 HN LEU 10 -17.668 -4.687 -3.730 81 HA LEU 10 HA LEU 10 -15.748 -3.497 -1.880 82 HB2 LEU 10 HB2 LEU 10 -16.522 -6.400 -2.129 83 HB3 LEU 10 HB1 LEU 10 -15.436 -5.729 -0.939 84 HG LEU 10 HG LEU 10 -17.322 -6.041 0.292 85 HD11 LEU 10 HD11 LEU 10 -16.583 -3.718 0.451 86 HD12 LEU 10 HD12 LEU 10 -18.274 -3.979 0.879 87 HD13 LEU 10 HD13 LEU 10 -17.861 -3.283 -0.690 88 HD21 LEU 10 HD21 LEU 10 -19.594 -5.771 -0.409 89 HD22 LEU 10 HD22 LEU 10 -18.742 -6.741 -1.611 90 HD23 LEU 10 HD23 LEU 10 -19.082 -5.039 -1.928 91 H ASN 11 HN ASN 11 -13.890 -3.033 -2.826 92 HA ASN 11 HA ASN 11 -12.845 -5.009 -4.725 93 HB2 ASN 11 HB2 ASN 11 -11.516 -2.351 -4.262 94 HB3 ASN 11 HB1 ASN 11 -11.584 -3.306 -5.735 95 HD21 ASN 11 HD21 ASN 11 -13.172 -0.970 -3.768 96 HD22 ASN 11 HD22 ASN 11 -14.364 -0.504 -4.927 97 H GLY 12 HN GLY 12 -12.284 -6.465 -3.073 98 HA2 GLY 12 HA2 GLY 12 -9.684 -5.839 -1.900 99 HA3 GLY 12 HA1 GLY 12 -10.973 -6.325 -0.785 100 H LYS 13 HN LYS 13 -8.374 -7.551 -1.773 101 HA LYS 13 HA LYS 13 -8.591 -9.765 -3.316 102 HB2 LYS 13 HB2 LYS 13 -7.053 -9.514 -0.724 103 HB3 LYS 13 HB1 LYS 13 -6.752 -10.722 -1.966 104 HG2 LYS 13 HG2 LYS 13 -6.622 -7.802 -2.575 105 HG3 LYS 13 HG1 LYS 13 -5.248 -8.656 -1.893 106 HD2 LYS 13 HD2 LYS 13 -6.674 -9.455 -4.425 107 HD3 LYS 13 HD1 LYS 13 -5.202 -8.481 -4.369 108 HE2 LYS 13 HE2 LYS 13 -5.473 -11.216 -3.180 109 HE3 LYS 13 HE1 LYS 13 -4.793 -10.900 -4.777 110 HZ1 LYS 13 HZ1 LYS 13 -3.010 -11.095 -3.234 111 HZ2 LYS 13 HZ2 LYS 13 -3.723 -10.012 -2.150 112 HZ3 LYS 13 HZ3 LYS 13 -3.136 -9.453 -3.639 113 H THR 14 HN THR 14 -9.817 -9.393 -0.073 114 HA THR 14 HA THR 14 -10.235 -12.229 0.354 115 HB THR 14 HB THR 14 -11.538 -11.314 2.374 116 HG1 THR 14 HG1 THR 14 -10.855 -9.081 2.839 117 HG21 THR 14 HG21 THR 14 -9.468 -10.800 3.596 118 HG22 THR 14 HG22 THR 14 -8.609 -10.631 2.063 119 HG23 THR 14 HG23 THR 14 -9.261 -12.197 2.540 120 H LEU 15 HN LEU 15 -12.145 -9.476 -0.725 121 HA LEU 15 HA LEU 15 -14.321 -11.230 -1.461 122 HB2 LEU 15 HB2 LEU 15 -14.373 -9.180 0.671 123 HB3 LEU 15 HB1 LEU 15 -15.767 -9.291 -0.362 124 HG LEU 15 HG LEU 15 -14.683 -11.754 0.934 125 HD11 LEU 15 HD11 LEU 15 -16.035 -11.325 2.891 126 HD12 LEU 15 HD12 LEU 15 -16.498 -9.751 2.238 127 HD13 LEU 15 HD13 LEU 15 -14.820 -10.063 2.671 128 HD21 LEU 15 HD21 LEU 15 -16.482 -11.896 -0.757 129 HD22 LEU 15 HD22 LEU 15 -17.494 -10.882 0.273 130 HD23 LEU 15 HD23 LEU 15 -16.983 -12.473 0.831 131 H LYS 16 HN LYS 16 -14.556 -10.704 -3.567 132 HA LYS 16 HA LYS 16 -14.592 -7.844 -4.262 133 HB2 LYS 16 HB2 LYS 16 -13.648 -10.168 -5.957 134 HB3 LYS 16 HB1 LYS 16 -13.732 -8.498 -6.496 135 HG2 LYS 16 HG2 LYS 16 -11.802 -7.968 -5.510 136 HG3 LYS 16 HG1 LYS 16 -12.173 -8.865 -4.033 137 HD2 LYS 16 HD2 LYS 16 -10.918 -9.795 -6.581 138 HD3 LYS 16 HD1 LYS 16 -10.338 -9.950 -4.920 139 HE2 LYS 16 HE2 LYS 16 -11.978 -11.605 -4.415 140 HE3 LYS 16 HE1 LYS 16 -12.789 -11.356 -5.960 141 HZ1 LYS 16 HZ1 LYS 16 -11.400 -13.361 -5.923 142 HZ2 LYS 16 HZ2 LYS 16 -10.027 -12.406 -5.636 143 HZ3 LYS 16 HZ3 LYS 16 -10.879 -12.250 -7.090 144 H GLY 17 HN GLY 17 -16.556 -7.236 -4.735 145 HA2 GLY 17 HA2 GLY 17 -18.242 -8.327 -6.632 146 HA3 GLY 17 HA1 GLY 17 -18.760 -8.986 -5.082 147 H GLU 18 HN GLU 18 -20.739 -7.657 -5.847 148 HA GLU 18 HA GLU 18 -20.644 -5.189 -4.347 149 HB2 GLU 18 HB2 GLU 18 -21.893 -4.100 -6.443 150 HB3 GLU 18 HB1 GLU 18 -20.158 -3.999 -6.216 151 HG2 GLU 18 HG2 GLU 18 -20.599 -4.515 -8.494 152 HG3 GLU 18 HG1 GLU 18 -19.891 -5.938 -7.741 153 H THR 19 HN THR 19 -22.769 -4.225 -3.997 154 HA THR 19 HA THR 19 -25.086 -5.837 -4.598 155 HB THR 19 HB THR 19 -24.109 -7.077 -2.680 156 HG1 THR 19 HG1 THR 19 -26.054 -7.124 -1.476 157 HG21 THR 19 HG21 THR 19 -23.027 -5.204 -1.494 158 HG22 THR 19 HG22 THR 19 -24.152 -6.043 -0.421 159 HG23 THR 19 HG23 THR 19 -24.607 -4.502 -1.147 160 H THR 20 HN THR 20 -26.990 -4.885 -3.030 161 HA THR 20 HA THR 20 -26.725 -1.967 -3.011 162 HB THR 20 HB THR 20 -29.003 -1.776 -4.000 163 HG1 THR 20 HG1 THR 20 -29.364 -4.166 -3.489 164 HG21 THR 20 HG21 THR 20 -27.084 -1.432 -5.477 165 HG22 THR 20 HG22 THR 20 -28.355 -2.292 -6.348 166 HG23 THR 20 HG23 THR 20 -26.948 -3.167 -5.743 167 H THR 21 HN THR 21 -28.318 -0.853 -1.754 168 HA THR 21 HA THR 21 -30.047 -2.435 -0.032 169 HB THR 21 HB THR 21 -27.842 -2.166 1.255 170 HG1 THR 21 HG1 THR 21 -29.831 -0.846 2.718 171 HG21 THR 21 HG21 THR 21 -27.576 0.066 2.410 172 HG22 THR 21 HG22 THR 21 -28.790 0.731 1.316 173 HG23 THR 21 HG23 THR 21 -27.255 0.151 0.674 174 H GLU 22 HN GLU 22 -31.649 -1.069 1.051 175 HA GLU 22 HA GLU 22 -32.200 1.310 -0.580 176 HB2 GLU 22 HB2 GLU 22 -34.004 -0.294 1.254 177 HB3 GLU 22 HB1 GLU 22 -34.521 1.085 0.308 178 HG2 GLU 22 HG2 GLU 22 -34.161 -0.151 -1.772 179 HG3 GLU 22 HG1 GLU 22 -33.521 -1.542 -0.817 180 H ALA 23 HN ALA 23 -31.891 3.287 0.264 181 HA ALA 23 HA ALA 23 -32.389 3.687 3.144 182 HB1 ALA 23 HB1 ALA 23 -29.980 3.328 2.988 183 HB2 ALA 23 HB2 ALA 23 -30.314 5.019 3.365 184 HB3 ALA 23 HB3 ALA 23 -29.850 4.556 1.729 185 H VAL 24 HN VAL 24 -32.767 6.008 3.658 186 HA VAL 24 HA VAL 24 -33.807 7.429 1.309 187 HB VAL 24 HB VAL 24 -35.104 8.789 2.921 188 HG11 VAL 24 HG11 VAL 24 -35.432 5.803 3.181 189 HG12 VAL 24 HG12 VAL 24 -36.157 6.843 1.955 190 HG13 VAL 24 HG13 VAL 24 -36.650 6.994 3.641 191 HG21 VAL 24 HG21 VAL 24 -34.005 6.908 5.003 192 HG22 VAL 24 HG22 VAL 24 -35.213 8.166 5.264 193 HG23 VAL 24 HG23 VAL 24 -33.560 8.605 4.827 194 H ASP 25 HN ASP 25 -30.972 7.395 2.710 195 HA ASP 25 HA ASP 25 -30.426 10.178 2.245 196 HB2 ASP 25 HB2 ASP 25 -31.059 10.499 4.501 197 HB3 ASP 25 HB1 ASP 25 -30.284 9.013 5.018 198 H ALA 26 HN ALA 26 -28.134 10.647 2.310 199 HA ALA 26 HA ALA 26 -26.680 8.468 1.111 200 HB1 ALA 26 HB1 ALA 26 -24.953 10.100 0.659 201 HB2 ALA 26 HB2 ALA 26 -25.722 11.256 1.747 202 HB3 ALA 26 HB3 ALA 26 -26.530 10.784 0.252 203 H ALA 27 HN ALA 27 -26.523 10.295 4.139 204 HA ALA 27 HA ALA 27 -24.025 9.138 4.958 205 HB1 ALA 27 HB1 ALA 27 -24.730 11.336 5.774 206 HB2 ALA 27 HB2 ALA 27 -24.444 10.214 7.104 207 HB3 ALA 27 HB3 ALA 27 -26.094 10.590 6.605 208 H THR 28 HN THR 28 -27.433 8.575 5.588 209 HA THR 28 HA THR 28 -27.152 6.520 7.502 210 HB THR 28 HB THR 28 -29.400 6.709 5.478 211 HG1 THR 28 HG1 THR 28 -28.873 8.743 6.680 212 HG21 THR 28 HG21 THR 28 -30.745 5.765 7.312 213 HG22 THR 28 HG22 THR 28 -29.307 5.706 8.333 214 HG23 THR 28 HG23 THR 28 -29.404 4.698 6.890 215 H ALA 29 HN ALA 29 -26.836 6.529 4.036 216 HA ALA 29 HA ALA 29 -27.109 3.676 3.712 217 HB1 ALA 29 HB1 ALA 29 -25.936 5.719 1.819 218 HB2 ALA 29 HB2 ALA 29 -27.638 5.264 1.885 219 HB3 ALA 29 HB3 ALA 29 -26.426 4.074 1.415 220 H GLU 30 HN GLU 30 -24.549 6.021 4.064 221 HA GLU 30 HA GLU 30 -22.352 4.374 3.492 222 HB2 GLU 30 HB2 GLU 30 -22.500 6.967 3.817 223 HB3 GLU 30 HB1 GLU 30 -22.278 6.589 5.517 224 HG2 GLU 30 HG2 GLU 30 -20.179 5.402 4.930 225 HG3 GLU 30 HG1 GLU 30 -20.383 5.986 3.277 226 H LYS 31 HN LYS 31 -23.673 5.426 6.601 227 HA LYS 31 HA LYS 31 -22.122 4.077 8.350 228 HB2 LYS 31 HB2 LYS 31 -25.056 4.666 8.591 229 HB3 LYS 31 HB1 LYS 31 -24.046 4.126 9.925 230 HG2 LYS 31 HG2 LYS 31 -23.873 6.711 8.393 231 HG3 LYS 31 HG1 LYS 31 -24.209 6.475 10.109 232 HD2 LYS 31 HD2 LYS 31 -21.916 5.547 10.368 233 HD3 LYS 31 HD1 LYS 31 -21.603 5.963 8.682 234 HE2 LYS 31 HE2 LYS 31 -20.707 7.720 10.016 235 HE3 LYS 31 HE1 LYS 31 -22.178 8.335 9.263 236 HZ1 LYS 31 HZ1 LYS 31 -23.370 8.018 11.313 237 HZ2 LYS 31 HZ2 LYS 31 -21.967 8.917 11.637 238 HZ3 LYS 31 HZ3 LYS 31 -22.027 7.271 12.034 239 H VAL 32 HN VAL 32 -25.002 2.696 6.761 240 HA VAL 32 HA VAL 32 -24.974 0.302 8.291 241 HB VAL 32 HB VAL 32 -26.187 0.800 5.554 242 HG11 VAL 32 HG11 VAL 32 -26.716 -1.410 7.549 243 HG12 VAL 32 HG12 VAL 32 -25.881 -1.585 6.006 244 HG13 VAL 32 HG13 VAL 32 -27.589 -1.146 6.039 245 HG21 VAL 32 HG21 VAL 32 -27.046 2.295 7.299 246 HG22 VAL 32 HG22 VAL 32 -27.446 0.899 8.300 247 HG23 VAL 32 HG23 VAL 32 -28.268 1.146 6.759 248 H PHE 33 HN PHE 33 -23.730 1.076 5.042 249 HA PHE 33 HA PHE 33 -22.764 -1.549 4.520 250 HB2 PHE 33 HB2 PHE 33 -22.274 1.139 3.289 251 HB3 PHE 33 HB1 PHE 33 -21.239 -0.204 2.861 252 HD1 PHE 33 HD1 PHE 33 -23.116 -2.441 2.698 253 HD2 PHE 33 HD2 PHE 33 -23.563 1.603 1.455 254 HE1 PHE 33 HE1 PHE 33 -24.725 -3.154 0.980 255 HE2 PHE 33 HE2 PHE 33 -25.173 0.898 -0.267 256 HZ PHE 33 HZ PHE 33 -25.762 -1.481 -0.514 257 H LYS 34 HN LYS 34 -21.528 1.049 6.440 258 HA LYS 34 HA LYS 34 -18.786 0.375 6.266 259 HB2 LYS 34 HB2 LYS 34 -20.290 1.830 8.466 260 HB3 LYS 34 HB1 LYS 34 -18.555 1.792 8.327 261 HG2 LYS 34 HG2 LYS 34 -19.235 2.721 5.903 262 HG3 LYS 34 HG1 LYS 34 -20.455 3.447 6.962 263 HD2 LYS 34 HD2 LYS 34 -18.591 4.870 6.973 264 HD3 LYS 34 HD1 LYS 34 -18.584 4.067 8.517 265 HE2 LYS 34 HE2 LYS 34 -16.896 2.518 7.714 266 HE3 LYS 34 HE1 LYS 34 -16.928 3.279 6.122 267 HZ1 LYS 34 HZ1 LYS 34 -15.068 4.084 7.414 268 HZ2 LYS 34 HZ2 LYS 34 -16.100 4.593 8.657 269 HZ3 LYS 34 HZ3 LYS 34 -16.166 5.342 7.133 270 H GLN 35 HN GLN 35 -21.405 -0.507 8.440 271 HA GLN 35 HA GLN 35 -19.838 -2.174 10.114 272 HB2 GLN 35 HB2 GLN 35 -21.999 -1.217 10.865 273 HB3 GLN 35 HB1 GLN 35 -22.846 -2.092 9.615 274 HG2 GLN 35 HG2 GLN 35 -21.391 -3.521 11.844 275 HG3 GLN 35 HG1 GLN 35 -23.051 -2.965 11.977 276 HE21 GLN 35 HE21 GLN 35 -21.850 -5.670 11.971 277 HE22 GLN 35 HE22 GLN 35 -22.701 -6.540 10.739 278 H TYR 36 HN TYR 36 -21.587 -2.557 7.162 279 HA TYR 36 HA TYR 36 -21.653 -5.369 6.966 280 HB2 TYR 36 HB2 TYR 36 -23.131 -4.116 5.612 281 HB3 TYR 36 HB1 TYR 36 -21.849 -3.078 5.035 282 HD1 TYR 36 HD1 TYR 36 -22.965 -6.657 4.856 283 HD2 TYR 36 HD2 TYR 36 -20.963 -3.408 3.011 284 HE1 TYR 36 HE1 TYR 36 -22.761 -7.972 2.779 285 HE2 TYR 36 HE2 TYR 36 -20.754 -4.674 0.927 286 HH TYR 36 HH TYR 36 -20.732 -7.036 0.213 287 H ALA 37 HN ALA 37 -19.437 -2.952 5.568 288 HA ALA 37 HA ALA 37 -17.689 -4.890 4.426 289 HB1 ALA 37 HB1 ALA 37 -17.201 -1.982 5.089 290 HB2 ALA 37 HB2 ALA 37 -17.825 -2.606 3.561 291 HB3 ALA 37 HB3 ALA 37 -16.174 -2.984 4.066 292 H ASN 38 HN ASN 38 -17.880 -3.216 7.465 293 HA ASN 38 HA ASN 38 -15.344 -3.633 8.547 294 HB2 ASN 38 HB2 ASN 38 -16.985 -2.165 9.647 295 HB3 ASN 38 HB1 ASN 38 -18.025 -3.547 9.978 296 HD21 ASN 38 HD21 ASN 38 -17.574 -4.898 11.711 297 HD22 ASN 38 HD22 ASN 38 -16.301 -4.529 12.896 298 H ASP 39 HN ASP 39 -18.253 -5.638 9.065 299 HA ASP 39 HA ASP 39 -16.819 -7.596 10.528 300 HB2 ASP 39 HB2 ASP 39 -19.587 -7.368 9.478 301 HB3 ASP 39 HB1 ASP 39 -19.000 -8.979 9.907 302 H ASN 40 HN ASN 40 -17.161 -7.098 7.149 303 HA ASN 40 HA ASN 40 -16.481 -9.825 6.488 304 HB2 ASN 40 HB2 ASN 40 -17.009 -7.322 4.923 305 HB3 ASN 40 HB1 ASN 40 -16.227 -8.694 4.145 306 HD21 ASN 40 HD21 ASN 40 -18.869 -7.390 3.810 307 HD22 ASN 40 HD22 ASN 40 -20.033 -8.715 3.955 308 H GLY 41 HN GLY 41 -14.888 -7.019 7.435 309 HA2 GLY 41 HA2 GLY 41 -12.626 -6.849 7.954 310 HA3 GLY 41 HA1 GLY 41 -12.316 -8.294 7.002 311 H VAL 42 HN VAL 42 -14.131 -5.608 5.685 312 HA VAL 42 HA VAL 42 -11.829 -4.991 3.993 313 HB VAL 42 HB VAL 42 -14.765 -4.653 3.335 314 HG11 VAL 42 HG11 VAL 42 -13.934 -4.223 1.060 315 HG12 VAL 42 HG12 VAL 42 -12.275 -4.373 1.644 316 HG13 VAL 42 HG13 VAL 42 -13.296 -3.052 2.213 317 HG21 VAL 42 HG21 VAL 42 -12.764 -6.748 2.520 318 HG22 VAL 42 HG22 VAL 42 -14.328 -6.517 1.736 319 HG23 VAL 42 HG23 VAL 42 -14.250 -6.990 3.440 320 H ASP 43 HN ASP 43 -10.949 -3.110 4.428 321 HA ASP 43 HA ASP 43 -12.650 -0.821 4.891 322 HB2 ASP 43 HB2 ASP 43 -11.544 -0.033 6.948 323 HB3 ASP 43 HB1 ASP 43 -12.230 -1.630 7.226 324 H GLY 44 HN GLY 44 -11.972 0.075 3.022 325 HA2 GLY 44 HA2 GLY 44 -9.152 0.876 2.859 326 HA3 GLY 44 HA1 GLY 44 -10.001 0.244 1.450 327 H GLU 45 HN GLU 45 -9.358 2.359 0.546 328 HA GLU 45 HA GLU 45 -10.258 4.830 1.504 329 HB2 GLU 45 HB2 GLU 45 -9.971 5.643 -0.785 330 HB3 GLU 45 HB1 GLU 45 -8.635 4.599 -0.339 331 HG2 GLU 45 HG2 GLU 45 -9.659 2.760 -1.580 332 HG3 GLU 45 HG1 GLU 45 -10.978 3.830 -2.056 333 H TRP 46 HN TRP 46 -12.172 5.903 1.403 334 HA TRP 46 HA TRP 46 -14.438 4.355 0.319 335 HB2 TRP 46 HB2 TRP 46 -14.180 5.960 2.826 336 HB3 TRP 46 HB1 TRP 46 -15.717 6.049 1.986 337 HD1 TRP 46 HD1 TRP 46 -13.321 3.352 3.406 338 HE1 TRP 46 HE1 TRP 46 -14.725 1.369 4.238 339 HE3 TRP 46 HE3 TRP 46 -18.032 4.970 2.033 340 HZ2 TRP 46 HZ2 TRP 46 -17.414 0.590 4.318 341 HZ3 TRP 46 HZ3 TRP 46 -19.948 3.529 2.555 342 HH2 TRP 46 HH2 TRP 46 -19.641 1.381 3.672 343 H THR 47 HN THR 47 -15.304 5.175 -1.440 344 HA THR 47 HA THR 47 -15.278 8.093 -1.812 345 HB THR 47 HB THR 47 -15.123 7.613 -4.291 346 HG1 THR 47 HG1 THR 47 -14.228 5.059 -3.376 347 HG21 THR 47 HG21 THR 47 -12.677 7.272 -4.252 348 HG22 THR 47 HG22 THR 47 -12.787 6.807 -2.552 349 HG23 THR 47 HG23 THR 47 -13.204 8.446 -3.044 350 H TYR 48 HN TYR 48 -17.107 8.984 -2.896 351 HA TYR 48 HA TYR 48 -19.300 7.152 -3.471 352 HB2 TYR 48 HB2 TYR 48 -19.801 7.743 -1.232 353 HB3 TYR 48 HB1 TYR 48 -19.405 9.412 -1.488 354 HD1 TYR 48 HD1 TYR 48 -21.199 10.878 -1.614 355 HD2 TYR 48 HD2 TYR 48 -21.768 6.850 -2.868 356 HE1 TYR 48 HE1 TYR 48 -23.574 11.352 -2.053 357 HE2 TYR 48 HE2 TYR 48 -24.137 7.316 -3.312 358 HH TYR 48 HH TYR 48 -25.421 10.523 -3.331 359 H ASP 49 HN ASP 49 -20.601 7.809 -5.148 360 HA ASP 49 HA ASP 49 -20.165 10.569 -6.158 361 HB2 ASP 49 HB2 ASP 49 -19.166 8.709 -7.665 362 HB3 ASP 49 HB1 ASP 49 -20.838 8.292 -8.050 363 H ASP 50 HN ASP 50 -22.090 11.658 -6.758 364 HA ASP 50 HA ASP 50 -24.411 10.365 -5.497 365 HB2 ASP 50 HB2 ASP 50 -23.740 12.723 -4.829 366 HB3 ASP 50 HB1 ASP 50 -24.236 13.235 -6.442 367 H ALA 51 HN ALA 51 -23.142 10.827 -8.581 368 HA ALA 51 HA ALA 51 -25.617 11.165 -9.978 369 HB1 ALA 51 HB1 ALA 51 -24.336 10.651 -12.000 370 HB2 ALA 51 HB2 ALA 51 -22.953 10.192 -11.007 371 HB3 ALA 51 HB3 ALA 51 -23.531 11.857 -10.998 372 H THR 52 HN THR 52 -23.643 8.399 -9.051 373 HA THR 52 HA THR 52 -25.684 6.622 -10.166 374 HB THR 52 HB THR 52 -23.918 4.844 -9.862 375 HG1 THR 52 HG1 THR 52 -22.240 5.420 -8.740 376 HG21 THR 52 HG21 THR 52 -23.210 7.201 -11.624 377 HG22 THR 52 HG22 THR 52 -24.303 5.882 -12.041 378 HG23 THR 52 HG23 THR 52 -22.586 5.558 -11.802 379 H LYS 53 HN LYS 53 -24.556 7.808 -7.172 380 HA LYS 53 HA LYS 53 -24.983 7.287 -4.977 381 HB2 LYS 53 HB2 LYS 53 -27.183 5.878 -6.398 382 HB3 LYS 53 HB1 LYS 53 -26.838 5.353 -4.757 383 HG2 LYS 53 HG2 LYS 53 -28.591 7.022 -4.767 384 HG3 LYS 53 HG1 LYS 53 -27.159 7.633 -3.944 385 HD2 LYS 53 HD2 LYS 53 -26.547 8.867 -5.985 386 HD3 LYS 53 HD1 LYS 53 -28.015 8.282 -6.764 387 HE2 LYS 53 HE2 LYS 53 -29.355 9.375 -5.035 388 HE3 LYS 53 HE1 LYS 53 -27.887 9.988 -4.282 389 HZ1 LYS 53 HZ1 LYS 53 -27.414 11.220 -6.321 390 HZ2 LYS 53 HZ2 LYS 53 -28.911 11.670 -5.677 391 HZ3 LYS 53 HZ3 LYS 53 -28.842 10.639 -7.014 392 H THR 54 HN THR 54 -22.932 5.962 -6.420 393 HA THR 54 HA THR 54 -22.936 3.258 -5.325 394 HB THR 54 HB THR 54 -20.863 4.427 -7.179 395 HG1 THR 54 HG1 THR 54 -22.205 3.151 -8.777 396 HG21 THR 54 HG21 THR 54 -20.322 2.302 -5.974 397 HG22 THR 54 HG22 THR 54 -20.422 2.093 -7.723 398 HG23 THR 54 HG23 THR 54 -21.755 1.563 -6.698 399 H TYR 55 HN TYR 55 -21.991 2.972 -3.413 400 HA TYR 55 HA TYR 55 -19.772 4.681 -2.606 401 HB2 TYR 55 HB2 TYR 55 -21.396 2.608 -1.105 402 HB3 TYR 55 HB1 TYR 55 -19.817 3.112 -0.515 403 HD1 TYR 55 HD1 TYR 55 -23.278 4.122 -1.058 404 HD2 TYR 55 HD2 TYR 55 -19.453 5.386 0.323 405 HE1 TYR 55 HE1 TYR 55 -24.317 6.059 0.028 406 HE2 TYR 55 HE2 TYR 55 -20.489 7.332 1.413 407 HH TYR 55 HH TYR 55 -22.542 8.687 1.194 408 H THR 56 HN THR 56 -17.718 4.116 -2.805 409 HA THR 56 HA THR 56 -17.176 1.361 -3.688 410 HB THR 56 HB THR 56 -15.672 3.836 -4.586 411 HG1 THR 56 HG1 THR 56 -18.106 3.201 -5.238 412 HG21 THR 56 HG21 THR 56 -14.396 1.765 -4.803 413 HG22 THR 56 HG22 THR 56 -14.890 2.334 -6.399 414 HG23 THR 56 HG23 THR 56 -15.748 0.998 -5.635 415 H VAL 57 HN VAL 57 -15.909 0.261 -2.346 416 HA VAL 57 HA VAL 57 -14.064 1.768 -0.621 417 HB VAL 57 HB VAL 57 -15.866 0.758 0.769 418 HG11 VAL 57 HG11 VAL 57 -14.883 -1.866 -0.342 419 HG12 VAL 57 HG12 VAL 57 -16.512 -1.196 -0.463 420 HG13 VAL 57 HG13 VAL 57 -15.886 -1.721 1.094 421 HG21 VAL 57 HG21 VAL 57 -13.624 1.066 1.679 422 HG22 VAL 57 HG22 VAL 57 -13.193 -0.565 1.158 423 HG23 VAL 57 HG23 VAL 57 -14.433 -0.332 2.389 424 H THR 58 HN THR 58 -12.085 1.516 -1.293 425 HA THR 58 HA THR 58 -11.360 -0.969 -2.702 426 HB THR 58 HB THR 58 -10.032 1.744 -2.910 427 HG1 THR 58 HG1 THR 58 -11.167 1.731 -5.004 428 HG21 THR 58 HG21 THR 58 -9.085 0.763 -5.006 429 HG22 THR 58 HG22 THR 58 -9.764 -0.799 -4.537 430 HG23 THR 58 HG23 THR 58 -8.529 -0.035 -3.538 431 H GLU 59 HN GLU 59 -9.993 -2.286 -1.733 432 HA GLU 59 HA GLU 59 -8.707 -1.679 0.726 433 HB2 GLU 59 HB2 GLU 59 -8.379 -4.012 -1.173 434 HB3 GLU 59 HB1 GLU 59 -7.388 -3.847 0.255 435 HG2 GLU 59 HG2 GLU 59 -10.388 -3.992 0.267 436 HG3 GLU 59 HG1 GLU 59 -9.293 -5.329 0.614 437 H GLY 60 HN GLY 60 -6.407 -1.523 1.175 438 HA2 GLY 60 HA2 GLY 60 -4.536 -1.223 -1.012 439 HA3 GLY 60 HA1 GLY 60 -4.969 0.309 -0.256 440 H SER 61 HN SER 61 -2.393 -1.144 -0.304 441 HA SER 61 HA SER 61 -1.867 -0.955 2.533 442 HB2 SER 61 HB2 SER 61 -1.329 -3.520 1.025 443 HB3 SER 61 HB1 SER 61 -0.662 -3.140 2.613 444 HG SER 61 HG SER 61 -3.374 -2.777 2.472 445 H GLY 62 HN GLY 62 -0.175 -2.327 -0.295 446 HA2 GLY 62 HA2 GLY 62 1.423 -0.292 -1.057 447 HA3 GLY 62 HA1 GLY 62 2.204 -0.863 0.412 448 H GLY 63 HN GLY 63 3.976 -1.253 -1.198 449 HA2 GLY 63 HA2 GLY 63 3.645 -3.949 -2.352 450 HA3 GLY 63 HA1 GLY 63 4.435 -2.667 -3.256 451 H ALA 64 HN ALA 64 5.878 -1.503 -1.129 452 HA ALA 64 HA ALA 64 7.921 -1.627 -0.145 453 HB1 ALA 64 HB1 ALA 64 8.299 -3.495 1.371 454 HB2 ALA 64 HB2 ALA 64 6.986 -4.392 0.608 455 HB3 ALA 64 HB3 ALA 64 6.645 -2.904 1.494 456 H GLY 65 HN GLY 65 7.768 -2.403 -2.938 457 HA2 GLY 65 HA2 GLY 65 9.681 -4.583 -3.220 458 HA3 GLY 65 HA1 GLY 65 8.857 -3.742 -4.524 459 H GLY 66 HN GLY 66 11.609 -4.359 -4.523 460 HA2 GLY 66 HA2 GLY 66 12.823 -1.690 -4.185 461 HA3 GLY 66 HA1 GLY 66 13.715 -3.202 -4.165 462 H GLN 67 HN GLN 67 11.344 -3.289 -6.491 463 HA GLN 67 HA GLN 67 11.274 -3.192 -8.742 464 HB2 GLN 67 HB2 GLN 67 11.849 -0.760 -8.262 465 HB3 GLN 67 HB1 GLN 67 13.543 -1.175 -8.632 466 HG2 GLN 67 HG2 GLN 67 12.876 -1.856 -10.877 467 HG3 GLN 67 HG1 GLN 67 11.195 -1.468 -10.507 468 HE21 GLN 67 HE21 GLN 67 12.969 -0.361 -12.554 469 HE22 GLN 67 HE22 GLN 67 13.008 1.342 -12.273 470 H GLY 68 HN GLY 68 13.199 -4.982 -7.265 471 HA2 GLY 68 HA2 GLY 68 14.083 -6.729 -8.937 472 HA3 GLY 68 HA1 GLY 68 15.159 -5.426 -9.415 473 H MET 69 HN MET 69 16.276 -7.740 -8.650 474 HA MET 69 HA MET 69 17.108 -7.372 -5.862 475 HB2 MET 69 HB2 MET 69 17.986 -9.640 -5.960 476 HB3 MET 69 HB1 MET 69 16.309 -9.626 -6.477 477 HG2 MET 69 HG2 MET 69 18.686 -9.714 -8.330 478 HG3 MET 69 HG1 MET 69 17.735 -11.111 -7.834 479 HE1 MET 69 HE1 MET 69 17.412 -11.739 -10.398 480 HE2 MET 69 HE2 MET 69 18.334 -10.317 -10.886 481 HE3 MET 69 HE3 MET 69 16.754 -10.634 -11.604 482 H ILE 70 HN ILE 70 18.166 -5.405 -7.024 483 HA ILE 70 HA ILE 70 20.722 -6.191 -8.245 484 HB ILE 70 HB ILE 70 19.419 -3.441 -8.460 485 HG12 ILE 70 HG12 ILE 70 19.603 -5.635 -10.543 486 HG13 ILE 70 HG11 ILE 70 18.146 -5.210 -9.655 487 HG21 ILE 70 HG21 ILE 70 21.122 -2.949 -10.108 488 HG22 ILE 70 HG22 ILE 70 21.764 -4.586 -10.016 489 HG23 ILE 70 HG23 ILE 70 21.921 -3.499 -8.633 490 HD11 ILE 70 HD11 ILE 70 18.142 -4.256 -11.897 491 HD12 ILE 70 HD12 ILE 70 19.643 -3.398 -11.543 492 HD13 ILE 70 HD13 ILE 70 18.166 -2.988 -10.672 493 H GLN 71 HN GLN 71 21.448 -6.619 -6.077 494 HA GLN 71 HA GLN 71 21.895 -4.224 -4.437 495 HB2 GLN 71 HB2 GLN 71 21.981 -5.648 -2.547 496 HB3 GLN 71 HB1 GLN 71 20.619 -6.193 -3.495 497 HG2 GLN 71 HG2 GLN 71 22.087 -7.965 -4.450 498 HG3 GLN 71 HG1 GLN 71 23.309 -7.497 -3.267 499 HE21 GLN 71 HE21 GLN 71 21.957 -10.006 -3.558 500 HE22 GLN 71 HE22 GLN 71 21.117 -10.291 -2.069 501 H GLU 72 HN GLU 72 23.368 -5.566 -6.783 502 HA GLU 72 HA GLU 72 26.014 -5.976 -5.603 503 HB2 GLU 72 HB2 GLU 72 25.007 -6.297 -8.445 504 HB3 GLU 72 HB1 GLU 72 26.661 -6.605 -7.940 505 HG2 GLU 72 HG2 GLU 72 25.976 -8.436 -6.567 506 HG3 GLU 72 HG1 GLU 72 24.276 -8.045 -6.818 507 HA PRO 73 HA PRO 73 27.311 -1.868 -6.609 508 HB2 PRO 73 HB2 PRO 73 29.988 -2.245 -6.913 509 HB3 PRO 73 HB1 PRO 73 29.178 -2.277 -5.305 510 HG2 PRO 73 HG2 PRO 73 30.007 -4.571 -7.066 511 HG3 PRO 73 HG1 PRO 73 30.200 -4.379 -5.313 512 HD2 PRO 73 HD2 PRO 73 28.213 -5.869 -6.400 513 HD3 PRO 73 HD1 PRO 73 28.002 -4.951 -4.871 514 H ALA 74 HN ALA 74 28.740 -0.716 -8.250 515 HA ALA 74 HA ALA 74 29.208 -2.066 -10.718 516 HB1 ALA 74 HB1 ALA 74 27.012 0.008 -10.686 517 HB2 ALA 74 HB2 ALA 74 26.762 -1.732 -10.836 518 HB3 ALA 74 HB3 ALA 74 27.629 -0.856 -12.097 519 H LEU 75 HN LEU 75 29.909 -0.472 -12.442 520 HA LEU 75 HA LEU 75 31.819 1.323 -11.295 521 HB2 LEU 75 HB2 LEU 75 31.081 0.479 -14.071 522 HB3 LEU 75 HB1 LEU 75 32.055 1.912 -13.856 523 HG LEU 75 HG LEU 75 33.457 0.017 -14.349 524 HD11 LEU 75 HD11 LEU 75 34.990 0.158 -12.466 525 HD12 LEU 75 HD12 LEU 75 33.709 0.845 -11.467 526 HD13 LEU 75 HD13 LEU 75 34.315 1.742 -12.859 527 HD21 LEU 75 HD21 LEU 75 33.606 -1.917 -12.887 528 HD22 LEU 75 HD22 LEU 75 31.969 -1.750 -13.525 529 HD23 LEU 75 HD23 LEU 75 32.322 -1.266 -11.867 530 HA PRO 76 HA PRO 76 29.256 4.969 -11.358 531 HB2 PRO 76 HB2 PRO 76 31.672 6.582 -11.923 532 HB3 PRO 76 HB1 PRO 76 30.645 6.626 -10.481 533 HG2 PRO 76 HG2 PRO 76 33.124 5.620 -10.378 534 HG3 PRO 76 HG1 PRO 76 31.764 4.855 -9.466 535 HD2 PRO 76 HD2 PRO 76 32.963 4.006 -12.135 536 HD3 PRO 76 HD1 PRO 76 32.580 3.022 -10.707 537 HA PRO 77 HA PRO 77 28.235 5.844 -15.598 538 HB2 PRO 77 HB2 PRO 77 27.944 8.614 -14.441 539 HB3 PRO 77 HB1 PRO 77 26.866 7.763 -15.559 540 HG2 PRO 77 HG2 PRO 77 26.182 7.818 -13.042 541 HG3 PRO 77 HG1 PRO 77 26.151 6.265 -13.905 542 HD2 PRO 77 HD2 PRO 77 28.216 7.279 -11.954 543 HD3 PRO 77 HD1 PRO 77 27.481 5.638 -12.108 544 H GLY 78 HN GLY 78 29.588 6.146 -17.227 545 HA2 GLY 78 HA2 GLY 78 31.132 7.404 -18.525 546 HA3 GLY 78 HA1 GLY 78 31.568 8.317 -17.091 547 H TRP 79 HN TRP 79 31.887 5.745 -15.529 548 HA TRP 79 HA TRP 79 34.619 5.191 -16.438 549 HB2 TRP 79 HB2 TRP 79 33.137 4.479 -13.889 550 HB3 TRP 79 HB1 TRP 79 34.760 3.910 -14.248 551 HD1 TRP 79 HD1 TRP 79 32.844 7.159 -13.483 552 HE1 TRP 79 HE1 TRP 79 34.532 8.916 -12.641 553 HE3 TRP 79 HE3 TRP 79 37.178 4.544 -14.234 554 HZ2 TRP 79 HZ2 TRP 79 37.331 9.150 -12.326 555 HZ3 TRP 79 HZ3 TRP 79 39.309 5.600 -13.632 556 HH2 TRP 79 HH2 TRP 79 39.387 7.851 -12.697 557 H GLU 80 HN GLU 80 35.345 3.162 -17.099 558 HA GLU 80 HA GLU 80 33.364 0.997 -17.276 559 HB2 GLU 80 HB2 GLU 80 33.694 2.095 -19.490 560 HB3 GLU 80 HB1 GLU 80 35.420 1.812 -19.355 561 HG2 GLU 80 HG2 GLU 80 34.369 0.204 -20.838 562 HG3 GLU 80 HG1 GLU 80 35.070 -0.582 -19.425 563 H MET 81 HN MET 81 34.371 -1.171 -17.327 564 HA MET 81 HA MET 81 37.126 -1.225 -16.328 565 HB2 MET 81 HB2 MET 81 35.636 -1.192 -14.355 566 HB3 MET 81 HB1 MET 81 34.811 -2.640 -14.975 567 HG2 MET 81 HG2 MET 81 37.756 -2.660 -14.428 568 HG3 MET 81 HG1 MET 81 36.595 -2.870 -13.120 569 HE1 MET 81 HE1 MET 81 34.713 -6.125 -14.186 570 HE2 MET 81 HE2 MET 81 34.247 -4.514 -14.735 571 HE3 MET 81 HE3 MET 81 34.777 -4.758 -13.074 572 H LYS 82 HN LYS 82 38.291 -2.747 -17.443 573 HA LYS 82 HA LYS 82 36.929 -5.116 -18.454 574 HB2 LYS 82 HB2 LYS 82 38.545 -3.427 -20.387 575 HB3 LYS 82 HB1 LYS 82 37.561 -4.819 -20.759 576 HG2 LYS 82 HG2 LYS 82 35.539 -3.528 -20.131 577 HG3 LYS 82 HG1 LYS 82 36.583 -2.099 -19.907 578 HD2 LYS 82 HD2 LYS 82 36.282 -3.667 -22.476 579 HD3 LYS 82 HD1 LYS 82 35.473 -2.143 -22.113 580 HE2 LYS 82 HE2 LYS 82 37.634 -1.030 -21.922 581 HE3 LYS 82 HE1 LYS 82 38.458 -2.555 -22.240 582 HZ1 LYS 82 HZ1 LYS 82 37.352 -2.611 -24.423 583 HZ2 LYS 82 HZ2 LYS 82 38.375 -1.265 -24.237 584 HZ3 LYS 82 HZ3 LYS 82 36.690 -1.077 -24.114 585 H TYR 83 HN TYR 83 38.577 -6.710 -19.372 586 HA TYR 83 HA TYR 83 41.073 -6.499 -17.793 587 HB2 TYR 83 HB2 TYR 83 39.441 -8.898 -18.680 588 HB3 TYR 83 HB1 TYR 83 41.127 -9.063 -18.133 589 HD1 TYR 83 HD1 TYR 83 41.471 -9.552 -15.874 590 HD2 TYR 83 HD2 TYR 83 37.894 -7.547 -17.016 591 HE1 TYR 83 HE1 TYR 83 40.685 -9.637 -13.547 592 HE2 TYR 83 HE2 TYR 83 37.100 -7.634 -14.694 593 HH TYR 83 HH TYR 83 37.427 -8.709 -12.670 594 H THR 84 HN THR 84 43.021 -7.392 -18.707 595 HA THR 84 HA THR 84 43.261 -6.936 -21.562 596 HB THR 84 HB THR 84 45.653 -7.167 -21.251 597 HG1 THR 84 HG1 THR 84 46.384 -7.618 -19.004 598 HG21 THR 84 HG21 THR 84 46.092 -5.455 -19.540 599 HG22 THR 84 HG22 THR 84 44.431 -5.609 -18.974 600 HG23 THR 84 HG23 THR 84 44.758 -5.015 -20.603 601 H SER 85 HN SER 85 45.348 -8.806 -22.119 602 HA SER 85 HA SER 85 43.702 -11.123 -22.647 603 HB2 SER 85 HB2 SER 85 45.803 -11.825 -23.949 604 HB3 SER 85 HB1 SER 85 44.962 -10.376 -24.503 605 HG SER 85 HG SER 85 46.570 -9.138 -23.825 606 H GLU 86 HN GLU 86 45.646 -10.299 -20.072 607 HA GLU 86 HA GLU 86 46.366 -13.142 -19.606 608 HB2 GLU 86 HB2 GLU 86 47.902 -10.650 -18.812 609 HB3 GLU 86 HB1 GLU 86 48.291 -12.268 -18.235 610 HG2 GLU 86 HG2 GLU 86 48.603 -12.966 -20.596 611 HG3 GLU 86 HG1 GLU 86 48.354 -11.289 -21.081 612 H GLY 87 HN GLY 87 44.086 -11.185 -18.785 613 HA2 GLY 87 HA2 GLY 87 42.578 -11.472 -17.035 614 HA3 GLY 87 HA1 GLY 87 43.804 -12.371 -16.162 615 H VAL 88 HN VAL 88 44.864 -9.337 -17.336 616 HA VAL 88 HA VAL 88 44.825 -8.310 -14.605 617 HB VAL 88 HB VAL 88 46.212 -7.194 -17.054 618 HG11 VAL 88 HG11 VAL 88 45.707 -5.431 -15.467 619 HG12 VAL 88 HG12 VAL 88 47.435 -5.783 -15.442 620 HG13 VAL 88 HG13 VAL 88 46.392 -6.386 -14.154 621 HG21 VAL 88 HG21 VAL 88 48.267 -7.994 -15.937 622 HG22 VAL 88 HG22 VAL 88 47.185 -9.306 -16.401 623 HG23 VAL 88 HG23 VAL 88 47.267 -8.785 -14.719 624 H ARG 89 HN ARG 89 43.476 -6.805 -13.941 625 HA ARG 89 HA ARG 89 41.475 -5.801 -15.800 626 HB2 ARG 89 HB2 ARG 89 40.478 -6.677 -13.891 627 HB3 ARG 89 HB1 ARG 89 41.726 -6.047 -12.829 628 HG2 ARG 89 HG2 ARG 89 40.813 -3.855 -12.942 629 HG3 ARG 89 HG1 ARG 89 39.696 -4.331 -14.223 630 HD2 ARG 89 HD2 ARG 89 38.226 -5.146 -12.762 631 HD3 ARG 89 HD1 ARG 89 39.474 -6.047 -11.914 632 HE ARG 89 HE ARG 89 39.930 -3.626 -10.958 633 HH11 ARG 89 HH11 ARG 89 36.878 -5.262 -11.466 634 HH12 ARG 89 HH12 ARG 89 36.109 -4.541 -10.083 635 HH21 ARG 89 HH21 ARG 89 38.945 -2.700 -9.136 636 HH22 ARG 89 HH22 ARG 89 37.291 -3.070 -8.760 637 H TYR 90 HN TYR 90 41.403 -3.804 -16.568 638 HA TYR 90 HA TYR 90 42.974 -1.732 -15.198 639 HB2 TYR 90 HB2 TYR 90 43.413 -0.663 -17.390 640 HB3 TYR 90 HB1 TYR 90 44.124 -2.259 -17.273 641 HD1 TYR 90 HD1 TYR 90 43.048 -4.181 -18.512 642 HD2 TYR 90 HD2 TYR 90 41.844 -0.135 -19.080 643 HE1 TYR 90 HE1 TYR 90 41.916 -4.811 -20.594 644 HE2 TYR 90 HE2 TYR 90 40.726 -0.761 -21.178 645 HH TYR 90 HH TYR 90 40.608 -2.430 -22.784 646 H PHE 91 HN PHE 91 42.075 0.477 -15.407 647 HA PHE 91 HA PHE 91 39.163 0.319 -15.611 648 HB2 PHE 91 HB2 PHE 91 40.889 2.421 -14.282 649 HB3 PHE 91 HB1 PHE 91 39.133 2.382 -14.278 650 HD1 PHE 91 HD1 PHE 91 38.034 0.077 -13.325 651 HD2 PHE 91 HD2 PHE 91 42.001 1.481 -12.509 652 HE1 PHE 91 HE1 PHE 91 38.121 -1.290 -11.307 653 HE2 PHE 91 HE2 PHE 91 42.051 0.108 -10.471 654 HZ PHE 91 HZ PHE 91 39.920 -1.460 -10.008 655 H VAL 92 HN VAL 92 38.020 1.903 -16.815 656 HA VAL 92 HA VAL 92 39.690 3.120 -18.917 657 HB VAL 92 HB VAL 92 37.132 1.576 -19.410 658 HG11 VAL 92 HG11 VAL 92 37.603 1.867 -21.769 659 HG12 VAL 92 HG12 VAL 92 39.053 2.792 -21.387 660 HG13 VAL 92 HG13 VAL 92 37.459 3.433 -20.976 661 HG21 VAL 92 HG21 VAL 92 40.002 0.838 -19.741 662 HG22 VAL 92 HG22 VAL 92 38.770 0.132 -20.777 663 HG23 VAL 92 HG23 VAL 92 38.687 -0.101 -19.035 664 H ASP 93 HN ASP 93 39.332 5.279 -18.695 665 HA ASP 93 HA ASP 93 36.759 6.310 -17.857 666 HB2 ASP 93 HB2 ASP 93 39.256 7.603 -18.999 667 HB3 ASP 93 HB1 ASP 93 37.762 8.511 -18.826 668 H HIS 94 HN HIS 94 35.527 5.022 -19.456 669 HA HIS 94 HA HIS 94 35.473 5.296 -22.197 670 HB2 HIS 94 HB2 HIS 94 33.986 3.770 -20.979 671 HB3 HIS 94 HB1 HIS 94 33.096 5.130 -20.305 672 HD1 HIS 94 HD1 HIS 94 31.089 5.866 -21.595 673 HD2 HIS 94 HD2 HIS 94 33.675 3.501 -23.832 674 HE1 HIS 94 HE1 HIS 94 29.894 5.428 -23.766 675 HE2 HIS 94 HE2 HIS 94 31.365 3.762 -24.972 676 H ASN 95 HN ASN 95 34.811 7.738 -19.909 677 HA ASN 95 HA ASN 95 33.146 9.363 -21.598 678 HB2 ASN 95 HB2 ASN 95 33.339 11.041 -19.766 679 HB3 ASN 95 HB1 ASN 95 32.828 9.462 -19.176 680 HD21 ASN 95 HD21 ASN 95 34.284 8.206 -17.969 681 HD22 ASN 95 HD22 ASN 95 35.676 8.909 -17.220 682 H THR 96 HN THR 96 36.594 9.204 -20.833 683 HA THR 96 HA THR 96 37.006 11.481 -22.657 684 HB THR 96 HB THR 96 39.300 11.615 -21.519 685 HG1 THR 96 HG1 THR 96 39.327 9.680 -20.391 686 HG21 THR 96 HG21 THR 96 36.780 12.258 -19.979 687 HG22 THR 96 HG22 THR 96 37.631 13.308 -21.113 688 HG23 THR 96 HG23 THR 96 38.380 12.878 -19.575 689 H ARG 97 HN ARG 97 37.241 8.205 -22.404 690 HA ARG 97 HA ARG 97 38.182 6.545 -23.641 691 HB2 ARG 97 HB2 ARG 97 38.834 8.791 -25.535 692 HB3 ARG 97 HB1 ARG 97 39.014 7.076 -25.899 693 HG2 ARG 97 HG2 ARG 97 36.626 6.767 -25.477 694 HG3 ARG 97 HG1 ARG 97 36.456 8.506 -25.223 695 HD2 ARG 97 HD2 ARG 97 37.130 7.025 -27.752 696 HD3 ARG 97 HD1 ARG 97 35.839 8.194 -27.464 697 HE ARG 97 HE ARG 97 38.367 9.417 -27.090 698 HH11 ARG 97 HH11 ARG 97 36.177 8.320 -29.579 699 HH12 ARG 97 HH12 ARG 97 36.874 9.315 -30.815 700 HH21 ARG 97 HH21 ARG 97 39.271 10.751 -28.674 701 HH22 ARG 97 HH22 ARG 97 38.621 10.755 -30.286 702 H THR 98 HN THR 98 39.615 6.317 -21.930 703 HA THR 98 HA THR 98 42.400 6.558 -22.686 704 HB THR 98 HB THR 98 42.730 7.554 -20.204 705 HG1 THR 98 HG1 THR 98 41.064 8.686 -19.505 706 HG21 THR 98 HG21 THR 98 43.717 8.538 -22.223 707 HG22 THR 98 HG22 THR 98 42.990 9.802 -21.228 708 HG23 THR 98 HG23 THR 98 42.154 9.225 -22.670 709 H THR 99 HN THR 99 43.814 5.335 -21.180 710 HA THR 99 HA THR 99 42.259 3.320 -19.663 711 HB THR 99 HB THR 99 44.322 1.823 -20.104 712 HG1 THR 99 HG1 THR 99 45.314 2.654 -22.232 713 HG21 THR 99 HG21 THR 99 43.597 1.229 -22.418 714 HG22 THR 99 HG22 THR 99 42.693 2.741 -22.506 715 HG23 THR 99 HG23 THR 99 42.202 1.494 -21.367 716 H THR 100 HN THR 100 42.909 2.956 -17.492 717 HA THR 100 HA THR 100 45.481 3.984 -16.639 718 HB THR 100 HB THR 100 44.056 5.968 -16.422 719 HG1 THR 100 HG1 THR 100 44.642 6.410 -14.311 720 HG21 THR 100 HG21 THR 100 42.413 4.280 -14.526 721 HG22 THR 100 HG22 THR 100 41.886 4.853 -16.108 722 HG23 THR 100 HG23 THR 100 42.201 6.006 -14.810 723 H PHE 101 HN PHE 101 46.197 3.144 -14.672 724 HA PHE 101 HA PHE 101 44.607 0.872 -13.693 725 HB2 PHE 101 HB2 PHE 101 47.600 1.371 -13.778 726 HB3 PHE 101 HB1 PHE 101 46.860 0.100 -12.722 727 HD1 PHE 101 HD1 PHE 101 46.377 -1.997 -13.604 728 HD2 PHE 101 HD2 PHE 101 47.177 1.238 -16.245 729 HE1 PHE 101 HE1 PHE 101 46.377 -3.562 -15.498 730 HE2 PHE 101 HE2 PHE 101 47.184 -0.317 -18.155 731 HZ PHE 101 HZ PHE 101 46.915 -2.774 -17.732 732 H LYS 102 HN LYS 102 43.404 1.816 -12.056 733 HA LYS 102 HA LYS 102 44.799 3.404 -10.055 734 HB2 LYS 102 HB2 LYS 102 41.885 2.696 -10.408 735 HB3 LYS 102 HB1 LYS 102 42.500 3.555 -9.009 736 HG2 LYS 102 HG2 LYS 102 43.303 5.353 -10.485 737 HG3 LYS 102 HG1 LYS 102 42.618 4.495 -11.864 738 HD2 LYS 102 HD2 LYS 102 41.082 6.234 -11.152 739 HD3 LYS 102 HD1 LYS 102 40.378 4.652 -10.809 740 HE2 LYS 102 HE2 LYS 102 39.977 6.015 -8.907 741 HE3 LYS 102 HE1 LYS 102 41.247 4.878 -8.470 742 HZ1 LYS 102 HZ1 LYS 102 41.844 7.015 -7.657 743 HZ2 LYS 102 HZ2 LYS 102 41.581 7.743 -9.163 744 HZ3 LYS 102 HZ3 LYS 102 42.875 6.668 -8.957 745 H ASP 103 HN ASP 103 46.117 1.892 -9.118 746 HA ASP 103 HA ASP 103 44.907 -0.527 -8.039 747 HB2 ASP 103 HB2 ASP 103 47.057 -0.629 -9.347 748 HB3 ASP 103 HB1 ASP 103 47.835 0.274 -8.053 749 HA PRO 104 HA PRO 104 44.604 1.449 -4.065 750 HB2 PRO 104 HB2 PRO 104 44.117 -0.767 -2.546 751 HB3 PRO 104 HB1 PRO 104 42.888 -0.061 -3.603 752 HG2 PRO 104 HG2 PRO 104 44.688 -2.402 -4.085 753 HG3 PRO 104 HG1 PRO 104 42.963 -2.223 -4.454 754 HD2 PRO 104 HD2 PRO 104 44.890 -1.956 -6.327 755 HD3 PRO 104 HD1 PRO 104 43.375 -1.031 -6.383 756 H ARG 105 HN ARG 105 47.057 -0.800 -4.893 757 HA ARG 105 HA ARG 105 48.404 -0.475 -2.295 758 HB2 ARG 105 HB2 ARG 105 48.919 -2.349 -4.607 759 HB3 ARG 105 HB1 ARG 105 50.066 -2.134 -3.297 760 HG2 ARG 105 HG2 ARG 105 48.872 -4.096 -2.818 761 HG3 ARG 105 HG1 ARG 105 48.235 -2.865 -1.725 762 HD2 ARG 105 HD2 ARG 105 46.476 -4.324 -2.794 763 HD3 ARG 105 HD1 ARG 105 46.266 -2.590 -3.050 764 HE ARG 105 HE ARG 105 47.301 -2.969 -5.296 765 HH11 ARG 105 HH11 ARG 105 45.736 -5.641 -3.617 766 HH12 ARG 105 HH12 ARG 105 45.254 -6.419 -5.096 767 HH21 ARG 105 HH21 ARG 105 46.701 -4.007 -7.195 768 HH22 ARG 105 HH22 ARG 105 45.828 -5.514 -7.129 769 HA PRO 106 HA PRO 106 50.670 2.888 -4.426 770 HB2 PRO 106 HB2 PRO 106 52.255 2.572 -1.897 771 HB3 PRO 106 HB1 PRO 106 51.658 4.071 -2.705 772 HG2 PRO 106 HG2 PRO 106 50.467 3.091 -0.520 773 HG3 PRO 106 HG1 PRO 106 49.528 3.828 -1.831 774 HD2 PRO 106 HD2 PRO 106 49.833 0.960 -1.079 775 HD3 PRO 106 HD1 PRO 106 48.439 1.818 -1.822 776 H GLY 107 HN GLY 107 52.064 2.267 -5.988 777 HA2 GLY 107 HA2 GLY 107 53.978 1.417 -6.962 778 HA3 GLY 107 HA1 GLY 107 54.552 0.977 -5.335 779 H PHE 108 HN PHE 108 51.887 -0.528 -5.032 780 HA PHE 108 HA PHE 108 51.485 -2.804 -4.843 781 HB2 PHE 108 HB2 PHE 108 50.887 -3.853 -7.040 782 HB3 PHE 108 HB1 PHE 108 50.084 -2.277 -6.724 783 HD1 PHE 108 HD1 PHE 108 50.571 -0.365 -8.136 784 HD2 PHE 108 HD2 PHE 108 52.579 -4.075 -8.762 785 HE1 PHE 108 HE1 PHE 108 51.329 0.414 -10.337 786 HE2 PHE 108 HE2 PHE 108 53.340 -3.288 -10.964 787 HZ PHE 108 HZ PHE 108 52.713 -1.039 -11.754 788 H GLU 109 HN GLU 109 54.155 -2.391 -4.456 789 HA GLU 109 HA GLU 109 55.275 -4.882 -5.560 790 HB2 GLU 109 HB2 GLU 109 56.688 -2.262 -4.950 791 HB3 GLU 109 HB1 GLU 109 57.569 -3.770 -5.117 792 HG2 GLU 109 HG2 GLU 109 55.859 -2.505 -7.267 793 HG3 GLU 109 HG1 GLU 109 57.613 -2.380 -7.133 Start of MODEL 18 1 H1 GLY 1 HT1 GLY 1 -41.534 4.847 -5.018 2 H2 GLY 1 HT2 GLY 1 -39.996 4.935 -4.323 3 H3 GLY 1 HT3 GLY 1 -40.550 6.199 -5.307 4 HA2 GLY 1 HA1 GLY 1 -42.281 6.719 -3.715 5 HA3 GLY 1 HA2 GLY 1 -41.705 5.408 -2.693 6 H SER 2 HN SER 2 -40.759 6.257 -0.970 7 HA SER 2 HA SER 2 -39.271 8.767 -1.245 8 HB2 SER 2 HB2 SER 2 -39.979 7.291 1.299 9 HB3 SER 2 HB1 SER 2 -39.488 8.978 1.138 10 HG SER 2 HG SER 2 -41.529 9.419 0.926 11 H HIS 3 HN HIS 3 -38.496 5.704 -1.717 12 HA HIS 3 HA HIS 3 -35.963 5.856 -0.223 13 HB2 HIS 3 HB2 HIS 3 -37.345 3.384 -1.297 14 HB3 HIS 3 HB1 HIS 3 -35.828 3.407 -0.412 15 HD1 HIS 3 HD1 HIS 3 -39.252 2.726 0.119 16 HD2 HIS 3 HD2 HIS 3 -36.321 4.719 2.286 17 HE1 HIS 3 HE1 HIS 3 -40.081 2.773 2.493 18 HE2 HIS 3 HE2 HIS 3 -38.399 4.195 3.728 19 H MET 4 HN MET 4 -34.078 4.900 -1.381 20 HA MET 4 HA MET 4 -34.346 4.841 -4.287 21 HB2 MET 4 HB2 MET 4 -33.583 7.153 -3.550 22 HB3 MET 4 HB1 MET 4 -32.141 6.374 -2.926 23 HG2 MET 4 HG2 MET 4 -32.013 7.487 -5.213 24 HG3 MET 4 HG1 MET 4 -31.307 5.887 -5.019 25 HE1 MET 4 HE1 MET 4 -31.892 7.146 -7.848 26 HE2 MET 4 HE2 MET 4 -32.627 5.784 -8.695 27 HE3 MET 4 HE3 MET 4 -31.247 5.520 -7.632 28 H GLN 5 HN GLN 5 -32.115 4.112 -5.177 29 HA GLN 5 HA GLN 5 -31.368 1.763 -3.585 30 HB2 GLN 5 HB2 GLN 5 -32.435 1.270 -5.740 31 HB3 GLN 5 HB1 GLN 5 -31.209 2.214 -6.570 32 HG2 GLN 5 HG2 GLN 5 -29.495 0.619 -5.773 33 HG3 GLN 5 HG1 GLN 5 -30.781 -0.356 -5.064 34 HE21 GLN 5 HE21 GLN 5 -32.192 -1.469 -6.414 35 HE22 GLN 5 HE22 GLN 5 -31.831 -1.757 -8.106 36 H TYR 6 HN TYR 6 -29.428 1.798 -2.699 37 HA TYR 6 HA TYR 6 -27.289 3.335 -4.041 38 HB2 TYR 6 HB2 TYR 6 -27.728 2.770 -1.071 39 HB3 TYR 6 HB1 TYR 6 -26.174 3.312 -1.685 40 HD1 TYR 6 HD1 TYR 6 -29.568 4.270 -0.798 41 HD2 TYR 6 HD2 TYR 6 -25.965 5.601 -2.623 42 HE1 TYR 6 HE1 TYR 6 -30.324 6.598 -0.579 43 HE2 TYR 6 HE2 TYR 6 -26.718 7.931 -2.415 44 HH TYR 6 HH TYR 6 -28.811 9.174 -2.173 45 H LYS 7 HN LYS 7 -25.382 2.220 -4.453 46 HA LYS 7 HA LYS 7 -25.322 -0.567 -3.538 47 HB2 LYS 7 HB2 LYS 7 -24.082 -1.124 -5.690 48 HB3 LYS 7 HB1 LYS 7 -25.823 -0.812 -5.843 49 HG2 LYS 7 HG2 LYS 7 -25.486 1.156 -6.980 50 HG3 LYS 7 HG1 LYS 7 -23.868 1.398 -6.312 51 HD2 LYS 7 HD2 LYS 7 -23.893 0.749 -8.726 52 HD3 LYS 7 HD1 LYS 7 -22.973 -0.348 -7.700 53 HE2 LYS 7 HE2 LYS 7 -24.991 -1.811 -7.599 54 HE3 LYS 7 HE1 LYS 7 -25.742 -0.763 -8.800 55 HZ1 LYS 7 HZ1 LYS 7 -23.195 -2.245 -9.179 56 HZ2 LYS 7 HZ2 LYS 7 -23.982 -1.290 -10.343 57 HZ3 LYS 7 HZ3 LYS 7 -24.701 -2.722 -9.789 58 H LEU 8 HN LEU 8 -23.165 -1.552 -3.641 59 HA LEU 8 HA LEU 8 -20.947 0.336 -3.230 60 HB2 LEU 8 HB2 LEU 8 -21.918 -0.084 -0.982 61 HB3 LEU 8 HB1 LEU 8 -21.849 -1.791 -1.280 62 HG LEU 8 HG LEU 8 -19.298 -1.475 -1.463 63 HD11 LEU 8 HD11 LEU 8 -19.266 0.950 -1.551 64 HD12 LEU 8 HD12 LEU 8 -18.429 0.380 -0.105 65 HD13 LEU 8 HD13 LEU 8 -20.061 1.035 0.021 66 HD21 LEU 8 HD21 LEU 8 -20.036 -2.745 0.307 67 HD22 LEU 8 HD22 LEU 8 -20.988 -1.433 0.984 68 HD23 LEU 8 HD23 LEU 8 -19.229 -1.409 1.131 69 H ILE 9 HN ILE 9 -18.963 -0.517 -3.735 70 HA ILE 9 HA ILE 9 -18.933 -3.303 -4.713 71 HB ILE 9 HB ILE 9 -17.399 -0.921 -5.807 72 HG12 ILE 9 HG12 ILE 9 -19.321 -2.803 -7.231 73 HG13 ILE 9 HG11 ILE 9 -19.815 -1.194 -6.580 74 HG21 ILE 9 HG21 ILE 9 -17.138 -3.858 -6.440 75 HG22 ILE 9 HG22 ILE 9 -15.893 -2.792 -5.773 76 HG23 ILE 9 HG23 ILE 9 -16.460 -2.570 -7.431 77 HD11 ILE 9 HD11 ILE 9 -18.242 -0.119 -8.113 78 HD12 ILE 9 HD12 ILE 9 -19.347 -1.167 -9.007 79 HD13 ILE 9 HD13 ILE 9 -17.691 -1.691 -8.698 80 H LEU 10 HN LEU 10 -17.568 -4.584 -3.648 81 HA LEU 10 HA LEU 10 -15.679 -3.307 -1.831 82 HB2 LEU 10 HB2 LEU 10 -16.389 -6.237 -2.004 83 HB3 LEU 10 HB1 LEU 10 -15.321 -5.516 -0.828 84 HG LEU 10 HG LEU 10 -17.199 -5.807 0.417 85 HD11 LEU 10 HD11 LEU 10 -17.859 -3.149 -0.751 86 HD12 LEU 10 HD12 LEU 10 -16.575 -3.445 0.437 87 HD13 LEU 10 HD13 LEU 10 -18.260 -3.765 0.855 88 HD21 LEU 10 HD21 LEU 10 -18.985 -4.999 -1.864 89 HD22 LEU 10 HD22 LEU 10 -19.473 -5.687 -0.317 90 HD23 LEU 10 HD23 LEU 10 -18.567 -6.665 -1.470 91 H ASN 11 HN ASN 11 -14.000 -2.671 -3.111 92 HA ASN 11 HA ASN 11 -12.811 -4.682 -4.883 93 HB2 ASN 11 HB2 ASN 11 -11.877 -1.842 -4.286 94 HB3 ASN 11 HB1 ASN 11 -11.200 -2.925 -5.476 95 HD21 ASN 11 HD21 ASN 11 -12.320 -0.255 -5.663 96 HD22 ASN 11 HD22 ASN 11 -13.516 -0.363 -6.906 97 H GLY 12 HN GLY 12 -12.382 -6.097 -3.130 98 HA2 GLY 12 HA2 GLY 12 -9.829 -5.434 -1.867 99 HA3 GLY 12 HA1 GLY 12 -11.120 -6.076 -0.854 100 H LYS 13 HN LYS 13 -8.388 -6.976 -2.082 101 HA LYS 13 HA LYS 13 -8.721 -9.082 -3.812 102 HB2 LYS 13 HB2 LYS 13 -6.621 -9.071 -1.643 103 HB3 LYS 13 HB1 LYS 13 -6.477 -9.677 -3.293 104 HG2 LYS 13 HG2 LYS 13 -6.777 -7.321 -4.088 105 HG3 LYS 13 HG1 LYS 13 -6.672 -6.808 -2.406 106 HD2 LYS 13 HD2 LYS 13 -4.434 -8.009 -2.336 107 HD3 LYS 13 HD1 LYS 13 -4.558 -8.124 -4.093 108 HE2 LYS 13 HE2 LYS 13 -4.431 -5.627 -2.408 109 HE3 LYS 13 HE1 LYS 13 -3.249 -6.191 -3.584 110 HZ1 LYS 13 HZ1 LYS 13 -5.050 -5.905 -5.293 111 HZ2 LYS 13 HZ2 LYS 13 -4.453 -4.477 -4.618 112 HZ3 LYS 13 HZ3 LYS 13 -5.950 -5.088 -4.110 113 H THR 14 HN THR 14 -9.559 -8.982 -0.465 114 HA THR 14 HA THR 14 -9.487 -11.857 -0.063 115 HB THR 14 HB THR 14 -10.833 -11.199 2.035 116 HG1 THR 14 HG1 THR 14 -11.055 -9.065 2.466 117 HG21 THR 14 HG21 THR 14 -8.443 -11.691 2.103 118 HG22 THR 14 HG22 THR 14 -8.825 -10.345 3.175 119 HG23 THR 14 HG23 THR 14 -8.074 -10.041 1.609 120 H LEU 15 HN LEU 15 -12.008 -9.370 -0.474 121 HA LEU 15 HA LEU 15 -13.813 -11.402 -1.559 122 HB2 LEU 15 HB2 LEU 15 -14.373 -11.135 0.805 123 HB3 LEU 15 HB1 LEU 15 -14.421 -9.397 0.603 124 HG LEU 15 HG LEU 15 -16.250 -10.148 -1.253 125 HD11 LEU 15 HD11 LEU 15 -16.613 -12.037 1.068 126 HD12 LEU 15 HD12 LEU 15 -16.141 -12.501 -0.568 127 HD13 LEU 15 HD13 LEU 15 -17.725 -11.787 -0.277 128 HD21 LEU 15 HD21 LEU 15 -17.858 -9.342 0.359 129 HD22 LEU 15 HD22 LEU 15 -16.371 -8.388 0.392 130 HD23 LEU 15 HD23 LEU 15 -16.686 -9.573 1.659 131 H LYS 16 HN LYS 16 -14.235 -10.725 -3.558 132 HA LYS 16 HA LYS 16 -14.593 -7.832 -3.992 133 HB2 LYS 16 HB2 LYS 16 -13.885 -9.931 -6.056 134 HB3 LYS 16 HB1 LYS 16 -14.041 -8.206 -6.348 135 HG2 LYS 16 HG2 LYS 16 -11.766 -8.367 -6.185 136 HG3 LYS 16 HG1 LYS 16 -12.151 -8.087 -4.495 137 HD2 LYS 16 HD2 LYS 16 -10.531 -9.914 -4.972 138 HD3 LYS 16 HD1 LYS 16 -11.902 -10.367 -3.958 139 HE2 LYS 16 HE2 LYS 16 -13.001 -11.321 -5.967 140 HE3 LYS 16 HE1 LYS 16 -11.564 -10.925 -6.908 141 HZ1 LYS 16 HZ1 LYS 16 -11.658 -12.770 -4.580 142 HZ2 LYS 16 HZ2 LYS 16 -10.274 -12.390 -5.479 143 HZ3 LYS 16 HZ3 LYS 16 -11.545 -13.234 -6.210 144 H GLY 17 HN GLY 17 -16.567 -7.147 -4.581 145 HA2 GLY 17 HA2 GLY 17 -18.426 -8.521 -6.112 146 HA3 GLY 17 HA1 GLY 17 -18.779 -8.919 -4.437 147 H GLU 18 HN GLU 18 -20.839 -7.841 -5.119 148 HA GLU 18 HA GLU 18 -20.696 -5.001 -4.416 149 HB2 GLU 18 HB2 GLU 18 -22.307 -6.129 -6.725 150 HB3 GLU 18 HB1 GLU 18 -22.461 -4.494 -6.104 151 HG2 GLU 18 HG2 GLU 18 -20.184 -4.001 -6.774 152 HG3 GLU 18 HG1 GLU 18 -19.979 -5.662 -7.337 153 H THR 19 HN THR 19 -22.889 -4.147 -3.848 154 HA THR 19 HA THR 19 -24.955 -6.052 -3.231 155 HB THR 19 HB THR 19 -23.390 -6.355 -1.301 156 HG1 THR 19 HG1 THR 19 -25.795 -6.507 -1.184 157 HG21 THR 19 HG21 THR 19 -22.519 -4.069 -1.136 158 HG22 THR 19 HG22 THR 19 -23.290 -4.528 0.388 159 HG23 THR 19 HG23 THR 19 -24.130 -3.469 -0.742 160 H THR 20 HN THR 20 -26.829 -4.917 -2.120 161 HA THR 20 HA THR 20 -26.906 -2.050 -2.742 162 HB THR 20 HB THR 20 -29.259 -2.488 -3.647 163 HG1 THR 20 HG1 THR 20 -29.660 -4.584 -3.125 164 HG21 THR 20 HG21 THR 20 -27.486 -1.846 -5.187 165 HG22 THR 20 HG22 THR 20 -28.424 -3.149 -5.918 166 HG23 THR 20 HG23 THR 20 -26.853 -3.493 -5.197 167 H THR 21 HN THR 21 -28.691 -0.919 -1.723 168 HA THR 21 HA THR 21 -30.338 -2.299 0.196 169 HB THR 21 HB THR 21 -28.143 -1.969 1.438 170 HG1 THR 21 HG1 THR 21 -29.905 -0.430 2.893 171 HG21 THR 21 HG21 THR 21 -28.973 0.957 1.254 172 HG22 THR 21 HG22 THR 21 -27.486 0.258 0.614 173 HG23 THR 21 HG23 THR 21 -27.744 0.340 2.358 174 H GLU 22 HN GLU 22 -31.961 -0.904 1.131 175 HA GLU 22 HA GLU 22 -32.518 1.409 -0.583 176 HB2 GLU 22 HB2 GLU 22 -34.776 1.329 0.368 177 HB3 GLU 22 HB1 GLU 22 -34.338 -0.290 -0.171 178 HG2 GLU 22 HG2 GLU 22 -33.880 -0.976 2.097 179 HG3 GLU 22 HG1 GLU 22 -34.197 0.694 2.685 180 H ALA 23 HN ALA 23 -32.216 3.475 0.122 181 HA ALA 23 HA ALA 23 -32.263 4.004 3.002 182 HB1 ALA 23 HB1 ALA 23 -30.065 5.101 2.994 183 HB2 ALA 23 HB2 ALA 23 -29.831 4.642 1.308 184 HB3 ALA 23 HB3 ALA 23 -29.919 3.399 2.554 185 H VAL 24 HN VAL 24 -32.555 6.287 3.478 186 HA VAL 24 HA VAL 24 -33.431 7.849 1.157 187 HB VAL 24 HB VAL 24 -34.649 9.251 2.799 188 HG11 VAL 24 HG11 VAL 24 -36.362 7.584 3.344 189 HG12 VAL 24 HG12 VAL 24 -35.227 6.295 2.948 190 HG13 VAL 24 HG13 VAL 24 -35.774 7.408 1.691 191 HG21 VAL 24 HG21 VAL 24 -34.889 8.457 5.104 192 HG22 VAL 24 HG22 VAL 24 -33.218 8.887 4.736 193 HG23 VAL 24 HG23 VAL 24 -33.702 7.191 4.789 194 H ASP 25 HN ASP 25 -30.668 7.538 2.772 195 HA ASP 25 HA ASP 25 -29.851 10.276 2.325 196 HB2 ASP 25 HB2 ASP 25 -29.572 8.942 5.032 197 HB3 ASP 25 HB1 ASP 25 -28.625 10.336 4.539 198 H ALA 26 HN ALA 26 -27.513 10.461 2.237 199 HA ALA 26 HA ALA 26 -26.290 8.060 1.185 200 HB1 ALA 26 HB1 ALA 26 -24.412 9.522 0.615 201 HB2 ALA 26 HB2 ALA 26 -25.135 10.830 1.551 202 HB3 ALA 26 HB3 ALA 26 -25.936 10.248 0.091 203 H ALA 27 HN ALA 27 -25.953 10.208 3.969 204 HA ALA 27 HA ALA 27 -23.671 9.005 5.105 205 HB1 ALA 27 HB1 ALA 27 -24.278 10.156 7.154 206 HB2 ALA 27 HB2 ALA 27 -25.900 10.452 6.531 207 HB3 ALA 27 HB3 ALA 27 -24.509 11.221 5.767 208 H THR 28 HN THR 28 -27.106 8.323 5.453 209 HA THR 28 HA THR 28 -26.858 6.409 7.517 210 HB THR 28 HB THR 28 -29.053 6.416 5.438 211 HG1 THR 28 HG1 THR 28 -29.955 7.889 7.274 212 HG21 THR 28 HG21 THR 28 -29.033 5.782 8.395 213 HG22 THR 28 HG22 THR 28 -29.060 4.591 7.096 214 HG23 THR 28 HG23 THR 28 -30.429 5.681 7.324 215 H ALA 29 HN ALA 29 -26.404 6.247 4.075 216 HA ALA 29 HA ALA 29 -26.639 3.382 3.900 217 HB1 ALA 29 HB1 ALA 29 -27.122 4.754 1.947 218 HB2 ALA 29 HB2 ALA 29 -25.760 3.680 1.622 219 HB3 ALA 29 HB3 ALA 29 -25.475 5.386 1.966 220 H GLU 30 HN GLU 30 -24.098 5.790 4.249 221 HA GLU 30 HA GLU 30 -21.872 4.126 3.906 222 HB2 GLU 30 HB2 GLU 30 -22.034 6.739 4.185 223 HB3 GLU 30 HB1 GLU 30 -21.863 6.362 5.892 224 HG2 GLU 30 HG2 GLU 30 -19.780 5.081 5.314 225 HG3 GLU 30 HG1 GLU 30 -19.912 5.776 3.699 226 H LYS 31 HN LYS 31 -23.389 5.241 6.925 227 HA LYS 31 HA LYS 31 -21.897 3.835 8.743 228 HB2 LYS 31 HB2 LYS 31 -24.845 4.450 8.974 229 HB3 LYS 31 HB1 LYS 31 -23.765 4.063 10.307 230 HG2 LYS 31 HG2 LYS 31 -23.615 6.482 8.524 231 HG3 LYS 31 HG1 LYS 31 -24.138 6.439 10.207 232 HD2 LYS 31 HD2 LYS 31 -21.384 5.678 9.241 233 HD3 LYS 31 HD1 LYS 31 -21.812 7.255 9.903 234 HE2 LYS 31 HE2 LYS 31 -21.994 4.613 11.356 235 HE3 LYS 31 HE1 LYS 31 -20.741 5.835 11.579 236 HZ1 LYS 31 HZ1 LYS 31 -22.280 6.136 13.311 237 HZ2 LYS 31 HZ2 LYS 31 -23.615 6.035 12.272 238 HZ3 LYS 31 HZ3 LYS 31 -22.595 7.388 12.206 239 H VAL 32 HN VAL 32 -24.783 2.638 7.031 240 HA VAL 32 HA VAL 32 -24.913 0.195 8.514 241 HB VAL 32 HB VAL 32 -26.137 0.859 5.826 242 HG11 VAL 32 HG11 VAL 32 -26.739 -1.374 7.766 243 HG12 VAL 32 HG12 VAL 32 -26.030 -1.539 6.160 244 HG13 VAL 32 HG13 VAL 32 -27.696 -0.989 6.334 245 HG21 VAL 32 HG21 VAL 32 -27.322 1.012 8.596 246 HG22 VAL 32 HG22 VAL 32 -28.186 1.294 7.084 247 HG23 VAL 32 HG23 VAL 32 -26.888 2.383 7.575 248 H PHE 33 HN PHE 33 -23.774 1.016 5.246 249 HA PHE 33 HA PHE 33 -22.959 -1.622 4.614 250 HB2 PHE 33 HB2 PHE 33 -22.509 1.050 3.389 251 HB3 PHE 33 HB1 PHE 33 -21.450 -0.252 2.916 252 HD1 PHE 33 HD1 PHE 33 -23.322 1.255 1.091 253 HD2 PHE 33 HD2 PHE 33 -23.833 -2.320 3.350 254 HE1 PHE 33 HE1 PHE 33 -25.050 0.500 -0.494 255 HE2 PHE 33 HE2 PHE 33 -25.553 -3.082 1.767 256 HZ PHE 33 HZ PHE 33 -26.083 -1.692 -0.237 257 H LYS 34 HN LYS 34 -21.462 0.832 6.519 258 HA LYS 34 HA LYS 34 -18.798 -0.083 6.141 259 HB2 LYS 34 HB2 LYS 34 -20.114 1.676 8.195 260 HB3 LYS 34 HB1 LYS 34 -18.421 1.283 8.296 261 HG2 LYS 34 HG2 LYS 34 -18.341 2.139 5.844 262 HG3 LYS 34 HG1 LYS 34 -19.859 2.935 6.277 263 HD2 LYS 34 HD2 LYS 34 -18.114 4.514 6.674 264 HD3 LYS 34 HD1 LYS 34 -18.693 3.939 8.237 265 HE2 LYS 34 HE2 LYS 34 -16.826 2.510 8.515 266 HE3 LYS 34 HE1 LYS 34 -16.319 2.744 6.844 267 HZ1 LYS 34 HZ1 LYS 34 -15.935 5.109 7.373 268 HZ2 LYS 34 HZ2 LYS 34 -14.928 4.058 8.245 269 HZ3 LYS 34 HZ3 LYS 34 -16.265 4.780 9.004 270 H GLN 35 HN GLN 35 -21.286 -0.642 8.611 271 HA GLN 35 HA GLN 35 -19.811 -2.506 10.124 272 HB2 GLN 35 HB2 GLN 35 -21.919 -1.443 10.909 273 HB3 GLN 35 HB1 GLN 35 -22.818 -2.367 9.719 274 HG2 GLN 35 HG2 GLN 35 -23.074 -3.430 11.834 275 HG3 GLN 35 HG1 GLN 35 -22.062 -4.450 10.820 276 HE21 GLN 35 HE21 GLN 35 -22.344 -4.345 13.718 277 HE22 GLN 35 HE22 GLN 35 -20.756 -4.058 14.351 278 H TYR 36 HN TYR 36 -21.672 -2.704 7.209 279 HA TYR 36 HA TYR 36 -21.856 -5.506 6.929 280 HB2 TYR 36 HB2 TYR 36 -23.305 -4.242 5.580 281 HB3 TYR 36 HB1 TYR 36 -22.034 -3.139 5.090 282 HD1 TYR 36 HD1 TYR 36 -21.191 -3.294 3.007 283 HD2 TYR 36 HD2 TYR 36 -22.932 -6.761 4.745 284 HE1 TYR 36 HE1 TYR 36 -20.855 -4.493 0.899 285 HE2 TYR 36 HE2 TYR 36 -22.601 -7.990 2.636 286 HH TYR 36 HH TYR 36 -22.297 -7.518 0.257 287 H ALA 37 HN ALA 37 -19.607 -3.119 5.558 288 HA ALA 37 HA ALA 37 -17.899 -4.994 4.318 289 HB1 ALA 37 HB1 ALA 37 -17.263 -2.195 5.270 290 HB2 ALA 37 HB2 ALA 37 -18.000 -2.604 3.721 291 HB3 ALA 37 HB3 ALA 37 -16.354 -3.126 4.079 292 H ASN 38 HN ASN 38 -17.950 -3.498 7.493 293 HA ASN 38 HA ASN 38 -15.450 -4.284 8.468 294 HB2 ASN 38 HB2 ASN 38 -16.916 -2.652 9.638 295 HB3 ASN 38 HB1 ASN 38 -18.037 -3.955 10.025 296 HD21 ASN 38 HD21 ASN 38 -17.569 -5.376 11.673 297 HD22 ASN 38 HD22 ASN 38 -16.210 -5.139 12.788 298 H ASP 39 HN ASP 39 -18.554 -5.997 8.544 299 HA ASP 39 HA ASP 39 -17.755 -8.184 10.105 300 HB2 ASP 39 HB2 ASP 39 -20.103 -7.747 9.629 301 HB3 ASP 39 HB1 ASP 39 -19.846 -8.060 7.915 302 H ASN 40 HN ASN 40 -17.077 -7.399 6.813 303 HA ASN 40 HA ASN 40 -16.098 -10.126 6.317 304 HB2 ASN 40 HB2 ASN 40 -16.882 -7.912 4.435 305 HB3 ASN 40 HB1 ASN 40 -15.894 -9.272 3.904 306 HD21 ASN 40 HD21 ASN 40 -19.048 -8.207 4.866 307 HD22 ASN 40 HD22 ASN 40 -19.884 -9.716 4.495 308 H GLY 41 HN GLY 41 -14.964 -7.335 7.522 309 HA2 GLY 41 HA2 GLY 41 -12.806 -6.688 7.994 310 HA3 GLY 41 HA1 GLY 41 -12.244 -8.106 7.124 311 H VAL 42 HN VAL 42 -14.316 -5.718 5.616 312 HA VAL 42 HA VAL 42 -12.055 -4.937 3.925 313 HB VAL 42 HB VAL 42 -15.028 -4.914 3.315 314 HG11 VAL 42 HG11 VAL 42 -12.683 -4.233 1.528 315 HG12 VAL 42 HG12 VAL 42 -13.794 -3.060 2.238 316 HG13 VAL 42 HG13 VAL 42 -14.387 -4.240 1.066 317 HG21 VAL 42 HG21 VAL 42 -14.409 -6.653 1.669 318 HG22 VAL 42 HG22 VAL 42 -14.093 -7.149 3.332 319 HG23 VAL 42 HG23 VAL 42 -12.761 -6.627 2.300 320 H ASP 43 HN ASP 43 -11.284 -3.002 4.281 321 HA ASP 43 HA ASP 43 -13.031 -0.751 4.726 322 HB2 ASP 43 HB2 ASP 43 -12.583 -1.595 7.059 323 HB3 ASP 43 HB1 ASP 43 -10.867 -1.321 6.771 324 H GLY 44 HN GLY 44 -12.178 1.038 3.734 325 HA2 GLY 44 HA2 GLY 44 -9.417 1.478 3.297 326 HA3 GLY 44 HA1 GLY 44 -10.160 0.752 1.875 327 H GLU 45 HN GLU 45 -9.448 2.901 0.970 328 HA GLU 45 HA GLU 45 -10.554 5.358 1.692 329 HB2 GLU 45 HB2 GLU 45 -9.814 4.269 -1.036 330 HB3 GLU 45 HB1 GLU 45 -10.292 5.939 -0.762 331 HG2 GLU 45 HG2 GLU 45 -7.955 4.629 0.612 332 HG3 GLU 45 HG1 GLU 45 -7.842 5.541 -0.891 333 H TRP 46 HN TRP 46 -12.472 6.264 1.492 334 HA TRP 46 HA TRP 46 -14.616 4.643 0.289 335 HB2 TRP 46 HB2 TRP 46 -14.536 6.256 2.791 336 HB3 TRP 46 HB1 TRP 46 -16.023 6.327 1.871 337 HD1 TRP 46 HD1 TRP 46 -13.688 3.672 3.464 338 HE1 TRP 46 HE1 TRP 46 -15.115 1.678 4.238 339 HE3 TRP 46 HE3 TRP 46 -18.306 5.195 1.746 340 HZ2 TRP 46 HZ2 TRP 46 -17.800 0.866 4.154 341 HZ3 TRP 46 HZ3 TRP 46 -20.234 3.741 2.171 342 HH2 TRP 46 HH2 TRP 46 -19.984 1.619 3.336 343 H THR 47 HN THR 47 -15.245 5.407 -1.598 344 HA THR 47 HA THR 47 -15.421 8.327 -1.929 345 HB THR 47 HB THR 47 -15.014 7.751 -4.432 346 HG1 THR 47 HG1 THR 47 -13.545 5.597 -3.325 347 HG21 THR 47 HG21 THR 47 -13.462 9.073 -3.114 348 HG22 THR 47 HG22 THR 47 -12.568 7.931 -4.119 349 HG23 THR 47 HG23 THR 47 -12.787 7.611 -2.398 350 H TYR 48 HN TYR 48 -17.073 9.041 -3.482 351 HA TYR 48 HA TYR 48 -19.172 7.065 -4.008 352 HB2 TYR 48 HB2 TYR 48 -19.871 8.030 -1.946 353 HB3 TYR 48 HB1 TYR 48 -19.488 9.635 -2.469 354 HD1 TYR 48 HD1 TYR 48 -21.733 6.779 -3.318 355 HD2 TYR 48 HD2 TYR 48 -21.232 11.009 -3.220 356 HE1 TYR 48 HE1 TYR 48 -24.070 7.072 -4.016 357 HE2 TYR 48 HE2 TYR 48 -23.561 11.305 -3.917 358 HH TYR 48 HH TYR 48 -25.803 8.664 -4.016 359 H ASP 49 HN ASP 49 -20.651 7.661 -5.665 360 HA ASP 49 HA ASP 49 -19.828 9.985 -7.302 361 HB2 ASP 49 HB2 ASP 49 -18.973 7.611 -8.114 362 HB3 ASP 49 HB1 ASP 49 -20.626 7.448 -8.706 363 H ASP 50 HN ASP 50 -21.615 11.270 -7.520 364 HA ASP 50 HA ASP 50 -24.184 10.478 -6.594 365 HB2 ASP 50 HB2 ASP 50 -23.342 12.817 -8.340 366 HB3 ASP 50 HB1 ASP 50 -24.934 12.654 -7.604 367 H ALA 51 HN ALA 51 -22.765 10.651 -9.793 368 HA ALA 51 HA ALA 51 -25.076 10.391 -11.337 369 HB1 ALA 51 HB1 ALA 51 -22.325 9.366 -12.012 370 HB2 ALA 51 HB2 ALA 51 -22.853 11.039 -12.194 371 HB3 ALA 51 HB3 ALA 51 -23.616 9.765 -13.146 372 H THR 52 HN THR 52 -23.502 8.024 -9.388 373 HA THR 52 HA THR 52 -25.189 5.981 -10.654 374 HB THR 52 HB THR 52 -22.954 5.593 -11.541 375 HG1 THR 52 HG1 THR 52 -23.471 3.496 -9.705 376 HG21 THR 52 HG21 THR 52 -22.252 5.431 -8.645 377 HG22 THR 52 HG22 THR 52 -21.465 6.358 -9.923 378 HG23 THR 52 HG23 THR 52 -21.287 4.608 -9.866 379 H LYS 53 HN LYS 53 -24.860 7.534 -7.848 380 HA LYS 53 HA LYS 53 -25.060 7.054 -5.589 381 HB2 LYS 53 HB2 LYS 53 -27.155 5.461 -7.003 382 HB3 LYS 53 HB1 LYS 53 -26.960 5.235 -5.274 383 HG2 LYS 53 HG2 LYS 53 -28.686 6.834 -5.680 384 HG3 LYS 53 HG1 LYS 53 -27.292 7.667 -4.989 385 HD2 LYS 53 HD2 LYS 53 -28.304 8.892 -6.850 386 HD3 LYS 53 HD1 LYS 53 -26.633 8.459 -7.173 387 HE2 LYS 53 HE2 LYS 53 -27.361 6.620 -8.570 388 HE3 LYS 53 HE1 LYS 53 -29.045 6.955 -8.184 389 HZ1 LYS 53 HZ1 LYS 53 -28.316 7.824 -10.370 390 HZ2 LYS 53 HZ2 LYS 53 -27.260 8.884 -9.570 391 HZ3 LYS 53 HZ3 LYS 53 -28.931 9.019 -9.339 392 H THR 54 HN THR 54 -22.900 5.650 -6.720 393 HA THR 54 HA THR 54 -23.044 3.037 -5.378 394 HB THR 54 HB THR 54 -21.161 3.865 -7.608 395 HG1 THR 54 HG1 THR 54 -23.765 3.243 -7.691 396 HG21 THR 54 HG21 THR 54 -20.734 1.439 -7.764 397 HG22 THR 54 HG22 THR 54 -21.857 1.148 -6.432 398 HG23 THR 54 HG23 THR 54 -20.351 2.027 -6.142 399 H TYR 55 HN TYR 55 -22.020 3.064 -3.480 400 HA TYR 55 HA TYR 55 -19.789 4.844 -3.001 401 HB2 TYR 55 HB2 TYR 55 -21.311 2.914 -1.248 402 HB3 TYR 55 HB1 TYR 55 -19.680 3.397 -0.792 403 HD1 TYR 55 HD1 TYR 55 -19.139 5.749 -0.327 404 HD2 TYR 55 HD2 TYR 55 -23.148 4.480 -1.016 405 HE1 TYR 55 HE1 TYR 55 -19.964 7.833 0.680 406 HE2 TYR 55 HE2 TYR 55 -23.979 6.564 -0.010 407 HH TYR 55 HH TYR 55 -22.048 9.245 0.519 408 H THR 56 HN THR 56 -17.677 4.315 -2.953 409 HA THR 56 HA THR 56 -17.048 1.546 -3.689 410 HB THR 56 HB THR 56 -14.882 2.956 -4.611 411 HG1 THR 56 HG1 THR 56 -15.532 4.991 -4.542 412 HG21 THR 56 HG21 THR 56 -15.899 2.740 -6.869 413 HG22 THR 56 HG22 THR 56 -17.440 2.333 -6.117 414 HG23 THR 56 HG23 THR 56 -16.048 1.264 -5.915 415 H VAL 57 HN VAL 57 -15.838 0.476 -2.324 416 HA VAL 57 HA VAL 57 -14.008 1.976 -0.575 417 HB VAL 57 HB VAL 57 -15.817 0.893 0.797 418 HG11 VAL 57 HG11 VAL 57 -14.691 -1.678 -0.299 419 HG12 VAL 57 HG12 VAL 57 -16.344 -1.082 -0.470 420 HG13 VAL 57 HG13 VAL 57 -15.742 -1.576 1.109 421 HG21 VAL 57 HG21 VAL 57 -13.654 1.315 1.775 422 HG22 VAL 57 HG22 VAL 57 -13.046 -0.220 1.157 423 HG23 VAL 57 HG23 VAL 57 -14.304 -0.206 2.391 424 H THR 58 HN THR 58 -11.965 1.593 -1.073 425 HA THR 58 HA THR 58 -11.389 -0.867 -2.594 426 HB THR 58 HB THR 58 -10.019 1.764 -3.126 427 HG1 THR 58 HG1 THR 58 -12.556 1.304 -3.514 428 HG21 THR 58 HG21 THR 58 -10.430 -0.703 -4.838 429 HG22 THR 58 HG22 THR 58 -8.945 -0.303 -3.971 430 HG23 THR 58 HG23 THR 58 -9.507 0.735 -5.279 431 H GLU 59 HN GLU 59 -10.065 -2.102 -1.570 432 HA GLU 59 HA GLU 59 -8.281 -1.254 0.473 433 HB2 GLU 59 HB2 GLU 59 -8.518 -3.869 -1.021 434 HB3 GLU 59 HB1 GLU 59 -7.309 -3.611 0.192 435 HG2 GLU 59 HG2 GLU 59 -9.449 -4.797 0.881 436 HG3 GLU 59 HG1 GLU 59 -8.834 -3.520 1.921 437 H GLY 60 HN GLY 60 -5.907 -1.424 0.424 438 HA2 GLY 60 HA2 GLY 60 -4.869 -0.083 -1.902 439 HA3 GLY 60 HA1 GLY 60 -3.970 -0.546 -0.463 440 H SER 61 HN SER 61 -2.302 -1.034 -2.041 441 HA SER 61 HA SER 61 -2.716 -3.314 -3.792 442 HB2 SER 61 HB2 SER 61 -1.384 -1.246 -4.419 443 HB3 SER 61 HB1 SER 61 -0.157 -1.785 -3.274 444 HG SER 61 HG SER 61 0.416 -2.531 -5.278 445 H GLY 62 HN GLY 62 -0.360 -4.640 -3.751 446 HA2 GLY 62 HA2 GLY 62 -0.015 -5.571 -0.986 447 HA3 GLY 62 HA1 GLY 62 -0.407 -6.743 -2.240 448 H GLY 63 HN GLY 63 1.902 -7.115 -0.833 449 HA2 GLY 63 HA2 GLY 63 3.993 -6.084 -2.637 450 HA3 GLY 63 HA1 GLY 63 4.255 -6.482 -0.947 451 H ALA 64 HN ALA 64 2.322 -8.608 -2.920 452 HA ALA 64 HA ALA 64 4.642 -10.395 -3.236 453 HB1 ALA 64 HB1 ALA 64 3.342 -11.122 -1.283 454 HB2 ALA 64 HB2 ALA 64 3.278 -12.312 -2.584 455 HB3 ALA 64 HB3 ALA 64 1.903 -11.249 -2.293 456 H GLY 65 HN GLY 65 1.202 -10.856 -3.985 457 HA2 GLY 65 HA2 GLY 65 0.104 -10.733 -6.029 458 HA3 GLY 65 HA1 GLY 65 1.622 -10.311 -6.803 459 H GLY 66 HN GLY 66 3.259 -12.208 -6.801 460 HA2 GLY 66 HA2 GLY 66 2.050 -14.265 -8.345 461 HA3 GLY 66 HA1 GLY 66 3.734 -14.196 -7.859 462 H GLN 67 HN GLN 67 3.380 -14.247 -5.062 463 HA GLN 67 HA GLN 67 1.907 -16.712 -4.527 464 HB2 GLN 67 HB2 GLN 67 4.211 -17.378 -5.146 465 HB3 GLN 67 HB1 GLN 67 4.849 -16.338 -3.848 466 HG2 GLN 67 HG2 GLN 67 3.816 -17.718 -2.181 467 HG3 GLN 67 HG1 GLN 67 2.992 -18.679 -3.408 468 HE21 GLN 67 HE21 GLN 67 3.940 -20.606 -2.709 469 HE22 GLN 67 HE22 GLN 67 5.616 -20.955 -2.986 470 H GLY 68 HN GLY 68 0.728 -16.427 -2.764 471 HA2 GLY 68 HA2 GLY 68 1.209 -14.088 -1.116 472 HA3 GLY 68 HA1 GLY 68 -0.210 -15.118 -1.078 473 H MET 69 HN MET 69 0.190 -14.717 1.266 474 HA MET 69 HA MET 69 1.276 -16.985 2.553 475 HB2 MET 69 HB2 MET 69 3.356 -15.531 1.961 476 HB3 MET 69 HB1 MET 69 2.759 -14.425 3.189 477 HG2 MET 69 HG2 MET 69 2.830 -16.321 4.817 478 HG3 MET 69 HG1 MET 69 3.633 -17.279 3.575 479 HE1 MET 69 HE1 MET 69 3.917 -14.247 6.051 480 HE2 MET 69 HE2 MET 69 4.022 -13.443 4.486 481 HE3 MET 69 HE3 MET 69 5.432 -13.503 5.545 482 H ILE 70 HN ILE 70 1.758 -15.509 5.061 483 HA ILE 70 HA ILE 70 0.790 -14.325 6.723 484 HB ILE 70 HB ILE 70 -1.242 -13.499 4.644 485 HG12 ILE 70 HG12 ILE 70 1.089 -12.015 5.893 486 HG13 ILE 70 HG11 ILE 70 1.021 -12.644 4.251 487 HG21 ILE 70 HG21 ILE 70 -0.910 -12.411 7.463 488 HG22 ILE 70 HG22 ILE 70 -2.248 -13.420 6.912 489 HG23 ILE 70 HG23 ILE 70 -2.025 -11.804 6.240 490 HD11 ILE 70 HD11 ILE 70 0.638 -10.254 4.274 491 HD12 ILE 70 HD12 ILE 70 -0.721 -10.463 5.381 492 HD13 ILE 70 HD13 ILE 70 -0.809 -11.111 3.745 493 H GLN 71 HN GLN 71 0.466 -16.384 7.653 494 HA GLN 71 HA GLN 71 -2.387 -16.930 8.105 495 HB2 GLN 71 HB2 GLN 71 -1.054 -18.800 6.900 496 HB3 GLN 71 HB1 GLN 71 -0.213 -19.017 8.430 497 HG2 GLN 71 HG2 GLN 71 -2.342 -19.470 9.536 498 HG3 GLN 71 HG1 GLN 71 -3.180 -19.263 8.003 499 HE21 GLN 71 HE21 GLN 71 -1.049 -20.593 6.497 500 HE22 GLN 71 HE22 GLN 71 -1.228 -22.277 6.829 501 H GLU 72 HN GLU 72 -0.551 -15.070 9.160 502 HA GLU 72 HA GLU 72 -0.010 -16.025 11.880 503 HB2 GLU 72 HB2 GLU 72 1.691 -14.143 11.959 504 HB3 GLU 72 HB1 GLU 72 2.107 -15.507 10.936 505 HG2 GLU 72 HG2 GLU 72 1.523 -14.277 8.962 506 HG3 GLU 72 HG1 GLU 72 0.904 -12.934 9.919 507 HA PRO 73 HA PRO 73 -2.817 -12.876 13.220 508 HB2 PRO 73 HB2 PRO 73 -1.944 -12.271 15.690 509 HB3 PRO 73 HB1 PRO 73 -2.525 -13.950 15.318 510 HG2 PRO 73 HG2 PRO 73 0.278 -12.857 15.302 511 HG3 PRO 73 HG1 PRO 73 -0.332 -14.286 16.167 512 HD2 PRO 73 HD2 PRO 73 0.920 -14.503 13.785 513 HD3 PRO 73 HD1 PRO 73 -0.473 -15.560 14.203 514 H ALA 74 HN ALA 74 -3.060 -10.671 13.470 515 HA ALA 74 HA ALA 74 -0.925 -8.814 13.680 516 HB1 ALA 74 HB1 ALA 74 -2.124 -9.224 10.932 517 HB2 ALA 74 HB2 ALA 74 -0.444 -9.491 11.398 518 HB3 ALA 74 HB3 ALA 74 -1.111 -7.859 11.397 519 H LEU 75 HN LEU 75 -1.845 -6.540 12.974 520 HA LEU 75 HA LEU 75 -4.507 -6.400 14.162 521 HB2 LEU 75 HB2 LEU 75 -2.440 -4.265 13.641 522 HB3 LEU 75 HB1 LEU 75 -4.039 -3.928 14.259 523 HG LEU 75 HG LEU 75 -2.592 -3.877 16.106 524 HD11 LEU 75 HD11 LEU 75 -4.681 -5.030 16.540 525 HD12 LEU 75 HD12 LEU 75 -3.380 -5.708 17.517 526 HD13 LEU 75 HD13 LEU 75 -3.944 -6.567 16.085 527 HD21 LEU 75 HD21 LEU 75 -0.676 -5.031 15.093 528 HD22 LEU 75 HD22 LEU 75 -1.512 -6.574 15.294 529 HD23 LEU 75 HD23 LEU 75 -1.038 -5.634 16.710 530 HA PRO 76 HA PRO 76 -6.345 -5.638 10.140 531 HB2 PRO 76 HB2 PRO 76 -8.368 -4.017 11.614 532 HB3 PRO 76 HB1 PRO 76 -8.640 -5.445 10.611 533 HG2 PRO 76 HG2 PRO 76 -8.897 -5.589 13.249 534 HG3 PRO 76 HG1 PRO 76 -8.089 -6.919 12.329 535 HD2 PRO 76 HD2 PRO 76 -6.793 -4.658 13.903 536 HD3 PRO 76 HD1 PRO 76 -6.437 -6.397 13.932 537 HA PRO 77 HA PRO 77 -4.948 -1.612 8.953 538 HB2 PRO 77 HB2 PRO 77 -6.828 -0.737 7.191 539 HB3 PRO 77 HB1 PRO 77 -5.649 -1.996 6.784 540 HG2 PRO 77 HG2 PRO 77 -8.462 -2.281 7.771 541 HG3 PRO 77 HG1 PRO 77 -7.705 -3.074 6.367 542 HD2 PRO 77 HD2 PRO 77 -7.926 -4.424 8.669 543 HD3 PRO 77 HD1 PRO 77 -6.392 -4.506 7.723 544 H GLY 78 HN GLY 78 -5.022 0.189 10.104 545 HA2 GLY 78 HA2 GLY 78 -6.060 2.116 10.989 546 HA3 GLY 78 HA1 GLY 78 -7.607 1.288 10.917 547 H TRP 79 HN TRP 79 -6.365 -1.124 12.320 548 HA TRP 79 HA TRP 79 -6.768 -0.020 15.009 549 HB2 TRP 79 HB2 TRP 79 -6.644 -2.871 13.988 550 HB3 TRP 79 HB1 TRP 79 -6.752 -2.470 15.696 551 HD1 TRP 79 HD1 TRP 79 -8.816 -2.262 12.452 552 HE1 TRP 79 HE1 TRP 79 -11.300 -2.041 13.085 553 HE3 TRP 79 HE3 TRP 79 -8.345 -1.754 17.537 554 HZ2 TRP 79 HZ2 TRP 79 -12.853 -1.703 15.414 555 HZ3 TRP 79 HZ3 TRP 79 -10.378 -1.484 18.879 556 HH2 TRP 79 HH2 TRP 79 -12.584 -1.458 17.846 557 H GLU 80 HN GLU 80 -5.231 -0.017 16.641 558 HA GLU 80 HA GLU 80 -2.659 -1.337 16.105 559 HB2 GLU 80 HB2 GLU 80 -3.173 1.441 17.109 560 HB3 GLU 80 HB1 GLU 80 -1.733 0.581 17.632 561 HG2 GLU 80 HG2 GLU 80 -1.240 0.238 15.161 562 HG3 GLU 80 HG1 GLU 80 -2.494 1.441 14.862 563 H MET 81 HN MET 81 -1.605 -2.197 17.946 564 HA MET 81 HA MET 81 -3.309 -2.401 20.340 565 HB2 MET 81 HB2 MET 81 -3.225 -4.470 18.851 566 HB3 MET 81 HB1 MET 81 -1.508 -4.606 19.306 567 HG2 MET 81 HG2 MET 81 -3.761 -4.558 21.301 568 HG3 MET 81 HG1 MET 81 -3.117 -6.038 20.596 569 HE1 MET 81 HE1 MET 81 -3.357 -5.361 23.683 570 HE2 MET 81 HE2 MET 81 -1.817 -5.952 24.311 571 HE3 MET 81 HE3 MET 81 -2.707 -6.897 23.114 572 H LYS 82 HN LYS 82 -2.273 -2.018 22.279 573 HA LYS 82 HA LYS 82 0.617 -2.050 22.441 574 HB2 LYS 82 HB2 LYS 82 -0.869 0.563 22.857 575 HB3 LYS 82 HB1 LYS 82 0.837 0.309 23.142 576 HG2 LYS 82 HG2 LYS 82 1.258 0.019 20.808 577 HG3 LYS 82 HG1 LYS 82 -0.494 0.049 20.450 578 HD2 LYS 82 HD2 LYS 82 -0.494 2.372 21.498 579 HD3 LYS 82 HD1 LYS 82 1.266 2.298 21.416 580 HE2 LYS 82 HE2 LYS 82 -0.577 1.962 19.053 581 HE3 LYS 82 HE1 LYS 82 0.220 3.470 19.492 582 HZ1 LYS 82 HZ1 LYS 82 1.734 0.980 18.942 583 HZ2 LYS 82 HZ2 LYS 82 2.318 2.570 19.007 584 HZ3 LYS 82 HZ3 LYS 82 1.320 2.084 17.721 585 H TYR 83 HN TYR 83 1.358 -1.793 24.675 586 HA TYR 83 HA TYR 83 -0.780 -2.379 26.644 587 HB2 TYR 83 HB2 TYR 83 2.125 -3.270 26.523 588 HB3 TYR 83 HB1 TYR 83 1.168 -3.369 28.020 589 HD1 TYR 83 HD1 TYR 83 1.677 -4.728 24.655 590 HD2 TYR 83 HD2 TYR 83 -0.570 -5.040 28.257 591 HE1 TYR 83 HE1 TYR 83 0.815 -6.908 23.917 592 HE2 TYR 83 HE2 TYR 83 -1.438 -7.225 27.530 593 HH TYR 83 HH TYR 83 -0.248 -8.804 24.608 594 H THR 84 HN THR 84 -0.639 -1.376 28.715 595 HA THR 84 HA THR 84 0.950 1.072 28.796 596 HB THR 84 HB THR 84 -0.286 1.733 30.718 597 HG1 THR 84 HG1 THR 84 -1.335 0.325 32.052 598 HG21 THR 84 HG21 THR 84 -2.647 1.423 30.118 599 HG22 THR 84 HG22 THR 84 -2.188 0.153 28.985 600 HG23 THR 84 HG23 THR 84 -1.655 1.810 28.713 601 H SER 85 HN SER 85 2.202 1.445 30.966 602 HA SER 85 HA SER 85 4.056 -0.730 31.201 603 HB2 SER 85 HB2 SER 85 5.168 0.848 32.858 604 HB3 SER 85 HB1 SER 85 4.950 1.482 31.230 605 HG SER 85 HG SER 85 3.338 2.015 33.503 606 H GLU 86 HN GLU 86 1.183 -0.860 32.303 607 HA GLU 86 HA GLU 86 1.879 -1.783 35.043 608 HB2 GLU 86 HB2 GLU 86 -0.773 -0.611 34.112 609 HB3 GLU 86 HB1 GLU 86 -0.359 -1.071 35.758 610 HG2 GLU 86 HG2 GLU 86 1.231 0.694 35.928 611 HG3 GLU 86 HG1 GLU 86 1.079 1.073 34.214 612 H GLY 87 HN GLY 87 1.252 -2.789 32.047 613 HA2 GLY 87 HA2 GLY 87 0.786 -4.930 31.304 614 HA3 GLY 87 HA1 GLY 87 0.257 -5.349 32.925 615 H VAL 88 HN VAL 88 -1.170 -2.512 31.658 616 HA VAL 88 HA VAL 88 -3.719 -3.900 31.451 617 HB VAL 88 HB VAL 88 -3.124 -0.937 31.305 618 HG11 VAL 88 HG11 VAL 88 -5.187 -1.418 30.155 619 HG12 VAL 88 HG12 VAL 88 -5.562 -0.695 31.720 620 HG13 VAL 88 HG13 VAL 88 -5.733 -2.435 31.490 621 HG21 VAL 88 HG21 VAL 88 -2.598 -1.892 33.496 622 HG22 VAL 88 HG22 VAL 88 -4.209 -2.604 33.573 623 HG23 VAL 88 HG23 VAL 88 -4.019 -0.852 33.578 624 H ARG 89 HN ARG 89 -4.930 -4.085 29.629 625 HA ARG 89 HA ARG 89 -3.458 -3.776 27.119 626 HB2 ARG 89 HB2 ARG 89 -4.513 -5.970 27.930 627 HB3 ARG 89 HB1 ARG 89 -6.064 -5.235 27.571 628 HG2 ARG 89 HG2 ARG 89 -5.376 -4.982 25.221 629 HG3 ARG 89 HG1 ARG 89 -3.854 -5.792 25.601 630 HD2 ARG 89 HD2 ARG 89 -5.526 -7.620 26.584 631 HD3 ARG 89 HD1 ARG 89 -6.605 -6.908 25.387 632 HE ARG 89 HE ARG 89 -3.988 -7.647 24.408 633 HH11 ARG 89 HH11 ARG 89 -7.352 -8.641 24.793 634 HH12 ARG 89 HH12 ARG 89 -7.204 -9.916 23.622 635 HH21 ARG 89 HH21 ARG 89 -3.841 -9.340 22.889 636 HH22 ARG 89 HH22 ARG 89 -5.247 -10.321 22.563 637 H TYR 90 HN TYR 90 -3.902 -1.973 25.908 638 HA TYR 90 HA TYR 90 -6.708 -1.119 25.829 639 HB2 TYR 90 HB2 TYR 90 -6.199 1.202 25.863 640 HB3 TYR 90 HB1 TYR 90 -5.336 0.496 27.206 641 HD1 TYR 90 HD1 TYR 90 -5.083 2.411 24.184 642 HD2 TYR 90 HD2 TYR 90 -2.840 0.140 26.995 643 HE1 TYR 90 HE1 TYR 90 -3.022 3.516 23.418 644 HE2 TYR 90 HE2 TYR 90 -0.776 1.230 26.239 645 HH TYR 90 HH TYR 90 -0.816 3.898 23.956 646 H PHE 91 HN PHE 91 -7.277 0.031 23.761 647 HA PHE 91 HA PHE 91 -5.476 -0.788 21.591 648 HB2 PHE 91 HB2 PHE 91 -8.466 -1.127 21.782 649 HB3 PHE 91 HB1 PHE 91 -7.636 -1.089 20.241 650 HD1 PHE 91 HD1 PHE 91 -6.799 -3.004 19.325 651 HD2 PHE 91 HD2 PHE 91 -7.577 -2.916 23.514 652 HE1 PHE 91 HE1 PHE 91 -6.288 -5.404 19.470 653 HE2 PHE 91 HE2 PHE 91 -7.063 -5.306 23.660 654 HZ PHE 91 HZ PHE 91 -6.418 -6.559 21.640 655 H VAL 92 HN VAL 92 -5.789 0.442 19.573 656 HA VAL 92 HA VAL 92 -6.762 3.176 20.100 657 HB VAL 92 HB VAL 92 -4.228 2.477 18.604 658 HG11 VAL 92 HG11 VAL 92 -3.837 4.884 18.561 659 HG12 VAL 92 HG12 VAL 92 -5.388 5.158 19.356 660 HG13 VAL 92 HG13 VAL 92 -5.338 4.465 17.735 661 HG21 VAL 92 HG21 VAL 92 -4.558 3.738 21.319 662 HG22 VAL 92 HG22 VAL 92 -3.031 3.512 20.468 663 HG23 VAL 92 HG23 VAL 92 -3.966 2.112 21.003 664 H ASP 93 HN ASP 93 -8.180 3.846 18.618 665 HA ASP 93 HA ASP 93 -8.395 2.454 16.034 666 HB2 ASP 93 HB2 ASP 93 -10.188 4.212 17.654 667 HB3 ASP 93 HB1 ASP 93 -10.172 4.576 15.930 668 H HIS 94 HN HIS 94 -6.788 3.175 14.599 669 HA HIS 94 HA HIS 94 -5.592 5.761 14.915 670 HB2 HIS 94 HB2 HIS 94 -4.525 3.565 13.965 671 HB3 HIS 94 HB1 HIS 94 -5.233 4.089 12.444 672 HD1 HIS 94 HD1 HIS 94 -4.082 6.009 11.190 673 HD2 HIS 94 HD2 HIS 94 -2.422 5.252 14.941 674 HE1 HIS 94 HE1 HIS 94 -1.939 7.314 11.274 675 HE2 HIS 94 HE2 HIS 94 -0.995 6.911 13.574 676 H ASN 95 HN ASN 95 -8.374 4.681 13.342 677 HA ASN 95 HA ASN 95 -8.352 6.591 11.191 678 HB2 ASN 95 HB2 ASN 95 -10.753 5.883 10.891 679 HB3 ASN 95 HB1 ASN 95 -9.607 4.547 10.849 680 HD21 ASN 95 HD21 ASN 95 -9.702 2.979 12.385 681 HD22 ASN 95 HD22 ASN 95 -10.930 2.901 13.611 682 H THR 96 HN THR 96 -10.072 6.309 14.306 683 HA THR 96 HA THR 96 -11.008 9.046 14.033 684 HB THR 96 HB THR 96 -12.069 8.575 16.307 685 HG1 THR 96 HG1 THR 96 -11.921 5.849 15.813 686 HG21 THR 96 HG21 THR 96 -13.360 8.519 14.236 687 HG22 THR 96 HG22 THR 96 -13.897 7.257 15.340 688 HG23 THR 96 HG23 THR 96 -12.873 6.844 13.965 689 H ARG 97 HN ARG 97 -8.460 7.293 15.458 690 HA ARG 97 HA ARG 97 -6.563 7.946 16.543 691 HB2 ARG 97 HB2 ARG 97 -7.626 10.753 16.142 692 HB3 ARG 97 HB1 ARG 97 -5.987 10.339 16.652 693 HG2 ARG 97 HG2 ARG 97 -5.542 9.256 14.569 694 HG3 ARG 97 HG1 ARG 97 -7.227 9.405 14.088 695 HD2 ARG 97 HD2 ARG 97 -6.938 11.884 14.125 696 HD3 ARG 97 HD1 ARG 97 -5.219 11.616 14.416 697 HE ARG 97 HE ARG 97 -6.220 10.218 12.119 698 HH11 ARG 97 HH11 ARG 97 -4.868 13.226 13.287 699 HH12 ARG 97 HH12 ARG 97 -4.374 13.754 11.702 700 HH21 ARG 97 HH21 ARG 97 -5.518 10.893 10.048 701 HH22 ARG 97 HH22 ARG 97 -4.693 12.413 9.876 702 H THR 98 HN THR 98 -8.715 7.070 17.835 703 HA THR 98 HA THR 98 -8.794 8.601 20.359 704 HB THR 98 HB THR 98 -10.922 7.268 20.796 705 HG1 THR 98 HG1 THR 98 -11.139 6.807 18.035 706 HG21 THR 98 HG21 THR 98 -11.017 9.615 20.055 707 HG22 THR 98 HG22 THR 98 -12.332 8.685 19.333 708 HG23 THR 98 HG23 THR 98 -10.913 9.092 18.371 709 H THR 99 HN THR 99 -8.748 7.303 22.358 710 HA THR 99 HA THR 99 -7.412 4.688 22.001 711 HB THR 99 HB THR 99 -6.897 5.059 24.533 712 HG1 THR 99 HG1 THR 99 -8.458 6.911 24.539 713 HG21 THR 99 HG21 THR 99 -5.668 6.891 22.430 714 HG22 THR 99 HG22 THR 99 -5.105 5.277 22.856 715 HG23 THR 99 HG23 THR 99 -4.959 6.598 24.017 716 H THR 100 HN THR 100 -8.566 2.840 22.659 717 HA THR 100 HA THR 100 -10.886 3.275 24.387 718 HB THR 100 HB THR 100 -11.647 3.434 22.001 719 HG1 THR 100 HG1 THR 100 -13.240 2.812 23.355 720 HG21 THR 100 HG21 THR 100 -10.820 0.521 21.908 721 HG22 THR 100 HG22 THR 100 -10.139 1.833 20.945 722 HG23 THR 100 HG23 THR 100 -11.809 1.333 20.696 723 H PHE 101 HN PHE 101 -11.455 1.526 25.633 724 HA PHE 101 HA PHE 101 -9.631 -0.762 25.549 725 HB2 PHE 101 HB2 PHE 101 -11.629 0.191 27.631 726 HB3 PHE 101 HB1 PHE 101 -10.776 -1.401 27.726 727 HD1 PHE 101 HD1 PHE 101 -10.161 2.286 27.504 728 HD2 PHE 101 HD2 PHE 101 -8.684 -1.524 28.710 729 HE1 PHE 101 HE1 PHE 101 -8.252 3.375 28.604 730 HE2 PHE 101 HE2 PHE 101 -6.768 -0.435 29.814 731 HZ PHE 101 HZ PHE 101 -6.553 2.018 29.758 732 H LYS 102 HN LYS 102 -10.337 -2.050 23.948 733 HA LYS 102 HA LYS 102 -13.031 -3.162 24.169 734 HB2 LYS 102 HB2 LYS 102 -13.191 -1.365 22.512 735 HB3 LYS 102 HB1 LYS 102 -11.837 -2.042 21.623 736 HG2 LYS 102 HG2 LYS 102 -13.191 -4.077 21.206 737 HG3 LYS 102 HG1 LYS 102 -14.555 -3.275 21.988 738 HD2 LYS 102 HD2 LYS 102 -13.083 -2.248 19.562 739 HD3 LYS 102 HD1 LYS 102 -14.632 -3.092 19.530 740 HE2 LYS 102 HE2 LYS 102 -14.156 -0.536 21.050 741 HE3 LYS 102 HE1 LYS 102 -14.766 -0.585 19.397 742 HZ1 LYS 102 HZ1 LYS 102 -16.715 -1.689 20.095 743 HZ2 LYS 102 HZ2 LYS 102 -16.493 -0.411 21.190 744 HZ3 LYS 102 HZ3 LYS 102 -16.096 -1.998 21.643 745 H ASP 103 HN ASP 103 -12.491 -5.201 24.625 746 HA ASP 103 HA ASP 103 -10.273 -6.475 23.227 747 HB2 ASP 103 HB2 ASP 103 -10.736 -6.722 25.746 748 HB3 ASP 103 HB1 ASP 103 -12.070 -7.770 25.278 749 HA PRO 104 HA PRO 104 -12.881 -8.320 20.162 750 HB2 PRO 104 HB2 PRO 104 -11.089 -10.676 20.249 751 HB3 PRO 104 HB1 PRO 104 -11.421 -9.595 18.896 752 HG2 PRO 104 HG2 PRO 104 -9.074 -9.616 20.273 753 HG3 PRO 104 HG1 PRO 104 -9.707 -8.176 19.458 754 HD2 PRO 104 HD2 PRO 104 -9.602 -8.839 22.344 755 HD3 PRO 104 HD1 PRO 104 -9.608 -7.254 21.546 756 H ARG 105 HN ARG 105 -12.003 -9.963 23.113 757 HA ARG 105 HA ARG 105 -14.018 -12.022 22.738 758 HB2 ARG 105 HB2 ARG 105 -12.023 -11.381 24.885 759 HB3 ARG 105 HB1 ARG 105 -13.378 -12.433 25.253 760 HG2 ARG 105 HG2 ARG 105 -11.384 -13.708 24.723 761 HG3 ARG 105 HG1 ARG 105 -12.655 -13.997 23.528 762 HD2 ARG 105 HD2 ARG 105 -10.677 -11.846 22.937 763 HD3 ARG 105 HD1 ARG 105 -10.109 -13.513 22.818 764 HE ARG 105 HE ARG 105 -12.536 -12.720 21.374 765 HH11 ARG 105 HH11 ARG 105 -9.164 -13.702 21.335 766 HH12 ARG 105 HH12 ARG 105 -9.191 -14.137 19.648 767 HH21 ARG 105 HH21 ARG 105 -12.545 -13.284 19.146 768 HH22 ARG 105 HH22 ARG 105 -11.088 -13.905 18.423 769 HA PRO 106 HA PRO 106 -17.133 -9.367 24.497 770 HB2 PRO 106 HB2 PRO 106 -19.083 -11.209 25.008 771 HB3 PRO 106 HB1 PRO 106 -18.718 -10.603 23.350 772 HG2 PRO 106 HG2 PRO 106 -17.898 -13.159 24.688 773 HG3 PRO 106 HG1 PRO 106 -18.416 -12.877 23.015 774 HD2 PRO 106 HD2 PRO 106 -15.807 -13.175 23.773 775 HD3 PRO 106 HD1 PRO 106 -16.326 -12.220 22.343 776 H GLY 107 HN GLY 107 -16.875 -8.551 26.475 777 HA2 GLY 107 HA2 GLY 107 -17.057 -8.399 28.764 778 HA3 GLY 107 HA1 GLY 107 -17.522 -10.115 28.810 779 H PHE 108 HN PHE 108 -15.048 -10.839 27.282 780 HA PHE 108 HA PHE 108 -13.084 -11.886 27.887 781 HB2 PHE 108 HB2 PHE 108 -12.474 -9.453 27.365 782 HB3 PHE 108 HB1 PHE 108 -12.368 -9.227 29.147 783 HD1 PHE 108 HD1 PHE 108 -10.481 -9.990 30.352 784 HD2 PHE 108 HD2 PHE 108 -10.940 -11.052 26.253 785 HE1 PHE 108 HE1 PHE 108 -8.167 -10.811 30.310 786 HE2 PHE 108 HE2 PHE 108 -8.628 -11.878 26.207 787 HZ PHE 108 HZ PHE 108 -7.247 -11.785 28.268 788 H GLU 109 HN GLU 109 -14.490 -13.096 29.476 789 HA GLU 109 HA GLU 109 -13.002 -13.429 31.838 790 HB2 GLU 109 HB2 GLU 109 -14.597 -12.866 33.528 791 HB3 GLU 109 HB1 GLU 109 -14.479 -11.449 32.500 792 HG2 GLU 109 HG2 GLU 109 -16.595 -11.760 31.621 793 HG3 GLU 109 HG1 GLU 109 -16.640 -13.466 32.067 Start of MODEL 19 1 H1 GLY 1 HT1 GLY 1 -40.002 9.518 -6.398 2 H2 GLY 1 HT2 GLY 1 -39.317 8.523 -7.581 3 H3 GLY 1 HT3 GLY 1 -38.328 9.238 -6.403 4 HA2 GLY 1 HA1 GLY 1 -40.391 7.148 -5.972 5 HA3 GLY 1 HA2 GLY 1 -38.649 6.933 -5.868 6 H SER 2 HN SER 2 -39.399 6.104 -3.696 7 HA SER 2 HA SER 2 -39.661 8.352 -1.807 8 HB2 SER 2 HB2 SER 2 -41.574 6.685 -1.901 9 HB3 SER 2 HB1 SER 2 -40.447 5.483 -1.272 10 HG SER 2 HG SER 2 -40.598 7.912 0.094 11 H HIS 3 HN HIS 3 -38.275 5.126 -2.271 12 HA HIS 3 HA HIS 3 -36.138 5.862 -0.385 13 HB2 HIS 3 HB2 HIS 3 -37.247 3.177 -1.206 14 HB3 HIS 3 HB1 HIS 3 -35.645 3.323 -0.492 15 HD1 HIS 3 HD1 HIS 3 -36.754 1.791 1.426 16 HD2 HIS 3 HD2 HIS 3 -38.162 5.692 1.159 17 HE1 HIS 3 HE1 HIS 3 -37.888 2.245 3.619 18 HE2 HIS 3 HE2 HIS 3 -38.792 4.592 3.422 19 H MET 4 HN MET 4 -33.917 5.461 -1.096 20 HA MET 4 HA MET 4 -33.749 5.441 -4.040 21 HB2 MET 4 HB2 MET 4 -31.842 6.759 -2.084 22 HB3 MET 4 HB1 MET 4 -31.687 6.773 -3.830 23 HG2 MET 4 HG2 MET 4 -33.935 8.013 -2.263 24 HG3 MET 4 HG1 MET 4 -32.574 8.876 -2.975 25 HE1 MET 4 HE1 MET 4 -33.210 8.246 -6.813 26 HE2 MET 4 HE2 MET 4 -32.271 7.215 -5.732 27 HE3 MET 4 HE3 MET 4 -32.132 8.968 -5.622 28 H GLN 5 HN GLN 5 -32.405 3.990 -5.009 29 HA GLN 5 HA GLN 5 -31.297 1.908 -3.380 30 HB2 GLN 5 HB2 GLN 5 -32.294 1.387 -5.550 31 HB3 GLN 5 HB1 GLN 5 -31.105 2.401 -6.358 32 HG2 GLN 5 HG2 GLN 5 -29.343 0.880 -5.366 33 HG3 GLN 5 HG1 GLN 5 -30.665 -0.206 -4.940 34 HE21 GLN 5 HE21 GLN 5 -28.788 1.193 -7.501 35 HE22 GLN 5 HE22 GLN 5 -29.324 0.086 -8.758 36 H TYR 6 HN TYR 6 -29.374 2.076 -2.404 37 HA TYR 6 HA TYR 6 -27.315 3.707 -3.725 38 HB2 TYR 6 HB2 TYR 6 -27.597 2.867 -0.807 39 HB3 TYR 6 HB1 TYR 6 -26.105 3.562 -1.436 40 HD1 TYR 6 HD1 TYR 6 -25.965 5.916 -1.968 41 HD2 TYR 6 HD2 TYR 6 -29.669 4.234 -0.686 42 HE1 TYR 6 HE1 TYR 6 -26.859 8.176 -1.593 43 HE2 TYR 6 HE2 TYR 6 -30.562 6.494 -0.314 44 HH TYR 6 HH TYR 6 -28.859 9.348 -1.353 45 H LYS 7 HN LYS 7 -25.158 2.831 -3.899 46 HA LYS 7 HA LYS 7 -25.317 -0.099 -4.300 47 HB2 LYS 7 HB2 LYS 7 -25.384 1.417 -6.411 48 HB3 LYS 7 HB1 LYS 7 -23.714 1.781 -6.010 49 HG2 LYS 7 HG2 LYS 7 -23.098 -0.531 -6.323 50 HG3 LYS 7 HG1 LYS 7 -24.789 -0.974 -6.586 51 HD2 LYS 7 HD2 LYS 7 -24.831 0.543 -8.550 52 HD3 LYS 7 HD1 LYS 7 -23.106 0.838 -8.315 53 HE2 LYS 7 HE2 LYS 7 -24.413 -1.809 -8.922 54 HE3 LYS 7 HE1 LYS 7 -23.439 -0.845 -10.029 55 HZ1 LYS 7 HZ1 LYS 7 -22.118 -2.617 -9.108 56 HZ2 LYS 7 HZ2 LYS 7 -22.503 -2.137 -7.529 57 HZ3 LYS 7 HZ3 LYS 7 -21.553 -1.137 -8.506 58 H LEU 8 HN LEU 8 -23.572 -1.312 -3.618 59 HA LEU 8 HA LEU 8 -21.159 0.217 -2.846 60 HB2 LEU 8 HB2 LEU 8 -22.428 -0.768 -0.876 61 HB3 LEU 8 HB1 LEU 8 -22.060 -2.345 -1.526 62 HG LEU 8 HG LEU 8 -19.614 -1.750 -1.330 63 HD11 LEU 8 HD11 LEU 8 -19.213 0.004 0.504 64 HD12 LEU 8 HD12 LEU 8 -20.803 0.630 0.051 65 HD13 LEU 8 HD13 LEU 8 -19.504 0.566 -1.138 66 HD21 LEU 8 HD21 LEU 8 -21.458 -2.016 0.998 67 HD22 LEU 8 HD22 LEU 8 -19.701 -2.039 1.191 68 HD23 LEU 8 HD23 LEU 8 -20.500 -3.262 0.198 69 H ILE 9 HN ILE 9 -19.195 -0.629 -3.345 70 HA ILE 9 HA ILE 9 -19.112 -3.184 -4.796 71 HB ILE 9 HB ILE 9 -17.712 -0.623 -5.637 72 HG12 ILE 9 HG12 ILE 9 -19.761 -2.315 -7.143 73 HG13 ILE 9 HG11 ILE 9 -20.160 -0.788 -6.274 74 HG21 ILE 9 HG21 ILE 9 -16.260 -2.552 -5.920 75 HG22 ILE 9 HG22 ILE 9 -16.803 -1.960 -7.491 76 HG23 ILE 9 HG23 ILE 9 -17.531 -3.408 -6.795 77 HD11 ILE 9 HD11 ILE 9 -19.906 -0.399 -8.663 78 HD12 ILE 9 HD12 ILE 9 -18.288 -1.102 -8.641 79 HD13 ILE 9 HD13 ILE 9 -18.605 0.404 -7.780 80 H LEU 10 HN LEU 10 -17.772 -4.518 -3.724 81 HA LEU 10 HA LEU 10 -15.794 -3.305 -1.940 82 HB2 LEU 10 HB2 LEU 10 -16.495 -6.230 -2.122 83 HB3 LEU 10 HB1 LEU 10 -15.450 -5.484 -0.944 84 HG LEU 10 HG LEU 10 -17.401 -5.935 0.218 85 HD11 LEU 10 HD11 LEU 10 -17.846 -3.100 -0.612 86 HD12 LEU 10 HD12 LEU 10 -16.596 -3.630 0.524 87 HD13 LEU 10 HD13 LEU 10 -18.298 -3.875 0.915 88 HD21 LEU 10 HD21 LEU 10 -19.606 -5.739 -0.523 89 HD22 LEU 10 HD22 LEU 10 -18.732 -6.361 -1.920 90 HD23 LEU 10 HD23 LEU 10 -19.164 -4.653 -1.832 91 H ASN 11 HN ASN 11 -13.931 -2.892 -2.850 92 HA ASN 11 HA ASN 11 -12.960 -4.794 -4.887 93 HB2 ASN 11 HB2 ASN 11 -13.285 -2.282 -5.412 94 HB3 ASN 11 HB1 ASN 11 -11.874 -2.020 -4.396 95 HD21 ASN 11 HD21 ASN 11 -12.343 -1.570 -7.250 96 HD22 ASN 11 HD22 ASN 11 -11.087 -2.424 -8.074 97 H GLY 12 HN GLY 12 -12.257 -6.249 -3.303 98 HA2 GLY 12 HA2 GLY 12 -9.651 -5.505 -2.195 99 HA3 GLY 12 HA1 GLY 12 -10.873 -6.125 -1.065 100 H LYS 13 HN LYS 13 -8.285 -7.169 -1.963 101 HA LYS 13 HA LYS 13 -8.382 -9.225 -3.785 102 HB2 LYS 13 HB2 LYS 13 -6.666 -9.020 -1.296 103 HB3 LYS 13 HB1 LYS 13 -6.332 -10.049 -2.692 104 HG2 LYS 13 HG2 LYS 13 -5.975 -8.183 -4.098 105 HG3 LYS 13 HG1 LYS 13 -6.643 -7.068 -2.909 106 HD2 LYS 13 HD2 LYS 13 -4.734 -7.648 -1.410 107 HD3 LYS 13 HD1 LYS 13 -4.041 -8.575 -2.744 108 HE2 LYS 13 HE2 LYS 13 -3.901 -6.606 -4.118 109 HE3 LYS 13 HE1 LYS 13 -4.779 -5.660 -2.918 110 HZ1 LYS 13 HZ1 LYS 13 -2.902 -6.065 -1.375 111 HZ2 LYS 13 HZ2 LYS 13 -2.483 -5.155 -2.747 112 HZ3 LYS 13 HZ3 LYS 13 -2.049 -6.793 -2.654 113 H THR 14 HN THR 14 -9.599 -9.250 -0.507 114 HA THR 14 HA THR 14 -9.935 -12.164 -0.675 115 HB THR 14 HB THR 14 -10.692 -10.385 1.651 116 HG1 THR 14 HG1 THR 14 -8.663 -10.571 2.372 117 HG21 THR 14 HG21 THR 14 -11.710 -12.626 1.639 118 HG22 THR 14 HG22 THR 14 -10.525 -12.467 2.937 119 HG23 THR 14 HG23 THR 14 -10.111 -13.347 1.467 120 H LEU 15 HN LEU 15 -11.836 -9.175 -0.483 121 HA LEU 15 HA LEU 15 -14.216 -10.737 -1.184 122 HB2 LEU 15 HB2 LEU 15 -13.842 -8.544 0.788 123 HB3 LEU 15 HB1 LEU 15 -15.340 -8.574 -0.099 124 HG LEU 15 HG LEU 15 -15.765 -9.661 1.941 125 HD11 LEU 15 HD11 LEU 15 -16.271 -11.960 1.268 126 HD12 LEU 15 HD12 LEU 15 -15.254 -11.750 -0.159 127 HD13 LEU 15 HD13 LEU 15 -16.715 -10.782 0.033 128 HD21 LEU 15 HD21 LEU 15 -14.416 -11.465 2.849 129 HD22 LEU 15 HD22 LEU 15 -13.428 -10.024 2.610 130 HD23 LEU 15 HD23 LEU 15 -13.319 -11.367 1.471 131 H LYS 16 HN LYS 16 -14.222 -10.397 -3.375 132 HA LYS 16 HA LYS 16 -14.512 -7.590 -4.233 133 HB2 LYS 16 HB2 LYS 16 -13.922 -9.959 -6.033 134 HB3 LYS 16 HB1 LYS 16 -13.940 -8.270 -6.495 135 HG2 LYS 16 HG2 LYS 16 -11.745 -8.364 -6.278 136 HG3 LYS 16 HG1 LYS 16 -11.971 -8.372 -4.522 137 HD2 LYS 16 HD2 LYS 16 -11.989 -10.795 -4.575 138 HD3 LYS 16 HD1 LYS 16 -11.884 -10.737 -6.331 139 HE2 LYS 16 HE2 LYS 16 -9.788 -9.556 -4.555 140 HE3 LYS 16 HE1 LYS 16 -9.722 -11.217 -5.143 141 HZ1 LYS 16 HZ1 LYS 16 -9.802 -8.778 -6.839 142 HZ2 LYS 16 HZ2 LYS 16 -9.759 -10.373 -7.408 143 HZ3 LYS 16 HZ3 LYS 16 -8.439 -9.742 -6.550 144 H GLY 17 HN GLY 17 -16.540 -7.019 -4.683 145 HA2 GLY 17 HA2 GLY 17 -18.396 -8.466 -6.113 146 HA3 GLY 17 HA1 GLY 17 -18.679 -8.882 -4.427 147 H GLU 18 HN GLU 18 -20.818 -7.855 -4.987 148 HA GLU 18 HA GLU 18 -20.670 -5.017 -4.279 149 HB2 GLU 18 HB2 GLU 18 -22.555 -6.052 -6.401 150 HB3 GLU 18 HB1 GLU 18 -22.313 -4.384 -5.916 151 HG2 GLU 18 HG2 GLU 18 -20.052 -4.452 -6.869 152 HG3 GLU 18 HG1 GLU 18 -20.337 -6.115 -7.390 153 H THR 19 HN THR 19 -22.973 -4.196 -3.865 154 HA THR 19 HA THR 19 -25.015 -6.013 -3.149 155 HB THR 19 HB THR 19 -23.492 -6.516 -1.270 156 HG1 THR 19 HG1 THR 19 -25.330 -6.782 -0.283 157 HG21 THR 19 HG21 THR 19 -23.121 -4.774 0.476 158 HG22 THR 19 HG22 THR 19 -23.828 -3.575 -0.608 159 HG23 THR 19 HG23 THR 19 -22.320 -4.381 -1.050 160 H THR 20 HN THR 20 -26.871 -4.878 -2.226 161 HA THR 20 HA THR 20 -26.759 -1.970 -2.623 162 HB THR 20 HB THR 20 -29.209 -2.351 -3.523 163 HG1 THR 20 HG1 THR 20 -27.991 -4.758 -4.438 164 HG21 THR 20 HG21 THR 20 -28.321 -2.590 -5.868 165 HG22 THR 20 HG22 THR 20 -26.719 -2.831 -5.175 166 HG23 THR 20 HG23 THR 20 -27.569 -1.302 -4.932 167 H THR 21 HN THR 21 -28.582 -0.817 -1.606 168 HA THR 21 HA THR 21 -30.147 -2.281 0.335 169 HB THR 21 HB THR 21 -27.975 -1.799 1.545 170 HG1 THR 21 HG1 THR 21 -30.025 -0.332 2.814 171 HG21 THR 21 HG21 THR 21 -28.948 1.070 1.259 172 HG22 THR 21 HG22 THR 21 -27.414 0.421 0.674 173 HG23 THR 21 HG23 THR 21 -27.712 0.560 2.409 174 H GLU 22 HN GLU 22 -31.952 -1.100 1.086 175 HA GLU 22 HA GLU 22 -32.614 1.186 -0.636 176 HB2 GLU 22 HB2 GLU 22 -34.561 0.118 1.365 177 HB3 GLU 22 HB1 GLU 22 -34.857 0.649 -0.281 178 HG2 GLU 22 HG2 GLU 22 -35.275 -1.600 -0.451 179 HG3 GLU 22 HG1 GLU 22 -33.536 -1.543 -0.911 180 H ALA 23 HN ALA 23 -32.022 3.156 0.164 181 HA ALA 23 HA ALA 23 -32.703 3.729 2.981 182 HB1 ALA 23 HB1 ALA 23 -30.017 4.440 1.771 183 HB2 ALA 23 HB2 ALA 23 -30.284 3.115 2.899 184 HB3 ALA 23 HB3 ALA 23 -30.551 4.780 3.416 185 H VAL 24 HN VAL 24 -32.835 6.116 3.374 186 HA VAL 24 HA VAL 24 -33.664 7.492 0.988 187 HB VAL 24 HB VAL 24 -35.263 7.664 2.679 188 HG11 VAL 24 HG11 VAL 24 -34.746 8.360 5.000 189 HG12 VAL 24 HG12 VAL 24 -33.029 8.263 4.613 190 HG13 VAL 24 HG13 VAL 24 -34.032 6.812 4.555 191 HG21 VAL 24 HG21 VAL 24 -34.808 9.806 1.681 192 HG22 VAL 24 HG22 VAL 24 -33.572 10.122 2.895 193 HG23 VAL 24 HG23 VAL 24 -35.264 10.004 3.374 194 H ASP 25 HN ASP 25 -31.307 7.970 3.637 195 HA ASP 25 HA ASP 25 -30.226 10.259 2.133 196 HB2 ASP 25 HB2 ASP 25 -29.646 9.549 5.030 197 HB3 ASP 25 HB1 ASP 25 -29.073 10.966 4.166 198 H ALA 26 HN ALA 26 -27.911 10.469 1.977 199 HA ALA 26 HA ALA 26 -26.672 8.023 1.193 200 HB1 ALA 26 HB1 ALA 26 -24.747 9.453 0.636 201 HB2 ALA 26 HB2 ALA 26 -25.523 10.808 1.456 202 HB3 ALA 26 HB3 ALA 26 -26.258 10.121 0.008 203 H ALA 27 HN ALA 27 -26.227 10.301 3.873 204 HA ALA 27 HA ALA 27 -24.007 9.090 5.073 205 HB1 ALA 27 HB1 ALA 27 -26.242 10.678 6.328 206 HB2 ALA 27 HB2 ALA 27 -24.714 11.306 5.711 207 HB3 ALA 27 HB3 ALA 27 -24.730 10.264 7.134 208 H THR 28 HN THR 28 -27.447 8.412 5.340 209 HA THR 28 HA THR 28 -27.264 6.551 7.483 210 HB THR 28 HB THR 28 -29.413 6.500 5.368 211 HG1 THR 28 HG1 THR 28 -29.894 8.118 7.541 212 HG21 THR 28 HG21 THR 28 -30.845 5.932 7.285 213 HG22 THR 28 HG22 THR 28 -29.450 6.048 8.358 214 HG23 THR 28 HG23 THR 28 -29.509 4.786 7.128 215 H ALA 29 HN ALA 29 -26.868 6.358 4.027 216 HA ALA 29 HA ALA 29 -27.121 3.503 3.842 217 HB1 ALA 29 HB1 ALA 29 -25.971 5.506 1.898 218 HB2 ALA 29 HB2 ALA 29 -27.642 4.944 1.942 219 HB3 ALA 29 HB3 ALA 29 -26.343 3.819 1.538 220 H GLU 30 HN GLU 30 -24.551 5.841 4.275 221 HA GLU 30 HA GLU 30 -22.360 4.143 3.805 222 HB2 GLU 30 HB2 GLU 30 -22.490 6.758 4.216 223 HB3 GLU 30 HB1 GLU 30 -22.238 6.290 5.887 224 HG2 GLU 30 HG2 GLU 30 -20.177 5.106 5.209 225 HG3 GLU 30 HG1 GLU 30 -20.404 5.742 3.579 226 H LYS 31 HN LYS 31 -23.852 5.153 6.876 227 HA LYS 31 HA LYS 31 -22.552 3.704 8.730 228 HB2 LYS 31 HB2 LYS 31 -25.546 4.026 8.636 229 HB3 LYS 31 HB1 LYS 31 -24.636 3.565 10.049 230 HG2 LYS 31 HG2 LYS 31 -23.597 5.742 10.087 231 HG3 LYS 31 HG1 LYS 31 -24.443 6.194 8.608 232 HD2 LYS 31 HD2 LYS 31 -26.576 5.909 9.709 233 HD3 LYS 31 HD1 LYS 31 -25.776 5.355 11.177 234 HE2 LYS 31 HE2 LYS 31 -24.688 7.557 11.376 235 HE3 LYS 31 HE1 LYS 31 -25.584 8.106 9.959 236 HZ1 LYS 31 HZ1 LYS 31 -27.656 7.730 11.147 237 HZ2 LYS 31 HZ2 LYS 31 -26.662 8.770 12.036 238 HZ3 LYS 31 HZ3 LYS 31 -26.811 7.146 12.497 239 H VAL 32 HN VAL 32 -25.106 2.373 6.644 240 HA VAL 32 HA VAL 32 -25.317 -0.092 8.078 241 HB VAL 32 HB VAL 32 -26.182 0.534 5.243 242 HG11 VAL 32 HG11 VAL 32 -27.685 -1.356 5.470 243 HG12 VAL 32 HG12 VAL 32 -27.091 -1.664 7.100 244 HG13 VAL 32 HG13 VAL 32 -26.018 -1.877 5.716 245 HG21 VAL 32 HG21 VAL 32 -27.186 2.045 6.895 246 HG22 VAL 32 HG22 VAL 32 -27.768 0.650 7.805 247 HG23 VAL 32 HG23 VAL 32 -28.380 0.961 6.181 248 H PHE 33 HN PHE 33 -23.714 0.882 5.059 249 HA PHE 33 HA PHE 33 -22.707 -1.743 4.551 250 HB2 PHE 33 HB2 PHE 33 -22.076 0.958 3.403 251 HB3 PHE 33 HB1 PHE 33 -21.195 -0.475 2.923 252 HD1 PHE 33 HD1 PHE 33 -23.442 -2.455 2.882 253 HD2 PHE 33 HD2 PHE 33 -23.210 1.553 1.459 254 HE1 PHE 33 HE1 PHE 33 -25.174 -2.951 1.203 255 HE2 PHE 33 HE2 PHE 33 -24.943 1.060 -0.215 256 HZ PHE 33 HZ PHE 33 -25.925 -1.192 -0.348 257 H LYS 34 HN LYS 34 -21.717 0.753 6.651 258 HA LYS 34 HA LYS 34 -18.919 0.217 6.606 259 HB2 LYS 34 HB2 LYS 34 -20.656 1.484 8.757 260 HB3 LYS 34 HB1 LYS 34 -18.912 1.499 8.776 261 HG2 LYS 34 HG2 LYS 34 -19.548 2.524 6.321 262 HG3 LYS 34 HG1 LYS 34 -20.695 3.256 7.463 263 HD2 LYS 34 HD2 LYS 34 -18.744 4.576 7.465 264 HD3 LYS 34 HD1 LYS 34 -18.734 3.686 8.967 265 HE2 LYS 34 HE2 LYS 34 -17.174 2.076 8.028 266 HE3 LYS 34 HE1 LYS 34 -17.246 2.887 6.469 267 HZ1 LYS 34 HZ1 LYS 34 -16.163 4.778 7.355 268 HZ2 LYS 34 HZ2 LYS 34 -15.253 3.419 7.809 269 HZ3 LYS 34 HZ3 LYS 34 -16.256 4.185 8.941 270 H GLN 35 HN GLN 35 -21.673 -0.888 8.487 271 HA GLN 35 HA GLN 35 -20.243 -2.601 10.250 272 HB2 GLN 35 HB2 GLN 35 -22.788 -1.699 10.148 273 HB3 GLN 35 HB1 GLN 35 -23.024 -3.265 9.422 274 HG2 GLN 35 HG2 GLN 35 -23.480 -3.331 11.809 275 HG3 GLN 35 HG1 GLN 35 -22.145 -4.391 11.369 276 HE21 GLN 35 HE21 GLN 35 -22.843 -3.246 13.948 277 HE22 GLN 35 HE22 GLN 35 -21.462 -2.340 14.464 278 H TYR 36 HN TYR 36 -21.924 -2.930 7.229 279 HA TYR 36 HA TYR 36 -21.642 -5.675 6.771 280 HB2 TYR 36 HB2 TYR 36 -23.116 -4.390 5.398 281 HB3 TYR 36 HB1 TYR 36 -21.812 -3.338 4.869 282 HD1 TYR 36 HD1 TYR 36 -20.474 -3.908 2.984 283 HD2 TYR 36 HD2 TYR 36 -23.165 -6.748 4.626 284 HE1 TYR 36 HE1 TYR 36 -20.128 -5.352 1.023 285 HE2 TYR 36 HE2 TYR 36 -22.828 -8.210 2.693 286 HH TYR 36 HH TYR 36 -20.371 -7.565 0.304 287 H ALA 37 HN ALA 37 -19.520 -3.045 5.572 288 HA ALA 37 HA ALA 37 -17.603 -4.824 4.471 289 HB1 ALA 37 HB1 ALA 37 -16.139 -2.834 4.345 290 HB2 ALA 37 HB2 ALA 37 -17.320 -1.928 5.293 291 HB3 ALA 37 HB3 ALA 37 -17.754 -2.537 3.693 292 H ASN 38 HN ASN 38 -18.168 -3.577 7.652 293 HA ASN 38 HA ASN 38 -15.597 -4.127 8.778 294 HB2 ASN 38 HB2 ASN 38 -17.258 -2.561 9.825 295 HB3 ASN 38 HB1 ASN 38 -18.283 -3.945 10.192 296 HD21 ASN 38 HD21 ASN 38 -17.702 -5.353 11.860 297 HD22 ASN 38 HD22 ASN 38 -16.432 -4.952 13.033 298 H ASP 39 HN ASP 39 -18.512 -5.929 8.237 299 HA ASP 39 HA ASP 39 -18.031 -8.157 9.886 300 HB2 ASP 39 HB2 ASP 39 -20.227 -7.640 8.910 301 HB3 ASP 39 HB1 ASP 39 -19.595 -7.971 7.302 302 H ASN 40 HN ASN 40 -17.067 -7.420 6.569 303 HA ASN 40 HA ASN 40 -15.751 -10.021 6.372 304 HB2 ASN 40 HB2 ASN 40 -15.195 -9.059 3.987 305 HB3 ASN 40 HB1 ASN 40 -16.783 -9.724 4.344 306 HD21 ASN 40 HD21 ASN 40 -18.565 -8.422 4.310 307 HD22 ASN 40 HD22 ASN 40 -18.494 -6.722 3.790 308 H GLY 41 HN GLY 41 -15.027 -6.756 7.096 309 HA2 GLY 41 HA2 GLY 41 -13.036 -6.066 8.101 310 HA3 GLY 41 HA1 GLY 41 -12.274 -7.547 7.557 311 H VAL 42 HN VAL 42 -14.023 -5.327 5.452 312 HA VAL 42 HA VAL 42 -11.532 -4.914 3.991 313 HB VAL 42 HB VAL 42 -14.402 -4.386 3.161 314 HG11 VAL 42 HG11 VAL 42 -11.820 -4.047 1.629 315 HG12 VAL 42 HG12 VAL 42 -12.896 -2.758 2.161 316 HG13 VAL 42 HG13 VAL 42 -13.438 -3.910 0.939 317 HG21 VAL 42 HG21 VAL 42 -13.868 -6.738 3.250 318 HG22 VAL 42 HG22 VAL 42 -12.385 -6.468 2.329 319 HG23 VAL 42 HG23 VAL 42 -13.956 -6.220 1.566 320 H ASP 43 HN ASP 43 -10.444 -3.181 4.363 321 HA ASP 43 HA ASP 43 -11.858 -0.683 5.031 322 HB2 ASP 43 HB2 ASP 43 -10.815 -1.530 7.122 323 HB3 ASP 43 HB1 ASP 43 -9.256 -1.610 6.314 324 H GLY 44 HN GLY 44 -11.174 1.092 3.894 325 HA2 GLY 44 HA2 GLY 44 -8.692 1.485 2.728 326 HA3 GLY 44 HA1 GLY 44 -9.707 0.692 1.527 327 H GLU 45 HN GLU 45 -9.188 2.876 0.479 328 HA GLU 45 HA GLU 45 -10.403 5.241 1.384 329 HB2 GLU 45 HB2 GLU 45 -9.725 4.284 -1.394 330 HB3 GLU 45 HB1 GLU 45 -10.455 5.853 -1.096 331 HG2 GLU 45 HG2 GLU 45 -8.150 6.217 -1.311 332 HG3 GLU 45 HG1 GLU 45 -8.510 6.357 0.407 333 H TRP 46 HN TRP 46 -12.410 6.036 1.277 334 HA TRP 46 HA TRP 46 -14.492 4.230 0.226 335 HB2 TRP 46 HB2 TRP 46 -14.460 6.095 2.565 336 HB3 TRP 46 HB1 TRP 46 -15.964 5.962 1.681 337 HD1 TRP 46 HD1 TRP 46 -13.377 3.563 3.294 338 HE1 TRP 46 HE1 TRP 46 -14.636 1.602 4.373 339 HE3 TRP 46 HE3 TRP 46 -18.210 4.807 1.985 340 HZ2 TRP 46 HZ2 TRP 46 -17.281 0.702 4.651 341 HZ3 TRP 46 HZ3 TRP 46 -20.026 3.328 2.717 342 HH2 TRP 46 HH2 TRP 46 -19.570 1.317 4.016 343 H THR 47 HN THR 47 -14.912 4.792 -1.807 344 HA THR 47 HA THR 47 -14.919 7.625 -2.525 345 HB THR 47 HB THR 47 -15.087 6.626 -4.908 346 HG1 THR 47 HG1 THR 47 -13.893 4.368 -3.713 347 HG21 THR 47 HG21 THR 47 -13.074 7.695 -3.965 348 HG22 THR 47 HG22 THR 47 -12.676 6.342 -5.024 349 HG23 THR 47 HG23 THR 47 -12.593 6.143 -3.275 350 H TYR 48 HN TYR 48 -16.611 8.421 -3.931 351 HA TYR 48 HA TYR 48 -19.122 7.004 -3.997 352 HB2 TYR 48 HB2 TYR 48 -19.503 7.895 -1.844 353 HB3 TYR 48 HB1 TYR 48 -18.701 9.407 -2.196 354 HD1 TYR 48 HD1 TYR 48 -19.903 11.202 -3.350 355 HD2 TYR 48 HD2 TYR 48 -21.855 7.503 -2.476 356 HE1 TYR 48 HE1 TYR 48 -22.081 12.221 -3.845 357 HE2 TYR 48 HE2 TYR 48 -24.020 8.525 -2.980 358 HH TYR 48 HH TYR 48 -25.084 10.620 -3.182 359 H ASP 49 HN ASP 49 -20.607 7.983 -5.494 360 HA ASP 49 HA ASP 49 -19.329 10.133 -7.091 361 HB2 ASP 49 HB2 ASP 49 -19.805 9.094 -9.158 362 HB3 ASP 49 HB1 ASP 49 -19.299 7.728 -8.184 363 H ASP 50 HN ASP 50 -20.865 11.527 -8.184 364 HA ASP 50 HA ASP 50 -23.209 11.885 -6.455 365 HB2 ASP 50 HB2 ASP 50 -21.725 13.829 -6.838 366 HB3 ASP 50 HB1 ASP 50 -21.981 13.688 -8.570 367 H ALA 51 HN ALA 51 -22.528 10.544 -9.500 368 HA ALA 51 HA ALA 51 -25.046 11.314 -10.683 369 HB1 ALA 51 HB1 ALA 51 -24.322 9.999 -12.623 370 HB2 ALA 51 HB2 ALA 51 -22.898 9.470 -11.728 371 HB3 ALA 51 HB3 ALA 51 -23.108 11.172 -12.119 372 H THR 52 HN THR 52 -23.625 8.274 -9.429 373 HA THR 52 HA THR 52 -26.319 7.118 -9.669 374 HB THR 52 HB THR 52 -25.065 4.888 -9.638 375 HG1 THR 52 HG1 THR 52 -22.951 6.724 -9.736 376 HG21 THR 52 HG21 THR 52 -26.105 5.756 -11.657 377 HG22 THR 52 HG22 THR 52 -24.537 5.050 -12.054 378 HG23 THR 52 HG23 THR 52 -24.713 6.803 -11.950 379 H LYS 53 HN LYS 53 -24.290 8.285 -7.332 380 HA LYS 53 HA LYS 53 -24.119 8.045 -5.054 381 HB2 LYS 53 HB2 LYS 53 -26.836 6.819 -5.521 382 HB3 LYS 53 HB1 LYS 53 -26.127 6.912 -3.915 383 HG2 LYS 53 HG2 LYS 53 -27.622 8.768 -4.261 384 HG3 LYS 53 HG1 LYS 53 -25.962 9.349 -4.132 385 HD2 LYS 53 HD2 LYS 53 -25.954 9.261 -6.705 386 HD3 LYS 53 HD1 LYS 53 -27.710 9.150 -6.561 387 HE2 LYS 53 HE2 LYS 53 -25.997 11.349 -5.412 388 HE3 LYS 53 HE1 LYS 53 -26.938 11.463 -6.897 389 HZ1 LYS 53 HZ1 LYS 53 -28.135 12.465 -5.113 390 HZ2 LYS 53 HZ2 LYS 53 -28.002 11.072 -4.159 391 HZ3 LYS 53 HZ3 LYS 53 -28.941 11.044 -5.569 392 H THR 54 HN THR 54 -22.712 6.305 -6.558 393 HA THR 54 HA THR 54 -23.019 3.663 -5.378 394 HB THR 54 HB THR 54 -20.989 4.609 -7.443 395 HG1 THR 54 HG1 THR 54 -22.889 4.799 -8.490 396 HG21 THR 54 HG21 THR 54 -20.679 2.365 -6.100 397 HG22 THR 54 HG22 THR 54 -20.538 2.321 -7.859 398 HG23 THR 54 HG23 THR 54 -22.036 1.791 -7.083 399 H TYR 55 HN TYR 55 -21.847 3.014 -3.677 400 HA TYR 55 HA TYR 55 -19.615 4.712 -2.770 401 HB2 TYR 55 HB2 TYR 55 -21.455 2.837 -1.264 402 HB3 TYR 55 HB1 TYR 55 -19.894 3.293 -0.606 403 HD1 TYR 55 HD1 TYR 55 -23.141 4.725 -1.781 404 HD2 TYR 55 HD2 TYR 55 -19.644 5.262 0.585 405 HE1 TYR 55 HE1 TYR 55 -24.131 6.731 -0.782 406 HE2 TYR 55 HE2 TYR 55 -20.627 7.281 1.586 407 HH TYR 55 HH TYR 55 -22.301 8.878 1.248 408 H THR 56 HN THR 56 -17.585 3.880 -2.814 409 HA THR 56 HA THR 56 -17.322 0.984 -3.297 410 HB THR 56 HB THR 56 -15.844 3.187 -4.756 411 HG1 THR 56 HG1 THR 56 -18.103 2.395 -5.317 412 HG21 THR 56 HG21 THR 56 -14.781 1.320 -6.039 413 HG22 THR 56 HG22 THR 56 -15.475 0.178 -4.888 414 HG23 THR 56 HG23 THR 56 -14.290 1.361 -4.343 415 H VAL 57 HN VAL 57 -15.831 -0.036 -2.118 416 HA VAL 57 HA VAL 57 -13.913 1.630 -0.621 417 HB VAL 57 HB VAL 57 -15.569 0.607 0.945 418 HG11 VAL 57 HG11 VAL 57 -16.184 -1.439 -0.126 419 HG12 VAL 57 HG12 VAL 57 -15.395 -1.847 1.393 420 HG13 VAL 57 HG13 VAL 57 -14.512 -2.006 -0.120 421 HG21 VAL 57 HG21 VAL 57 -13.325 1.108 1.723 422 HG22 VAL 57 HG22 VAL 57 -12.761 -0.470 1.174 423 HG23 VAL 57 HG23 VAL 57 -13.925 -0.361 2.493 424 H THR 58 HN THR 58 -11.917 1.352 -1.251 425 HA THR 58 HA THR 58 -11.261 -1.097 -2.750 426 HB THR 58 HB THR 58 -9.871 1.574 -2.991 427 HG1 THR 58 HG1 THR 58 -12.319 1.096 -3.687 428 HG21 THR 58 HG21 THR 58 -8.607 -0.376 -3.781 429 HG22 THR 58 HG22 THR 58 -9.096 0.652 -5.127 430 HG23 THR 58 HG23 THR 58 -9.969 -0.846 -4.798 431 H GLU 59 HN GLU 59 -9.572 -2.313 -2.131 432 HA GLU 59 HA GLU 59 -8.185 -1.526 0.313 433 HB2 GLU 59 HB2 GLU 59 -7.998 -4.151 -1.183 434 HB3 GLU 59 HB1 GLU 59 -7.370 -3.827 0.412 435 HG2 GLU 59 HG2 GLU 59 -9.913 -3.302 0.932 436 HG3 GLU 59 HG1 GLU 59 -10.154 -4.373 -0.448 437 H GLY 60 HN GLY 60 -5.841 -1.651 0.457 438 HA2 GLY 60 HA2 GLY 60 -3.682 -1.615 -0.471 439 HA3 GLY 60 HA1 GLY 60 -4.391 -1.589 -2.086 440 H SER 61 HN SER 61 -2.978 0.229 0.363 441 HA SER 61 HA SER 61 -3.612 2.710 -1.082 442 HB2 SER 61 HB2 SER 61 -4.877 2.297 1.186 443 HB3 SER 61 HB1 SER 61 -3.331 2.716 1.917 444 HG SER 61 HG SER 61 -5.219 4.336 0.925 445 H GLY 62 HN GLY 62 -1.461 1.050 1.225 446 HA2 GLY 62 HA2 GLY 62 0.937 1.302 0.181 447 HA3 GLY 62 HA1 GLY 62 0.657 2.981 0.610 448 H GLY 63 HN GLY 63 1.518 -0.160 1.789 449 HA2 GLY 63 HA2 GLY 63 1.530 0.849 4.549 450 HA3 GLY 63 HA1 GLY 63 1.662 -0.835 4.061 451 H ALA 64 HN ALA 64 3.464 1.734 2.558 452 HA ALA 64 HA ALA 64 5.937 0.422 3.408 453 HB1 ALA 64 HB1 ALA 64 5.480 2.429 1.201 454 HB2 ALA 64 HB2 ALA 64 5.599 0.681 0.998 455 HB3 ALA 64 HB3 ALA 64 6.996 1.602 1.554 456 H GLY 65 HN GLY 65 7.648 1.592 4.319 457 HA2 GLY 65 HA2 GLY 65 8.677 3.587 5.121 458 HA3 GLY 65 HA1 GLY 65 7.113 4.386 5.062 459 H GLY 66 HN GLY 66 7.478 1.210 6.410 460 HA2 GLY 66 HA2 GLY 66 6.415 2.099 8.921 461 HA3 GLY 66 HA1 GLY 66 6.846 0.450 8.495 462 H GLN 67 HN GLN 67 9.474 2.299 7.772 463 HA GLN 67 HA GLN 67 10.768 1.566 10.299 464 HB2 GLN 67 HB2 GLN 67 11.717 0.892 8.022 465 HB3 GLN 67 HB1 GLN 67 12.105 2.615 7.787 466 HG2 GLN 67 HG2 GLN 67 14.082 1.742 8.587 467 HG3 GLN 67 HG1 GLN 67 13.332 2.391 10.045 468 HE21 GLN 67 HE21 GLN 67 15.333 0.307 9.718 469 HE22 GLN 67 HE22 GLN 67 14.690 -1.112 10.468 470 H GLY 68 HN GLY 68 11.138 4.263 7.985 471 HA2 GLY 68 HA2 GLY 68 10.932 6.545 8.355 472 HA3 GLY 68 HA1 GLY 68 10.519 6.216 10.031 473 H MET 69 HN MET 69 12.238 5.759 11.516 474 HA MET 69 HA MET 69 14.469 7.491 11.063 475 HB2 MET 69 HB2 MET 69 15.184 6.750 13.356 476 HB3 MET 69 HB1 MET 69 13.589 7.480 13.270 477 HG2 MET 69 HG2 MET 69 12.571 5.268 13.349 478 HG3 MET 69 HG1 MET 69 14.168 4.529 13.406 479 HE1 MET 69 HE1 MET 69 15.715 6.642 15.320 480 HE2 MET 69 HE2 MET 69 15.891 4.889 15.406 481 HE3 MET 69 HE3 MET 69 15.525 5.812 16.864 482 H ILE 70 HN ILE 70 16.301 6.942 10.023 483 HA ILE 70 HA ILE 70 17.433 4.273 10.410 484 HB ILE 70 HB ILE 70 16.972 5.479 7.654 485 HG12 ILE 70 HG12 ILE 70 15.961 2.886 8.859 486 HG13 ILE 70 HG11 ILE 70 15.001 4.348 8.643 487 HG21 ILE 70 HG21 ILE 70 18.130 3.540 6.734 488 HG22 ILE 70 HG22 ILE 70 18.394 2.890 8.350 489 HG23 ILE 70 HG23 ILE 70 19.199 4.381 7.862 490 HD11 ILE 70 HD11 ILE 70 15.255 4.174 6.223 491 HD12 ILE 70 HD12 ILE 70 14.567 2.691 6.889 492 HD13 ILE 70 HD13 ILE 70 16.268 2.747 6.422 493 H GLN 71 HN GLN 71 17.722 7.552 9.247 494 HA GLN 71 HA GLN 71 20.619 7.481 9.056 495 HB2 GLN 71 HB2 GLN 71 18.602 9.714 8.732 496 HB3 GLN 71 HB1 GLN 71 20.325 9.879 8.429 497 HG2 GLN 71 HG2 GLN 71 20.240 8.637 6.499 498 HG3 GLN 71 HG1 GLN 71 18.780 7.778 6.988 499 HE21 GLN 71 HE21 GLN 71 20.065 10.746 5.680 500 HE22 GLN 71 HE22 GLN 71 18.566 11.336 5.042 501 H GLU 72 HN GLU 72 19.093 7.099 11.618 502 HA GLU 72 HA GLU 72 19.511 9.499 13.152 503 HB2 GLU 72 HB2 GLU 72 18.650 6.726 14.001 504 HB3 GLU 72 HB1 GLU 72 18.695 8.134 15.056 505 HG2 GLU 72 HG2 GLU 72 16.992 7.825 12.591 506 HG3 GLU 72 HG1 GLU 72 16.445 7.685 14.260 507 HA PRO 73 HA PRO 73 23.501 8.395 14.763 508 HB2 PRO 73 HB2 PRO 73 23.579 10.016 16.930 509 HB3 PRO 73 HB1 PRO 73 23.695 10.655 15.251 510 HG2 PRO 73 HG2 PRO 73 21.323 10.590 17.098 511 HG3 PRO 73 HG1 PRO 73 21.863 11.876 15.998 512 HD2 PRO 73 HD2 PRO 73 19.840 10.105 15.430 513 HD3 PRO 73 HD1 PRO 73 20.839 10.931 14.190 514 H ALA 74 HN ALA 74 24.382 8.132 17.175 515 HA ALA 74 HA ALA 74 24.474 6.936 19.076 516 HB1 ALA 74 HB1 ALA 74 21.472 6.763 18.913 517 HB2 ALA 74 HB2 ALA 74 22.382 8.054 19.696 518 HB3 ALA 74 HB3 ALA 74 22.466 6.409 20.327 519 H LEU 75 HN LEU 75 23.627 4.689 20.013 520 HA LEU 75 HA LEU 75 24.024 2.795 17.825 521 HB2 LEU 75 HB2 LEU 75 24.629 2.669 20.747 522 HB3 LEU 75 HB1 LEU 75 24.564 1.222 19.785 523 HG LEU 75 HG LEU 75 26.841 1.842 19.960 524 HD11 LEU 75 HD11 LEU 75 25.770 2.659 17.271 525 HD12 LEU 75 HD12 LEU 75 26.189 1.026 17.787 526 HD13 LEU 75 HD13 LEU 75 27.450 2.248 17.617 527 HD21 LEU 75 HD21 LEU 75 26.071 4.590 18.976 528 HD22 LEU 75 HD22 LEU 75 27.706 4.029 19.331 529 HD23 LEU 75 HD23 LEU 75 26.524 4.178 20.631 530 HA PRO 76 HA PRO 76 19.839 1.263 18.537 531 HB2 PRO 76 HB2 PRO 76 20.840 -1.031 16.905 532 HB3 PRO 76 HB1 PRO 76 19.428 -0.007 16.611 533 HG2 PRO 76 HG2 PRO 76 21.593 0.230 15.079 534 HG3 PRO 76 HG1 PRO 76 20.705 1.698 15.644 535 HD2 PRO 76 HD2 PRO 76 23.260 0.486 16.776 536 HD3 PRO 76 HD1 PRO 76 22.893 2.183 16.385 537 HA PRO 77 HA PRO 77 20.172 -1.604 21.898 538 HB2 PRO 77 HB2 PRO 77 18.138 -3.170 20.321 539 HB3 PRO 77 HB1 PRO 77 18.150 -2.805 22.054 540 HG2 PRO 77 HG2 PRO 77 16.609 -1.360 20.530 541 HG3 PRO 77 HG1 PRO 77 17.675 -0.533 21.691 542 HD2 PRO 77 HD2 PRO 77 18.037 -0.870 18.710 543 HD3 PRO 77 HD1 PRO 77 18.314 0.585 19.738 544 H GLY 78 HN GLY 78 21.756 -2.981 22.230 545 HA2 GLY 78 HA2 GLY 78 22.780 -5.108 22.025 546 HA3 GLY 78 HA1 GLY 78 22.105 -5.258 20.415 547 H TRP 79 HN TRP 79 23.129 -2.471 19.724 548 HA TRP 79 HA TRP 79 25.765 -3.431 18.881 549 HB2 TRP 79 HB2 TRP 79 24.163 -0.958 18.166 550 HB3 TRP 79 HB1 TRP 79 25.796 -1.228 17.586 551 HD1 TRP 79 HD1 TRP 79 22.225 -2.638 17.256 552 HE1 TRP 79 HE1 TRP 79 22.070 -3.945 15.049 553 HE3 TRP 79 HE3 TRP 79 27.156 -2.489 15.843 554 HZ2 TRP 79 HZ2 TRP 79 23.781 -4.801 12.997 555 HZ3 TRP 79 HZ3 TRP 79 27.799 -3.586 13.741 556 HH2 TRP 79 HH2 TRP 79 26.152 -4.718 12.348 557 H GLU 80 HN GLU 80 27.739 -2.599 19.537 558 HA GLU 80 HA GLU 80 27.714 -0.347 21.439 559 HB2 GLU 80 HB2 GLU 80 29.504 -2.775 21.314 560 HB3 GLU 80 HB1 GLU 80 29.911 -1.350 22.252 561 HG2 GLU 80 HG2 GLU 80 27.916 -1.666 23.610 562 HG3 GLU 80 HG1 GLU 80 27.484 -3.087 22.655 563 H MET 81 HN MET 81 29.138 1.330 21.041 564 HA MET 81 HA MET 81 30.844 1.059 18.647 565 HB2 MET 81 HB2 MET 81 29.056 2.710 18.316 566 HB3 MET 81 HB1 MET 81 29.581 3.573 19.786 567 HG2 MET 81 HG2 MET 81 31.689 4.114 18.743 568 HG3 MET 81 HG1 MET 81 31.269 3.175 17.315 569 HE1 MET 81 HE1 MET 81 28.280 5.272 15.850 570 HE2 MET 81 HE2 MET 81 28.156 3.934 16.994 571 HE3 MET 81 HE3 MET 81 29.288 3.842 15.645 572 H LYS 82 HN LYS 82 33.012 1.144 19.045 573 HA LYS 82 HA LYS 82 33.988 2.773 21.224 574 HB2 LYS 82 HB2 LYS 82 34.485 -0.231 21.220 575 HB3 LYS 82 HB1 LYS 82 35.380 0.914 22.201 576 HG2 LYS 82 HG2 LYS 82 33.470 1.482 23.474 577 HG3 LYS 82 HG1 LYS 82 32.392 0.627 22.333 578 HD2 LYS 82 HD2 LYS 82 34.474 -0.661 24.112 579 HD3 LYS 82 HD1 LYS 82 32.736 -0.630 24.410 580 HE2 LYS 82 HE2 LYS 82 32.487 -1.770 22.147 581 HE3 LYS 82 HE1 LYS 82 34.229 -2.049 22.218 582 HZ1 LYS 82 HZ1 LYS 82 33.746 -3.096 24.472 583 HZ2 LYS 82 HZ2 LYS 82 33.272 -3.970 23.105 584 HZ3 LYS 82 HZ3 LYS 82 32.114 -3.111 23.997 585 H TYR 83 HN TYR 83 36.301 3.143 21.089 586 HA TYR 83 HA TYR 83 37.292 2.691 18.333 587 HB2 TYR 83 HB2 TYR 83 37.648 5.062 20.208 588 HB3 TYR 83 HB1 TYR 83 38.690 4.809 18.786 589 HD1 TYR 83 HD1 TYR 83 38.128 5.974 16.901 590 HD2 TYR 83 HD2 TYR 83 35.013 4.941 19.612 591 HE1 TYR 83 HE1 TYR 83 36.517 7.208 15.514 592 HE2 TYR 83 HE2 TYR 83 33.395 6.158 18.225 593 HH TYR 83 HH TYR 83 34.230 7.415 15.082 594 H THR 84 HN THR 84 39.538 2.283 18.082 595 HA THR 84 HA THR 84 40.761 0.995 20.371 596 HB THR 84 HB THR 84 42.448 0.195 18.871 597 HG1 THR 84 HG1 THR 84 42.879 1.129 16.943 598 HG21 THR 84 HG21 THR 84 41.134 -0.862 17.081 599 HG22 THR 84 HG22 THR 84 39.803 0.251 17.403 600 HG23 THR 84 HG23 THR 84 40.290 -0.915 18.629 601 H SER 85 HN SER 85 43.310 1.536 20.525 602 HA SER 85 HA SER 85 43.352 4.193 21.531 603 HB2 SER 85 HB2 SER 85 45.592 2.260 21.336 604 HB3 SER 85 HB1 SER 85 45.511 3.648 22.401 605 HG SER 85 HG SER 85 44.937 1.508 23.317 606 H GLU 86 HN GLU 86 43.604 3.346 18.425 607 HA GLU 86 HA GLU 86 45.599 5.478 17.892 608 HB2 GLU 86 HB2 GLU 86 46.158 4.249 15.767 609 HB3 GLU 86 HB1 GLU 86 46.558 3.329 17.218 610 HG2 GLU 86 HG2 GLU 86 44.338 2.157 16.916 611 HG3 GLU 86 HG1 GLU 86 44.271 2.917 15.326 612 H GLY 87 HN GLY 87 42.439 4.970 17.959 613 HA2 GLY 87 HA2 GLY 87 40.874 6.503 17.110 614 HA3 GLY 87 HA1 GLY 87 41.994 6.903 15.820 615 H VAL 88 HN VAL 88 41.672 3.544 16.145 616 HA VAL 88 HA VAL 88 40.161 3.432 13.677 617 HB VAL 88 HB VAL 88 41.329 1.209 15.362 618 HG11 VAL 88 HG11 VAL 88 40.866 -0.252 13.449 619 HG12 VAL 88 HG12 VAL 88 40.012 1.073 12.657 620 HG13 VAL 88 HG13 VAL 88 39.386 0.388 14.159 621 HG21 VAL 88 HG21 VAL 88 43.003 2.602 14.286 622 HG22 VAL 88 HG22 VAL 88 42.193 2.395 12.734 623 HG23 VAL 88 HG23 VAL 88 42.940 1.010 13.529 624 H ARG 89 HN ARG 89 38.081 2.977 13.474 625 HA ARG 89 HA ARG 89 36.461 2.802 15.896 626 HB2 ARG 89 HB2 ARG 89 36.115 4.410 13.880 627 HB3 ARG 89 HB1 ARG 89 35.431 3.010 13.075 628 HG2 ARG 89 HG2 ARG 89 33.763 2.828 14.900 629 HG3 ARG 89 HG1 ARG 89 34.418 4.319 15.588 630 HD2 ARG 89 HD2 ARG 89 34.003 5.304 13.231 631 HD3 ARG 89 HD1 ARG 89 32.943 3.917 13.010 632 HE ARG 89 HE ARG 89 32.169 5.048 15.384 633 HH11 ARG 89 HH11 ARG 89 32.428 6.141 12.059 634 HH12 ARG 89 HH12 ARG 89 31.164 7.317 12.229 635 HH21 ARG 89 HH21 ARG 89 30.523 6.630 15.600 636 HH22 ARG 89 HH22 ARG 89 30.080 7.584 14.214 637 H TYR 90 HN TYR 90 35.699 0.863 16.587 638 HA TYR 90 HA TYR 90 35.152 -1.151 14.534 639 HB2 TYR 90 HB2 TYR 90 35.949 -2.968 15.892 640 HB3 TYR 90 HB1 TYR 90 37.232 -1.795 15.710 641 HD1 TYR 90 HD1 TYR 90 37.750 -0.261 17.690 642 HD2 TYR 90 HD2 TYR 90 35.221 -3.664 17.978 643 HE1 TYR 90 HE1 TYR 90 38.088 -0.295 20.126 644 HE2 TYR 90 HE2 TYR 90 35.540 -3.712 20.415 645 HH TYR 90 HH TYR 90 37.045 -1.125 22.132 646 H PHE 91 HN PHE 91 33.383 -2.664 15.138 647 HA PHE 91 HA PHE 91 31.614 -1.474 17.124 648 HB2 PHE 91 HB2 PHE 91 31.034 -2.833 14.496 649 HB3 PHE 91 HB1 PHE 91 29.837 -2.462 15.676 650 HD1 PHE 91 HD1 PHE 91 29.353 -0.054 16.255 651 HD2 PHE 91 HD2 PHE 91 31.867 -1.165 12.991 652 HE1 PHE 91 HE1 PHE 91 29.113 2.197 15.298 653 HE2 PHE 91 HE2 PHE 91 31.621 1.088 12.048 654 HZ PHE 91 HZ PHE 91 30.289 2.754 13.166 655 H VAL 92 HN VAL 92 30.185 -2.955 18.237 656 HA VAL 92 HA VAL 92 31.176 -5.722 18.346 657 HB VAL 92 HB VAL 92 30.536 -4.043 20.779 658 HG11 VAL 92 HG11 VAL 92 31.737 -6.794 20.539 659 HG12 VAL 92 HG12 VAL 92 30.118 -6.399 21.122 660 HG13 VAL 92 HG13 VAL 92 31.534 -5.888 22.037 661 HG21 VAL 92 HG21 VAL 92 32.567 -3.208 19.787 662 HG22 VAL 92 HG22 VAL 92 33.221 -4.841 19.676 663 HG23 VAL 92 HG23 VAL 92 32.951 -4.106 21.255 664 H ASP 93 HN ASP 93 29.564 -7.182 18.246 665 HA ASP 93 HA ASP 93 26.785 -6.295 18.644 666 HB2 ASP 93 HB2 ASP 93 28.057 -8.431 17.097 667 HB3 ASP 93 HB1 ASP 93 26.858 -9.106 18.203 668 H HIS 94 HN HIS 94 26.069 -6.343 20.763 669 HA HIS 94 HA HIS 94 27.640 -7.702 22.733 670 HB2 HIS 94 HB2 HIS 94 26.632 -5.490 23.141 671 HB3 HIS 94 HB1 HIS 94 25.027 -6.199 23.025 672 HD1 HIS 94 HD1 HIS 94 27.743 -5.479 25.342 673 HD2 HIS 94 HD2 HIS 94 24.436 -8.000 25.231 674 HE1 HIS 94 HE1 HIS 94 27.370 -6.224 27.723 675 HE2 HIS 94 HE2 HIS 94 25.298 -7.657 27.652 676 H ASN 95 HN ASN 95 24.753 -8.461 20.979 677 HA ASN 95 HA ASN 95 23.692 -10.328 22.867 678 HB2 ASN 95 HB2 ASN 95 22.236 -11.061 20.942 679 HB3 ASN 95 HB1 ASN 95 22.155 -9.333 21.279 680 HD21 ASN 95 HD21 ASN 95 23.059 -7.881 19.824 681 HD22 ASN 95 HD22 ASN 95 23.542 -8.339 18.219 682 H THR 96 HN THR 96 25.594 -10.717 19.867 683 HA THR 96 HA THR 96 25.801 -13.578 20.364 684 HB THR 96 HB THR 96 27.235 -13.466 18.241 685 HG1 THR 96 HG1 THR 96 26.066 -11.099 17.497 686 HG21 THR 96 HG21 THR 96 24.358 -12.539 18.112 687 HG22 THR 96 HG22 THR 96 24.905 -14.214 18.192 688 HG23 THR 96 HG23 THR 96 25.269 -13.234 16.771 689 H ARG 97 HN ARG 97 27.434 -10.763 21.178 690 HA ARG 97 HA ARG 97 29.454 -10.248 22.069 691 HB2 ARG 97 HB2 ARG 97 29.144 -13.095 22.903 692 HB3 ARG 97 HB1 ARG 97 30.662 -12.257 23.210 693 HG2 ARG 97 HG2 ARG 97 29.465 -10.499 24.377 694 HG3 ARG 97 HG1 ARG 97 27.944 -11.341 24.094 695 HD2 ARG 97 HD2 ARG 97 30.273 -12.486 25.629 696 HD3 ARG 97 HD1 ARG 97 28.850 -11.741 26.357 697 HE ARG 97 HE ARG 97 27.975 -13.737 24.608 698 HH11 ARG 97 HH11 ARG 97 29.785 -13.483 27.595 699 HH12 ARG 97 HH12 ARG 97 29.199 -14.994 28.216 700 HH21 ARG 97 HH21 ARG 97 27.234 -15.739 25.417 701 HH22 ARG 97 HH22 ARG 97 27.764 -16.278 26.982 702 H THR 98 HN THR 98 29.754 -10.011 19.752 703 HA THR 98 HA THR 98 32.195 -11.436 18.942 704 HB THR 98 HB THR 98 31.318 -11.314 16.543 705 HG1 THR 98 HG1 THR 98 28.728 -11.212 17.699 706 HG21 THR 98 HG21 THR 98 30.064 -13.409 16.736 707 HG22 THR 98 HG22 THR 98 29.803 -13.117 18.455 708 HG23 THR 98 HG23 THR 98 31.429 -13.427 17.852 709 H THR 99 HN THR 99 33.561 -10.173 17.483 710 HA THR 99 HA THR 99 32.981 -7.277 17.586 711 HB THR 99 HB THR 99 35.551 -7.203 17.026 712 HG1 THR 99 HG1 THR 99 36.549 -9.075 17.059 713 HG21 THR 99 HG21 THR 99 34.525 -8.132 19.746 714 HG22 THR 99 HG22 THR 99 34.746 -6.459 19.229 715 HG23 THR 99 HG23 THR 99 36.149 -7.501 19.472 716 H THR 100 HN THR 100 32.931 -6.127 15.582 717 HA THR 100 HA THR 100 33.780 -7.562 13.206 718 HB THR 100 HB THR 100 31.456 -8.291 13.451 719 HG1 THR 100 HG1 THR 100 32.216 -7.976 11.326 720 HG21 THR 100 HG21 THR 100 29.605 -6.662 13.235 721 HG22 THR 100 HG22 THR 100 30.778 -5.349 13.332 722 HG23 THR 100 HG23 THR 100 30.537 -6.421 14.712 723 H PHE 101 HN PHE 101 34.645 -6.293 11.741 724 HA PHE 101 HA PHE 101 34.502 -3.412 12.102 725 HB2 PHE 101 HB2 PHE 101 36.218 -5.266 10.444 726 HB3 PHE 101 HB1 PHE 101 36.135 -3.493 10.059 727 HD1 PHE 101 HD1 PHE 101 37.262 -1.913 11.426 728 HD2 PHE 101 HD2 PHE 101 37.096 -5.993 12.623 729 HE1 PHE 101 HE1 PHE 101 38.960 -1.476 13.158 730 HE2 PHE 101 HE2 PHE 101 38.787 -5.563 14.355 731 HZ PHE 101 HZ PHE 101 39.730 -3.261 14.603 732 H LYS 102 HN LYS 102 32.621 -2.653 11.385 733 HA LYS 102 HA LYS 102 31.874 -3.217 8.600 734 HB2 LYS 102 HB2 LYS 102 30.425 -4.429 10.282 735 HB3 LYS 102 HB1 LYS 102 29.918 -2.858 10.882 736 HG2 LYS 102 HG2 LYS 102 29.019 -2.328 8.643 737 HG3 LYS 102 HG1 LYS 102 29.459 -3.954 8.112 738 HD2 LYS 102 HD2 LYS 102 27.543 -3.270 10.341 739 HD3 LYS 102 HD1 LYS 102 27.103 -3.838 8.732 740 HE2 LYS 102 HE2 LYS 102 28.784 -5.395 10.691 741 HE3 LYS 102 HE1 LYS 102 27.050 -5.609 10.464 742 HZ1 LYS 102 HZ1 LYS 102 28.263 -7.256 9.208 743 HZ2 LYS 102 HZ2 LYS 102 29.159 -6.057 8.413 744 HZ3 LYS 102 HZ3 LYS 102 27.490 -6.192 8.134 745 H ASP 103 HN ASP 103 30.748 -1.416 7.573 746 HA ASP 103 HA ASP 103 31.745 1.117 8.447 747 HB2 ASP 103 HB2 ASP 103 29.802 0.419 6.226 748 HB3 ASP 103 HB1 ASP 103 30.514 2.001 6.486 749 HA PRO 104 HA PRO 104 28.378 2.519 11.002 750 HB2 PRO 104 HB2 PRO 104 28.303 5.161 10.040 751 HB3 PRO 104 HB1 PRO 104 29.325 4.598 11.367 752 HG2 PRO 104 HG2 PRO 104 29.996 5.012 8.491 753 HG3 PRO 104 HG1 PRO 104 30.988 5.296 9.932 754 HD2 PRO 104 HD2 PRO 104 31.401 3.173 8.362 755 HD3 PRO 104 HD1 PRO 104 31.562 3.051 10.128 756 H ARG 105 HN ARG 105 28.430 3.233 7.561 757 HA ARG 105 HA ARG 105 25.514 2.947 7.520 758 HB2 ARG 105 HB2 ARG 105 27.368 4.468 5.691 759 HB3 ARG 105 HB1 ARG 105 25.757 4.006 5.173 760 HG2 ARG 105 HG2 ARG 105 25.616 6.243 5.880 761 HG3 ARG 105 HG1 ARG 105 24.868 5.280 7.169 762 HD2 ARG 105 HD2 ARG 105 26.255 6.939 8.231 763 HD3 ARG 105 HD1 ARG 105 27.090 5.388 8.374 764 HE ARG 105 HE ARG 105 28.062 6.516 6.065 765 HH11 ARG 105 HH11 ARG 105 27.867 7.520 9.422 766 HH12 ARG 105 HH12 ARG 105 29.361 8.402 9.366 767 HH21 ARG 105 HH21 ARG 105 30.007 7.711 6.005 768 HH22 ARG 105 HH22 ARG 105 30.566 8.520 7.439 769 HA PRO 106 HA PRO 106 26.681 -1.026 5.933 770 HB2 PRO 106 HB2 PRO 106 24.268 -1.845 4.926 771 HB3 PRO 106 HB1 PRO 106 24.683 -1.872 6.682 772 HG2 PRO 106 HG2 PRO 106 23.069 0.120 5.127 773 HG3 PRO 106 HG1 PRO 106 22.798 -0.531 6.751 774 HD2 PRO 106 HD2 PRO 106 23.855 1.920 6.281 775 HD3 PRO 106 HD1 PRO 106 24.262 0.941 7.732 776 H GLY 107 HN GLY 107 27.825 -1.356 4.153 777 HA2 GLY 107 HA2 GLY 107 28.180 -1.724 1.889 778 HA3 GLY 107 HA1 GLY 107 26.611 -0.966 1.527 779 H PHE 108 HN PHE 108 27.368 1.418 3.207 780 HA PHE 108 HA PHE 108 28.151 3.556 2.770 781 HB2 PHE 108 HB2 PHE 108 30.311 1.961 3.128 782 HB3 PHE 108 HB1 PHE 108 30.608 2.516 1.443 783 HD1 PHE 108 HD1 PHE 108 30.229 3.606 4.956 784 HD2 PHE 108 HD2 PHE 108 31.242 4.769 0.986 785 HE1 PHE 108 HE1 PHE 108 31.163 5.713 5.811 786 HE2 PHE 108 HE2 PHE 108 32.176 6.878 1.840 787 HZ PHE 108 HZ PHE 108 32.121 7.359 4.246 788 H GLU 109 HN GLU 109 26.338 3.170 1.058 789 HA GLU 109 HA GLU 109 27.231 4.207 -1.431 790 HB2 GLU 109 HB2 GLU 109 26.203 2.339 -2.857 791 HB3 GLU 109 HB1 GLU 109 27.754 1.986 -2.109 792 HG2 GLU 109 HG2 GLU 109 26.780 0.529 -0.538 793 HG3 GLU 109 HG1 GLU 109 25.151 1.111 -0.887 Start of MODEL 20 1 H1 GLY 1 HT1 GLY 1 -40.428 10.899 3.067 2 H2 GLY 1 HT2 GLY 1 -42.056 10.436 3.186 3 H3 GLY 1 HT3 GLY 1 -41.418 10.909 1.690 4 HA2 GLY 1 HA1 GLY 1 -40.524 8.529 3.218 5 HA3 GLY 1 HA2 GLY 1 -41.696 8.476 1.911 6 H SER 2 HN SER 2 -40.844 7.724 0.142 7 HA SER 2 HA SER 2 -39.485 7.273 -1.583 8 HB2 SER 2 HB2 SER 2 -38.077 9.129 -2.471 9 HB3 SER 2 HB1 SER 2 -39.751 9.582 -2.167 10 HG SER 2 HG SER 2 -38.054 9.993 -0.035 11 H HIS 3 HN HIS 3 -38.240 5.602 -1.164 12 HA HIS 3 HA HIS 3 -35.802 5.927 0.420 13 HB2 HIS 3 HB2 HIS 3 -37.051 3.448 -0.820 14 HB3 HIS 3 HB1 HIS 3 -35.590 3.447 0.157 15 HD1 HIS 3 HD1 HIS 3 -39.251 3.305 0.405 16 HD2 HIS 3 HD2 HIS 3 -36.039 4.133 2.919 17 HE1 HIS 3 HE1 HIS 3 -40.161 3.161 2.748 18 HE2 HIS 3 HE2 HIS 3 -38.166 3.480 4.255 19 H MET 4 HN MET 4 -33.727 5.197 -0.486 20 HA MET 4 HA MET 4 -33.645 5.454 -3.415 21 HB2 MET 4 HB2 MET 4 -31.722 6.647 -1.402 22 HB3 MET 4 HB1 MET 4 -31.413 6.575 -3.126 23 HG2 MET 4 HG2 MET 4 -33.735 8.005 -1.858 24 HG3 MET 4 HG1 MET 4 -32.232 8.762 -2.383 25 HE1 MET 4 HE1 MET 4 -33.669 10.480 -3.835 26 HE2 MET 4 HE2 MET 4 -35.155 9.687 -3.320 27 HE3 MET 4 HE3 MET 4 -34.863 9.988 -5.035 28 H GLN 5 HN GLN 5 -32.423 3.984 -4.491 29 HA GLN 5 HA GLN 5 -31.279 1.795 -2.961 30 HB2 GLN 5 HB2 GLN 5 -32.691 1.296 -4.918 31 HB3 GLN 5 HB1 GLN 5 -31.578 2.184 -5.949 32 HG2 GLN 5 HG2 GLN 5 -31.012 -0.041 -6.282 33 HG3 GLN 5 HG1 GLN 5 -29.804 0.539 -5.147 34 HE21 GLN 5 HE21 GLN 5 -32.549 -1.499 -5.633 35 HE22 GLN 5 HE22 GLN 5 -32.414 -2.382 -4.120 36 H TYR 6 HN TYR 6 -29.199 1.795 -2.417 37 HA TYR 6 HA TYR 6 -27.300 3.292 -4.133 38 HB2 TYR 6 HB2 TYR 6 -27.253 2.822 -1.113 39 HB3 TYR 6 HB1 TYR 6 -25.825 3.354 -1.986 40 HD1 TYR 6 HD1 TYR 6 -25.749 5.599 -2.961 41 HD2 TYR 6 HD2 TYR 6 -29.090 4.325 -0.655 42 HE1 TYR 6 HE1 TYR 6 -26.477 7.936 -2.740 43 HE2 TYR 6 HE2 TYR 6 -29.826 6.660 -0.425 44 HH TYR 6 HH TYR 6 -28.905 8.908 -0.548 45 H LYS 7 HN LYS 7 -25.266 2.245 -4.500 46 HA LYS 7 HA LYS 7 -25.236 -0.598 -3.772 47 HB2 LYS 7 HB2 LYS 7 -23.858 -0.728 -6.076 48 HB3 LYS 7 HB1 LYS 7 -25.607 -0.980 -5.993 49 HG2 LYS 7 HG2 LYS 7 -25.876 1.466 -6.533 50 HG3 LYS 7 HG1 LYS 7 -24.135 1.490 -6.849 51 HD2 LYS 7 HD2 LYS 7 -24.342 -0.104 -8.591 52 HD3 LYS 7 HD1 LYS 7 -26.019 -0.454 -8.166 53 HE2 LYS 7 HE2 LYS 7 -26.568 1.913 -8.758 54 HE3 LYS 7 HE1 LYS 7 -24.915 2.093 -9.345 55 HZ1 LYS 7 HZ1 LYS 7 -26.191 1.583 -11.217 56 HZ2 LYS 7 HZ2 LYS 7 -27.062 0.377 -10.414 57 HZ3 LYS 7 HZ3 LYS 7 -25.437 0.114 -10.816 58 H LEU 8 HN LEU 8 -23.136 -1.609 -3.920 59 HA LEU 8 HA LEU 8 -20.885 0.193 -3.368 60 HB2 LEU 8 HB2 LEU 8 -22.011 -0.342 -1.181 61 HB3 LEU 8 HB1 LEU 8 -21.808 -2.029 -1.534 62 HG LEU 8 HG LEU 8 -19.279 -1.537 -1.564 63 HD11 LEU 8 HD11 LEU 8 -20.253 0.858 -0.007 64 HD12 LEU 8 HD12 LEU 8 -19.425 0.903 -1.564 65 HD13 LEU 8 HD13 LEU 8 -18.583 0.309 -0.138 66 HD21 LEU 8 HD21 LEU 8 -20.314 -2.888 0.102 67 HD22 LEU 8 HD22 LEU 8 -20.968 -1.469 0.915 68 HD23 LEU 8 HD23 LEU 8 -19.227 -1.756 0.909 69 H ILE 9 HN ILE 9 -18.930 -0.649 -3.873 70 HA ILE 9 HA ILE 9 -18.908 -3.387 -4.963 71 HB ILE 9 HB ILE 9 -17.420 -0.961 -6.036 72 HG12 ILE 9 HG12 ILE 9 -19.490 -2.741 -7.406 73 HG13 ILE 9 HG11 ILE 9 -19.855 -1.122 -6.721 74 HG21 ILE 9 HG21 ILE 9 -16.541 -2.491 -7.758 75 HG22 ILE 9 HG22 ILE 9 -17.262 -3.853 -6.899 76 HG23 ILE 9 HG23 ILE 9 -15.984 -2.904 -6.137 77 HD11 ILE 9 HD11 ILE 9 -17.919 -1.716 -8.977 78 HD12 ILE 9 HD12 ILE 9 -18.285 -0.122 -8.316 79 HD13 ILE 9 HD13 ILE 9 -19.543 -1.043 -9.143 80 H LEU 10 HN LEU 10 -17.663 -4.625 -3.662 81 HA LEU 10 HA LEU 10 -15.717 -3.306 -1.954 82 HB2 LEU 10 HB2 LEU 10 -16.460 -6.227 -2.045 83 HB3 LEU 10 HB1 LEU 10 -15.332 -5.517 -0.925 84 HG LEU 10 HG LEU 10 -17.154 -5.710 0.403 85 HD11 LEU 10 HD11 LEU 10 -16.500 -3.359 0.301 86 HD12 LEU 10 HD12 LEU 10 -18.164 -3.641 0.811 87 HD13 LEU 10 HD13 LEU 10 -17.830 -3.088 -0.835 88 HD21 LEU 10 HD21 LEU 10 -18.617 -6.634 -1.362 89 HD22 LEU 10 HD22 LEU 10 -19.016 -4.985 -1.847 90 HD23 LEU 10 HD23 LEU 10 -19.460 -5.566 -0.244 91 H ASN 11 HN ASN 11 -13.962 -2.745 -3.011 92 HA ASN 11 HA ASN 11 -12.752 -4.674 -4.866 93 HB2 ASN 11 HB2 ASN 11 -13.147 -2.145 -5.353 94 HB3 ASN 11 HB1 ASN 11 -11.793 -1.872 -4.267 95 HD21 ASN 11 HD21 ASN 11 -12.089 -1.270 -7.049 96 HD22 ASN 11 HD22 ASN 11 -10.825 -2.090 -7.890 97 H GLY 12 HN GLY 12 -12.199 -6.055 -3.153 98 HA2 GLY 12 HA2 GLY 12 -9.700 -5.246 -1.857 99 HA3 GLY 12 HA1 GLY 12 -10.969 -6.007 -0.880 100 H LYS 13 HN LYS 13 -8.173 -6.651 -2.371 101 HA LYS 13 HA LYS 13 -8.618 -8.916 -3.929 102 HB2 LYS 13 HB2 LYS 13 -6.202 -8.221 -2.253 103 HB3 LYS 13 HB1 LYS 13 -6.239 -9.468 -3.494 104 HG2 LYS 13 HG2 LYS 13 -6.731 -7.803 -5.192 105 HG3 LYS 13 HG1 LYS 13 -6.773 -6.540 -3.964 106 HD2 LYS 13 HD2 LYS 13 -4.420 -6.893 -3.481 107 HD3 LYS 13 HD1 LYS 13 -4.363 -8.228 -4.635 108 HE2 LYS 13 HE2 LYS 13 -3.435 -6.246 -5.657 109 HE3 LYS 13 HE1 LYS 13 -4.959 -6.649 -6.441 110 HZ1 LYS 13 HZ1 LYS 13 -4.616 -4.561 -4.354 111 HZ2 LYS 13 HZ2 LYS 13 -6.056 -4.918 -5.175 112 HZ3 LYS 13 HZ3 LYS 13 -4.733 -4.263 -6.016 113 H THR 14 HN THR 14 -9.026 -8.606 -0.550 114 HA THR 14 HA THR 14 -8.541 -11.390 0.087 115 HB THR 14 HB THR 14 -10.133 -9.432 1.751 116 HG1 THR 14 HG1 THR 14 -7.672 -9.359 2.606 117 HG21 THR 14 HG21 THR 14 -9.153 -10.707 3.619 118 HG22 THR 14 HG22 THR 14 -8.328 -11.751 2.462 119 HG23 THR 14 HG23 THR 14 -10.089 -11.745 2.542 120 H LEU 15 HN LEU 15 -11.296 -9.329 -0.694 121 HA LEU 15 HA LEU 15 -12.937 -11.589 -1.351 122 HB2 LEU 15 HB2 LEU 15 -13.251 -11.365 1.137 123 HB3 LEU 15 HB1 LEU 15 -13.787 -9.727 0.883 124 HG LEU 15 HG LEU 15 -15.569 -11.475 1.314 125 HD11 LEU 15 HD11 LEU 15 -17.106 -10.479 -0.373 126 HD12 LEU 15 HD12 LEU 15 -15.704 -9.684 -1.099 127 HD13 LEU 15 HD13 LEU 15 -16.176 -9.301 0.558 128 HD21 LEU 15 HD21 LEU 15 -14.871 -12.188 -1.521 129 HD22 LEU 15 HD22 LEU 15 -16.308 -12.741 -0.660 130 HD23 LEU 15 HD23 LEU 15 -14.705 -13.217 -0.100 131 H LYS 16 HN LYS 16 -13.818 -10.954 -3.239 132 HA LYS 16 HA LYS 16 -14.393 -8.083 -3.565 133 HB2 LYS 16 HB2 LYS 16 -13.833 -10.097 -5.751 134 HB3 LYS 16 HB1 LYS 16 -14.122 -8.385 -5.980 135 HG2 LYS 16 HG2 LYS 16 -11.844 -8.425 -6.113 136 HG3 LYS 16 HG1 LYS 16 -12.031 -8.159 -4.385 137 HD2 LYS 16 HD2 LYS 16 -10.378 -9.885 -5.045 138 HD3 LYS 16 HD1 LYS 16 -11.600 -10.432 -3.900 139 HE2 LYS 16 HE2 LYS 16 -12.855 -11.344 -5.912 140 HE3 LYS 16 HE1 LYS 16 -11.397 -11.023 -6.849 141 HZ1 LYS 16 HZ1 LYS 16 -10.165 -12.478 -5.330 142 HZ2 LYS 16 HZ2 LYS 16 -11.430 -13.307 -6.102 143 HZ3 LYS 16 HZ3 LYS 16 -11.598 -12.822 -4.490 144 H GLY 17 HN GLY 17 -16.349 -7.470 -4.466 145 HA2 GLY 17 HA2 GLY 17 -18.349 -9.122 -5.403 146 HA3 GLY 17 HA1 GLY 17 -18.550 -9.065 -3.657 147 H GLU 18 HN GLU 18 -20.645 -8.143 -4.698 148 HA GLU 18 HA GLU 18 -20.497 -5.232 -4.472 149 HB2 GLU 18 HB2 GLU 18 -21.945 -6.645 -6.738 150 HB3 GLU 18 HB1 GLU 18 -21.897 -4.908 -6.462 151 HG2 GLU 18 HG2 GLU 18 -19.844 -4.687 -7.369 152 HG3 GLU 18 HG1 GLU 18 -19.284 -6.238 -6.744 153 H THR 19 HN THR 19 -22.781 -4.323 -4.226 154 HA THR 19 HA THR 19 -24.915 -6.106 -3.613 155 HB THR 19 HB THR 19 -23.477 -6.549 -1.651 156 HG1 THR 19 HG1 THR 19 -25.385 -5.323 -0.234 157 HG21 THR 19 HG21 THR 19 -23.942 -3.616 -1.049 158 HG22 THR 19 HG22 THR 19 -22.398 -4.339 -1.498 159 HG23 THR 19 HG23 THR 19 -23.162 -4.769 0.037 160 H THR 20 HN THR 20 -26.744 -4.935 -2.487 161 HA THR 20 HA THR 20 -26.723 -2.038 -2.954 162 HB THR 20 HB THR 20 -29.125 -2.303 -3.794 163 HG1 THR 20 HG1 THR 20 -29.167 -4.600 -3.130 164 HG21 THR 20 HG21 THR 20 -26.847 -3.365 -5.476 165 HG22 THR 20 HG22 THR 20 -27.356 -1.681 -5.341 166 HG23 THR 20 HG23 THR 20 -28.411 -2.865 -6.117 167 H THR 21 HN THR 21 -28.483 -0.908 -1.801 168 HA THR 21 HA THR 21 -29.891 -2.361 0.255 169 HB THR 21 HB THR 21 -27.521 -1.997 1.208 170 HG1 THR 21 HG1 THR 21 -29.658 -0.807 2.689 171 HG21 THR 21 HG21 THR 21 -27.236 0.362 0.430 172 HG22 THR 21 HG22 THR 21 -27.080 0.231 2.185 173 HG23 THR 21 HG23 THR 21 -28.572 0.846 1.474 174 H GLU 22 HN GLU 22 -31.500 -1.073 1.285 175 HA GLU 22 HA GLU 22 -32.172 1.310 -0.279 176 HB2 GLU 22 HB2 GLU 22 -34.398 1.110 0.737 177 HB3 GLU 22 HB1 GLU 22 -33.932 -0.454 0.075 178 HG2 GLU 22 HG2 GLU 22 -33.431 0.160 2.972 179 HG3 GLU 22 HG1 GLU 22 -35.075 -0.316 2.407 180 H ALA 23 HN ALA 23 -31.959 3.333 0.505 181 HA ALA 23 HA ALA 23 -31.899 3.738 3.426 182 HB1 ALA 23 HB1 ALA 23 -29.759 4.857 1.593 183 HB2 ALA 23 HB2 ALA 23 -29.539 3.463 2.651 184 HB3 ALA 23 HB3 ALA 23 -29.870 5.050 3.345 185 H VAL 24 HN VAL 24 -32.302 6.034 3.994 186 HA VAL 24 HA VAL 24 -33.755 7.404 1.851 187 HB VAL 24 HB VAL 24 -34.757 8.762 3.697 188 HG11 VAL 24 HG11 VAL 24 -35.950 6.880 2.755 189 HG12 VAL 24 HG12 VAL 24 -36.238 6.964 4.494 190 HG13 VAL 24 HG13 VAL 24 -35.114 5.772 3.840 191 HG21 VAL 24 HG21 VAL 24 -33.378 6.739 5.462 192 HG22 VAL 24 HG22 VAL 24 -34.555 7.940 5.993 193 HG23 VAL 24 HG23 VAL 24 -32.992 8.457 5.361 194 H ASP 25 HN ASP 25 -30.731 7.463 2.839 195 HA ASP 25 HA ASP 25 -30.223 10.117 1.972 196 HB2 ASP 25 HB2 ASP 25 -30.911 10.609 4.311 197 HB3 ASP 25 HB1 ASP 25 -29.647 9.533 4.890 198 H ALA 26 HN ALA 26 -27.884 10.564 1.935 199 HA ALA 26 HA ALA 26 -26.471 8.238 1.074 200 HB1 ALA 26 HB1 ALA 26 -25.527 11.084 1.445 201 HB2 ALA 26 HB2 ALA 26 -26.165 10.377 -0.041 202 HB3 ALA 26 HB3 ALA 26 -24.627 9.812 0.617 203 H ALA 27 HN ALA 27 -26.159 10.418 3.865 204 HA ALA 27 HA ALA 27 -23.783 9.221 4.876 205 HB1 ALA 27 HB1 ALA 27 -24.463 11.502 5.469 206 HB2 ALA 27 HB2 ALA 27 -24.209 10.502 6.899 207 HB3 ALA 27 HB3 ALA 27 -25.848 10.856 6.350 208 H THR 28 HN THR 28 -27.140 8.460 5.097 209 HA THR 28 HA THR 28 -26.940 6.754 7.382 210 HB THR 28 HB THR 28 -29.094 6.605 5.268 211 HG1 THR 28 HG1 THR 28 -28.545 8.600 7.164 212 HG21 THR 28 HG21 THR 28 -29.070 6.063 8.244 213 HG22 THR 28 HG22 THR 28 -29.173 4.854 6.965 214 HG23 THR 28 HG23 THR 28 -30.502 5.991 7.217 215 H ALA 29 HN ALA 29 -26.313 6.404 4.003 216 HA ALA 29 HA ALA 29 -26.677 3.540 3.908 217 HB1 ALA 29 HB1 ALA 29 -25.798 3.707 1.642 218 HB2 ALA 29 HB2 ALA 29 -25.353 5.390 1.924 219 HB3 ALA 29 HB3 ALA 29 -27.052 4.920 1.904 220 H GLU 30 HN GLU 30 -24.058 5.855 4.150 221 HA GLU 30 HA GLU 30 -21.827 4.221 3.975 222 HB2 GLU 30 HB2 GLU 30 -21.985 6.797 4.266 223 HB3 GLU 30 HB1 GLU 30 -22.096 6.449 5.981 224 HG2 GLU 30 HG2 GLU 30 -19.930 5.041 5.534 225 HG3 GLU 30 HG1 GLU 30 -19.791 6.134 4.156 226 H LYS 31 HN LYS 31 -23.462 5.280 6.943 227 HA LYS 31 HA LYS 31 -22.048 3.848 8.803 228 HB2 LYS 31 HB2 LYS 31 -25.010 4.430 8.928 229 HB3 LYS 31 HB1 LYS 31 -23.944 4.135 10.293 230 HG2 LYS 31 HG2 LYS 31 -23.627 6.452 8.398 231 HG3 LYS 31 HG1 LYS 31 -24.531 6.529 9.913 232 HD2 LYS 31 HD2 LYS 31 -22.508 5.927 11.153 233 HD3 LYS 31 HD1 LYS 31 -21.607 5.829 9.638 234 HE2 LYS 31 HE2 LYS 31 -21.860 8.159 9.239 235 HE3 LYS 31 HE1 LYS 31 -23.028 8.323 10.546 236 HZ1 LYS 31 HZ1 LYS 31 -21.249 7.774 12.118 237 HZ2 LYS 31 HZ2 LYS 31 -20.897 9.173 11.232 238 HZ3 LYS 31 HZ3 LYS 31 -20.134 7.708 10.844 239 H VAL 32 HN VAL 32 -24.776 2.704 6.857 240 HA VAL 32 HA VAL 32 -25.032 0.230 8.296 241 HB VAL 32 HB VAL 32 -26.152 1.042 5.611 242 HG11 VAL 32 HG11 VAL 32 -26.762 -1.357 7.335 243 HG12 VAL 32 HG12 VAL 32 -26.034 -1.356 5.729 244 HG13 VAL 32 HG13 VAL 32 -27.712 -0.853 5.937 245 HG21 VAL 32 HG21 VAL 32 -26.977 2.418 7.440 246 HG22 VAL 32 HG22 VAL 32 -27.441 0.972 8.339 247 HG23 VAL 32 HG23 VAL 32 -28.247 1.365 6.821 248 H PHE 33 HN PHE 33 -23.943 1.046 4.999 249 HA PHE 33 HA PHE 33 -23.023 -1.536 4.354 250 HB2 PHE 33 HB2 PHE 33 -22.620 1.172 3.205 251 HB3 PHE 33 HB1 PHE 33 -21.425 -0.039 2.793 252 HD1 PHE 33 HD1 PHE 33 -23.583 -2.329 2.929 253 HD2 PHE 33 HD2 PHE 33 -23.322 1.407 0.909 254 HE1 PHE 33 HE1 PHE 33 -25.024 -3.201 1.136 255 HE2 PHE 33 HE2 PHE 33 -24.766 0.547 -0.886 256 HZ PHE 33 HZ PHE 33 -25.622 -1.763 -0.775 257 H LYS 34 HN LYS 34 -21.499 0.977 6.241 258 HA LYS 34 HA LYS 34 -18.865 -0.011 5.997 259 HB2 LYS 34 HB2 LYS 34 -20.252 1.802 7.930 260 HB3 LYS 34 HB1 LYS 34 -18.590 1.340 8.203 261 HG2 LYS 34 HG2 LYS 34 -18.256 2.139 5.748 262 HG3 LYS 34 HG1 LYS 34 -19.763 3.016 6.031 263 HD2 LYS 34 HD2 LYS 34 -17.920 4.499 6.546 264 HD3 LYS 34 HD1 LYS 34 -18.739 4.042 8.041 265 HE2 LYS 34 HE2 LYS 34 -17.047 2.457 8.583 266 HE3 LYS 34 HE1 LYS 34 -16.283 2.650 7.008 267 HZ1 LYS 34 HZ1 LYS 34 -15.241 3.841 8.975 268 HZ2 LYS 34 HZ2 LYS 34 -16.551 4.919 8.886 269 HZ3 LYS 34 HZ3 LYS 34 -15.497 4.758 7.570 270 H GLN 35 HN GLN 35 -21.469 -0.621 8.311 271 HA GLN 35 HA GLN 35 -19.935 -2.415 9.913 272 HB2 GLN 35 HB2 GLN 35 -22.026 -1.262 10.688 273 HB3 GLN 35 HB1 GLN 35 -22.956 -2.292 9.613 274 HG2 GLN 35 HG2 GLN 35 -23.043 -3.099 11.896 275 HG3 GLN 35 HG1 GLN 35 -22.219 -4.259 10.854 276 HE21 GLN 35 HE21 GLN 35 -21.838 -1.928 13.423 277 HE22 GLN 35 HE22 GLN 35 -20.257 -2.439 13.906 278 H TYR 36 HN TYR 36 -21.869 -2.640 7.044 279 HA TYR 36 HA TYR 36 -22.077 -5.438 6.780 280 HB2 TYR 36 HB2 TYR 36 -23.456 -4.136 5.356 281 HB3 TYR 36 HB1 TYR 36 -22.113 -3.116 4.863 282 HD1 TYR 36 HD1 TYR 36 -23.120 -6.735 4.659 283 HD2 TYR 36 HD2 TYR 36 -21.264 -3.393 2.801 284 HE1 TYR 36 HE1 TYR 36 -22.776 -8.066 2.612 285 HE2 TYR 36 HE2 TYR 36 -20.913 -4.692 0.756 286 HH TYR 36 HH TYR 36 -22.379 -7.799 0.282 287 H ALA 37 HN ALA 37 -19.783 -3.123 5.380 288 HA ALA 37 HA ALA 37 -18.073 -5.019 4.190 289 HB1 ALA 37 HB1 ALA 37 -18.168 -2.606 3.615 290 HB2 ALA 37 HB2 ALA 37 -16.527 -3.169 3.938 291 HB3 ALA 37 HB3 ALA 37 -17.397 -2.239 5.157 292 H ASN 38 HN ASN 38 -18.214 -3.566 7.373 293 HA ASN 38 HA ASN 38 -15.698 -4.293 8.374 294 HB2 ASN 38 HB2 ASN 38 -17.176 -2.667 9.514 295 HB3 ASN 38 HB1 ASN 38 -18.305 -3.965 9.901 296 HD21 ASN 38 HD21 ASN 38 -17.867 -5.344 11.590 297 HD22 ASN 38 HD22 ASN 38 -16.500 -5.115 12.698 298 H ASP 39 HN ASP 39 -18.751 -6.075 8.351 299 HA ASP 39 HA ASP 39 -17.918 -8.242 9.940 300 HB2 ASP 39 HB2 ASP 39 -20.273 -7.809 9.462 301 HB3 ASP 39 HB1 ASP 39 -20.007 -8.142 7.755 302 H ASN 40 HN ASN 40 -17.341 -7.454 6.615 303 HA ASN 40 HA ASN 40 -16.354 -10.146 6.028 304 HB2 ASN 40 HB2 ASN 40 -17.066 -7.770 4.343 305 HB3 ASN 40 HB1 ASN 40 -15.974 -8.991 3.707 306 HD21 ASN 40 HD21 ASN 40 -19.228 -8.213 4.566 307 HD22 ASN 40 HD22 ASN 40 -19.963 -9.705 3.976 308 H GLY 41 HN GLY 41 -15.228 -7.356 7.360 309 HA2 GLY 41 HA2 GLY 41 -13.086 -6.748 7.954 310 HA3 GLY 41 HA1 GLY 41 -12.491 -8.157 7.089 311 H VAL 42 HN VAL 42 -14.532 -5.877 5.457 312 HA VAL 42 HA VAL 42 -12.220 -5.093 3.852 313 HB VAL 42 HB VAL 42 -15.167 -5.110 3.165 314 HG11 VAL 42 HG11 VAL 42 -12.791 -4.387 1.439 315 HG12 VAL 42 HG12 VAL 42 -13.962 -3.242 2.094 316 HG13 VAL 42 HG13 VAL 42 -14.477 -4.457 0.922 317 HG21 VAL 42 HG21 VAL 42 -12.822 -6.783 2.285 318 HG22 VAL 42 HG22 VAL 42 -14.421 -6.837 1.538 319 HG23 VAL 42 HG23 VAL 42 -14.217 -7.317 3.225 320 H ASP 43 HN ASP 43 -11.426 -3.325 4.761 321 HA ASP 43 HA ASP 43 -13.199 -1.010 4.876 322 HB2 ASP 43 HB2 ASP 43 -12.242 -0.193 6.993 323 HB3 ASP 43 HB1 ASP 43 -12.869 -1.821 7.243 324 H GLY 44 HN GLY 44 -12.322 0.851 4.066 325 HA2 GLY 44 HA2 GLY 44 -9.577 1.311 3.635 326 HA3 GLY 44 HA1 GLY 44 -10.299 0.631 2.183 327 H GLU 45 HN GLU 45 -9.583 2.799 1.364 328 HA GLU 45 HA GLU 45 -10.789 5.207 2.184 329 HB2 GLU 45 HB2 GLU 45 -9.449 4.273 -0.318 330 HB3 GLU 45 HB1 GLU 45 -10.314 5.803 -0.341 331 HG2 GLU 45 HG2 GLU 45 -7.878 5.992 0.102 332 HG3 GLU 45 HG1 GLU 45 -8.900 6.718 1.343 333 H TRP 46 HN TRP 46 -12.590 6.323 1.473 334 HA TRP 46 HA TRP 46 -14.574 4.614 0.121 335 HB2 TRP 46 HB2 TRP 46 -14.859 6.344 2.536 336 HB3 TRP 46 HB1 TRP 46 -16.223 6.267 1.437 337 HD1 TRP 46 HD1 TRP 46 -13.850 3.652 3.056 338 HE1 TRP 46 HE1 TRP 46 -15.255 1.679 3.899 339 HE3 TRP 46 HE3 TRP 46 -18.545 5.259 1.654 340 HZ2 TRP 46 HZ2 TRP 46 -17.932 0.901 3.979 341 HZ3 TRP 46 HZ3 TRP 46 -20.454 3.813 2.184 342 HH2 TRP 46 HH2 TRP 46 -20.151 1.680 3.312 343 H THR 47 HN THR 47 -15.359 5.321 -1.707 344 HA THR 47 HA THR 47 -15.263 8.202 -2.283 345 HB THR 47 HB THR 47 -15.003 7.453 -4.731 346 HG1 THR 47 HG1 THR 47 -14.422 5.053 -3.332 347 HG21 THR 47 HG21 THR 47 -13.212 8.564 -3.494 348 HG22 THR 47 HG22 THR 47 -12.553 7.296 -4.531 349 HG23 THR 47 HG23 THR 47 -12.722 7.020 -2.799 350 H TYR 48 HN TYR 48 -16.921 8.904 -3.865 351 HA TYR 48 HA TYR 48 -19.215 7.112 -4.014 352 HB2 TYR 48 HB2 TYR 48 -19.726 8.233 -1.965 353 HB3 TYR 48 HB1 TYR 48 -19.350 9.802 -2.619 354 HD1 TYR 48 HD1 TYR 48 -21.085 11.092 -3.776 355 HD2 TYR 48 HD2 TYR 48 -21.742 6.994 -2.754 356 HE1 TYR 48 HE1 TYR 48 -23.455 11.323 -4.344 357 HE2 TYR 48 HE2 TYR 48 -24.116 7.239 -3.330 358 HH TYR 48 HH TYR 48 -25.780 9.040 -3.485 359 H ASP 49 HN ASP 49 -20.536 7.437 -5.780 360 HA ASP 49 HA ASP 49 -19.759 9.708 -7.531 361 HB2 ASP 49 HB2 ASP 49 -20.282 8.285 -9.485 362 HB3 ASP 49 HB1 ASP 49 -19.060 7.488 -8.501 363 H ASP 50 HN ASP 50 -21.505 10.731 -8.664 364 HA ASP 50 HA ASP 50 -24.083 10.382 -7.258 365 HB2 ASP 50 HB2 ASP 50 -23.024 12.702 -7.452 366 HB3 ASP 50 HB1 ASP 50 -23.335 12.609 -9.181 367 H ALA 51 HN ALA 51 -22.483 10.033 -10.279 368 HA ALA 51 HA ALA 51 -24.626 10.009 -12.062 369 HB1 ALA 51 HB1 ALA 51 -22.274 10.139 -12.747 370 HB2 ALA 51 HB2 ALA 51 -23.140 8.859 -13.596 371 HB3 ALA 51 HB3 ALA 51 -22.050 8.453 -12.272 372 H THR 52 HN THR 52 -23.386 7.426 -9.991 373 HA THR 52 HA THR 52 -25.662 5.837 -10.905 374 HB THR 52 HB THR 52 -23.718 4.948 -12.102 375 HG1 THR 52 HG1 THR 52 -23.947 2.719 -10.979 376 HG21 THR 52 HG21 THR 52 -22.133 3.553 -10.742 377 HG22 THR 52 HG22 THR 52 -22.673 4.514 -9.366 378 HG23 THR 52 HG23 THR 52 -21.893 5.299 -10.735 379 H LYS 53 HN LYS 53 -24.872 7.442 -8.429 380 HA LYS 53 HA LYS 53 -24.930 7.296 -6.115 381 HB2 LYS 53 HB2 LYS 53 -27.220 5.549 -7.016 382 HB3 LYS 53 HB1 LYS 53 -26.863 5.760 -5.318 383 HG2 LYS 53 HG2 LYS 53 -28.610 7.283 -6.029 384 HG3 LYS 53 HG1 LYS 53 -27.178 8.164 -5.502 385 HD2 LYS 53 HD2 LYS 53 -26.530 8.382 -7.911 386 HD3 LYS 53 HD1 LYS 53 -28.093 7.687 -8.336 387 HE2 LYS 53 HE2 LYS 53 -29.242 9.512 -7.247 388 HE3 LYS 53 HE1 LYS 53 -27.711 10.175 -6.681 389 HZ1 LYS 53 HZ1 LYS 53 -28.282 11.431 -8.546 390 HZ2 LYS 53 HZ2 LYS 53 -28.758 10.082 -9.446 391 HZ3 LYS 53 HZ3 LYS 53 -27.111 10.350 -9.124 392 H THR 54 HN THR 54 -22.912 5.766 -7.127 393 HA THR 54 HA THR 54 -23.142 3.219 -5.701 394 HB THR 54 HB THR 54 -21.394 3.960 -8.091 395 HG1 THR 54 HG1 THR 54 -23.782 3.401 -8.161 396 HG21 THR 54 HG21 THR 54 -20.238 2.367 -6.496 397 HG22 THR 54 HG22 THR 54 -20.654 1.610 -8.037 398 HG23 THR 54 HG23 THR 54 -21.639 1.294 -6.606 399 H TYR 55 HN TYR 55 -21.986 2.877 -3.961 400 HA TYR 55 HA TYR 55 -19.873 4.744 -3.192 401 HB2 TYR 55 HB2 TYR 55 -21.398 2.618 -1.650 402 HB3 TYR 55 HB1 TYR 55 -19.855 3.222 -1.062 403 HD1 TYR 55 HD1 TYR 55 -23.323 4.125 -1.823 404 HD2 TYR 55 HD2 TYR 55 -19.666 5.424 -0.074 405 HE1 TYR 55 HE1 TYR 55 -24.501 6.006 -0.766 406 HE2 TYR 55 HE2 TYR 55 -20.837 7.307 0.984 407 HH TYR 55 HH TYR 55 -24.286 7.520 1.045 408 H THR 56 HN THR 56 -17.760 4.245 -3.282 409 HA THR 56 HA THR 56 -17.090 1.468 -4.002 410 HB THR 56 HB THR 56 -15.540 3.910 -4.879 411 HG1 THR 56 HG1 THR 56 -17.927 3.110 -5.731 412 HG21 THR 56 HG21 THR 56 -14.543 2.372 -6.507 413 HG22 THR 56 HG22 THR 56 -15.550 1.054 -5.910 414 HG23 THR 56 HG23 THR 56 -14.309 1.752 -4.872 415 H VAL 57 HN VAL 57 -15.936 0.503 -2.476 416 HA VAL 57 HA VAL 57 -14.209 2.175 -0.774 417 HB VAL 57 HB VAL 57 -15.897 0.952 0.595 418 HG11 VAL 57 HG11 VAL 57 -16.331 -1.038 -0.642 419 HG12 VAL 57 HG12 VAL 57 -15.613 -1.530 0.888 420 HG13 VAL 57 HG13 VAL 57 -14.637 -1.513 -0.577 421 HG21 VAL 57 HG21 VAL 57 -14.356 -0.028 2.203 422 HG22 VAL 57 HG22 VAL 57 -13.732 1.490 1.561 423 HG23 VAL 57 HG23 VAL 57 -13.081 -0.047 0.988 424 H THR 58 HN THR 58 -12.093 1.876 -0.928 425 HA THR 58 HA THR 58 -11.193 -0.380 -2.588 426 HB THR 58 HB THR 58 -9.913 2.352 -2.609 427 HG1 THR 58 HG1 THR 58 -12.251 1.546 -3.700 428 HG21 THR 58 HG21 THR 58 -9.795 0.054 -4.574 429 HG22 THR 58 HG22 THR 58 -8.542 0.444 -3.395 430 HG23 THR 58 HG23 THR 58 -8.918 1.582 -4.688 431 H GLU 59 HN GLU 59 -10.111 -1.701 -1.398 432 HA GLU 59 HA GLU 59 -8.746 -1.084 0.979 433 HB2 GLU 59 HB2 GLU 59 -8.634 -3.488 -0.831 434 HB3 GLU 59 HB1 GLU 59 -7.619 -3.369 0.577 435 HG2 GLU 59 HG2 GLU 59 -9.805 -4.619 0.833 436 HG3 GLU 59 HG1 GLU 59 -9.394 -3.419 2.055 437 H GLY 60 HN GLY 60 -7.304 0.670 0.615 438 HA2 GLY 60 HA2 GLY 60 -5.303 0.654 -1.407 439 HA3 GLY 60 HA1 GLY 60 -5.276 1.623 0.070 440 H SER 61 HN SER 61 -3.882 -0.898 -1.592 441 HA SER 61 HA SER 61 -2.221 -1.618 0.687 442 HB2 SER 61 HB2 SER 61 -2.472 -4.089 -0.108 443 HB3 SER 61 HB1 SER 61 -3.772 -3.396 0.870 444 HG SER 61 HG SER 61 -4.975 -3.074 -0.995 445 H GLY 62 HN GLY 62 -2.764 -2.851 -2.608 446 HA2 GLY 62 HA2 GLY 62 -0.741 -1.525 -3.940 447 HA3 GLY 62 HA1 GLY 62 0.018 -2.937 -3.211 448 H GLY 63 HN GLY 63 -0.060 -2.624 -5.960 449 HA2 GLY 63 HA2 GLY 63 -2.072 -4.648 -6.743 450 HA3 GLY 63 HA1 GLY 63 -1.499 -3.380 -7.822 451 H ALA 64 HN ALA 64 1.235 -3.505 -7.152 452 HA ALA 64 HA ALA 64 1.917 -6.042 -8.458 453 HB1 ALA 64 HB1 ALA 64 2.590 -4.031 -9.669 454 HB2 ALA 64 HB2 ALA 64 4.000 -4.947 -9.131 455 HB3 ALA 64 HB3 ALA 64 3.512 -3.490 -8.267 456 H GLY 65 HN GLY 65 2.078 -7.435 -6.760 457 HA2 GLY 65 HA2 GLY 65 3.289 -6.796 -4.269 458 HA3 GLY 65 HA1 GLY 65 2.875 -8.403 -4.843 459 H GLY 66 HN GLY 66 4.597 -7.812 -7.303 460 HA2 GLY 66 HA2 GLY 66 6.964 -9.023 -6.275 461 HA3 GLY 66 HA1 GLY 66 6.723 -8.464 -7.923 462 H GLN 67 HN GLN 67 6.087 -5.777 -7.189 463 HA GLN 67 HA GLN 67 7.083 -3.754 -7.073 464 HB2 GLN 67 HB2 GLN 67 7.147 -4.479 -4.648 465 HB3 GLN 67 HB1 GLN 67 8.844 -4.956 -4.916 466 HG2 GLN 67 HG2 GLN 67 9.173 -2.556 -5.747 467 HG3 GLN 67 HG1 GLN 67 7.622 -2.211 -4.985 468 HE21 GLN 67 HE21 GLN 67 8.461 -0.856 -3.481 469 HE22 GLN 67 HE22 GLN 67 9.472 -1.374 -2.178 470 H GLY 68 HN GLY 68 9.956 -5.628 -6.158 471 HA2 GLY 68 HA2 GLY 68 11.545 -6.144 -8.034 472 HA3 GLY 68 HA1 GLY 68 11.312 -4.468 -8.513 473 H MET 69 HN MET 69 11.220 -3.808 -5.523 474 HA MET 69 HA MET 69 12.661 -2.900 -4.017 475 HB2 MET 69 HB2 MET 69 14.256 -5.350 -4.795 476 HB3 MET 69 HB1 MET 69 14.727 -4.261 -3.496 477 HG2 MET 69 HG2 MET 69 12.656 -4.738 -2.322 478 HG3 MET 69 HG1 MET 69 12.136 -5.790 -3.635 479 HE1 MET 69 HE1 MET 69 12.885 -8.269 -0.660 480 HE2 MET 69 HE2 MET 69 11.683 -7.756 -1.846 481 HE3 MET 69 HE3 MET 69 12.188 -6.651 -0.568 482 H ILE 70 HN ILE 70 12.753 -1.927 -6.691 483 HA ILE 70 HA ILE 70 15.492 -0.891 -6.759 484 HB ILE 70 HB ILE 70 13.971 -1.823 -9.229 485 HG12 ILE 70 HG12 ILE 70 16.593 -2.804 -8.073 486 HG13 ILE 70 HG11 ILE 70 15.043 -3.628 -7.913 487 HG21 ILE 70 HG21 ILE 70 16.725 -0.571 -9.093 488 HG22 ILE 70 HG22 ILE 70 15.263 0.284 -9.589 489 HG23 ILE 70 HG23 ILE 70 15.861 -1.076 -10.545 490 HD11 ILE 70 HD11 ILE 70 16.484 -3.066 -10.500 491 HD12 ILE 70 HD12 ILE 70 14.935 -3.893 -10.339 492 HD13 ILE 70 HD13 ILE 70 16.397 -4.626 -9.677 493 H GLN 71 HN GLN 71 14.557 0.967 -5.737 494 HA GLN 71 HA GLN 71 12.731 2.504 -7.445 495 HB2 GLN 71 HB2 GLN 71 12.128 3.784 -5.495 496 HB3 GLN 71 HB1 GLN 71 12.003 2.081 -5.098 497 HG2 GLN 71 HG2 GLN 71 14.455 3.670 -4.453 498 HG3 GLN 71 HG1 GLN 71 13.056 3.641 -3.380 499 HE21 GLN 71 HE21 GLN 71 12.383 0.881 -3.924 500 HE22 GLN 71 HE22 GLN 71 13.571 -0.086 -3.112 501 H GLU 72 HN GLU 72 15.777 2.094 -7.398 502 HA GLU 72 HA GLU 72 16.867 4.674 -6.854 503 HB2 GLU 72 HB2 GLU 72 17.994 2.273 -8.292 504 HB3 GLU 72 HB1 GLU 72 18.906 3.737 -7.957 505 HG2 GLU 72 HG2 GLU 72 18.543 3.394 -5.554 506 HG3 GLU 72 HG1 GLU 72 17.701 1.885 -5.912 507 HA PRO 73 HA PRO 73 15.802 6.415 -10.803 508 HB2 PRO 73 HB2 PRO 73 16.913 8.842 -10.460 509 HB3 PRO 73 HB1 PRO 73 15.463 8.327 -9.512 510 HG2 PRO 73 HG2 PRO 73 18.367 8.355 -8.692 511 HG3 PRO 73 HG1 PRO 73 16.940 8.883 -7.780 512 HD2 PRO 73 HD2 PRO 73 18.150 6.443 -7.446 513 HD3 PRO 73 HD1 PRO 73 16.412 6.757 -7.119 514 H ALA 74 HN ALA 74 17.109 8.055 -12.291 515 HA ALA 74 HA ALA 74 18.732 8.447 -13.779 516 HB1 ALA 74 HB1 ALA 74 21.051 7.994 -13.294 517 HB2 ALA 74 HB2 ALA 74 20.591 6.934 -11.960 518 HB3 ALA 74 HB3 ALA 74 20.249 8.662 -11.872 519 H LEU 75 HN LEU 75 18.276 7.485 -15.592 520 HA LEU 75 HA LEU 75 18.468 4.578 -15.793 521 HB2 LEU 75 HB2 LEU 75 17.145 6.674 -17.495 522 HB3 LEU 75 HB1 LEU 75 17.408 5.052 -18.094 523 HG LEU 75 HG LEU 75 15.145 5.232 -17.334 524 HD11 LEU 75 HD11 LEU 75 16.770 3.691 -15.318 525 HD12 LEU 75 HD12 LEU 75 16.253 3.112 -16.901 526 HD13 LEU 75 HD13 LEU 75 15.053 3.470 -15.659 527 HD21 LEU 75 HD21 LEU 75 15.387 7.125 -15.829 528 HD22 LEU 75 HD22 LEU 75 16.260 6.115 -14.677 529 HD23 LEU 75 HD23 LEU 75 14.563 5.786 -15.031 530 HA PRO 76 HA PRO 76 22.162 4.930 -18.269 531 HB2 PRO 76 HB2 PRO 76 21.303 2.591 -19.872 532 HB3 PRO 76 HB1 PRO 76 22.671 2.700 -18.760 533 HG2 PRO 76 HG2 PRO 76 20.529 1.212 -18.164 534 HG3 PRO 76 HG1 PRO 76 21.372 2.181 -16.903 535 HD2 PRO 76 HD2 PRO 76 18.842 2.905 -18.442 536 HD3 PRO 76 HD1 PRO 76 19.139 2.953 -16.688 537 HA PRO 77 HA PRO 77 21.075 6.970 -22.056 538 HB2 PRO 77 HB2 PRO 77 23.138 6.363 -23.722 539 HB3 PRO 77 HB1 PRO 77 23.315 7.488 -22.365 540 HG2 PRO 77 HG2 PRO 77 23.948 4.568 -22.502 541 HG3 PRO 77 HG1 PRO 77 24.985 5.893 -21.922 542 HD2 PRO 77 HD2 PRO 77 23.653 4.380 -20.147 543 HD3 PRO 77 HD1 PRO 77 23.750 6.171 -19.934 544 H GLY 78 HN GLY 78 19.662 6.464 -23.609 545 HA2 GLY 78 HA2 GLY 78 18.824 5.169 -25.409 546 HA3 GLY 78 HA1 GLY 78 19.815 3.820 -24.877 547 H TRP 79 HN TRP 79 18.814 4.179 -22.040 548 HA TRP 79 HA TRP 79 16.382 2.575 -22.431 549 HB2 TRP 79 HB2 TRP 79 18.132 3.095 -20.005 550 HB3 TRP 79 HB1 TRP 79 16.593 2.254 -19.895 551 HD1 TRP 79 HD1 TRP 79 20.105 1.833 -21.436 552 HE1 TRP 79 HE1 TRP 79 20.498 -0.686 -21.837 553 HE3 TRP 79 HE3 TRP 79 15.475 0.075 -20.191 554 HZ2 TRP 79 HZ2 TRP 79 19.028 -3.095 -21.637 555 HZ3 TRP 79 HZ3 TRP 79 15.043 -2.334 -20.320 556 HH2 TRP 79 HH2 TRP 79 16.778 -3.890 -21.029 557 H GLU 80 HN GLU 80 14.330 3.189 -21.698 558 HA GLU 80 HA GLU 80 14.082 5.847 -20.455 559 HB2 GLU 80 HB2 GLU 80 13.314 5.792 -22.832 560 HB3 GLU 80 HB1 GLU 80 12.209 4.497 -22.415 561 HG2 GLU 80 HG2 GLU 80 11.000 6.547 -22.567 562 HG3 GLU 80 HG1 GLU 80 11.034 6.017 -20.887 563 H MET 81 HN MET 81 12.473 6.087 -18.872 564 HA MET 81 HA MET 81 11.240 3.588 -17.926 565 HB2 MET 81 HB2 MET 81 13.162 3.981 -16.506 566 HB3 MET 81 HB1 MET 81 12.669 5.668 -16.259 567 HG2 MET 81 HG2 MET 81 10.583 4.759 -15.174 568 HG3 MET 81 HG1 MET 81 11.367 3.191 -15.207 569 HE1 MET 81 HE1 MET 81 10.740 3.433 -12.470 570 HE2 MET 81 HE2 MET 81 10.314 5.135 -12.654 571 HE3 MET 81 HE3 MET 81 11.509 4.651 -11.452 572 H LYS 82 HN LYS 82 9.074 3.785 -17.481 573 HA LYS 82 HA LYS 82 7.935 6.351 -16.780 574 HB2 LYS 82 HB2 LYS 82 7.077 4.978 -19.356 575 HB3 LYS 82 HB1 LYS 82 6.256 6.339 -18.628 576 HG2 LYS 82 HG2 LYS 82 8.180 7.758 -19.010 577 HG3 LYS 82 HG1 LYS 82 9.083 6.364 -19.680 578 HD2 LYS 82 HD2 LYS 82 7.398 6.160 -21.453 579 HD3 LYS 82 HD1 LYS 82 6.535 7.549 -20.797 580 HE2 LYS 82 HE2 LYS 82 9.343 7.556 -21.891 581 HE3 LYS 82 HE1 LYS 82 7.917 8.186 -22.706 582 HZ1 LYS 82 HZ1 LYS 82 9.068 10.004 -21.738 583 HZ2 LYS 82 HZ2 LYS 82 9.180 9.235 -20.230 584 HZ3 LYS 82 HZ3 LYS 82 7.672 9.756 -20.801 585 H TYR 83 HN TYR 83 5.595 6.096 -16.167 586 HA TYR 83 HA TYR 83 5.152 3.355 -15.146 587 HB2 TYR 83 HB2 TYR 83 4.262 6.061 -14.089 588 HB3 TYR 83 HB1 TYR 83 3.513 4.540 -13.544 589 HD1 TYR 83 HD1 TYR 83 4.491 3.351 -11.770 590 HD2 TYR 83 HD2 TYR 83 6.793 6.277 -13.822 591 HE1 TYR 83 HE1 TYR 83 6.284 3.094 -10.112 592 HE2 TYR 83 HE2 TYR 83 8.598 6.027 -12.170 593 HH TYR 83 HH TYR 83 8.779 3.474 -10.023 594 H THR 84 HN THR 84 3.089 2.416 -15.258 595 HA THR 84 HA THR 84 1.461 3.310 -17.489 596 HB THR 84 HB THR 84 0.277 1.232 -17.328 597 HG1 THR 84 HG1 THR 84 0.619 -0.179 -15.511 598 HG21 THR 84 HG21 THR 84 3.151 0.651 -16.618 599 HG22 THR 84 HG22 THR 84 2.557 1.059 -18.230 600 HG23 THR 84 HG23 THR 84 2.030 -0.428 -17.446 601 H SER 85 HN SER 85 -1.087 2.709 -16.824 602 HA SER 85 HA SER 85 -1.752 4.843 -15.014 603 HB2 SER 85 HB2 SER 85 -3.620 3.085 -16.493 604 HB3 SER 85 HB1 SER 85 -3.941 4.696 -15.881 605 HG SER 85 HG SER 85 -2.173 5.359 -17.353 606 H GLU 86 HN GLU 86 -0.796 1.963 -14.266 607 HA GLU 86 HA GLU 86 -2.860 1.503 -12.173 608 HB2 GLU 86 HB2 GLU 86 -1.110 -0.573 -13.548 609 HB3 GLU 86 HB1 GLU 86 -2.243 -0.905 -12.249 610 HG2 GLU 86 HG2 GLU 86 -4.089 -0.173 -13.717 611 HG3 GLU 86 HG1 GLU 86 -2.921 0.066 -15.014 612 H GLY 87 HN GLY 87 0.101 2.698 -12.714 613 HA2 GLY 87 HA2 GLY 87 1.711 3.302 -11.155 614 HA3 GLY 87 HA1 GLY 87 0.998 2.174 -10.014 615 H VAL 88 HN VAL 88 1.720 0.956 -13.165 616 HA VAL 88 HA VAL 88 3.863 -0.643 -11.996 617 HB VAL 88 HB VAL 88 2.400 -1.009 -14.619 618 HG11 VAL 88 HG11 VAL 88 4.345 -2.845 -13.224 619 HG12 VAL 88 HG12 VAL 88 4.683 -1.911 -14.681 620 HG13 VAL 88 HG13 VAL 88 3.470 -3.190 -14.715 621 HG21 VAL 88 HG21 VAL 88 0.942 -1.402 -12.735 622 HG22 VAL 88 HG22 VAL 88 2.151 -2.432 -11.972 623 HG23 VAL 88 HG23 VAL 88 1.377 -2.943 -13.472 624 H ARG 89 HN ARG 89 5.916 -0.421 -12.516 625 HA ARG 89 HA ARG 89 6.784 1.718 -14.235 626 HB2 ARG 89 HB2 ARG 89 7.972 1.363 -12.189 627 HB3 ARG 89 HB1 ARG 89 8.208 -0.337 -12.540 628 HG2 ARG 89 HG2 ARG 89 9.754 0.245 -14.333 629 HG3 ARG 89 HG1 ARG 89 9.494 1.960 -14.001 630 HD2 ARG 89 HD2 ARG 89 10.503 1.808 -11.875 631 HD3 ARG 89 HD1 ARG 89 10.441 0.049 -11.886 632 HE ARG 89 HE ARG 89 12.043 0.583 -13.975 633 HH11 ARG 89 HH11 ARG 89 12.077 1.731 -10.667 634 HH12 ARG 89 HH12 ARG 89 13.800 1.874 -10.597 635 HH21 ARG 89 HH21 ARG 89 14.320 0.748 -13.881 636 HH22 ARG 89 HH22 ARG 89 15.078 1.314 -12.431 637 H TYR 90 HN TYR 90 7.048 1.502 -16.392 638 HA TYR 90 HA TYR 90 7.905 -1.133 -17.392 639 HB2 TYR 90 HB2 TYR 90 6.539 -0.959 -19.357 640 HB3 TYR 90 HB1 TYR 90 5.496 -0.641 -17.995 641 HD1 TYR 90 HD1 TYR 90 4.698 1.682 -17.576 642 HD2 TYR 90 HD2 TYR 90 6.905 0.666 -21.058 643 HE1 TYR 90 HE1 TYR 90 4.031 3.812 -18.612 644 HE2 TYR 90 HE2 TYR 90 6.250 2.786 -22.113 645 HH TYR 90 HH TYR 90 4.671 4.515 -21.970 646 H PHE 91 HN PHE 91 9.150 -0.976 -19.510 647 HA PHE 91 HA PHE 91 10.712 1.520 -19.493 648 HB2 PHE 91 HB2 PHE 91 11.629 -1.292 -20.102 649 HB3 PHE 91 HB1 PHE 91 12.636 0.132 -20.251 650 HD1 PHE 91 HD1 PHE 91 11.409 1.363 -17.570 651 HD2 PHE 91 HD2 PHE 91 13.251 -2.363 -18.552 652 HE1 PHE 91 HE1 PHE 91 12.120 1.109 -15.252 653 HE2 PHE 91 HE2 PHE 91 13.950 -2.619 -16.229 654 HZ PHE 91 HZ PHE 91 13.444 -0.927 -14.591 655 H VAL 92 HN VAL 92 11.628 2.194 -21.463 656 HA VAL 92 HA VAL 92 10.333 1.084 -23.868 657 HB VAL 92 HB VAL 92 11.054 3.996 -23.585 658 HG11 VAL 92 HG11 VAL 92 10.862 3.194 -25.850 659 HG12 VAL 92 HG12 VAL 92 9.494 4.243 -25.476 660 HG13 VAL 92 HG13 VAL 92 9.281 2.492 -25.503 661 HG21 VAL 92 HG21 VAL 92 8.736 4.510 -23.142 662 HG22 VAL 92 HG22 VAL 92 9.366 3.445 -21.882 663 HG23 VAL 92 HG23 VAL 92 8.328 2.795 -23.151 664 H ASP 93 HN ASP 93 11.981 0.013 -24.825 665 HA ASP 93 HA ASP 93 14.714 1.004 -24.692 666 HB2 ASP 93 HB2 ASP 93 14.404 -1.391 -24.772 667 HB3 ASP 93 HB1 ASP 93 13.400 -1.284 -26.212 668 H HIS 94 HN HIS 94 15.548 2.513 -26.141 669 HA HIS 94 HA HIS 94 13.676 3.603 -28.048 670 HB2 HIS 94 HB2 HIS 94 16.428 4.488 -27.189 671 HB3 HIS 94 HB1 HIS 94 15.512 5.299 -28.448 672 HD1 HIS 94 HD1 HIS 94 16.216 5.636 -25.020 673 HD2 HIS 94 HD2 HIS 94 12.762 5.995 -27.298 674 HE1 HIS 94 HE1 HIS 94 14.667 7.079 -23.671 675 HE2 HIS 94 HE2 HIS 94 12.628 7.386 -25.121 676 H ASN 95 HN ASN 95 16.373 1.429 -28.256 677 HA ASN 95 HA ASN 95 17.005 2.196 -30.980 678 HB2 ASN 95 HB2 ASN 95 18.676 0.408 -30.988 679 HB3 ASN 95 HB1 ASN 95 18.837 1.369 -29.522 680 HD21 ASN 95 HD21 ASN 95 18.524 0.436 -27.583 681 HD22 ASN 95 HD22 ASN 95 18.204 -1.244 -27.350 682 H THR 96 HN THR 96 15.079 -0.283 -29.383 683 HA THR 96 HA THR 96 14.426 -1.408 -32.012 684 HB THR 96 HB THR 96 13.103 -3.096 -30.742 685 HG1 THR 96 HG1 THR 96 14.280 -1.826 -28.462 686 HG21 THR 96 HG21 THR 96 14.987 -4.346 -29.883 687 HG22 THR 96 HG22 THR 96 15.968 -2.886 -29.812 688 HG23 THR 96 HG23 THR 96 15.452 -3.524 -31.372 689 H ARG 97 HN ARG 97 13.155 0.547 -29.450 690 HA ARG 97 HA ARG 97 11.346 1.928 -29.315 691 HB2 ARG 97 HB2 ARG 97 11.075 1.264 -32.249 692 HB3 ARG 97 HB1 ARG 97 10.108 2.478 -31.407 693 HG2 ARG 97 HG2 ARG 97 12.041 3.765 -30.897 694 HG3 ARG 97 HG1 ARG 97 13.101 2.485 -31.471 695 HD2 ARG 97 HD2 ARG 97 11.101 3.698 -33.320 696 HD3 ARG 97 HD1 ARG 97 12.600 4.555 -32.980 697 HE ARG 97 HE ARG 97 12.951 1.802 -33.791 698 HH11 ARG 97 HH11 ARG 97 12.610 5.111 -34.883 699 HH12 ARG 97 HH12 ARG 97 13.527 4.863 -36.340 700 HH21 ARG 97 HH21 ARG 97 14.149 1.463 -35.728 701 HH22 ARG 97 HH22 ARG 97 14.384 2.794 -36.828 702 H THR 98 HN THR 98 11.223 -0.475 -28.398 703 HA THR 98 HA THR 98 8.465 -1.415 -28.891 704 HB THR 98 HB THR 98 10.448 -3.251 -27.591 705 HG1 THR 98 HG1 THR 98 11.747 -2.728 -29.269 706 HG21 THR 98 HG21 THR 98 8.195 -4.084 -27.919 707 HG22 THR 98 HG22 THR 98 9.266 -4.920 -29.038 708 HG23 THR 98 HG23 THR 98 8.227 -3.627 -29.626 709 H THR 99 HN THR 99 7.200 -1.897 -26.941 710 HA THR 99 HA THR 99 8.170 -0.502 -24.565 711 HB THR 99 HB THR 99 5.861 -1.348 -23.661 712 HG1 THR 99 HG1 THR 99 5.519 -2.874 -25.338 713 HG21 THR 99 HG21 THR 99 4.651 0.518 -24.760 714 HG22 THR 99 HG22 THR 99 5.913 0.635 -25.983 715 HG23 THR 99 HG23 THR 99 6.281 1.030 -24.304 716 H THR 100 HN THR 100 9.412 -1.575 -23.125 717 HA THR 100 HA THR 100 9.279 -4.491 -23.063 718 HB THR 100 HB THR 100 11.427 -2.458 -22.841 719 HG1 THR 100 HG1 THR 100 11.416 -3.700 -24.666 720 HG21 THR 100 HG21 THR 100 12.854 -3.712 -21.454 721 HG22 THR 100 HG22 THR 100 11.769 -5.103 -21.472 722 HG23 THR 100 HG23 THR 100 11.295 -3.638 -20.601 723 H PHE 101 HN PHE 101 9.336 -5.524 -21.010 724 HA PHE 101 HA PHE 101 8.374 -3.856 -18.837 725 HB2 PHE 101 HB2 PHE 101 7.931 -6.643 -19.614 726 HB3 PHE 101 HB1 PHE 101 8.252 -6.410 -17.841 727 HD1 PHE 101 HD1 PHE 101 5.749 -6.605 -20.203 728 HD2 PHE 101 HD2 PHE 101 6.969 -4.194 -16.915 729 HE1 PHE 101 HE1 PHE 101 3.431 -5.858 -19.902 730 HE2 PHE 101 HE2 PHE 101 4.643 -3.442 -16.600 731 HZ PHE 101 HZ PHE 101 2.917 -4.157 -18.060 732 H LYS 102 HN LYS 102 9.186 -3.962 -16.843 733 HA LYS 102 HA LYS 102 11.819 -3.540 -16.457 734 HB2 LYS 102 HB2 LYS 102 11.411 -3.816 -14.043 735 HB3 LYS 102 HB1 LYS 102 10.113 -2.921 -14.825 736 HG2 LYS 102 HG2 LYS 102 8.654 -4.776 -14.748 737 HG3 LYS 102 HG1 LYS 102 9.956 -5.875 -14.303 738 HD2 LYS 102 HD2 LYS 102 8.632 -5.439 -12.359 739 HD3 LYS 102 HD1 LYS 102 10.186 -4.631 -12.153 740 HE2 LYS 102 HE2 LYS 102 9.223 -2.501 -12.652 741 HE3 LYS 102 HE1 LYS 102 7.712 -3.248 -13.177 742 HZ1 LYS 102 HZ1 LYS 102 7.612 -2.269 -10.916 743 HZ2 LYS 102 HZ2 LYS 102 8.764 -3.402 -10.398 744 HZ3 LYS 102 HZ3 LYS 102 7.246 -3.924 -10.949 745 H ASP 103 HN ASP 103 13.437 -4.627 -15.257 746 HA ASP 103 HA ASP 103 14.413 -6.905 -16.291 747 HB2 ASP 103 HB2 ASP 103 14.802 -6.257 -13.373 748 HB3 ASP 103 HB1 ASP 103 15.953 -6.975 -14.489 749 HA PRO 104 HA PRO 104 11.462 -9.941 -14.678 750 HB2 PRO 104 HB2 PRO 104 12.452 -12.034 -16.145 751 HB3 PRO 104 HB1 PRO 104 11.310 -10.855 -16.795 752 HG2 PRO 104 HG2 PRO 104 14.276 -11.002 -17.120 753 HG3 PRO 104 HG1 PRO 104 13.036 -10.585 -18.316 754 HD2 PRO 104 HD2 PRO 104 14.557 -8.720 -17.070 755 HD3 PRO 104 HD1 PRO 104 12.886 -8.400 -17.579 756 H ARG 105 HN ARG 105 14.891 -10.674 -15.180 757 HA ARG 105 HA ARG 105 14.903 -12.162 -12.651 758 HB2 ARG 105 HB2 ARG 105 16.451 -12.546 -15.194 759 HB3 ARG 105 HB1 ARG 105 17.100 -13.116 -13.666 760 HG2 ARG 105 HG2 ARG 105 16.020 -14.920 -14.824 761 HG3 ARG 105 HG1 ARG 105 15.115 -14.532 -13.359 762 HD2 ARG 105 HD2 ARG 105 13.523 -13.232 -14.761 763 HD3 ARG 105 HD1 ARG 105 14.405 -13.765 -16.192 764 HE ARG 105 HE ARG 105 13.773 -16.044 -15.634 765 HH11 ARG 105 HH11 ARG 105 11.960 -13.469 -14.078 766 HH12 ARG 105 HH12 ARG 105 10.590 -14.479 -13.735 767 HH21 ARG 105 HH21 ARG 105 11.970 -17.343 -15.199 768 HH22 ARG 105 HH22 ARG 105 10.585 -16.664 -14.398 769 HA PRO 106 HA PRO 106 17.276 -8.502 -11.355 770 HB2 PRO 106 HB2 PRO 106 18.065 -10.444 -9.209 771 HB3 PRO 106 HB1 PRO 106 17.505 -8.736 -9.059 772 HG2 PRO 106 HG2 PRO 106 15.886 -10.819 -8.512 773 HG3 PRO 106 HG1 PRO 106 15.288 -9.343 -9.252 774 HD2 PRO 106 HD2 PRO 106 15.669 -11.978 -10.424 775 HD3 PRO 106 HD1 PRO 106 14.539 -10.679 -10.892 776 H GLY 107 HN GLY 107 19.129 -8.097 -12.413 777 HA2 GLY 107 HA2 GLY 107 21.439 -8.240 -12.736 778 HA3 GLY 107 HA1 GLY 107 21.430 -9.841 -11.963 779 H PHE 108 HN PHE 108 19.229 -10.819 -13.698 780 HA PHE 108 HA PHE 108 19.411 -12.420 -15.416 781 HB2 PHE 108 HB2 PHE 108 19.088 -11.184 -17.634 782 HB3 PHE 108 HB1 PHE 108 17.916 -10.807 -16.329 783 HD1 PHE 108 HD1 PHE 108 20.548 -9.505 -18.512 784 HD2 PHE 108 HD2 PHE 108 18.032 -8.629 -15.184 785 HE1 PHE 108 HE1 PHE 108 21.021 -7.116 -18.776 786 HE2 PHE 108 HE2 PHE 108 18.513 -6.233 -15.455 787 HZ PHE 108 HZ PHE 108 19.973 -5.474 -17.283 788 H GLU 109 HN GLU 109 21.648 -13.055 -14.777 789 HA GLU 109 HA GLU 109 23.447 -12.725 -17.053 790 HB2 GLU 109 HB2 GLU 109 24.167 -11.034 -15.406 791 HB3 GLU 109 HB1 GLU 109 24.292 -12.278 -14.173 792 HG2 GLU 109 HG2 GLU 109 26.460 -11.620 -15.062 793 HG3 GLU 109 HG1 GLU 109 26.110 -13.319 -15.350
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