NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
610666 | 2n77 | 25796 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 76 HT1 MET 76 12.636 -16.424 -20.708 2 H2 MET 76 HT2 MET 76 12.822 -17.603 -21.916 3 H3 MET 76 HT3 MET 76 11.345 -17.456 -21.089 4 HA MET 76 HA MET 76 12.537 -15.546 -23.013 5 HB2 MET 76 HB2 MET 76 10.034 -15.991 -23.878 6 HB3 MET 76 HB1 MET 76 11.386 -17.022 -24.344 7 HG2 MET 76 HG2 MET 76 10.846 -18.607 -22.569 8 HG3 MET 76 HG1 MET 76 9.563 -17.552 -21.978 9 HE1 MET 76 HE1 MET 76 8.067 -20.827 -23.634 10 HE2 MET 76 HE2 MET 76 7.736 -19.746 -22.283 11 HE3 MET 76 HE3 MET 76 9.350 -20.423 -22.485 12 H LYS 77 HN LYS 77 9.178 -15.798 -22.084 13 HA LYS 77 HA LYS 77 9.357 -13.106 -20.870 14 HB2 LYS 77 HB2 LYS 77 8.085 -13.219 -22.986 15 HB3 LYS 77 HB1 LYS 77 7.002 -14.403 -22.262 16 HG2 LYS 77 HG2 LYS 77 6.361 -12.768 -20.521 17 HG3 LYS 77 HG1 LYS 77 7.446 -11.579 -21.237 18 HD2 LYS 77 HD2 LYS 77 5.288 -12.863 -22.899 19 HD3 LYS 77 HD1 LYS 77 4.909 -11.500 -21.850 20 HE2 LYS 77 HE2 LYS 77 7.024 -11.502 -24.030 21 HE3 LYS 77 HE1 LYS 77 5.447 -10.728 -24.126 22 HZ1 LYS 77 HZ1 LYS 77 7.691 -10.053 -22.321 23 HZ2 LYS 77 HZ2 LYS 77 6.111 -9.482 -22.068 24 HZ3 LYS 77 HZ3 LYS 77 6.952 -9.065 -23.485 25 H ASP 78 HN ASP 78 8.909 -12.952 -18.780 26 HA ASP 78 HA ASP 78 7.470 -15.165 -17.459 27 HB2 ASP 78 HB2 ASP 78 9.429 -13.110 -16.422 28 HB3 ASP 78 HB1 ASP 78 8.478 -14.149 -15.362 29 H THR 79 HN THR 79 6.208 -14.352 -15.435 30 HA THR 79 HA THR 79 4.152 -12.636 -16.336 31 HB THR 79 HB THR 79 3.256 -12.853 -14.074 32 HG1 THR 79 HG1 THR 79 4.992 -14.423 -12.920 33 HG21 THR 79 HG21 THR 79 3.348 -14.806 -15.799 34 HG22 THR 79 HG22 THR 79 2.890 -15.168 -14.135 35 HG23 THR 79 HG23 THR 79 4.528 -15.508 -14.692 36 H ASP 80 HN ASP 80 3.555 -11.014 -14.176 37 HA ASP 80 HA ASP 80 5.689 -8.976 -14.353 38 HB2 ASP 80 HB2 ASP 80 2.692 -8.713 -14.094 39 HB3 ASP 80 HB1 ASP 80 3.801 -7.365 -13.845 40 H SER 81 HN SER 81 6.090 -7.673 -12.507 41 HA SER 81 HA SER 81 5.936 -9.131 -10.005 42 HB2 SER 81 HB2 SER 81 7.107 -6.419 -10.677 43 HB3 SER 81 HB1 SER 81 7.245 -7.218 -9.112 44 HG SER 81 HG SER 81 8.160 -8.197 -11.622 45 H GLU 82 HN GLU 82 3.869 -7.095 -11.622 46 HA GLU 82 HA GLU 82 2.924 -5.349 -9.653 47 HB2 GLU 82 HB2 GLU 82 1.471 -6.756 -11.904 48 HB3 GLU 82 HB1 GLU 82 0.747 -5.484 -10.918 49 HG2 GLU 82 HG2 GLU 82 2.481 -3.914 -11.607 50 HG3 GLU 82 HG1 GLU 82 3.302 -5.177 -12.517 51 H GLU 83 HN GLU 83 2.248 -8.709 -10.307 52 HA GLU 83 HA GLU 83 0.114 -9.094 -8.494 53 HB2 GLU 83 HB2 GLU 83 0.564 -11.450 -8.729 54 HB3 GLU 83 HB1 GLU 83 0.839 -10.694 -10.298 55 HG2 GLU 83 HG2 GLU 83 3.301 -10.514 -9.643 56 HG3 GLU 83 HG1 GLU 83 2.921 -11.560 -8.277 57 H GLU 84 HN GLU 84 3.604 -9.053 -8.091 58 HA GLU 84 HA GLU 84 3.739 -10.233 -5.528 59 HB2 GLU 84 HB2 GLU 84 5.707 -9.883 -7.013 60 HB3 GLU 84 HB1 GLU 84 5.587 -8.150 -6.721 61 HG2 GLU 84 HG2 GLU 84 5.923 -8.494 -4.319 62 HG3 GLU 84 HG1 GLU 84 5.986 -10.239 -4.564 63 H ILE 85 HN ILE 85 3.366 -6.875 -6.582 64 HA ILE 85 HA ILE 85 3.431 -5.739 -3.974 65 HB ILE 85 HB ILE 85 2.292 -4.702 -6.581 66 HG12 ILE 85 HG12 ILE 85 4.868 -5.093 -6.104 67 HG13 ILE 85 HG11 ILE 85 4.328 -3.607 -6.881 68 HG21 ILE 85 HG21 ILE 85 2.499 -2.465 -5.276 69 HG22 ILE 85 HG22 ILE 85 2.497 -3.473 -3.826 70 HG23 ILE 85 HG23 ILE 85 1.115 -3.500 -4.925 71 HD11 ILE 85 HD11 ILE 85 4.576 -3.770 -3.876 72 HD12 ILE 85 HD12 ILE 85 4.565 -2.343 -4.906 73 HD13 ILE 85 HD13 ILE 85 5.973 -3.403 -4.885 74 H ARG 86 HN ARG 86 0.855 -6.924 -6.082 75 HA ARG 86 HA ARG 86 -1.348 -6.014 -4.584 76 HB2 ARG 86 HB2 ARG 86 -1.012 -8.361 -6.455 77 HB3 ARG 86 HB1 ARG 86 -2.561 -7.906 -5.743 78 HG2 ARG 86 HG2 ARG 86 -2.375 -5.663 -6.736 79 HG3 ARG 86 HG1 ARG 86 -0.813 -6.092 -7.431 80 HD2 ARG 86 HD2 ARG 86 -1.881 -7.886 -8.740 81 HD3 ARG 86 HD1 ARG 86 -3.442 -7.474 -8.037 82 HE ARG 86 HE ARG 86 -2.366 -5.157 -9.221 83 HH11 ARG 86 HH21 ARG 86 -3.556 -8.298 -10.054 84 HH12 ARG 86 HH22 ARG 86 -4.131 -7.817 -11.615 85 HH21 ARG 86 HH11 ARG 86 -3.119 -4.519 -11.267 86 HH22 ARG 86 HH12 ARG 86 -3.884 -5.678 -12.302 87 H GLU 87 HN GLU 87 0.633 -8.924 -4.326 88 HA GLU 87 HA GLU 87 -0.962 -10.413 -2.578 89 HB2 GLU 87 HB2 GLU 87 1.136 -11.252 -3.620 90 HB3 GLU 87 HB1 GLU 87 2.062 -10.199 -2.551 91 HG2 GLU 87 HG2 GLU 87 1.992 -12.440 -1.597 92 HG3 GLU 87 HG1 GLU 87 1.038 -11.357 -0.589 93 H ALA 88 HN ALA 88 1.340 -7.807 -1.960 94 HA ALA 88 HA ALA 88 1.286 -7.855 0.844 95 HB1 ALA 88 HB1 ALA 88 2.181 -5.626 0.745 96 HB2 ALA 88 HB2 ALA 88 1.549 -5.386 -0.884 97 HB3 ALA 88 HB3 ALA 88 2.864 -6.528 -0.608 98 H PHE 89 HN PHE 89 -0.971 -6.487 -1.502 99 HA PHE 89 HA PHE 89 -2.479 -5.093 0.555 100 HB2 PHE 89 HB2 PHE 89 -2.897 -5.487 -2.405 101 HB3 PHE 89 HB1 PHE 89 -4.099 -4.708 -1.373 102 HD1 PHE 89 HD2 PHE 89 -3.542 -2.612 -0.153 103 HD2 PHE 89 HD1 PHE 89 -0.836 -4.375 -2.979 104 HE1 PHE 89 HE2 PHE 89 -2.259 -0.493 -0.245 105 HE2 PHE 89 HE1 PHE 89 0.458 -2.258 -3.067 106 HZ PHE 89 HZ PHE 89 -0.260 -0.316 -1.701 107 H ARG 90 HN ARG 90 -2.822 -7.992 -1.444 108 HA ARG 90 HA ARG 90 -5.386 -8.762 -0.773 109 HB2 ARG 90 HB2 ARG 90 -2.946 -10.458 -1.296 110 HB3 ARG 90 HB1 ARG 90 -4.562 -11.137 -1.105 111 HG2 ARG 90 HG2 ARG 90 -5.379 -9.743 -2.964 112 HG3 ARG 90 HG1 ARG 90 -3.772 -9.045 -3.155 113 HD2 ARG 90 HD2 ARG 90 -2.860 -11.291 -3.639 114 HD3 ARG 90 HD1 ARG 90 -4.471 -11.978 -3.465 115 HE ARG 90 HE ARG 90 -3.474 -10.451 -5.725 116 HH11 ARG 90 HH21 ARG 90 -6.207 -11.615 -3.950 117 HH12 ARG 90 HH22 ARG 90 -7.293 -11.528 -5.297 118 HH21 ARG 90 HH11 ARG 90 -4.893 -10.334 -7.496 119 HH22 ARG 90 HH12 ARG 90 -6.549 -10.803 -7.304 120 H VAL 91 HN VAL 91 -2.573 -8.747 1.204 121 HA VAL 91 HA VAL 91 -3.300 -10.631 3.177 122 HB VAL 91 HB VAL 91 -1.632 -8.113 3.339 123 HG11 VAL 91 HG11 VAL 91 -2.109 -8.336 5.587 124 HG12 VAL 91 HG12 VAL 91 -0.839 -9.553 5.474 125 HG13 VAL 91 HG13 VAL 91 -2.531 -10.042 5.434 126 HG21 VAL 91 HG21 VAL 91 0.068 -9.437 2.650 127 HG22 VAL 91 HG22 VAL 91 -1.161 -10.622 2.208 128 HG23 VAL 91 HG23 VAL 91 -0.376 -10.712 3.785 129 H PHE 92 HN PHE 92 -4.131 -7.240 2.717 130 HA PHE 92 HA PHE 92 -5.640 -7.152 5.212 131 HB2 PHE 92 HB2 PHE 92 -5.522 -5.030 3.066 132 HB3 PHE 92 HB1 PHE 92 -5.922 -4.827 4.773 133 HD1 PHE 92 HD2 PHE 92 -3.984 -6.024 6.357 134 HD2 PHE 92 HD1 PHE 92 -3.400 -4.255 2.495 135 HE1 PHE 92 HE2 PHE 92 -1.583 -5.725 6.864 136 HE2 PHE 92 HE1 PHE 92 -0.993 -3.960 3.000 137 HZ PHE 92 HZ PHE 92 -0.083 -4.693 5.182 138 H ASP 93 HN ASP 93 -6.221 -7.851 1.881 139 HA ASP 93 HA ASP 93 -9.090 -7.293 2.065 140 HB2 ASP 93 HB2 ASP 93 -7.779 -6.912 -0.063 141 HB3 ASP 93 HB1 ASP 93 -7.613 -8.661 -0.183 142 H LYS 94 HN LYS 94 -9.238 -8.866 3.948 143 HA LYS 94 HA LYS 94 -8.860 -11.649 3.485 144 HB2 LYS 94 HB2 LYS 94 -10.019 -11.929 5.601 145 HB3 LYS 94 HB1 LYS 94 -8.856 -10.614 5.727 146 HG2 LYS 94 HG2 LYS 94 -10.677 -8.980 5.342 147 HG3 LYS 94 HG1 LYS 94 -11.839 -10.302 5.261 148 HD2 LYS 94 HD2 LYS 94 -11.246 -10.972 7.560 149 HD3 LYS 94 HD1 LYS 94 -10.100 -9.634 7.650 150 HE2 LYS 94 HE2 LYS 94 -11.936 -8.029 7.288 151 HE3 LYS 94 HE1 LYS 94 -13.086 -9.362 7.190 152 HZ1 LYS 94 HZ1 LYS 94 -13.218 -9.397 9.384 153 HZ2 LYS 94 HZ2 LYS 94 -12.177 -8.057 9.471 154 HZ3 LYS 94 HZ3 LYS 94 -11.545 -9.633 9.526 155 H ASP 95 HN ASP 95 -11.373 -9.424 2.745 156 HA ASP 95 HA ASP 95 -13.490 -11.373 2.580 157 HB2 ASP 95 HB2 ASP 95 -13.241 -8.517 1.636 158 HB3 ASP 95 HB1 ASP 95 -14.689 -9.492 1.386 159 H GLY 96 HN GLY 96 -11.006 -10.161 0.475 160 HA2 GLY 96 HA2 GLY 96 -10.339 -10.844 -1.620 161 HA3 GLY 96 HA1 GLY 96 -11.440 -12.208 -1.449 162 H ASN 97 HN ASN 97 -12.502 -8.869 -1.195 163 HA ASN 97 HA ASN 97 -14.184 -9.295 -3.570 164 HB2 ASN 97 HB2 ASN 97 -15.231 -7.080 -2.672 165 HB3 ASN 97 HB1 ASN 97 -15.576 -8.596 -1.843 166 HD21 ASN 97 HD21 ASN 97 -12.581 -6.617 -1.692 167 HD22 ASN 97 HD22 ASN 97 -12.672 -6.338 -0.021 168 H GLY 98 HN GLY 98 -11.237 -7.987 -2.882 169 HA2 GLY 98 HA2 GLY 98 -9.900 -6.880 -4.497 170 HA3 GLY 98 HA1 GLY 98 -11.365 -6.270 -5.257 171 H TYR 99 HN TYR 99 -11.572 -5.939 -1.929 172 HA TYR 99 HA TYR 99 -10.399 -3.231 -1.956 173 HB2 TYR 99 HB2 TYR 99 -13.135 -3.882 -0.846 174 HB3 TYR 99 HB1 TYR 99 -12.344 -2.304 -0.871 175 HD1 TYR 99 HD1 TYR 99 -13.453 -5.048 -3.141 176 HD2 TYR 99 HD2 TYR 99 -12.666 -0.855 -2.681 177 HE1 TYR 99 HE1 TYR 99 -14.334 -4.641 -5.423 178 HE2 TYR 99 HE2 TYR 99 -13.547 -0.442 -4.969 179 HH TYR 99 HH TYR 99 -13.810 -1.829 -7.115 180 H ILE 100 HN ILE 100 -9.970 -2.340 0.138 181 HA ILE 100 HA ILE 100 -9.895 -4.299 2.347 182 HB ILE 100 HB ILE 100 -7.645 -3.954 2.781 183 HG12 ILE 100 HG12 ILE 100 -8.037 -1.238 1.506 184 HG13 ILE 100 HG11 ILE 100 -7.665 -1.588 3.196 185 HG21 ILE 100 HG21 ILE 100 -8.067 -4.619 0.261 186 HG22 ILE 100 HG22 ILE 100 -6.438 -4.205 0.800 187 HG23 ILE 100 HG23 ILE 100 -7.417 -3.007 -0.051 188 HD11 ILE 100 HD11 ILE 100 -5.868 -1.768 0.792 189 HD12 ILE 100 HD12 ILE 100 -5.526 -2.720 2.239 190 HD13 ILE 100 HD13 ILE 100 -5.589 -0.962 2.331 191 H SER 101 HN SER 101 -10.294 -3.332 4.416 192 HA SER 101 HA SER 101 -11.879 -1.022 4.413 193 HB2 SER 101 HB2 SER 101 -11.972 -2.645 6.236 194 HB3 SER 101 HB1 SER 101 -10.307 -2.277 6.681 195 HG SER 101 HG SER 101 -10.927 -0.282 7.346 196 H ALA 102 HN ALA 102 -11.424 1.117 4.576 197 HA ALA 102 HA ALA 102 -8.793 2.031 4.046 198 HB1 ALA 102 HB1 ALA 102 -9.744 4.083 3.748 199 HB2 ALA 102 HB2 ALA 102 -10.759 3.939 5.185 200 HB3 ALA 102 HB3 ALA 102 -11.222 3.122 3.691 201 H ALA 103 HN ALA 103 -10.702 1.817 6.997 202 HA ALA 103 HA ALA 103 -9.086 3.375 8.678 203 HB1 ALA 103 HB1 ALA 103 -10.182 1.215 10.181 204 HB2 ALA 103 HB2 ALA 103 -11.353 1.688 8.949 205 HB3 ALA 103 HB3 ALA 103 -10.739 2.886 10.089 206 H GLU 104 HN GLU 104 -8.861 -0.118 7.975 207 HA GLU 104 HA GLU 104 -6.817 -0.614 9.887 208 HB2 GLU 104 HB2 GLU 104 -6.611 -2.765 8.953 209 HB3 GLU 104 HB1 GLU 104 -8.305 -2.340 8.748 210 HG2 GLU 104 HG2 GLU 104 -7.965 -2.964 6.594 211 HG3 GLU 104 HG1 GLU 104 -7.259 -1.368 6.437 212 H LEU 105 HN LEU 105 -6.796 0.649 6.676 213 HA LEU 105 HA LEU 105 -4.101 0.158 5.983 214 HB2 LEU 105 HB2 LEU 105 -5.839 1.003 4.394 215 HB3 LEU 105 HB1 LEU 105 -5.795 2.551 5.230 216 HG LEU 105 HG LEU 105 -3.355 2.729 4.716 217 HD11 LEU 105 HD11 LEU 105 -3.920 0.053 3.520 218 HD12 LEU 105 HD12 LEU 105 -2.494 0.621 4.365 219 HD13 LEU 105 HD13 LEU 105 -2.769 1.097 2.694 220 HD21 LEU 105 HD21 LEU 105 -5.043 3.782 3.247 221 HD22 LEU 105 HD22 LEU 105 -5.162 2.290 2.314 222 HD23 LEU 105 HD23 LEU 105 -3.660 3.216 2.311 223 H ARG 106 HN ARG 106 -5.675 2.882 7.627 224 HA ARG 106 HA ARG 106 -3.423 4.496 7.967 225 HB2 ARG 106 HB2 ARG 106 -5.708 5.262 8.459 226 HB3 ARG 106 HB1 ARG 106 -5.784 4.165 9.838 227 HG2 ARG 106 HG2 ARG 106 -3.413 5.911 9.832 228 HG3 ARG 106 HG1 ARG 106 -4.941 6.780 9.968 229 HD2 ARG 106 HD2 ARG 106 -4.167 4.423 11.712 230 HD3 ARG 106 HD1 ARG 106 -3.967 6.106 12.181 231 HE ARG 106 HE ARG 106 -6.623 5.847 11.440 232 HH11 ARG 106 HH21 ARG 106 -4.437 4.426 13.714 233 HH12 ARG 106 HH22 ARG 106 -5.661 4.092 14.893 234 HH21 ARG 106 HH11 ARG 106 -8.235 5.410 12.980 235 HH22 ARG 106 HH12 ARG 106 -7.812 4.649 14.477 236 H HIS 107 HN HIS 107 -4.773 2.033 10.237 237 HA HIS 107 HA HIS 107 -2.753 2.299 12.166 238 HB2 HIS 107 HB2 HIS 107 -4.841 1.171 12.653 239 HB3 HIS 107 HB1 HIS 107 -4.504 -0.059 11.437 240 HD1 HIS 107 HD1 HIS 107 -2.859 1.312 14.607 241 HD2 HIS 107 HD2 HIS 107 -3.245 -2.260 12.493 242 HE1 HIS 107 HE1 HIS 107 -1.712 -0.470 15.997 243 HE2 HIS 107 HE2 HIS 107 -1.931 -2.653 14.717 244 H VAL 108 HN VAL 108 -3.047 0.192 9.361 245 HA VAL 108 HA VAL 108 -0.734 -1.359 9.769 246 HB VAL 108 HB VAL 108 -2.269 -0.623 7.273 247 HG11 VAL 108 HG11 VAL 108 0.026 -2.557 7.677 248 HG12 VAL 108 HG12 VAL 108 -0.062 -1.226 6.525 249 HG13 VAL 108 HG13 VAL 108 -1.081 -2.641 6.313 250 HG21 VAL 108 HG21 VAL 108 -3.085 -2.133 9.337 251 HG22 VAL 108 HG22 VAL 108 -2.158 -3.355 8.466 252 HG23 VAL 108 HG23 VAL 108 -3.497 -2.529 7.670 253 H MET 109 HN MET 109 -1.229 1.732 8.137 254 HA MET 109 HA MET 109 1.501 1.835 7.135 255 HB2 MET 109 HB2 MET 109 -0.924 3.554 6.946 256 HB3 MET 109 HB1 MET 109 0.642 4.346 6.765 257 HG2 MET 109 HG2 MET 109 -0.552 3.375 4.644 258 HG3 MET 109 HG1 MET 109 1.186 3.133 4.842 259 HE1 MET 109 HE1 MET 109 -0.507 0.457 2.932 260 HE2 MET 109 HE2 MET 109 1.169 0.137 3.368 261 HE3 MET 109 HE3 MET 109 0.660 1.784 3.006 262 H THR 110 HN THR 110 -0.089 2.717 10.056 263 HA THR 110 HA THR 110 2.195 4.446 10.783 264 HB THR 110 HB THR 110 0.753 5.334 12.550 265 HG1 THR 110 HG1 THR 110 -1.599 4.464 11.807 266 HG21 THR 110 HG21 THR 110 -1.157 5.627 10.394 267 HG22 THR 110 HG22 THR 110 0.500 5.735 9.800 268 HG23 THR 110 HG23 THR 110 -0.051 6.815 11.081 269 H ASN 111 HN ASN 111 0.684 1.409 11.420 270 HA ASN 111 HA ASN 111 2.209 1.099 13.921 271 HB2 ASN 111 HB2 ASN 111 -0.324 0.668 13.764 272 HB3 ASN 111 HB1 ASN 111 0.121 -0.816 12.923 273 HD21 ASN 111 HD21 ASN 111 -0.455 -2.280 14.633 274 HD22 ASN 111 HD22 ASN 111 0.360 -2.305 16.122 275 H LEU 112 HN LEU 112 1.678 -0.475 10.765 276 HA LEU 112 HA LEU 112 3.800 -2.415 11.434 277 HB2 LEU 112 HB2 LEU 112 1.837 -2.414 9.138 278 HB3 LEU 112 HB1 LEU 112 3.007 -3.682 9.486 279 HG LEU 112 HG LEU 112 0.767 -2.805 11.336 280 HD11 LEU 112 HD11 LEU 112 0.633 -5.544 10.504 281 HD12 LEU 112 HD12 LEU 112 0.781 -4.533 9.068 282 HD13 LEU 112 HD13 LEU 112 -0.533 -4.255 10.208 283 HD21 LEU 112 HD21 LEU 112 3.102 -4.642 11.611 284 HD22 LEU 112 HD22 LEU 112 1.566 -5.204 12.270 285 HD23 LEU 112 HD23 LEU 112 2.271 -3.691 12.841 286 H GLY 113 HN GLY 113 5.651 -2.596 10.324 287 HA2 GLY 113 HA2 GLY 113 7.448 -1.980 9.032 288 HA3 GLY 113 HA1 GLY 113 6.261 -1.666 7.773 289 H GLU 114 HN GLU 114 8.776 -0.285 9.159 290 HA GLU 114 HA GLU 114 9.094 1.934 10.134 291 HB2 GLU 114 HB2 GLU 114 8.889 1.920 7.119 292 HB3 GLU 114 HB1 GLU 114 9.535 3.283 8.033 293 HG2 GLU 114 HG2 GLU 114 11.281 1.898 8.981 294 HG3 GLU 114 HG1 GLU 114 10.578 0.448 8.266 295 H LYS 115 HN LYS 115 7.349 2.693 11.303 296 HA LYS 115 HA LYS 115 4.826 3.311 10.457 297 HB2 LYS 115 HB2 LYS 115 6.475 4.808 12.504 298 HB3 LYS 115 HB1 LYS 115 4.714 4.822 12.390 299 HG2 LYS 115 HG2 LYS 115 4.700 2.351 12.717 300 HG3 LYS 115 HG1 LYS 115 6.449 2.387 12.898 301 HD2 LYS 115 HD2 LYS 115 6.236 3.883 14.842 302 HD3 LYS 115 HD1 LYS 115 4.480 3.857 14.674 303 HE2 LYS 115 HE2 LYS 115 4.478 1.415 15.026 304 HE3 LYS 115 HE1 LYS 115 6.233 1.436 15.194 305 HZ1 LYS 115 HZ1 LYS 115 4.489 3.102 16.902 306 HZ2 LYS 115 HZ2 LYS 115 6.104 2.646 17.166 307 HZ3 LYS 115 HZ3 LYS 115 4.859 1.498 17.310 308 H LEU 116 HN LEU 116 3.809 4.912 9.405 309 HA LEU 116 HA LEU 116 5.429 6.976 8.089 310 HB2 LEU 116 HB2 LEU 116 2.697 5.805 7.653 311 HB3 LEU 116 HB1 LEU 116 3.028 7.423 7.051 312 HG LEU 116 HG LEU 116 3.444 5.623 5.353 313 HD11 LEU 116 HD11 LEU 116 5.005 6.967 4.447 314 HD12 LEU 116 HD12 LEU 116 6.182 6.548 5.690 315 HD13 LEU 116 HD13 LEU 116 5.028 7.850 5.971 316 HD21 LEU 116 HD21 LEU 116 4.267 3.956 7.055 317 HD22 LEU 116 HD22 LEU 116 5.765 4.882 7.150 318 HD23 LEU 116 HD23 LEU 116 5.304 4.110 5.636 319 H THR 117 HN THR 117 4.740 9.234 8.138 320 HA THR 117 HA THR 117 3.760 9.994 10.771 321 HB THR 117 HB THR 117 4.378 12.263 10.099 322 HG1 THR 117 HG1 THR 117 4.794 11.006 7.597 323 HG21 THR 117 HG21 THR 117 6.759 11.060 9.010 324 HG22 THR 117 HG22 THR 117 6.127 10.050 10.310 325 HG23 THR 117 HG23 THR 117 6.503 11.746 10.614 326 H ASP 118 HN ASP 118 2.122 11.830 10.861 327 HA ASP 118 HA ASP 118 -0.305 11.006 9.735 328 HB2 ASP 118 HB2 ASP 118 -1.167 13.213 10.472 329 HB3 ASP 118 HB1 ASP 118 -0.242 12.392 11.726 330 H GLU 119 HN GLU 119 1.996 13.467 8.703 331 HA GLU 119 HA GLU 119 0.478 14.578 6.600 332 HB2 GLU 119 HB2 GLU 119 3.467 14.335 6.997 333 HB3 GLU 119 HB1 GLU 119 2.739 15.235 5.666 334 HG2 GLU 119 HG2 GLU 119 1.591 16.707 7.212 335 HG3 GLU 119 HG1 GLU 119 2.121 15.742 8.588 336 H GLU 120 HN GLU 120 2.680 11.813 6.703 337 HA GLU 120 HA GLU 120 2.537 11.273 3.895 338 HB2 GLU 120 HB2 GLU 120 3.462 9.677 6.280 339 HB3 GLU 120 HB1 GLU 120 3.440 8.992 4.663 340 HG2 GLU 120 HG2 GLU 120 4.886 11.542 5.436 341 HG3 GLU 120 HG1 GLU 120 5.652 9.969 5.264 342 H VAL 121 HN VAL 121 0.838 10.092 6.769 343 HA VAL 121 HA VAL 121 -0.682 8.080 5.466 344 HB VAL 121 HB VAL 121 -1.118 9.651 8.018 345 HG11 VAL 121 HG11 VAL 121 -2.709 7.714 8.523 346 HG12 VAL 121 HG12 VAL 121 -2.685 7.381 6.792 347 HG13 VAL 121 HG13 VAL 121 -3.291 8.928 7.386 348 HG21 VAL 121 HG21 VAL 121 0.764 7.778 7.475 349 HG22 VAL 121 HG22 VAL 121 -0.565 6.734 7.972 350 HG23 VAL 121 HG23 VAL 121 0.039 7.973 9.070 351 H ASP 122 HN ASP 122 -1.384 11.505 6.245 352 HA ASP 122 HA ASP 122 -4.047 11.540 5.368 353 HB2 ASP 122 HB2 ASP 122 -2.999 13.370 6.651 354 HB3 ASP 122 HB1 ASP 122 -2.008 13.780 5.252 355 H GLU 123 HN GLU 123 -1.038 12.150 3.579 356 HA GLU 123 HA GLU 123 -2.233 12.848 1.118 357 HB2 GLU 123 HB2 GLU 123 0.161 13.216 1.641 358 HB3 GLU 123 HB1 GLU 123 0.423 11.474 1.609 359 HG2 GLU 123 HG2 GLU 123 1.069 12.435 -0.541 360 HG3 GLU 123 HG1 GLU 123 -0.358 11.428 -0.757 361 H MET 124 HN MET 124 -1.338 9.771 2.562 362 HA MET 124 HA MET 124 -1.841 8.098 0.313 363 HB2 MET 124 HB2 MET 124 -1.828 7.583 3.299 364 HB3 MET 124 HB1 MET 124 -1.972 6.319 2.084 365 HG2 MET 124 HG2 MET 124 0.255 8.270 1.764 366 HG3 MET 124 HG1 MET 124 0.411 7.081 3.054 367 HE1 MET 124 HE1 MET 124 -0.296 3.832 1.483 368 HE2 MET 124 HE2 MET 124 -0.302 4.904 2.883 369 HE3 MET 124 HE3 MET 124 1.226 4.276 2.267 370 H ILE 125 HN ILE 125 -3.835 9.211 3.041 371 HA ILE 125 HA ILE 125 -6.104 7.630 2.509 372 HB ILE 125 HB ILE 125 -5.401 9.843 4.243 373 HG12 ILE 125 HG12 ILE 125 -6.986 8.612 5.767 374 HG13 ILE 125 HG11 ILE 125 -7.257 7.475 4.453 375 HG21 ILE 125 HG21 ILE 125 -8.233 9.714 3.208 376 HG22 ILE 125 HG22 ILE 125 -7.140 11.099 3.177 377 HG23 ILE 125 HG23 ILE 125 -7.772 10.506 4.710 378 HD11 ILE 125 HD11 ILE 125 -5.484 6.731 6.063 379 HD12 ILE 125 HD12 ILE 125 -4.532 8.135 5.583 380 HD13 ILE 125 HD13 ILE 125 -4.906 6.881 4.402 381 H ARG 126 HN ARG 126 -5.199 10.862 1.392 382 HA ARG 126 HA ARG 126 -7.645 11.472 0.113 383 HB2 ARG 126 HB2 ARG 126 -4.815 12.410 -0.405 384 HB3 ARG 126 HB1 ARG 126 -6.227 13.073 -1.229 385 HG2 ARG 126 HG2 ARG 126 -7.210 13.710 0.936 386 HG3 ARG 126 HG1 ARG 126 -5.817 13.027 1.776 387 HD2 ARG 126 HD2 ARG 126 -4.334 14.623 0.624 388 HD3 ARG 126 HD1 ARG 126 -5.721 15.305 -0.221 389 HE ARG 126 HE ARG 126 -6.227 15.410 2.549 390 HH11 ARG 126 HH21 ARG 126 -4.123 16.738 0.144 391 HH12 ARG 126 HH22 ARG 126 -3.897 18.242 0.973 392 HH21 ARG 126 HH11 ARG 126 -5.937 17.380 3.643 393 HH22 ARG 126 HH12 ARG 126 -4.925 18.606 2.954 394 H GLU 127 HN GLU 127 -4.943 9.499 -0.757 395 HA GLU 127 HA GLU 127 -5.917 9.187 -3.515 396 HB2 GLU 127 HB2 GLU 127 -3.385 8.244 -2.154 397 HB3 GLU 127 HB1 GLU 127 -3.813 7.870 -3.824 398 HG2 GLU 127 HG2 GLU 127 -3.885 10.253 -4.373 399 HG3 GLU 127 HG1 GLU 127 -3.539 10.669 -2.695 400 H ALA 128 HN ALA 128 -5.888 7.587 -0.441 401 HA ALA 128 HA ALA 128 -6.124 4.901 -1.285 402 HB1 ALA 128 HB1 ALA 128 -6.730 4.413 0.932 403 HB2 ALA 128 HB2 ALA 128 -7.469 5.992 1.178 404 HB3 ALA 128 HB3 ALA 128 -5.718 5.839 1.083 405 H ASP 129 HN ASP 129 -8.590 7.359 -0.598 406 HA ASP 129 HA ASP 129 -10.488 7.132 -2.371 407 HB2 ASP 129 HB2 ASP 129 -10.595 4.752 -2.528 408 HB3 ASP 129 HB1 ASP 129 -10.696 4.573 -0.768 409 H ILE 130 HN ILE 130 -11.711 5.563 0.408 410 HA ILE 130 HA ILE 130 -13.325 6.229 1.889 411 HB ILE 130 HB ILE 130 -11.279 8.388 2.429 412 HG12 ILE 130 HG12 ILE 130 -11.541 5.660 3.713 413 HG13 ILE 130 HG11 ILE 130 -10.417 5.989 2.392 414 HG21 ILE 130 HG21 ILE 130 -12.527 7.431 4.774 415 HG22 ILE 130 HG22 ILE 130 -13.833 7.658 3.609 416 HG23 ILE 130 HG23 ILE 130 -12.765 9.005 4.016 417 HD11 ILE 130 HD11 ILE 130 -9.233 6.245 4.504 418 HD12 ILE 130 HD12 ILE 130 -10.470 7.351 5.101 419 HD13 ILE 130 HD13 ILE 130 -9.427 7.832 3.764 420 H ASP 131 HN ASP 131 -14.029 7.203 -0.625 421 HA ASP 131 HA ASP 131 -14.497 9.994 -0.696 422 HB2 ASP 131 HB2 ASP 131 -15.986 7.669 -1.944 423 HB3 ASP 131 HB1 ASP 131 -16.397 9.354 -2.257 424 H GLY 132 HN GLY 132 -16.285 7.260 0.561 425 HA2 GLY 132 HA2 GLY 132 -17.419 8.492 2.770 426 HA3 GLY 132 HA1 GLY 132 -18.579 8.690 1.458 427 H ASP 133 HN ASP 133 -16.524 5.922 1.344 428 HA ASP 133 HA ASP 133 -18.816 4.228 2.075 429 HB2 ASP 133 HB2 ASP 133 -16.488 3.705 0.230 430 HB3 ASP 133 HB1 ASP 133 -17.654 2.474 0.711 431 H GLY 134 HN GLY 134 -15.484 4.927 2.800 432 HA2 GLY 134 HA2 GLY 134 -14.368 4.381 4.784 433 HA3 GLY 134 HA1 GLY 134 -15.667 3.262 5.178 434 H GLN 135 HN GLN 135 -14.594 2.800 2.005 435 HA GLN 135 HA GLN 135 -12.725 0.665 2.848 436 HB2 GLN 135 HB2 GLN 135 -13.635 -0.424 0.604 437 HB3 GLN 135 HB1 GLN 135 -14.460 -0.670 2.146 438 HG2 GLN 135 HG2 GLN 135 -16.008 1.146 1.643 439 HG3 GLN 135 HG1 GLN 135 -15.156 1.493 0.139 440 HE21 GLN 135 HE21 GLN 135 -17.681 -0.380 1.526 441 HE22 GLN 135 HE22 GLN 135 -17.947 -1.411 0.204 442 H VAL 136 HN VAL 136 -11.094 0.090 1.318 443 HA VAL 136 HA VAL 136 -10.518 2.192 -0.671 444 HB VAL 136 HB VAL 136 -8.728 0.947 1.398 445 HG11 VAL 136 HG11 VAL 136 -6.909 2.257 0.102 446 HG12 VAL 136 HG12 VAL 136 -8.022 2.187 -1.263 447 HG13 VAL 136 HG13 VAL 136 -7.401 0.695 -0.549 448 HG21 VAL 136 HG21 VAL 136 -8.368 3.179 2.060 449 HG22 VAL 136 HG22 VAL 136 -10.083 3.144 1.650 450 HG23 VAL 136 HG23 VAL 136 -8.921 3.813 0.514 451 H ASN 137 HN ASN 137 -9.878 1.538 -2.626 452 HA ASN 137 HA ASN 137 -9.764 -1.351 -3.122 453 HB2 ASN 137 HB2 ASN 137 -9.786 -0.566 -5.551 454 HB3 ASN 137 HB1 ASN 137 -11.239 -0.224 -4.616 455 HD21 ASN 137 HD21 ASN 137 -9.131 1.210 -6.761 456 HD22 ASN 137 HD22 ASN 137 -9.345 2.832 -6.309 457 H TYR 138 HN TYR 138 -7.721 -2.161 -2.860 458 HA TYR 138 HA TYR 138 -5.366 -0.655 -2.949 459 HB2 TYR 138 HB2 TYR 138 -4.175 -2.818 -3.138 460 HB3 TYR 138 HB1 TYR 138 -5.389 -2.810 -1.863 461 HD1 TYR 138 HD1 TYR 138 -4.713 -3.915 -5.358 462 HD2 TYR 138 HD2 TYR 138 -7.234 -4.308 -1.910 463 HE1 TYR 138 HE1 TYR 138 -5.787 -5.916 -6.362 464 HE2 TYR 138 HE2 TYR 138 -8.305 -6.296 -2.897 465 HH TYR 138 HH TYR 138 -7.971 -7.936 -4.542 466 H GLU 139 HN GLU 139 -7.332 -1.591 -5.521 467 HA GLU 139 HA GLU 139 -5.451 -2.100 -7.553 468 HB2 GLU 139 HB2 GLU 139 -7.879 -2.431 -7.849 469 HB3 GLU 139 HB1 GLU 139 -8.118 -0.684 -7.804 470 HG2 GLU 139 HG2 GLU 139 -6.725 -0.413 -9.801 471 HG3 GLU 139 HG1 GLU 139 -6.393 -2.144 -9.827 472 H GLU 140 HN GLU 140 -6.952 1.005 -6.573 473 HA GLU 140 HA GLU 140 -5.566 2.640 -8.359 474 HB2 GLU 140 HB2 GLU 140 -7.506 3.390 -7.043 475 HB3 GLU 140 HB1 GLU 140 -6.540 3.314 -5.571 476 HG2 GLU 140 HG2 GLU 140 -6.641 5.620 -6.396 477 HG3 GLU 140 HG1 GLU 140 -4.993 5.017 -6.517 478 H PHE 141 HN PHE 141 -4.644 1.579 -5.089 479 HA PHE 141 HA PHE 141 -2.307 3.162 -4.870 480 HB2 PHE 141 HB2 PHE 141 -3.382 0.762 -3.514 481 HB3 PHE 141 HB1 PHE 141 -1.629 0.937 -3.462 482 HD1 PHE 141 HD2 PHE 141 -0.820 3.447 -2.993 483 HD2 PHE 141 HD1 PHE 141 -4.609 1.809 -1.802 484 HE1 PHE 141 HE2 PHE 141 -1.005 5.164 -1.220 485 HE2 PHE 141 HE1 PHE 141 -4.782 3.517 -0.016 486 HZ PHE 141 HZ PHE 141 -2.985 5.201 0.271 487 H VAL 142 HN VAL 142 -2.885 -0.035 -6.250 488 HA VAL 142 HA VAL 142 -0.195 -0.644 -6.866 489 HB VAL 142 HB VAL 142 -2.810 -1.561 -8.066 490 HG11 VAL 142 HG11 VAL 142 0.042 -2.163 -8.807 491 HG12 VAL 142 HG12 VAL 142 -1.354 -1.930 -9.861 492 HG13 VAL 142 HG13 VAL 142 -1.178 -3.429 -8.946 493 HG21 VAL 142 HG21 VAL 142 -1.000 -3.448 -6.734 494 HG22 VAL 142 HG22 VAL 142 -2.722 -3.172 -6.467 495 HG23 VAL 142 HG23 VAL 142 -1.527 -2.141 -5.675 496 H GLN 143 HN GLN 143 -2.753 1.000 -8.709 497 HA GLN 143 HA GLN 143 -1.332 1.256 -11.111 498 HB2 GLN 143 HB2 GLN 143 -3.762 1.720 -10.841 499 HB3 GLN 143 HB1 GLN 143 -3.352 3.194 -9.963 500 HG2 GLN 143 HG2 GLN 143 -2.335 4.177 -11.873 501 HG3 GLN 143 HG1 GLN 143 -2.286 2.639 -12.734 502 HE21 GLN 143 HE21 GLN 143 -4.459 1.684 -13.327 503 HE22 GLN 143 HE22 GLN 143 -5.746 2.746 -13.649 504 H MET 144 HN MET 144 -1.479 3.399 -8.256 505 HA MET 144 HA MET 144 0.178 5.426 -9.322 506 HB2 MET 144 HB2 MET 144 -0.206 4.509 -6.458 507 HB3 MET 144 HB1 MET 144 0.763 5.915 -6.900 508 HG2 MET 144 HG2 MET 144 -1.328 6.761 -8.137 509 HG3 MET 144 HG1 MET 144 -2.210 5.504 -7.270 510 HE1 MET 144 HE1 MET 144 -2.723 5.455 -4.804 511 HE2 MET 144 HE2 MET 144 -1.966 6.463 -3.569 512 HE3 MET 144 HE3 MET 144 -1.000 5.281 -4.444 513 H MET 145 HN MET 145 0.893 2.467 -7.514 514 HA MET 145 HA MET 145 3.699 2.803 -7.432 515 HB2 MET 145 HB2 MET 145 1.754 0.851 -6.599 516 HB3 MET 145 HB1 MET 145 3.093 0.040 -7.412 517 HG2 MET 145 HG2 MET 145 3.608 0.265 -5.035 518 HG3 MET 145 HG1 MET 145 4.691 1.288 -5.979 519 HE1 MET 145 HE1 MET 145 2.316 1.002 -3.129 520 HE2 MET 145 HE2 MET 145 1.122 1.283 -4.393 521 HE3 MET 145 HE3 MET 145 1.342 2.479 -3.119 522 H THR 146 HN THR 146 1.569 1.845 -9.966 523 HA THR 146 HA THR 146 3.876 0.876 -11.547 524 HB THR 146 HB THR 146 2.275 -0.518 -12.801 525 HG1 THR 146 HG1 THR 146 0.481 0.946 -12.152 526 HG21 THR 146 HG21 THR 146 2.592 -0.804 -9.832 527 HG22 THR 146 HG22 THR 146 3.289 -1.776 -11.126 528 HG23 THR 146 HG23 THR 146 1.586 -1.960 -10.704 529 H ALA 147 HN ALA 147 2.493 3.606 -11.166 530 HA ALA 147 HA ALA 147 2.075 4.132 -14.050 531 HB1 ALA 147 HB1 ALA 147 0.626 5.369 -11.699 532 HB2 ALA 147 HB2 ALA 147 -0.069 4.311 -12.928 533 HB3 ALA 147 HB3 ALA 147 0.489 5.925 -13.367 534 H LYS 148 HN LYS 148 4.608 4.308 -13.080 535 HA LYS 148 HA LYS 148 5.183 7.103 -13.461 536 HB2 LYS 148 HB2 LYS 148 4.689 6.524 -10.878 537 HB3 LYS 148 HB1 LYS 148 6.393 6.075 -10.948 538 HG2 LYS 148 HG2 LYS 148 6.560 8.334 -10.429 539 HG3 LYS 148 HG1 LYS 148 6.638 8.397 -12.189 540 HD2 LYS 148 HD2 LYS 148 4.072 8.646 -12.116 541 HD3 LYS 148 HD1 LYS 148 4.278 8.989 -10.399 542 HE2 LYS 148 HE2 LYS 148 4.311 11.117 -11.463 543 HE3 LYS 148 HE1 LYS 148 6.001 10.748 -11.118 544 HZ1 LYS 148 HZ1 LYS 148 4.760 11.185 -13.616 545 HZ2 LYS 148 HZ2 LYS 148 5.427 9.622 -13.583 546 HZ3 LYS 148 HZ3 LYS 148 6.406 10.975 -13.268 547 H PHE 30 HT1 PHE 30 -9.065 -4.509 12.578 548 HA PHE 30 HA PHE 30 -7.776 -4.542 9.951 549 HB2 PHE 30 HB2 PHE 30 -6.570 -5.829 12.318 550 HB3 PHE 30 HB1 PHE 30 -5.884 -4.640 11.211 551 HD1 PHE 30 HD2 PHE 30 -7.517 -2.332 11.324 552 HD2 PHE 30 HD1 PHE 30 -6.557 -5.041 14.518 553 HE1 PHE 30 HE2 PHE 30 -7.949 -0.536 12.978 554 HE2 PHE 30 HE1 PHE 30 -6.990 -3.244 16.170 555 HZ PHE 30 HZ PHE 30 -7.686 -0.992 15.401 556 H ASP 31 HN ASP 31 -8.253 -6.903 12.591 557 HA ASP 31 HA ASP 31 -8.594 -9.174 12.548 558 HB2 ASP 31 HB2 ASP 31 -10.745 -8.283 11.537 559 HB3 ASP 31 HB1 ASP 31 -10.056 -8.658 9.958 560 H ILE 32 HN ILE 32 -6.111 -8.531 11.643 561 HA ILE 32 HA ILE 32 -5.702 -10.461 9.436 562 HB ILE 32 HB ILE 32 -4.100 -9.105 8.412 563 HG12 ILE 32 HG12 ILE 32 -3.951 -7.698 11.084 564 HG13 ILE 32 HG11 ILE 32 -2.661 -8.527 10.208 565 HG21 ILE 32 HG21 ILE 32 -6.563 -8.147 8.624 566 HG22 ILE 32 HG22 ILE 32 -5.291 -7.217 7.838 567 HG23 ILE 32 HG23 ILE 32 -5.739 -6.861 9.505 568 HD11 ILE 32 HD11 ILE 32 -2.212 -6.247 9.812 569 HD12 ILE 32 HD12 ILE 32 -3.918 -5.854 9.592 570 HD13 ILE 32 HD13 ILE 32 -3.055 -6.771 8.356 571 H ASP 33 HN ASP 33 -3.477 -11.394 9.454 572 HA ASP 33 HA ASP 33 -2.836 -12.221 12.146 573 HB2 ASP 33 HB2 ASP 33 -1.716 -12.943 9.436 574 HB3 ASP 33 HB1 ASP 33 -1.054 -13.580 10.941 575 H MET 34 HN MET 34 -2.140 -10.206 13.035 576 HA MET 34 HA MET 34 -0.051 -8.625 11.999 577 HB2 MET 34 HB2 MET 34 -1.050 -9.059 14.821 578 HB3 MET 34 HB1 MET 34 0.202 -7.886 14.418 579 HG2 MET 34 HG2 MET 34 -2.533 -7.924 13.116 580 HG3 MET 34 HG1 MET 34 -2.132 -6.925 14.514 581 HE1 MET 34 HE1 MET 34 -2.204 -4.221 11.828 582 HE2 MET 34 HE2 MET 34 -2.772 -4.791 13.394 583 HE3 MET 34 HE3 MET 34 -3.262 -5.632 11.927 584 H ASP 35 HN ASP 35 -0.089 -11.406 14.158 585 HA ASP 35 HA ASP 35 2.619 -11.408 14.920 586 HB2 ASP 35 HB2 ASP 35 0.578 -13.620 14.706 587 HB3 ASP 35 HB1 ASP 35 2.201 -13.875 15.342 588 H ALA 36 HN ALA 36 0.979 -12.812 12.115 589 HA ALA 36 HA ALA 36 3.034 -14.438 11.171 590 HB1 ALA 36 HB1 ALA 36 1.962 -14.018 8.907 591 HB2 ALA 36 HB2 ALA 36 0.862 -12.922 9.745 592 HB3 ALA 36 HB3 ALA 36 0.898 -14.632 10.172 593 HA PRO 37 HA PRO 37 6.125 -11.188 10.255 594 HB2 PRO 37 HB2 PRO 37 7.198 -13.394 8.542 595 HB3 PRO 37 HB1 PRO 37 8.048 -12.344 9.693 596 HG2 PRO 37 HG2 PRO 37 7.492 -14.843 10.322 597 HG3 PRO 37 HG1 PRO 37 7.329 -13.548 11.523 598 HD2 PRO 37 HD2 PRO 37 5.182 -15.004 10.022 599 HD3 PRO 37 HD1 PRO 37 5.190 -14.379 11.690 600 H GLU 38 HN GLU 38 4.484 -13.191 7.860 601 HA GLU 38 HA GLU 38 5.232 -11.830 5.527 602 HB2 GLU 38 HB2 GLU 38 4.051 -14.007 5.552 603 HB3 GLU 38 HB1 GLU 38 2.590 -13.191 6.109 604 HG2 GLU 38 HG2 GLU 38 2.550 -11.824 4.069 605 HG3 GLU 38 HG1 GLU 38 4.040 -12.586 3.515 606 H THR 39 HN THR 39 2.526 -11.239 7.768 607 HA THR 39 HA THR 39 1.322 -9.167 6.277 608 HB THR 39 HB THR 39 1.349 -9.587 9.277 609 HG1 THR 39 HG1 THR 39 0.481 -11.210 7.644 610 HG21 THR 39 HG21 THR 39 -1.039 -8.391 8.514 611 HG22 THR 39 HG22 THR 39 0.170 -7.549 7.545 612 HG23 THR 39 HG23 THR 39 0.314 -7.580 9.302 613 H GLU 40 HN GLU 40 3.769 -9.091 8.858 614 HA GLU 40 HA GLU 40 4.033 -6.278 8.970 615 HB2 GLU 40 HB2 GLU 40 5.940 -8.518 9.667 616 HB3 GLU 40 HB1 GLU 40 6.290 -6.818 9.978 617 HG2 GLU 40 HG2 GLU 40 4.349 -6.616 11.410 618 HG3 GLU 40 HG1 GLU 40 3.813 -8.241 10.985 619 H ARG 41 HN ARG 41 5.708 -8.761 7.075 620 HA ARG 41 HA ARG 41 7.601 -7.036 5.869 621 HB2 ARG 41 HB2 ARG 41 6.449 -9.691 4.983 622 HB3 ARG 41 HB1 ARG 41 7.768 -8.876 4.146 623 HG2 ARG 41 HG2 ARG 41 7.972 -9.367 7.107 624 HG3 ARG 41 HG1 ARG 41 8.319 -10.679 5.983 625 HD2 ARG 41 HD2 ARG 41 10.000 -9.261 4.852 626 HD3 ARG 41 HD1 ARG 41 9.667 -7.958 5.983 627 HE ARG 41 HE ARG 41 10.843 -9.126 7.632 628 HH11 ARG 41 HH21 ARG 41 10.323 -11.040 4.794 629 HH12 ARG 41 HH22 ARG 41 11.428 -12.288 5.267 630 HH21 ARG 41 HH11 ARG 41 12.293 -10.757 8.256 631 HH22 ARG 41 HH12 ARG 41 12.543 -12.127 7.227 632 H ALA 42 HN ALA 42 4.344 -8.043 4.950 633 HA ALA 42 HA ALA 42 4.302 -6.923 2.367 634 HB1 ALA 42 HB1 ALA 42 1.751 -6.777 2.894 635 HB2 ALA 42 HB2 ALA 42 2.186 -7.627 4.377 636 HB3 ALA 42 HB3 ALA 42 2.520 -8.362 2.809 637 H ALA 43 HN ALA 43 3.546 -5.552 5.542 638 HA ALA 43 HA ALA 43 2.530 -3.076 4.658 639 HB1 ALA 43 HB1 ALA 43 4.033 -2.808 7.119 640 HB2 ALA 43 HB2 ALA 43 3.092 -4.301 7.131 641 HB3 ALA 43 HB3 ALA 43 2.287 -2.756 6.867 642 H VAL 44 HN VAL 44 5.815 -4.169 5.385 643 HA VAL 44 HA VAL 44 7.114 -1.680 5.121 644 HB VAL 44 HB VAL 44 8.094 -4.513 4.753 645 HG11 VAL 44 HG11 VAL 44 9.430 -1.884 4.350 646 HG12 VAL 44 HG12 VAL 44 9.785 -3.450 3.621 647 HG13 VAL 44 HG13 VAL 44 10.333 -3.095 5.259 648 HG21 VAL 44 HG21 VAL 44 7.309 -3.736 7.025 649 HG22 VAL 44 HG22 VAL 44 8.565 -2.499 6.971 650 HG23 VAL 44 HG23 VAL 44 9.008 -4.206 6.972 651 H ALA 45 HN ALA 45 6.484 -4.257 2.737 652 HA ALA 45 HA ALA 45 7.924 -3.131 0.603 653 HB1 ALA 45 HB1 ALA 45 6.425 -4.514 -0.841 654 HB2 ALA 45 HB2 ALA 45 5.468 -4.893 0.592 655 HB3 ALA 45 HB3 ALA 45 7.150 -5.415 0.491 656 H ILE 46 HN ILE 46 4.503 -2.725 1.520 657 HA ILE 46 HA ILE 46 3.815 -1.057 -0.662 658 HB ILE 46 HB ILE 46 2.645 -1.292 2.119 659 HG12 ILE 46 HG12 ILE 46 1.590 -2.287 -0.541 660 HG13 ILE 46 HG11 ILE 46 2.591 -3.280 0.519 661 HG21 ILE 46 HG21 ILE 46 1.982 0.860 1.304 662 HG22 ILE 46 HG22 ILE 46 0.630 -0.220 0.962 663 HG23 ILE 46 HG23 ILE 46 1.739 0.240 -0.329 664 HD11 ILE 46 HD11 ILE 46 0.931 -2.852 2.361 665 HD12 ILE 46 HD12 ILE 46 0.279 -3.783 1.012 666 HD13 ILE 46 HD13 ILE 46 -0.108 -2.069 1.170 667 H GLN 47 HN GLN 47 4.858 -0.346 2.656 668 HA GLN 47 HA GLN 47 4.754 2.471 2.476 669 HB2 GLN 47 HB2 GLN 47 6.352 0.603 4.229 670 HB3 GLN 47 HB1 GLN 47 6.346 2.355 4.433 671 HG2 GLN 47 HG2 GLN 47 3.971 2.372 4.851 672 HG3 GLN 47 HG1 GLN 47 3.830 0.671 4.411 673 HE21 GLN 47 HE21 GLN 47 3.284 2.090 7.067 674 HE22 GLN 47 HE22 GLN 47 4.210 1.226 8.196 675 H SER 48 HN SER 48 7.386 0.153 1.881 676 HA SER 48 HA SER 48 9.430 2.048 1.458 677 HB2 SER 48 HB2 SER 48 9.895 -0.344 1.769 678 HB3 SER 48 HB1 SER 48 9.090 -0.708 0.246 679 HG SER 48 HG SER 48 10.941 -0.308 -0.647 680 H GLN 49 HN GLN 49 7.181 0.461 -0.765 681 HA GLN 49 HA GLN 49 8.117 1.714 -3.127 682 HB2 GLN 49 HB2 GLN 49 5.466 0.456 -2.409 683 HB3 GLN 49 HB1 GLN 49 5.867 1.036 -4.023 684 HG2 GLN 49 HG2 GLN 49 7.563 -0.961 -2.514 685 HG3 GLN 49 HG1 GLN 49 6.307 -1.429 -3.656 686 HE21 GLN 49 HE21 GLN 49 9.153 -1.985 -4.021 687 HE22 GLN 49 HE22 GLN 49 9.650 -1.140 -5.407 688 H PHE 50 HN PHE 50 5.623 2.554 -0.763 689 HA PHE 50 HA PHE 50 4.487 4.723 -2.138 690 HB2 PHE 50 HB2 PHE 50 3.366 3.816 -0.204 691 HB3 PHE 50 HB1 PHE 50 4.741 4.204 0.832 692 HD1 PHE 50 HD1 PHE 50 2.555 5.953 -1.677 693 HD2 PHE 50 HD2 PHE 50 4.538 6.138 2.135 694 HE1 PHE 50 HE1 PHE 50 1.653 8.233 -1.318 695 HE2 PHE 50 HE2 PHE 50 3.642 8.423 2.483 696 HZ PHE 50 HZ PHE 50 2.197 9.468 0.762 697 H ARG 51 HN ARG 51 7.144 4.638 0.229 698 HA ARG 51 HA ARG 51 7.643 7.401 0.287 699 HB2 ARG 51 HB2 ARG 51 8.586 5.656 1.858 700 HB3 ARG 51 HB1 ARG 51 9.713 5.209 0.580 701 HG2 ARG 51 HG2 ARG 51 10.995 6.752 1.745 702 HG3 ARG 51 HG1 ARG 51 10.224 7.811 0.568 703 HD2 ARG 51 HD2 ARG 51 10.059 8.788 2.807 704 HD3 ARG 51 HD1 ARG 51 8.458 8.348 2.226 705 HE ARG 51 HE ARG 51 8.346 6.727 3.899 706 HH11 ARG 51 HH21 ARG 51 11.559 7.956 3.525 707 HH12 ARG 51 HH22 ARG 51 12.171 7.178 4.946 708 HH21 ARG 51 HH11 ARG 51 9.141 5.704 5.766 709 HH22 ARG 51 HH12 ARG 51 10.802 5.903 6.215 710 H LYS 52 HN LYS 52 8.961 4.838 -1.798 711 HA LYS 52 HA LYS 52 10.751 6.507 -3.243 712 HB2 LYS 52 HB2 LYS 52 9.921 3.757 -3.294 713 HB3 LYS 52 HB1 LYS 52 9.878 4.407 -4.931 714 HG2 LYS 52 HG2 LYS 52 12.104 3.519 -4.491 715 HG3 LYS 52 HG1 LYS 52 12.196 5.274 -4.615 716 HD2 LYS 52 HD2 LYS 52 12.681 5.544 -2.381 717 HD3 LYS 52 HD1 LYS 52 11.734 4.137 -1.895 718 HE2 LYS 52 HE2 LYS 52 14.164 3.746 -1.606 719 HE3 LYS 52 HE1 LYS 52 13.466 2.642 -2.792 720 HZ1 LYS 52 HZ1 LYS 52 14.352 3.873 -4.555 721 HZ2 LYS 52 HZ2 LYS 52 15.615 3.785 -3.422 722 HZ3 LYS 52 HZ3 LYS 52 14.705 5.212 -3.576 723 H PHE 53 HN PHE 53 7.370 5.636 -3.669 724 HA PHE 53 HA PHE 53 6.973 6.631 -6.263 725 HB2 PHE 53 HB2 PHE 53 5.298 5.260 -5.135 726 HB3 PHE 53 HB1 PHE 53 5.046 6.522 -3.931 727 HD1 PHE 53 HD1 PHE 53 4.807 5.793 -7.581 728 HD2 PHE 53 HD2 PHE 53 3.572 8.328 -4.341 729 HE1 PHE 53 HE1 PHE 53 3.146 6.882 -9.067 730 HE2 PHE 53 HE2 PHE 53 1.910 9.417 -5.826 731 HZ PHE 53 HZ PHE 53 1.697 8.693 -8.189 732 H GLN 54 HN GLN 54 6.646 8.225 -3.102 733 HA GLN 54 HA GLN 54 5.789 10.732 -4.054 734 HB2 GLN 54 HB2 GLN 54 7.335 9.961 -1.567 735 HB3 GLN 54 HB1 GLN 54 6.697 11.578 -1.856 736 HG2 GLN 54 HG2 GLN 54 5.030 9.045 -1.790 737 HG3 GLN 54 HG1 GLN 54 5.172 10.190 -0.459 738 HE21 GLN 54 HE21 GLN 54 4.737 12.627 -1.348 739 HE22 GLN 54 HE22 GLN 54 3.339 12.767 -2.300 740 H LYS 55 HN LYS 55 9.041 9.421 -3.498 741 HA LYS 55 HA LYS 55 10.467 11.808 -3.977 742 HB2 LYS 55 HB2 LYS 55 11.245 8.907 -4.303 743 HB3 LYS 55 HB1 LYS 55 12.375 10.241 -4.532 744 HG2 LYS 55 HG2 LYS 55 11.917 11.022 -2.232 745 HG3 LYS 55 HG1 LYS 55 10.801 9.675 -2.002 746 HD2 LYS 55 HD2 LYS 55 12.638 8.078 -2.401 747 HD3 LYS 55 HD1 LYS 55 13.758 9.422 -2.631 748 HE2 LYS 55 HE2 LYS 55 12.178 8.898 -0.097 749 HE3 LYS 55 HE1 LYS 55 13.878 8.493 -0.327 750 HZ1 LYS 55 HZ1 LYS 55 13.625 11.125 -1.093 751 HZ2 LYS 55 HZ2 LYS 55 14.343 10.541 0.332 752 HZ3 LYS 55 HZ3 LYS 55 12.706 10.993 0.326 753 H LYS 56 HN LYS 56 9.339 9.254 -6.156 754 HA LYS 56 HA LYS 56 10.655 10.157 -8.482 755 HB2 LYS 56 HB2 LYS 56 8.113 8.570 -8.092 756 HB3 LYS 56 HB1 LYS 56 8.819 8.896 -9.675 757 HG2 LYS 56 HG2 LYS 56 10.886 7.779 -9.042 758 HG3 LYS 56 HG1 LYS 56 10.314 7.579 -7.388 759 HD2 LYS 56 HD2 LYS 56 9.916 5.470 -8.361 760 HD3 LYS 56 HD1 LYS 56 8.345 6.263 -8.448 761 HE2 LYS 56 HE2 LYS 56 8.877 5.174 -10.586 762 HE3 LYS 56 HE1 LYS 56 8.822 6.919 -10.797 763 HZ1 LYS 56 HZ1 LYS 56 10.799 5.588 -11.745 764 HZ2 LYS 56 HZ2 LYS 56 11.368 5.596 -10.144 765 HZ3 LYS 56 HZ3 LYS 56 11.100 7.061 -10.962 766 H LYS 57 HN LYS 57 7.517 10.975 -7.069 767 HA LYS 57 HA LYS 57 6.525 12.536 -9.191 768 HB2 LYS 57 HB2 LYS 57 5.138 11.771 -7.299 769 HB3 LYS 57 HB1 LYS 57 6.029 12.842 -6.218 770 HG2 LYS 57 HG2 LYS 57 5.279 14.798 -7.512 771 HG3 LYS 57 HG1 LYS 57 4.416 13.737 -8.627 772 HD2 LYS 57 HD2 LYS 57 3.006 12.931 -6.773 773 HD3 LYS 57 HD1 LYS 57 3.871 13.985 -5.654 774 HE2 LYS 57 HE2 LYS 57 3.144 15.958 -6.940 775 HE3 LYS 57 HE1 LYS 57 2.285 14.910 -8.069 776 HZ1 LYS 57 HZ1 LYS 57 0.686 15.632 -6.541 777 HZ2 LYS 57 HZ2 LYS 57 1.707 15.381 -5.206 778 HZ3 LYS 57 HZ3 LYS 57 1.064 14.053 -6.049 779 H ALA 58 HN ALA 58 8.473 13.398 -6.353 780 HA ALA 58 HA ALA 58 8.652 16.179 -7.129 781 HB1 ALA 58 HB1 ALA 58 9.306 14.573 -4.804 782 HB2 ALA 58 HB2 ALA 58 9.019 16.310 -4.920 783 HB3 ALA 58 HB3 ALA 58 10.630 15.660 -5.223 784 H GLY 59 HN GLY 59 10.165 13.360 -8.129 785 HA2 GLY 59 HA2 GLY 59 12.855 14.201 -8.432 786 HA3 GLY 59 HA1 GLY 59 12.072 12.911 -9.340 787 H SER 60 HN SER 60 13.955 14.978 -10.250 788 HA SER 60 HA SER 60 12.277 16.188 -12.364 789 HB2 SER 60 HB2 SER 60 14.662 17.432 -10.977 790 HB3 SER 60 HB1 SER 60 13.824 18.120 -12.365 791 HG SER 60 HG SER 60 12.139 18.590 -11.131 792 H GLN 61 HN GLN 61 13.239 16.359 -14.423 793 HA GLN 61 HA GLN 61 14.917 14.212 -15.161 794 HB2 GLN 61 HB2 GLN 61 14.944 15.236 -17.376 795 HB3 GLN 61 HB1 GLN 61 13.316 15.308 -16.701 796 HG2 GLN 61 HG2 GLN 61 13.788 17.643 -15.935 797 HG3 GLN 61 HG1 GLN 61 15.347 17.561 -16.755 798 HE21 GLN 61 HE21 GLN 61 12.292 18.737 -17.207 799 HE22 GLN 61 HE22 GLN 61 12.199 18.647 -18.899 800 H SER 62 HN SER 62 15.606 17.376 -13.983 801 HA SER 62 HA SER 62 18.440 16.806 -13.953 802 HB2 SER 62 HB2 SER 62 19.202 18.499 -15.377 803 HB3 SER 62 HB1 SER 62 17.836 17.829 -16.265 804 HG SER 62 HG SER 62 18.175 20.307 -15.555 Start of MODEL 2 1 H1 MET 76 HT1 MET 76 5.988 -17.975 -15.772 2 H2 MET 76 HT2 MET 76 6.383 -19.392 -14.921 3 H3 MET 76 HT3 MET 76 5.848 -19.487 -16.531 4 HA MET 76 HA MET 76 8.478 -18.887 -15.478 5 HB2 MET 76 HB2 MET 76 7.799 -20.899 -16.857 6 HB3 MET 76 HB1 MET 76 7.561 -19.802 -18.217 7 HG2 MET 76 HG2 MET 76 9.900 -19.085 -18.086 8 HG3 MET 76 HG1 MET 76 10.154 -20.111 -16.673 9 HE1 MET 76 HE1 MET 76 12.262 -22.093 -18.721 10 HE2 MET 76 HE2 MET 76 12.078 -20.489 -18.014 11 HE3 MET 76 HE3 MET 76 11.983 -20.691 -19.762 12 H LYS 77 HN LYS 77 6.481 -17.853 -18.257 13 HA LYS 77 HA LYS 77 8.295 -15.623 -18.765 14 HB2 LYS 77 HB2 LYS 77 5.801 -16.569 -20.199 15 HB3 LYS 77 HB1 LYS 77 6.800 -15.206 -20.707 16 HG2 LYS 77 HG2 LYS 77 8.713 -16.634 -21.047 17 HG3 LYS 77 HG1 LYS 77 7.891 -18.001 -20.299 18 HD2 LYS 77 HD2 LYS 77 7.775 -18.344 -22.673 19 HD3 LYS 77 HD1 LYS 77 6.167 -17.848 -22.155 20 HE2 LYS 77 HE2 LYS 77 6.537 -15.589 -22.940 21 HE3 LYS 77 HE1 LYS 77 8.237 -15.930 -23.265 22 HZ1 LYS 77 HZ1 LYS 77 5.852 -16.718 -24.756 23 HZ2 LYS 77 HZ2 LYS 77 7.147 -17.817 -24.719 24 HZ3 LYS 77 HZ3 LYS 77 7.379 -16.247 -25.325 25 H ASP 78 HN ASP 78 5.725 -16.192 -16.762 26 HA ASP 78 HA ASP 78 4.121 -13.881 -17.041 27 HB2 ASP 78 HB2 ASP 78 4.760 -15.625 -14.659 28 HB3 ASP 78 HB1 ASP 78 3.638 -14.268 -14.566 29 H THR 79 HN THR 79 6.653 -14.487 -14.598 30 HA THR 79 HA THR 79 7.913 -13.001 -13.356 31 HB THR 79 HB THR 79 9.325 -11.588 -14.676 32 HG1 THR 79 HG1 THR 79 7.756 -10.517 -15.865 33 HG21 THR 79 HG21 THR 79 8.801 -13.590 -16.783 34 HG22 THR 79 HG22 THR 79 9.019 -14.254 -15.164 35 HG23 THR 79 HG23 THR 79 10.283 -13.259 -15.888 36 H ASP 80 HN ASP 80 8.261 -10.160 -14.136 37 HA ASP 80 HA ASP 80 7.269 -8.099 -13.849 38 HB2 ASP 80 HB2 ASP 80 5.272 -9.383 -15.046 39 HB3 ASP 80 HB1 ASP 80 4.556 -9.282 -13.440 40 H SER 81 HN SER 81 7.441 -7.016 -12.017 41 HA SER 81 HA SER 81 7.204 -8.385 -9.480 42 HB2 SER 81 HB2 SER 81 7.931 -5.522 -10.141 43 HB3 SER 81 HB1 SER 81 7.993 -6.235 -8.530 44 HG SER 81 HG SER 81 9.468 -6.970 -10.842 45 H GLU 82 HN GLU 82 5.006 -6.858 -11.458 46 HA GLU 82 HA GLU 82 3.505 -5.284 -9.675 47 HB2 GLU 82 HB2 GLU 82 2.650 -6.919 -12.075 48 HB3 GLU 82 HB1 GLU 82 1.582 -5.808 -11.216 49 HG2 GLU 82 HG2 GLU 82 3.062 -3.936 -11.704 50 HG3 GLU 82 HG1 GLU 82 4.228 -5.018 -12.462 51 H GLU 83 HN GLU 83 3.569 -8.706 -10.351 52 HA GLU 83 HA GLU 83 1.326 -9.507 -8.833 53 HB2 GLU 83 HB2 GLU 83 2.264 -11.732 -8.965 54 HB3 GLU 83 HB1 GLU 83 2.551 -10.918 -10.501 55 HG2 GLU 83 HG2 GLU 83 4.668 -11.789 -10.073 56 HG3 GLU 83 HG1 GLU 83 4.812 -10.176 -9.374 57 H GLU 84 HN GLU 84 4.635 -8.740 -7.972 58 HA GLU 84 HA GLU 84 4.586 -9.902 -5.370 59 HB2 GLU 84 HB2 GLU 84 6.681 -9.407 -6.582 60 HB3 GLU 84 HB1 GLU 84 6.343 -7.683 -6.451 61 HG2 GLU 84 HG2 GLU 84 7.888 -8.341 -4.684 62 HG3 GLU 84 HG1 GLU 84 6.342 -7.903 -3.966 63 H ILE 85 HN ILE 85 3.941 -6.642 -6.610 64 HA ILE 85 HA ILE 85 3.623 -5.436 -4.060 65 HB ILE 85 HB ILE 85 2.637 -4.600 -6.787 66 HG12 ILE 85 HG12 ILE 85 5.089 -4.686 -6.537 67 HG13 ILE 85 HG11 ILE 85 4.529 -3.026 -6.685 68 HG21 ILE 85 HG21 ILE 85 2.497 -2.314 -5.628 69 HG22 ILE 85 HG22 ILE 85 2.539 -3.209 -4.108 70 HG23 ILE 85 HG23 ILE 85 1.220 -3.473 -5.251 71 HD11 ILE 85 HD11 ILE 85 5.758 -4.415 -4.357 72 HD12 ILE 85 HD12 ILE 85 4.480 -3.260 -3.981 73 HD13 ILE 85 HD13 ILE 85 5.909 -2.737 -4.871 74 H ARG 86 HN ARG 86 1.211 -6.698 -6.392 75 HA ARG 86 HA ARG 86 -1.038 -5.937 -4.864 76 HB2 ARG 86 HB2 ARG 86 -2.317 -7.415 -6.266 77 HB3 ARG 86 HB1 ARG 86 -1.098 -6.630 -7.271 78 HG2 ARG 86 HG2 ARG 86 0.366 -8.644 -6.904 79 HG3 ARG 86 HG1 ARG 86 -1.007 -9.438 -6.139 80 HD2 ARG 86 HD2 ARG 86 -0.966 -10.105 -8.460 81 HD3 ARG 86 HD1 ARG 86 -2.329 -9.014 -8.231 82 HE ARG 86 HE ARG 86 0.005 -7.576 -9.031 83 HH11 ARG 86 HH21 ARG 86 -2.507 -9.680 -10.138 84 HH12 ARG 86 HH22 ARG 86 -2.471 -9.094 -11.767 85 HH21 ARG 86 HH11 ARG 86 0.062 -6.802 -11.163 86 HH22 ARG 86 HH12 ARG 86 -1.014 -7.462 -12.349 87 H GLU 87 HN GLU 87 1.164 -8.610 -4.619 88 HA GLU 87 HA GLU 87 -0.402 -10.401 -3.120 89 HB2 GLU 87 HB2 GLU 87 1.812 -10.975 -4.076 90 HB3 GLU 87 HB1 GLU 87 2.580 -9.901 -2.906 91 HG2 GLU 87 HG2 GLU 87 1.700 -11.245 -1.055 92 HG3 GLU 87 HG1 GLU 87 0.856 -12.292 -2.193 93 H ALA 88 HN ALA 88 1.580 -7.640 -2.198 94 HA ALA 88 HA ALA 88 1.393 -7.897 0.600 95 HB1 ALA 88 HB1 ALA 88 1.505 -5.244 -0.816 96 HB2 ALA 88 HB2 ALA 88 2.889 -6.336 -0.812 97 HB3 ALA 88 HB3 ALA 88 2.253 -5.712 0.709 98 H PHE 89 HN PHE 89 -0.838 -6.554 -1.780 99 HA PHE 89 HA PHE 89 -2.530 -5.374 0.269 100 HB2 PHE 89 HB2 PHE 89 -2.818 -5.677 -2.724 101 HB3 PHE 89 HB1 PHE 89 -4.080 -4.982 -1.701 102 HD1 PHE 89 HD2 PHE 89 -3.727 -2.852 -0.525 103 HD2 PHE 89 HD1 PHE 89 -0.704 -4.524 -3.060 104 HE1 PHE 89 HE2 PHE 89 -2.517 -0.686 -0.515 105 HE2 PHE 89 HE1 PHE 89 0.520 -2.370 -3.053 106 HZ PHE 89 HZ PHE 89 -0.395 -0.443 -1.777 107 H ARG 90 HN ARG 90 -2.577 -8.212 -1.868 108 HA ARG 90 HA ARG 90 -5.077 -9.228 -1.414 109 HB2 ARG 90 HB2 ARG 90 -2.466 -10.398 -2.050 110 HB3 ARG 90 HB1 ARG 90 -3.544 -11.514 -1.219 111 HG2 ARG 90 HG2 ARG 90 -3.945 -11.770 -3.576 112 HG3 ARG 90 HG1 ARG 90 -5.331 -10.905 -2.922 113 HD2 ARG 90 HD2 ARG 90 -4.388 -8.774 -3.677 114 HD3 ARG 90 HD1 ARG 90 -2.939 -9.600 -4.244 115 HE ARG 90 HE ARG 90 -5.537 -9.568 -5.554 116 HH11 ARG 90 HH21 ARG 90 -2.418 -11.031 -5.217 117 HH12 ARG 90 HH22 ARG 90 -2.430 -11.746 -6.794 118 HH21 ARG 90 HH11 ARG 90 -5.558 -10.501 -7.626 119 HH22 ARG 90 HH12 ARG 90 -4.207 -11.446 -8.157 120 H VAL 91 HN VAL 91 -2.434 -9.035 0.830 121 HA VAL 91 HA VAL 91 -3.294 -10.886 2.766 122 HB VAL 91 HB VAL 91 -1.661 -8.353 2.981 123 HG11 VAL 91 HG11 VAL 91 -2.480 -10.389 5.060 124 HG12 VAL 91 HG12 VAL 91 -2.546 -8.629 5.168 125 HG13 VAL 91 HG13 VAL 91 -0.991 -9.460 5.221 126 HG21 VAL 91 HG21 VAL 91 -1.092 -10.863 1.933 127 HG22 VAL 91 HG22 VAL 91 -0.457 -10.956 3.576 128 HG23 VAL 91 HG23 VAL 91 0.101 -9.687 2.486 129 H PHE 92 HN PHE 92 -4.118 -7.497 2.228 130 HA PHE 92 HA PHE 92 -5.821 -7.466 4.602 131 HB2 PHE 92 HB2 PHE 92 -5.544 -5.255 2.574 132 HB3 PHE 92 HB1 PHE 92 -5.989 -5.132 4.276 133 HD1 PHE 92 HD2 PHE 92 -4.056 -6.574 5.784 134 HD2 PHE 92 HD1 PHE 92 -3.439 -4.338 2.166 135 HE1 PHE 92 HE2 PHE 92 -1.671 -6.286 6.371 136 HE2 PHE 92 HE1 PHE 92 -1.051 -4.058 2.759 137 HZ PHE 92 HZ PHE 92 -0.165 -5.029 4.857 138 H ASP 93 HN ASP 93 -6.095 -7.869 1.160 139 HA ASP 93 HA ASP 93 -8.983 -7.408 1.174 140 HB2 ASP 93 HB2 ASP 93 -7.610 -6.710 -0.774 141 HB3 ASP 93 HB1 ASP 93 -7.197 -8.397 -1.054 142 H LYS 94 HN LYS 94 -9.031 -9.184 2.912 143 HA LYS 94 HA LYS 94 -8.696 -11.902 2.082 144 HB2 LYS 94 HB2 LYS 94 -9.710 -12.448 4.217 145 HB3 LYS 94 HB1 LYS 94 -8.523 -11.167 4.433 146 HG2 LYS 94 HG2 LYS 94 -10.342 -9.487 4.393 147 HG3 LYS 94 HG1 LYS 94 -11.526 -10.783 4.222 148 HD2 LYS 94 HD2 LYS 94 -10.785 -11.752 6.365 149 HD3 LYS 94 HD1 LYS 94 -9.610 -10.448 6.546 150 HE2 LYS 94 HE2 LYS 94 -11.439 -8.793 6.538 151 HE3 LYS 94 HE1 LYS 94 -12.616 -10.093 6.351 152 HZ1 LYS 94 HZ1 LYS 94 -11.018 -10.796 8.491 153 HZ2 LYS 94 HZ2 LYS 94 -12.633 -10.271 8.544 154 HZ3 LYS 94 HZ3 LYS 94 -11.367 -9.151 8.708 155 H ASP 95 HN ASP 95 -11.195 -9.575 1.783 156 HA ASP 95 HA ASP 95 -13.394 -11.410 1.561 157 HB2 ASP 95 HB2 ASP 95 -13.050 -8.509 0.796 158 HB3 ASP 95 HB1 ASP 95 -14.554 -9.396 0.556 159 H GLY 96 HN GLY 96 -10.965 -10.157 -0.572 160 HA2 GLY 96 HA2 GLY 96 -10.410 -10.738 -2.727 161 HA3 GLY 96 HA1 GLY 96 -11.595 -12.035 -2.618 162 H ASN 97 HN ASN 97 -12.570 -8.755 -1.988 163 HA ASN 97 HA ASN 97 -14.303 -8.846 -4.346 164 HB2 ASN 97 HB2 ASN 97 -15.157 -6.648 -3.218 165 HB3 ASN 97 HB1 ASN 97 -15.570 -8.207 -2.507 166 HD21 ASN 97 HD21 ASN 97 -12.392 -6.569 -2.326 167 HD22 ASN 97 HD22 ASN 97 -12.411 -6.386 -0.639 168 H GLY 98 HN GLY 98 -11.287 -7.670 -3.552 169 HA2 GLY 98 HA2 GLY 98 -9.896 -6.525 -5.116 170 HA3 GLY 98 HA1 GLY 98 -11.341 -5.843 -5.855 171 H TYR 99 HN TYR 99 -11.505 -5.719 -2.513 172 HA TYR 99 HA TYR 99 -10.363 -2.997 -2.399 173 HB2 TYR 99 HB2 TYR 99 -13.085 -3.744 -1.326 174 HB3 TYR 99 HB1 TYR 99 -12.289 -2.178 -1.166 175 HD1 TYR 99 HD1 TYR 99 -13.283 -4.642 -3.810 176 HD2 TYR 99 HD2 TYR 99 -12.748 -0.516 -2.727 177 HE1 TYR 99 HE1 TYR 99 -14.190 -3.956 -6.006 178 HE2 TYR 99 HE2 TYR 99 -13.655 0.172 -4.935 179 HH TYR 99 HH TYR 99 -15.089 -2.151 -7.138 180 H ILE 100 HN ILE 100 -9.880 -2.184 -0.323 181 HA ILE 100 HA ILE 100 -9.758 -4.183 1.843 182 HB ILE 100 HB ILE 100 -7.505 -3.868 2.238 183 HG12 ILE 100 HG12 ILE 100 -7.876 -1.097 1.074 184 HG13 ILE 100 HG11 ILE 100 -7.534 -1.511 2.755 185 HG21 ILE 100 HG21 ILE 100 -7.956 -4.429 -0.295 186 HG22 ILE 100 HG22 ILE 100 -6.321 -4.034 0.237 187 HG23 ILE 100 HG23 ILE 100 -7.310 -2.804 -0.557 188 HD11 ILE 100 HD11 ILE 100 -5.414 -2.687 1.662 189 HD12 ILE 100 HD12 ILE 100 -5.402 -0.970 2.057 190 HD13 ILE 100 HD13 ILE 100 -5.697 -1.492 0.398 191 H SER 101 HN SER 101 -10.186 -3.268 3.906 192 HA SER 101 HA SER 101 -11.759 -0.947 3.922 193 HB2 SER 101 HB2 SER 101 -10.305 -2.318 6.196 194 HB3 SER 101 HB1 SER 101 -11.501 -1.044 6.409 195 HG SER 101 HG SER 101 -11.820 -3.637 5.324 196 H ALA 102 HN ALA 102 -11.274 1.185 4.103 197 HA ALA 102 HA ALA 102 -8.636 2.117 3.701 198 HB1 ALA 102 HB1 ALA 102 -10.594 3.979 4.932 199 HB2 ALA 102 HB2 ALA 102 -11.059 3.252 3.394 200 HB3 ALA 102 HB3 ALA 102 -9.573 4.190 3.509 201 H ALA 103 HN ALA 103 -10.635 1.817 6.570 202 HA ALA 103 HA ALA 103 -9.007 3.186 8.407 203 HB1 ALA 103 HB1 ALA 103 -10.042 1.576 10.115 204 HB2 ALA 103 HB2 ALA 103 -10.900 0.860 8.751 205 HB3 ALA 103 HB3 ALA 103 -11.166 2.553 9.168 206 H GLU 104 HN GLU 104 -8.948 -0.197 7.344 207 HA GLU 104 HA GLU 104 -6.900 -1.113 9.036 208 HB2 GLU 104 HB2 GLU 104 -8.102 -2.787 7.937 209 HB3 GLU 104 HB1 GLU 104 -8.011 -1.970 6.381 210 HG2 GLU 104 HG2 GLU 104 -5.481 -2.914 7.697 211 HG3 GLU 104 HG1 GLU 104 -6.502 -4.069 6.850 212 H LEU 105 HN LEU 105 -6.793 0.403 5.821 213 HA LEU 105 HA LEU 105 -4.061 0.027 5.314 214 HB2 LEU 105 HB2 LEU 105 -5.621 0.791 3.593 215 HB3 LEU 105 HB1 LEU 105 -5.852 2.311 4.459 216 HG LEU 105 HG LEU 105 -3.021 1.737 4.023 217 HD11 LEU 105 HD11 LEU 105 -4.899 1.883 1.648 218 HD12 LEU 105 HD12 LEU 105 -3.703 0.635 1.998 219 HD13 LEU 105 HD13 LEU 105 -3.178 2.255 1.539 220 HD21 LEU 105 HD21 LEU 105 -4.153 3.922 4.667 221 HD22 LEU 105 HD22 LEU 105 -4.750 4.010 3.009 222 HD23 LEU 105 HD23 LEU 105 -3.015 4.037 3.325 223 H ARG 106 HN ARG 106 -5.711 2.810 6.843 224 HA ARG 106 HA ARG 106 -3.431 4.371 7.276 225 HB2 ARG 106 HB2 ARG 106 -5.700 5.225 7.629 226 HB3 ARG 106 HB1 ARG 106 -5.904 4.149 9.011 227 HG2 ARG 106 HG2 ARG 106 -3.469 5.799 9.134 228 HG3 ARG 106 HG1 ARG 106 -4.966 6.730 9.169 229 HD2 ARG 106 HD2 ARG 106 -5.785 5.373 11.042 230 HD3 ARG 106 HD1 ARG 106 -4.325 4.394 10.997 231 HE ARG 106 HE ARG 106 -3.723 7.179 11.302 232 HH11 ARG 106 HH21 ARG 106 -4.803 4.317 12.917 233 HH12 ARG 106 HH22 ARG 106 -4.218 4.807 14.472 234 HH21 ARG 106 HH11 ARG 106 -2.949 7.828 13.335 235 HH22 ARG 106 HH12 ARG 106 -3.167 6.796 14.709 236 H HIS 107 HN HIS 107 -4.963 1.987 9.492 237 HA HIS 107 HA HIS 107 -3.094 2.246 11.570 238 HB2 HIS 107 HB2 HIS 107 -5.240 1.136 11.881 239 HB3 HIS 107 HB1 HIS 107 -4.777 -0.134 10.747 240 HD1 HIS 107 HD1 HIS 107 -3.506 1.371 14.018 241 HD2 HIS 107 HD2 HIS 107 -3.524 -2.262 11.977 242 HE1 HIS 107 HE1 HIS 107 -2.437 -0.323 15.566 243 HE2 HIS 107 HE2 HIS 107 -2.434 -2.544 14.335 244 H VAL 108 HN VAL 108 -3.237 -0.027 8.866 245 HA VAL 108 HA VAL 108 -0.922 -1.499 9.492 246 HB VAL 108 HB VAL 108 -2.414 -1.017 6.911 247 HG11 VAL 108 HG11 VAL 108 -0.164 -1.524 6.212 248 HG12 VAL 108 HG12 VAL 108 -1.083 -3.022 6.096 249 HG13 VAL 108 HG13 VAL 108 -0.001 -2.760 7.456 250 HG21 VAL 108 HG21 VAL 108 -3.201 -3.285 7.309 251 HG22 VAL 108 HG22 VAL 108 -3.468 -2.340 8.774 252 HG23 VAL 108 HG23 VAL 108 -2.110 -3.461 8.681 253 H MET 109 HN MET 109 -1.399 1.458 7.658 254 HA MET 109 HA MET 109 1.298 1.585 6.644 255 HB2 MET 109 HB2 MET 109 -1.070 3.383 6.635 256 HB3 MET 109 HB1 MET 109 0.517 4.136 6.453 257 HG2 MET 109 HG2 MET 109 -0.669 3.385 4.297 258 HG3 MET 109 HG1 MET 109 1.016 2.892 4.502 259 HE1 MET 109 HE1 MET 109 1.503 0.780 3.456 260 HE2 MET 109 HE2 MET 109 0.142 1.274 2.451 261 HE3 MET 109 HE3 MET 109 0.268 -0.398 2.992 262 H THR 110 HN THR 110 -0.296 2.702 9.576 263 HA THR 110 HA THR 110 2.147 4.176 10.312 264 HB THR 110 HB THR 110 0.769 5.248 12.018 265 HG1 THR 110 HG1 THR 110 -1.622 4.361 11.184 266 HG21 THR 110 HG21 THR 110 -0.175 6.691 10.535 267 HG22 THR 110 HG22 THR 110 -1.052 5.414 9.694 268 HG23 THR 110 HG23 THR 110 0.654 5.693 9.342 269 H ASN 111 HN ASN 111 0.464 1.247 11.004 270 HA ASN 111 HA ASN 111 1.836 0.984 13.598 271 HB2 ASN 111 HB2 ASN 111 -0.633 0.580 13.446 272 HB3 ASN 111 HB1 ASN 111 -0.281 -0.824 12.438 273 HD21 ASN 111 HD21 ASN 111 -0.463 0.303 15.703 274 HD22 ASN 111 HD22 ASN 111 0.148 -1.097 16.443 275 H LEU 112 HN LEU 112 1.374 -0.844 10.553 276 HA LEU 112 HA LEU 112 3.535 -2.664 11.388 277 HB2 LEU 112 HB2 LEU 112 1.648 -2.853 9.041 278 HB3 LEU 112 HB1 LEU 112 2.788 -4.092 9.550 279 HG LEU 112 HG LEU 112 0.482 -3.034 11.214 280 HD11 LEU 112 HD11 LEU 112 0.536 -5.873 10.504 281 HD12 LEU 112 HD12 LEU 112 0.407 -4.824 9.095 282 HD13 LEU 112 HD13 LEU 112 -0.787 -4.716 10.387 283 HD21 LEU 112 HD21 LEU 112 2.758 -4.916 11.739 284 HD22 LEU 112 HD22 LEU 112 1.193 -5.263 12.475 285 HD23 LEU 112 HD23 LEU 112 2.011 -3.737 12.817 286 H GLY 113 HN GLY 113 5.403 -2.916 10.284 287 HA2 GLY 113 HA2 GLY 113 7.191 -2.367 8.949 288 HA3 GLY 113 HA1 GLY 113 5.997 -2.040 7.695 289 H GLU 114 HN GLU 114 8.536 -0.679 9.057 290 HA GLU 114 HA GLU 114 8.896 1.522 10.024 291 HB2 GLU 114 HB2 GLU 114 8.545 1.720 7.026 292 HB3 GLU 114 HB1 GLU 114 9.462 2.845 8.031 293 HG2 GLU 114 HG2 GLU 114 10.030 -0.124 7.881 294 HG3 GLU 114 HG1 GLU 114 10.878 1.084 6.917 295 H LYS 115 HN LYS 115 7.052 2.117 11.236 296 HA LYS 115 HA LYS 115 4.576 2.864 10.430 297 HB2 LYS 115 HB2 LYS 115 6.238 4.328 12.495 298 HB3 LYS 115 HB1 LYS 115 4.479 4.315 12.386 299 HG2 LYS 115 HG2 LYS 115 4.436 1.898 12.794 300 HG3 LYS 115 HG1 LYS 115 6.194 1.842 12.787 301 HD2 LYS 115 HD2 LYS 115 5.637 1.880 15.082 302 HD3 LYS 115 HD1 LYS 115 6.081 3.545 14.721 303 HE2 LYS 115 HE2 LYS 115 3.724 4.172 14.532 304 HE3 LYS 115 HE1 LYS 115 3.235 2.494 14.759 305 HZ1 LYS 115 HZ1 LYS 115 4.023 4.449 16.701 306 HZ2 LYS 115 HZ2 LYS 115 4.846 2.973 16.880 307 HZ3 LYS 115 HZ3 LYS 115 3.148 3.010 16.905 308 H LEU 116 HN LEU 116 3.677 4.399 9.216 309 HA LEU 116 HA LEU 116 5.345 6.505 8.053 310 HB2 LEU 116 HB2 LEU 116 2.625 5.375 7.484 311 HB3 LEU 116 HB1 LEU 116 2.943 7.035 7.008 312 HG LEU 116 HG LEU 116 3.403 5.374 5.183 313 HD11 LEU 116 HD11 LEU 116 4.994 7.553 6.034 314 HD12 LEU 116 HD12 LEU 116 4.934 6.844 4.422 315 HD13 LEU 116 HD13 LEU 116 6.127 6.280 5.589 316 HD21 LEU 116 HD21 LEU 116 5.742 4.534 6.908 317 HD22 LEU 116 HD22 LEU 116 5.234 3.844 5.372 318 HD23 LEU 116 HD23 LEU 116 4.240 3.618 6.810 319 H THR 117 HN THR 117 4.612 8.803 8.149 320 HA THR 117 HA THR 117 3.475 9.367 10.785 321 HB THR 117 HB THR 117 4.307 11.635 10.434 322 HG1 THR 117 HG1 THR 117 4.065 11.936 8.284 323 HG21 THR 117 HG21 THR 117 5.820 9.459 10.928 324 HG22 THR 117 HG22 THR 117 6.488 11.090 10.861 325 HG23 THR 117 HG23 THR 117 6.607 10.030 9.456 326 H ASP 118 HN ASP 118 2.055 11.420 10.815 327 HA ASP 118 HA ASP 118 -0.344 10.865 9.488 328 HB2 ASP 118 HB2 ASP 118 -0.181 12.201 11.560 329 HB3 ASP 118 HB1 ASP 118 0.565 13.510 10.645 330 H GLU 119 HN GLU 119 2.223 13.195 8.682 331 HA GLU 119 HA GLU 119 0.889 14.456 6.540 332 HB2 GLU 119 HB2 GLU 119 3.827 14.042 7.116 333 HB3 GLU 119 HB1 GLU 119 3.237 15.016 5.770 334 HG2 GLU 119 HG2 GLU 119 2.067 16.502 7.283 335 HG3 GLU 119 HG1 GLU 119 2.449 15.468 8.660 336 H GLU 120 HN GLU 120 2.950 11.569 6.650 337 HA GLU 120 HA GLU 120 2.964 11.135 3.827 338 HB2 GLU 120 HB2 GLU 120 3.651 9.479 6.233 339 HB3 GLU 120 HB1 GLU 120 3.590 8.751 4.628 340 HG2 GLU 120 HG2 GLU 120 5.851 9.747 5.479 341 HG3 GLU 120 HG1 GLU 120 5.349 10.064 3.820 342 H VAL 121 HN VAL 121 1.004 9.928 6.520 343 HA VAL 121 HA VAL 121 -0.530 8.060 5.034 344 HB VAL 121 HB VAL 121 -1.044 9.543 7.629 345 HG11 VAL 121 HG11 VAL 121 -2.639 7.398 6.215 346 HG12 VAL 121 HG12 VAL 121 -3.211 8.956 6.817 347 HG13 VAL 121 HG13 VAL 121 -2.766 7.683 7.949 348 HG21 VAL 121 HG21 VAL 121 0.648 7.404 6.941 349 HG22 VAL 121 HG22 VAL 121 -0.740 6.656 7.727 350 HG23 VAL 121 HG23 VAL 121 0.186 7.899 8.569 351 H ASP 122 HN ASP 122 -1.082 11.499 5.883 352 HA ASP 122 HA ASP 122 -3.689 11.691 4.889 353 HB2 ASP 122 HB2 ASP 122 -1.464 13.729 5.094 354 HB3 ASP 122 HB1 ASP 122 -3.097 14.147 4.573 355 H GLU 123 HN GLU 123 -0.566 12.040 3.255 356 HA GLU 123 HA GLU 123 -1.574 12.833 0.724 357 HB2 GLU 123 HB2 GLU 123 0.812 13.032 1.367 358 HB3 GLU 123 HB1 GLU 123 0.946 11.275 1.370 359 HG2 GLU 123 HG2 GLU 123 1.771 12.144 -0.756 360 HG3 GLU 123 HG1 GLU 123 0.278 11.255 -1.036 361 H MET 124 HN MET 124 -0.994 9.729 2.263 362 HA MET 124 HA MET 124 -1.507 8.066 0.005 363 HB2 MET 124 HB2 MET 124 -1.607 7.579 2.993 364 HB3 MET 124 HB1 MET 124 -1.779 6.316 1.782 365 HG2 MET 124 HG2 MET 124 0.557 8.167 1.577 366 HG3 MET 124 HG1 MET 124 0.606 6.900 2.800 367 HE1 MET 124 HE1 MET 124 -0.128 3.757 1.053 368 HE2 MET 124 HE2 MET 124 -0.186 4.775 2.493 369 HE3 MET 124 HE3 MET 124 1.363 4.162 1.916 370 H ILE 125 HN ILE 125 -3.494 9.378 2.633 371 HA ILE 125 HA ILE 125 -5.840 7.918 2.124 372 HB ILE 125 HB ILE 125 -5.041 10.139 3.779 373 HG12 ILE 125 HG12 ILE 125 -6.817 9.153 5.256 374 HG13 ILE 125 HG11 ILE 125 -7.217 8.041 3.951 375 HG21 ILE 125 HG21 ILE 125 -7.319 11.120 4.052 376 HG22 ILE 125 HG22 ILE 125 -7.818 10.282 2.590 377 HG23 ILE 125 HG23 ILE 125 -6.562 11.518 2.514 378 HD11 ILE 125 HD11 ILE 125 -4.378 8.267 4.930 379 HD12 ILE 125 HD12 ILE 125 -5.153 6.918 4.106 380 HD13 ILE 125 HD13 ILE 125 -5.534 7.255 5.793 381 H ARG 126 HN ARG 126 -4.711 11.007 0.823 382 HA ARG 126 HA ARG 126 -7.087 11.662 -0.565 383 HB2 ARG 126 HB2 ARG 126 -4.201 12.411 -1.068 384 HB3 ARG 126 HB1 ARG 126 -5.555 13.088 -1.972 385 HG2 ARG 126 HG2 ARG 126 -6.537 13.973 0.076 386 HG3 ARG 126 HG1 ARG 126 -5.276 13.208 1.044 387 HD2 ARG 126 HD2 ARG 126 -4.736 15.568 0.715 388 HD3 ARG 126 HD1 ARG 126 -3.571 14.566 -0.147 389 HE ARG 126 HE ARG 126 -5.743 15.276 -1.853 390 HH11 ARG 126 HH21 ARG 126 -2.887 16.488 -0.320 391 HH12 ARG 126 HH22 ARG 126 -2.582 17.689 -1.530 392 HH21 ARG 126 HH11 ARG 126 -5.351 16.846 -3.442 393 HH22 ARG 126 HH12 ARG 126 -3.978 17.893 -3.299 394 H GLU 127 HN GLU 127 -4.515 9.452 -1.207 395 HA GLU 127 HA GLU 127 -5.407 9.056 -3.980 396 HB2 GLU 127 HB2 GLU 127 -3.050 7.879 -2.494 397 HB3 GLU 127 HB1 GLU 127 -3.417 7.643 -4.202 398 HG2 GLU 127 HG2 GLU 127 -2.961 10.352 -2.926 399 HG3 GLU 127 HG1 GLU 127 -1.718 9.445 -3.786 400 H ALA 128 HN ALA 128 -6.049 7.874 -0.912 401 HA ALA 128 HA ALA 128 -6.445 5.101 -1.711 402 HB1 ALA 128 HB1 ALA 128 -7.477 6.118 0.896 403 HB2 ALA 128 HB2 ALA 128 -5.738 6.142 0.639 404 HB3 ALA 128 HB3 ALA 128 -6.616 4.629 0.523 405 H ASP 129 HN ASP 129 -8.752 7.134 0.109 406 HA ASP 129 HA ASP 129 -10.764 7.608 -1.630 407 HB2 ASP 129 HB2 ASP 129 -10.573 4.688 -1.184 408 HB3 ASP 129 HB1 ASP 129 -12.186 5.369 -1.051 409 H ILE 130 HN ILE 130 -11.575 5.276 0.785 410 HA ILE 130 HA ILE 130 -12.497 5.378 2.875 411 HB ILE 130 HB ILE 130 -12.108 8.380 2.805 412 HG12 ILE 130 HG12 ILE 130 -10.434 6.256 4.173 413 HG13 ILE 130 HG11 ILE 130 -9.991 6.988 2.631 414 HG21 ILE 130 HG21 ILE 130 -13.240 8.361 4.735 415 HG22 ILE 130 HG22 ILE 130 -12.089 7.203 5.399 416 HG23 ILE 130 HG23 ILE 130 -13.524 6.632 4.554 417 HD11 ILE 130 HD11 ILE 130 -9.254 7.976 5.084 418 HD12 ILE 130 HD12 ILE 130 -10.690 8.938 4.733 419 HD13 ILE 130 HD13 ILE 130 -9.337 8.931 3.608 420 H ASP 131 HN ASP 131 -13.566 8.446 1.477 421 HA ASP 131 HA ASP 131 -15.685 9.230 1.006 422 HB2 ASP 131 HB2 ASP 131 -15.901 6.358 0.093 423 HB3 ASP 131 HB1 ASP 131 -17.142 7.572 -0.214 424 H GLY 132 HN GLY 132 -15.302 8.548 3.685 425 HA2 GLY 132 HA2 GLY 132 -16.596 8.404 5.600 426 HA3 GLY 132 HA1 GLY 132 -18.016 8.301 4.564 427 H ASP 133 HN ASP 133 -17.591 6.022 3.126 428 HA ASP 133 HA ASP 133 -18.419 3.998 4.849 429 HB2 ASP 133 HB2 ASP 133 -17.189 3.878 2.093 430 HB3 ASP 133 HB1 ASP 133 -17.812 2.454 2.925 431 H GLY 134 HN GLY 134 -15.169 4.774 3.665 432 HA2 GLY 134 HA2 GLY 134 -13.182 4.339 4.837 433 HA3 GLY 134 HA1 GLY 134 -14.065 3.239 5.882 434 H GLN 135 HN GLN 135 -13.959 3.186 2.313 435 HA GLN 135 HA GLN 135 -12.479 0.638 2.507 436 HB2 GLN 135 HB2 GLN 135 -14.372 1.017 0.248 437 HB3 GLN 135 HB1 GLN 135 -13.840 -0.461 1.060 438 HG2 GLN 135 HG2 GLN 135 -15.753 1.597 2.194 439 HG3 GLN 135 HG1 GLN 135 -16.180 -0.010 1.609 440 HE21 GLN 135 HE21 GLN 135 -14.416 -1.723 2.733 441 HE22 GLN 135 HE22 GLN 135 -14.391 -1.587 4.425 442 H VAL 136 HN VAL 136 -10.946 0.231 0.993 443 HA VAL 136 HA VAL 136 -10.402 2.367 -0.964 444 HB VAL 136 HB VAL 136 -8.516 1.104 1.004 445 HG11 VAL 136 HG11 VAL 136 -7.279 0.923 -1.008 446 HG12 VAL 136 HG12 VAL 136 -6.782 2.480 -0.345 447 HG13 VAL 136 HG13 VAL 136 -7.958 2.419 -1.656 448 HG21 VAL 136 HG21 VAL 136 -8.814 3.991 0.198 449 HG22 VAL 136 HG22 VAL 136 -8.159 3.331 1.698 450 HG23 VAL 136 HG23 VAL 136 -9.892 3.263 1.385 451 H ASN 137 HN ASN 137 -9.854 1.756 -2.942 452 HA ASN 137 HA ASN 137 -9.768 -1.112 -3.526 453 HB2 ASN 137 HB2 ASN 137 -11.266 0.330 -4.872 454 HB3 ASN 137 HB1 ASN 137 -9.878 1.290 -5.378 455 HD21 ASN 137 HD21 ASN 137 -9.438 -2.165 -4.993 456 HD22 ASN 137 HD22 ASN 137 -9.372 -2.531 -6.649 457 H TYR 138 HN TYR 138 -7.721 -1.973 -3.387 458 HA TYR 138 HA TYR 138 -5.376 -0.395 -3.450 459 HB2 TYR 138 HB2 TYR 138 -4.151 -2.521 -3.483 460 HB3 TYR 138 HB1 TYR 138 -5.441 -2.533 -2.284 461 HD1 TYR 138 HD1 TYR 138 -4.429 -3.747 -5.639 462 HD2 TYR 138 HD2 TYR 138 -7.332 -3.997 -2.497 463 HE1 TYR 138 HE1 TYR 138 -5.407 -5.767 -6.697 464 HE2 TYR 138 HE2 TYR 138 -8.302 -6.010 -3.533 465 HH TYR 138 HH TYR 138 -7.608 -6.954 -6.704 466 H GLU 139 HN GLU 139 -7.311 -1.366 -6.050 467 HA GLU 139 HA GLU 139 -5.374 -2.019 -7.984 468 HB2 GLU 139 HB2 GLU 139 -7.817 -2.300 -8.308 469 HB3 GLU 139 HB1 GLU 139 -7.982 -0.550 -8.431 470 HG2 GLU 139 HG2 GLU 139 -6.049 -2.033 -10.207 471 HG3 GLU 139 HG1 GLU 139 -7.756 -1.939 -10.628 472 H GLU 140 HN GLU 140 -6.816 1.208 -7.256 473 HA GLU 140 HA GLU 140 -5.277 2.605 -9.148 474 HB2 GLU 140 HB2 GLU 140 -5.927 4.610 -7.976 475 HB3 GLU 140 HB1 GLU 140 -7.295 3.502 -7.983 476 HG2 GLU 140 HG2 GLU 140 -6.596 2.736 -5.697 477 HG3 GLU 140 HG1 GLU 140 -5.379 4.006 -5.692 478 H PHE 141 HN PHE 141 -4.604 1.665 -5.838 479 HA PHE 141 HA PHE 141 -2.273 3.249 -5.473 480 HB2 PHE 141 HB2 PHE 141 -3.544 0.981 -4.100 481 HB3 PHE 141 HB1 PHE 141 -1.785 0.978 -3.988 482 HD1 PHE 141 HD2 PHE 141 -0.762 3.448 -3.599 483 HD2 PHE 141 HD1 PHE 141 -4.691 2.161 -2.418 484 HE1 PHE 141 HE2 PHE 141 -0.825 5.221 -1.872 485 HE2 PHE 141 HE1 PHE 141 -4.741 3.930 -0.686 486 HZ PHE 141 HZ PHE 141 -2.816 5.464 -0.415 487 H VAL 142 HN VAL 142 -2.773 -0.040 -6.726 488 HA VAL 142 HA VAL 142 -0.035 -0.606 -7.148 489 HB VAL 142 HB VAL 142 -2.548 -1.683 -8.436 490 HG11 VAL 142 HG11 VAL 142 0.368 -2.227 -8.978 491 HG12 VAL 142 HG12 VAL 142 -0.960 -2.074 -10.130 492 HG13 VAL 142 HG13 VAL 142 -0.813 -3.527 -9.138 493 HG21 VAL 142 HG21 VAL 142 -1.415 -2.064 -5.953 494 HG22 VAL 142 HG22 VAL 142 -0.694 -3.375 -6.886 495 HG23 VAL 142 HG23 VAL 142 -2.448 -3.239 -6.769 496 H GLN 143 HN GLN 143 -2.505 0.950 -9.162 497 HA GLN 143 HA GLN 143 -0.974 1.196 -11.511 498 HB2 GLN 143 HB2 GLN 143 -3.428 1.667 -11.315 499 HB3 GLN 143 HB1 GLN 143 -3.034 3.149 -10.449 500 HG2 GLN 143 HG2 GLN 143 -3.399 3.689 -12.782 501 HG3 GLN 143 HG1 GLN 143 -1.681 3.870 -12.427 502 HE21 GLN 143 HE21 GLN 143 -0.427 2.993 -14.043 503 HE22 GLN 143 HE22 GLN 143 -0.813 1.615 -14.951 504 H MET 144 HN MET 144 -1.284 3.239 -8.631 505 HA MET 144 HA MET 144 0.350 5.386 -9.467 506 HB2 MET 144 HB2 MET 144 -0.216 4.253 -6.718 507 HB3 MET 144 HB1 MET 144 0.703 5.726 -6.986 508 HG2 MET 144 HG2 MET 144 -1.156 6.872 -7.859 509 HG3 MET 144 HG1 MET 144 -2.038 5.377 -8.179 510 HE1 MET 144 HE1 MET 144 -1.137 7.185 -4.044 511 HE2 MET 144 HE2 MET 144 -0.373 7.573 -5.586 512 HE3 MET 144 HE3 MET 144 -0.003 6.048 -4.786 513 H MET 145 HN MET 145 1.098 2.410 -7.678 514 HA MET 145 HA MET 145 3.888 2.966 -7.465 515 HB2 MET 145 HB2 MET 145 2.124 0.589 -6.910 516 HB3 MET 145 HB1 MET 145 3.873 0.381 -6.937 517 HG2 MET 145 HG2 MET 145 3.450 0.859 -4.677 518 HG3 MET 145 HG1 MET 145 3.900 2.437 -5.301 519 HE1 MET 145 HE1 MET 145 0.670 1.856 -2.654 520 HE2 MET 145 HE2 MET 145 2.409 1.577 -2.712 521 HE3 MET 145 HE3 MET 145 1.308 0.391 -3.414 522 H THR 146 HN THR 146 1.933 1.647 -9.963 523 HA THR 146 HA THR 146 4.325 0.565 -11.323 524 HB THR 146 HB THR 146 2.738 -0.689 -12.731 525 HG1 THR 146 HG1 THR 146 0.557 -0.606 -12.222 526 HG21 THR 146 HG21 THR 146 3.543 -1.837 -10.783 527 HG22 THR 146 HG22 THR 146 1.808 -2.147 -10.873 528 HG23 THR 146 HG23 THR 146 2.435 -0.956 -9.732 529 H ALA 147 HN ALA 147 3.214 3.402 -11.083 530 HA ALA 147 HA ALA 147 3.803 4.205 -13.763 531 HB1 ALA 147 HB1 ALA 147 1.758 4.613 -14.635 532 HB2 ALA 147 HB2 ALA 147 1.131 5.220 -13.103 533 HB3 ALA 147 HB3 ALA 147 1.173 3.484 -13.413 534 H LYS 148 HN LYS 148 2.550 6.719 -13.701 535 HA LYS 148 HA LYS 148 2.895 8.838 -12.894 536 HB2 LYS 148 HB2 LYS 148 2.400 7.203 -10.446 537 HB3 LYS 148 HB1 LYS 148 3.046 8.826 -10.224 538 HG2 LYS 148 HG2 LYS 148 0.731 8.435 -12.090 539 HG3 LYS 148 HG1 LYS 148 0.433 8.436 -10.353 540 HD2 LYS 148 HD2 LYS 148 1.567 10.636 -10.172 541 HD3 LYS 148 HD1 LYS 148 1.809 10.643 -11.918 542 HE2 LYS 148 HE2 LYS 148 -0.630 10.547 -12.262 543 HE3 LYS 148 HE1 LYS 148 -0.877 10.531 -10.516 544 HZ1 LYS 148 HZ1 LYS 148 -1.122 12.751 -11.136 545 HZ2 LYS 148 HZ2 LYS 148 0.204 12.709 -12.199 546 HZ3 LYS 148 HZ3 LYS 148 0.456 12.673 -10.518 547 H PHE 30 HT1 PHE 30 -9.851 -3.514 12.302 548 HA PHE 30 HA PHE 30 -9.302 -4.308 10.291 549 HB2 PHE 30 HB2 PHE 30 -6.740 -5.408 11.294 550 HB3 PHE 30 HB1 PHE 30 -7.038 -4.137 10.107 551 HD1 PHE 30 HD2 PHE 30 -8.266 -1.972 11.173 552 HD2 PHE 30 HD1 PHE 30 -5.737 -4.722 13.294 553 HE1 PHE 30 HE2 PHE 30 -7.805 -0.232 12.878 554 HE2 PHE 30 HE1 PHE 30 -5.277 -2.982 15.000 555 HZ PHE 30 HZ PHE 30 -6.309 -0.737 14.791 556 H ASP 31 HN ASP 31 -8.984 -6.649 12.869 557 HA ASP 31 HA ASP 31 -9.218 -8.936 12.927 558 HB2 ASP 31 HB2 ASP 31 -11.363 -8.282 11.750 559 HB3 ASP 31 HB1 ASP 31 -10.546 -8.637 10.229 560 H ILE 32 HN ILE 32 -6.801 -7.949 12.029 561 HA ILE 32 HA ILE 32 -5.990 -9.953 10.012 562 HB ILE 32 HB ILE 32 -5.072 -7.108 10.406 563 HG12 ILE 32 HG12 ILE 32 -5.959 -8.527 7.891 564 HG13 ILE 32 HG11 ILE 32 -7.098 -7.716 8.966 565 HG21 ILE 32 HG21 ILE 32 -3.628 -7.954 8.299 566 HG22 ILE 32 HG22 ILE 32 -3.664 -9.444 9.241 567 HG23 ILE 32 HG23 ILE 32 -3.016 -7.964 9.952 568 HD11 ILE 32 HD11 ILE 32 -4.648 -6.266 8.012 569 HD12 ILE 32 HD12 ILE 32 -6.187 -5.608 8.549 570 HD13 ILE 32 HD13 ILE 32 -6.067 -6.375 6.969 571 H ASP 33 HN ASP 33 -4.456 -11.341 10.634 572 HA ASP 33 HA ASP 33 -3.425 -11.258 13.308 573 HB2 ASP 33 HB2 ASP 33 -2.194 -13.301 12.630 574 HB3 ASP 33 HB1 ASP 33 -3.912 -13.393 12.247 575 H MET 34 HN MET 34 -1.920 -9.819 13.850 576 HA MET 34 HA MET 34 0.126 -9.009 11.927 577 HB2 MET 34 HB2 MET 34 -0.475 -8.053 14.737 578 HB3 MET 34 HB1 MET 34 0.748 -7.362 13.670 579 HG2 MET 34 HG2 MET 34 -0.981 -6.796 12.022 580 HG3 MET 34 HG1 MET 34 -2.215 -7.528 13.047 581 HE1 MET 34 HE1 MET 34 -3.315 -4.019 13.524 582 HE2 MET 34 HE2 MET 34 -3.433 -5.527 12.620 583 HE3 MET 34 HE3 MET 34 -2.336 -4.261 12.072 584 H ASP 35 HN ASP 35 -0.248 -11.499 14.041 585 HA ASP 35 HA ASP 35 2.408 -11.488 15.203 586 HB2 ASP 35 HB2 ASP 35 1.761 -13.596 16.209 587 HB3 ASP 35 HB1 ASP 35 0.448 -12.437 16.399 588 H ALA 36 HN ALA 36 1.370 -12.037 12.150 589 HA ALA 36 HA ALA 36 3.204 -14.293 11.678 590 HB1 ALA 36 HB1 ALA 36 0.692 -14.053 10.791 591 HB2 ALA 36 HB2 ALA 36 1.941 -14.868 9.852 592 HB3 ALA 36 HB3 ALA 36 1.515 -13.197 9.486 593 HA PRO 37 HA PRO 37 6.134 -11.448 9.941 594 HB2 PRO 37 HB2 PRO 37 7.544 -13.081 8.298 595 HB3 PRO 37 HB1 PRO 37 7.692 -13.117 10.068 596 HG2 PRO 37 HG2 PRO 37 6.116 -14.876 8.267 597 HG3 PRO 37 HG1 PRO 37 7.114 -15.300 9.665 598 HD2 PRO 37 HD2 PRO 37 4.404 -15.139 9.815 599 HD3 PRO 37 HD1 PRO 37 5.460 -14.734 11.188 600 H GLU 38 HN GLU 38 4.152 -13.395 7.804 601 HA GLU 38 HA GLU 38 4.822 -12.170 5.356 602 HB2 GLU 38 HB2 GLU 38 2.312 -13.566 6.287 603 HB3 GLU 38 HB1 GLU 38 2.548 -13.008 4.631 604 HG2 GLU 38 HG2 GLU 38 4.508 -14.410 4.375 605 HG3 GLU 38 HG1 GLU 38 4.454 -14.867 6.076 606 H THR 39 HN THR 39 2.337 -11.379 7.770 607 HA THR 39 HA THR 39 1.090 -9.323 6.281 608 HB THR 39 HB THR 39 1.298 -9.654 9.284 609 HG1 THR 39 HG1 THR 39 -0.983 -10.390 8.687 610 HG21 THR 39 HG21 THR 39 -0.541 -8.001 7.529 611 HG22 THR 39 HG22 THR 39 0.604 -7.397 8.728 612 HG23 THR 39 HG23 THR 39 -0.818 -8.302 9.243 613 H GLU 40 HN GLU 40 3.682 -9.246 8.711 614 HA GLU 40 HA GLU 40 4.040 -6.445 8.721 615 HB2 GLU 40 HB2 GLU 40 4.939 -7.947 10.466 616 HB3 GLU 40 HB1 GLU 40 6.074 -8.615 9.293 617 HG2 GLU 40 HG2 GLU 40 7.102 -6.411 8.990 618 HG3 GLU 40 HG1 GLU 40 5.931 -5.694 10.094 619 H ARG 41 HN ARG 41 5.562 -9.028 6.828 620 HA ARG 41 HA ARG 41 7.440 -7.412 5.480 621 HB2 ARG 41 HB2 ARG 41 6.110 -10.023 4.729 622 HB3 ARG 41 HB1 ARG 41 7.388 -9.284 3.768 623 HG2 ARG 41 HG2 ARG 41 7.815 -9.726 6.711 624 HG3 ARG 41 HG1 ARG 41 8.013 -11.072 5.591 625 HD2 ARG 41 HD2 ARG 41 9.469 -8.412 5.407 626 HD3 ARG 41 HD1 ARG 41 10.158 -9.916 5.996 627 HE ARG 41 HE ARG 41 9.632 -9.222 3.226 628 HH11 ARG 41 HH21 ARG 41 10.204 -11.698 5.575 629 HH12 ARG 41 HH22 ARG 41 10.790 -12.850 4.422 630 HH21 ARG 41 HH11 ARG 41 10.400 -10.729 1.707 631 HH22 ARG 41 HH12 ARG 41 10.901 -12.301 2.233 632 H ALA 42 HN ALA 42 4.094 -8.285 4.735 633 HA ALA 42 HA ALA 42 3.984 -7.176 2.147 634 HB1 ALA 42 HB1 ALA 42 1.914 -7.743 4.253 635 HB2 ALA 42 HB2 ALA 42 2.175 -8.560 2.711 636 HB3 ALA 42 HB3 ALA 42 1.473 -6.943 2.745 637 H ALA 43 HN ALA 43 3.383 -5.768 5.342 638 HA ALA 43 HA ALA 43 2.463 -3.249 4.467 639 HB1 ALA 43 HB1 ALA 43 2.495 -2.670 6.681 640 HB2 ALA 43 HB2 ALA 43 4.091 -3.371 6.956 641 HB3 ALA 43 HB3 ALA 43 2.668 -4.411 6.888 642 H VAL 44 HN VAL 44 5.706 -4.478 5.175 643 HA VAL 44 HA VAL 44 7.103 -2.049 4.896 644 HB VAL 44 HB VAL 44 7.967 -4.917 4.522 645 HG11 VAL 44 HG11 VAL 44 9.582 -3.760 3.271 646 HG12 VAL 44 HG12 VAL 44 10.291 -3.771 4.887 647 HG13 VAL 44 HG13 VAL 44 9.478 -2.324 4.288 648 HG21 VAL 44 HG21 VAL 44 8.390 -2.874 6.728 649 HG22 VAL 44 HG22 VAL 44 9.034 -4.517 6.721 650 HG23 VAL 44 HG23 VAL 44 7.292 -4.253 6.800 651 H ALA 45 HN ALA 45 6.347 -4.584 2.508 652 HA ALA 45 HA ALA 45 7.829 -3.514 0.376 653 HB1 ALA 45 HB1 ALA 45 5.721 -4.697 -0.885 654 HB2 ALA 45 HB2 ALA 45 5.655 -5.472 0.698 655 HB3 ALA 45 HB3 ALA 45 7.127 -5.564 -0.269 656 H ILE 46 HN ILE 46 4.434 -2.947 1.308 657 HA ILE 46 HA ILE 46 3.822 -1.242 -0.868 658 HB ILE 46 HB ILE 46 2.630 -1.449 1.900 659 HG12 ILE 46 HG12 ILE 46 1.549 -2.356 -0.782 660 HG13 ILE 46 HG11 ILE 46 2.486 -3.411 0.277 661 HG21 ILE 46 HG21 ILE 46 1.873 0.207 -0.509 662 HG22 ILE 46 HG22 ILE 46 2.031 0.723 1.170 663 HG23 ILE 46 HG23 ILE 46 0.667 -0.281 0.682 664 HD11 ILE 46 HD11 ILE 46 -0.183 -2.109 0.862 665 HD12 ILE 46 HD12 ILE 46 0.810 -2.862 2.109 666 HD13 ILE 46 HD13 ILE 46 0.180 -3.832 0.778 667 H GLN 47 HN GLN 47 4.868 -0.553 2.459 668 HA GLN 47 HA GLN 47 4.857 2.264 2.221 669 HB2 GLN 47 HB2 GLN 47 6.395 0.410 4.040 670 HB3 GLN 47 HB1 GLN 47 6.415 2.165 4.193 671 HG2 GLN 47 HG2 GLN 47 3.945 2.156 4.444 672 HG3 GLN 47 HG1 GLN 47 3.959 0.396 4.354 673 HE21 GLN 47 HE21 GLN 47 6.799 1.343 5.852 674 HE22 GLN 47 HE22 GLN 47 6.308 1.213 7.469 675 H SER 48 HN SER 48 7.388 -0.165 1.685 676 HA SER 48 HA SER 48 9.536 1.610 1.307 677 HB2 SER 48 HB2 SER 48 9.859 -0.806 1.595 678 HB3 SER 48 HB1 SER 48 9.062 -1.108 0.054 679 HG SER 48 HG SER 48 11.586 -0.692 0.418 680 H GLN 49 HN GLN 49 7.253 0.188 -1.015 681 HA GLN 49 HA GLN 49 8.362 1.463 -3.293 682 HB2 GLN 49 HB2 GLN 49 6.805 -0.533 -3.320 683 HB3 GLN 49 HB1 GLN 49 5.491 0.583 -2.951 684 HG2 GLN 49 HG2 GLN 49 5.585 0.258 -5.359 685 HG3 GLN 49 HG1 GLN 49 6.101 1.900 -4.984 686 HE21 GLN 49 HE21 GLN 49 7.806 2.449 -6.333 687 HE22 GLN 49 HE22 GLN 49 9.090 1.416 -6.745 688 H PHE 50 HN PHE 50 5.868 2.332 -0.965 689 HA PHE 50 HA PHE 50 4.843 4.595 -2.270 690 HB2 PHE 50 HB2 PHE 50 3.684 3.642 -0.355 691 HB3 PHE 50 HB1 PHE 50 5.049 4.023 0.695 692 HD1 PHE 50 HD1 PHE 50 2.948 5.828 -1.861 693 HD2 PHE 50 HD2 PHE 50 4.777 5.920 2.035 694 HE1 PHE 50 HE1 PHE 50 2.053 8.106 -1.492 695 HE2 PHE 50 HE2 PHE 50 3.879 8.205 2.391 696 HZ PHE 50 HZ PHE 50 2.520 9.294 0.631 697 H ARG 51 HN ARG 51 7.576 4.264 -0.026 698 HA ARG 51 HA ARG 51 8.160 6.986 0.276 699 HB2 ARG 51 HB2 ARG 51 9.231 5.187 1.598 700 HB3 ARG 51 HB1 ARG 51 10.116 4.675 0.161 701 HG2 ARG 51 HG2 ARG 51 11.245 6.823 0.029 702 HG3 ARG 51 HG1 ARG 51 10.280 7.452 1.366 703 HD2 ARG 51 HD2 ARG 51 12.136 5.066 1.578 704 HD3 ARG 51 HD1 ARG 51 12.570 6.703 2.058 705 HE ARG 51 HE ARG 51 10.190 6.070 3.378 706 HH11 ARG 51 HH21 ARG 51 13.470 4.983 3.195 707 HH12 ARG 51 HH22 ARG 51 13.518 4.414 4.830 708 HH21 ARG 51 HH11 ARG 51 10.244 5.323 5.524 709 HH22 ARG 51 HH12 ARG 51 11.692 4.606 6.149 710 H LYS 52 HN LYS 52 9.097 4.687 -2.250 711 HA LYS 52 HA LYS 52 10.875 6.369 -3.656 712 HB2 LYS 52 HB2 LYS 52 9.141 4.071 -4.586 713 HB3 LYS 52 HB1 LYS 52 10.324 4.868 -5.615 714 HG2 LYS 52 HG2 LYS 52 11.159 3.826 -2.920 715 HG3 LYS 52 HG1 LYS 52 11.012 2.712 -4.277 716 HD2 LYS 52 HD2 LYS 52 12.550 4.183 -5.595 717 HD3 LYS 52 HD1 LYS 52 12.768 5.185 -4.163 718 HE2 LYS 52 HE2 LYS 52 13.638 3.245 -2.922 719 HE3 LYS 52 HE1 LYS 52 13.411 2.231 -4.347 720 HZ1 LYS 52 HZ1 LYS 52 15.611 2.847 -4.507 721 HZ2 LYS 52 HZ2 LYS 52 15.339 4.416 -3.913 722 HZ3 LYS 52 HZ3 LYS 52 14.860 4.007 -5.491 723 H PHE 53 HN PHE 53 7.375 5.998 -3.750 724 HA PHE 53 HA PHE 53 6.796 7.443 -6.078 725 HB2 PHE 53 HB2 PHE 53 5.145 6.123 -4.736 726 HB3 PHE 53 HB1 PHE 53 5.167 7.404 -3.529 727 HD1 PHE 53 HD2 PHE 53 4.280 9.647 -4.036 728 HD2 PHE 53 HD1 PHE 53 4.049 6.432 -6.875 729 HE1 PHE 53 HE2 PHE 53 2.594 10.918 -5.338 730 HE2 PHE 53 HE1 PHE 53 2.361 7.702 -8.173 731 HZ PHE 53 HZ PHE 53 1.635 9.945 -7.407 732 H GLN 54 HN GLN 54 7.294 8.553 -2.742 733 HA GLN 54 HA GLN 54 6.634 11.260 -3.141 734 HB2 GLN 54 HB2 GLN 54 8.510 9.926 -1.183 735 HB3 GLN 54 HB1 GLN 54 8.106 11.641 -1.123 736 HG2 GLN 54 HG2 GLN 54 5.719 11.084 -0.910 737 HG3 GLN 54 HG1 GLN 54 6.107 9.366 -0.995 738 HE21 GLN 54 HE21 GLN 54 5.318 11.667 1.224 739 HE22 GLN 54 HE22 GLN 54 6.164 11.076 2.572 740 H LYS 55 HN LYS 55 9.692 9.508 -3.536 741 HA LYS 55 HA LYS 55 11.343 11.747 -3.994 742 HB2 LYS 55 HB2 LYS 55 11.552 8.876 -4.912 743 HB3 LYS 55 HB1 LYS 55 12.805 10.078 -5.218 744 HG2 LYS 55 HG2 LYS 55 12.994 10.496 -2.789 745 HG3 LYS 55 HG1 LYS 55 11.755 9.276 -2.488 746 HD2 LYS 55 HD2 LYS 55 13.165 7.544 -3.472 747 HD3 LYS 55 HD1 LYS 55 14.386 8.744 -3.899 748 HE2 LYS 55 HE2 LYS 55 15.036 7.590 -1.836 749 HE3 LYS 55 HE1 LYS 55 14.672 9.281 -1.492 750 HZ1 LYS 55 HZ1 LYS 55 13.013 6.898 -0.941 751 HZ2 LYS 55 HZ2 LYS 55 12.344 8.460 -0.980 752 HZ3 LYS 55 HZ3 LYS 55 13.558 8.081 0.147 753 H LYS 56 HN LYS 56 9.359 9.791 -6.176 754 HA LYS 56 HA LYS 56 10.264 10.907 -8.601 755 HB2 LYS 56 HB2 LYS 56 7.634 9.633 -7.820 756 HB3 LYS 56 HB1 LYS 56 8.017 10.136 -9.469 757 HG2 LYS 56 HG2 LYS 56 9.906 8.647 -9.574 758 HG3 LYS 56 HG1 LYS 56 9.797 8.295 -7.851 759 HD2 LYS 56 HD2 LYS 56 8.840 6.415 -8.990 760 HD3 LYS 56 HD1 LYS 56 7.493 7.325 -8.311 761 HE2 LYS 56 HE2 LYS 56 7.006 8.332 -10.458 762 HE3 LYS 56 HE1 LYS 56 8.465 7.639 -11.164 763 HZ1 LYS 56 HZ1 LYS 56 7.342 5.805 -11.617 764 HZ2 LYS 56 HZ2 LYS 56 5.928 6.499 -10.981 765 HZ3 LYS 56 HZ3 LYS 56 6.957 5.592 -9.979 766 H LYS 57 HN LYS 57 7.710 11.899 -6.354 767 HA LYS 57 HA LYS 57 6.726 14.029 -7.977 768 HB2 LYS 57 HB2 LYS 57 6.188 12.933 -5.344 769 HB3 LYS 57 HB1 LYS 57 6.192 14.696 -5.315 770 HG2 LYS 57 HG2 LYS 57 4.624 14.710 -7.245 771 HG3 LYS 57 HG1 LYS 57 4.580 12.946 -7.198 772 HD2 LYS 57 HD2 LYS 57 3.771 13.086 -4.831 773 HD3 LYS 57 HD1 LYS 57 3.690 14.839 -5.003 774 HE2 LYS 57 HE2 LYS 57 2.196 12.853 -6.742 775 HE3 LYS 57 HE1 LYS 57 1.486 13.765 -5.411 776 HZ1 LYS 57 HZ1 LYS 57 2.249 15.813 -6.593 777 HZ2 LYS 57 HZ2 LYS 57 1.024 14.946 -7.389 778 HZ3 LYS 57 HZ3 LYS 57 2.633 14.837 -7.925 779 H ALA 58 HN ALA 58 9.184 13.752 -5.477 780 HA ALA 58 HA ALA 58 9.684 16.587 -5.332 781 HB1 ALA 58 HB1 ALA 58 11.867 14.931 -4.387 782 HB2 ALA 58 HB2 ALA 58 10.319 14.357 -3.766 783 HB3 ALA 58 HB3 ALA 58 10.819 16.025 -3.482 784 H GLY 59 HN GLY 59 10.286 14.371 -7.684 785 HA2 GLY 59 HA2 GLY 59 12.992 15.065 -8.382 786 HA3 GLY 59 HA1 GLY 59 11.860 14.145 -9.369 787 H SER 60 HN SER 60 13.170 15.696 -10.910 788 HA SER 60 HA SER 60 11.366 17.939 -11.495 789 HB2 SER 60 HB2 SER 60 13.230 19.464 -11.877 790 HB3 SER 60 HB1 SER 60 13.280 18.867 -10.221 791 HG SER 60 HG SER 60 14.807 17.299 -10.959 792 H GLN 61 HN GLN 61 11.649 18.766 -13.702 793 HA GLN 61 HA GLN 61 11.703 16.688 -15.606 794 HB2 GLN 61 HB2 GLN 61 11.846 19.693 -15.895 795 HB3 GLN 61 HB1 GLN 61 11.724 18.594 -17.268 796 HG2 GLN 61 HG2 GLN 61 9.613 17.729 -16.479 797 HG3 GLN 61 HG1 GLN 61 9.765 18.610 -14.960 798 HE21 GLN 61 HE21 GLN 61 7.601 18.873 -17.012 799 HE22 GLN 61 HE22 GLN 61 7.625 20.500 -17.492 800 H SER 62 HN SER 62 14.126 19.089 -14.657 801 HA SER 62 HA SER 62 16.325 19.373 -15.317 802 HB2 SER 62 HB2 SER 62 16.221 16.353 -15.161 803 HB3 SER 62 HB1 SER 62 17.672 17.346 -15.065 804 HG SER 62 HG SER 62 16.475 18.406 -13.251 Start of MODEL 3 1 H1 MET 76 HT1 MET 76 7.618 -16.923 -24.117 2 H2 MET 76 HT2 MET 76 7.308 -16.181 -22.619 3 H3 MET 76 HT3 MET 76 6.186 -16.044 -23.888 4 HA MET 76 HA MET 76 5.124 -17.763 -22.996 5 HB2 MET 76 HB2 MET 76 7.094 -18.698 -24.742 6 HB3 MET 76 HB1 MET 76 7.233 -19.751 -23.333 7 HG2 MET 76 HG2 MET 76 5.601 -20.729 -24.826 8 HG3 MET 76 HG1 MET 76 4.736 -20.082 -23.432 9 HE1 MET 76 HE1 MET 76 2.440 -19.698 -26.524 10 HE2 MET 76 HE2 MET 76 2.215 -19.684 -24.777 11 HE3 MET 76 HE3 MET 76 3.253 -20.902 -25.514 12 H LYS 77 HN LYS 77 6.916 -16.248 -21.192 13 HA LYS 77 HA LYS 77 6.960 -18.190 -18.999 14 HB2 LYS 77 HB2 LYS 77 9.251 -18.200 -19.936 15 HB3 LYS 77 HB1 LYS 77 9.333 -16.453 -19.700 16 HG2 LYS 77 HG2 LYS 77 9.158 -16.678 -17.315 17 HG3 LYS 77 HG1 LYS 77 8.750 -18.388 -17.446 18 HD2 LYS 77 HD2 LYS 77 11.058 -18.289 -16.803 19 HD3 LYS 77 HD1 LYS 77 11.033 -18.738 -18.507 20 HE2 LYS 77 HE2 LYS 77 11.561 -16.470 -19.177 21 HE3 LYS 77 HE1 LYS 77 11.388 -15.894 -17.520 22 HZ1 LYS 77 HZ1 LYS 77 13.183 -17.953 -17.370 23 HZ2 LYS 77 HZ2 LYS 77 13.545 -16.294 -17.309 24 HZ3 LYS 77 HZ3 LYS 77 13.622 -17.130 -18.786 25 H ASP 78 HN ASP 78 6.592 -17.281 -16.981 26 HA ASP 78 HA ASP 78 5.118 -14.938 -16.820 27 HB2 ASP 78 HB2 ASP 78 6.683 -16.450 -14.728 28 HB3 ASP 78 HB1 ASP 78 5.659 -15.068 -14.341 29 H THR 79 HN THR 79 5.601 -12.933 -15.735 30 HA THR 79 HA THR 79 8.177 -12.003 -15.125 31 HB THR 79 HB THR 79 8.831 -12.156 -17.395 32 HG1 THR 79 HG1 THR 79 8.185 -9.714 -16.374 33 HG21 THR 79 HG21 THR 79 7.148 -10.850 -19.053 34 HG22 THR 79 HG22 THR 79 5.985 -11.451 -17.871 35 HG23 THR 79 HG23 THR 79 7.027 -12.581 -18.738 36 H ASP 80 HN ASP 80 5.871 -11.708 -13.819 37 HA ASP 80 HA ASP 80 5.300 -8.830 -14.121 38 HB2 ASP 80 HB2 ASP 80 3.160 -10.888 -13.555 39 HB3 ASP 80 HB1 ASP 80 2.943 -9.167 -13.868 40 H SER 81 HN SER 81 6.176 -8.033 -12.299 41 HA SER 81 HA SER 81 6.103 -9.491 -9.788 42 HB2 SER 81 HB2 SER 81 7.108 -6.720 -10.473 43 HB3 SER 81 HB1 SER 81 7.277 -7.490 -8.898 44 HG SER 81 HG SER 81 9.102 -7.737 -10.363 45 H GLU 82 HN GLU 82 3.956 -7.493 -11.427 46 HA GLU 82 HA GLU 82 2.903 -5.850 -9.436 47 HB2 GLU 82 HB2 GLU 82 0.861 -5.814 -10.730 48 HB3 GLU 82 HB1 GLU 82 2.222 -5.842 -11.849 49 HG2 GLU 82 HG2 GLU 82 1.959 -8.361 -11.939 50 HG3 GLU 82 HG1 GLU 82 0.451 -8.163 -11.051 51 H GLU 83 HN GLU 83 2.530 -9.243 -10.039 52 HA GLU 83 HA GLU 83 0.358 -9.741 -8.273 53 HB2 GLU 83 HB2 GLU 83 0.951 -12.070 -8.484 54 HB3 GLU 83 HB1 GLU 83 1.178 -11.309 -10.060 55 HG2 GLU 83 HG2 GLU 83 3.620 -10.958 -9.379 56 HG3 GLU 83 HG1 GLU 83 3.299 -12.056 -8.038 57 H GLU 84 HN GLU 84 3.843 -9.544 -7.856 58 HA GLU 84 HA GLU 84 4.008 -10.667 -5.271 59 HB2 GLU 84 HB2 GLU 84 5.965 -10.275 -6.749 60 HB3 GLU 84 HB1 GLU 84 5.761 -8.539 -6.530 61 HG2 GLU 84 HG2 GLU 84 7.474 -9.350 -4.994 62 HG3 GLU 84 HG1 GLU 84 6.065 -8.833 -4.075 63 H ILE 85 HN ILE 85 3.602 -7.318 -6.379 64 HA ILE 85 HA ILE 85 3.547 -6.164 -3.788 65 HB ILE 85 HB ILE 85 2.481 -5.168 -6.440 66 HG12 ILE 85 HG12 ILE 85 5.043 -5.538 -5.892 67 HG13 ILE 85 HG11 ILE 85 4.517 -4.055 -6.686 68 HG21 ILE 85 HG21 ILE 85 1.253 -3.951 -4.834 69 HG22 ILE 85 HG22 ILE 85 2.646 -2.918 -5.156 70 HG23 ILE 85 HG23 ILE 85 2.602 -3.911 -3.698 71 HD11 ILE 85 HD11 ILE 85 4.681 -4.208 -3.675 72 HD12 ILE 85 HD12 ILE 85 4.694 -2.786 -4.708 73 HD13 ILE 85 HD13 ILE 85 6.106 -3.841 -4.644 74 H ARG 86 HN ARG 86 1.023 -7.341 -5.973 75 HA ARG 86 HA ARG 86 -1.208 -6.453 -4.511 76 HB2 ARG 86 HB2 ARG 86 -0.832 -8.776 -6.399 77 HB3 ARG 86 HB1 ARG 86 -2.394 -8.368 -5.686 78 HG2 ARG 86 HG2 ARG 86 -2.371 -6.182 -6.695 79 HG3 ARG 86 HG1 ARG 86 -0.705 -6.381 -7.226 80 HD2 ARG 86 HD2 ARG 86 -2.235 -6.765 -9.102 81 HD3 ARG 86 HD1 ARG 86 -1.407 -8.262 -8.682 82 HE ARG 86 HE ARG 86 -3.898 -8.037 -7.295 83 HH11 ARG 86 HH21 ARG 86 -2.439 -8.721 -10.358 84 HH12 ARG 86 HH22 ARG 86 -3.728 -9.744 -10.899 85 HH21 ARG 86 HH11 ARG 86 -5.591 -9.379 -7.998 86 HH22 ARG 86 HH12 ARG 86 -5.511 -10.117 -9.563 87 H GLU 87 HN GLU 87 0.803 -9.330 -4.177 88 HA GLU 87 HA GLU 87 -0.823 -10.830 -2.473 89 HB2 GLU 87 HB2 GLU 87 1.340 -11.612 -3.452 90 HB3 GLU 87 HB1 GLU 87 2.193 -10.574 -2.311 91 HG2 GLU 87 HG2 GLU 87 0.175 -12.605 -1.351 92 HG3 GLU 87 HG1 GLU 87 1.844 -13.067 -1.669 93 H ALA 88 HN ALA 88 1.420 -8.189 -1.782 94 HA ALA 88 HA ALA 88 1.254 -8.240 1.025 95 HB1 ALA 88 HB1 ALA 88 2.017 -5.902 0.921 96 HB2 ALA 88 HB2 ALA 88 1.664 -5.863 -0.806 97 HB3 ALA 88 HB3 ALA 88 2.935 -6.920 -0.190 98 H PHE 89 HN PHE 89 -0.887 -6.835 -1.414 99 HA PHE 89 HA PHE 89 -2.488 -5.433 0.555 100 HB2 PHE 89 HB2 PHE 89 -2.804 -5.935 -2.404 101 HB3 PHE 89 HB1 PHE 89 -4.059 -5.152 -1.440 102 HD1 PHE 89 HD2 PHE 89 -3.614 -2.996 -0.304 103 HD2 PHE 89 HD1 PHE 89 -0.726 -4.809 -2.910 104 HE1 PHE 89 HE2 PHE 89 -2.377 -0.851 -0.425 105 HE2 PHE 89 HE1 PHE 89 0.520 -2.666 -3.028 106 HZ PHE 89 HZ PHE 89 -0.313 -0.687 -1.784 107 H ARG 90 HN ARG 90 -2.733 -8.396 -1.369 108 HA ARG 90 HA ARG 90 -5.286 -9.205 -0.779 109 HB2 ARG 90 HB2 ARG 90 -2.789 -10.874 -1.045 110 HB3 ARG 90 HB1 ARG 90 -4.391 -11.586 -0.856 111 HG2 ARG 90 HG2 ARG 90 -5.167 -10.328 -2.851 112 HG3 ARG 90 HG1 ARG 90 -3.541 -9.683 -3.058 113 HD2 ARG 90 HD2 ARG 90 -2.661 -11.974 -3.315 114 HD3 ARG 90 HD1 ARG 90 -4.283 -12.620 -3.101 115 HE ARG 90 HE ARG 90 -4.324 -10.754 -5.217 116 HH11 ARG 90 HH21 ARG 90 -3.059 -13.861 -4.366 117 HH12 ARG 90 HH22 ARG 90 -3.052 -14.457 -5.993 118 HH21 ARG 90 HH11 ARG 90 -4.317 -11.529 -7.352 119 HH22 ARG 90 HH12 ARG 90 -3.764 -13.137 -7.683 120 H VAL 91 HN VAL 91 -2.563 -9.072 1.382 121 HA VAL 91 HA VAL 91 -3.511 -10.784 3.416 122 HB VAL 91 HB VAL 91 -1.725 -8.344 3.506 123 HG11 VAL 91 HG11 VAL 91 -2.846 -10.069 5.671 124 HG12 VAL 91 HG12 VAL 91 -2.355 -8.376 5.728 125 HG13 VAL 91 HG13 VAL 91 -1.137 -9.651 5.785 126 HG21 VAL 91 HG21 VAL 91 -1.068 -10.567 2.340 127 HG22 VAL 91 HG22 VAL 91 -1.004 -11.239 3.970 128 HG23 VAL 91 HG23 VAL 91 0.056 -9.900 3.526 129 H PHE 92 HN PHE 92 -4.101 -7.376 2.693 130 HA PHE 92 HA PHE 92 -5.803 -7.065 5.038 131 HB2 PHE 92 HB2 PHE 92 -5.459 -5.068 2.807 132 HB3 PHE 92 HB1 PHE 92 -5.884 -4.767 4.490 133 HD1 PHE 92 HD2 PHE 92 -3.881 -6.361 5.978 134 HD2 PHE 92 HD1 PHE 92 -3.418 -3.981 2.433 135 HE1 PHE 92 HE2 PHE 92 -1.501 -6.041 6.516 136 HE2 PHE 92 HE1 PHE 92 -1.022 -3.664 2.979 137 HZ PHE 92 HZ PHE 92 -0.060 -4.694 5.013 138 H ASP 93 HN ASP 93 -6.142 -7.697 1.614 139 HA ASP 93 HA ASP 93 -9.006 -7.111 1.645 140 HB2 ASP 93 HB2 ASP 93 -7.518 -6.702 -0.382 141 HB3 ASP 93 HB1 ASP 93 -7.450 -8.450 -0.567 142 H LYS 94 HN LYS 94 -9.248 -8.738 3.469 143 HA LYS 94 HA LYS 94 -8.932 -11.514 2.934 144 HB2 LYS 94 HB2 LYS 94 -10.187 -11.817 4.994 145 HB3 LYS 94 HB1 LYS 94 -8.985 -10.548 5.203 146 HG2 LYS 94 HG2 LYS 94 -10.746 -8.847 4.759 147 HG3 LYS 94 HG1 LYS 94 -11.939 -10.139 4.651 148 HD2 LYS 94 HD2 LYS 94 -11.462 -10.813 6.958 149 HD3 LYS 94 HD1 LYS 94 -10.217 -9.570 7.079 150 HE2 LYS 94 HE2 LYS 94 -12.276 -8.752 8.104 151 HE3 LYS 94 HE1 LYS 94 -11.951 -7.835 6.634 152 HZ1 LYS 94 HZ1 LYS 94 -14.163 -8.379 6.410 153 HZ2 LYS 94 HZ2 LYS 94 -13.980 -9.915 7.114 154 HZ3 LYS 94 HZ3 LYS 94 -13.419 -9.628 5.537 155 H ASP 95 HN ASP 95 -11.350 -9.196 2.161 156 HA ASP 95 HA ASP 95 -13.522 -11.066 1.865 157 HB2 ASP 95 HB2 ASP 95 -13.126 -8.207 0.974 158 HB3 ASP 95 HB1 ASP 95 -14.597 -9.123 0.649 159 H GLY 96 HN GLY 96 -10.913 -9.893 -0.108 160 HA2 GLY 96 HA2 GLY 96 -10.180 -10.537 -2.192 161 HA3 GLY 96 HA1 GLY 96 -11.300 -11.893 -2.087 162 H ASN 97 HN ASN 97 -12.344 -8.561 -1.791 163 HA ASN 97 HA ASN 97 -13.960 -8.906 -4.224 164 HB2 ASN 97 HB2 ASN 97 -14.127 -6.960 -1.919 165 HB3 ASN 97 HB1 ASN 97 -15.129 -6.837 -3.364 166 HD21 ASN 97 HD21 ASN 97 -16.222 -7.339 -0.726 167 HD22 ASN 97 HD22 ASN 97 -16.907 -8.892 -0.744 168 H GLY 98 HN GLY 98 -11.014 -7.691 -3.431 169 HA2 GLY 98 HA2 GLY 98 -9.597 -6.577 -4.981 170 HA3 GLY 98 HA1 GLY 98 -11.026 -5.909 -5.764 171 H TYR 99 HN TYR 99 -11.339 -5.650 -2.441 172 HA TYR 99 HA TYR 99 -10.095 -2.973 -2.367 173 HB2 TYR 99 HB2 TYR 99 -12.885 -3.579 -1.382 174 HB3 TYR 99 HB1 TYR 99 -12.042 -2.032 -1.287 175 HD1 TYR 99 HD1 TYR 99 -13.048 -4.611 -3.801 176 HD2 TYR 99 HD2 TYR 99 -12.364 -0.456 -2.966 177 HE1 TYR 99 HE1 TYR 99 -13.867 -4.031 -6.064 178 HE2 TYR 99 HE2 TYR 99 -13.183 0.129 -5.238 179 HH TYR 99 HH TYR 99 -14.483 -2.354 -7.420 180 H ILE 100 HN ILE 100 -9.742 -2.105 -0.255 181 HA ILE 100 HA ILE 100 -9.775 -4.074 1.945 182 HB ILE 100 HB ILE 100 -7.533 -3.805 2.444 183 HG12 ILE 100 HG12 ILE 100 -7.800 -1.051 1.217 184 HG13 ILE 100 HG11 ILE 100 -7.517 -1.447 2.913 185 HG21 ILE 100 HG21 ILE 100 -7.203 -2.812 -0.369 186 HG22 ILE 100 HG22 ILE 100 -7.872 -4.423 -0.087 187 HG23 ILE 100 HG23 ILE 100 -6.257 -4.026 0.496 188 HD11 ILE 100 HD11 ILE 100 -5.385 -0.853 2.150 189 HD12 ILE 100 HD12 ILE 100 -5.612 -1.642 0.592 190 HD13 ILE 100 HD13 ILE 100 -5.364 -2.612 2.046 191 H SER 101 HN SER 101 -10.167 -3.082 4.017 192 HA SER 101 HA SER 101 -11.717 -0.739 3.965 193 HB2 SER 101 HB2 SER 101 -10.225 -2.011 6.276 194 HB3 SER 101 HB1 SER 101 -11.445 -0.753 6.440 195 HG SER 101 HG SER 101 -12.961 -2.145 5.592 196 H ALA 102 HN ALA 102 -11.195 1.400 4.080 197 HA ALA 102 HA ALA 102 -8.539 2.247 3.600 198 HB1 ALA 102 HB1 ALA 102 -10.901 3.410 3.190 199 HB2 ALA 102 HB2 ALA 102 -9.421 4.355 3.364 200 HB3 ALA 102 HB3 ALA 102 -10.515 4.167 4.736 201 H ALA 103 HN ALA 103 -10.503 2.147 6.507 202 HA ALA 103 HA ALA 103 -8.877 3.642 8.223 203 HB1 ALA 103 HB1 ALA 103 -10.981 1.577 8.591 204 HB2 ALA 103 HB2 ALA 103 -10.906 3.235 9.187 205 HB3 ALA 103 HB3 ALA 103 -9.971 1.970 9.983 206 H GLU 104 HN GLU 104 -8.741 0.140 7.562 207 HA GLU 104 HA GLU 104 -6.750 -0.374 9.530 208 HB2 GLU 104 HB2 GLU 104 -6.631 -2.562 8.681 209 HB3 GLU 104 HB1 GLU 104 -8.298 -2.072 8.423 210 HG2 GLU 104 HG2 GLU 104 -7.945 -2.795 6.304 211 HG3 GLU 104 HG1 GLU 104 -7.165 -1.239 6.098 212 H LEU 105 HN LEU 105 -6.627 0.745 6.254 213 HA LEU 105 HA LEU 105 -3.931 0.143 5.656 214 HB2 LEU 105 HB2 LEU 105 -5.617 0.910 3.979 215 HB3 LEU 105 HB1 LEU 105 -5.584 2.507 4.715 216 HG LEU 105 HG LEU 105 -3.045 2.493 4.246 217 HD11 LEU 105 HD11 LEU 105 -2.107 0.752 3.167 218 HD12 LEU 105 HD12 LEU 105 -3.371 0.753 1.943 219 HD13 LEU 105 HD13 LEU 105 -3.598 -0.139 3.442 220 HD21 LEU 105 HD21 LEU 105 -3.454 3.077 1.814 221 HD22 LEU 105 HD22 LEU 105 -4.505 3.907 2.962 222 HD23 LEU 105 HD23 LEU 105 -5.117 2.535 2.039 223 H ARG 106 HN ARG 106 -5.433 3.061 7.043 224 HA ARG 106 HA ARG 106 -3.100 4.559 7.337 225 HB2 ARG 106 HB2 ARG 106 -4.919 5.876 7.746 226 HB3 ARG 106 HB1 ARG 106 -5.809 4.590 8.548 227 HG2 ARG 106 HG2 ARG 106 -5.151 6.483 10.064 228 HG3 ARG 106 HG1 ARG 106 -4.571 4.916 10.605 229 HD2 ARG 106 HD2 ARG 106 -2.437 5.632 10.525 230 HD3 ARG 106 HD1 ARG 106 -2.620 6.166 8.863 231 HE ARG 106 HE ARG 106 -3.051 8.330 9.639 232 HH11 ARG 106 HH21 ARG 106 -3.001 6.003 12.199 233 HH12 ARG 106 HH22 ARG 106 -2.975 7.188 13.462 234 HH21 ARG 106 HH11 ARG 106 -3.017 9.891 11.291 235 HH22 ARG 106 HH12 ARG 106 -2.985 9.388 12.948 236 H HIS 107 HN HIS 107 -4.685 2.407 9.747 237 HA HIS 107 HA HIS 107 -2.742 2.707 11.757 238 HB2 HIS 107 HB2 HIS 107 -4.889 1.708 12.239 239 HB3 HIS 107 HB1 HIS 107 -4.585 0.400 11.098 240 HD1 HIS 107 HD1 HIS 107 -3.057 1.827 14.292 241 HD2 HIS 107 HD2 HIS 107 -3.362 -1.783 12.235 242 HE1 HIS 107 HE1 HIS 107 -1.992 0.071 15.774 243 HE2 HIS 107 HE2 HIS 107 -2.165 -2.139 14.532 244 H VAL 108 HN VAL 108 -3.052 0.359 9.147 245 HA VAL 108 HA VAL 108 -0.831 -1.255 9.751 246 HB VAL 108 HB VAL 108 -2.276 -0.649 7.165 247 HG11 VAL 108 HG11 VAL 108 -1.190 -2.782 6.367 248 HG12 VAL 108 HG12 VAL 108 -0.110 -2.682 7.752 249 HG13 VAL 108 HG13 VAL 108 -0.081 -1.422 6.518 250 HG21 VAL 108 HG21 VAL 108 -3.625 -2.426 7.699 251 HG22 VAL 108 HG22 VAL 108 -3.181 -1.956 9.339 252 HG23 VAL 108 HG23 VAL 108 -2.338 -3.285 8.543 253 H MET 109 HN MET 109 -1.140 1.690 7.864 254 HA MET 109 HA MET 109 1.576 1.635 6.854 255 HB2 MET 109 HB2 MET 109 -0.756 3.457 6.632 256 HB3 MET 109 HB1 MET 109 0.842 4.181 6.434 257 HG2 MET 109 HG2 MET 109 -0.288 3.261 4.313 258 HG3 MET 109 HG1 MET 109 1.383 2.768 4.611 259 HE1 MET 109 HE1 MET 109 0.478 1.286 2.690 260 HE2 MET 109 HE2 MET 109 0.102 -0.403 3.027 261 HE3 MET 109 HE3 MET 109 1.641 0.272 3.556 262 H THR 110 HN THR 110 -0.013 2.967 9.675 263 HA THR 110 HA THR 110 2.431 4.481 10.317 264 HB THR 110 HB THR 110 1.047 5.639 11.974 265 HG1 THR 110 HG1 THR 110 -0.360 3.727 12.223 266 HG21 THR 110 HG21 THR 110 1.150 6.309 9.526 267 HG22 THR 110 HG22 THR 110 -0.250 6.903 10.423 268 HG23 THR 110 HG23 THR 110 -0.417 5.524 9.336 269 H ASN 111 HN ASN 111 0.722 1.617 11.158 270 HA ASN 111 HA ASN 111 2.155 1.444 13.734 271 HB2 ASN 111 HB2 ASN 111 -0.395 1.185 13.580 272 HB3 ASN 111 HB1 ASN 111 -0.060 -0.386 12.855 273 HD21 ASN 111 HD21 ASN 111 -0.705 -1.715 14.631 274 HD22 ASN 111 HD22 ASN 111 0.070 -1.675 16.140 275 H LEU 112 HN LEU 112 1.551 -0.362 10.726 276 HA LEU 112 HA LEU 112 3.549 -2.365 11.589 277 HB2 LEU 112 HB2 LEU 112 1.598 -2.493 9.288 278 HB3 LEU 112 HB1 LEU 112 2.622 -3.803 9.866 279 HG LEU 112 HG LEU 112 0.435 -2.439 11.464 280 HD11 LEU 112 HD11 LEU 112 0.267 -4.419 9.478 281 HD12 LEU 112 HD12 LEU 112 -0.978 -3.994 10.653 282 HD13 LEU 112 HD13 LEU 112 0.163 -5.292 11.008 283 HD21 LEU 112 HD21 LEU 112 1.850 -3.174 13.135 284 HD22 LEU 112 HD22 LEU 112 2.568 -4.424 12.121 285 HD23 LEU 112 HD23 LEU 112 0.976 -4.676 12.835 286 H GLY 113 HN GLY 113 5.388 -2.755 10.438 287 HA2 GLY 113 HA2 GLY 113 7.143 -2.358 9.016 288 HA3 GLY 113 HA1 GLY 113 5.919 -2.032 7.793 289 H GLU 114 HN GLU 114 8.558 -0.733 9.118 290 HA GLU 114 HA GLU 114 9.045 1.500 9.929 291 HB2 GLU 114 HB2 GLU 114 8.690 1.400 6.931 292 HB3 GLU 114 HB1 GLU 114 9.458 2.748 7.769 293 HG2 GLU 114 HG2 GLU 114 11.152 1.266 8.698 294 HG3 GLU 114 HG1 GLU 114 10.347 -0.140 8.003 295 H LYS 115 HN LYS 115 7.254 2.228 11.149 296 HA LYS 115 HA LYS 115 4.791 3.027 10.332 297 HB2 LYS 115 HB2 LYS 115 6.551 4.439 12.348 298 HB3 LYS 115 HB1 LYS 115 4.796 4.582 12.240 299 HG2 LYS 115 HG2 LYS 115 4.584 2.141 12.627 300 HG3 LYS 115 HG1 LYS 115 6.335 2.023 12.768 301 HD2 LYS 115 HD2 LYS 115 6.295 3.574 14.686 302 HD3 LYS 115 HD1 LYS 115 4.540 3.689 14.555 303 HE2 LYS 115 HE2 LYS 115 4.344 1.266 14.964 304 HE3 LYS 115 HE1 LYS 115 6.099 1.142 15.087 305 HZ1 LYS 115 HZ1 LYS 115 5.130 1.300 17.270 306 HZ2 LYS 115 HZ2 LYS 115 4.321 2.735 16.852 307 HZ3 LYS 115 HZ3 LYS 115 6.018 2.710 16.948 308 H LEU 116 HN LEU 116 3.918 4.572 9.118 309 HA LEU 116 HA LEU 116 5.644 6.581 7.867 310 HB2 LEU 116 HB2 LEU 116 2.901 5.489 7.339 311 HB3 LEU 116 HB1 LEU 116 3.255 7.122 6.794 312 HG LEU 116 HG LEU 116 3.684 5.368 5.046 313 HD11 LEU 116 HD11 LEU 116 6.422 6.237 5.397 314 HD12 LEU 116 HD12 LEU 116 5.322 7.551 5.804 315 HD13 LEU 116 HD13 LEU 116 5.229 6.784 4.221 316 HD21 LEU 116 HD21 LEU 116 5.483 3.814 5.303 317 HD22 LEU 116 HD22 LEU 116 4.493 3.675 6.758 318 HD23 LEU 116 HD23 LEU 116 6.013 4.569 6.801 319 H THR 117 HN THR 117 4.997 8.890 7.891 320 HA THR 117 HA THR 117 3.898 9.605 10.508 321 HB THR 117 HB THR 117 4.788 11.833 10.048 322 HG1 THR 117 HG1 THR 117 4.372 11.663 7.746 323 HG21 THR 117 HG21 THR 117 7.092 11.287 10.163 324 HG22 THR 117 HG22 THR 117 6.880 9.840 9.177 325 HG23 THR 117 HG23 THR 117 6.264 9.880 10.830 326 H ASP 118 HN ASP 118 2.514 11.691 10.475 327 HA ASP 118 HA ASP 118 0.096 11.127 9.190 328 HB2 ASP 118 HB2 ASP 118 1.165 13.666 10.418 329 HB3 ASP 118 HB1 ASP 118 -0.480 13.521 9.802 330 H GLU 119 HN GLU 119 2.702 13.354 8.286 331 HA GLU 119 HA GLU 119 1.390 14.570 6.098 332 HB2 GLU 119 HB2 GLU 119 4.323 14.109 6.672 333 HB3 GLU 119 HB1 GLU 119 3.745 15.045 5.294 334 HG2 GLU 119 HG2 GLU 119 2.626 16.619 6.752 335 HG3 GLU 119 HG1 GLU 119 2.983 15.629 8.166 336 H GLU 120 HN GLU 120 3.389 11.647 6.304 337 HA GLU 120 HA GLU 120 3.355 11.100 3.499 338 HB2 GLU 120 HB2 GLU 120 4.024 9.514 5.960 339 HB3 GLU 120 HB1 GLU 120 3.925 8.734 4.381 340 HG2 GLU 120 HG2 GLU 120 6.221 9.705 5.188 341 HG3 GLU 120 HG1 GLU 120 5.720 9.948 3.517 342 H VAL 121 HN VAL 121 1.385 10.094 6.271 343 HA VAL 121 HA VAL 121 -0.218 8.189 4.937 344 HB VAL 121 HB VAL 121 -0.673 9.937 7.368 345 HG11 VAL 121 HG11 VAL 121 -2.466 8.259 7.921 346 HG12 VAL 121 HG12 VAL 121 -2.346 7.676 6.264 347 HG13 VAL 121 HG13 VAL 121 -2.861 9.334 6.587 348 HG21 VAL 121 HG21 VAL 121 -0.359 6.992 7.526 349 HG22 VAL 121 HG22 VAL 121 0.276 8.250 8.586 350 HG23 VAL 121 HG23 VAL 121 1.076 7.899 7.055 351 H ASP 122 HN ASP 122 -0.688 11.690 5.552 352 HA ASP 122 HA ASP 122 -3.271 11.883 4.500 353 HB2 ASP 122 HB2 ASP 122 -1.001 13.883 4.636 354 HB3 ASP 122 HB1 ASP 122 -2.614 14.307 4.056 355 H GLU 123 HN GLU 123 -0.121 12.065 2.885 356 HA GLU 123 HA GLU 123 -1.114 12.733 0.313 357 HB2 GLU 123 HB2 GLU 123 1.305 12.854 1.054 358 HB3 GLU 123 HB1 GLU 123 1.361 11.098 0.932 359 HG2 GLU 123 HG2 GLU 123 0.466 12.832 -1.380 360 HG3 GLU 123 HG1 GLU 123 2.158 12.421 -1.121 361 H MET 124 HN MET 124 -0.579 9.716 2.033 362 HA MET 124 HA MET 124 -1.103 7.921 -0.118 363 HB2 MET 124 HB2 MET 124 -1.250 7.615 2.894 364 HB3 MET 124 HB1 MET 124 -1.413 6.286 1.755 365 HG2 MET 124 HG2 MET 124 0.938 8.101 1.489 366 HG3 MET 124 HG1 MET 124 0.958 6.908 2.783 367 HE1 MET 124 HE1 MET 124 1.630 4.024 1.990 368 HE2 MET 124 HE2 MET 124 0.092 3.723 1.185 369 HE3 MET 124 HE3 MET 124 0.149 4.787 2.590 370 H ILE 125 HN ILE 125 -3.104 9.388 2.423 371 HA ILE 125 HA ILE 125 -5.450 7.917 1.938 372 HB ILE 125 HB ILE 125 -4.676 10.229 3.500 373 HG12 ILE 125 HG12 ILE 125 -6.358 9.219 5.062 374 HG13 ILE 125 HG11 ILE 125 -6.731 8.038 3.816 375 HG21 ILE 125 HG21 ILE 125 -7.017 11.076 3.782 376 HG22 ILE 125 HG22 ILE 125 -7.463 10.172 2.340 377 HG23 ILE 125 HG23 ILE 125 -6.284 11.480 2.234 378 HD11 ILE 125 HD11 ILE 125 -3.905 8.441 4.735 379 HD12 ILE 125 HD12 ILE 125 -4.605 7.040 3.938 380 HD13 ILE 125 HD13 ILE 125 -4.991 7.382 5.626 381 H ARG 126 HN ARG 126 -4.243 10.918 0.555 382 HA ARG 126 HA ARG 126 -6.555 11.612 -0.908 383 HB2 ARG 126 HB2 ARG 126 -4.525 13.074 -0.451 384 HB3 ARG 126 HB1 ARG 126 -3.707 12.189 -1.739 385 HG2 ARG 126 HG2 ARG 126 -4.585 13.971 -2.942 386 HG3 ARG 126 HG1 ARG 126 -5.887 12.797 -3.110 387 HD2 ARG 126 HD2 ARG 126 -6.793 14.990 -2.477 388 HD3 ARG 126 HD1 ARG 126 -7.058 13.830 -1.183 389 HE ARG 126 HE ARG 126 -5.573 15.041 0.150 390 HH11 ARG 126 HH21 ARG 126 -5.442 16.039 -3.160 391 HH12 ARG 126 HH22 ARG 126 -4.458 17.429 -2.847 392 HH21 ARG 126 HH11 ARG 126 -4.280 16.863 0.569 393 HH22 ARG 126 HH12 ARG 126 -3.799 17.896 -0.735 394 H GLU 127 HN GLU 127 -4.011 9.324 -1.469 395 HA GLU 127 HA GLU 127 -4.894 8.852 -4.235 396 HB2 GLU 127 HB2 GLU 127 -2.572 7.679 -2.687 397 HB3 GLU 127 HB1 GLU 127 -2.918 7.394 -4.393 398 HG2 GLU 127 HG2 GLU 127 -2.425 10.129 -3.188 399 HG3 GLU 127 HG1 GLU 127 -1.200 9.177 -4.023 400 H ALA 128 HN ALA 128 -5.506 7.716 -1.121 401 HA ALA 128 HA ALA 128 -5.907 4.935 -1.793 402 HB1 ALA 128 HB1 ALA 128 -7.174 6.125 0.624 403 HB2 ALA 128 HB2 ALA 128 -5.416 6.144 0.522 404 HB3 ALA 128 HB3 ALA 128 -6.275 4.622 0.444 405 H ASP 129 HN ASP 129 -8.274 7.328 -0.547 406 HA ASP 129 HA ASP 129 -10.155 7.478 -2.451 407 HB2 ASP 129 HB2 ASP 129 -10.164 4.709 -1.367 408 HB3 ASP 129 HB1 ASP 129 -11.730 5.467 -1.587 409 H ILE 130 HN ILE 130 -11.378 5.703 0.243 410 HA ILE 130 HA ILE 130 -12.694 6.254 2.004 411 HB ILE 130 HB ILE 130 -11.080 8.811 1.973 412 HG12 ILE 130 HG12 ILE 130 -10.841 6.354 3.736 413 HG13 ILE 130 HG11 ILE 130 -9.850 6.613 2.299 414 HG21 ILE 130 HG21 ILE 130 -13.363 7.863 3.561 415 HG22 ILE 130 HG22 ILE 130 -12.671 9.483 3.447 416 HG23 ILE 130 HG23 ILE 130 -11.967 8.300 4.546 417 HD11 ILE 130 HD11 ILE 130 -10.038 8.643 4.531 418 HD12 ILE 130 HD12 ILE 130 -8.866 8.582 3.221 419 HD13 ILE 130 HD13 ILE 130 -8.819 7.372 4.503 420 H ASP 131 HN ASP 131 -14.057 6.414 -0.206 421 HA ASP 131 HA ASP 131 -15.238 9.049 -0.573 422 HB2 ASP 131 HB2 ASP 131 -14.949 7.432 -2.472 423 HB3 ASP 131 HB1 ASP 131 -16.138 6.384 -1.700 424 H GLY 132 HN GLY 132 -15.696 9.025 1.802 425 HA2 GLY 132 HA2 GLY 132 -17.125 8.757 3.617 426 HA3 GLY 132 HA1 GLY 132 -18.371 8.954 2.386 427 H ASP 133 HN ASP 133 -16.125 6.274 2.309 428 HA ASP 133 HA ASP 133 -18.263 4.455 3.228 429 HB2 ASP 133 HB2 ASP 133 -16.531 4.220 0.773 430 HB3 ASP 133 HB1 ASP 133 -17.411 2.852 1.456 431 H GLY 134 HN GLY 134 -14.915 5.302 3.208 432 HA2 GLY 134 HA2 GLY 134 -13.224 4.614 4.622 433 HA3 GLY 134 HA1 GLY 134 -14.381 3.557 5.417 434 H GLN 135 HN GLN 135 -13.824 3.335 1.952 435 HA GLN 135 HA GLN 135 -12.272 0.853 2.398 436 HB2 GLN 135 HB2 GLN 135 -13.386 -0.036 0.318 437 HB3 GLN 135 HB1 GLN 135 -14.443 0.124 1.725 438 HG2 GLN 135 HG2 GLN 135 -15.221 2.311 0.867 439 HG3 GLN 135 HG1 GLN 135 -14.193 2.117 -0.549 440 HE21 GLN 135 HE21 GLN 135 -15.591 1.646 -2.261 441 HE22 GLN 135 HE22 GLN 135 -16.818 0.473 -2.210 442 H VAL 136 HN VAL 136 -10.708 0.319 0.869 443 HA VAL 136 HA VAL 136 -10.045 2.413 -1.084 444 HB VAL 136 HB VAL 136 -8.287 1.182 1.017 445 HG11 VAL 136 HG11 VAL 136 -6.951 0.880 -0.917 446 HG12 VAL 136 HG12 VAL 136 -6.442 2.445 -0.287 447 HG13 VAL 136 HG13 VAL 136 -7.546 2.369 -1.660 448 HG21 VAL 136 HG21 VAL 136 -9.613 3.390 1.245 449 HG22 VAL 136 HG22 VAL 136 -8.466 4.039 0.078 450 HG23 VAL 136 HG23 VAL 136 -7.894 3.429 1.631 451 H ASN 137 HN ASN 137 -9.410 1.737 -3.022 452 HA ASN 137 HA ASN 137 -9.344 -1.148 -3.505 453 HB2 ASN 137 HB2 ASN 137 -9.214 -0.319 -5.947 454 HB3 ASN 137 HB1 ASN 137 -10.720 -0.055 -5.075 455 HD21 ASN 137 HD21 ASN 137 -11.515 1.996 -5.525 456 HD22 ASN 137 HD22 ASN 137 -10.565 3.392 -5.697 457 H TYR 138 HN TYR 138 -7.352 -2.061 -3.240 458 HA TYR 138 HA TYR 138 -4.933 -0.616 -3.263 459 HB2 TYR 138 HB2 TYR 138 -3.817 -2.819 -3.290 460 HB3 TYR 138 HB1 TYR 138 -5.105 -2.735 -2.092 461 HD1 TYR 138 HD1 TYR 138 -4.215 -4.013 -5.470 462 HD2 TYR 138 HD2 TYR 138 -7.032 -4.131 -2.240 463 HE1 TYR 138 HE1 TYR 138 -5.296 -6.003 -6.482 464 HE2 TYR 138 HE2 TYR 138 -8.114 -6.113 -3.236 465 HH TYR 138 HH TYR 138 -6.771 -8.032 -5.423 466 H GLU 139 HN GLU 139 -6.843 -1.609 -5.870 467 HA GLU 139 HA GLU 139 -4.916 -2.288 -7.802 468 HB2 GLU 139 HB2 GLU 139 -7.347 -2.528 -8.169 469 HB3 GLU 139 HB1 GLU 139 -7.507 -0.773 -8.224 470 HG2 GLU 139 HG2 GLU 139 -6.036 -0.669 -10.181 471 HG3 GLU 139 HG1 GLU 139 -5.782 -2.411 -10.105 472 H GLU 140 HN GLU 140 -6.297 0.935 -7.034 473 HA GLU 140 HA GLU 140 -4.759 2.381 -8.874 474 HB2 GLU 140 HB2 GLU 140 -6.000 3.182 -6.241 475 HB3 GLU 140 HB1 GLU 140 -5.219 4.332 -7.327 476 HG2 GLU 140 HG2 GLU 140 -6.768 3.782 -9.113 477 HG3 GLU 140 HG1 GLU 140 -7.482 2.492 -8.148 478 H PHE 141 HN PHE 141 -4.066 1.457 -5.527 479 HA PHE 141 HA PHE 141 -1.683 2.975 -5.243 480 HB2 PHE 141 HB2 PHE 141 -2.956 0.720 -3.814 481 HB3 PHE 141 HB1 PHE 141 -1.200 0.786 -3.678 482 HD1 PHE 141 HD2 PHE 141 -0.245 3.259 -3.291 483 HD2 PHE 141 HD1 PHE 141 -4.200 1.940 -2.242 484 HE1 PHE 141 HE2 PHE 141 -0.410 5.080 -1.618 485 HE2 PHE 141 HE1 PHE 141 -4.352 3.752 -0.561 486 HZ PHE 141 HZ PHE 141 -2.463 5.326 -0.252 487 H VAL 142 HN VAL 142 -2.280 -0.320 -6.437 488 HA VAL 142 HA VAL 142 0.455 -0.961 -6.850 489 HB VAL 142 HB VAL 142 -2.088 -2.055 -8.064 490 HG11 VAL 142 HG11 VAL 142 -0.409 -3.974 -8.665 491 HG12 VAL 142 HG12 VAL 142 0.813 -2.706 -8.561 492 HG13 VAL 142 HG13 VAL 142 -0.504 -2.570 -9.728 493 HG21 VAL 142 HG21 VAL 142 -2.087 -3.400 -6.242 494 HG22 VAL 142 HG22 VAL 142 -0.822 -2.369 -5.569 495 HG23 VAL 142 HG23 VAL 142 -0.391 -3.811 -6.486 496 H GLN 143 HN GLN 143 -2.011 0.537 -8.914 497 HA GLN 143 HA GLN 143 -0.496 0.615 -11.287 498 HB2 GLN 143 HB2 GLN 143 -2.940 1.148 -11.115 499 HB3 GLN 143 HB1 GLN 143 -2.510 2.668 -10.331 500 HG2 GLN 143 HG2 GLN 143 -2.864 3.079 -12.703 501 HG3 GLN 143 HG1 GLN 143 -1.153 3.270 -12.337 502 HE21 GLN 143 HE21 GLN 143 -3.394 0.611 -13.334 503 HE22 GLN 143 HE22 GLN 143 -2.299 -0.086 -14.429 504 H MET 144 HN MET 144 -0.721 2.814 -8.528 505 HA MET 144 HA MET 144 0.935 4.881 -9.487 506 HB2 MET 144 HB2 MET 144 0.459 3.850 -6.674 507 HB3 MET 144 HB1 MET 144 1.381 5.304 -7.028 508 HG2 MET 144 HG2 MET 144 -0.497 6.439 -7.870 509 HG3 MET 144 HG1 MET 144 -1.400 4.945 -8.118 510 HE1 MET 144 HE1 MET 144 0.270 7.291 -5.658 511 HE2 MET 144 HE2 MET 144 0.723 5.804 -4.828 512 HE3 MET 144 HE3 MET 144 -0.423 6.911 -4.073 513 H MET 145 HN MET 145 1.649 1.896 -7.720 514 HA MET 145 HA MET 145 4.455 2.301 -7.540 515 HB2 MET 145 HB2 MET 145 2.733 -0.177 -7.288 516 HB3 MET 145 HB1 MET 145 4.467 -0.136 -6.946 517 HG2 MET 145 HG2 MET 145 4.094 1.631 -5.266 518 HG3 MET 145 HG1 MET 145 2.368 1.582 -5.603 519 HE1 MET 145 HE1 MET 145 3.301 0.483 -2.195 520 HE2 MET 145 HE2 MET 145 1.611 0.300 -2.658 521 HE3 MET 145 HE3 MET 145 2.543 1.662 -3.273 522 H THR 146 HN THR 146 2.417 1.216 -10.113 523 HA THR 146 HA THR 146 4.789 0.216 -11.575 524 HB THR 146 HB THR 146 3.213 -1.153 -12.897 525 HG1 THR 146 HG1 THR 146 1.386 0.049 -11.116 526 HG21 THR 146 HG21 THR 146 2.566 -2.709 -11.000 527 HG22 THR 146 HG22 THR 146 3.174 -1.481 -9.890 528 HG23 THR 146 HG23 THR 146 4.267 -2.249 -11.041 529 H ALA 147 HN ALA 147 3.417 2.967 -11.284 530 HA ALA 147 HA ALA 147 3.247 3.496 -14.188 531 HB1 ALA 147 HB1 ALA 147 1.508 4.713 -12.029 532 HB2 ALA 147 HB2 ALA 147 0.982 3.558 -13.254 533 HB3 ALA 147 HB3 ALA 147 1.500 5.175 -13.731 534 H LYS 148 HN LYS 148 5.592 3.731 -12.664 535 HA LYS 148 HA LYS 148 6.338 6.405 -13.245 536 HB2 LYS 148 HB2 LYS 148 4.982 6.418 -10.939 537 HB3 LYS 148 HB1 LYS 148 6.558 5.942 -10.309 538 HG2 LYS 148 HG2 LYS 148 6.760 8.251 -10.233 539 HG3 LYS 148 HG1 LYS 148 7.411 7.929 -11.839 540 HD2 LYS 148 HD2 LYS 148 5.048 8.271 -12.733 541 HD3 LYS 148 HD1 LYS 148 4.626 8.877 -11.132 542 HE2 LYS 148 HE2 LYS 148 6.822 9.995 -12.899 543 HE3 LYS 148 HE1 LYS 148 5.233 10.723 -12.664 544 HZ1 LYS 148 HZ1 LYS 148 6.145 11.774 -10.950 545 HZ2 LYS 148 HZ2 LYS 148 7.536 10.799 -10.971 546 HZ3 LYS 148 HZ3 LYS 148 6.148 10.287 -10.136 547 H PHE 30 HT1 PHE 30 -9.148 -2.353 12.128 548 HA PHE 30 HA PHE 30 -8.208 -3.880 10.637 549 HB2 PHE 30 HB2 PHE 30 -6.176 -4.439 12.635 550 HB3 PHE 30 HB1 PHE 30 -6.105 -3.348 11.253 551 HD1 PHE 30 HD2 PHE 30 -7.654 -1.159 11.549 552 HD2 PHE 30 HD1 PHE 30 -5.972 -3.474 14.753 553 HE1 PHE 30 HE2 PHE 30 -7.858 0.791 13.066 554 HE2 PHE 30 HE1 PHE 30 -6.179 -1.524 16.269 555 HZ PHE 30 HZ PHE 30 -7.121 0.608 15.426 556 H ASP 31 HN ASP 31 -9.224 -5.809 10.221 557 HA ASP 31 HA ASP 31 -8.998 -7.973 12.204 558 HB2 ASP 31 HB2 ASP 31 -10.733 -7.601 9.761 559 HB3 ASP 31 HB1 ASP 31 -10.623 -9.131 10.629 560 H ILE 32 HN ILE 32 -6.586 -7.819 11.451 561 HA ILE 32 HA ILE 32 -6.236 -9.829 9.310 562 HB ILE 32 HB ILE 32 -4.452 -8.667 8.335 563 HG12 ILE 32 HG12 ILE 32 -4.381 -7.019 10.884 564 HG13 ILE 32 HG11 ILE 32 -3.128 -8.107 10.275 565 HG21 ILE 32 HG21 ILE 32 -6.028 -6.287 9.243 566 HG22 ILE 32 HG22 ILE 32 -6.819 -7.534 8.277 567 HG23 ILE 32 HG23 ILE 32 -5.422 -6.675 7.637 568 HD11 ILE 32 HD11 ILE 32 -3.125 -6.594 8.175 569 HD12 ILE 32 HD12 ILE 32 -2.343 -5.989 9.635 570 HD13 ILE 32 HD13 ILE 32 -3.955 -5.422 9.197 571 H ASP 33 HN ASP 33 -4.094 -10.935 9.466 572 HA ASP 33 HA ASP 33 -3.643 -11.691 12.230 573 HB2 ASP 33 HB2 ASP 33 -2.339 -12.696 9.687 574 HB3 ASP 33 HB1 ASP 33 -2.182 -13.422 11.286 575 H MET 34 HN MET 34 -2.783 -9.629 12.916 576 HA MET 34 HA MET 34 -0.455 -8.466 11.836 577 HB2 MET 34 HB2 MET 34 -1.696 -8.305 14.582 578 HB3 MET 34 HB1 MET 34 -0.265 -7.382 14.121 579 HG2 MET 34 HG2 MET 34 -1.518 -6.381 12.241 580 HG3 MET 34 HG1 MET 34 -2.952 -7.291 12.720 581 HE1 MET 34 HE1 MET 34 -3.778 -3.622 13.607 582 HE2 MET 34 HE2 MET 34 -3.855 -4.906 12.402 583 HE3 MET 34 HE3 MET 34 -2.416 -3.892 12.506 584 H ASP 35 HN ASP 35 -0.945 -10.977 14.258 585 HA ASP 35 HA ASP 35 1.658 -11.078 15.306 586 HB2 ASP 35 HB2 ASP 35 -0.467 -13.200 14.988 587 HB3 ASP 35 HB1 ASP 35 1.059 -13.492 15.821 588 H ALA 36 HN ALA 36 0.252 -12.568 12.414 589 HA ALA 36 HA ALA 36 2.358 -14.302 11.780 590 HB1 ALA 36 HB1 ALA 36 0.009 -14.023 10.710 591 HB2 ALA 36 HB2 ALA 36 1.355 -14.527 9.691 592 HB3 ALA 36 HB3 ALA 36 0.810 -12.851 9.664 593 HA PRO 37 HA PRO 37 5.591 -11.155 11.012 594 HB2 PRO 37 HB2 PRO 37 6.697 -13.424 9.397 595 HB3 PRO 37 HB1 PRO 37 7.517 -12.364 10.562 596 HG2 PRO 37 HG2 PRO 37 6.868 -14.816 11.246 597 HG3 PRO 37 HG1 PRO 37 6.642 -13.477 12.388 598 HD2 PRO 37 HD2 PRO 37 4.582 -14.950 10.782 599 HD3 PRO 37 HD1 PRO 37 4.483 -14.278 12.428 600 H GLU 38 HN GLU 38 4.219 -13.193 8.454 601 HA GLU 38 HA GLU 38 5.141 -11.850 6.199 602 HB2 GLU 38 HB2 GLU 38 3.209 -12.799 5.041 603 HB3 GLU 38 HB1 GLU 38 3.914 -13.986 6.136 604 HG2 GLU 38 HG2 GLU 38 2.204 -13.358 7.846 605 HG3 GLU 38 HG1 GLU 38 1.457 -12.291 6.660 606 H THR 39 HN THR 39 2.453 -11.044 8.345 607 HA THR 39 HA THR 39 1.221 -9.094 6.721 608 HB THR 39 HB THR 39 1.359 -9.234 9.744 609 HG1 THR 39 HG1 THR 39 -0.798 -9.996 8.119 610 HG21 THR 39 HG21 THR 39 -0.798 -7.928 9.539 611 HG22 THR 39 HG22 THR 39 -0.412 -7.688 7.835 612 HG23 THR 39 HG23 THR 39 0.649 -7.030 9.081 613 H GLU 40 HN GLU 40 3.716 -8.745 9.254 614 HA GLU 40 HA GLU 40 4.016 -5.936 8.967 615 HB2 GLU 40 HB2 GLU 40 5.854 -8.088 10.034 616 HB3 GLU 40 HB1 GLU 40 6.271 -6.374 10.059 617 HG2 GLU 40 HG2 GLU 40 5.278 -6.931 12.192 618 HG3 GLU 40 HG1 GLU 40 4.130 -5.939 11.297 619 H ARG 41 HN ARG 41 5.592 -8.709 7.487 620 HA ARG 41 HA ARG 41 7.598 -7.351 6.075 621 HB2 ARG 41 HB2 ARG 41 7.659 -9.752 6.355 622 HB3 ARG 41 HB1 ARG 41 6.129 -9.925 5.513 623 HG2 ARG 41 HG2 ARG 41 8.009 -10.543 4.061 624 HG3 ARG 41 HG1 ARG 41 7.164 -9.139 3.422 625 HD2 ARG 41 HD2 ARG 41 8.879 -7.645 4.249 626 HD3 ARG 41 HD1 ARG 41 9.656 -8.951 5.141 627 HE ARG 41 HE ARG 41 9.639 -9.757 2.495 628 HH11 ARG 41 HH21 ARG 41 10.787 -7.058 4.334 629 HH12 ARG 41 HH22 ARG 41 12.136 -6.746 3.293 630 HH21 ARG 41 HH11 ARG 41 11.407 -9.353 1.125 631 HH22 ARG 41 HH12 ARG 41 12.487 -8.045 1.478 632 H ALA 42 HN ALA 42 4.291 -8.267 5.162 633 HA ALA 42 HA ALA 42 4.359 -7.298 2.516 634 HB1 ALA 42 HB1 ALA 42 2.521 -8.657 2.957 635 HB2 ALA 42 HB2 ALA 42 1.791 -7.051 2.977 636 HB3 ALA 42 HB3 ALA 42 2.176 -7.865 4.494 637 H ALA 43 HN ALA 43 3.561 -5.749 5.594 638 HA ALA 43 HA ALA 43 2.627 -3.297 4.571 639 HB1 ALA 43 HB1 ALA 43 2.795 -2.485 6.766 640 HB2 ALA 43 HB2 ALA 43 4.189 -3.499 7.140 641 HB3 ALA 43 HB3 ALA 43 2.584 -4.219 7.002 642 H VAL 44 HN VAL 44 5.872 -4.436 5.407 643 HA VAL 44 HA VAL 44 7.246 -2.005 5.065 644 HB VAL 44 HB VAL 44 8.149 -4.874 4.799 645 HG11 VAL 44 HG11 VAL 44 10.444 -3.631 5.212 646 HG12 VAL 44 HG12 VAL 44 9.609 -2.275 4.453 647 HG13 VAL 44 HG13 VAL 44 9.807 -3.792 3.575 648 HG21 VAL 44 HG21 VAL 44 8.775 -2.842 6.949 649 HG22 VAL 44 HG22 VAL 44 8.958 -4.594 7.021 650 HG23 VAL 44 HG23 VAL 44 7.348 -3.875 7.031 651 H ALA 45 HN ALA 45 6.611 -4.645 2.747 652 HA ALA 45 HA ALA 45 8.095 -3.585 0.607 653 HB1 ALA 45 HB1 ALA 45 6.947 -5.906 0.885 654 HB2 ALA 45 HB2 ALA 45 7.068 -5.198 -0.726 655 HB3 ALA 45 HB3 ALA 45 5.549 -5.108 0.165 656 H ILE 46 HN ILE 46 4.679 -3.140 1.480 657 HA ILE 46 HA ILE 46 3.994 -1.554 -0.751 658 HB ILE 46 HB ILE 46 2.832 -1.732 2.031 659 HG12 ILE 46 HG12 ILE 46 1.773 -2.724 -0.626 660 HG13 ILE 46 HG11 ILE 46 2.778 -3.716 0.431 661 HG21 ILE 46 HG21 ILE 46 1.977 -0.150 -0.393 662 HG22 ILE 46 HG22 ILE 46 2.135 0.404 1.271 663 HG23 ILE 46 HG23 ILE 46 0.812 -0.671 0.819 664 HD11 ILE 46 HD11 ILE 46 0.275 -2.363 1.436 665 HD12 ILE 46 HD12 ILE 46 1.164 -3.702 2.163 666 HD13 ILE 46 HD13 ILE 46 0.232 -3.960 0.688 667 H GLN 47 HN GLN 47 5.096 -0.675 2.511 668 HA GLN 47 HA GLN 47 4.998 2.132 2.132 669 HB2 GLN 47 HB2 GLN 47 6.602 0.400 4.012 670 HB3 GLN 47 HB1 GLN 47 6.609 2.162 4.070 671 HG2 GLN 47 HG2 GLN 47 4.156 2.158 4.395 672 HG3 GLN 47 HG1 GLN 47 4.161 0.397 4.355 673 HE21 GLN 47 HE21 GLN 47 7.039 1.195 5.753 674 HE22 GLN 47 HE22 GLN 47 6.582 1.186 7.387 675 H SER 48 HN SER 48 7.565 -0.273 1.639 676 HA SER 48 HA SER 48 9.676 1.513 1.133 677 HB2 SER 48 HB2 SER 48 10.041 -0.881 1.509 678 HB3 SER 48 HB1 SER 48 9.207 -1.257 0.004 679 HG SER 48 HG SER 48 10.926 -0.684 -1.079 680 H GLN 49 HN GLN 49 7.387 -0.047 -1.104 681 HA GLN 49 HA GLN 49 8.428 1.188 -3.439 682 HB2 GLN 49 HB2 GLN 49 5.993 -0.357 -2.740 683 HB3 GLN 49 HB1 GLN 49 5.893 0.678 -4.162 684 HG2 GLN 49 HG2 GLN 49 6.668 -1.566 -4.793 685 HG3 GLN 49 HG1 GLN 49 7.933 -0.376 -5.079 686 HE21 GLN 49 HE21 GLN 49 9.943 -1.031 -4.322 687 HE22 GLN 49 HE22 GLN 49 10.198 -2.094 -3.023 688 H PHE 50 HN PHE 50 5.974 2.103 -1.086 689 HA PHE 50 HA PHE 50 4.855 4.260 -2.482 690 HB2 PHE 50 HB2 PHE 50 3.737 3.456 -0.511 691 HB3 PHE 50 HB1 PHE 50 5.146 3.800 0.493 692 HD1 PHE 50 HD1 PHE 50 3.099 5.663 -2.062 693 HD2 PHE 50 HD2 PHE 50 4.935 5.710 1.833 694 HE1 PHE 50 HE1 PHE 50 2.331 7.986 -1.726 695 HE2 PHE 50 HE2 PHE 50 4.160 8.047 2.158 696 HZ PHE 50 HZ PHE 50 2.859 9.180 0.381 697 H ARG 51 HN ARG 51 7.597 4.184 -0.211 698 HA ARG 51 HA ARG 51 8.116 6.953 -0.239 699 HB2 ARG 51 HB2 ARG 51 9.971 4.598 0.196 700 HB3 ARG 51 HB1 ARG 51 10.443 6.278 0.448 701 HG2 ARG 51 HG2 ARG 51 7.977 5.927 1.813 702 HG3 ARG 51 HG1 ARG 51 8.977 4.534 2.216 703 HD2 ARG 51 HD2 ARG 51 9.464 6.271 3.817 704 HD3 ARG 51 HD1 ARG 51 10.855 6.122 2.747 705 HE ARG 51 HE ARG 51 9.109 8.076 1.697 706 HH11 ARG 51 HH21 ARG 51 11.198 7.487 4.392 707 HH12 ARG 51 HH22 ARG 51 11.586 9.158 4.632 708 HH21 ARG 51 HH11 ARG 51 9.615 10.267 2.004 709 HH22 ARG 51 HH12 ARG 51 10.690 10.732 3.280 710 H LYS 52 HN LYS 52 9.167 4.345 -2.383 711 HA LYS 52 HA LYS 52 11.066 5.799 -3.873 712 HB2 LYS 52 HB2 LYS 52 9.297 3.466 -4.623 713 HB3 LYS 52 HB1 LYS 52 10.549 4.112 -5.684 714 HG2 LYS 52 HG2 LYS 52 12.244 3.700 -3.937 715 HG3 LYS 52 HG1 LYS 52 10.994 3.046 -2.879 716 HD2 LYS 52 HD2 LYS 52 10.509 1.281 -4.533 717 HD3 LYS 52 HD1 LYS 52 11.755 1.934 -5.597 718 HE2 LYS 52 HE2 LYS 52 13.462 1.516 -3.868 719 HE3 LYS 52 HE1 LYS 52 12.220 0.867 -2.796 720 HZ1 LYS 52 HZ1 LYS 52 13.321 -0.926 -3.917 721 HZ2 LYS 52 HZ2 LYS 52 13.026 -0.225 -5.437 722 HZ3 LYS 52 HZ3 LYS 52 11.733 -0.813 -4.504 723 H PHE 53 HN PHE 53 7.568 5.490 -4.163 724 HA PHE 53 HA PHE 53 7.199 6.737 -6.649 725 HB2 PHE 53 HB2 PHE 53 5.423 5.530 -5.408 726 HB3 PHE 53 HB1 PHE 53 5.386 6.835 -4.225 727 HD1 PHE 53 HD1 PHE 53 4.636 5.894 -7.712 728 HD2 PHE 53 HD2 PHE 53 4.410 8.995 -4.748 729 HE1 PHE 53 HE1 PHE 53 3.049 7.151 -9.147 730 HE2 PHE 53 HE2 PHE 53 2.824 10.250 -6.182 731 HZ PHE 53 HZ PHE 53 2.144 9.327 -8.382 732 H GLN 54 HN GLN 54 7.325 8.108 -3.368 733 HA GLN 54 HA GLN 54 6.802 10.787 -4.067 734 HB2 GLN 54 HB2 GLN 54 8.362 9.589 -1.770 735 HB3 GLN 54 HB1 GLN 54 7.986 11.306 -1.902 736 HG2 GLN 54 HG2 GLN 54 5.571 10.753 -2.007 737 HG3 GLN 54 HG1 GLN 54 5.970 9.045 -1.814 738 HE21 GLN 54 HE21 GLN 54 5.532 8.447 0.308 739 HE22 GLN 54 HE22 GLN 54 5.903 9.379 1.677 740 H LYS 55 HN LYS 55 9.836 8.960 -3.876 741 HA LYS 55 HA LYS 55 11.597 11.126 -4.239 742 HB2 LYS 55 HB2 LYS 55 11.862 8.189 -4.897 743 HB3 LYS 55 HB1 LYS 55 13.175 9.349 -5.104 744 HG2 LYS 55 HG2 LYS 55 13.142 9.910 -2.751 745 HG3 LYS 55 HG1 LYS 55 11.685 8.954 -2.495 746 HD2 LYS 55 HD2 LYS 55 13.518 7.622 -1.708 747 HD3 LYS 55 HD1 LYS 55 13.018 6.924 -3.246 748 HE2 LYS 55 HE2 LYS 55 14.858 7.982 -4.403 749 HE3 LYS 55 HE1 LYS 55 15.282 8.921 -2.973 750 HZ1 LYS 55 HZ1 LYS 55 15.632 6.735 -1.835 751 HZ2 LYS 55 HZ2 LYS 55 16.749 7.094 -3.065 752 HZ3 LYS 55 HZ3 LYS 55 15.489 5.990 -3.352 753 H LYS 56 HN LYS 56 9.898 9.072 -6.580 754 HA LYS 56 HA LYS 56 11.204 9.940 -8.903 755 HB2 LYS 56 HB2 LYS 56 8.602 8.685 -8.255 756 HB3 LYS 56 HB1 LYS 56 8.660 9.553 -9.786 757 HG2 LYS 56 HG2 LYS 56 9.289 7.234 -10.170 758 HG3 LYS 56 HG1 LYS 56 10.710 8.249 -10.398 759 HD2 LYS 56 HD2 LYS 56 11.319 7.749 -7.978 760 HD3 LYS 56 HD1 LYS 56 10.028 6.547 -7.988 761 HE2 LYS 56 HE2 LYS 56 12.111 5.425 -8.519 762 HE3 LYS 56 HE1 LYS 56 11.126 5.481 -9.981 763 HZ1 LYS 56 HZ1 LYS 56 13.306 6.139 -10.571 764 HZ2 LYS 56 HZ2 LYS 56 13.412 7.232 -9.274 765 HZ3 LYS 56 HZ3 LYS 56 12.362 7.548 -10.571 766 H LYS 57 HN LYS 57 8.237 11.206 -7.369 767 HA LYS 57 HA LYS 57 7.921 13.375 -9.166 768 HB2 LYS 57 HB2 LYS 57 6.923 12.917 -6.347 769 HB3 LYS 57 HB1 LYS 57 6.469 14.318 -7.316 770 HG2 LYS 57 HG2 LYS 57 6.151 11.574 -8.490 771 HG3 LYS 57 HG1 LYS 57 4.956 12.152 -7.330 772 HD2 LYS 57 HD2 LYS 57 4.605 14.178 -8.725 773 HD3 LYS 57 HD1 LYS 57 5.753 13.549 -9.906 774 HE2 LYS 57 HE2 LYS 57 3.472 13.019 -10.611 775 HE3 LYS 57 HE1 LYS 57 4.327 11.536 -10.190 776 HZ1 LYS 57 HZ1 LYS 57 2.828 12.911 -8.085 777 HZ2 LYS 57 HZ2 LYS 57 3.110 11.250 -8.308 778 HZ3 LYS 57 HZ3 LYS 57 1.948 12.051 -9.253 779 H ALA 58 HN ALA 58 9.553 13.024 -6.055 780 HA ALA 58 HA ALA 58 10.842 14.510 -4.837 781 HB1 ALA 58 HB1 ALA 58 11.880 14.681 -7.661 782 HB2 ALA 58 HB2 ALA 58 12.530 13.756 -6.307 783 HB3 ALA 58 HB3 ALA 58 12.672 15.515 -6.324 784 H GLY 59 HN GLY 59 8.420 15.686 -5.205 785 HA2 GLY 59 HA2 GLY 59 7.519 17.798 -4.866 786 HA3 GLY 59 HA1 GLY 59 9.111 18.489 -5.161 787 H SER 60 HN SER 60 8.043 16.282 -7.533 788 HA SER 60 HA SER 60 7.085 16.535 -9.628 789 HB2 SER 60 HB2 SER 60 6.729 19.476 -9.336 790 HB3 SER 60 HB1 SER 60 5.666 18.280 -10.072 791 HG SER 60 HG SER 60 4.986 17.661 -8.071 792 H GLN 61 HN GLN 61 7.394 18.735 -11.383 793 HA GLN 61 HA GLN 61 10.062 18.337 -12.244 794 HB2 GLN 61 HB2 GLN 61 9.562 20.046 -13.930 795 HB3 GLN 61 HB1 GLN 61 8.225 18.906 -13.785 796 HG2 GLN 61 HG2 GLN 61 7.077 20.503 -12.249 797 HG3 GLN 61 HG1 GLN 61 8.380 21.659 -12.523 798 HE21 GLN 61 HE21 GLN 61 6.426 22.982 -13.391 799 HE22 GLN 61 HE22 GLN 61 6.027 22.768 -15.026 800 H SER 62 HN SER 62 11.815 19.785 -12.316 801 HA SER 62 HA SER 62 13.300 21.252 -11.350 802 HB2 SER 62 HB2 SER 62 10.792 22.932 -11.142 803 HB3 SER 62 HB1 SER 62 12.438 23.534 -10.966 804 HG SER 62 HG SER 62 12.475 22.195 -13.174 Start of MODEL 4 1 H1 MET 76 HT1 MET 76 4.326 -13.433 -20.850 2 H2 MET 76 HT2 MET 76 4.497 -14.558 -19.590 3 H3 MET 76 HT3 MET 76 4.059 -15.081 -21.145 4 HA MET 76 HA MET 76 6.241 -15.589 -21.267 5 HB2 MET 76 HB2 MET 76 6.505 -12.611 -21.723 6 HB3 MET 76 HB1 MET 76 7.385 -13.914 -22.521 7 HG2 MET 76 HG2 MET 76 4.409 -13.384 -22.776 8 HG3 MET 76 HG1 MET 76 5.627 -13.016 -23.997 9 HE1 MET 76 HE1 MET 76 3.957 -15.697 -25.821 10 HE2 MET 76 HE2 MET 76 3.773 -14.062 -25.190 11 HE3 MET 76 HE3 MET 76 2.919 -15.396 -24.421 12 H LYS 77 HN LYS 77 8.394 -15.428 -20.430 13 HA LYS 77 HA LYS 77 9.891 -15.261 -18.693 14 HB2 LYS 77 HB2 LYS 77 8.633 -12.510 -18.536 15 HB3 LYS 77 HB1 LYS 77 10.119 -12.982 -17.714 16 HG2 LYS 77 HG2 LYS 77 11.150 -13.538 -19.884 17 HG3 LYS 77 HG1 LYS 77 9.669 -13.050 -20.709 18 HD2 LYS 77 HD2 LYS 77 9.910 -10.768 -19.819 19 HD3 LYS 77 HD1 LYS 77 11.377 -11.248 -18.967 20 HE2 LYS 77 HE2 LYS 77 11.966 -10.138 -21.070 21 HE3 LYS 77 HE1 LYS 77 12.421 -11.841 -21.143 22 HZ1 LYS 77 HZ1 LYS 77 11.285 -11.121 -23.158 23 HZ2 LYS 77 HZ2 LYS 77 9.921 -10.679 -22.247 24 HZ3 LYS 77 HZ3 LYS 77 10.390 -12.310 -22.343 25 H ASP 78 HN ASP 78 9.613 -13.786 -16.246 26 HA ASP 78 HA ASP 78 7.809 -15.614 -14.848 27 HB2 ASP 78 HB2 ASP 78 10.176 -15.174 -14.074 28 HB3 ASP 78 HB1 ASP 78 9.652 -13.548 -13.638 29 H THR 79 HN THR 79 6.190 -14.089 -16.223 30 HA THR 79 HA THR 79 4.544 -12.470 -16.173 31 HB THR 79 HB THR 79 3.207 -12.512 -14.225 32 HG1 THR 79 HG1 THR 79 4.290 -12.039 -12.491 33 HG21 THR 79 HG21 THR 79 4.612 -15.098 -13.745 34 HG22 THR 79 HG22 THR 79 3.977 -14.806 -15.365 35 HG23 THR 79 HG23 THR 79 2.892 -14.778 -13.974 36 H ASP 80 HN ASP 80 3.931 -10.702 -13.975 37 HA ASP 80 HA ASP 80 6.219 -8.838 -14.193 38 HB2 ASP 80 HB2 ASP 80 3.988 -8.242 -15.316 39 HB3 ASP 80 HB1 ASP 80 3.359 -8.036 -13.683 40 H SER 81 HN SER 81 6.343 -7.251 -12.375 41 HA SER 81 HA SER 81 6.292 -8.677 -9.858 42 HB2 SER 81 HB2 SER 81 7.126 -5.845 -10.528 43 HB3 SER 81 HB1 SER 81 7.315 -6.606 -8.949 44 HG SER 81 HG SER 81 9.044 -6.682 -10.809 45 H GLU 82 HN GLU 82 4.050 -6.920 -11.570 46 HA GLU 82 HA GLU 82 2.806 -5.321 -9.644 47 HB2 GLU 82 HB2 GLU 82 2.194 -5.306 -12.041 48 HB3 GLU 82 HB1 GLU 82 1.503 -6.918 -11.862 49 HG2 GLU 82 HG2 GLU 82 -0.126 -6.075 -10.245 50 HG3 GLU 82 HG1 GLU 82 0.596 -4.471 -10.321 51 H GLU 83 HN GLU 83 2.553 -8.736 -10.355 52 HA GLU 83 HA GLU 83 0.436 -9.385 -8.605 53 HB2 GLU 83 HB2 GLU 83 1.193 -11.671 -8.829 54 HB3 GLU 83 HB1 GLU 83 1.372 -10.873 -10.391 55 HG2 GLU 83 HG2 GLU 83 3.456 -11.887 -10.195 56 HG3 GLU 83 HG1 GLU 83 3.791 -10.303 -9.497 57 H GLU 84 HN GLU 84 3.911 -9.018 -8.111 58 HA GLU 84 HA GLU 84 4.059 -10.165 -5.532 59 HB2 GLU 84 HB2 GLU 84 6.043 -9.698 -6.942 60 HB3 GLU 84 HB1 GLU 84 5.781 -7.970 -6.716 61 HG2 GLU 84 HG2 GLU 84 6.067 -8.212 -4.293 62 HG3 GLU 84 HG1 GLU 84 6.265 -9.954 -4.477 63 H ILE 85 HN ILE 85 3.491 -6.840 -6.624 64 HA ILE 85 HA ILE 85 3.417 -5.669 -4.045 65 HB ILE 85 HB ILE 85 2.139 -4.791 -6.648 66 HG12 ILE 85 HG12 ILE 85 4.749 -4.994 -6.285 67 HG13 ILE 85 HG11 ILE 85 4.077 -3.558 -7.053 68 HG21 ILE 85 HG21 ILE 85 0.955 -3.623 -4.973 69 HG22 ILE 85 HG22 ILE 85 2.256 -2.512 -5.399 70 HG23 ILE 85 HG23 ILE 85 2.375 -3.489 -3.933 71 HD11 ILE 85 HD11 ILE 85 5.793 -3.229 -5.132 72 HD12 ILE 85 HD12 ILE 85 4.460 -3.654 -4.062 73 HD13 ILE 85 HD13 ILE 85 4.327 -2.252 -5.116 74 H ARG 86 HN ARG 86 0.945 -7.046 -6.151 75 HA ARG 86 HA ARG 86 -1.324 -6.353 -4.648 76 HB2 ARG 86 HB2 ARG 86 -0.779 -8.663 -6.515 77 HB3 ARG 86 HB1 ARG 86 -2.362 -8.355 -5.801 78 HG2 ARG 86 HG2 ARG 86 -2.407 -6.118 -6.806 79 HG3 ARG 86 HG1 ARG 86 -0.798 -6.372 -7.480 80 HD2 ARG 86 HD2 ARG 86 -1.640 -8.264 -8.808 81 HD3 ARG 86 HD1 ARG 86 -3.245 -8.041 -8.121 82 HE ARG 86 HE ARG 86 -2.439 -5.608 -9.285 83 HH11 ARG 86 HH21 ARG 86 -3.235 -8.865 -10.142 84 HH12 ARG 86 HH22 ARG 86 -3.846 -8.449 -11.709 85 HH21 ARG 86 HH11 ARG 86 -3.239 -5.055 -11.338 86 HH22 ARG 86 HH12 ARG 86 -3.848 -6.294 -12.385 87 H GLU 87 HN GLU 87 0.927 -9.060 -4.369 88 HA GLU 87 HA GLU 87 -0.520 -10.696 -2.634 89 HB2 GLU 87 HB2 GLU 87 1.643 -11.321 -3.682 90 HB3 GLU 87 HB1 GLU 87 2.465 -10.188 -2.609 91 HG2 GLU 87 HG2 GLU 87 2.614 -12.432 -1.668 92 HG3 GLU 87 HG1 GLU 87 1.565 -11.451 -0.651 93 H ALA 88 HN ALA 88 1.482 -7.862 -2.011 94 HA ALA 88 HA ALA 88 1.467 -7.943 0.803 95 HB1 ALA 88 HB1 ALA 88 2.796 -6.428 -0.872 96 HB2 ALA 88 HB2 ALA 88 2.368 -5.803 0.720 97 HB3 ALA 88 HB3 ALA 88 1.416 -5.344 -0.692 98 H PHE 89 HN PHE 89 -0.895 -6.664 -1.513 99 HA PHE 89 HA PHE 89 -2.499 -5.426 0.559 100 HB2 PHE 89 HB2 PHE 89 -2.922 -5.899 -2.393 101 HB3 PHE 89 HB1 PHE 89 -4.165 -5.197 -1.354 102 HD1 PHE 89 HD2 PHE 89 -3.795 -3.032 -0.227 103 HD2 PHE 89 HD1 PHE 89 -0.911 -4.664 -2.955 104 HE1 PHE 89 HE2 PHE 89 -2.677 -0.824 -0.365 105 HE2 PHE 89 HE1 PHE 89 0.221 -2.458 -3.088 106 HZ PHE 89 HZ PHE 89 -0.671 -0.538 -1.792 107 H ARG 90 HN ARG 90 -2.633 -8.371 -1.412 108 HA ARG 90 HA ARG 90 -5.085 -9.387 -0.770 109 HB2 ARG 90 HB2 ARG 90 -2.483 -10.582 -1.430 110 HB3 ARG 90 HB1 ARG 90 -3.561 -11.653 -0.544 111 HG2 ARG 90 HG2 ARG 90 -3.975 -11.967 -2.906 112 HG3 ARG 90 HG1 ARG 90 -5.363 -11.118 -2.232 113 HD2 ARG 90 HD2 ARG 90 -4.393 -8.967 -3.003 114 HD3 ARG 90 HD1 ARG 90 -3.037 -9.846 -3.701 115 HE ARG 90 HE ARG 90 -5.739 -9.702 -4.765 116 HH11 ARG 90 HH21 ARG 90 -2.678 -11.316 -4.707 117 HH12 ARG 90 HH22 ARG 90 -2.875 -12.038 -6.270 118 HH21 ARG 90 HH11 ARG 90 -6.003 -10.643 -6.813 119 HH22 ARG 90 HH12 ARG 90 -4.757 -11.657 -7.463 120 H VAL 91 HN VAL 91 -2.298 -9.111 1.323 121 HA VAL 91 HA VAL 91 -3.121 -10.825 3.399 122 HB VAL 91 HB VAL 91 -1.391 -8.345 3.396 123 HG11 VAL 91 HG11 VAL 91 -1.847 -8.376 5.646 124 HG12 VAL 91 HG12 VAL 91 -0.672 -9.690 5.638 125 HG13 VAL 91 HG13 VAL 91 -2.397 -10.051 5.615 126 HG21 VAL 91 HG21 VAL 91 0.383 -9.788 3.101 127 HG22 VAL 91 HG22 VAL 91 -0.864 -10.732 2.285 128 HG23 VAL 91 HG23 VAL 91 -0.416 -11.112 3.949 129 H PHE 92 HN PHE 92 -3.835 -7.433 2.709 130 HA PHE 92 HA PHE 92 -5.399 -7.162 5.148 131 HB2 PHE 92 HB2 PHE 92 -5.285 -5.191 2.875 132 HB3 PHE 92 HB1 PHE 92 -5.611 -4.879 4.577 133 HD1 PHE 92 HD2 PHE 92 -3.424 -6.449 5.897 134 HD2 PHE 92 HD1 PHE 92 -3.350 -3.948 2.405 135 HE1 PHE 92 HE2 PHE 92 -1.032 -6.008 6.275 136 HE2 PHE 92 HE1 PHE 92 -0.940 -3.521 2.782 137 HZ PHE 92 HZ PHE 92 0.222 -4.550 4.710 138 H ASP 93 HN ASP 93 -5.911 -7.931 1.800 139 HA ASP 93 HA ASP 93 -8.807 -7.513 2.027 140 HB2 ASP 93 HB2 ASP 93 -7.659 -6.920 -0.099 141 HB3 ASP 93 HB1 ASP 93 -7.207 -8.611 -0.292 142 H LYS 94 HN LYS 94 -9.191 -9.081 3.684 143 HA LYS 94 HA LYS 94 -8.575 -11.854 3.121 144 HB2 LYS 94 HB2 LYS 94 -8.312 -11.500 5.371 145 HB3 LYS 94 HB1 LYS 94 -9.572 -10.270 5.436 146 HG2 LYS 94 HG2 LYS 94 -11.302 -11.899 5.393 147 HG3 LYS 94 HG1 LYS 94 -10.178 -13.189 4.958 148 HD2 LYS 94 HD2 LYS 94 -9.150 -13.134 7.122 149 HD3 LYS 94 HD1 LYS 94 -9.965 -11.626 7.541 150 HE2 LYS 94 HE2 LYS 94 -11.077 -13.531 8.630 151 HE3 LYS 94 HE1 LYS 94 -12.149 -12.788 7.442 152 HZ1 LYS 94 HZ1 LYS 94 -10.403 -14.982 6.583 153 HZ2 LYS 94 HZ2 LYS 94 -11.940 -14.536 6.014 154 HZ3 LYS 94 HZ3 LYS 94 -11.784 -15.360 7.491 155 H ASP 95 HN ASP 95 -11.206 -9.642 2.731 156 HA ASP 95 HA ASP 95 -13.286 -11.630 2.642 157 HB2 ASP 95 HB2 ASP 95 -13.144 -8.750 1.736 158 HB3 ASP 95 HB1 ASP 95 -14.587 -9.745 1.557 159 H GLY 96 HN GLY 96 -10.962 -10.282 0.444 160 HA2 GLY 96 HA2 GLY 96 -10.342 -10.930 -1.675 161 HA3 GLY 96 HA1 GLY 96 -11.451 -12.290 -1.527 162 H ASN 97 HN ASN 97 -12.566 -9.021 -1.039 163 HA ASN 97 HA ASN 97 -14.315 -9.305 -3.373 164 HB2 ASN 97 HB2 ASN 97 -14.300 -7.392 -1.037 165 HB3 ASN 97 HB1 ASN 97 -15.408 -7.244 -2.400 166 HD21 ASN 97 HD21 ASN 97 -16.306 -7.782 0.300 167 HD22 ASN 97 HD22 ASN 97 -16.992 -9.334 0.313 168 H GLY 98 HN GLY 98 -11.313 -8.035 -2.769 169 HA2 GLY 98 HA2 GLY 98 -10.025 -6.889 -4.400 170 HA3 GLY 98 HA1 GLY 98 -11.515 -6.278 -5.111 171 H TYR 99 HN TYR 99 -11.579 -6.022 -1.777 172 HA TYR 99 HA TYR 99 -10.459 -3.288 -1.792 173 HB2 TYR 99 HB2 TYR 99 -13.158 -3.968 -0.626 174 HB3 TYR 99 HB1 TYR 99 -12.363 -2.391 -0.619 175 HD1 TYR 99 HD1 TYR 99 -13.496 -5.061 -2.957 176 HD2 TYR 99 HD2 TYR 99 -12.750 -0.881 -2.357 177 HE1 TYR 99 HE1 TYR 99 -14.460 -4.579 -5.190 178 HE2 TYR 99 HE2 TYR 99 -13.710 -0.390 -4.598 179 HH TYR 99 HH TYR 99 -14.006 -1.745 -6.808 180 H ILE 100 HN ILE 100 -10.046 -2.364 0.289 181 HA ILE 100 HA ILE 100 -9.793 -4.317 2.492 182 HB ILE 100 HB ILE 100 -7.572 -3.707 2.948 183 HG12 ILE 100 HG12 ILE 100 -8.153 -1.221 1.311 184 HG13 ILE 100 HG11 ILE 100 -7.757 -1.311 3.029 185 HG21 ILE 100 HG21 ILE 100 -8.055 -4.690 0.491 186 HG22 ILE 100 HG22 ILE 100 -6.425 -4.302 1.042 187 HG23 ILE 100 HG23 ILE 100 -7.313 -3.155 0.040 188 HD11 ILE 100 HD11 ILE 100 -5.531 -2.360 2.294 189 HD12 ILE 100 HD12 ILE 100 -5.745 -0.632 2.007 190 HD13 ILE 100 HD13 ILE 100 -5.927 -1.772 0.677 191 H SER 101 HN SER 101 -10.217 -3.390 4.567 192 HA SER 101 HA SER 101 -11.755 -0.976 4.540 193 HB2 SER 101 HB2 SER 101 -10.597 -2.582 6.840 194 HB3 SER 101 HB1 SER 101 -11.724 -1.241 7.025 195 HG SER 101 HG SER 101 -12.422 -3.654 6.752 196 H ALA 102 HN ALA 102 -10.650 0.870 4.006 197 HA ALA 102 HA ALA 102 -8.005 1.434 4.297 198 HB1 ALA 102 HB1 ALA 102 -9.847 2.786 3.164 199 HB2 ALA 102 HB2 ALA 102 -8.528 3.686 3.898 200 HB3 ALA 102 HB3 ALA 102 -10.082 3.563 4.723 201 H ALA 103 HN ALA 103 -10.316 1.309 6.910 202 HA ALA 103 HA ALA 103 -8.994 3.046 8.708 203 HB1 ALA 103 HB1 ALA 103 -10.349 0.515 9.603 204 HB2 ALA 103 HB2 ALA 103 -11.301 1.829 8.912 205 HB3 ALA 103 HB3 ALA 103 -10.348 2.104 10.369 206 H GLU 104 HN GLU 104 -8.613 -0.365 7.908 207 HA GLU 104 HA GLU 104 -6.559 -0.868 9.844 208 HB2 GLU 104 HB2 GLU 104 -6.609 -3.033 9.086 209 HB3 GLU 104 HB1 GLU 104 -8.174 -2.497 8.481 210 HG2 GLU 104 HG2 GLU 104 -6.928 -1.846 6.325 211 HG3 GLU 104 HG1 GLU 104 -5.590 -2.805 6.949 212 H LEU 105 HN LEU 105 -6.656 0.282 6.545 213 HA LEU 105 HA LEU 105 -3.972 -0.202 5.818 214 HB2 LEU 105 HB2 LEU 105 -5.752 0.544 4.217 215 HB3 LEU 105 HB1 LEU 105 -5.710 2.136 4.970 216 HG LEU 105 HG LEU 105 -3.268 2.297 4.411 217 HD11 LEU 105 HD11 LEU 105 -2.406 0.175 4.137 218 HD12 LEU 105 HD12 LEU 105 -2.718 0.575 2.453 219 HD13 LEU 105 HD13 LEU 105 -3.851 -0.436 3.344 220 HD21 LEU 105 HD21 LEU 105 -4.453 3.455 2.811 221 HD22 LEU 105 HD22 LEU 105 -5.458 2.066 2.399 222 HD23 LEU 105 HD23 LEU 105 -3.810 2.177 1.779 223 H ARG 106 HN ARG 106 -5.518 2.653 7.274 224 HA ARG 106 HA ARG 106 -3.245 4.252 7.522 225 HB2 ARG 106 HB2 ARG 106 -5.462 5.150 7.921 226 HB3 ARG 106 HB1 ARG 106 -5.686 4.086 9.309 227 HG2 ARG 106 HG2 ARG 106 -3.230 5.698 9.452 228 HG3 ARG 106 HG1 ARG 106 -4.707 6.660 9.441 229 HD2 ARG 106 HD2 ARG 106 -4.249 4.300 11.283 230 HD3 ARG 106 HD1 ARG 106 -3.952 5.974 11.741 231 HE ARG 106 HE ARG 106 -6.553 5.901 10.781 232 HH11 ARG 106 HH21 ARG 106 -4.682 4.398 13.274 233 HH12 ARG 106 HH22 ARG 106 -6.023 4.200 14.352 234 HH21 ARG 106 HH11 ARG 106 -8.316 5.645 12.187 235 HH22 ARG 106 HH12 ARG 106 -8.082 4.906 13.736 236 H HIS 107 HN HIS 107 -4.632 1.961 9.922 237 HA HIS 107 HA HIS 107 -2.666 2.342 11.895 238 HB2 HIS 107 HB2 HIS 107 -4.784 1.198 12.343 239 HB3 HIS 107 HB1 HIS 107 -4.329 -0.108 11.250 240 HD1 HIS 107 HD1 HIS 107 -2.959 1.574 14.394 241 HD2 HIS 107 HD2 HIS 107 -3.001 -2.159 12.532 242 HE1 HIS 107 HE1 HIS 107 -1.811 -0.031 15.981 243 HE2 HIS 107 HE2 HIS 107 -1.829 -2.309 14.863 244 H VAL 108 HN VAL 108 -2.908 0.071 9.218 245 HA VAL 108 HA VAL 108 -0.582 -1.434 9.712 246 HB VAL 108 HB VAL 108 -2.111 -0.816 7.180 247 HG11 VAL 108 HG11 VAL 108 -0.901 -2.872 6.317 248 HG12 VAL 108 HG12 VAL 108 0.208 -2.693 7.669 249 HG13 VAL 108 HG13 VAL 108 0.090 -1.424 6.449 250 HG21 VAL 108 HG21 VAL 108 -1.994 -3.507 8.428 251 HG22 VAL 108 HG22 VAL 108 -3.353 -2.679 7.670 252 HG23 VAL 108 HG23 VAL 108 -2.883 -2.275 9.321 253 H MET 109 HN MET 109 -1.127 1.539 7.908 254 HA MET 109 HA MET 109 1.576 1.691 6.881 255 HB2 MET 109 HB2 MET 109 -0.887 3.351 6.745 256 HB3 MET 109 HB1 MET 109 0.649 4.196 6.549 257 HG2 MET 109 HG2 MET 109 -0.526 3.228 4.431 258 HG3 MET 109 HG1 MET 109 1.217 2.991 4.620 259 HE1 MET 109 HE1 MET 109 0.726 1.643 2.783 260 HE2 MET 109 HE2 MET 109 -0.270 0.193 2.700 261 HE3 MET 109 HE3 MET 109 1.403 0.072 3.236 262 H THR 110 HN THR 110 -0.025 2.666 9.787 263 HA THR 110 HA THR 110 2.235 4.433 10.472 264 HB THR 110 HB THR 110 0.778 5.347 12.199 265 HG1 THR 110 HG1 THR 110 -0.639 3.962 12.898 266 HG21 THR 110 HG21 THR 110 -0.301 5.113 9.408 267 HG22 THR 110 HG22 THR 110 0.497 6.484 10.171 268 HG23 THR 110 HG23 THR 110 -1.153 6.060 10.623 269 H ASN 111 HN ASN 111 0.870 1.345 11.197 270 HA ASN 111 HA ASN 111 2.435 1.186 13.696 271 HB2 ASN 111 HB2 ASN 111 -0.092 0.708 13.637 272 HB3 ASN 111 HB1 ASN 111 0.350 -0.799 12.836 273 HD21 ASN 111 HD21 ASN 111 -0.136 -2.217 14.606 274 HD22 ASN 111 HD22 ASN 111 0.715 -2.173 16.074 275 H LEU 112 HN LEU 112 1.927 -0.436 10.579 276 HA LEU 112 HA LEU 112 4.084 -2.339 11.274 277 HB2 LEU 112 HB2 LEU 112 2.056 -2.475 9.041 278 HB3 LEU 112 HB1 LEU 112 3.254 -3.706 9.421 279 HG LEU 112 HG LEU 112 1.056 -2.769 11.292 280 HD11 LEU 112 HD11 LEU 112 -0.195 -4.133 9.967 281 HD12 LEU 112 HD12 LEU 112 0.651 -5.439 10.798 282 HD13 LEU 112 HD13 LEU 112 1.225 -4.874 9.229 283 HD21 LEU 112 HD21 LEU 112 2.700 -3.536 12.744 284 HD22 LEU 112 HD22 LEU 112 3.382 -4.643 11.554 285 HD23 LEU 112 HD23 LEU 112 1.878 -5.053 12.378 286 H GLY 113 HN GLY 113 5.902 -2.512 10.096 287 HA2 GLY 113 HA2 GLY 113 7.633 -1.883 8.726 288 HA3 GLY 113 HA1 GLY 113 6.391 -1.639 7.503 289 H GLU 114 HN GLU 114 8.891 -0.131 8.921 290 HA GLU 114 HA GLU 114 9.170 2.115 9.757 291 HB2 GLU 114 HB2 GLU 114 8.809 2.049 6.758 292 HB3 GLU 114 HB1 GLU 114 9.451 3.446 7.624 293 HG2 GLU 114 HG2 GLU 114 11.288 2.127 8.505 294 HG3 GLU 114 HG1 GLU 114 10.608 0.653 7.819 295 H LYS 115 HN LYS 115 7.344 2.655 11.004 296 HA LYS 115 HA LYS 115 4.802 3.226 10.214 297 HB2 LYS 115 HB2 LYS 115 6.426 4.736 12.273 298 HB3 LYS 115 HB1 LYS 115 4.665 4.707 12.173 299 HG2 LYS 115 HG2 LYS 115 4.716 2.232 12.458 300 HG3 LYS 115 HG1 LYS 115 6.466 2.312 12.633 301 HD2 LYS 115 HD2 LYS 115 6.225 3.769 14.600 302 HD3 LYS 115 HD1 LYS 115 4.469 3.714 14.433 303 HE2 LYS 115 HE2 LYS 115 5.180 2.093 16.122 304 HE3 LYS 115 HE1 LYS 115 4.550 1.240 14.713 305 HZ1 LYS 115 HZ1 LYS 115 6.626 0.275 15.489 306 HZ2 LYS 115 HZ2 LYS 115 7.420 1.761 15.273 307 HZ3 LYS 115 HZ3 LYS 115 6.806 0.920 13.931 308 H LEU 116 HN LEU 116 3.742 4.784 9.149 309 HA LEU 116 HA LEU 116 5.294 6.922 7.882 310 HB2 LEU 116 HB2 LEU 116 2.610 5.671 7.421 311 HB3 LEU 116 HB1 LEU 116 2.830 7.341 6.921 312 HG LEU 116 HG LEU 116 3.301 5.726 5.081 313 HD11 LEU 116 HD11 LEU 116 6.015 6.704 5.477 314 HD12 LEU 116 HD12 LEU 116 4.813 7.931 5.862 315 HD13 LEU 116 HD13 LEU 116 4.817 7.175 4.273 316 HD21 LEU 116 HD21 LEU 116 5.175 4.224 5.208 317 HD22 LEU 116 HD22 LEU 116 4.216 3.959 6.665 318 HD23 LEU 116 HD23 LEU 116 5.698 4.913 6.743 319 H THR 117 HN THR 117 4.477 9.191 7.975 320 HA THR 117 HA THR 117 3.481 9.795 10.654 321 HB THR 117 HB THR 117 4.113 12.098 10.132 322 HG1 THR 117 HG1 THR 117 4.247 11.002 7.575 323 HG21 THR 117 HG21 THR 117 6.235 10.142 9.210 324 HG22 THR 117 HG22 THR 117 5.855 10.495 10.895 325 HG23 THR 117 HG23 THR 117 6.516 11.758 9.857 326 H ASP 118 HN ASP 118 1.850 11.650 10.789 327 HA ASP 118 HA ASP 118 -0.552 10.882 9.574 328 HB2 ASP 118 HB2 ASP 118 0.290 13.458 10.903 329 HB3 ASP 118 HB1 ASP 118 -1.357 13.160 10.350 330 H GLU 119 HN GLU 119 1.769 13.410 8.714 331 HA GLU 119 HA GLU 119 0.268 14.604 6.637 332 HB2 GLU 119 HB2 GLU 119 2.275 15.642 7.645 333 HB3 GLU 119 HB1 GLU 119 3.278 14.391 6.915 334 HG2 GLU 119 HG2 GLU 119 3.331 16.399 5.525 335 HG3 GLU 119 HG1 GLU 119 2.494 15.115 4.663 336 H GLU 120 HN GLU 120 2.576 11.924 6.653 337 HA GLU 120 HA GLU 120 2.513 11.505 3.825 338 HB2 GLU 120 HB2 GLU 120 3.411 9.779 6.136 339 HB3 GLU 120 HB1 GLU 120 3.547 9.277 4.447 340 HG2 GLU 120 HG2 GLU 120 4.884 11.282 3.943 341 HG3 GLU 120 HG1 GLU 120 4.721 11.828 5.608 342 H VAL 121 HN VAL 121 0.774 10.168 6.592 343 HA VAL 121 HA VAL 121 -0.652 8.144 5.199 344 HB VAL 121 HB VAL 121 -1.266 9.674 7.739 345 HG11 VAL 121 HG11 VAL 121 -3.372 8.901 7.306 346 HG12 VAL 121 HG12 VAL 121 -2.698 7.415 7.971 347 HG13 VAL 121 HG13 VAL 121 -2.796 7.632 6.224 348 HG21 VAL 121 HG21 VAL 121 0.534 7.553 7.098 349 HG22 VAL 121 HG22 VAL 121 -0.761 6.890 8.085 350 HG23 VAL 121 HG23 VAL 121 0.192 8.244 8.682 351 H ASP 122 HN ASP 122 -1.461 11.544 5.982 352 HA ASP 122 HA ASP 122 -4.095 11.493 5.006 353 HB2 ASP 122 HB2 ASP 122 -2.056 13.723 5.200 354 HB3 ASP 122 HB1 ASP 122 -3.720 13.992 4.675 355 H GLU 123 HN GLU 123 -1.010 12.105 3.373 356 HA GLU 123 HA GLU 123 -2.097 12.765 0.837 357 HB2 GLU 123 HB2 GLU 123 0.253 13.226 1.450 358 HB3 GLU 123 HB1 GLU 123 0.574 11.492 1.504 359 HG2 GLU 123 HG2 GLU 123 0.022 11.282 -0.868 360 HG3 GLU 123 HG1 GLU 123 -0.414 12.988 -0.943 361 H MET 124 HN MET 124 -1.151 9.748 2.382 362 HA MET 124 HA MET 124 -1.478 8.011 0.171 363 HB2 MET 124 HB2 MET 124 -1.671 7.578 3.161 364 HB3 MET 124 HB1 MET 124 -1.738 6.275 1.983 365 HG2 MET 124 HG2 MET 124 0.501 8.240 1.801 366 HG3 MET 124 HG1 MET 124 0.578 7.012 3.059 367 HE1 MET 124 HE1 MET 124 1.455 4.216 2.201 368 HE2 MET 124 HE2 MET 124 -0.035 3.819 1.351 369 HE3 MET 124 HE3 MET 124 -0.095 4.842 2.786 370 H ILE 125 HN ILE 125 -3.690 9.128 2.708 371 HA ILE 125 HA ILE 125 -5.883 7.503 1.960 372 HB ILE 125 HB ILE 125 -5.352 9.683 3.820 373 HG12 ILE 125 HG12 ILE 125 -7.180 8.327 5.100 374 HG13 ILE 125 HG11 ILE 125 -6.941 7.129 3.836 375 HG21 ILE 125 HG21 ILE 125 -7.788 10.222 4.147 376 HG22 ILE 125 HG22 ILE 125 -8.101 9.472 2.586 377 HG23 ILE 125 HG23 ILE 125 -7.069 10.902 2.691 378 HD11 ILE 125 HD11 ILE 125 -4.368 7.610 4.412 379 HD12 ILE 125 HD12 ILE 125 -5.313 6.425 5.316 380 HD13 ILE 125 HD13 ILE 125 -5.074 8.046 5.967 381 H ARG 126 HN ARG 126 -4.783 10.664 0.938 382 HA ARG 126 HA ARG 126 -7.114 11.490 -0.426 383 HB2 ARG 126 HB2 ARG 126 -4.197 12.170 -0.849 384 HB3 ARG 126 HB1 ARG 126 -5.519 12.966 -1.702 385 HG2 ARG 126 HG2 ARG 126 -6.083 12.883 1.134 386 HG3 ARG 126 HG1 ARG 126 -4.504 13.613 0.854 387 HD2 ARG 126 HD2 ARG 126 -6.197 15.355 0.786 388 HD3 ARG 126 HD1 ARG 126 -5.548 15.129 -0.835 389 HE ARG 126 HE ARG 126 -7.762 13.469 -0.672 390 HH11 ARG 126 HH21 ARG 126 -7.043 16.834 -0.302 391 HH12 ARG 126 HH22 ARG 126 -8.595 17.368 -0.859 392 HH21 ARG 126 HH11 ARG 126 -9.799 14.162 -1.402 393 HH22 ARG 126 HH12 ARG 126 -10.155 15.856 -1.481 394 H GLU 127 HN GLU 127 -4.482 9.372 -1.309 395 HA GLU 127 HA GLU 127 -5.476 9.158 -4.067 396 HB2 GLU 127 HB2 GLU 127 -2.982 8.123 -2.710 397 HB3 GLU 127 HB1 GLU 127 -3.430 7.702 -4.364 398 HG2 GLU 127 HG2 GLU 127 -3.365 10.017 -5.048 399 HG3 GLU 127 HG1 GLU 127 -3.154 10.553 -3.382 400 H ALA 128 HN ALA 128 -5.882 7.692 -1.076 401 HA ALA 128 HA ALA 128 -6.210 4.968 -1.980 402 HB1 ALA 128 HB1 ALA 128 -5.600 5.822 0.388 403 HB2 ALA 128 HB2 ALA 128 -6.682 4.452 0.249 404 HB3 ALA 128 HB3 ALA 128 -7.332 6.052 0.592 405 H ASP 129 HN ASP 129 -8.612 6.987 -0.311 406 HA ASP 129 HA ASP 129 -10.595 7.259 -2.200 407 HB2 ASP 129 HB2 ASP 129 -10.703 4.839 -2.517 408 HB3 ASP 129 HB1 ASP 129 -10.901 4.593 -0.787 409 H ILE 130 HN ILE 130 -11.989 5.500 0.299 410 HA ILE 130 HA ILE 130 -13.219 5.998 2.114 411 HB ILE 130 HB ILE 130 -11.240 8.253 2.457 412 HG12 ILE 130 HG12 ILE 130 -11.289 5.503 3.734 413 HG13 ILE 130 HG11 ILE 130 -10.312 5.891 2.317 414 HG21 ILE 130 HG21 ILE 130 -12.154 7.345 4.931 415 HG22 ILE 130 HG22 ILE 130 -13.608 7.376 3.934 416 HG23 ILE 130 HG23 ILE 130 -12.643 8.840 4.134 417 HD11 ILE 130 HD11 ILE 130 -9.187 7.686 3.589 418 HD12 ILE 130 HD12 ILE 130 -8.981 6.122 4.375 419 HD13 ILE 130 HD13 ILE 130 -10.150 7.280 5.007 420 H ASP 131 HN ASP 131 -14.436 6.828 -0.130 421 HA ASP 131 HA ASP 131 -15.117 9.577 -0.224 422 HB2 ASP 131 HB2 ASP 131 -16.581 7.096 -1.145 423 HB3 ASP 131 HB1 ASP 131 -17.185 8.728 -1.430 424 H GLY 132 HN GLY 132 -16.530 6.798 1.428 425 HA2 GLY 132 HA2 GLY 132 -17.642 8.485 3.500 426 HA3 GLY 132 HA1 GLY 132 -18.862 7.745 2.469 427 H ASP 133 HN ASP 133 -18.048 5.250 2.028 428 HA ASP 133 HA ASP 133 -18.616 3.893 4.418 429 HB2 ASP 133 HB2 ASP 133 -17.441 2.954 1.804 430 HB3 ASP 133 HB1 ASP 133 -17.829 1.852 3.123 431 H GLY 134 HN GLY 134 -15.572 4.637 2.840 432 HA2 GLY 134 HA2 GLY 134 -13.598 5.044 4.164 433 HA3 GLY 134 HA1 GLY 134 -14.166 3.834 5.301 434 H GLN 135 HN GLN 135 -14.927 2.039 2.960 435 HA GLN 135 HA GLN 135 -12.610 0.473 2.935 436 HB2 GLN 135 HB2 GLN 135 -13.638 -0.722 0.997 437 HB3 GLN 135 HB1 GLN 135 -14.721 -0.534 2.381 438 HG2 GLN 135 HG2 GLN 135 -15.696 1.487 1.286 439 HG3 GLN 135 HG1 GLN 135 -14.674 1.186 -0.118 440 HE21 GLN 135 HE21 GLN 135 -15.671 -0.028 -1.728 441 HE22 GLN 135 HE22 GLN 135 -16.949 -1.115 -1.477 442 H VAL 136 HN VAL 136 -11.014 0.075 1.419 443 HA VAL 136 HA VAL 136 -10.658 2.136 -0.666 444 HB VAL 136 HB VAL 136 -8.878 1.352 1.572 445 HG11 VAL 136 HG11 VAL 136 -6.879 2.087 0.168 446 HG12 VAL 136 HG12 VAL 136 -7.880 1.806 -1.256 447 HG13 VAL 136 HG13 VAL 136 -7.485 0.466 -0.173 448 HG21 VAL 136 HG21 VAL 136 -8.392 3.655 1.563 449 HG22 VAL 136 HG22 VAL 136 -10.083 3.591 1.073 450 HG23 VAL 136 HG23 VAL 136 -8.827 3.827 -0.139 451 H ASN 137 HN ASN 137 -10.076 1.428 -2.619 452 HA ASN 137 HA ASN 137 -9.793 -1.460 -2.978 453 HB2 ASN 137 HB2 ASN 137 -10.170 -1.020 -5.337 454 HB3 ASN 137 HB1 ASN 137 -11.389 -0.172 -4.392 455 HD21 ASN 137 HD21 ASN 137 -10.534 0.605 -7.084 456 HD22 ASN 137 HD22 ASN 137 -9.845 2.150 -6.951 457 H TYR 138 HN TYR 138 -7.761 -2.259 -2.926 458 HA TYR 138 HA TYR 138 -5.435 -0.669 -3.100 459 HB2 TYR 138 HB2 TYR 138 -4.209 -2.814 -3.165 460 HB3 TYR 138 HB1 TYR 138 -5.424 -2.769 -1.890 461 HD1 TYR 138 HD1 TYR 138 -4.625 -4.113 -5.254 462 HD2 TYR 138 HD2 TYR 138 -7.354 -4.204 -1.947 463 HE1 TYR 138 HE1 TYR 138 -5.693 -6.151 -6.183 464 HE2 TYR 138 HE2 TYR 138 -8.411 -6.233 -2.854 465 HH TYR 138 HH TYR 138 -7.538 -7.489 -6.039 466 H GLU 139 HN GLU 139 -7.444 -1.720 -5.602 467 HA GLU 139 HA GLU 139 -5.595 -2.387 -7.611 468 HB2 GLU 139 HB2 GLU 139 -8.025 -2.713 -7.847 469 HB3 GLU 139 HB1 GLU 139 -8.255 -0.967 -7.898 470 HG2 GLU 139 HG2 GLU 139 -8.251 -1.876 -10.170 471 HG3 GLU 139 HG1 GLU 139 -6.836 -0.860 -9.935 472 H GLU 140 HN GLU 140 -7.011 0.820 -6.829 473 HA GLU 140 HA GLU 140 -5.618 2.274 -8.768 474 HB2 GLU 140 HB2 GLU 140 -6.666 3.100 -6.055 475 HB3 GLU 140 HB1 GLU 140 -6.032 4.236 -7.245 476 HG2 GLU 140 HG2 GLU 140 -8.273 2.288 -7.833 477 HG3 GLU 140 HG1 GLU 140 -8.544 3.948 -7.304 478 H PHE 141 HN PHE 141 -4.687 1.349 -5.511 479 HA PHE 141 HA PHE 141 -2.317 2.923 -5.337 480 HB2 PHE 141 HB2 PHE 141 -3.455 0.638 -3.863 481 HB3 PHE 141 HB1 PHE 141 -1.692 0.720 -3.852 482 HD1 PHE 141 HD2 PHE 141 -0.684 3.122 -3.443 483 HD2 PHE 141 HD1 PHE 141 -4.644 1.926 -2.291 484 HE1 PHE 141 HE2 PHE 141 -0.745 4.948 -1.774 485 HE2 PHE 141 HE1 PHE 141 -4.697 3.750 -0.621 486 HZ PHE 141 HZ PHE 141 -2.755 5.265 -0.360 487 H VAL 142 HN VAL 142 -2.922 -0.361 -6.528 488 HA VAL 142 HA VAL 142 -0.218 -0.930 -7.159 489 HB VAL 142 HB VAL 142 -2.829 -2.071 -8.161 490 HG11 VAL 142 HG11 VAL 142 -1.205 -3.962 -8.915 491 HG12 VAL 142 HG12 VAL 142 0.032 -2.705 -8.880 492 HG13 VAL 142 HG13 VAL 142 -1.360 -2.542 -9.950 493 HG21 VAL 142 HG21 VAL 142 -0.921 -3.737 -6.692 494 HG22 VAL 142 HG22 VAL 142 -2.634 -3.460 -6.376 495 HG23 VAL 142 HG23 VAL 142 -1.427 -2.323 -5.768 496 H GLN 143 HN GLN 143 -2.901 0.403 -9.137 497 HA GLN 143 HA GLN 143 -1.399 0.578 -11.533 498 HB2 GLN 143 HB2 GLN 143 -3.759 2.187 -10.532 499 HB3 GLN 143 HB1 GLN 143 -3.084 2.348 -12.153 500 HG2 GLN 143 HG2 GLN 143 -3.501 -0.051 -12.564 501 HG3 GLN 143 HG1 GLN 143 -4.190 -0.205 -10.948 502 HE21 GLN 143 HE21 GLN 143 -6.316 0.713 -10.568 503 HE22 GLN 143 HE22 GLN 143 -7.292 1.260 -11.843 504 H MET 144 HN MET 144 -1.923 2.766 -8.827 505 HA MET 144 HA MET 144 -0.502 5.002 -9.810 506 HB2 MET 144 HB2 MET 144 -1.798 5.512 -7.961 507 HB3 MET 144 HB1 MET 144 -1.415 4.005 -7.147 508 HG2 MET 144 HG2 MET 144 0.545 4.809 -6.258 509 HG3 MET 144 HG1 MET 144 0.790 5.979 -7.556 510 HE1 MET 144 HE1 MET 144 -1.430 6.454 -3.626 511 HE2 MET 144 HE2 MET 144 -0.180 5.307 -4.099 512 HE3 MET 144 HE3 MET 144 -1.830 5.087 -4.671 513 H MET 145 HN MET 145 0.511 2.224 -7.820 514 HA MET 145 HA MET 145 3.238 3.077 -7.731 515 HB2 MET 145 HB2 MET 145 1.654 0.775 -6.753 516 HB3 MET 145 HB1 MET 145 3.352 0.433 -7.103 517 HG2 MET 145 HG2 MET 145 4.055 2.301 -5.684 518 HG3 MET 145 HG1 MET 145 2.372 2.724 -5.377 519 HE1 MET 145 HE1 MET 145 1.108 0.612 -2.763 520 HE2 MET 145 HE2 MET 145 0.735 1.470 -4.253 521 HE3 MET 145 HE3 MET 145 1.656 2.280 -2.986 522 H THR 146 HN THR 146 1.359 1.391 -10.066 523 HA THR 146 HA THR 146 3.825 0.486 -11.433 524 HB THR 146 HB THR 146 2.388 -1.138 -12.613 525 HG1 THR 146 HG1 THR 146 0.476 0.313 -12.098 526 HG21 THR 146 HG21 THR 146 3.442 -2.070 -10.734 527 HG22 THR 146 HG22 THR 146 1.741 -2.449 -10.464 528 HG23 THR 146 HG23 THR 146 2.490 -1.103 -9.606 529 H ALA 147 HN ALA 147 2.181 3.093 -11.393 530 HA ALA 147 HA ALA 147 2.453 3.618 -14.226 531 HB1 ALA 147 HB1 ALA 147 0.246 4.085 -14.755 532 HB2 ALA 147 HB2 ALA 147 -0.218 4.330 -13.072 533 HB3 ALA 147 HB3 ALA 147 0.040 2.696 -13.689 534 H LYS 148 HN LYS 148 1.314 6.052 -14.428 535 HA LYS 148 HA LYS 148 1.462 8.264 -13.811 536 HB2 LYS 148 HB2 LYS 148 1.071 6.952 -11.345 537 HB3 LYS 148 HB1 LYS 148 2.454 8.013 -11.101 538 HG2 LYS 148 HG2 LYS 148 -0.194 8.884 -12.303 539 HG3 LYS 148 HG1 LYS 148 0.270 9.131 -10.623 540 HD2 LYS 148 HD2 LYS 148 2.425 10.234 -11.750 541 HD3 LYS 148 HD1 LYS 148 1.302 10.473 -13.088 542 HE2 LYS 148 HE2 LYS 148 0.831 11.360 -10.225 543 HE3 LYS 148 HE1 LYS 148 1.296 12.414 -11.561 544 HZ1 LYS 148 HZ1 LYS 148 -0.785 12.488 -12.285 545 HZ2 LYS 148 HZ2 LYS 148 -1.254 11.743 -10.833 546 HZ3 LYS 148 HZ3 LYS 148 -0.961 10.803 -12.217 547 H PHE 30 HT1 PHE 30 -10.177 -4.869 12.251 548 HA PHE 30 HA PHE 30 -8.261 -4.598 10.646 549 HB2 PHE 30 HB2 PHE 30 -6.507 -5.411 12.918 550 HB3 PHE 30 HB1 PHE 30 -6.104 -4.520 11.450 551 HD1 PHE 30 HD2 PHE 30 -7.755 -2.246 11.321 552 HD2 PHE 30 HD1 PHE 30 -6.160 -4.128 14.839 553 HE1 PHE 30 HE2 PHE 30 -7.950 -0.105 12.555 554 HE2 PHE 30 HE1 PHE 30 -6.356 -1.987 16.072 555 HZ PHE 30 HZ PHE 30 -7.251 0.024 14.932 556 H ASP 31 HN ASP 31 -9.015 -6.423 9.722 557 HA ASP 31 HA ASP 31 -9.171 -8.905 11.266 558 HB2 ASP 31 HB2 ASP 31 -10.383 -9.790 9.350 559 HB3 ASP 31 HB1 ASP 31 -11.069 -8.235 9.819 560 H ILE 32 HN ILE 32 -6.706 -7.417 9.944 561 HA ILE 32 HA ILE 32 -5.666 -9.482 8.197 562 HB ILE 32 HB ILE 32 -3.944 -7.991 7.716 563 HG12 ILE 32 HG12 ILE 32 -4.383 -6.802 10.484 564 HG13 ILE 32 HG11 ILE 32 -2.991 -7.752 9.964 565 HG21 ILE 32 HG21 ILE 32 -6.065 -6.134 8.814 566 HG22 ILE 32 HG22 ILE 32 -6.260 -7.050 7.320 567 HG23 ILE 32 HG23 ILE 32 -4.989 -5.836 7.452 568 HD11 ILE 32 HD11 ILE 32 -2.004 -5.803 9.433 569 HD12 ILE 32 HD12 ILE 32 -3.513 -4.910 9.597 570 HD13 ILE 32 HD13 ILE 32 -3.123 -5.713 8.079 571 H ASP 33 HN ASP 33 -3.699 -10.646 8.608 572 HA ASP 33 HA ASP 33 -3.530 -11.545 11.372 573 HB2 ASP 33 HB2 ASP 33 -2.020 -12.478 8.916 574 HB3 ASP 33 HB1 ASP 33 -2.038 -13.277 10.486 575 H MET 34 HN MET 34 -2.701 -9.531 12.203 576 HA MET 34 HA MET 34 -0.302 -8.339 11.337 577 HB2 MET 34 HB2 MET 34 -1.651 -8.293 14.043 578 HB3 MET 34 HB1 MET 34 -0.300 -7.257 13.583 579 HG2 MET 34 HG2 MET 34 -1.685 -6.473 11.624 580 HG3 MET 34 HG1 MET 34 -3.043 -7.357 12.309 581 HE1 MET 34 HE1 MET 34 -0.135 -4.953 13.673 582 HE2 MET 34 HE2 MET 34 -1.099 -3.484 13.703 583 HE3 MET 34 HE3 MET 34 -0.897 -4.361 12.191 584 H ASP 35 HN ASP 35 -0.953 -10.916 13.649 585 HA ASP 35 HA ASP 35 1.564 -11.037 14.884 586 HB2 ASP 35 HB2 ASP 35 -0.533 -13.148 14.379 587 HB3 ASP 35 HB1 ASP 35 0.926 -13.456 15.318 588 H ALA 36 HN ALA 36 0.390 -12.504 11.877 589 HA ALA 36 HA ALA 36 2.533 -14.238 11.404 590 HB1 ALA 36 HB1 ALA 36 1.643 -13.118 8.934 591 HB2 ALA 36 HB2 ALA 36 0.254 -13.322 10.002 592 HB3 ALA 36 HB3 ALA 36 1.280 -14.703 9.619 593 HA PRO 37 HA PRO 37 5.841 -11.114 10.906 594 HB2 PRO 37 HB2 PRO 37 7.068 -13.403 9.410 595 HB3 PRO 37 HB1 PRO 37 7.790 -12.344 10.640 596 HG2 PRO 37 HG2 PRO 37 7.061 -14.791 11.267 597 HG3 PRO 37 HG1 PRO 37 6.756 -13.449 12.385 598 HD2 PRO 37 HD2 PRO 37 4.818 -14.905 10.622 599 HD3 PRO 37 HD1 PRO 37 4.593 -14.218 12.249 600 H GLU 38 HN GLU 38 4.620 -13.161 8.295 601 HA GLU 38 HA GLU 38 5.715 -11.780 6.109 602 HB2 GLU 38 HB2 GLU 38 3.168 -13.390 6.364 603 HB3 GLU 38 HB1 GLU 38 3.799 -12.794 4.829 604 HG2 GLU 38 HG2 GLU 38 5.402 -14.516 6.737 605 HG3 GLU 38 HG1 GLU 38 4.476 -15.165 5.385 606 H THR 39 HN THR 39 2.738 -11.238 7.946 607 HA THR 39 HA THR 39 1.567 -9.331 6.244 608 HB THR 39 HB THR 39 1.396 -9.560 9.258 609 HG1 THR 39 HG1 THR 39 -0.764 -10.414 8.186 610 HG21 THR 39 HG21 THR 39 0.078 -7.819 7.244 611 HG22 THR 39 HG22 THR 39 0.415 -7.513 8.948 612 HG23 THR 39 HG23 THR 39 -0.961 -8.515 8.486 613 H GLU 40 HN GLU 40 3.799 -8.922 8.989 614 HA GLU 40 HA GLU 40 3.887 -6.101 8.917 615 HB2 GLU 40 HB2 GLU 40 4.718 -7.498 10.803 616 HB3 GLU 40 HB1 GLU 40 6.074 -8.003 9.798 617 HG2 GLU 40 HG2 GLU 40 5.489 -5.077 10.253 618 HG3 GLU 40 HG1 GLU 40 6.428 -6.002 11.420 619 H ARG 41 HN ARG 41 5.851 -8.577 7.312 620 HA ARG 41 HA ARG 41 7.723 -6.832 6.124 621 HB2 ARG 41 HB2 ARG 41 6.742 -9.578 5.316 622 HB3 ARG 41 HB1 ARG 41 8.067 -8.745 4.505 623 HG2 ARG 41 HG2 ARG 41 8.139 -9.048 7.494 624 HG3 ARG 41 HG1 ARG 41 8.585 -10.417 6.478 625 HD2 ARG 41 HD2 ARG 41 10.260 -9.004 5.325 626 HD3 ARG 41 HD1 ARG 41 9.834 -7.652 6.366 627 HE ARG 41 HE ARG 41 10.513 -9.841 7.997 628 HH11 ARG 41 HH21 ARG 41 11.905 -7.640 5.718 629 HH12 ARG 41 HH22 ARG 41 13.485 -7.688 6.428 630 HH21 ARG 41 HH11 ARG 41 12.582 -9.907 8.934 631 HH22 ARG 41 HH12 ARG 41 13.868 -8.970 8.248 632 H ALA 42 HN ALA 42 4.565 -8.000 5.067 633 HA ALA 42 HA ALA 42 4.638 -7.047 2.422 634 HB1 ALA 42 HB1 ALA 42 2.032 -6.853 2.924 635 HB2 ALA 42 HB2 ALA 42 2.489 -7.768 4.361 636 HB3 ALA 42 HB3 ALA 42 2.823 -8.421 2.757 637 H ALA 43 HN ALA 43 3.745 -5.475 5.459 638 HA ALA 43 HA ALA 43 2.703 -3.087 4.397 639 HB1 ALA 43 HB1 ALA 43 4.292 -3.077 6.947 640 HB2 ALA 43 HB2 ALA 43 2.795 -4.009 6.866 641 HB3 ALA 43 HB3 ALA 43 2.766 -2.272 6.572 642 H VAL 44 HN VAL 44 6.002 -4.070 5.202 643 HA VAL 44 HA VAL 44 7.261 -1.583 4.827 644 HB VAL 44 HB VAL 44 8.284 -4.410 4.543 645 HG11 VAL 44 HG11 VAL 44 9.802 -3.150 3.242 646 HG12 VAL 44 HG12 VAL 44 10.543 -3.179 4.843 647 HG13 VAL 44 HG13 VAL 44 9.674 -1.743 4.298 648 HG21 VAL 44 HG21 VAL 44 9.219 -4.007 6.743 649 HG22 VAL 44 HG22 VAL 44 7.508 -3.582 6.796 650 HG23 VAL 44 HG23 VAL 44 8.730 -2.314 6.690 651 H ALA 45 HN ALA 45 6.652 -4.241 2.528 652 HA ALA 45 HA ALA 45 8.055 -3.155 0.348 653 HB1 ALA 45 HB1 ALA 45 7.300 -4.977 -0.736 654 HB2 ALA 45 HB2 ALA 45 5.615 -4.587 -0.388 655 HB3 ALA 45 HB3 ALA 45 6.588 -5.442 0.809 656 H ILE 46 HN ILE 46 4.634 -2.792 1.272 657 HA ILE 46 HA ILE 46 3.928 -1.175 -0.946 658 HB ILE 46 HB ILE 46 2.700 -1.485 1.794 659 HG12 ILE 46 HG12 ILE 46 1.755 -2.432 -0.924 660 HG13 ILE 46 HG11 ILE 46 2.758 -3.421 0.138 661 HG21 ILE 46 HG21 ILE 46 1.979 0.662 1.052 662 HG22 ILE 46 HG22 ILE 46 0.683 -0.441 0.587 663 HG23 ILE 46 HG23 ILE 46 1.841 0.119 -0.617 664 HD11 ILE 46 HD11 ILE 46 0.359 -2.185 1.375 665 HD12 ILE 46 HD12 ILE 46 1.063 -3.784 1.628 666 HD13 ILE 46 HD13 ILE 46 0.060 -3.476 0.210 667 H GLN 47 HN GLN 47 4.938 -0.376 2.357 668 HA GLN 47 HA GLN 47 4.675 2.424 2.160 669 HB2 GLN 47 HB2 GLN 47 6.408 0.656 3.883 670 HB3 GLN 47 HB1 GLN 47 6.326 2.408 4.075 671 HG2 GLN 47 HG2 GLN 47 3.975 2.329 4.562 672 HG3 GLN 47 HG1 GLN 47 3.879 0.628 4.106 673 HE21 GLN 47 HE21 GLN 47 3.350 2.002 6.789 674 HE22 GLN 47 HE22 GLN 47 4.333 1.163 7.887 675 H SER 48 HN SER 48 7.414 0.265 1.479 676 HA SER 48 HA SER 48 9.337 2.275 1.022 677 HB2 SER 48 HB2 SER 48 9.098 -0.519 -0.116 678 HB3 SER 48 HB1 SER 48 10.515 0.510 -0.309 679 HG SER 48 HG SER 48 10.127 -1.087 1.634 680 H GLN 49 HN GLN 49 7.031 0.666 -1.121 681 HA GLN 49 HA GLN 49 7.891 1.908 -3.518 682 HB2 GLN 49 HB2 GLN 49 5.255 0.665 -2.732 683 HB3 GLN 49 HB1 GLN 49 5.635 1.226 -4.360 684 HG2 GLN 49 HG2 GLN 49 7.352 -0.756 -2.857 685 HG3 GLN 49 HG1 GLN 49 6.072 -1.236 -3.963 686 HE21 GLN 49 HE21 GLN 49 8.908 -1.804 -4.388 687 HE22 GLN 49 HE22 GLN 49 9.376 -0.978 -5.795 688 H PHE 50 HN PHE 50 5.480 2.789 -1.075 689 HA PHE 50 HA PHE 50 4.330 4.940 -2.463 690 HB2 PHE 50 HB2 PHE 50 3.250 4.098 -0.474 691 HB3 PHE 50 HB1 PHE 50 4.656 4.495 0.512 692 HD1 PHE 50 HD1 PHE 50 2.512 6.266 -2.031 693 HD2 PHE 50 HD2 PHE 50 4.400 6.407 1.839 694 HE1 PHE 50 HE1 PHE 50 1.633 8.554 -1.683 695 HE2 PHE 50 HE2 PHE 50 3.516 8.704 2.175 696 HZ PHE 50 HZ PHE 50 2.136 9.773 0.415 697 H ARG 51 HN ARG 51 7.056 4.883 -0.172 698 HA ARG 51 HA ARG 51 7.617 7.646 -0.273 699 HB2 ARG 51 HB2 ARG 51 8.564 6.127 1.432 700 HB3 ARG 51 HB1 ARG 51 9.534 5.345 0.183 701 HG2 ARG 51 HG2 ARG 51 10.721 7.412 -0.268 702 HG3 ARG 51 HG1 ARG 51 9.674 8.300 0.839 703 HD2 ARG 51 HD2 ARG 51 11.447 5.989 1.667 704 HD3 ARG 51 HD1 ARG 51 11.894 7.684 1.835 705 HE ARG 51 HE ARG 51 9.403 7.350 3.069 706 HH11 ARG 51 HH21 ARG 51 12.676 6.270 3.372 707 HH12 ARG 51 HH22 ARG 51 12.594 6.062 5.089 708 HH21 ARG 51 HH11 ARG 51 9.287 7.080 5.321 709 HH22 ARG 51 HH12 ARG 51 10.675 6.520 6.193 710 H LYS 52 HN LYS 52 8.725 4.916 -2.213 711 HA LYS 52 HA LYS 52 10.633 6.252 -3.785 712 HB2 LYS 52 HB2 LYS 52 10.404 3.788 -3.670 713 HB3 LYS 52 HB1 LYS 52 8.874 3.901 -4.533 714 HG2 LYS 52 HG2 LYS 52 10.634 3.321 -6.114 715 HG3 LYS 52 HG1 LYS 52 10.082 4.958 -6.458 716 HD2 LYS 52 HD2 LYS 52 12.024 5.936 -5.575 717 HD3 LYS 52 HD1 LYS 52 12.419 4.514 -4.608 718 HE2 LYS 52 HE2 LYS 52 13.929 4.680 -6.536 719 HE3 LYS 52 HE1 LYS 52 12.898 3.258 -6.696 720 HZ1 LYS 52 HZ1 LYS 52 13.189 4.889 -8.677 721 HZ2 LYS 52 HZ2 LYS 52 12.021 5.811 -7.857 722 HZ3 LYS 52 HZ3 LYS 52 11.664 4.224 -8.348 723 H PHE 53 HN PHE 53 7.147 5.862 -4.134 724 HA PHE 53 HA PHE 53 6.789 6.808 -6.734 725 HB2 PHE 53 HB2 PHE 53 5.006 5.791 -5.336 726 HB3 PHE 53 HB1 PHE 53 4.976 7.249 -4.349 727 HD1 PHE 53 HD2 PHE 53 4.226 9.411 -5.311 728 HD2 PHE 53 HD1 PHE 53 4.017 5.741 -7.533 729 HE1 PHE 53 HE2 PHE 53 2.646 10.466 -6.905 730 HE2 PHE 53 HE1 PHE 53 2.430 6.791 -9.125 731 HZ PHE 53 HZ PHE 53 1.754 9.160 -8.814 732 H GLN 54 HN GLN 54 6.896 8.618 -3.665 733 HA GLN 54 HA GLN 54 6.383 11.165 -4.753 734 HB2 GLN 54 HB2 GLN 54 7.924 10.326 -2.285 735 HB3 GLN 54 HB1 GLN 54 7.523 11.999 -2.662 736 HG2 GLN 54 HG2 GLN 54 5.500 9.763 -2.342 737 HG3 GLN 54 HG1 GLN 54 5.879 10.960 -1.107 738 HE21 GLN 54 HE21 GLN 54 3.496 10.326 -3.209 739 HE22 GLN 54 HE22 GLN 54 3.047 11.897 -3.668 740 H LYS 55 HN LYS 55 9.413 9.387 -4.270 741 HA LYS 55 HA LYS 55 11.169 11.479 -4.978 742 HB2 LYS 55 HB2 LYS 55 11.452 8.477 -5.150 743 HB3 LYS 55 HB1 LYS 55 12.765 9.593 -5.527 744 HG2 LYS 55 HG2 LYS 55 12.579 10.573 -3.266 745 HG3 LYS 55 HG1 LYS 55 11.277 9.443 -2.887 746 HD2 LYS 55 HD2 LYS 55 12.809 7.546 -3.266 747 HD3 LYS 55 HD1 LYS 55 14.114 8.674 -3.639 748 HE2 LYS 55 HE2 LYS 55 12.616 8.566 -1.004 749 HE3 LYS 55 HE1 LYS 55 14.214 7.877 -1.285 750 HZ1 LYS 55 HZ1 LYS 55 14.242 10.130 -0.288 751 HZ2 LYS 55 HZ2 LYS 55 13.541 10.735 -1.712 752 HZ3 LYS 55 HZ3 LYS 55 15.086 10.028 -1.756 753 H LYS 56 HN LYS 56 9.488 9.043 -6.911 754 HA LYS 56 HA LYS 56 10.765 9.529 -9.370 755 HB2 LYS 56 HB2 LYS 56 9.297 7.594 -8.937 756 HB3 LYS 56 HB1 LYS 56 7.902 8.666 -8.874 757 HG2 LYS 56 HG2 LYS 56 8.331 9.377 -11.204 758 HG3 LYS 56 HG1 LYS 56 9.729 8.308 -11.273 759 HD2 LYS 56 HD2 LYS 56 7.008 7.225 -10.566 760 HD3 LYS 56 HD1 LYS 56 7.464 7.467 -12.250 761 HE2 LYS 56 HE2 LYS 56 8.984 5.766 -10.243 762 HE3 LYS 56 HE1 LYS 56 7.957 5.164 -11.538 763 HZ1 LYS 56 HZ1 LYS 56 9.584 6.810 -12.873 764 HZ2 LYS 56 HZ2 LYS 56 9.853 5.142 -12.693 765 HZ3 LYS 56 HZ3 LYS 56 10.632 6.248 -11.663 766 H LYS 57 HN LYS 57 7.890 11.005 -7.898 767 HA LYS 57 HA LYS 57 7.172 12.652 -10.061 768 HB2 LYS 57 HB2 LYS 57 5.701 12.232 -8.128 769 HB3 LYS 57 HB1 LYS 57 6.794 13.158 -7.099 770 HG2 LYS 57 HG2 LYS 57 6.404 15.169 -8.456 771 HG3 LYS 57 HG1 LYS 57 5.355 14.251 -9.537 772 HD2 LYS 57 HD2 LYS 57 3.807 13.804 -7.687 773 HD3 LYS 57 HD1 LYS 57 4.870 14.663 -6.571 774 HE2 LYS 57 HE2 LYS 57 3.048 16.139 -7.295 775 HE3 LYS 57 HE1 LYS 57 4.588 16.728 -7.921 776 HZ1 LYS 57 HZ1 LYS 57 2.430 16.352 -9.431 777 HZ2 LYS 57 HZ2 LYS 57 3.180 14.838 -9.612 778 HZ3 LYS 57 HZ3 LYS 57 4.015 16.259 -10.027 779 H ALA 58 HN ALA 58 9.332 13.230 -7.300 780 HA ALA 58 HA ALA 58 9.906 15.932 -7.841 781 HB1 ALA 58 HB1 ALA 58 11.155 15.721 -5.990 782 HB2 ALA 58 HB2 ALA 58 12.198 14.528 -6.766 783 HB3 ALA 58 HB3 ALA 58 10.714 14.013 -5.962 784 H GLY 59 HN GLY 59 11.406 12.938 -8.990 785 HA2 GLY 59 HA2 GLY 59 12.575 12.581 -10.966 786 HA3 GLY 59 HA1 GLY 59 12.434 14.298 -11.326 787 H SER 60 HN SER 60 14.733 13.743 -12.020 788 HA SER 60 HA SER 60 16.614 13.872 -9.752 789 HB2 SER 60 HB2 SER 60 17.070 13.155 -12.655 790 HB3 SER 60 HB1 SER 60 18.331 13.237 -11.429 791 HG SER 60 HG SER 60 17.764 11.289 -10.920 792 H GLN 61 HN GLN 61 14.978 16.108 -10.994 793 HA GLN 61 HA GLN 61 17.252 17.935 -11.452 794 HB2 GLN 61 HB2 GLN 61 15.994 19.078 -13.212 795 HB3 GLN 61 HB1 GLN 61 16.223 17.381 -13.633 796 HG2 GLN 61 HG2 GLN 61 13.945 16.904 -12.684 797 HG3 GLN 61 HG1 GLN 61 13.721 18.639 -12.470 798 HE21 GLN 61 HE21 GLN 61 12.712 19.655 -14.200 799 HE22 GLN 61 HE22 GLN 61 12.714 19.085 -15.799 800 H SER 62 HN SER 62 16.811 20.155 -10.945 801 HA SER 62 HA SER 62 16.133 21.720 -9.391 802 HB2 SER 62 HB2 SER 62 13.696 22.195 -9.481 803 HB3 SER 62 HB1 SER 62 14.408 22.015 -11.082 804 HG SER 62 HG SER 62 12.785 20.651 -11.258 Start of MODEL 5 1 H1 MET 76 HT1 MET 76 12.655 -15.441 -17.840 2 H2 MET 76 HT2 MET 76 11.077 -15.479 -17.210 3 H3 MET 76 HT3 MET 76 12.261 -16.539 -16.609 4 HA MET 76 HA MET 76 11.972 -14.798 -15.025 5 HB2 MET 76 HB2 MET 76 14.281 -15.620 -15.475 6 HB3 MET 76 HB1 MET 76 14.485 -14.329 -16.658 7 HG2 MET 76 HG2 MET 76 14.089 -12.645 -14.902 8 HG3 MET 76 HG1 MET 76 13.873 -13.929 -13.713 9 HE1 MET 76 HE1 MET 76 15.395 -15.531 -13.013 10 HE2 MET 76 HE2 MET 76 17.152 -15.431 -13.021 11 HE3 MET 76 HE3 MET 76 16.310 -16.103 -14.414 12 H LYS 77 HN LYS 77 12.199 -13.765 -18.343 13 HA LYS 77 HA LYS 77 12.140 -10.948 -17.843 14 HB2 LYS 77 HB2 LYS 77 11.454 -12.581 -20.298 15 HB3 LYS 77 HB1 LYS 77 11.504 -10.817 -20.265 16 HG2 LYS 77 HG2 LYS 77 13.865 -10.895 -19.548 17 HG3 LYS 77 HG1 LYS 77 13.818 -12.658 -19.591 18 HD2 LYS 77 HD2 LYS 77 13.314 -12.606 -21.994 19 HD3 LYS 77 HD1 LYS 77 13.310 -10.841 -21.965 20 HE2 LYS 77 HE2 LYS 77 15.475 -11.657 -22.776 21 HE3 LYS 77 HE1 LYS 77 15.676 -10.869 -21.211 22 HZ1 LYS 77 HZ1 LYS 77 15.097 -13.502 -20.653 23 HZ2 LYS 77 HZ2 LYS 77 16.607 -12.736 -20.511 24 HZ3 LYS 77 HZ3 LYS 77 16.201 -13.561 -21.939 25 H ASP 78 HN ASP 78 10.391 -9.516 -18.063 26 HA ASP 78 HA ASP 78 8.247 -8.795 -17.678 27 HB2 ASP 78 HB2 ASP 78 7.531 -11.362 -19.118 28 HB3 ASP 78 HB1 ASP 78 6.442 -10.008 -18.825 29 H THR 79 HN THR 79 9.507 -10.139 -15.593 30 HA THR 79 HA THR 79 7.809 -12.122 -14.406 31 HB THR 79 HB THR 79 10.137 -12.044 -13.761 32 HG1 THR 79 HG1 THR 79 9.315 -12.681 -11.947 33 HG21 THR 79 HG21 THR 79 9.598 -9.199 -13.644 34 HG22 THR 79 HG22 THR 79 11.149 -10.036 -13.707 35 HG23 THR 79 HG23 THR 79 10.362 -9.754 -12.154 36 H ASP 80 HN ASP 80 6.009 -10.406 -15.102 37 HA ASP 80 HA ASP 80 5.111 -8.200 -14.086 38 HB2 ASP 80 HB2 ASP 80 3.625 -10.819 -13.943 39 HB3 ASP 80 HB1 ASP 80 2.860 -9.271 -13.590 40 H SER 81 HN SER 81 5.744 -7.252 -12.276 41 HA SER 81 HA SER 81 5.813 -8.645 -9.734 42 HB2 SER 81 HB2 SER 81 6.375 -5.757 -10.446 43 HB3 SER 81 HB1 SER 81 6.605 -6.465 -8.849 44 HG SER 81 HG SER 81 8.478 -7.055 -9.581 45 H GLU 82 HN GLU 82 3.394 -7.221 -11.509 46 HA GLU 82 HA GLU 82 2.001 -5.654 -9.659 47 HB2 GLU 82 HB2 GLU 82 1.014 -7.430 -11.895 48 HB3 GLU 82 HB1 GLU 82 -0.043 -6.368 -10.962 49 HG2 GLU 82 HG2 GLU 82 1.174 -4.443 -11.631 50 HG3 GLU 82 HG1 GLU 82 2.427 -5.407 -12.403 51 H GLU 83 HN GLU 83 2.071 -9.124 -10.178 52 HA GLU 83 HA GLU 83 0.026 -9.825 -8.349 53 HB2 GLU 83 HB2 GLU 83 1.440 -12.041 -8.323 54 HB3 GLU 83 HB1 GLU 83 0.591 -11.554 -9.793 55 HG2 GLU 83 HG2 GLU 83 2.552 -10.753 -10.809 56 HG3 GLU 83 HG1 GLU 83 3.434 -10.662 -9.282 57 H GLU 84 HN GLU 84 3.525 -9.380 -8.001 58 HA GLU 84 HA GLU 84 3.760 -10.350 -5.366 59 HB2 GLU 84 HB2 GLU 84 5.384 -8.342 -6.936 60 HB3 GLU 84 HB1 GLU 84 5.836 -8.897 -5.323 61 HG2 GLU 84 HG2 GLU 84 5.975 -11.191 -6.084 62 HG3 GLU 84 HG1 GLU 84 5.326 -10.751 -7.664 63 H ILE 85 HN ILE 85 3.190 -7.055 -6.597 64 HA ILE 85 HA ILE 85 3.160 -5.824 -4.042 65 HB ILE 85 HB ILE 85 1.929 -4.947 -6.667 66 HG12 ILE 85 HG12 ILE 85 4.530 -5.249 -6.288 67 HG13 ILE 85 HG11 ILE 85 3.918 -3.804 -7.088 68 HG21 ILE 85 HG21 ILE 85 2.214 -3.602 -3.979 69 HG22 ILE 85 HG22 ILE 85 0.788 -3.711 -5.010 70 HG23 ILE 85 HG23 ILE 85 2.125 -2.657 -5.467 71 HD11 ILE 85 HD11 ILE 85 4.207 -2.467 -5.172 72 HD12 ILE 85 HD12 ILE 85 5.639 -3.497 -5.168 73 HD13 ILE 85 HD13 ILE 85 4.291 -3.855 -4.093 74 H ARG 86 HN ARG 86 0.610 -7.088 -6.145 75 HA ARG 86 HA ARG 86 -1.601 -6.281 -4.611 76 HB2 ARG 86 HB2 ARG 86 -1.209 -8.576 -6.530 77 HB3 ARG 86 HB1 ARG 86 -2.761 -8.229 -5.764 78 HG2 ARG 86 HG2 ARG 86 -2.839 -6.030 -6.744 79 HG3 ARG 86 HG1 ARG 86 -1.187 -6.174 -7.337 80 HD2 ARG 86 HD2 ARG 86 -1.846 -7.978 -8.843 81 HD3 ARG 86 HD1 ARG 86 -3.482 -7.958 -8.193 82 HE ARG 86 HE ARG 86 -2.995 -5.382 -9.099 83 HH11 ARG 86 HH21 ARG 86 -3.027 -8.597 -10.380 84 HH12 ARG 86 HH22 ARG 86 -3.523 -8.108 -11.966 85 HH21 ARG 86 HH11 ARG 86 -3.646 -4.734 -11.176 86 HH22 ARG 86 HH12 ARG 86 -3.874 -5.921 -12.416 87 H GLU 87 HN GLU 87 0.488 -9.113 -4.364 88 HA GLU 87 HA GLU 87 -1.044 -10.661 -2.609 89 HB2 GLU 87 HB2 GLU 87 1.082 -11.427 -3.636 90 HB3 GLU 87 HB1 GLU 87 1.968 -10.316 -2.591 91 HG2 GLU 87 HG2 GLU 87 1.120 -11.473 -0.601 92 HG3 GLU 87 HG1 GLU 87 0.168 -12.554 -1.617 93 H ALA 88 HN ALA 88 1.158 -7.968 -1.991 94 HA ALA 88 HA ALA 88 1.101 -8.011 0.809 95 HB1 ALA 88 HB1 ALA 88 2.553 -6.594 -0.802 96 HB2 ALA 88 HB2 ALA 88 2.051 -5.867 0.725 97 HB3 ALA 88 HB3 ALA 88 1.210 -5.451 -0.768 98 H PHE 89 HN PHE 89 -1.182 -6.645 -1.528 99 HA PHE 89 HA PHE 89 -2.744 -5.342 0.545 100 HB2 PHE 89 HB2 PHE 89 -3.175 -5.745 -2.416 101 HB3 PHE 89 HB1 PHE 89 -4.367 -4.972 -1.369 102 HD1 PHE 89 HD2 PHE 89 -3.839 -2.853 -0.203 103 HD2 PHE 89 HD1 PHE 89 -1.103 -4.634 -2.989 104 HE1 PHE 89 HE2 PHE 89 -2.579 -0.722 -0.327 105 HE2 PHE 89 HE1 PHE 89 0.166 -2.504 -3.112 106 HZ PHE 89 HZ PHE 89 -0.579 -0.547 -1.779 107 H ARG 90 HN ARG 90 -2.977 -8.232 -1.487 108 HA ARG 90 HA ARG 90 -5.501 -9.104 -0.854 109 HB2 ARG 90 HB2 ARG 90 -2.990 -10.706 -1.303 110 HB3 ARG 90 HB1 ARG 90 -4.569 -11.463 -1.082 111 HG2 ARG 90 HG2 ARG 90 -5.464 -10.156 -2.976 112 HG3 ARG 90 HG1 ARG 90 -3.887 -9.408 -3.207 113 HD2 ARG 90 HD2 ARG 90 -2.895 -11.622 -3.646 114 HD3 ARG 90 HD1 ARG 90 -4.468 -12.375 -3.404 115 HE ARG 90 HE ARG 90 -4.724 -10.391 -5.390 116 HH11 ARG 90 HH21 ARG 90 -3.204 -13.446 -4.809 117 HH12 ARG 90 HH22 ARG 90 -3.231 -13.932 -6.471 118 HH21 ARG 90 HH11 ARG 90 -4.762 -11.021 -7.572 119 HH22 ARG 90 HH12 ARG 90 -4.114 -12.560 -8.036 120 H VAL 91 HN VAL 91 -2.706 -9.015 1.205 121 HA VAL 91 HA VAL 91 -3.551 -10.828 3.203 122 HB VAL 91 HB VAL 91 -1.789 -8.372 3.332 123 HG11 VAL 91 HG11 VAL 91 -2.779 -10.234 5.456 124 HG12 VAL 91 HG12 VAL 91 -2.367 -8.524 5.571 125 HG13 VAL 91 HG13 VAL 91 -1.090 -9.738 5.527 126 HG21 VAL 91 HG21 VAL 91 -1.212 -10.612 2.069 127 HG22 VAL 91 HG22 VAL 91 -0.944 -11.233 3.698 128 HG23 VAL 91 HG23 VAL 91 -0.003 -9.861 3.111 129 H PHE 92 HN PHE 92 -4.183 -7.389 2.669 130 HA PHE 92 HA PHE 92 -5.761 -7.169 5.099 131 HB2 PHE 92 HB2 PHE 92 -5.578 -5.151 2.866 132 HB3 PHE 92 HB1 PHE 92 -5.980 -4.861 4.555 133 HD1 PHE 92 HD2 PHE 92 -3.941 -6.267 6.070 134 HD2 PHE 92 HD1 PHE 92 -3.543 -4.118 2.378 135 HE1 PHE 92 HE2 PHE 92 -1.557 -5.895 6.558 136 HE2 PHE 92 HE1 PHE 92 -1.147 -3.745 2.873 137 HZ PHE 92 HZ PHE 92 -0.148 -4.631 4.956 138 H ASP 93 HN ASP 93 -6.285 -7.843 1.732 139 HA ASP 93 HA ASP 93 -9.177 -7.384 1.976 140 HB2 ASP 93 HB2 ASP 93 -8.005 -6.717 -0.126 141 HB3 ASP 93 HB1 ASP 93 -7.626 -8.413 -0.403 142 H LYS 94 HN LYS 94 -9.569 -9.000 3.559 143 HA LYS 94 HA LYS 94 -8.981 -11.763 2.921 144 HB2 LYS 94 HB2 LYS 94 -8.764 -11.556 5.175 145 HB3 LYS 94 HB1 LYS 94 -9.890 -10.207 5.267 146 HG2 LYS 94 HG2 LYS 94 -11.783 -11.666 5.171 147 HG3 LYS 94 HG1 LYS 94 -10.772 -13.056 4.773 148 HD2 LYS 94 HD2 LYS 94 -10.222 -11.551 7.304 149 HD3 LYS 94 HD1 LYS 94 -11.593 -12.657 7.261 150 HE2 LYS 94 HE2 LYS 94 -10.079 -14.474 6.489 151 HE3 LYS 94 HE1 LYS 94 -8.713 -13.367 6.615 152 HZ1 LYS 94 HZ1 LYS 94 -9.910 -14.890 8.638 153 HZ2 LYS 94 HZ2 LYS 94 -10.140 -13.247 9.008 154 HZ3 LYS 94 HZ3 LYS 94 -8.573 -13.853 8.751 155 H ASP 95 HN ASP 95 -11.528 -9.524 2.426 156 HA ASP 95 HA ASP 95 -13.625 -11.524 2.255 157 HB2 ASP 95 HB2 ASP 95 -13.584 -8.611 1.428 158 HB3 ASP 95 HB1 ASP 95 -15.012 -9.644 1.459 159 H GLY 96 HN GLY 96 -11.299 -9.994 0.178 160 HA2 GLY 96 HA2 GLY 96 -10.677 -10.479 -1.991 161 HA3 GLY 96 HA1 GLY 96 -11.790 -11.844 -1.948 162 H ASN 97 HN ASN 97 -12.802 -8.572 -1.240 163 HA ASN 97 HA ASN 97 -14.645 -8.677 -3.513 164 HB2 ASN 97 HB2 ASN 97 -15.206 -7.999 -1.040 165 HB3 ASN 97 HB1 ASN 97 -14.563 -6.433 -1.530 166 HD21 ASN 97 HD21 ASN 97 -17.252 -6.476 -0.902 167 HD22 ASN 97 HD22 ASN 97 -18.194 -6.380 -2.309 168 H GLY 98 HN GLY 98 -11.575 -7.520 -2.900 169 HA2 GLY 98 HA2 GLY 98 -10.263 -6.388 -4.521 170 HA3 GLY 98 HA1 GLY 98 -11.739 -5.717 -5.210 171 H TYR 99 HN TYR 99 -11.782 -5.518 -1.864 172 HA TYR 99 HA TYR 99 -10.552 -2.837 -1.839 173 HB2 TYR 99 HB2 TYR 99 -13.298 -3.424 -0.726 174 HB3 TYR 99 HB1 TYR 99 -12.444 -1.879 -0.673 175 HD1 TYR 99 HD1 TYR 99 -13.715 -4.447 -3.057 176 HD2 TYR 99 HD2 TYR 99 -12.649 -0.339 -2.429 177 HE1 TYR 99 HE1 TYR 99 -14.605 -3.882 -5.299 178 HE2 TYR 99 HE2 TYR 99 -13.537 0.233 -4.677 179 HH TYR 99 HH TYR 99 -15.461 -1.922 -6.495 180 H ILE 100 HN ILE 100 -10.102 -1.981 0.268 181 HA ILE 100 HA ILE 100 -9.985 -3.972 2.439 182 HB ILE 100 HB ILE 100 -7.726 -3.510 2.929 183 HG12 ILE 100 HG12 ILE 100 -7.976 -1.041 1.185 184 HG13 ILE 100 HG11 ILE 100 -7.844 -1.049 2.946 185 HG21 ILE 100 HG21 ILE 100 -8.254 -4.404 0.432 186 HG22 ILE 100 HG22 ILE 100 -6.614 -4.171 1.033 187 HG23 ILE 100 HG23 ILE 100 -7.375 -2.922 0.052 188 HD11 ILE 100 HD11 ILE 100 -5.647 -2.351 2.584 189 HD12 ILE 100 HD12 ILE 100 -5.647 -0.625 2.224 190 HD13 ILE 100 HD13 ILE 100 -5.752 -1.796 0.913 191 H SER 101 HN SER 101 -10.351 -3.017 4.537 192 HA SER 101 HA SER 101 -11.917 -0.665 4.515 193 HB2 SER 101 HB2 SER 101 -10.540 -2.072 6.817 194 HB3 SER 101 HB1 SER 101 -11.736 -0.793 6.997 195 HG SER 101 HG SER 101 -13.111 -2.378 6.877 196 H ALA 102 HN ALA 102 -11.433 1.446 4.859 197 HA ALA 102 HA ALA 102 -8.801 2.381 4.449 198 HB1 ALA 102 HB1 ALA 102 -10.719 4.209 5.763 199 HB2 ALA 102 HB2 ALA 102 -11.238 3.512 4.229 200 HB3 ALA 102 HB3 ALA 102 -9.738 4.438 4.315 201 H ALA 103 HN ALA 103 -10.720 1.985 7.379 202 HA ALA 103 HA ALA 103 -9.091 3.407 9.158 203 HB1 ALA 103 HB1 ALA 103 -11.266 2.719 9.870 204 HB2 ALA 103 HB2 ALA 103 -10.101 1.910 10.917 205 HB3 ALA 103 HB3 ALA 103 -10.879 1.018 9.610 206 H GLU 104 HN GLU 104 -8.874 0.012 8.145 207 HA GLU 104 HA GLU 104 -6.782 -0.644 9.976 208 HB2 GLU 104 HB2 GLU 104 -6.837 -2.747 9.063 209 HB3 GLU 104 HB1 GLU 104 -8.407 -2.167 8.514 210 HG2 GLU 104 HG2 GLU 104 -7.166 -1.353 6.409 211 HG3 GLU 104 HG1 GLU 104 -5.841 -2.379 6.946 212 H LEU 105 HN LEU 105 -6.875 0.796 6.808 213 HA LEU 105 HA LEU 105 -4.206 0.336 6.002 214 HB2 LEU 105 HB2 LEU 105 -6.028 1.270 4.540 215 HB3 LEU 105 HB1 LEU 105 -5.914 2.779 5.436 216 HG LEU 105 HG LEU 105 -3.441 2.830 4.797 217 HD11 LEU 105 HD11 LEU 105 -4.107 0.268 3.727 218 HD12 LEU 105 HD12 LEU 105 -2.563 1.105 3.654 219 HD13 LEU 105 HD13 LEU 105 -3.746 1.332 2.374 220 HD21 LEU 105 HD21 LEU 105 -3.957 3.653 2.492 221 HD22 LEU 105 HD22 LEU 105 -5.067 4.280 3.711 222 HD23 LEU 105 HD23 LEU 105 -5.575 2.967 2.648 223 H ARG 106 HN ARG 106 -5.667 3.099 7.714 224 HA ARG 106 HA ARG 106 -3.365 4.609 8.110 225 HB2 ARG 106 HB2 ARG 106 -5.313 5.728 8.676 226 HB3 ARG 106 HB1 ARG 106 -5.986 4.350 9.532 227 HG2 ARG 106 HG2 ARG 106 -5.415 6.144 11.091 228 HG3 ARG 106 HG1 ARG 106 -4.405 4.750 11.410 229 HD2 ARG 106 HD2 ARG 106 -2.927 6.573 11.494 230 HD3 ARG 106 HD1 ARG 106 -2.678 5.925 9.881 231 HE ARG 106 HE ARG 106 -4.645 7.804 9.540 232 HH11 ARG 106 HH21 ARG 106 -1.511 7.771 11.010 233 HH12 ARG 106 HH22 ARG 106 -1.163 9.424 10.631 234 HH21 ARG 106 HH11 ARG 106 -4.196 9.980 9.047 235 HH22 ARG 106 HH12 ARG 106 -2.681 10.673 9.520 236 H HIS 107 HN HIS 107 -4.785 2.150 10.314 237 HA HIS 107 HA HIS 107 -2.757 2.263 12.258 238 HB2 HIS 107 HB2 HIS 107 -4.876 1.220 12.736 239 HB3 HIS 107 HB1 HIS 107 -4.636 0.036 11.453 240 HD1 HIS 107 HD1 HIS 107 -2.950 1.122 14.700 241 HD2 HIS 107 HD2 HIS 107 -3.379 -2.261 12.304 242 HE1 HIS 107 HE1 HIS 107 -1.846 -0.784 15.952 243 HE2 HIS 107 HE2 HIS 107 -2.093 -2.855 14.502 244 H VAL 108 HN VAL 108 -3.173 0.112 9.479 245 HA VAL 108 HA VAL 108 -0.925 -1.518 9.896 246 HB VAL 108 HB VAL 108 -2.473 -0.789 7.411 247 HG11 VAL 108 HG11 VAL 108 -0.346 -1.485 6.586 248 HG12 VAL 108 HG12 VAL 108 -1.373 -2.913 6.513 249 HG13 VAL 108 HG13 VAL 108 -0.203 -2.742 7.815 250 HG21 VAL 108 HG21 VAL 108 -2.404 -3.463 8.772 251 HG22 VAL 108 HG22 VAL 108 -3.702 -2.721 7.838 252 HG23 VAL 108 HG23 VAL 108 -3.371 -2.170 9.480 253 H MET 109 HN MET 109 -1.284 1.501 8.120 254 HA MET 109 HA MET 109 1.389 1.462 7.026 255 HB2 MET 109 HB2 MET 109 -0.912 3.343 7.016 256 HB3 MET 109 HB1 MET 109 0.690 4.037 6.768 257 HG2 MET 109 HG2 MET 109 -0.625 3.233 4.686 258 HG3 MET 109 HG1 MET 109 1.074 2.773 4.820 259 HE1 MET 109 HE1 MET 109 -0.549 -0.179 3.048 260 HE2 MET 109 HE2 MET 109 1.105 0.315 3.403 261 HE3 MET 109 HE3 MET 109 -0.075 1.518 2.886 262 H THR 110 HN THR 110 -0.048 2.591 9.988 263 HA THR 110 HA THR 110 2.423 4.067 10.622 264 HB THR 110 HB THR 110 1.120 5.165 12.360 265 HG1 THR 110 HG1 THR 110 -0.854 3.340 11.485 266 HG21 THR 110 HG21 THR 110 -0.539 6.275 10.871 267 HG22 THR 110 HG22 THR 110 -0.227 5.026 9.666 268 HG23 THR 110 HG23 THR 110 1.063 6.126 10.149 269 H ASN 111 HN ASN 111 0.721 1.163 11.367 270 HA ASN 111 HA ASN 111 2.240 0.841 13.875 271 HB2 ASN 111 HB2 ASN 111 -0.306 0.539 13.763 272 HB3 ASN 111 HB1 ASN 111 0.040 -0.973 12.924 273 HD21 ASN 111 HD21 ASN 111 -0.544 -2.427 14.630 274 HD22 ASN 111 HD22 ASN 111 0.274 -2.473 16.117 275 H LEU 112 HN LEU 112 1.643 -0.737 10.743 276 HA LEU 112 HA LEU 112 3.710 -2.742 11.427 277 HB2 LEU 112 HB2 LEU 112 1.634 -2.805 9.233 278 HB3 LEU 112 HB1 LEU 112 2.770 -4.094 9.618 279 HG LEU 112 HG LEU 112 0.644 -3.008 11.494 280 HD11 LEU 112 HD11 LEU 112 0.487 -5.821 10.770 281 HD12 LEU 112 HD12 LEU 112 0.393 -4.788 9.343 282 HD13 LEU 112 HD13 LEU 112 -0.754 -4.572 10.666 283 HD21 LEU 112 HD21 LEU 112 2.920 -4.920 11.798 284 HD22 LEU 112 HD22 LEU 112 1.400 -5.340 12.587 285 HD23 LEU 112 HD23 LEU 112 2.209 -3.824 12.981 286 H GLY 113 HN GLY 113 5.498 -3.021 10.205 287 HA2 GLY 113 HA2 GLY 113 7.211 -2.501 8.770 288 HA3 GLY 113 HA1 GLY 113 5.948 -2.177 7.588 289 H GLU 114 HN GLU 114 8.575 -0.845 8.925 290 HA GLU 114 HA GLU 114 9.047 1.372 9.758 291 HB2 GLU 114 HB2 GLU 114 8.474 1.563 6.789 292 HB3 GLU 114 HB1 GLU 114 9.499 2.654 7.718 293 HG2 GLU 114 HG2 GLU 114 11.111 1.206 6.915 294 HG3 GLU 114 HG1 GLU 114 10.698 0.390 8.422 295 H LYS 115 HN LYS 115 7.306 2.039 11.089 296 HA LYS 115 HA LYS 115 4.783 2.784 10.398 297 HB2 LYS 115 HB2 LYS 115 6.584 4.207 12.370 298 HB3 LYS 115 HB1 LYS 115 4.820 4.273 12.349 299 HG2 LYS 115 HG2 LYS 115 4.765 1.791 12.644 300 HG3 LYS 115 HG1 LYS 115 6.520 1.798 12.768 301 HD2 LYS 115 HD2 LYS 115 6.397 3.283 14.725 302 HD3 LYS 115 HD1 LYS 115 4.637 3.302 14.607 303 HE2 LYS 115 HE2 LYS 115 5.321 1.669 16.292 304 HE3 LYS 115 HE1 LYS 115 4.621 0.829 14.908 305 HZ1 LYS 115 HZ1 LYS 115 7.517 1.213 15.443 306 HZ2 LYS 115 HZ2 LYS 115 6.871 0.458 14.066 307 HZ3 LYS 115 HZ3 LYS 115 6.656 -0.238 15.600 308 H LEU 116 HN LEU 116 3.818 4.354 9.268 309 HA LEU 116 HA LEU 116 5.464 6.406 7.987 310 HB2 LEU 116 HB2 LEU 116 2.730 5.268 7.543 311 HB3 LEU 116 HB1 LEU 116 3.004 6.930 7.044 312 HG LEU 116 HG LEU 116 3.407 5.306 5.196 313 HD11 LEU 116 HD11 LEU 116 5.010 7.449 5.981 314 HD12 LEU 116 HD12 LEU 116 4.970 6.706 4.386 315 HD13 LEU 116 HD13 LEU 116 6.157 6.177 5.578 316 HD21 LEU 116 HD21 LEU 116 5.791 4.406 6.825 317 HD22 LEU 116 HD22 LEU 116 5.202 3.724 5.313 318 HD23 LEU 116 HD23 LEU 116 4.269 3.512 6.797 319 H THR 117 HN THR 117 4.796 8.702 8.063 320 HA THR 117 HA THR 117 3.852 9.415 10.729 321 HB THR 117 HB THR 117 4.552 11.681 10.126 322 HG1 THR 117 HG1 THR 117 5.220 10.549 7.615 323 HG21 THR 117 HG21 THR 117 6.234 9.386 10.242 324 HG22 THR 117 HG22 THR 117 6.630 11.045 10.691 325 HG23 THR 117 HG23 THR 117 6.918 10.485 9.044 326 H ASP 118 HN ASP 118 2.271 11.291 10.868 327 HA ASP 118 HA ASP 118 -0.165 10.583 9.675 328 HB2 ASP 118 HB2 ASP 118 0.755 13.133 11.005 329 HB3 ASP 118 HB1 ASP 118 -0.904 12.878 10.468 330 H GLU 119 HN GLU 119 2.230 13.035 8.773 331 HA GLU 119 HA GLU 119 0.709 14.262 6.724 332 HB2 GLU 119 HB2 GLU 119 3.700 13.990 7.111 333 HB3 GLU 119 HB1 GLU 119 2.973 14.965 5.836 334 HG2 GLU 119 HG2 GLU 119 2.482 15.333 8.806 335 HG3 GLU 119 HG1 GLU 119 3.551 16.331 7.825 336 H GLU 120 HN GLU 120 2.927 11.515 6.729 337 HA GLU 120 HA GLU 120 2.827 11.073 3.912 338 HB2 GLU 120 HB2 GLU 120 3.675 9.345 6.239 339 HB3 GLU 120 HB1 GLU 120 3.784 8.816 4.556 340 HG2 GLU 120 HG2 GLU 120 5.184 10.769 4.019 341 HG3 GLU 120 HG1 GLU 120 5.050 11.337 5.679 342 H VAL 121 HN VAL 121 1.057 9.808 6.689 343 HA VAL 121 HA VAL 121 -0.445 7.828 5.309 344 HB VAL 121 HB VAL 121 -1.062 9.414 7.821 345 HG11 VAL 121 HG11 VAL 121 -3.195 8.730 7.393 346 HG12 VAL 121 HG12 VAL 121 -2.602 7.172 7.964 347 HG13 VAL 121 HG13 VAL 121 -2.679 7.502 6.237 348 HG21 VAL 121 HG21 VAL 121 -0.657 6.521 7.979 349 HG22 VAL 121 HG22 VAL 121 0.088 7.806 8.927 350 HG23 VAL 121 HG23 VAL 121 0.754 7.368 7.354 351 H ASP 122 HN ASP 122 -1.040 11.269 5.987 352 HA ASP 122 HA ASP 122 -3.658 11.391 4.988 353 HB2 ASP 122 HB2 ASP 122 -2.585 13.212 6.280 354 HB3 ASP 122 HB1 ASP 122 -1.534 13.554 4.908 355 H GLU 123 HN GLU 123 -0.525 11.776 3.341 356 HA GLU 123 HA GLU 123 -1.538 12.469 0.792 357 HB2 GLU 123 HB2 GLU 123 0.983 10.990 1.593 358 HB3 GLU 123 HB1 GLU 123 0.645 11.542 -0.045 359 HG2 GLU 123 HG2 GLU 123 0.700 13.367 2.367 360 HG3 GLU 123 HG1 GLU 123 2.076 13.111 1.296 361 H MET 124 HN MET 124 -0.865 9.406 2.371 362 HA MET 124 HA MET 124 -1.358 7.676 0.180 363 HB2 MET 124 HB2 MET 124 -1.586 7.271 3.180 364 HB3 MET 124 HB1 MET 124 -1.641 5.977 1.989 365 HG2 MET 124 HG2 MET 124 0.642 7.902 1.878 366 HG3 MET 124 HG1 MET 124 0.658 6.678 3.144 367 HE1 MET 124 HE1 MET 124 -0.049 4.525 2.850 368 HE2 MET 124 HE2 MET 124 1.497 3.860 2.330 369 HE3 MET 124 HE3 MET 124 0.037 3.493 1.415 370 H ILE 125 HN ILE 125 -3.423 9.006 2.752 371 HA ILE 125 HA ILE 125 -5.745 7.551 2.083 372 HB ILE 125 HB ILE 125 -5.024 9.720 3.879 373 HG12 ILE 125 HG12 ILE 125 -6.973 8.601 5.188 374 HG13 ILE 125 HG11 ILE 125 -6.908 7.367 3.938 375 HG21 ILE 125 HG21 ILE 125 -6.604 11.077 2.685 376 HG22 ILE 125 HG22 ILE 125 -7.379 10.538 4.171 377 HG23 ILE 125 HG23 ILE 125 -7.783 9.763 2.643 378 HD11 ILE 125 HD11 ILE 125 -5.337 6.454 5.341 379 HD12 ILE 125 HD12 ILE 125 -4.955 8.012 6.074 380 HD13 ILE 125 HD13 ILE 125 -4.267 7.584 4.509 381 H ARG 126 HN ARG 126 -4.466 10.629 1.000 382 HA ARG 126 HA ARG 126 -6.708 11.584 -0.396 383 HB2 ARG 126 HB2 ARG 126 -4.566 12.845 0.129 384 HB3 ARG 126 HB1 ARG 126 -3.824 11.982 -1.217 385 HG2 ARG 126 HG2 ARG 126 -4.551 13.887 -2.316 386 HG3 ARG 126 HG1 ARG 126 -5.969 12.861 -2.518 387 HD2 ARG 126 HD2 ARG 126 -6.735 15.013 -1.743 388 HD3 ARG 126 HD1 ARG 126 -6.908 13.881 -0.408 389 HE ARG 126 HE ARG 126 -4.373 15.196 -0.318 390 HH11 ARG 126 HH21 ARG 126 -7.762 15.579 0.275 391 HH12 ARG 126 HH22 ARG 126 -7.551 16.788 1.498 392 HH21 ARG 126 HH11 ARG 126 -4.089 16.779 1.283 393 HH22 ARG 126 HH12 ARG 126 -5.471 17.469 2.068 394 H GLU 127 HN GLU 127 -4.235 9.270 -1.242 395 HA GLU 127 HA GLU 127 -5.299 8.987 -3.969 396 HB2 GLU 127 HB2 GLU 127 -2.867 7.759 -2.652 397 HB3 GLU 127 HB1 GLU 127 -3.325 7.554 -4.345 398 HG2 GLU 127 HG2 GLU 127 -3.175 10.002 -4.674 399 HG3 GLU 127 HG1 GLU 127 -2.689 10.192 -2.991 400 H ALA 128 HN ALA 128 -5.914 7.759 -0.960 401 HA ALA 128 HA ALA 128 -6.278 4.976 -1.735 402 HB1 ALA 128 HB1 ALA 128 -5.556 5.720 0.570 403 HB2 ALA 128 HB2 ALA 128 -6.911 4.599 0.533 404 HB3 ALA 128 HB3 ALA 128 -7.199 6.309 0.813 405 H ASP 129 HN ASP 129 -8.580 7.038 -0.006 406 HA ASP 129 HA ASP 129 -10.624 7.213 -1.910 407 HB2 ASP 129 HB2 ASP 129 -10.681 4.747 -1.848 408 HB3 ASP 129 HB1 ASP 129 -10.916 4.793 -0.106 409 H ILE 130 HN ILE 130 -12.087 5.852 0.721 410 HA ILE 130 HA ILE 130 -13.232 6.582 2.518 411 HB ILE 130 HB ILE 130 -11.197 8.819 2.645 412 HG12 ILE 130 HG12 ILE 130 -11.252 6.156 4.086 413 HG13 ILE 130 HG11 ILE 130 -10.262 6.464 2.658 414 HG21 ILE 130 HG21 ILE 130 -13.580 8.218 4.135 415 HG22 ILE 130 HG22 ILE 130 -12.404 9.501 4.433 416 HG23 ILE 130 HG23 ILE 130 -12.184 7.915 5.168 417 HD11 ILE 130 HD11 ILE 130 -9.067 8.242 3.819 418 HD12 ILE 130 HD12 ILE 130 -9.005 6.781 4.800 419 HD13 ILE 130 HD13 ILE 130 -10.119 8.080 5.223 420 H ASP 131 HN ASP 131 -12.768 9.811 2.693 421 HA ASP 131 HA ASP 131 -14.002 11.666 2.176 422 HB2 ASP 131 HB2 ASP 131 -14.983 10.124 -0.241 423 HB3 ASP 131 HB1 ASP 131 -15.054 11.862 0.010 424 H GLY 132 HN GLY 132 -15.569 8.537 2.066 425 HA2 GLY 132 HA2 GLY 132 -17.489 9.047 3.980 426 HA3 GLY 132 HA1 GLY 132 -18.236 9.461 2.439 427 H ASP 133 HN ASP 133 -16.005 7.152 1.726 428 HA ASP 133 HA ASP 133 -18.052 5.103 1.504 429 HB2 ASP 133 HB2 ASP 133 -15.171 5.226 0.610 430 HB3 ASP 133 HB1 ASP 133 -16.196 3.809 0.381 431 H GLY 134 HN GLY 134 -14.987 5.581 3.200 432 HA2 GLY 134 HA2 GLY 134 -14.377 4.710 5.280 433 HA3 GLY 134 HA1 GLY 134 -15.798 3.671 5.237 434 H GLN 135 HN GLN 135 -14.587 3.199 2.292 435 HA GLN 135 HA GLN 135 -12.813 0.992 3.164 436 HB2 GLN 135 HB2 GLN 135 -14.273 0.930 0.549 437 HB3 GLN 135 HB1 GLN 135 -13.699 -0.406 1.552 438 HG2 GLN 135 HG2 GLN 135 -16.048 1.418 2.132 439 HG3 GLN 135 HG1 GLN 135 -16.109 -0.305 1.755 440 HE21 GLN 135 HE21 GLN 135 -16.540 1.621 4.326 441 HE22 GLN 135 HE22 GLN 135 -15.881 0.660 5.560 442 H VAL 136 HN VAL 136 -11.251 0.283 1.418 443 HA VAL 136 HA VAL 136 -10.382 2.523 -0.274 444 HB VAL 136 HB VAL 136 -8.765 1.021 1.768 445 HG11 VAL 136 HG11 VAL 136 -6.805 2.279 0.654 446 HG12 VAL 136 HG12 VAL 136 -7.855 2.419 -0.756 447 HG13 VAL 136 HG13 VAL 136 -7.381 0.823 -0.158 448 HG21 VAL 136 HG21 VAL 136 -9.865 3.138 2.385 449 HG22 VAL 136 HG22 VAL 136 -9.064 3.946 1.046 450 HG23 VAL 136 HG23 VAL 136 -8.112 3.307 2.387 451 H ASN 137 HN ASN 137 -9.830 1.933 -2.289 452 HA ASN 137 HA ASN 137 -9.824 -0.938 -2.896 453 HB2 ASN 137 HB2 ASN 137 -10.138 -0.281 -5.207 454 HB3 ASN 137 HB1 ASN 137 -11.287 0.600 -4.206 455 HD21 ASN 137 HD21 ASN 137 -10.290 1.482 -6.835 456 HD22 ASN 137 HD22 ASN 137 -9.480 2.951 -6.574 457 H TYR 138 HN TYR 138 -7.843 -1.867 -2.767 458 HA TYR 138 HA TYR 138 -5.410 -0.469 -2.851 459 HB2 TYR 138 HB2 TYR 138 -4.337 -2.684 -3.064 460 HB3 TYR 138 HB1 TYR 138 -5.551 -2.641 -1.790 461 HD1 TYR 138 HD1 TYR 138 -4.929 -3.715 -5.305 462 HD2 TYR 138 HD2 TYR 138 -7.469 -4.049 -1.870 463 HE1 TYR 138 HE1 TYR 138 -6.113 -5.625 -6.357 464 HE2 TYR 138 HE2 TYR 138 -8.644 -5.949 -2.896 465 HH TYR 138 HH TYR 138 -8.650 -7.400 -4.605 466 H GLU 139 HN GLU 139 -7.453 -1.220 -5.416 467 HA GLU 139 HA GLU 139 -5.639 -1.871 -7.469 468 HB2 GLU 139 HB2 GLU 139 -8.256 -0.361 -7.552 469 HB3 GLU 139 HB1 GLU 139 -7.360 -0.818 -9.001 470 HG2 GLU 139 HG2 GLU 139 -7.506 -3.170 -8.418 471 HG3 GLU 139 HG1 GLU 139 -8.247 -2.778 -6.866 472 H GLU 140 HN GLU 140 -6.830 1.365 -6.470 473 HA GLU 140 HA GLU 140 -5.327 2.846 -8.306 474 HB2 GLU 140 HB2 GLU 140 -7.180 3.776 -6.965 475 HB3 GLU 140 HB1 GLU 140 -6.183 3.655 -5.516 476 HG2 GLU 140 HG2 GLU 140 -4.543 5.200 -6.482 477 HG3 GLU 140 HG1 GLU 140 -5.472 5.278 -7.977 478 H PHE 141 HN PHE 141 -4.499 1.729 -5.054 479 HA PHE 141 HA PHE 141 -2.026 3.091 -4.814 480 HB2 PHE 141 HB2 PHE 141 -3.264 0.702 -3.533 481 HB3 PHE 141 HB1 PHE 141 -1.521 0.898 -3.372 482 HD1 PHE 141 HD2 PHE 141 -0.660 3.212 -2.605 483 HD2 PHE 141 HD1 PHE 141 -4.722 1.903 -2.118 484 HE1 PHE 141 HE2 PHE 141 -0.991 4.892 -0.818 485 HE2 PHE 141 HE1 PHE 141 -5.040 3.571 -0.324 486 HZ PHE 141 HZ PHE 141 -3.179 5.067 0.330 487 H VAL 142 HN VAL 142 -2.823 -0.126 -6.072 488 HA VAL 142 HA VAL 142 -0.153 -0.836 -6.700 489 HB VAL 142 HB VAL 142 -2.809 -1.827 -7.750 490 HG11 VAL 142 HG11 VAL 142 -1.251 -3.793 -8.491 491 HG12 VAL 142 HG12 VAL 142 0.029 -2.580 -8.436 492 HG13 VAL 142 HG13 VAL 142 -1.346 -2.361 -9.518 493 HG21 VAL 142 HG21 VAL 142 -2.751 -3.139 -5.914 494 HG22 VAL 142 HG22 VAL 142 -1.335 -2.245 -5.358 495 HG23 VAL 142 HG23 VAL 142 -1.136 -3.704 -6.330 496 H GLN 143 HN GLN 143 -2.712 0.783 -8.587 497 HA GLN 143 HA GLN 143 -1.386 0.783 -11.052 498 HB2 GLN 143 HB2 GLN 143 -3.756 1.493 -10.683 499 HB3 GLN 143 HB1 GLN 143 -3.155 2.975 -9.941 500 HG2 GLN 143 HG2 GLN 143 -3.675 3.413 -12.280 501 HG3 GLN 143 HG1 GLN 143 -1.930 3.489 -12.055 502 HE21 GLN 143 HE21 GLN 143 -4.407 0.971 -12.837 503 HE22 GLN 143 HE22 GLN 143 -3.457 0.210 -14.020 504 H MET 144 HN MET 144 -1.232 3.068 -8.333 505 HA MET 144 HA MET 144 0.512 4.920 -9.529 506 HB2 MET 144 HB2 MET 144 0.158 4.131 -6.625 507 HB3 MET 144 HB1 MET 144 1.202 5.457 -7.141 508 HG2 MET 144 HG2 MET 144 -0.867 6.386 -8.364 509 HG3 MET 144 HG1 MET 144 -1.798 5.220 -7.425 510 HE1 MET 144 HE1 MET 144 -1.414 6.313 -3.775 511 HE2 MET 144 HE2 MET 144 -0.662 4.988 -4.656 512 HE3 MET 144 HE3 MET 144 -2.351 5.386 -4.955 513 H MET 145 HN MET 145 1.119 1.935 -7.747 514 HA MET 145 HA MET 145 3.962 2.185 -7.753 515 HB2 MET 145 HB2 MET 145 2.134 -0.183 -7.280 516 HB3 MET 145 HB1 MET 145 3.886 -0.210 -7.039 517 HG2 MET 145 HG2 MET 145 3.703 1.647 -5.435 518 HG3 MET 145 HG1 MET 145 1.961 1.691 -5.680 519 HE1 MET 145 HE1 MET 145 2.253 1.893 -3.373 520 HE2 MET 145 HE2 MET 145 2.894 0.711 -2.236 521 HE3 MET 145 HE3 MET 145 1.198 0.639 -2.708 522 H THR 146 HN THR 146 1.697 1.183 -10.148 523 HA THR 146 HA THR 146 3.749 -0.315 -11.622 524 HB THR 146 HB THR 146 1.362 -0.187 -13.137 525 HG1 THR 146 HG1 THR 146 -0.117 -0.949 -11.579 526 HG21 THR 146 HG21 THR 146 1.300 -2.548 -12.796 527 HG22 THR 146 HG22 THR 146 2.229 -2.433 -11.298 528 HG23 THR 146 HG23 THR 146 3.002 -2.101 -12.852 529 H ALA 147 HN ALA 147 3.717 2.674 -11.210 530 HA ALA 147 HA ALA 147 3.916 3.395 -14.060 531 HB1 ALA 147 HB1 ALA 147 2.573 4.965 -11.859 532 HB2 ALA 147 HB2 ALA 147 1.873 4.427 -13.385 533 HB3 ALA 147 HB3 ALA 147 3.095 5.699 -13.375 534 H LYS 148 HN LYS 148 4.294 5.912 -11.850 535 HA LYS 148 HA LYS 148 6.810 6.701 -12.460 536 HB2 LYS 148 HB2 LYS 148 5.677 6.712 -9.653 537 HB3 LYS 148 HB1 LYS 148 6.951 7.764 -10.261 538 HG2 LYS 148 HG2 LYS 148 4.248 7.685 -11.601 539 HG3 LYS 148 HG1 LYS 148 4.522 8.693 -10.182 540 HD2 LYS 148 HD2 LYS 148 6.460 9.751 -11.377 541 HD3 LYS 148 HD1 LYS 148 6.017 8.836 -12.817 542 HE2 LYS 148 HE2 LYS 148 4.140 10.718 -11.368 543 HE3 LYS 148 HE1 LYS 148 5.084 11.164 -12.789 544 HZ1 LYS 148 HZ1 LYS 148 2.820 9.313 -12.564 545 HZ2 LYS 148 HZ2 LYS 148 3.999 9.016 -13.752 546 HZ3 LYS 148 HZ3 LYS 148 3.143 10.483 -13.749 547 H PHE 30 HT1 PHE 30 -9.448 -3.824 12.009 548 HA PHE 30 HA PHE 30 -8.449 -4.409 9.946 549 HB2 PHE 30 HB2 PHE 30 -6.855 -6.030 11.895 550 HB3 PHE 30 HB1 PHE 30 -6.309 -4.804 10.750 551 HD1 PHE 30 HD2 PHE 30 -7.705 -2.430 11.212 552 HD2 PHE 30 HD1 PHE 30 -6.581 -5.386 14.122 553 HE1 PHE 30 HE2 PHE 30 -7.803 -0.712 12.995 554 HE2 PHE 30 HE1 PHE 30 -6.681 -3.666 15.905 555 HZ PHE 30 HZ PHE 30 -7.291 -1.329 15.341 556 H ASP 31 HN ASP 31 -8.938 -7.265 12.016 557 HA ASP 31 HA ASP 31 -9.240 -9.486 11.517 558 HB2 ASP 31 HB2 ASP 31 -11.230 -8.429 10.381 559 HB3 ASP 31 HB1 ASP 31 -10.307 -8.471 8.879 560 H ILE 32 HN ILE 32 -6.649 -8.703 11.107 561 HA ILE 32 HA ILE 32 -5.901 -10.292 8.728 562 HB ILE 32 HB ILE 32 -4.261 -8.770 8.065 563 HG12 ILE 32 HG12 ILE 32 -4.466 -7.633 10.869 564 HG13 ILE 32 HG11 ILE 32 -3.073 -8.433 10.134 565 HG21 ILE 32 HG21 ILE 32 -5.398 -6.726 7.758 566 HG22 ILE 32 HG22 ILE 32 -6.216 -6.848 9.311 567 HG23 ILE 32 HG23 ILE 32 -6.691 -7.901 7.976 568 HD11 ILE 32 HD11 ILE 32 -4.062 -5.656 9.763 569 HD12 ILE 32 HD12 ILE 32 -3.422 -6.469 8.335 570 HD13 ILE 32 HD13 ILE 32 -2.411 -6.275 9.767 571 H ASP 33 HN ASP 33 -3.681 -11.190 8.904 572 HA ASP 33 HA ASP 33 -3.259 -12.165 11.625 573 HB2 ASP 33 HB2 ASP 33 -1.925 -12.959 9.026 574 HB3 ASP 33 HB1 ASP 33 -1.728 -13.772 10.577 575 H MET 34 HN MET 34 -2.481 -10.078 12.416 576 HA MET 34 HA MET 34 -0.199 -8.782 11.394 577 HB2 MET 34 HB2 MET 34 -1.394 -8.844 14.167 578 HB3 MET 34 HB1 MET 34 -0.007 -7.841 13.742 579 HG2 MET 34 HG2 MET 34 -1.337 -6.757 11.966 580 HG3 MET 34 HG1 MET 34 -2.722 -7.756 12.402 581 HE1 MET 34 HE1 MET 34 -3.674 -4.192 13.590 582 HE2 MET 34 HE2 MET 34 -3.796 -5.413 12.327 583 HE3 MET 34 HE3 MET 34 -2.379 -4.367 12.395 584 H ASP 35 HN ASP 35 -0.596 -11.394 13.724 585 HA ASP 35 HA ASP 35 2.043 -11.519 14.679 586 HB2 ASP 35 HB2 ASP 35 0.116 -12.708 15.699 587 HB3 ASP 35 HB1 ASP 35 0.098 -13.810 14.321 588 H ALA 36 HN ALA 36 0.513 -12.975 11.834 589 HA ALA 36 HA ALA 36 2.575 -14.702 11.088 590 HB1 ALA 36 HB1 ALA 36 1.636 -14.465 8.783 591 HB2 ALA 36 HB2 ALA 36 0.590 -13.187 9.399 592 HB3 ALA 36 HB3 ALA 36 0.429 -14.831 10.016 593 HA PRO 37 HA PRO 37 5.828 -11.622 10.199 594 HB2 PRO 37 HB2 PRO 37 6.786 -13.852 8.444 595 HB3 PRO 37 HB1 PRO 37 7.693 -12.860 9.603 596 HG2 PRO 37 HG2 PRO 37 7.016 -15.329 10.212 597 HG3 PRO 37 HG1 PRO 37 6.912 -14.039 11.425 598 HD2 PRO 37 HD2 PRO 37 4.700 -15.384 9.915 599 HD3 PRO 37 HD1 PRO 37 4.736 -14.761 11.583 600 H GLU 38 HN GLU 38 4.126 -13.489 7.732 601 HA GLU 38 HA GLU 38 4.974 -12.090 5.451 602 HB2 GLU 38 HB2 GLU 38 2.386 -13.537 6.040 603 HB3 GLU 38 HB1 GLU 38 2.818 -12.916 4.447 604 HG2 GLU 38 HG2 GLU 38 4.564 -14.823 6.025 605 HG3 GLU 38 HG1 GLU 38 3.398 -15.349 4.812 606 H THR 39 HN THR 39 2.296 -11.435 7.697 607 HA THR 39 HA THR 39 1.115 -9.347 6.214 608 HB THR 39 HB THR 39 1.190 -9.746 9.215 609 HG1 THR 39 HG1 THR 39 -0.556 -10.576 7.148 610 HG21 THR 39 HG21 THR 39 0.408 -7.580 9.035 611 HG22 THR 39 HG22 THR 39 -1.101 -8.461 8.797 612 HG23 THR 39 HG23 THR 39 -0.219 -7.830 7.405 613 H GLU 40 HN GLU 40 3.601 -9.286 8.763 614 HA GLU 40 HA GLU 40 3.925 -6.476 8.814 615 HB2 GLU 40 HB2 GLU 40 5.791 -8.740 9.547 616 HB3 GLU 40 HB1 GLU 40 6.181 -7.041 9.812 617 HG2 GLU 40 HG2 GLU 40 4.262 -6.759 11.257 618 HG3 GLU 40 HG1 GLU 40 3.684 -8.381 10.879 619 H ARG 41 HN ARG 41 5.519 -9.035 6.959 620 HA ARG 41 HA ARG 41 7.429 -7.375 5.682 621 HB2 ARG 41 HB2 ARG 41 6.223 -10.031 4.871 622 HB3 ARG 41 HB1 ARG 41 7.563 -9.263 4.024 623 HG2 ARG 41 HG2 ARG 41 7.732 -9.709 6.996 624 HG3 ARG 41 HG1 ARG 41 8.078 -11.036 5.890 625 HD2 ARG 41 HD2 ARG 41 9.778 -9.625 4.758 626 HD3 ARG 41 HD1 ARG 41 9.462 -8.332 5.907 627 HE ARG 41 HE ARG 41 10.084 -10.679 7.341 628 HH11 ARG 41 HH21 ARG 41 11.496 -8.336 5.224 629 HH12 ARG 41 HH22 ARG 41 13.090 -8.494 5.883 630 HH21 ARG 41 HH11 ARG 41 12.173 -10.893 8.215 631 HH22 ARG 41 HH12 ARG 41 13.474 -9.944 7.578 632 H ALA 42 HN ALA 42 4.139 -8.342 4.864 633 HA ALA 42 HA ALA 42 4.054 -7.323 2.242 634 HB1 ALA 42 HB1 ALA 42 2.224 -8.654 2.756 635 HB2 ALA 42 HB2 ALA 42 1.519 -7.042 2.894 636 HB3 ALA 42 HB3 ALA 42 2.005 -7.921 4.344 637 H ALA 43 HN ALA 43 3.429 -5.813 5.377 638 HA ALA 43 HA ALA 43 2.482 -3.332 4.436 639 HB1 ALA 43 HB1 ALA 43 2.567 -4.337 6.858 640 HB2 ALA 43 HB2 ALA 43 2.686 -2.592 6.636 641 HB3 ALA 43 HB3 ALA 43 4.141 -3.544 6.933 642 H VAL 44 HN VAL 44 5.734 -4.542 5.094 643 HA VAL 44 HA VAL 44 7.144 -2.130 4.785 644 HB VAL 44 HB VAL 44 7.966 -5.000 4.322 645 HG11 VAL 44 HG11 VAL 44 10.307 -3.905 4.653 646 HG12 VAL 44 HG12 VAL 44 9.505 -2.418 4.148 647 HG13 VAL 44 HG13 VAL 44 9.550 -3.808 3.063 648 HG21 VAL 44 HG21 VAL 44 8.960 -4.809 6.513 649 HG22 VAL 44 HG22 VAL 44 7.297 -4.235 6.641 650 HG23 VAL 44 HG23 VAL 44 8.626 -3.079 6.571 651 H ALA 45 HN ALA 45 6.344 -4.655 2.384 652 HA ALA 45 HA ALA 45 7.737 -3.518 0.221 653 HB1 ALA 45 HB1 ALA 45 5.211 -4.877 -0.443 654 HB2 ALA 45 HB2 ALA 45 6.301 -5.800 0.590 655 HB3 ALA 45 HB3 ALA 45 6.854 -5.219 -0.981 656 H ILE 46 HN ILE 46 4.333 -3.110 1.207 657 HA ILE 46 HA ILE 46 3.645 -1.375 -0.921 658 HB ILE 46 HB ILE 46 2.463 -1.763 1.830 659 HG12 ILE 46 HG12 ILE 46 1.434 -2.562 -0.904 660 HG13 ILE 46 HG11 ILE 46 2.425 -3.626 0.098 661 HG21 ILE 46 HG21 ILE 46 0.455 -0.601 0.773 662 HG22 ILE 46 HG22 ILE 46 1.548 -0.058 -0.497 663 HG23 ILE 46 HG23 ILE 46 1.813 0.450 1.170 664 HD11 ILE 46 HD11 ILE 46 0.732 -4.048 1.548 665 HD12 ILE 46 HD12 ILE 46 -0.299 -3.525 0.215 666 HD13 ILE 46 HD13 ILE 46 0.139 -2.388 1.492 667 H GLN 47 HN GLN 47 4.715 -0.752 2.398 668 HA GLN 47 HA GLN 47 4.608 2.072 2.268 669 HB2 GLN 47 HB2 GLN 47 6.198 0.162 3.983 670 HB3 GLN 47 HB1 GLN 47 6.208 1.910 4.217 671 HG2 GLN 47 HG2 GLN 47 3.843 1.945 4.654 672 HG3 GLN 47 HG1 GLN 47 3.670 0.262 4.161 673 HE21 GLN 47 HE21 GLN 47 3.178 1.634 6.864 674 HE22 GLN 47 HE22 GLN 47 4.085 0.713 7.963 675 H SER 48 HN SER 48 7.204 -0.255 1.602 676 HA SER 48 HA SER 48 9.272 1.622 1.214 677 HB2 SER 48 HB2 SER 48 8.875 -1.141 0.049 678 HB3 SER 48 HB1 SER 48 10.363 -0.211 -0.095 679 HG SER 48 HG SER 48 10.160 -1.745 1.733 680 H GLN 49 HN GLN 49 6.932 0.183 -1.013 681 HA GLN 49 HA GLN 49 7.958 1.424 -3.356 682 HB2 GLN 49 HB2 GLN 49 5.587 -0.159 -2.617 683 HB3 GLN 49 HB1 GLN 49 5.350 0.962 -3.956 684 HG2 GLN 49 HG2 GLN 49 6.147 -1.250 -4.743 685 HG3 GLN 49 HG1 GLN 49 7.295 0.031 -5.119 686 HE21 GLN 49 HE21 GLN 49 6.647 -2.476 -2.611 687 HE22 GLN 49 HE22 GLN 49 8.284 -2.724 -2.234 688 H PHE 50 HN PHE 50 5.506 2.353 -0.981 689 HA PHE 50 HA PHE 50 4.421 4.529 -2.378 690 HB2 PHE 50 HB2 PHE 50 3.281 3.717 -0.424 691 HB3 PHE 50 HB1 PHE 50 4.680 4.050 0.596 692 HD1 PHE 50 HD1 PHE 50 2.638 5.930 -1.953 693 HD2 PHE 50 HD2 PHE 50 4.479 5.954 1.941 694 HE1 PHE 50 HE1 PHE 50 1.844 8.251 -1.589 695 HE2 PHE 50 HE2 PHE 50 3.688 8.279 2.290 696 HZ PHE 50 HZ PHE 50 2.369 9.428 0.532 697 H ARG 51 HN ARG 51 7.121 4.448 -0.042 698 HA ARG 51 HA ARG 51 7.652 7.216 -0.114 699 HB2 ARG 51 HB2 ARG 51 9.449 4.855 0.469 700 HB3 ARG 51 HB1 ARG 51 9.961 6.533 0.653 701 HG2 ARG 51 HG2 ARG 51 8.182 6.944 2.269 702 HG3 ARG 51 HG1 ARG 51 7.548 5.316 2.027 703 HD2 ARG 51 HD2 ARG 51 10.344 5.909 3.026 704 HD3 ARG 51 HD1 ARG 51 8.981 5.554 4.081 705 HE ARG 51 HE ARG 51 9.128 3.477 2.220 706 HH11 ARG 51 HH21 ARG 51 11.052 4.912 4.714 707 HH12 ARG 51 HH22 ARG 51 11.853 3.436 5.138 708 HH21 ARG 51 HH11 ARG 51 10.176 1.535 2.773 709 HH22 ARG 51 HH12 ARG 51 11.357 1.525 4.039 710 H LYS 52 HN LYS 52 8.856 4.537 -2.106 711 HA LYS 52 HA LYS 52 10.750 6.026 -3.588 712 HB2 LYS 52 HB2 LYS 52 9.187 3.527 -4.256 713 HB3 LYS 52 HB1 LYS 52 10.436 4.195 -5.306 714 HG2 LYS 52 HG2 LYS 52 12.079 4.017 -3.480 715 HG3 LYS 52 HG1 LYS 52 10.835 3.359 -2.419 716 HD2 LYS 52 HD2 LYS 52 10.531 1.449 -3.952 717 HD3 LYS 52 HD1 LYS 52 11.777 2.105 -5.014 718 HE2 LYS 52 HE2 LYS 52 13.430 1.931 -3.193 719 HE3 LYS 52 HE1 LYS 52 12.187 1.283 -2.124 720 HZ1 LYS 52 HZ1 LYS 52 12.840 -0.690 -2.889 721 HZ2 LYS 52 HZ2 LYS 52 13.672 -0.020 -4.211 722 HZ3 LYS 52 HZ3 LYS 52 11.998 -0.297 -4.308 723 H PHE 53 HN PHE 53 7.306 5.426 -4.019 724 HA PHE 53 HA PHE 53 6.982 6.497 -6.590 725 HB2 PHE 53 HB2 PHE 53 5.231 5.218 -5.433 726 HB3 PHE 53 HB1 PHE 53 5.041 6.524 -4.263 727 HD1 PHE 53 HD1 PHE 53 4.692 5.616 -7.843 728 HD2 PHE 53 HD2 PHE 53 3.797 8.501 -4.793 729 HE1 PHE 53 HE1 PHE 53 3.125 6.761 -9.389 730 HE2 PHE 53 HE2 PHE 53 2.227 9.645 -6.335 731 HZ PHE 53 HZ PHE 53 1.892 8.775 -8.632 732 H GLN 54 HN GLN 54 6.730 8.062 -3.399 733 HA GLN 54 HA GLN 54 6.077 10.639 -4.343 734 HB2 GLN 54 HB2 GLN 54 7.472 9.730 -1.814 735 HB3 GLN 54 HB1 GLN 54 6.960 11.391 -2.103 736 HG2 GLN 54 HG2 GLN 54 5.117 8.982 -2.129 737 HG3 GLN 54 HG1 GLN 54 5.291 10.102 -0.780 738 HE21 GLN 54 HE21 GLN 54 3.078 9.464 -3.000 739 HE22 GLN 54 HE22 GLN 54 2.566 11.025 -3.430 740 H LYS 55 HN LYS 55 9.192 9.082 -3.690 741 HA LYS 55 HA LYS 55 10.821 11.351 -4.087 742 HB2 LYS 55 HB2 LYS 55 11.370 8.398 -4.412 743 HB3 LYS 55 HB1 LYS 55 12.615 9.637 -4.578 744 HG2 LYS 55 HG2 LYS 55 12.145 10.432 -2.296 745 HG3 LYS 55 HG1 LYS 55 10.887 9.210 -2.124 746 HD2 LYS 55 HD2 LYS 55 12.574 7.432 -2.470 747 HD3 LYS 55 HD1 LYS 55 13.829 8.663 -2.604 748 HE2 LYS 55 HE2 LYS 55 12.057 8.256 -0.178 749 HE3 LYS 55 HE1 LYS 55 13.720 7.689 -0.318 750 HZ1 LYS 55 HZ1 LYS 55 13.758 9.758 0.808 751 HZ2 LYS 55 HZ2 LYS 55 12.766 10.496 -0.356 752 HZ3 LYS 55 HZ3 LYS 55 14.354 10.040 -0.754 753 H LYS 56 HN LYS 56 9.554 8.922 -6.324 754 HA LYS 56 HA LYS 56 11.018 9.698 -8.602 755 HB2 LYS 56 HB2 LYS 56 8.305 8.396 -8.303 756 HB3 LYS 56 HB1 LYS 56 9.099 8.626 -9.860 757 HG2 LYS 56 HG2 LYS 56 10.617 7.304 -7.634 758 HG3 LYS 56 HG1 LYS 56 9.422 6.366 -8.526 759 HD2 LYS 56 HD2 LYS 56 10.559 6.978 -10.652 760 HD3 LYS 56 HD1 LYS 56 11.786 7.842 -9.729 761 HE2 LYS 56 HE2 LYS 56 12.591 5.596 -10.274 762 HE3 LYS 56 HE1 LYS 56 12.344 5.739 -8.534 763 HZ1 LYS 56 HZ1 LYS 56 10.504 4.412 -8.588 764 HZ2 LYS 56 HZ2 LYS 56 11.402 3.711 -9.850 765 HZ3 LYS 56 HZ3 LYS 56 10.129 4.781 -10.200 766 H LYS 57 HN LYS 57 7.938 10.830 -7.277 767 HA LYS 57 HA LYS 57 7.182 12.495 -9.419 768 HB2 LYS 57 HB2 LYS 57 5.718 11.824 -7.491 769 HB3 LYS 57 HB1 LYS 57 6.632 12.930 -6.471 770 HG2 LYS 57 HG2 LYS 57 4.830 14.268 -7.107 771 HG3 LYS 57 HG1 LYS 57 6.023 14.701 -8.328 772 HD2 LYS 57 HD2 LYS 57 5.019 13.116 -9.911 773 HD3 LYS 57 HD1 LYS 57 3.864 12.599 -8.683 774 HE2 LYS 57 HE2 LYS 57 4.108 15.429 -9.744 775 HE3 LYS 57 HE1 LYS 57 2.889 14.262 -10.260 776 HZ1 LYS 57 HZ1 LYS 57 3.040 14.488 -7.417 777 HZ2 LYS 57 HZ2 LYS 57 1.693 14.630 -8.443 778 HZ3 LYS 57 HZ3 LYS 57 2.686 15.978 -8.147 779 H ALA 58 HN ALA 58 9.152 13.079 -6.542 780 HA ALA 58 HA ALA 58 9.573 15.841 -6.904 781 HB1 ALA 58 HB1 ALA 58 10.087 14.741 -4.794 782 HB2 ALA 58 HB2 ALA 58 11.543 15.506 -5.431 783 HB3 ALA 58 HB3 ALA 58 11.327 13.762 -5.578 784 H GLY 59 HN GLY 59 11.061 13.027 -8.347 785 HA2 GLY 59 HA2 GLY 59 13.443 14.148 -9.309 786 HA3 GLY 59 HA1 GLY 59 12.591 12.798 -10.050 787 H SER 60 HN SER 60 14.008 15.010 -11.337 788 HA SER 60 HA SER 60 12.140 16.874 -12.414 789 HB2 SER 60 HB2 SER 60 13.921 17.511 -13.907 790 HB3 SER 60 HB1 SER 60 14.625 17.201 -12.321 791 HG SER 60 HG SER 60 14.988 15.002 -13.166 792 H GLN 61 HN GLN 61 11.520 17.022 -14.679 793 HA GLN 61 HA GLN 61 11.526 14.570 -16.247 794 HB2 GLN 61 HB2 GLN 61 9.064 14.520 -16.453 795 HB3 GLN 61 HB1 GLN 61 9.587 14.230 -14.793 796 HG2 GLN 61 HG2 GLN 61 9.213 16.643 -14.291 797 HG3 GLN 61 HG1 GLN 61 8.591 16.860 -15.926 798 HE21 GLN 61 HE21 GLN 61 7.545 16.393 -12.808 799 HE22 GLN 61 HE22 GLN 61 6.065 15.626 -13.122 800 H SER 62 HN SER 62 12.532 17.334 -16.474 801 HA SER 62 HA SER 62 12.667 19.026 -18.022 802 HB2 SER 62 HB2 SER 62 12.398 18.389 -20.313 803 HB3 SER 62 HB1 SER 62 13.007 16.972 -19.462 804 HG SER 62 HG SER 62 10.515 17.472 -20.590 Start of MODEL 6 1 H1 MET 76 HT1 MET 76 10.122 -6.472 -12.157 2 H2 MET 76 HT2 MET 76 11.282 -7.346 -11.275 3 H3 MET 76 HT3 MET 76 9.917 -8.137 -11.908 4 HA MET 76 HA MET 76 10.776 -7.333 -14.175 5 HB2 MET 76 HB2 MET 76 13.397 -7.446 -12.682 6 HB3 MET 76 HB1 MET 76 13.090 -6.858 -14.315 7 HG2 MET 76 HG2 MET 76 12.130 -5.555 -11.748 8 HG3 MET 76 HG1 MET 76 13.427 -4.967 -12.787 9 HE1 MET 76 HE1 MET 76 12.042 -2.635 -12.707 10 HE2 MET 76 HE2 MET 76 10.827 -3.469 -11.742 11 HE3 MET 76 HE3 MET 76 10.331 -2.525 -13.145 12 H LYS 77 HN LYS 77 11.751 -9.021 -15.438 13 HA LYS 77 HA LYS 77 12.045 -11.234 -15.980 14 HB2 LYS 77 HB2 LYS 77 13.396 -11.216 -13.271 15 HB3 LYS 77 HB1 LYS 77 13.518 -12.526 -14.447 16 HG2 LYS 77 HG2 LYS 77 14.469 -10.957 -16.099 17 HG3 LYS 77 HG1 LYS 77 14.363 -9.652 -14.916 18 HD2 LYS 77 HD2 LYS 77 15.882 -10.868 -13.413 19 HD3 LYS 77 HD1 LYS 77 15.975 -12.197 -14.570 20 HE2 LYS 77 HE2 LYS 77 17.926 -10.736 -14.825 21 HE3 LYS 77 HE1 LYS 77 16.907 -10.631 -16.260 22 HZ1 LYS 77 HZ1 LYS 77 16.331 -8.519 -15.810 23 HZ2 LYS 77 HZ2 LYS 77 17.781 -8.510 -14.922 24 HZ3 LYS 77 HZ3 LYS 77 16.298 -8.756 -14.130 25 H ASP 78 HN ASP 78 9.547 -10.544 -14.823 26 HA ASP 78 HA ASP 78 8.689 -13.181 -13.976 27 HB2 ASP 78 HB2 ASP 78 9.357 -12.133 -11.837 28 HB3 ASP 78 HB1 ASP 78 8.255 -10.796 -12.163 29 H THR 79 HN THR 79 7.888 -12.528 -16.224 30 HA THR 79 HA THR 79 6.298 -11.480 -17.626 31 HB THR 79 HB THR 79 4.062 -12.551 -17.053 32 HG1 THR 79 HG1 THR 79 4.686 -14.299 -15.363 33 HG21 THR 79 HG21 THR 79 5.290 -14.946 -17.108 34 HG22 THR 79 HG22 THR 79 6.660 -13.917 -17.524 35 HG23 THR 79 HG23 THR 79 5.205 -13.891 -18.520 36 H ASP 80 HN ASP 80 4.154 -11.627 -14.882 37 HA ASP 80 HA ASP 80 3.914 -8.676 -14.917 38 HB2 ASP 80 HB2 ASP 80 1.525 -8.995 -14.357 39 HB3 ASP 80 HB1 ASP 80 1.939 -9.694 -15.920 40 H SER 81 HN SER 81 4.993 -8.052 -13.132 41 HA SER 81 HA SER 81 4.922 -9.594 -10.682 42 HB2 SER 81 HB2 SER 81 6.411 -7.911 -9.795 43 HB3 SER 81 HB1 SER 81 6.944 -8.319 -11.425 44 HG SER 81 HG SER 81 5.074 -6.279 -11.194 45 H GLU 82 HN GLU 82 2.858 -7.400 -12.111 46 HA GLU 82 HA GLU 82 2.037 -5.752 -10.016 47 HB2 GLU 82 HB2 GLU 82 0.418 -6.991 -12.256 48 HB3 GLU 82 HB1 GLU 82 -0.202 -5.749 -11.173 49 HG2 GLU 82 HG2 GLU 82 0.555 -4.492 -12.996 50 HG3 GLU 82 HG1 GLU 82 1.914 -4.399 -11.884 51 H GLU 83 HN GLU 83 1.257 -9.072 -10.773 52 HA GLU 83 HA GLU 83 -0.809 -9.442 -8.865 53 HB2 GLU 83 HB2 GLU 83 -0.507 -11.791 -9.282 54 HB3 GLU 83 HB1 GLU 83 -0.275 -10.950 -10.815 55 HG2 GLU 83 HG2 GLU 83 2.229 -10.937 -10.268 56 HG3 GLU 83 HG1 GLU 83 1.849 -12.077 -8.980 57 H GLU 84 HN GLU 84 2.714 -9.626 -8.693 58 HA GLU 84 HA GLU 84 2.965 -11.022 -6.263 59 HB2 GLU 84 HB2 GLU 84 4.847 -10.594 -7.809 60 HB3 GLU 84 HB1 GLU 84 4.790 -8.883 -7.392 61 HG2 GLU 84 HG2 GLU 84 5.287 -9.404 -5.049 62 HG3 GLU 84 HG1 GLU 84 5.274 -11.129 -5.414 63 H ILE 85 HN ILE 85 2.762 -7.534 -6.902 64 HA ILE 85 HA ILE 85 2.920 -6.800 -4.149 65 HB ILE 85 HB ILE 85 2.019 -5.290 -6.610 66 HG12 ILE 85 HG12 ILE 85 4.515 -5.941 -6.013 67 HG13 ILE 85 HG11 ILE 85 4.139 -4.317 -6.587 68 HG21 ILE 85 HG21 ILE 85 0.791 -4.255 -4.881 69 HG22 ILE 85 HG22 ILE 85 2.260 -3.288 -4.974 70 HG23 ILE 85 HG23 ILE 85 2.073 -4.491 -3.696 71 HD11 ILE 85 HD11 ILE 85 5.619 -4.540 -4.464 72 HD12 ILE 85 HD12 ILE 85 4.121 -4.948 -3.632 73 HD13 ILE 85 HD13 ILE 85 4.286 -3.388 -4.425 74 H ARG 86 HN ARG 86 0.360 -7.626 -6.368 75 HA ARG 86 HA ARG 86 -1.858 -6.663 -4.920 76 HB2 ARG 86 HB2 ARG 86 -1.937 -7.400 -7.274 77 HB3 ARG 86 HB1 ARG 86 -1.636 -9.054 -6.752 78 HG2 ARG 86 HG2 ARG 86 -3.715 -9.120 -5.533 79 HG3 ARG 86 HG1 ARG 86 -3.997 -7.406 -5.834 80 HD2 ARG 86 HD2 ARG 86 -3.686 -9.445 -8.046 81 HD3 ARG 86 HD1 ARG 86 -5.254 -8.987 -7.376 82 HE ARG 86 HE ARG 86 -3.898 -6.635 -8.103 83 HH11 ARG 86 HH21 ARG 86 -5.249 -9.488 -9.520 84 HH12 ARG 86 HH22 ARG 86 -5.635 -8.724 -11.026 85 HH21 ARG 86 HH11 ARG 86 -4.401 -5.626 -10.074 86 HH22 ARG 86 HH12 ARG 86 -5.154 -6.537 -11.340 87 H GLU 87 HN GLU 87 -0.047 -9.696 -4.778 88 HA GLU 87 HA GLU 87 -1.768 -11.145 -3.103 89 HB2 GLU 87 HB2 GLU 87 1.231 -11.240 -3.426 90 HB3 GLU 87 HB1 GLU 87 0.348 -12.358 -2.385 91 HG2 GLU 87 HG2 GLU 87 -0.933 -13.197 -4.242 92 HG3 GLU 87 HG1 GLU 87 -0.305 -11.947 -5.310 93 H ALA 88 HN ALA 88 0.759 -8.796 -2.350 94 HA ALA 88 HA ALA 88 0.783 -9.128 0.451 95 HB1 ALA 88 HB1 ALA 88 1.569 -6.936 -1.421 96 HB2 ALA 88 HB2 ALA 88 2.548 -7.826 -0.261 97 HB3 ALA 88 HB3 ALA 88 1.445 -6.568 0.297 98 H PHE 89 HN PHE 89 -1.414 -7.360 -1.674 99 HA PHE 89 HA PHE 89 -2.718 -5.979 0.505 100 HB2 PHE 89 HB2 PHE 89 -3.310 -6.304 -2.429 101 HB3 PHE 89 HB1 PHE 89 -4.487 -5.577 -1.331 102 HD1 PHE 89 HD2 PHE 89 -3.924 -3.509 -0.071 103 HD2 PHE 89 HD1 PHE 89 -1.277 -5.149 -3.023 104 HE1 PHE 89 HE2 PHE 89 -2.668 -1.372 -0.134 105 HE2 PHE 89 HE1 PHE 89 -0.011 -3.015 -3.083 106 HZ PHE 89 HZ PHE 89 -0.714 -1.124 -1.639 107 H ARG 90 HN ARG 90 -3.293 -8.880 -1.440 108 HA ARG 90 HA ARG 90 -5.815 -9.616 -0.704 109 HB2 ARG 90 HB2 ARG 90 -3.427 -11.062 -1.513 110 HB3 ARG 90 HB1 ARG 90 -4.422 -12.011 -0.419 111 HG2 ARG 90 HG2 ARG 90 -5.178 -12.470 -2.658 112 HG3 ARG 90 HG1 ARG 90 -6.409 -11.468 -1.897 113 HD2 ARG 90 HD2 ARG 90 -5.120 -9.470 -2.934 114 HD3 ARG 90 HD1 ARG 90 -4.339 -10.685 -3.940 115 HE ARG 90 HE ARG 90 -7.114 -9.823 -4.100 116 HH11 ARG 90 HH21 ARG 90 -4.715 -12.192 -4.880 117 HH12 ARG 90 HH22 ARG 90 -5.588 -12.832 -6.232 118 HH21 ARG 90 HH11 ARG 90 -8.264 -10.656 -5.872 119 HH22 ARG 90 HH12 ARG 90 -7.597 -11.961 -6.794 120 H VAL 91 HN VAL 91 -2.964 -9.558 1.313 121 HA VAL 91 HA VAL 91 -3.863 -11.156 3.432 122 HB VAL 91 HB VAL 91 -1.957 -8.811 3.304 123 HG11 VAL 91 HG11 VAL 91 -2.976 -10.415 5.617 124 HG12 VAL 91 HG12 VAL 91 -2.444 -8.734 5.569 125 HG13 VAL 91 HG13 VAL 91 -1.254 -10.037 5.580 126 HG21 VAL 91 HG21 VAL 91 -1.586 -11.188 2.229 127 HG22 VAL 91 HG22 VAL 91 -1.286 -11.681 3.895 128 HG23 VAL 91 HG23 VAL 91 -0.286 -10.434 3.150 129 H PHE 92 HN PHE 92 -4.365 -7.724 2.702 130 HA PHE 92 HA PHE 92 -5.906 -7.365 5.155 131 HB2 PHE 92 HB2 PHE 92 -5.525 -5.368 2.927 132 HB3 PHE 92 HB1 PHE 92 -5.946 -5.050 4.609 133 HD1 PHE 92 HD2 PHE 92 -4.143 -6.394 6.286 134 HD2 PHE 92 HD1 PHE 92 -3.346 -4.755 2.398 135 HE1 PHE 92 HE2 PHE 92 -1.742 -6.218 6.854 136 HE2 PHE 92 HE1 PHE 92 -0.948 -4.592 2.968 137 HZ PHE 92 HZ PHE 92 -0.139 -5.318 5.193 138 H ASP 93 HN ASP 93 -6.434 -7.914 1.750 139 HA ASP 93 HA ASP 93 -9.272 -7.226 1.935 140 HB2 ASP 93 HB2 ASP 93 -7.955 -6.749 -0.147 141 HB3 ASP 93 HB1 ASP 93 -7.796 -8.486 -0.382 142 H LYS 94 HN LYS 94 -9.484 -8.888 3.712 143 HA LYS 94 HA LYS 94 -9.217 -11.656 3.153 144 HB2 LYS 94 HB2 LYS 94 -10.433 -11.971 5.225 145 HB3 LYS 94 HB1 LYS 94 -9.238 -10.695 5.423 146 HG2 LYS 94 HG2 LYS 94 -11.003 -8.998 5.053 147 HG3 LYS 94 HG1 LYS 94 -12.200 -10.282 4.899 148 HD2 LYS 94 HD2 LYS 94 -11.680 -11.049 7.186 149 HD3 LYS 94 HD1 LYS 94 -10.499 -9.748 7.349 150 HE2 LYS 94 HE2 LYS 94 -12.278 -8.078 7.004 151 HE3 LYS 94 HE1 LYS 94 -13.463 -9.372 6.829 152 HZ1 LYS 94 HZ1 LYS 94 -12.223 -9.979 9.155 153 HZ2 LYS 94 HZ2 LYS 94 -13.714 -9.176 9.018 154 HZ3 LYS 94 HZ3 LYS 94 -12.280 -8.285 9.209 155 H ASP 95 HN ASP 95 -11.614 -9.351 2.343 156 HA ASP 95 HA ASP 95 -13.752 -11.296 2.060 157 HB2 ASP 95 HB2 ASP 95 -13.533 -8.363 1.371 158 HB3 ASP 95 HB1 ASP 95 -14.970 -9.331 1.045 159 H GLY 96 HN GLY 96 -11.256 -9.864 0.115 160 HA2 GLY 96 HA2 GLY 96 -10.561 -10.354 -2.035 161 HA3 GLY 96 HA1 GLY 96 -11.685 -11.713 -2.021 162 H ASN 97 HN ASN 97 -12.618 -8.388 -1.411 163 HA ASN 97 HA ASN 97 -14.433 -8.503 -3.711 164 HB2 ASN 97 HB2 ASN 97 -15.121 -7.808 -1.319 165 HB3 ASN 97 HB1 ASN 97 -14.312 -6.285 -1.682 166 HD21 ASN 97 HD21 ASN 97 -16.241 -4.995 -1.827 167 HD22 ASN 97 HD22 ASN 97 -17.398 -5.225 -3.048 168 H GLY 98 HN GLY 98 -11.349 -7.454 -3.089 169 HA2 GLY 98 HA2 GLY 98 -9.986 -6.380 -4.700 170 HA3 GLY 98 HA1 GLY 98 -11.427 -5.645 -5.396 171 H TYR 99 HN TYR 99 -11.588 -5.378 -2.074 172 HA TYR 99 HA TYR 99 -10.162 -2.794 -2.021 173 HB2 TYR 99 HB2 TYR 99 -12.962 -3.206 -0.953 174 HB3 TYR 99 HB1 TYR 99 -12.027 -1.709 -0.936 175 HD1 TYR 99 HD1 TYR 99 -13.378 -4.282 -3.268 176 HD2 TYR 99 HD2 TYR 99 -12.200 -0.194 -2.716 177 HE1 TYR 99 HE1 TYR 99 -14.245 -3.736 -5.524 178 HE2 TYR 99 HE2 TYR 99 -13.062 0.359 -4.979 179 HH TYR 99 HH TYR 99 -15.086 -1.687 -6.721 180 H ILE 100 HN ILE 100 -9.724 -1.995 0.145 181 HA ILE 100 HA ILE 100 -9.903 -4.030 2.268 182 HB ILE 100 HB ILE 100 -7.658 -4.015 2.756 183 HG12 ILE 100 HG12 ILE 100 -7.631 -1.169 1.732 184 HG13 ILE 100 HG11 ILE 100 -7.451 -1.701 3.402 185 HG21 ILE 100 HG21 ILE 100 -6.365 -4.176 0.802 186 HG22 ILE 100 HG22 ILE 100 -7.239 -2.859 0.011 187 HG23 ILE 100 HG23 ILE 100 -8.003 -4.442 0.206 188 HD11 ILE 100 HD11 ILE 100 -5.489 -1.893 1.136 189 HD12 ILE 100 HD12 ILE 100 -5.402 -3.036 2.476 190 HD13 ILE 100 HD13 ILE 100 -5.236 -1.308 2.781 191 H SER 101 HN SER 101 -10.118 -3.075 4.389 192 HA SER 101 HA SER 101 -11.591 -0.682 4.422 193 HB2 SER 101 HB2 SER 101 -10.119 -2.069 6.677 194 HB3 SER 101 HB1 SER 101 -11.291 -0.772 6.892 195 HG SER 101 HG SER 101 -11.697 -3.404 6.473 196 H ALA 102 HN ALA 102 -11.037 1.416 4.615 197 HA ALA 102 HA ALA 102 -8.370 2.239 4.133 198 HB1 ALA 102 HB1 ALA 102 -10.781 3.429 3.836 199 HB2 ALA 102 HB2 ALA 102 -9.250 4.308 3.841 200 HB3 ALA 102 HB3 ALA 102 -10.221 4.216 5.312 201 H ALA 103 HN ALA 103 -10.312 2.060 7.077 202 HA ALA 103 HA ALA 103 -8.645 3.534 8.778 203 HB1 ALA 103 HB1 ALA 103 -11.020 2.566 9.169 204 HB2 ALA 103 HB2 ALA 103 -9.916 2.694 10.540 205 HB3 ALA 103 HB3 ALA 103 -10.164 1.137 9.750 206 H GLU 104 HN GLU 104 -8.560 0.052 8.016 207 HA GLU 104 HA GLU 104 -6.517 -0.542 9.911 208 HB2 GLU 104 HB2 GLU 104 -6.588 -2.697 9.103 209 HB3 GLU 104 HB1 GLU 104 -8.170 -2.117 8.597 210 HG2 GLU 104 HG2 GLU 104 -6.982 -1.418 6.409 211 HG3 GLU 104 HG1 GLU 104 -5.689 -2.486 6.933 212 H LEU 105 HN LEU 105 -6.507 0.632 6.629 213 HA LEU 105 HA LEU 105 -3.843 0.029 5.935 214 HB2 LEU 105 HB2 LEU 105 -5.439 0.810 4.267 215 HB3 LEU 105 HB1 LEU 105 -5.566 2.366 5.084 216 HG LEU 105 HG LEU 105 -2.785 1.666 4.516 217 HD11 LEU 105 HD11 LEU 105 -2.981 2.005 2.057 218 HD12 LEU 105 HD12 LEU 105 -4.737 1.943 2.206 219 HD13 LEU 105 HD13 LEU 105 -3.770 0.517 2.583 220 HD21 LEU 105 HD21 LEU 105 -4.500 3.974 3.549 221 HD22 LEU 105 HD22 LEU 105 -2.744 3.944 3.719 222 HD23 LEU 105 HD23 LEU 105 -3.769 3.912 5.155 223 H ARG 106 HN ARG 106 -5.260 2.927 7.437 224 HA ARG 106 HA ARG 106 -2.925 4.434 7.692 225 HB2 ARG 106 HB2 ARG 106 -5.142 5.358 8.161 226 HB3 ARG 106 HB1 ARG 106 -5.306 4.303 9.566 227 HG2 ARG 106 HG2 ARG 106 -2.832 5.900 9.550 228 HG3 ARG 106 HG1 ARG 106 -4.305 6.864 9.644 229 HD2 ARG 106 HD2 ARG 106 -5.064 5.497 11.561 230 HD3 ARG 106 HD1 ARG 106 -3.579 4.558 11.477 231 HE ARG 106 HE ARG 106 -2.418 6.367 12.405 232 HH11 ARG 106 HH21 ARG 106 -5.676 7.194 11.570 233 HH12 ARG 106 HH22 ARG 106 -5.659 8.697 12.431 234 HH21 ARG 106 HH11 ARG 106 -2.392 8.335 13.534 235 HH22 ARG 106 HH12 ARG 106 -3.801 9.344 13.541 236 H HIS 107 HN HIS 107 -4.364 2.136 10.055 237 HA HIS 107 HA HIS 107 -2.318 2.382 11.979 238 HB2 HIS 107 HB2 HIS 107 -4.479 1.343 12.482 239 HB3 HIS 107 HB1 HIS 107 -4.116 0.021 11.371 240 HD1 HIS 107 HD1 HIS 107 -2.651 1.616 14.509 241 HD2 HIS 107 HD2 HIS 107 -2.732 -2.061 12.550 242 HE1 HIS 107 HE1 HIS 107 -1.455 -0.027 16.022 243 HE2 HIS 107 HE2 HIS 107 -1.498 -2.275 14.843 244 H VAL 108 HN VAL 108 -2.762 0.161 9.279 245 HA VAL 108 HA VAL 108 -0.510 -1.474 9.692 246 HB VAL 108 HB VAL 108 -2.058 -0.719 7.200 247 HG11 VAL 108 HG11 VAL 108 -0.009 -2.924 7.529 248 HG12 VAL 108 HG12 VAL 108 0.187 -1.492 6.522 249 HG13 VAL 108 HG13 VAL 108 -1.041 -2.688 6.127 250 HG21 VAL 108 HG21 VAL 108 -2.844 -2.183 9.352 251 HG22 VAL 108 HG22 VAL 108 -2.131 -3.444 8.345 252 HG23 VAL 108 HG23 VAL 108 -3.445 -2.450 7.715 253 H MET 109 HN MET 109 -0.948 1.568 7.948 254 HA MET 109 HA MET 109 1.722 1.625 6.863 255 HB2 MET 109 HB2 MET 109 -0.596 3.505 6.936 256 HB3 MET 109 HB1 MET 109 1.007 4.167 6.603 257 HG2 MET 109 HG2 MET 109 -0.431 3.357 4.594 258 HG3 MET 109 HG1 MET 109 1.274 2.891 4.652 259 HE1 MET 109 HE1 MET 109 1.222 1.003 3.170 260 HE2 MET 109 HE2 MET 109 -0.468 1.268 2.745 261 HE3 MET 109 HE3 MET 109 0.083 -0.350 3.175 262 H THR 110 HN THR 110 0.277 2.654 9.869 263 HA THR 110 HA THR 110 2.705 4.204 10.503 264 HB THR 110 HB THR 110 1.390 5.193 12.300 265 HG1 THR 110 HG1 THR 110 -0.303 3.115 11.598 266 HG21 THR 110 HG21 THR 110 0.932 5.494 9.545 267 HG22 THR 110 HG22 THR 110 0.581 6.653 10.830 268 HG23 THR 110 HG23 THR 110 -0.660 5.516 10.306 269 H ASN 111 HN ASN 111 1.141 1.207 11.235 270 HA ASN 111 HA ASN 111 2.797 0.902 13.675 271 HB2 ASN 111 HB2 ASN 111 0.249 0.706 13.787 272 HB3 ASN 111 HB1 ASN 111 0.440 -0.812 12.911 273 HD21 ASN 111 HD21 ASN 111 -0.119 -2.221 14.669 274 HD22 ASN 111 HD22 ASN 111 0.821 -2.345 16.077 275 H LEU 112 HN LEU 112 1.603 -1.005 10.887 276 HA LEU 112 HA LEU 112 3.588 -3.074 11.390 277 HB2 LEU 112 HB2 LEU 112 1.606 -2.780 9.137 278 HB3 LEU 112 HB1 LEU 112 2.543 -4.223 9.502 279 HG LEU 112 HG LEU 112 0.518 -2.931 11.357 280 HD11 LEU 112 HD11 LEU 112 -0.062 -5.637 10.543 281 HD12 LEU 112 HD12 LEU 112 0.154 -4.626 9.118 282 HD13 LEU 112 HD13 LEU 112 -1.046 -4.189 10.334 283 HD21 LEU 112 HD21 LEU 112 1.992 -4.027 12.800 284 HD22 LEU 112 HD22 LEU 112 2.417 -5.246 11.600 285 HD23 LEU 112 HD23 LEU 112 0.862 -5.326 12.423 286 H GLY 113 HN GLY 113 5.148 -3.779 9.814 287 HA2 GLY 113 HA2 GLY 113 6.825 -3.466 8.288 288 HA3 GLY 113 HA1 GLY 113 5.701 -2.432 7.414 289 H GLU 114 HN GLU 114 6.159 -0.379 7.271 290 HA GLU 114 HA GLU 114 8.343 0.733 8.890 291 HB2 GLU 114 HB2 GLU 114 7.081 1.764 6.338 292 HB3 GLU 114 HB1 GLU 114 8.454 2.493 7.175 293 HG2 GLU 114 HG2 GLU 114 8.422 -0.354 6.161 294 HG3 GLU 114 HG1 GLU 114 9.106 0.997 5.259 295 H LYS 115 HN LYS 115 8.058 3.087 9.464 296 HA LYS 115 HA LYS 115 5.276 3.526 10.368 297 HB2 LYS 115 HB2 LYS 115 7.855 4.589 11.545 298 HB3 LYS 115 HB1 LYS 115 6.230 4.917 12.148 299 HG2 LYS 115 HG2 LYS 115 5.897 2.450 12.447 300 HG3 LYS 115 HG1 LYS 115 7.576 2.204 11.975 301 HD2 LYS 115 HD2 LYS 115 7.699 2.230 14.320 302 HD3 LYS 115 HD1 LYS 115 8.125 3.884 13.889 303 HE2 LYS 115 HE2 LYS 115 5.873 4.656 14.385 304 HE3 LYS 115 HE1 LYS 115 5.315 3.001 14.631 305 HZ1 LYS 115 HZ1 LYS 115 5.906 4.365 16.674 306 HZ2 LYS 115 HZ2 LYS 115 7.529 4.149 16.219 307 HZ3 LYS 115 HZ3 LYS 115 6.557 2.802 16.574 308 H LEU 116 HN LEU 116 4.330 4.771 8.901 309 HA LEU 116 HA LEU 116 5.808 6.917 7.593 310 HB2 LEU 116 HB2 LEU 116 3.026 5.785 7.279 311 HB3 LEU 116 HB1 LEU 116 3.439 7.344 6.580 312 HG LEU 116 HG LEU 116 3.691 5.461 4.956 313 HD11 LEU 116 HD11 LEU 116 5.475 7.571 5.446 314 HD12 LEU 116 HD12 LEU 116 5.351 6.625 3.968 315 HD13 LEU 116 HD13 LEU 116 6.509 6.165 5.214 316 HD21 LEU 116 HD21 LEU 116 5.462 3.833 5.257 317 HD22 LEU 116 HD22 LEU 116 4.420 3.781 6.673 318 HD23 LEU 116 HD23 LEU 116 5.979 4.598 6.758 319 H THR 117 HN THR 117 5.185 9.163 7.784 320 HA THR 117 HA THR 117 4.183 9.790 10.450 321 HB THR 117 HB THR 117 4.912 12.070 9.965 322 HG1 THR 117 HG1 THR 117 5.777 11.124 7.455 323 HG21 THR 117 HG21 THR 117 6.536 10.119 10.557 324 HG22 THR 117 HG22 THR 117 7.218 11.649 10.005 325 HG23 THR 117 HG23 THR 117 7.084 10.290 8.889 326 H ASP 118 HN ASP 118 2.666 11.757 10.572 327 HA ASP 118 HA ASP 118 0.206 11.087 9.425 328 HB2 ASP 118 HB2 ASP 118 -0.529 13.341 10.159 329 HB3 ASP 118 HB1 ASP 118 0.345 12.471 11.417 330 H GLU 119 HN GLU 119 2.646 13.428 8.395 331 HA GLU 119 HA GLU 119 1.176 14.579 6.277 332 HB2 GLU 119 HB2 GLU 119 4.149 14.268 6.723 333 HB3 GLU 119 HB1 GLU 119 3.466 15.171 5.371 334 HG2 GLU 119 HG2 GLU 119 2.325 16.682 6.886 335 HG3 GLU 119 HG1 GLU 119 2.815 15.719 8.278 336 H GLU 120 HN GLU 120 3.318 11.748 6.392 337 HA GLU 120 HA GLU 120 3.167 11.219 3.580 338 HB2 GLU 120 HB2 GLU 120 4.110 9.675 5.974 339 HB3 GLU 120 HB1 GLU 120 3.951 8.893 4.400 340 HG2 GLU 120 HG2 GLU 120 6.226 10.029 5.073 341 HG3 GLU 120 HG1 GLU 120 5.615 10.197 3.430 342 H VAL 121 HN VAL 121 1.464 10.019 6.453 343 HA VAL 121 HA VAL 121 -0.053 8.019 5.148 344 HB VAL 121 HB VAL 121 -0.502 9.610 7.694 345 HG11 VAL 121 HG11 VAL 121 -2.133 7.451 6.387 346 HG12 VAL 121 HG12 VAL 121 -2.681 8.940 7.164 347 HG13 VAL 121 HG13 VAL 121 -2.089 7.599 8.142 348 HG21 VAL 121 HG21 VAL 121 0.264 7.608 8.785 349 HG22 VAL 121 HG22 VAL 121 1.434 7.996 7.533 350 HG23 VAL 121 HG23 VAL 121 0.260 6.708 7.271 351 H ASP 122 HN ASP 122 -0.691 11.473 5.821 352 HA ASP 122 HA ASP 122 -3.346 11.529 4.877 353 HB2 ASP 122 HB2 ASP 122 -1.190 13.652 4.982 354 HB3 ASP 122 HB1 ASP 122 -2.841 13.989 4.461 355 H GLU 123 HN GLU 123 -0.238 11.895 3.210 356 HA GLU 123 HA GLU 123 -1.237 12.578 0.650 357 HB2 GLU 123 HB2 GLU 123 1.264 11.153 1.556 358 HB3 GLU 123 HB1 GLU 123 0.953 11.530 -0.137 359 HG2 GLU 123 HG2 GLU 123 0.899 13.883 0.330 360 HG3 GLU 123 HG1 GLU 123 0.938 13.596 2.064 361 H MET 124 HN MET 124 -0.581 9.529 2.258 362 HA MET 124 HA MET 124 -1.085 7.793 0.084 363 HB2 MET 124 HB2 MET 124 -1.258 7.416 3.084 364 HB3 MET 124 HB1 MET 124 -1.371 6.105 1.915 365 HG2 MET 124 HG2 MET 124 0.932 7.997 1.702 366 HG3 MET 124 HG1 MET 124 0.975 6.778 2.972 367 HE1 MET 124 HE1 MET 124 1.844 4.070 2.242 368 HE2 MET 124 HE2 MET 124 0.425 3.545 1.337 369 HE3 MET 124 HE3 MET 124 0.232 4.625 2.720 370 H ILE 125 HN ILE 125 -3.138 9.117 2.656 371 HA ILE 125 HA ILE 125 -5.465 7.664 1.996 372 HB ILE 125 HB ILE 125 -4.755 9.903 3.736 373 HG12 ILE 125 HG12 ILE 125 -6.430 8.651 5.218 374 HG13 ILE 125 HG11 ILE 125 -6.489 7.439 3.943 375 HG21 ILE 125 HG21 ILE 125 -6.495 11.100 2.638 376 HG22 ILE 125 HG22 ILE 125 -7.186 10.471 4.130 377 HG23 ILE 125 HG23 ILE 125 -7.541 9.677 2.597 378 HD11 ILE 125 HD11 ILE 125 -3.982 8.378 5.344 379 HD12 ILE 125 HD12 ILE 125 -4.054 7.137 4.099 380 HD13 ILE 125 HD13 ILE 125 -4.811 6.857 5.669 381 H ARG 126 HN ARG 126 -4.206 10.756 0.903 382 HA ARG 126 HA ARG 126 -6.475 11.657 -0.499 383 HB2 ARG 126 HB2 ARG 126 -4.510 13.085 -0.040 384 HB3 ARG 126 HB1 ARG 126 -3.557 12.119 -1.169 385 HG2 ARG 126 HG2 ARG 126 -4.993 12.748 -3.016 386 HG3 ARG 126 HG1 ARG 126 -6.111 13.566 -1.925 387 HD2 ARG 126 HD2 ARG 126 -3.208 14.354 -2.269 388 HD3 ARG 126 HD1 ARG 126 -4.541 15.122 -3.125 389 HE ARG 126 HE ARG 126 -5.138 15.183 -0.384 390 HH11 ARG 126 HH21 ARG 126 -2.830 16.428 -2.640 391 HH12 ARG 126 HH22 ARG 126 -2.520 17.875 -1.738 392 HH21 ARG 126 HH11 ARG 126 -4.739 17.077 0.805 393 HH22 ARG 126 HH12 ARG 126 -3.602 18.242 0.214 394 H GLU 127 HN GLU 127 -3.975 9.364 -1.283 395 HA GLU 127 HA GLU 127 -5.003 9.037 -4.018 396 HB2 GLU 127 HB2 GLU 127 -2.578 7.843 -2.655 397 HB3 GLU 127 HB1 GLU 127 -3.027 7.581 -4.341 398 HG2 GLU 127 HG2 GLU 127 -2.871 10.004 -4.768 399 HG3 GLU 127 HG1 GLU 127 -2.435 10.277 -3.082 400 H ALA 128 HN ALA 128 -5.410 7.726 -0.927 401 HA ALA 128 HA ALA 128 -5.875 4.991 -1.726 402 HB1 ALA 128 HB1 ALA 128 -6.408 4.567 0.525 403 HB2 ALA 128 HB2 ALA 128 -6.887 6.234 0.823 404 HB3 ALA 128 HB3 ALA 128 -5.186 5.824 0.607 405 H ASP 129 HN ASP 129 -8.159 7.335 -0.242 406 HA ASP 129 HA ASP 129 -10.115 7.441 -2.136 407 HB2 ASP 129 HB2 ASP 129 -10.032 4.760 -0.919 408 HB3 ASP 129 HB1 ASP 129 -11.624 5.498 -0.946 409 H ILE 130 HN ILE 130 -11.106 5.923 0.817 410 HA ILE 130 HA ILE 130 -12.639 6.651 2.360 411 HB ILE 130 HB ILE 130 -10.575 8.831 2.738 412 HG12 ILE 130 HG12 ILE 130 -10.742 6.086 3.997 413 HG13 ILE 130 HG11 ILE 130 -9.637 6.489 2.683 414 HG21 ILE 130 HG21 ILE 130 -11.837 9.398 4.531 415 HG22 ILE 130 HG22 ILE 130 -11.761 7.738 5.120 416 HG23 ILE 130 HG23 ILE 130 -13.053 8.222 4.024 417 HD11 ILE 130 HD11 ILE 130 -9.719 7.814 5.411 418 HD12 ILE 130 HD12 ILE 130 -8.641 8.272 4.095 419 HD13 ILE 130 HD13 ILE 130 -8.489 6.684 4.848 420 H ASP 131 HN ASP 131 -12.162 9.827 2.803 421 HA ASP 131 HA ASP 131 -13.261 11.755 2.166 422 HB2 ASP 131 HB2 ASP 131 -12.773 10.658 -0.222 423 HB3 ASP 131 HB1 ASP 131 -14.521 10.442 -0.201 424 H GLY 132 HN GLY 132 -14.808 8.649 2.083 425 HA2 GLY 132 HA2 GLY 132 -16.764 9.023 3.925 426 HA3 GLY 132 HA1 GLY 132 -17.496 9.607 2.430 427 H ASP 133 HN ASP 133 -15.388 7.450 1.320 428 HA ASP 133 HA ASP 133 -17.370 5.438 0.820 429 HB2 ASP 133 HB2 ASP 133 -14.404 5.562 0.271 430 HB3 ASP 133 HB1 ASP 133 -15.412 4.188 -0.189 431 H GLY 134 HN GLY 134 -14.504 5.676 2.858 432 HA2 GLY 134 HA2 GLY 134 -14.141 4.665 4.924 433 HA3 GLY 134 HA1 GLY 134 -15.568 3.665 4.664 434 H GLN 135 HN GLN 135 -14.189 3.195 1.851 435 HA GLN 135 HA GLN 135 -12.388 1.037 2.808 436 HB2 GLN 135 HB2 GLN 135 -13.632 0.670 0.167 437 HB3 GLN 135 HB1 GLN 135 -13.400 -0.481 1.487 438 HG2 GLN 135 HG2 GLN 135 -15.274 0.612 2.715 439 HG3 GLN 135 HG1 GLN 135 -15.543 1.653 1.315 440 HE21 GLN 135 HE21 GLN 135 -17.058 0.871 -0.144 441 HE22 GLN 135 HE22 GLN 135 -17.489 -0.762 -0.321 442 H VAL 136 HN VAL 136 -10.871 0.258 1.055 443 HA VAL 136 HA VAL 136 -10.010 2.450 -0.703 444 HB VAL 136 HB VAL 136 -8.344 0.935 1.287 445 HG11 VAL 136 HG11 VAL 136 -6.443 2.271 0.160 446 HG12 VAL 136 HG12 VAL 136 -7.538 2.419 -1.215 447 HG13 VAL 136 HG13 VAL 136 -7.011 0.822 -0.669 448 HG21 VAL 136 HG21 VAL 136 -7.774 3.153 2.056 449 HG22 VAL 136 HG22 VAL 136 -9.528 3.053 1.919 450 HG23 VAL 136 HG23 VAL 136 -8.601 3.884 0.680 451 H ASN 137 HN ASN 137 -9.449 1.846 -2.696 452 HA ASN 137 HA ASN 137 -9.508 -1.019 -3.320 453 HB2 ASN 137 HB2 ASN 137 -9.124 0.467 -5.678 454 HB3 ASN 137 HB1 ASN 137 -10.619 -0.278 -5.124 455 HD21 ASN 137 HD21 ASN 137 -9.186 2.711 -5.893 456 HD22 ASN 137 HD22 ASN 137 -10.333 3.722 -5.156 457 H TYR 138 HN TYR 138 -7.530 -1.946 -3.020 458 HA TYR 138 HA TYR 138 -5.078 -0.571 -3.147 459 HB2 TYR 138 HB2 TYR 138 -4.029 -2.809 -3.179 460 HB3 TYR 138 HB1 TYR 138 -5.271 -2.668 -1.937 461 HD1 TYR 138 HD1 TYR 138 -4.560 -3.989 -5.342 462 HD2 TYR 138 HD2 TYR 138 -7.234 -4.021 -1.984 463 HE1 TYR 138 HE1 TYR 138 -5.756 -5.934 -6.311 464 HE2 TYR 138 HE2 TYR 138 -8.428 -5.965 -2.944 465 HH TYR 138 HH TYR 138 -8.376 -6.844 -5.955 466 H GLU 139 HN GLU 139 -7.106 -1.617 -5.663 467 HA GLU 139 HA GLU 139 -5.255 -2.341 -7.647 468 HB2 GLU 139 HB2 GLU 139 -7.696 -2.599 -7.904 469 HB3 GLU 139 HB1 GLU 139 -7.868 -0.847 -7.995 470 HG2 GLU 139 HG2 GLU 139 -6.487 -0.787 -10.018 471 HG3 GLU 139 HG1 GLU 139 -6.221 -2.526 -9.909 472 H GLU 140 HN GLU 140 -6.626 0.898 -6.924 473 HA GLU 140 HA GLU 140 -5.159 2.293 -8.864 474 HB2 GLU 140 HB2 GLU 140 -7.096 3.245 -7.664 475 HB3 GLU 140 HB1 GLU 140 -6.152 3.283 -6.176 476 HG2 GLU 140 HG2 GLU 140 -6.146 5.494 -7.227 477 HG3 GLU 140 HG1 GLU 140 -4.523 4.815 -7.270 478 H PHE 141 HN PHE 141 -4.392 1.538 -5.493 479 HA PHE 141 HA PHE 141 -1.976 3.006 -5.311 480 HB2 PHE 141 HB2 PHE 141 -3.250 0.788 -3.827 481 HB3 PHE 141 HB1 PHE 141 -1.492 0.819 -3.739 482 HD1 PHE 141 HD2 PHE 141 -0.545 3.362 -3.477 483 HD2 PHE 141 HD1 PHE 141 -4.363 1.938 -2.118 484 HE1 PHE 141 HE2 PHE 141 -0.611 5.163 -1.777 485 HE2 PHE 141 HE1 PHE 141 -4.425 3.738 -0.418 486 HZ PHE 141 HZ PHE 141 -2.550 5.349 -0.247 487 H VAL 142 HN VAL 142 -2.578 -0.381 -6.233 488 HA VAL 142 HA VAL 142 0.129 -0.992 -6.771 489 HB VAL 142 HB VAL 142 -2.445 -2.202 -7.800 490 HG11 VAL 142 HG11 VAL 142 0.443 -2.924 -8.248 491 HG12 VAL 142 HG12 VAL 142 -0.879 -2.867 -9.416 492 HG13 VAL 142 HG13 VAL 142 -0.799 -4.176 -8.237 493 HG21 VAL 142 HG21 VAL 142 -0.815 -2.466 -5.358 494 HG22 VAL 142 HG22 VAL 142 -1.126 -4.008 -6.161 495 HG23 VAL 142 HG23 VAL 142 -2.471 -2.986 -5.670 496 H GLN 143 HN GLN 143 -2.487 0.221 -8.865 497 HA GLN 143 HA GLN 143 -1.001 0.164 -11.274 498 HB2 GLN 143 HB2 GLN 143 -3.474 0.550 -11.125 499 HB3 GLN 143 HB1 GLN 143 -3.142 2.157 -10.482 500 HG2 GLN 143 HG2 GLN 143 -3.533 2.337 -12.876 501 HG3 GLN 143 HG1 GLN 143 -1.833 2.664 -12.551 502 HE21 GLN 143 HE21 GLN 143 -3.921 -0.195 -13.293 503 HE22 GLN 143 HE22 GLN 143 -2.790 -0.921 -14.330 504 H MET 144 HN MET 144 -1.372 2.545 -8.716 505 HA MET 144 HA MET 144 0.211 4.604 -9.867 506 HB2 MET 144 HB2 MET 144 -1.124 5.424 -8.187 507 HB3 MET 144 HB1 MET 144 -0.971 3.973 -7.206 508 HG2 MET 144 HG2 MET 144 1.015 4.663 -6.245 509 HG3 MET 144 HG1 MET 144 1.435 5.729 -7.589 510 HE1 MET 144 HE1 MET 144 -0.946 6.613 -3.844 511 HE2 MET 144 HE2 MET 144 0.320 5.429 -4.149 512 HE3 MET 144 HE3 MET 144 -1.302 5.158 -4.779 513 H MET 145 HN MET 145 0.966 2.096 -7.439 514 HA MET 145 HA MET 145 3.669 2.784 -7.092 515 HB2 MET 145 HB2 MET 145 2.166 0.213 -6.628 516 HB3 MET 145 HB1 MET 145 3.864 0.427 -6.201 517 HG2 MET 145 HG2 MET 145 3.280 2.328 -4.762 518 HG3 MET 145 HG1 MET 145 1.588 2.160 -5.208 519 HE1 MET 145 HE1 MET 145 2.195 1.466 -1.633 520 HE2 MET 145 HE2 MET 145 0.585 1.137 -2.276 521 HE3 MET 145 HE3 MET 145 1.528 2.484 -2.912 522 H THR 146 HN THR 146 2.133 0.593 -9.442 523 HA THR 146 HA THR 146 4.566 -0.623 -10.254 524 HB THR 146 HB THR 146 3.257 -1.334 -12.254 525 HG1 THR 146 HG1 THR 146 1.664 -0.070 -12.721 526 HG21 THR 146 HG21 THR 146 2.365 -1.723 -9.428 527 HG22 THR 146 HG22 THR 146 3.063 -2.883 -10.553 528 HG23 THR 146 HG23 THR 146 1.373 -2.406 -10.717 529 H ALA 147 HN ALA 147 2.839 2.282 -11.369 530 HA ALA 147 HA ALA 147 4.223 2.725 -13.739 531 HB1 ALA 147 HB1 ALA 147 3.228 4.767 -11.738 532 HB2 ALA 147 HB2 ALA 147 2.287 4.061 -13.053 533 HB3 ALA 147 HB3 ALA 147 3.663 5.105 -13.414 534 H LYS 148 HN LYS 148 6.369 1.971 -13.286 535 HA LYS 148 HA LYS 148 8.137 4.125 -12.469 536 HB2 LYS 148 HB2 LYS 148 7.437 2.099 -10.608 537 HB3 LYS 148 HB1 LYS 148 9.090 1.772 -11.130 538 HG2 LYS 148 HG2 LYS 148 8.112 4.480 -10.173 539 HG3 LYS 148 HG1 LYS 148 8.959 3.314 -9.158 540 HD2 LYS 148 HD2 LYS 148 10.371 3.733 -11.664 541 HD3 LYS 148 HD1 LYS 148 10.141 5.253 -10.800 542 HE2 LYS 148 HE2 LYS 148 11.304 2.721 -9.601 543 HE3 LYS 148 HE1 LYS 148 12.239 4.126 -10.114 544 HZ1 LYS 148 HZ1 LYS 148 10.222 5.079 -8.480 545 HZ2 LYS 148 HZ2 LYS 148 11.880 4.982 -8.121 546 HZ3 LYS 148 HZ3 LYS 148 10.838 3.710 -7.693 547 H PHE 30 HT1 PHE 30 -9.337 -5.561 13.588 548 HA PHE 30 HA PHE 30 -9.085 -3.852 11.204 549 HB2 PHE 30 HB2 PHE 30 -6.751 -5.286 12.504 550 HB3 PHE 30 HB1 PHE 30 -6.716 -4.184 11.131 551 HD1 PHE 30 HD2 PHE 30 -7.825 -1.797 11.612 552 HD2 PHE 30 HD1 PHE 30 -6.172 -4.409 14.597 553 HE1 PHE 30 HE2 PHE 30 -7.535 0.134 13.139 554 HE2 PHE 30 HE1 PHE 30 -5.882 -2.477 16.124 555 HZ PHE 30 HZ PHE 30 -6.564 -0.206 15.396 556 H ASP 31 HN ASP 31 -9.216 -6.861 12.933 557 HA ASP 31 HA ASP 31 -9.499 -9.038 12.268 558 HB2 ASP 31 HB2 ASP 31 -10.569 -7.622 9.815 559 HB3 ASP 31 HB1 ASP 31 -10.675 -9.363 10.068 560 H ILE 32 HN ILE 32 -6.963 -7.835 11.933 561 HA ILE 32 HA ILE 32 -5.908 -9.353 9.627 562 HB ILE 32 HB ILE 32 -5.009 -6.707 10.766 563 HG12 ILE 32 HG12 ILE 32 -5.631 -7.510 7.915 564 HG13 ILE 32 HG11 ILE 32 -6.836 -6.830 9.004 565 HG21 ILE 32 HG21 ILE 32 -3.205 -6.949 8.952 566 HG22 ILE 32 HG22 ILE 32 -3.569 -8.675 8.994 567 HG23 ILE 32 HG23 ILE 32 -2.978 -7.858 10.443 568 HD11 ILE 32 HD11 ILE 32 -5.677 -5.135 7.516 569 HD12 ILE 32 HD12 ILE 32 -4.196 -5.476 8.412 570 HD13 ILE 32 HD13 ILE 32 -5.585 -4.790 9.238 571 H ASP 33 HN ASP 33 -4.406 -10.850 10.070 572 HA ASP 33 HA ASP 33 -3.690 -11.329 12.839 573 HB2 ASP 33 HB2 ASP 33 -4.271 -13.198 11.336 574 HB3 ASP 33 HB1 ASP 33 -2.891 -12.799 10.314 575 H MET 34 HN MET 34 -2.169 -9.996 13.642 576 HA MET 34 HA MET 34 0.071 -9.123 11.999 577 HB2 MET 34 HB2 MET 34 -0.684 -8.531 14.868 578 HB3 MET 34 HB1 MET 34 0.687 -7.811 14.021 579 HG2 MET 34 HG2 MET 34 -0.857 -6.908 12.313 580 HG3 MET 34 HG1 MET 34 -2.220 -7.600 13.186 581 HE1 MET 34 HE1 MET 34 -1.626 -4.120 12.603 582 HE2 MET 34 HE2 MET 34 -2.880 -4.009 13.837 583 HE3 MET 34 HE3 MET 34 -2.931 -5.314 12.654 584 H ASP 35 HN ASP 35 -0.617 -11.764 13.946 585 HA ASP 35 HA ASP 35 1.963 -12.123 15.158 586 HB2 ASP 35 HB2 ASP 35 -0.375 -13.990 14.732 587 HB3 ASP 35 HB1 ASP 35 1.109 -14.472 15.549 588 H ALA 36 HN ALA 36 0.806 -12.454 12.013 589 HA ALA 36 HA ALA 36 2.641 -14.605 11.276 590 HB1 ALA 36 HB1 ALA 36 0.168 -13.951 10.371 591 HB2 ALA 36 HB2 ALA 36 1.337 -14.899 9.453 592 HB3 ALA 36 HB3 ALA 36 1.184 -13.167 9.163 593 HA PRO 37 HA PRO 37 5.763 -11.327 10.470 594 HB2 PRO 37 HB2 PRO 37 7.047 -13.662 9.105 595 HB3 PRO 37 HB1 PRO 37 7.754 -12.483 10.228 596 HG2 PRO 37 HG2 PRO 37 7.175 -14.924 11.040 597 HG3 PRO 37 HG1 PRO 37 6.873 -13.524 12.085 598 HD2 PRO 37 HD2 PRO 37 4.908 -15.171 10.534 599 HD3 PRO 37 HD1 PRO 37 4.734 -14.382 12.119 600 H GLU 38 HN GLU 38 4.214 -13.497 8.226 601 HA GLU 38 HA GLU 38 5.176 -12.501 5.782 602 HB2 GLU 38 HB2 GLU 38 2.516 -13.748 6.516 603 HB3 GLU 38 HB1 GLU 38 2.994 -13.382 4.861 604 HG2 GLU 38 HG2 GLU 38 3.630 -15.630 5.104 605 HG3 GLU 38 HG1 GLU 38 5.134 -14.766 5.402 606 H THR 39 HN THR 39 2.553 -11.408 7.882 607 HA THR 39 HA THR 39 1.392 -9.538 6.129 608 HB THR 39 HB THR 39 1.591 -9.432 9.150 609 HG1 THR 39 HG1 THR 39 -0.255 -10.585 9.111 610 HG21 THR 39 HG21 THR 39 -0.202 -8.008 7.163 611 HG22 THR 39 HG22 THR 39 0.953 -7.265 8.272 612 HG23 THR 39 HG23 THR 39 -0.496 -8.050 8.902 613 H GLU 40 HN GLU 40 4.096 -9.253 8.415 614 HA GLU 40 HA GLU 40 4.515 -6.477 8.182 615 HB2 GLU 40 HB2 GLU 40 6.435 -8.746 8.745 616 HB3 GLU 40 HB1 GLU 40 6.887 -7.045 8.839 617 HG2 GLU 40 HG2 GLU 40 4.555 -8.207 10.369 618 HG3 GLU 40 HG1 GLU 40 6.184 -8.113 11.035 619 H ARG 41 HN ARG 41 5.774 -9.211 6.293 620 HA ARG 41 HA ARG 41 7.506 -7.691 4.653 621 HB2 ARG 41 HB2 ARG 41 6.105 -10.333 4.172 622 HB3 ARG 41 HB1 ARG 41 7.328 -9.663 3.095 623 HG2 ARG 41 HG2 ARG 41 7.934 -9.955 6.027 624 HG3 ARG 41 HG1 ARG 41 8.047 -11.362 4.972 625 HD2 ARG 41 HD2 ARG 41 9.607 -10.118 3.501 626 HD3 ARG 41 HD1 ARG 41 9.524 -8.737 4.586 627 HE ARG 41 HE ARG 41 10.267 -10.994 6.092 628 HH11 ARG 41 HH21 ARG 41 11.432 -8.948 3.556 629 HH12 ARG 41 HH22 ARG 41 13.102 -9.164 3.960 630 HH21 ARG 41 HH11 ARG 41 12.456 -11.283 6.628 631 HH22 ARG 41 HH12 ARG 41 13.681 -10.487 5.699 632 H ALA 42 HN ALA 42 4.102 -8.623 4.318 633 HA ALA 42 HA ALA 42 3.774 -7.559 1.706 634 HB1 ALA 42 HB1 ALA 42 2.090 -9.052 2.397 635 HB2 ALA 42 HB2 ALA 42 1.302 -7.475 2.452 636 HB3 ALA 42 HB3 ALA 42 1.871 -8.227 3.941 637 H ALA 43 HN ALA 43 3.254 -6.240 4.944 638 HA ALA 43 HA ALA 43 2.218 -3.732 4.133 639 HB1 ALA 43 HB1 ALA 43 1.909 -4.637 6.392 640 HB2 ALA 43 HB2 ALA 43 2.657 -3.041 6.443 641 HB3 ALA 43 HB3 ALA 43 3.639 -4.484 6.693 642 H VAL 44 HN VAL 44 5.532 -4.795 4.889 643 HA VAL 44 HA VAL 44 6.664 -2.198 4.792 644 HB VAL 44 HB VAL 44 7.602 -4.530 5.671 645 HG11 VAL 44 HG11 VAL 44 7.751 -5.369 3.267 646 HG12 VAL 44 HG12 VAL 44 9.199 -5.546 4.244 647 HG13 VAL 44 HG13 VAL 44 9.089 -4.245 3.059 648 HG21 VAL 44 HG21 VAL 44 9.001 -2.070 4.685 649 HG22 VAL 44 HG22 VAL 44 9.966 -3.419 5.283 650 HG23 VAL 44 HG23 VAL 44 8.782 -2.649 6.338 651 H ALA 45 HN ALA 45 6.146 -4.663 2.309 652 HA ALA 45 HA ALA 45 7.673 -3.446 0.262 653 HB1 ALA 45 HB1 ALA 45 5.221 -5.206 0.042 654 HB2 ALA 45 HB2 ALA 45 6.892 -5.764 0.120 655 HB3 ALA 45 HB3 ALA 45 6.337 -4.835 -1.272 656 H ILE 46 HN ILE 46 4.254 -3.119 1.162 657 HA ILE 46 HA ILE 46 3.474 -1.450 -0.976 658 HB ILE 46 HB ILE 46 2.416 -1.700 1.851 659 HG12 ILE 46 HG12 ILE 46 1.324 -2.787 -0.758 660 HG13 ILE 46 HG11 ILE 46 2.379 -3.718 0.306 661 HG21 ILE 46 HG21 ILE 46 1.678 0.439 0.926 662 HG22 ILE 46 HG22 ILE 46 0.333 -0.699 0.876 663 HG23 ILE 46 HG23 ILE 46 1.237 -0.347 -0.590 664 HD11 ILE 46 HD11 ILE 46 0.139 -4.313 0.905 665 HD12 ILE 46 HD12 ILE 46 -0.371 -2.624 0.928 666 HD13 ILE 46 HD13 ILE 46 0.720 -3.234 2.172 667 H GLN 47 HN GLN 47 4.607 -0.724 2.293 668 HA GLN 47 HA GLN 47 4.452 2.088 2.150 669 HB2 GLN 47 HB2 GLN 47 6.095 0.195 3.828 670 HB3 GLN 47 HB1 GLN 47 6.114 1.944 4.060 671 HG2 GLN 47 HG2 GLN 47 3.762 1.991 4.541 672 HG3 GLN 47 HG1 GLN 47 3.562 0.317 4.027 673 HE21 GLN 47 HE21 GLN 47 3.673 2.127 6.781 674 HE22 GLN 47 HE22 GLN 47 4.325 0.982 7.851 675 H SER 48 HN SER 48 7.067 -0.174 1.358 676 HA SER 48 HA SER 48 9.083 1.756 0.929 677 HB2 SER 48 HB2 SER 48 10.243 -0.018 -0.293 678 HB3 SER 48 HB1 SER 48 9.521 -0.667 1.177 679 HG SER 48 HG SER 48 9.153 -1.505 -1.268 680 H GLN 49 HN GLN 49 6.630 0.368 -1.200 681 HA GLN 49 HA GLN 49 7.578 1.519 -3.608 682 HB2 GLN 49 HB2 GLN 49 4.851 0.523 -2.783 683 HB3 GLN 49 HB1 GLN 49 5.219 1.097 -4.408 684 HG2 GLN 49 HG2 GLN 49 6.731 -1.125 -3.013 685 HG3 GLN 49 HG1 GLN 49 5.425 -1.387 -4.162 686 HE21 GLN 49 HE21 GLN 49 8.601 -1.711 -4.152 687 HE22 GLN 49 HE22 GLN 49 9.014 -1.110 -5.685 688 H PHE 50 HN PHE 50 5.314 2.686 -1.142 689 HA PHE 50 HA PHE 50 4.315 4.879 -2.563 690 HB2 PHE 50 HB2 PHE 50 3.240 4.245 -0.511 691 HB3 PHE 50 HB1 PHE 50 4.724 4.491 0.408 692 HD1 PHE 50 HD1 PHE 50 2.742 6.488 -2.105 693 HD2 PHE 50 HD2 PHE 50 4.689 6.416 1.734 694 HE1 PHE 50 HE1 PHE 50 2.147 8.867 -1.758 695 HE2 PHE 50 HE2 PHE 50 4.097 8.804 2.067 696 HZ PHE 50 HZ PHE 50 2.828 10.032 0.322 697 H ARG 51 HN ARG 51 7.137 4.697 -0.379 698 HA ARG 51 HA ARG 51 7.904 7.394 -0.620 699 HB2 ARG 51 HB2 ARG 51 9.564 4.908 -0.136 700 HB3 ARG 51 HB1 ARG 51 10.128 6.564 0.117 701 HG2 ARG 51 HG2 ARG 51 8.186 6.910 1.672 702 HG3 ARG 51 HG1 ARG 51 7.830 5.189 1.524 703 HD2 ARG 51 HD2 ARG 51 10.156 4.702 2.314 704 HD3 ARG 51 HD1 ARG 51 10.373 6.426 2.593 705 HE ARG 51 HE ARG 51 8.840 6.306 4.373 706 HH11 ARG 51 HH21 ARG 51 9.198 3.281 2.717 707 HH12 ARG 51 HH22 ARG 51 8.433 2.360 3.965 708 HH21 ARG 51 HH11 ARG 51 7.836 5.098 6.001 709 HH22 ARG 51 HH12 ARG 51 7.660 3.386 5.818 710 H LYS 52 HN LYS 52 8.718 4.532 -2.550 711 HA LYS 52 HA LYS 52 10.665 5.760 -4.197 712 HB2 LYS 52 HB2 LYS 52 9.075 3.261 -4.240 713 HB3 LYS 52 HB1 LYS 52 9.638 3.828 -5.810 714 HG2 LYS 52 HG2 LYS 52 11.316 2.342 -4.886 715 HG3 LYS 52 HG1 LYS 52 11.962 3.979 -4.858 716 HD2 LYS 52 HD2 LYS 52 11.013 4.073 -2.434 717 HD3 LYS 52 HD1 LYS 52 10.935 2.317 -2.561 718 HE2 LYS 52 HE2 LYS 52 13.421 3.992 -3.016 719 HE3 LYS 52 HE1 LYS 52 13.075 3.058 -1.560 720 HZ1 LYS 52 HZ1 LYS 52 14.115 1.408 -2.612 721 HZ2 LYS 52 HZ2 LYS 52 14.022 2.174 -4.125 722 HZ3 LYS 52 HZ3 LYS 52 12.710 1.260 -3.550 723 H PHE 53 HN PHE 53 7.158 5.396 -4.517 724 HA PHE 53 HA PHE 53 6.888 6.396 -7.130 725 HB2 PHE 53 HB2 PHE 53 5.065 5.268 -5.896 726 HB3 PHE 53 HB1 PHE 53 4.948 6.660 -4.818 727 HD1 PHE 53 HD1 PHE 53 4.455 5.474 -8.288 728 HD2 PHE 53 HD2 PHE 53 3.941 8.737 -5.542 729 HE1 PHE 53 HE1 PHE 53 2.960 6.604 -9.915 730 HE2 PHE 53 HE2 PHE 53 2.449 9.870 -7.169 731 HZ PHE 53 HZ PHE 53 1.962 8.805 -9.355 732 H GLN 54 HN GLN 54 6.788 8.049 -3.987 733 HA GLN 54 HA GLN 54 6.287 10.647 -4.962 734 HB2 GLN 54 HB2 GLN 54 7.687 9.679 -2.457 735 HB3 GLN 54 HB1 GLN 54 7.291 11.369 -2.761 736 HG2 GLN 54 HG2 GLN 54 5.274 9.106 -2.702 737 HG3 GLN 54 HG1 GLN 54 5.571 10.219 -1.370 738 HE21 GLN 54 HE21 GLN 54 5.497 12.691 -2.252 739 HE22 GLN 54 HE22 GLN 54 4.146 13.034 -3.220 740 H LYS 55 HN LYS 55 9.298 8.876 -4.387 741 HA LYS 55 HA LYS 55 11.094 10.997 -4.815 742 HB2 LYS 55 HB2 LYS 55 11.762 8.823 -3.862 743 HB3 LYS 55 HB1 LYS 55 11.467 8.052 -5.419 744 HG2 LYS 55 HG2 LYS 55 13.199 9.450 -6.463 745 HG3 LYS 55 HG1 LYS 55 13.469 10.280 -4.930 746 HD2 LYS 55 HD2 LYS 55 14.177 8.175 -3.891 747 HD3 LYS 55 HD1 LYS 55 13.849 7.306 -5.390 748 HE2 LYS 55 HE2 LYS 55 16.245 7.800 -5.220 749 HE3 LYS 55 HE1 LYS 55 15.534 8.711 -6.553 750 HZ1 LYS 55 HZ1 LYS 55 15.526 10.669 -5.297 751 HZ2 LYS 55 HZ2 LYS 55 17.045 9.970 -4.990 752 HZ3 LYS 55 HZ3 LYS 55 15.802 9.852 -3.837 753 H LYS 56 HN LYS 56 9.666 8.657 -7.077 754 HA LYS 56 HA LYS 56 11.050 9.490 -9.378 755 HB2 LYS 56 HB2 LYS 56 9.761 7.394 -9.261 756 HB3 LYS 56 HB1 LYS 56 8.265 8.316 -9.146 757 HG2 LYS 56 HG2 LYS 56 8.607 7.553 -11.451 758 HG3 LYS 56 HG1 LYS 56 8.724 9.308 -11.382 759 HD2 LYS 56 HD2 LYS 56 11.052 9.294 -11.666 760 HD3 LYS 56 HD1 LYS 56 11.206 7.627 -11.108 761 HE2 LYS 56 HE2 LYS 56 11.516 7.753 -13.544 762 HE3 LYS 56 HE1 LYS 56 10.049 6.853 -13.160 763 HZ1 LYS 56 HZ1 LYS 56 10.231 9.022 -14.810 764 HZ2 LYS 56 HZ2 LYS 56 9.565 9.657 -13.383 765 HZ3 LYS 56 HZ3 LYS 56 8.802 8.363 -14.178 766 H LYS 57 HN LYS 57 7.963 10.548 -7.986 767 HA LYS 57 HA LYS 57 7.215 12.340 -10.020 768 HB2 LYS 57 HB2 LYS 57 5.679 11.606 -8.243 769 HB3 LYS 57 HB1 LYS 57 6.639 12.488 -7.056 770 HG2 LYS 57 HG2 LYS 57 6.110 14.600 -8.066 771 HG3 LYS 57 HG1 LYS 57 5.401 13.817 -9.476 772 HD2 LYS 57 HD2 LYS 57 3.570 14.542 -8.104 773 HD3 LYS 57 HD1 LYS 57 3.682 12.794 -7.911 774 HE2 LYS 57 HE2 LYS 57 4.819 13.040 -5.784 775 HE3 LYS 57 HE1 LYS 57 4.944 14.786 -6.003 776 HZ1 LYS 57 HZ1 LYS 57 2.267 14.063 -6.310 777 HZ2 LYS 57 HZ2 LYS 57 2.965 14.992 -5.071 778 HZ3 LYS 57 HZ3 LYS 57 2.831 13.306 -4.901 779 H ALA 58 HN ALA 58 9.135 12.825 -7.073 780 HA ALA 58 HA ALA 58 9.494 15.608 -7.318 781 HB1 ALA 58 HB1 ALA 58 11.078 13.428 -5.972 782 HB2 ALA 58 HB2 ALA 58 10.076 14.678 -5.234 783 HB3 ALA 58 HB3 ALA 58 11.628 15.103 -5.955 784 H GLY 59 HN GLY 59 11.295 12.872 -8.637 785 HA2 GLY 59 HA2 GLY 59 13.445 14.397 -9.718 786 HA3 GLY 59 HA1 GLY 59 13.017 12.748 -10.161 787 H SER 60 HN SER 60 10.199 14.159 -10.622 788 HA SER 60 HA SER 60 10.831 15.159 -13.337 789 HB2 SER 60 HB2 SER 60 8.816 14.043 -14.161 790 HB3 SER 60 HB1 SER 60 9.915 12.869 -13.442 791 HG SER 60 HG SER 60 8.642 13.186 -11.473 792 H GLN 61 HN GLN 61 9.231 16.602 -14.243 793 HA GLN 61 HA GLN 61 7.929 18.490 -14.144 794 HB2 GLN 61 HB2 GLN 61 6.231 16.779 -13.464 795 HB3 GLN 61 HB1 GLN 61 6.630 17.119 -11.780 796 HG2 GLN 61 HG2 GLN 61 5.980 19.458 -12.060 797 HG3 GLN 61 HG1 GLN 61 5.670 19.191 -13.775 798 HE21 GLN 61 HE21 GLN 61 3.483 20.132 -12.545 799 HE22 GLN 61 HE22 GLN 61 2.363 18.908 -12.187 800 H SER 62 HN SER 62 9.999 19.513 -13.427 801 HA SER 62 HA SER 62 9.961 20.347 -10.603 802 HB2 SER 62 HB2 SER 62 12.199 20.279 -10.722 803 HB3 SER 62 HB1 SER 62 12.042 19.610 -12.344 804 HG SER 62 HG SER 62 12.908 22.033 -11.576 Start of MODEL 7 1 H1 MET 76 HT1 MET 76 -1.369 -13.250 -18.351 2 H2 MET 76 HT2 MET 76 -1.522 -11.562 -18.479 3 H3 MET 76 HT3 MET 76 -0.268 -12.237 -17.550 4 HA MET 76 HA MET 76 -0.550 -12.602 -20.480 5 HB2 MET 76 HB2 MET 76 -0.040 -10.219 -19.489 6 HB3 MET 76 HB1 MET 76 1.550 -10.906 -19.157 7 HG2 MET 76 HG2 MET 76 1.668 -9.878 -21.330 8 HG3 MET 76 HG1 MET 76 1.640 -11.622 -21.585 9 HE1 MET 76 HE1 MET 76 0.886 -9.614 -24.011 10 HE2 MET 76 HE2 MET 76 -0.321 -10.727 -24.652 11 HE3 MET 76 HE3 MET 76 1.145 -11.361 -23.908 12 H LYS 77 HN LYS 77 0.839 -13.416 -17.443 13 HA LYS 77 HA LYS 77 2.477 -14.901 -16.807 14 HB2 LYS 77 HB2 LYS 77 1.813 -16.061 -19.525 15 HB3 LYS 77 HB1 LYS 77 2.746 -16.883 -18.275 16 HG2 LYS 77 HG2 LYS 77 0.828 -16.726 -16.731 17 HG3 LYS 77 HG1 LYS 77 -0.110 -15.908 -17.982 18 HD2 LYS 77 HD2 LYS 77 0.110 -17.886 -19.444 19 HD3 LYS 77 HD1 LYS 77 1.038 -18.707 -18.189 20 HE2 LYS 77 HE2 LYS 77 -0.885 -18.553 -16.655 21 HE3 LYS 77 HE1 LYS 77 -1.816 -17.723 -17.901 22 HZ1 LYS 77 HZ1 LYS 77 -1.900 -19.615 -19.214 23 HZ2 LYS 77 HZ2 LYS 77 -2.110 -20.235 -17.646 24 HZ3 LYS 77 HZ3 LYS 77 -0.602 -20.361 -18.420 25 H ASP 78 HN ASP 78 3.369 -12.481 -17.964 26 HA ASP 78 HA ASP 78 5.703 -13.290 -19.573 27 HB2 ASP 78 HB2 ASP 78 5.924 -10.924 -20.130 28 HB3 ASP 78 HB1 ASP 78 4.289 -11.479 -20.486 29 H THR 79 HN THR 79 5.111 -13.297 -16.477 30 HA THR 79 HA THR 79 6.471 -13.211 -14.626 31 HB THR 79 HB THR 79 8.722 -12.004 -16.202 32 HG1 THR 79 HG1 THR 79 8.587 -13.594 -17.543 33 HG21 THR 79 HG21 THR 79 10.061 -13.131 -14.649 34 HG22 THR 79 HG22 THR 79 8.805 -14.312 -14.278 35 HG23 THR 79 HG23 THR 79 8.668 -12.661 -13.675 36 H ASP 80 HN ASP 80 4.906 -11.524 -14.076 37 HA ASP 80 HA ASP 80 6.073 -8.807 -14.125 38 HB2 ASP 80 HB2 ASP 80 3.207 -9.746 -13.980 39 HB3 ASP 80 HB1 ASP 80 3.691 -8.082 -13.660 40 H SER 81 HN SER 81 6.316 -7.685 -12.262 41 HA SER 81 HA SER 81 6.304 -9.185 -9.782 42 HB2 SER 81 HB2 SER 81 7.399 -7.251 -8.833 43 HB3 SER 81 HB1 SER 81 8.128 -7.577 -10.403 44 HG SER 81 HG SER 81 7.412 -5.723 -11.078 45 H GLU 82 HN GLU 82 4.025 -7.458 -11.471 46 HA GLU 82 HA GLU 82 2.718 -5.894 -9.586 47 HB2 GLU 82 HB2 GLU 82 2.111 -5.992 -11.984 48 HB3 GLU 82 HB1 GLU 82 1.458 -7.612 -11.737 49 HG2 GLU 82 HG2 GLU 82 -0.179 -6.731 -10.136 50 HG3 GLU 82 HG1 GLU 82 0.501 -5.117 -10.314 51 H GLU 83 HN GLU 83 2.562 -9.352 -10.160 52 HA GLU 83 HA GLU 83 0.463 -9.963 -8.362 53 HB2 GLU 83 HB2 GLU 83 1.263 -12.249 -8.530 54 HB3 GLU 83 HB1 GLU 83 1.366 -11.495 -10.121 55 HG2 GLU 83 HG2 GLU 83 3.791 -10.934 -9.580 56 HG3 GLU 83 HG1 GLU 83 3.628 -11.965 -8.160 57 H GLU 84 HN GLU 84 3.961 -9.599 -7.952 58 HA GLU 84 HA GLU 84 4.179 -10.672 -5.354 59 HB2 GLU 84 HB2 GLU 84 6.119 -10.214 -6.819 60 HB3 GLU 84 HB1 GLU 84 5.838 -8.484 -6.636 61 HG2 GLU 84 HG2 GLU 84 6.203 -8.648 -4.218 62 HG3 GLU 84 HG1 GLU 84 6.410 -10.394 -4.352 63 H ILE 85 HN ILE 85 3.674 -7.327 -6.455 64 HA ILE 85 HA ILE 85 3.551 -6.193 -3.855 65 HB ILE 85 HB ILE 85 2.435 -5.220 -6.502 66 HG12 ILE 85 HG12 ILE 85 5.015 -5.516 -6.009 67 HG13 ILE 85 HG11 ILE 85 4.431 -4.042 -6.777 68 HG21 ILE 85 HG21 ILE 85 2.556 -2.972 -5.208 69 HG22 ILE 85 HG22 ILE 85 2.569 -3.974 -3.755 70 HG23 ILE 85 HG23 ILE 85 1.202 -4.048 -4.866 71 HD11 ILE 85 HD11 ILE 85 4.660 -4.216 -3.772 72 HD12 ILE 85 HD12 ILE 85 4.620 -2.786 -4.796 73 HD13 ILE 85 HD13 ILE 85 6.057 -3.808 -4.766 74 H ARG 86 HN ARG 86 1.179 -7.508 -6.074 75 HA ARG 86 HA ARG 86 -1.192 -6.766 -4.793 76 HB2 ARG 86 HB2 ARG 86 -1.105 -7.725 -7.041 77 HB3 ARG 86 HB1 ARG 86 -0.535 -9.254 -6.379 78 HG2 ARG 86 HG2 ARG 86 -2.614 -9.594 -5.193 79 HG3 ARG 86 HG1 ARG 86 -3.179 -7.980 -5.635 80 HD2 ARG 86 HD2 ARG 86 -2.451 -10.084 -7.682 81 HD3 ARG 86 HD1 ARG 86 -4.091 -9.880 -7.063 82 HE ARG 86 HE ARG 86 -3.170 -7.374 -7.949 83 HH11 ARG 86 HH21 ARG 86 -3.966 -10.518 -9.160 84 HH12 ARG 86 HH22 ARG 86 -4.462 -9.944 -10.717 85 HH21 ARG 86 HH11 ARG 86 -3.821 -6.615 -9.988 86 HH22 ARG 86 HH12 ARG 86 -4.379 -7.735 -11.186 87 H GLU 87 HN GLU 87 0.957 -9.518 -4.266 88 HA GLU 87 HA GLU 87 -0.647 -11.001 -2.509 89 HB2 GLU 87 HB2 GLU 87 1.477 -11.829 -3.479 90 HB3 GLU 87 HB1 GLU 87 2.368 -10.702 -2.456 91 HG2 GLU 87 HG2 GLU 87 1.480 -11.786 -0.444 92 HG3 GLU 87 HG1 GLU 87 0.519 -12.880 -1.437 93 H ALA 88 HN ALA 88 1.545 -8.295 -1.926 94 HA ALA 88 HA ALA 88 1.447 -8.302 0.890 95 HB1 ALA 88 HB1 ALA 88 2.822 -6.543 0.661 96 HB2 ALA 88 HB2 ALA 88 1.614 -5.631 -0.244 97 HB3 ALA 88 HB3 ALA 88 2.675 -6.764 -1.082 98 H PHE 89 HN PHE 89 -0.695 -6.815 -1.527 99 HA PHE 89 HA PHE 89 -2.251 -5.409 0.446 100 HB2 PHE 89 HB2 PHE 89 -2.599 -5.964 -2.489 101 HB3 PHE 89 HB1 PHE 89 -3.887 -5.222 -1.536 102 HD1 PHE 89 HD2 PHE 89 -3.487 -3.064 -0.352 103 HD2 PHE 89 HD1 PHE 89 -0.606 -4.740 -3.059 104 HE1 PHE 89 HE2 PHE 89 -2.339 -0.870 -0.487 105 HE2 PHE 89 HE1 PHE 89 0.548 -2.547 -3.192 106 HZ PHE 89 HZ PHE 89 -0.322 -0.612 -1.906 107 H ARG 90 HN ARG 90 -2.607 -8.398 -1.395 108 HA ARG 90 HA ARG 90 -5.155 -9.144 -0.711 109 HB2 ARG 90 HB2 ARG 90 -2.692 -10.835 -1.079 110 HB3 ARG 90 HB1 ARG 90 -4.272 -11.551 -0.760 111 HG2 ARG 90 HG2 ARG 90 -5.207 -10.396 -2.723 112 HG3 ARG 90 HG1 ARG 90 -3.641 -9.653 -3.041 113 HD2 ARG 90 HD2 ARG 90 -2.636 -11.873 -3.363 114 HD3 ARG 90 HD1 ARG 90 -4.184 -12.634 -3.009 115 HE ARG 90 HE ARG 90 -3.436 -11.284 -5.476 116 HH11 ARG 90 HH21 ARG 90 -5.941 -12.510 -3.428 117 HH12 ARG 90 HH22 ARG 90 -7.109 -12.641 -4.700 118 HH21 ARG 90 HH11 ARG 90 -4.965 -11.454 -7.151 119 HH22 ARG 90 HH12 ARG 90 -6.556 -12.043 -6.807 120 H VAL 91 HN VAL 91 -2.394 -8.958 1.370 121 HA VAL 91 HA VAL 91 -3.264 -10.658 3.453 122 HB VAL 91 HB VAL 91 -1.480 -8.216 3.459 123 HG11 VAL 91 HG11 VAL 91 -0.830 -9.587 5.714 124 HG12 VAL 91 HG12 VAL 91 -2.563 -9.885 5.669 125 HG13 VAL 91 HG13 VAL 91 -1.954 -8.230 5.706 126 HG21 VAL 91 HG21 VAL 91 -0.930 -10.527 2.311 127 HG22 VAL 91 HG22 VAL 91 -0.658 -11.060 3.970 128 HG23 VAL 91 HG23 VAL 91 0.290 -9.728 3.305 129 H PHE 92 HN PHE 92 -3.906 -7.244 2.738 130 HA PHE 92 HA PHE 92 -5.445 -6.890 5.173 131 HB2 PHE 92 HB2 PHE 92 -5.260 -5.068 2.769 132 HB3 PHE 92 HB1 PHE 92 -5.846 -4.638 4.371 133 HD1 PHE 92 HD2 PHE 92 -4.033 -5.436 6.317 134 HD2 PHE 92 HD1 PHE 92 -3.123 -4.308 2.280 135 HE1 PHE 92 HE2 PHE 92 -1.719 -4.886 6.995 136 HE2 PHE 92 HE1 PHE 92 -0.810 -3.761 2.960 137 HZ PHE 92 HZ PHE 92 -0.104 -4.047 5.314 138 H ASP 93 HN ASP 93 -6.025 -8.003 1.977 139 HA ASP 93 HA ASP 93 -8.918 -7.478 2.150 140 HB2 ASP 93 HB2 ASP 93 -7.727 -7.047 0.004 141 HB3 ASP 93 HB1 ASP 93 -7.335 -8.760 -0.081 142 H LYS 94 HN LYS 94 -9.677 -8.998 3.705 143 HA LYS 94 HA LYS 94 -8.757 -11.713 3.676 144 HB2 LYS 94 HB2 LYS 94 -10.336 -12.024 5.492 145 HB3 LYS 94 HB1 LYS 94 -9.390 -10.560 5.741 146 HG2 LYS 94 HG2 LYS 94 -11.252 -9.213 4.827 147 HG3 LYS 94 HG1 LYS 94 -12.205 -10.684 4.620 148 HD2 LYS 94 HD2 LYS 94 -12.064 -11.122 7.045 149 HD3 LYS 94 HD1 LYS 94 -11.125 -9.644 7.254 150 HE2 LYS 94 HE2 LYS 94 -13.009 -8.314 6.380 151 HE3 LYS 94 HE1 LYS 94 -13.950 -9.790 6.158 152 HZ1 LYS 94 HZ1 LYS 94 -13.116 -9.953 8.732 153 HZ2 LYS 94 HZ2 LYS 94 -14.651 -9.432 8.226 154 HZ3 LYS 94 HZ3 LYS 94 -13.430 -8.297 8.553 155 H ASP 95 HN ASP 95 -11.336 -10.051 2.080 156 HA ASP 95 HA ASP 95 -12.687 -12.617 1.518 157 HB2 ASP 95 HB2 ASP 95 -14.595 -11.253 0.773 158 HB3 ASP 95 HB1 ASP 95 -14.152 -10.880 2.437 159 H GLY 96 HN GLY 96 -10.309 -10.904 0.347 160 HA2 GLY 96 HA2 GLY 96 -9.394 -10.479 -1.783 161 HA3 GLY 96 HA1 GLY 96 -10.048 -12.078 -2.125 162 H ASN 97 HN ASN 97 -11.772 -9.061 -1.392 163 HA ASN 97 HA ASN 97 -13.442 -9.467 -3.758 164 HB2 ASN 97 HB2 ASN 97 -14.317 -8.858 -1.428 165 HB3 ASN 97 HB1 ASN 97 -13.703 -7.238 -1.748 166 HD21 ASN 97 HD21 ASN 97 -15.876 -6.332 -1.843 167 HD22 ASN 97 HD22 ASN 97 -16.905 -6.648 -3.155 168 H GLY 98 HN GLY 98 -10.573 -8.003 -3.143 169 HA2 GLY 98 HA2 GLY 98 -9.359 -6.775 -4.765 170 HA3 GLY 98 HA1 GLY 98 -10.881 -6.244 -5.466 171 H TYR 99 HN TYR 99 -11.086 -5.933 -2.125 172 HA TYR 99 HA TYR 99 -9.969 -3.209 -2.137 173 HB2 TYR 99 HB2 TYR 99 -12.706 -3.886 -1.049 174 HB3 TYR 99 HB1 TYR 99 -11.945 -2.297 -1.134 175 HD1 TYR 99 HD1 TYR 99 -13.030 -5.136 -3.298 176 HD2 TYR 99 HD2 TYR 99 -12.297 -0.919 -2.987 177 HE1 TYR 99 HE1 TYR 99 -13.951 -4.815 -5.577 178 HE2 TYR 99 HE2 TYR 99 -13.216 -0.594 -5.274 179 HH TYR 99 HH TYR 99 -14.409 -3.364 -7.185 180 H ILE 100 HN ILE 100 -9.636 -2.336 0.014 181 HA ILE 100 HA ILE 100 -9.631 -4.340 2.179 182 HB ILE 100 HB ILE 100 -7.400 -4.016 2.717 183 HG12 ILE 100 HG12 ILE 100 -7.715 -1.305 1.433 184 HG13 ILE 100 HG11 ILE 100 -7.421 -1.650 3.135 185 HG21 ILE 100 HG21 ILE 100 -6.107 -4.227 0.762 186 HG22 ILE 100 HG22 ILE 100 -7.126 -3.098 -0.135 187 HG23 ILE 100 HG23 ILE 100 -7.713 -4.729 0.229 188 HD11 ILE 100 HD11 ILE 100 -5.518 -1.854 0.815 189 HD12 ILE 100 HD12 ILE 100 -5.245 -2.788 2.286 190 HD13 ILE 100 HD13 ILE 100 -5.303 -1.028 2.357 191 H SER 101 HN SER 101 -9.852 -3.336 4.311 192 HA SER 101 HA SER 101 -11.572 -1.092 4.289 193 HB2 SER 101 HB2 SER 101 -11.618 -2.718 6.111 194 HB3 SER 101 HB1 SER 101 -9.969 -2.295 6.566 195 HG SER 101 HG SER 101 -11.563 -1.202 7.822 196 H ALA 102 HN ALA 102 -11.137 1.017 4.188 197 HA ALA 102 HA ALA 102 -8.546 2.027 3.803 198 HB1 ALA 102 HB1 ALA 102 -10.714 3.821 4.815 199 HB2 ALA 102 HB2 ALA 102 -10.921 3.041 3.248 200 HB3 ALA 102 HB3 ALA 102 -9.539 4.095 3.529 201 H ALA 103 HN ALA 103 -10.525 1.770 6.709 202 HA ALA 103 HA ALA 103 -9.080 3.484 8.381 203 HB1 ALA 103 HB1 ALA 103 -10.974 2.826 9.452 204 HB2 ALA 103 HB2 ALA 103 -9.890 1.622 10.148 205 HB3 ALA 103 HB3 ALA 103 -10.918 1.197 8.780 206 H GLU 104 HN GLU 104 -8.593 -0.079 7.974 207 HA GLU 104 HA GLU 104 -6.460 -0.246 9.780 208 HB2 GLU 104 HB2 GLU 104 -6.182 -2.415 9.030 209 HB3 GLU 104 HB1 GLU 104 -7.835 -2.096 8.511 210 HG2 GLU 104 HG2 GLU 104 -6.765 -1.275 6.304 211 HG3 GLU 104 HG1 GLU 104 -5.324 -2.121 6.851 212 H LEU 105 HN LEU 105 -6.570 0.852 6.472 213 HA LEU 105 HA LEU 105 -3.833 0.588 5.830 214 HB2 LEU 105 HB2 LEU 105 -5.716 1.222 4.237 215 HB3 LEU 105 HB1 LEU 105 -5.655 2.837 4.936 216 HG LEU 105 HG LEU 105 -3.132 2.781 4.369 217 HD11 LEU 105 HD11 LEU 105 -3.747 0.173 3.595 218 HD12 LEU 105 HD12 LEU 105 -2.289 1.059 3.165 219 HD13 LEU 105 HD13 LEU 105 -3.668 1.051 2.071 220 HD21 LEU 105 HD21 LEU 105 -3.775 3.229 1.855 221 HD22 LEU 105 HD22 LEU 105 -4.385 4.297 3.118 222 HD23 LEU 105 HD23 LEU 105 -5.426 3.041 2.448 223 H ARG 106 HN ARG 106 -5.638 3.351 7.152 224 HA ARG 106 HA ARG 106 -3.514 5.110 7.520 225 HB2 ARG 106 HB2 ARG 106 -5.767 5.876 7.835 226 HB3 ARG 106 HB1 ARG 106 -6.056 4.706 9.115 227 HG2 ARG 106 HG2 ARG 106 -5.711 6.968 10.031 228 HG3 ARG 106 HG1 ARG 106 -4.437 5.884 10.566 229 HD2 ARG 106 HD2 ARG 106 -2.905 6.793 8.955 230 HD3 ARG 106 HD1 ARG 106 -4.185 7.738 8.197 231 HE ARG 106 HE ARG 106 -2.786 8.350 10.676 232 HH11 ARG 106 HH21 ARG 106 -5.513 8.890 8.615 233 HH12 ARG 106 HH22 ARG 106 -5.884 10.444 9.282 234 HH21 ARG 106 HH11 ARG 106 -3.266 10.390 11.555 235 HH22 ARG 106 HH12 ARG 106 -4.613 11.293 10.947 236 H HIS 107 HN HIS 107 -4.841 2.761 9.897 237 HA HIS 107 HA HIS 107 -2.913 3.231 11.884 238 HB2 HIS 107 HB2 HIS 107 -4.938 2.101 12.444 239 HB3 HIS 107 HB1 HIS 107 -4.650 0.851 11.234 240 HD1 HIS 107 HD1 HIS 107 -2.999 2.195 14.405 241 HD2 HIS 107 HD2 HIS 107 -3.330 -1.346 12.224 242 HE1 HIS 107 HE1 HIS 107 -1.819 0.407 15.760 243 HE2 HIS 107 HE2 HIS 107 -2.012 -1.757 14.445 244 H VAL 108 HN VAL 108 -3.063 0.732 9.370 245 HA VAL 108 HA VAL 108 -0.725 -0.648 10.059 246 HB VAL 108 HB VAL 108 -2.198 -0.368 7.441 247 HG11 VAL 108 HG11 VAL 108 -0.013 -1.009 6.779 248 HG12 VAL 108 HG12 VAL 108 -0.896 -2.528 6.921 249 HG13 VAL 108 HG13 VAL 108 0.204 -2.027 8.201 250 HG21 VAL 108 HG21 VAL 108 -2.016 -2.834 9.138 251 HG22 VAL 108 HG22 VAL 108 -3.319 -2.306 8.073 252 HG23 VAL 108 HG23 VAL 108 -3.097 -1.535 9.644 253 H MET 109 HN MET 109 -1.182 2.032 7.768 254 HA MET 109 HA MET 109 1.488 2.006 6.784 255 HB2 MET 109 HB2 MET 109 -0.824 3.862 6.627 256 HB3 MET 109 HB1 MET 109 0.773 4.561 6.356 257 HG2 MET 109 HG2 MET 109 -0.428 3.639 4.289 258 HG3 MET 109 HG1 MET 109 1.231 3.098 4.545 259 HE1 MET 109 HE1 MET 109 -0.002 1.496 2.613 260 HE2 MET 109 HE2 MET 109 0.026 -0.177 3.165 261 HE3 MET 109 HE3 MET 109 1.424 0.859 3.442 262 H THR 110 HN THR 110 0.018 3.488 9.612 263 HA THR 110 HA THR 110 2.532 4.931 10.137 264 HB THR 110 HB THR 110 1.245 6.263 11.699 265 HG1 THR 110 HG1 THR 110 -0.708 5.682 12.334 266 HG21 THR 110 HG21 THR 110 0.337 7.495 10.045 267 HG22 THR 110 HG22 THR 110 -0.740 6.189 9.548 268 HG23 THR 110 HG23 THR 110 0.926 6.224 8.971 269 H ASN 111 HN ASN 111 1.021 2.037 10.972 270 HA ASN 111 HA ASN 111 2.271 2.012 13.655 271 HB2 ASN 111 HB2 ASN 111 -0.142 1.483 13.597 272 HB3 ASN 111 HB1 ASN 111 0.195 0.139 12.504 273 HD21 ASN 111 HD21 ASN 111 0.772 1.310 15.830 274 HD22 ASN 111 HD22 ASN 111 1.140 -0.219 16.468 275 H LEU 112 HN LEU 112 1.910 0.051 10.705 276 HA LEU 112 HA LEU 112 4.199 -1.594 11.578 277 HB2 LEU 112 HB2 LEU 112 2.222 -2.113 9.353 278 HB3 LEU 112 HB1 LEU 112 3.443 -3.230 9.951 279 HG LEU 112 HG LEU 112 1.119 -2.132 11.567 280 HD11 LEU 112 HD11 LEU 112 1.190 -4.197 9.662 281 HD12 LEU 112 HD12 LEU 112 -0.069 -3.913 10.865 282 HD13 LEU 112 HD13 LEU 112 1.262 -5.011 11.226 283 HD21 LEU 112 HD21 LEU 112 1.976 -4.128 13.063 284 HD22 LEU 112 HD22 LEU 112 2.776 -2.558 13.162 285 HD23 LEU 112 HD23 LEU 112 3.496 -3.858 12.212 286 H GLY 113 HN GLY 113 5.298 -2.555 9.506 287 HA2 GLY 113 HA2 GLY 113 6.746 -2.238 7.757 288 HA3 GLY 113 HA1 GLY 113 5.662 -0.974 7.204 289 H GLU 114 HN GLU 114 6.686 0.845 6.888 290 HA GLU 114 HA GLU 114 9.080 1.479 8.461 291 HB2 GLU 114 HB2 GLU 114 8.027 2.612 5.867 292 HB3 GLU 114 HB1 GLU 114 9.459 3.222 6.696 293 HG2 GLU 114 HG2 GLU 114 10.523 1.023 6.538 294 HG3 GLU 114 HG1 GLU 114 9.078 0.358 5.779 295 H LYS 115 HN LYS 115 6.154 1.869 9.215 296 HA LYS 115 HA LYS 115 4.811 3.450 10.212 297 HB2 LYS 115 HB2 LYS 115 7.598 3.889 11.162 298 HB3 LYS 115 HB1 LYS 115 6.312 4.947 11.745 299 HG2 LYS 115 HG2 LYS 115 5.038 2.957 12.491 300 HG3 LYS 115 HG1 LYS 115 6.339 1.916 11.913 301 HD2 LYS 115 HD2 LYS 115 7.889 2.835 13.512 302 HD3 LYS 115 HD1 LYS 115 6.744 4.094 13.977 303 HE2 LYS 115 HE2 LYS 115 6.745 2.297 15.649 304 HE3 LYS 115 HE1 LYS 115 5.191 2.351 14.816 305 HZ1 LYS 115 HZ1 LYS 115 7.428 0.542 14.084 306 HZ2 LYS 115 HZ2 LYS 115 5.864 0.546 13.419 307 HZ3 LYS 115 HZ3 LYS 115 6.101 0.089 15.039 308 H LEU 116 HN LEU 116 3.824 4.797 8.827 309 HA LEU 116 HA LEU 116 5.344 7.005 7.622 310 HB2 LEU 116 HB2 LEU 116 2.689 5.734 7.020 311 HB3 LEU 116 HB1 LEU 116 2.996 7.381 6.490 312 HG LEU 116 HG LEU 116 3.543 5.663 4.753 313 HD11 LEU 116 HD11 LEU 116 6.243 6.627 5.253 314 HD12 LEU 116 HD12 LEU 116 5.056 7.899 5.527 315 HD13 LEU 116 HD13 LEU 116 5.118 7.073 3.971 316 HD21 LEU 116 HD21 LEU 116 4.321 3.950 6.423 317 HD22 LEU 116 HD22 LEU 116 5.790 4.901 6.641 318 HD23 LEU 116 HD23 LEU 116 5.425 4.186 5.071 319 H THR 117 HN THR 117 4.506 9.185 7.734 320 HA THR 117 HA THR 117 3.267 9.730 10.331 321 HB THR 117 HB THR 117 3.982 12.033 9.967 322 HG1 THR 117 HG1 THR 117 3.818 11.378 7.469 323 HG21 THR 117 HG21 THR 117 5.607 10.137 10.679 324 HG22 THR 117 HG22 THR 117 6.297 11.683 10.186 325 HG23 THR 117 HG23 THR 117 6.289 10.323 9.063 326 H ASP 118 HN ASP 118 1.678 11.656 10.289 327 HA ASP 118 HA ASP 118 -0.600 10.909 8.846 328 HB2 ASP 118 HB2 ASP 118 0.149 13.492 10.216 329 HB3 ASP 118 HB1 ASP 118 -1.437 13.216 9.500 330 H GLU 119 HN GLU 119 1.851 13.382 8.147 331 HA GLU 119 HA GLU 119 0.529 14.562 5.948 332 HB2 GLU 119 HB2 GLU 119 3.470 14.325 6.612 333 HB3 GLU 119 HB1 GLU 119 2.849 15.286 5.270 334 HG2 GLU 119 HG2 GLU 119 1.940 15.638 8.137 335 HG3 GLU 119 HG1 GLU 119 3.232 16.587 7.404 336 H GLU 120 HN GLU 120 2.832 11.842 6.104 337 HA GLU 120 HA GLU 120 2.934 11.427 3.289 338 HB2 GLU 120 HB2 GLU 120 3.666 9.782 5.690 339 HB3 GLU 120 HB1 GLU 120 3.702 9.080 4.072 340 HG2 GLU 120 HG2 GLU 120 5.862 10.215 5.009 341 HG3 GLU 120 HG1 GLU 120 5.391 10.522 3.340 342 H VAL 121 HN VAL 121 0.994 10.011 5.897 343 HA VAL 121 HA VAL 121 -0.322 8.061 4.309 344 HB VAL 121 HB VAL 121 -1.213 9.482 6.835 345 HG11 VAL 121 HG11 VAL 121 -2.518 7.075 6.743 346 HG12 VAL 121 HG12 VAL 121 -2.529 7.546 5.054 347 HG13 VAL 121 HG13 VAL 121 -3.232 8.616 6.267 348 HG21 VAL 121 HG21 VAL 121 -0.663 6.759 7.289 349 HG22 VAL 121 HG22 VAL 121 0.312 8.133 7.807 350 HG23 VAL 121 HG23 VAL 121 0.661 7.332 6.276 351 H ASP 122 HN ASP 122 -1.248 11.391 5.238 352 HA ASP 122 HA ASP 122 -3.752 11.448 4.065 353 HB2 ASP 122 HB2 ASP 122 -1.665 13.623 4.356 354 HB3 ASP 122 HB1 ASP 122 -3.294 13.936 3.754 355 H GLU 123 HN GLU 123 -0.574 11.885 2.559 356 HA GLU 123 HA GLU 123 -1.486 12.665 -0.007 357 HB2 GLU 123 HB2 GLU 123 0.991 11.138 0.839 358 HB3 GLU 123 HB1 GLU 123 0.708 11.724 -0.799 359 HG2 GLU 123 HG2 GLU 123 0.688 13.514 1.639 360 HG3 GLU 123 HG1 GLU 123 2.114 13.248 0.637 361 H MET 124 HN MET 124 -0.980 9.550 1.554 362 HA MET 124 HA MET 124 -1.463 7.920 -0.731 363 HB2 MET 124 HB2 MET 124 -1.609 7.340 2.235 364 HB3 MET 124 HB1 MET 124 -1.704 6.123 0.971 365 HG2 MET 124 HG2 MET 124 0.567 8.020 0.788 366 HG3 MET 124 HG1 MET 124 0.633 6.858 2.111 367 HE1 MET 124 HE1 MET 124 1.474 4.102 1.500 368 HE2 MET 124 HE2 MET 124 0.064 3.557 0.593 369 HE3 MET 124 HE3 MET 124 -0.140 4.688 1.931 370 H ILE 125 HN ILE 125 -3.513 9.134 1.910 371 HA ILE 125 HA ILE 125 -5.814 7.648 1.300 372 HB ILE 125 HB ILE 125 -5.146 9.947 2.958 373 HG12 ILE 125 HG12 ILE 125 -6.657 8.753 4.529 374 HG13 ILE 125 HG11 ILE 125 -7.035 7.608 3.246 375 HG21 ILE 125 HG21 ILE 125 -7.564 10.548 3.315 376 HG22 ILE 125 HG22 ILE 125 -7.925 9.700 1.814 377 HG23 ILE 125 HG23 ILE 125 -6.871 11.117 1.800 378 HD11 ILE 125 HD11 ILE 125 -4.176 7.916 3.487 379 HD12 ILE 125 HD12 ILE 125 -5.146 6.454 3.639 380 HD13 ILE 125 HD13 ILE 125 -4.872 7.479 5.047 381 H ARG 126 HN ARG 126 -4.738 10.811 0.158 382 HA ARG 126 HA ARG 126 -7.047 11.484 -1.307 383 HB2 ARG 126 HB2 ARG 126 -5.208 13.074 -0.774 384 HB3 ARG 126 HB1 ARG 126 -4.179 12.229 -1.931 385 HG2 ARG 126 HG2 ARG 126 -5.690 12.769 -3.754 386 HG3 ARG 126 HG1 ARG 126 -6.850 13.480 -2.631 387 HD2 ARG 126 HD2 ARG 126 -4.018 14.485 -3.026 388 HD3 ARG 126 HD1 ARG 126 -5.439 15.187 -3.795 389 HE ARG 126 HE ARG 126 -5.942 15.115 -1.045 390 HH11 ARG 126 HH21 ARG 126 -3.736 16.559 -3.287 391 HH12 ARG 126 HH22 ARG 126 -3.472 17.976 -2.328 392 HH21 ARG 126 HH11 ARG 126 -5.601 16.972 0.218 393 HH22 ARG 126 HH12 ARG 126 -4.528 18.211 -0.343 394 H GLU 127 HN GLU 127 -4.345 9.409 -1.989 395 HA GLU 127 HA GLU 127 -5.239 8.990 -4.759 396 HB2 GLU 127 HB2 GLU 127 -2.778 7.975 -3.317 397 HB3 GLU 127 HB1 GLU 127 -3.143 7.728 -5.025 398 HG2 GLU 127 HG2 GLU 127 -2.862 10.447 -3.715 399 HG3 GLU 127 HG1 GLU 127 -1.582 9.643 -4.622 400 H ALA 128 HN ALA 128 -6.049 7.825 -1.809 401 HA ALA 128 HA ALA 128 -6.093 4.987 -2.536 402 HB1 ALA 128 HB1 ALA 128 -5.475 5.776 -0.227 403 HB2 ALA 128 HB2 ALA 128 -6.767 4.586 -0.275 404 HB3 ALA 128 HB3 ALA 128 -7.147 6.283 -0.015 405 H ASP 129 HN ASP 129 -8.668 6.706 -0.785 406 HA ASP 129 HA ASP 129 -10.608 6.750 -2.826 407 HB2 ASP 129 HB2 ASP 129 -10.449 4.317 -2.839 408 HB3 ASP 129 HB1 ASP 129 -10.676 4.269 -1.094 409 H ILE 130 HN ILE 130 -11.809 5.171 -0.089 410 HA ILE 130 HA ILE 130 -13.130 5.763 1.637 411 HB ILE 130 HB ILE 130 -11.489 8.304 1.657 412 HG12 ILE 130 HG12 ILE 130 -11.148 5.786 3.311 413 HG13 ILE 130 HG11 ILE 130 -10.212 6.107 1.848 414 HG21 ILE 130 HG21 ILE 130 -12.326 7.574 4.233 415 HG22 ILE 130 HG22 ILE 130 -13.746 7.310 3.219 416 HG23 ILE 130 HG23 ILE 130 -12.971 8.895 3.260 417 HD11 ILE 130 HD11 ILE 130 -9.251 8.092 2.805 418 HD12 ILE 130 HD12 ILE 130 -9.083 6.813 4.006 419 HD13 ILE 130 HD13 ILE 130 -10.347 8.030 4.181 420 H ASP 131 HN ASP 131 -14.418 6.042 -0.643 421 HA ASP 131 HA ASP 131 -15.381 8.609 -1.309 422 HB2 ASP 131 HB2 ASP 131 -15.719 6.578 -2.711 423 HB3 ASP 131 HB1 ASP 131 -16.846 5.963 -1.504 424 H GLY 132 HN GLY 132 -16.469 6.155 0.974 425 HA2 GLY 132 HA2 GLY 132 -17.535 8.043 2.808 426 HA3 GLY 132 HA1 GLY 132 -18.836 7.309 1.875 427 H ASP 133 HN ASP 133 -17.949 4.726 1.571 428 HA ASP 133 HA ASP 133 -18.684 3.562 4.012 429 HB2 ASP 133 HB2 ASP 133 -17.407 2.415 1.537 430 HB3 ASP 133 HB1 ASP 133 -17.875 1.417 2.913 431 H GLY 134 HN GLY 134 -15.465 4.055 2.601 432 HA2 GLY 134 HA2 GLY 134 -13.585 4.452 4.054 433 HA3 GLY 134 HA1 GLY 134 -14.344 3.423 5.260 434 H GLN 135 HN GLN 135 -14.042 2.640 1.829 435 HA GLN 135 HA GLN 135 -12.167 0.458 2.545 436 HB2 GLN 135 HB2 GLN 135 -13.147 -0.591 0.369 437 HB3 GLN 135 HB1 GLN 135 -14.089 -0.681 1.863 438 HG2 GLN 135 HG2 GLN 135 -15.388 1.285 1.187 439 HG3 GLN 135 HG1 GLN 135 -14.413 1.450 -0.272 440 HE21 GLN 135 HE21 GLN 135 -16.599 1.183 -1.399 441 HE22 GLN 135 HE22 GLN 135 -17.168 -0.394 -1.662 442 H VAL 136 HN VAL 136 -10.588 -0.131 0.861 443 HA VAL 136 HA VAL 136 -10.076 2.029 -1.067 444 HB VAL 136 HB VAL 136 -8.196 0.811 0.931 445 HG11 VAL 136 HG11 VAL 136 -7.624 2.047 -1.748 446 HG12 VAL 136 HG12 VAL 136 -6.904 0.608 -1.015 447 HG13 VAL 136 HG13 VAL 136 -6.473 2.216 -0.422 448 HG21 VAL 136 HG21 VAL 136 -7.677 3.178 1.353 449 HG22 VAL 136 HG22 VAL 136 -9.396 2.857 1.550 450 HG23 VAL 136 HG23 VAL 136 -8.817 3.644 0.093 451 H ASN 137 HN ASN 137 -9.642 1.360 -3.060 452 HA ASN 137 HA ASN 137 -9.480 -1.500 -3.578 453 HB2 ASN 137 HB2 ASN 137 -9.394 -0.649 -6.011 454 HB3 ASN 137 HB1 ASN 137 -10.886 -0.397 -5.112 455 HD21 ASN 137 HD21 ASN 137 -11.682 1.628 -5.681 456 HD22 ASN 137 HD22 ASN 137 -10.747 3.040 -5.800 457 H TYR 138 HN TYR 138 -7.480 -2.372 -3.253 458 HA TYR 138 HA TYR 138 -5.084 -0.890 -3.389 459 HB2 TYR 138 HB2 TYR 138 -3.929 -3.057 -3.261 460 HB3 TYR 138 HB1 TYR 138 -5.199 -2.903 -2.056 461 HD1 TYR 138 HD1 TYR 138 -4.332 -4.434 -5.334 462 HD2 TYR 138 HD2 TYR 138 -7.071 -4.392 -2.033 463 HE1 TYR 138 HE1 TYR 138 -5.323 -6.558 -6.133 464 HE2 TYR 138 HE2 TYR 138 -8.072 -6.512 -2.828 465 HH TYR 138 HH TYR 138 -7.521 -7.758 -5.913 466 H GLU 139 HN GLU 139 -6.993 -2.026 -5.917 467 HA GLU 139 HA GLU 139 -5.060 -2.853 -7.791 468 HB2 GLU 139 HB2 GLU 139 -7.734 -1.489 -8.162 469 HB3 GLU 139 HB1 GLU 139 -6.758 -2.084 -9.506 470 HG2 GLU 139 HG2 GLU 139 -6.837 -4.347 -8.638 471 HG3 GLU 139 HG1 GLU 139 -7.647 -3.799 -7.172 472 H GLU 140 HN GLU 140 -6.440 0.425 -7.269 473 HA GLU 140 HA GLU 140 -4.901 1.720 -9.220 474 HB2 GLU 140 HB2 GLU 140 -6.883 2.723 -8.157 475 HB3 GLU 140 HB1 GLU 140 -6.008 2.839 -6.632 476 HG2 GLU 140 HG2 GLU 140 -5.966 4.997 -7.794 477 HG3 GLU 140 HG1 GLU 140 -4.340 4.330 -7.719 478 H PHE 141 HN PHE 141 -4.249 1.183 -5.785 479 HA PHE 141 HA PHE 141 -1.849 2.687 -5.589 480 HB2 PHE 141 HB2 PHE 141 -3.138 0.500 -4.048 481 HB3 PHE 141 HB1 PHE 141 -1.395 0.661 -3.846 482 HD1 PHE 141 HD2 PHE 141 -0.574 3.182 -3.616 483 HD2 PHE 141 HD1 PHE 141 -4.508 1.786 -2.632 484 HE1 PHE 141 HE2 PHE 141 -0.873 5.111 -2.092 485 HE2 PHE 141 HE1 PHE 141 -4.798 3.702 -1.100 486 HZ PHE 141 HZ PHE 141 -2.990 5.365 -0.831 487 H VAL 142 HN VAL 142 -2.408 -0.725 -6.437 488 HA VAL 142 HA VAL 142 0.334 -1.366 -6.792 489 HB VAL 142 HB VAL 142 -2.202 -2.607 -7.878 490 HG11 VAL 142 HG11 VAL 142 -0.603 -4.574 -8.316 491 HG12 VAL 142 HG12 VAL 142 0.700 -3.390 -8.195 492 HG13 VAL 142 HG13 VAL 142 -0.530 -3.223 -9.447 493 HG21 VAL 142 HG21 VAL 142 -2.266 -3.522 -5.820 494 HG22 VAL 142 HG22 VAL 142 -0.758 -2.733 -5.371 495 HG23 VAL 142 HG23 VAL 142 -0.730 -4.313 -6.156 496 H GLN 143 HN GLN 143 -2.187 -0.270 -9.059 497 HA GLN 143 HA GLN 143 -0.578 -0.396 -11.384 498 HB2 GLN 143 HB2 GLN 143 -3.070 -0.089 -11.365 499 HB3 GLN 143 HB1 GLN 143 -2.817 1.562 -10.800 500 HG2 GLN 143 HG2 GLN 143 -3.100 1.592 -13.217 501 HG3 GLN 143 HG1 GLN 143 -1.428 1.997 -12.830 502 HE21 GLN 143 HE21 GLN 143 -3.379 -0.977 -13.497 503 HE22 GLN 143 HE22 GLN 143 -2.176 -1.719 -14.436 504 H MET 144 HN MET 144 -1.149 2.081 -8.959 505 HA MET 144 HA MET 144 0.422 4.140 -10.130 506 HB2 MET 144 HB2 MET 144 -0.964 5.017 -8.534 507 HB3 MET 144 HB1 MET 144 -0.875 3.584 -7.518 508 HG2 MET 144 HG2 MET 144 1.162 4.234 -6.560 509 HG3 MET 144 HG1 MET 144 1.492 5.417 -7.833 510 HE1 MET 144 HE1 MET 144 1.863 6.152 -4.885 511 HE2 MET 144 HE2 MET 144 0.667 4.960 -4.386 512 HE3 MET 144 HE3 MET 144 0.444 6.653 -3.954 513 H MET 145 HN MET 145 1.136 1.742 -7.571 514 HA MET 145 HA MET 145 3.830 2.520 -7.233 515 HB2 MET 145 HB2 MET 145 2.113 0.271 -6.376 516 HB3 MET 145 HB1 MET 145 3.819 -0.133 -6.529 517 HG2 MET 145 HG2 MET 145 3.619 0.594 -4.299 518 HG3 MET 145 HG1 MET 145 4.245 2.019 -5.119 519 HE1 MET 145 HE1 MET 145 0.913 1.906 -2.371 520 HE2 MET 145 HE2 MET 145 2.605 1.428 -2.364 521 HE3 MET 145 HE3 MET 145 1.407 0.391 -3.139 522 H THR 146 HN THR 146 2.253 0.526 -9.607 523 HA THR 146 HA THR 146 4.865 -0.434 -10.582 524 HB THR 146 HB THR 146 2.244 -1.372 -11.688 525 HG1 THR 146 HG1 THR 146 3.440 -2.534 -9.417 526 HG21 THR 146 HG21 THR 146 4.390 -2.093 -12.690 527 HG22 THR 146 HG22 THR 146 3.529 -3.447 -11.962 528 HG23 THR 146 HG23 THR 146 4.900 -2.722 -11.123 529 H ALA 147 HN ALA 147 3.450 2.287 -10.934 530 HA ALA 147 HA ALA 147 3.421 2.330 -13.891 531 HB1 ALA 147 HB1 ALA 147 2.053 4.020 -11.811 532 HB2 ALA 147 HB2 ALA 147 1.345 3.168 -13.184 533 HB3 ALA 147 HB3 ALA 147 2.302 4.625 -13.448 534 H LYS 148 HN LYS 148 5.849 2.260 -13.547 535 HA LYS 148 HA LYS 148 6.974 4.762 -14.111 536 HB2 LYS 148 HB2 LYS 148 6.631 4.249 -11.295 537 HB3 LYS 148 HB1 LYS 148 8.350 4.298 -11.677 538 HG2 LYS 148 HG2 LYS 148 6.434 6.441 -12.638 539 HG3 LYS 148 HG1 LYS 148 7.244 6.534 -11.077 540 HD2 LYS 148 HD2 LYS 148 9.443 6.305 -12.240 541 HD3 LYS 148 HD1 LYS 148 8.599 6.357 -13.787 542 HE2 LYS 148 HE2 LYS 148 7.686 8.578 -13.219 543 HE3 LYS 148 HE1 LYS 148 8.530 8.528 -11.671 544 HZ1 LYS 148 HZ1 LYS 148 9.579 9.659 -13.787 545 HZ2 LYS 148 HZ2 LYS 148 10.103 8.072 -14.091 546 HZ3 LYS 148 HZ3 LYS 148 10.536 8.851 -12.644 547 H PHE 30 HT1 PHE 30 -9.540 -3.920 12.978 548 HA PHE 30 HA PHE 30 -7.735 -4.120 11.119 549 HB2 PHE 30 HB2 PHE 30 -5.877 -4.487 13.390 550 HB3 PHE 30 HB1 PHE 30 -5.573 -3.827 11.783 551 HD1 PHE 30 HD2 PHE 30 -7.315 -1.601 11.475 552 HD2 PHE 30 HD1 PHE 30 -5.305 -2.922 15.033 553 HE1 PHE 30 HE2 PHE 30 -7.420 0.702 12.389 554 HE2 PHE 30 HE1 PHE 30 -5.412 -0.619 15.948 555 HZ PHE 30 HZ PHE 30 -6.470 1.192 14.627 556 H ASP 31 HN ASP 31 -8.642 -6.096 10.769 557 HA ASP 31 HA ASP 31 -8.692 -8.054 12.970 558 HB2 ASP 31 HB2 ASP 31 -10.289 -9.289 11.598 559 HB3 ASP 31 HB1 ASP 31 -10.818 -7.619 11.794 560 H ILE 32 HN ILE 32 -6.370 -7.238 11.077 561 HA ILE 32 HA ILE 32 -5.850 -9.777 9.728 562 HB ILE 32 HB ILE 32 -4.217 -8.672 8.528 563 HG12 ILE 32 HG12 ILE 32 -3.881 -6.954 10.997 564 HG13 ILE 32 HG11 ILE 32 -2.694 -8.018 10.237 565 HG21 ILE 32 HG21 ILE 32 -5.242 -6.775 7.727 566 HG22 ILE 32 HG22 ILE 32 -5.600 -6.151 9.337 567 HG23 ILE 32 HG23 ILE 32 -6.578 -7.451 8.650 568 HD11 ILE 32 HD11 ILE 32 -3.669 -5.328 9.310 569 HD12 ILE 32 HD12 ILE 32 -2.986 -6.477 8.160 570 HD13 ILE 32 HD13 ILE 32 -2.012 -5.897 9.511 571 H ASP 33 HN ASP 33 -3.621 -10.714 9.955 572 HA ASP 33 HA ASP 33 -3.088 -11.127 12.788 573 HB2 ASP 33 HB2 ASP 33 -2.087 -12.459 10.270 574 HB3 ASP 33 HB1 ASP 33 -1.457 -12.851 11.869 575 H MET 34 HN MET 34 -2.192 -9.065 13.272 576 HA MET 34 HA MET 34 0.023 -7.935 11.942 577 HB2 MET 34 HB2 MET 34 -1.022 -7.617 14.755 578 HB3 MET 34 HB1 MET 34 0.349 -6.698 14.133 579 HG2 MET 34 HG2 MET 34 -1.056 -5.836 12.301 580 HG3 MET 34 HG1 MET 34 -2.428 -6.757 12.918 581 HE1 MET 34 HE1 MET 34 -3.263 -4.433 12.413 582 HE2 MET 34 HE2 MET 34 -2.000 -3.221 12.625 583 HE3 MET 34 HE3 MET 34 -3.432 -3.182 13.652 584 H ASP 35 HN ASP 35 -0.232 -10.246 14.592 585 HA ASP 35 HA ASP 35 2.436 -10.223 15.452 586 HB2 ASP 35 HB2 ASP 35 0.580 -11.331 16.663 587 HB3 ASP 35 HB1 ASP 35 0.530 -12.571 15.412 588 H ALA 36 HN ALA 36 0.866 -12.070 12.851 589 HA ALA 36 HA ALA 36 3.022 -13.759 12.259 590 HB1 ALA 36 HB1 ALA 36 0.632 -12.780 10.780 591 HB2 ALA 36 HB2 ALA 36 1.139 -14.432 11.128 592 HB3 ALA 36 HB3 ALA 36 1.922 -13.522 9.835 593 HA PRO 37 HA PRO 37 5.893 -10.762 10.632 594 HB2 PRO 37 HB2 PRO 37 7.578 -12.375 9.245 595 HB3 PRO 37 HB1 PRO 37 7.568 -12.268 11.018 596 HG2 PRO 37 HG2 PRO 37 6.309 -14.288 9.242 597 HG3 PRO 37 HG1 PRO 37 7.210 -14.519 10.747 598 HD2 PRO 37 HD2 PRO 37 4.496 -14.591 10.662 599 HD3 PRO 37 HD1 PRO 37 5.384 -13.986 12.081 600 H GLU 38 HN GLU 38 4.108 -12.897 8.560 601 HA GLU 38 HA GLU 38 4.938 -11.935 6.044 602 HB2 GLU 38 HB2 GLU 38 2.320 -13.148 6.951 603 HB3 GLU 38 HB1 GLU 38 2.710 -12.810 5.264 604 HG2 GLU 38 HG2 GLU 38 4.443 -14.518 7.066 605 HG3 GLU 38 HG1 GLU 38 3.206 -15.179 5.998 606 H THR 39 HN THR 39 2.358 -10.854 8.238 607 HA THR 39 HA THR 39 1.256 -8.923 6.484 608 HB THR 39 HB THR 39 1.257 -8.964 9.512 609 HG1 THR 39 HG1 THR 39 -0.728 -9.989 9.215 610 HG21 THR 39 HG21 THR 39 0.251 -6.959 9.309 611 HG22 THR 39 HG22 THR 39 -1.077 -7.787 8.495 612 HG23 THR 39 HG23 THR 39 0.233 -7.086 7.549 613 H GLU 40 HN GLU 40 3.712 -8.685 9.041 614 HA GLU 40 HA GLU 40 4.124 -5.897 8.829 615 HB2 GLU 40 HB2 GLU 40 5.913 -8.138 9.789 616 HB3 GLU 40 HB1 GLU 40 6.357 -6.434 9.896 617 HG2 GLU 40 HG2 GLU 40 4.425 -5.958 11.282 618 HG3 GLU 40 HG1 GLU 40 3.815 -7.597 11.064 619 H ARG 41 HN ARG 41 5.638 -8.662 7.212 620 HA ARG 41 HA ARG 41 7.634 -7.207 5.836 621 HB2 ARG 41 HB2 ARG 41 6.260 -9.833 5.229 622 HB3 ARG 41 HB1 ARG 41 7.600 -9.204 4.273 623 HG2 ARG 41 HG2 ARG 41 7.910 -9.381 7.252 624 HG3 ARG 41 HG1 ARG 41 8.062 -10.852 6.294 625 HD2 ARG 41 HD2 ARG 41 9.631 -8.313 5.749 626 HD3 ARG 41 HD1 ARG 41 10.243 -9.669 6.685 627 HE ARG 41 HE ARG 41 9.367 -10.718 4.261 628 HH11 ARG 41 HH21 ARG 41 11.668 -8.410 5.423 629 HH12 ARG 41 HH22 ARG 41 12.791 -8.673 4.131 630 HH21 ARG 41 HH11 ARG 41 10.835 -11.069 2.564 631 HH22 ARG 41 HH12 ARG 41 12.320 -10.178 2.512 632 H ALA 42 HN ALA 42 4.306 -8.073 5.020 633 HA ALA 42 HA ALA 42 4.315 -7.143 2.357 634 HB1 ALA 42 HB1 ALA 42 2.116 -7.482 4.396 635 HB2 ALA 42 HB2 ALA 42 2.498 -8.519 3.022 636 HB3 ALA 42 HB3 ALA 42 1.802 -6.922 2.754 637 H ALA 43 HN ALA 43 3.650 -5.539 5.433 638 HA ALA 43 HA ALA 43 2.727 -3.079 4.420 639 HB1 ALA 43 HB1 ALA 43 4.364 -3.330 6.935 640 HB2 ALA 43 HB2 ALA 43 2.718 -3.959 6.845 641 HB3 ALA 43 HB3 ALA 43 3.020 -2.238 6.599 642 H VAL 44 HN VAL 44 5.983 -4.273 5.118 643 HA VAL 44 HA VAL 44 7.384 -1.864 4.741 644 HB VAL 44 HB VAL 44 8.217 -4.744 4.369 645 HG11 VAL 44 HG11 VAL 44 10.543 -3.448 4.735 646 HG12 VAL 44 HG12 VAL 44 9.658 -2.180 3.885 647 HG13 VAL 44 HG13 VAL 44 9.885 -3.758 3.128 648 HG21 VAL 44 HG21 VAL 44 8.694 -2.683 6.544 649 HG22 VAL 44 HG22 VAL 44 9.395 -4.300 6.519 650 HG23 VAL 44 HG23 VAL 44 7.649 -4.099 6.665 651 H ALA 45 HN ALA 45 6.598 -4.463 2.421 652 HA ALA 45 HA ALA 45 7.973 -3.373 0.223 653 HB1 ALA 45 HB1 ALA 45 6.771 -4.909 -1.116 654 HB2 ALA 45 HB2 ALA 45 5.411 -4.944 0.007 655 HB3 ALA 45 HB3 ALA 45 6.942 -5.697 0.453 656 H ILE 46 HN ILE 46 4.572 -2.979 1.219 657 HA ILE 46 HA ILE 46 3.858 -1.302 -0.949 658 HB ILE 46 HB ILE 46 2.668 -1.649 1.804 659 HG12 ILE 46 HG12 ILE 46 1.675 -2.541 -0.916 660 HG13 ILE 46 HG11 ILE 46 2.677 -3.559 0.119 661 HG21 ILE 46 HG21 ILE 46 1.897 0.487 1.171 662 HG22 ILE 46 HG22 ILE 46 0.638 -0.587 0.561 663 HG23 ILE 46 HG23 ILE 46 1.853 0.062 -0.540 664 HD11 ILE 46 HD11 ILE 46 -0.090 -3.392 0.214 665 HD12 ILE 46 HD12 ILE 46 0.428 -2.373 1.558 666 HD13 ILE 46 HD13 ILE 46 0.948 -4.058 1.475 667 H GLN 47 HN GLN 47 4.865 -0.572 2.379 668 HA GLN 47 HA GLN 47 4.708 2.246 2.125 669 HB2 GLN 47 HB2 GLN 47 6.221 0.449 4.018 670 HB3 GLN 47 HB1 GLN 47 6.224 2.207 4.154 671 HG2 GLN 47 HG2 GLN 47 3.757 2.199 4.292 672 HG3 GLN 47 HG1 GLN 47 3.759 0.441 4.168 673 HE21 GLN 47 HE21 GLN 47 3.051 -0.130 6.266 674 HE22 GLN 47 HE22 GLN 47 3.866 0.321 7.684 675 H SER 48 HN SER 48 7.366 -0.052 1.636 676 HA SER 48 HA SER 48 9.420 1.844 1.274 677 HB2 SER 48 HB2 SER 48 9.880 -0.537 1.620 678 HB3 SER 48 HB1 SER 48 9.123 -0.921 0.077 679 HG SER 48 HG SER 48 11.568 0.306 0.641 680 H GLN 49 HN GLN 49 7.254 0.262 -1.049 681 HA GLN 49 HA GLN 49 8.336 1.471 -3.364 682 HB2 GLN 49 HB2 GLN 49 5.629 0.260 -2.792 683 HB3 GLN 49 HB1 GLN 49 6.113 0.839 -4.386 684 HG2 GLN 49 HG2 GLN 49 7.670 -1.215 -2.794 685 HG3 GLN 49 HG1 GLN 49 6.501 -1.623 -4.047 686 HE21 GLN 49 HE21 GLN 49 9.729 -1.473 -3.664 687 HE22 GLN 49 HE22 GLN 49 10.203 -0.944 -5.205 688 H PHE 50 HN PHE 50 5.755 2.471 -1.148 689 HA PHE 50 HA PHE 50 4.736 4.585 -2.678 690 HB2 PHE 50 HB2 PHE 50 3.534 3.875 -0.717 691 HB3 PHE 50 HB1 PHE 50 4.905 4.254 0.324 692 HD1 PHE 50 HD1 PHE 50 2.948 6.015 -2.372 693 HD2 PHE 50 HD2 PHE 50 4.661 6.216 1.571 694 HE1 PHE 50 HE1 PHE 50 2.128 8.342 -2.131 695 HE2 PHE 50 HE2 PHE 50 3.840 8.549 1.801 696 HZ PHE 50 HZ PHE 50 2.574 9.612 -0.046 697 H ARG 51 HN ARG 51 7.342 4.594 -0.245 698 HA ARG 51 HA ARG 51 7.946 7.344 -0.467 699 HB2 ARG 51 HB2 ARG 51 9.638 4.974 0.351 700 HB3 ARG 51 HB1 ARG 51 10.191 6.646 0.456 701 HG2 ARG 51 HG2 ARG 51 8.287 7.195 1.919 702 HG3 ARG 51 HG1 ARG 51 7.715 5.531 1.806 703 HD2 ARG 51 HD2 ARG 51 9.815 4.737 2.823 704 HD3 ARG 51 HD1 ARG 51 10.392 6.397 2.935 705 HE ARG 51 HE ARG 51 7.900 6.230 4.239 706 HH11 ARG 51 HH21 ARG 51 11.160 5.101 4.498 707 HH12 ARG 51 HH22 ARG 51 11.132 4.992 6.226 708 HH21 ARG 51 HH11 ARG 51 7.853 6.090 6.505 709 HH22 ARG 51 HH12 ARG 51 9.259 5.553 7.363 710 H LYS 52 HN LYS 52 9.087 4.495 -2.207 711 HA LYS 52 HA LYS 52 11.089 5.798 -3.735 712 HB2 LYS 52 HB2 LYS 52 10.916 3.333 -3.419 713 HB3 LYS 52 HB1 LYS 52 9.508 3.327 -4.479 714 HG2 LYS 52 HG2 LYS 52 10.893 4.342 -6.285 715 HG3 LYS 52 HG1 LYS 52 12.300 4.255 -5.230 716 HD2 LYS 52 HD2 LYS 52 10.661 1.811 -5.930 717 HD3 LYS 52 HD1 LYS 52 12.012 2.348 -6.925 718 HE2 LYS 52 HE2 LYS 52 13.459 2.258 -4.846 719 HE3 LYS 52 HE1 LYS 52 12.108 1.486 -4.020 720 HZ1 LYS 52 HZ1 LYS 52 13.043 0.413 -6.589 721 HZ2 LYS 52 HZ2 LYS 52 12.251 -0.381 -5.313 722 HZ3 LYS 52 HZ3 LYS 52 13.890 0.040 -5.168 723 H PHE 53 HN PHE 53 7.642 5.233 -4.253 724 HA PHE 53 HA PHE 53 7.433 5.928 -6.945 725 HB2 PHE 53 HB2 PHE 53 5.598 4.931 -5.674 726 HB3 PHE 53 HB1 PHE 53 5.446 6.401 -4.713 727 HD1 PHE 53 HD1 PHE 53 4.918 4.889 -8.040 728 HD2 PHE 53 HD2 PHE 53 4.492 8.437 -5.653 729 HE1 PHE 53 HE1 PHE 53 3.412 5.866 -9.759 730 HE2 PHE 53 HE2 PHE 53 2.996 9.413 -7.371 731 HZ PHE 53 HZ PHE 53 2.458 8.129 -9.423 732 H GLN 54 HN GLN 54 7.085 8.091 -4.092 733 HA GLN 54 HA GLN 54 6.663 10.407 -5.694 734 HB2 GLN 54 HB2 GLN 54 7.050 11.677 -3.613 735 HB3 GLN 54 HB1 GLN 54 5.916 10.347 -3.376 736 HG2 GLN 54 HG2 GLN 54 7.716 8.959 -2.460 737 HG3 GLN 54 HG1 GLN 54 8.873 10.264 -2.713 738 HE21 GLN 54 HE21 GLN 54 6.986 8.871 -0.341 739 HE22 GLN 54 HE22 GLN 54 6.802 10.210 0.684 740 H LYS 55 HN LYS 55 9.557 8.885 -4.370 741 HA LYS 55 HA LYS 55 11.344 11.025 -4.896 742 HB2 LYS 55 HB2 LYS 55 11.779 8.046 -4.643 743 HB3 LYS 55 HB1 LYS 55 13.097 9.192 -4.888 744 HG2 LYS 55 HG2 LYS 55 12.445 10.400 -2.847 745 HG3 LYS 55 HG1 LYS 55 11.110 9.278 -2.598 746 HD2 LYS 55 HD2 LYS 55 12.685 7.410 -2.386 747 HD3 LYS 55 HD1 LYS 55 14.037 8.496 -2.704 748 HE2 LYS 55 HE2 LYS 55 13.815 8.128 -0.290 749 HE3 LYS 55 HE1 LYS 55 13.436 9.805 -0.681 750 HZ1 LYS 55 HZ1 LYS 55 11.370 7.694 -0.452 751 HZ2 LYS 55 HZ2 LYS 55 11.136 9.375 -0.520 752 HZ3 LYS 55 HZ3 LYS 55 11.840 8.667 0.854 753 H LYS 56 HN LYS 56 10.218 8.296 -6.857 754 HA LYS 56 HA LYS 56 11.992 8.649 -9.017 755 HB2 LYS 56 HB2 LYS 56 9.183 7.530 -8.888 756 HB3 LYS 56 HB1 LYS 56 10.175 7.483 -10.343 757 HG2 LYS 56 HG2 LYS 56 11.321 6.448 -7.771 758 HG3 LYS 56 HG1 LYS 56 10.182 5.442 -8.664 759 HD2 LYS 56 HD2 LYS 56 11.606 5.668 -10.692 760 HD3 LYS 56 HD1 LYS 56 12.767 6.605 -9.752 761 HE2 LYS 56 HE2 LYS 56 13.482 4.267 -9.857 762 HE3 LYS 56 HE1 LYS 56 13.035 4.683 -8.203 763 HZ1 LYS 56 HZ1 LYS 56 10.932 3.635 -9.933 764 HZ2 LYS 56 HZ2 LYS 56 11.193 3.395 -8.271 765 HZ3 LYS 56 HZ3 LYS 56 12.116 2.537 -9.411 766 H LYS 57 HN LYS 57 8.780 10.022 -8.357 767 HA LYS 57 HA LYS 57 8.554 11.460 -10.787 768 HB2 LYS 57 HB2 LYS 57 6.631 11.019 -9.315 769 HB3 LYS 57 HB1 LYS 57 7.326 12.075 -8.089 770 HG2 LYS 57 HG2 LYS 57 7.195 13.992 -9.580 771 HG3 LYS 57 HG1 LYS 57 6.653 12.969 -10.908 772 HD2 LYS 57 HD2 LYS 57 5.081 13.020 -8.348 773 HD3 LYS 57 HD1 LYS 57 4.889 14.331 -9.510 774 HE2 LYS 57 HE2 LYS 57 4.539 11.382 -10.153 775 HE3 LYS 57 HE1 LYS 57 3.228 12.522 -9.874 776 HZ1 LYS 57 HZ1 LYS 57 5.237 12.593 -12.052 777 HZ2 LYS 57 HZ2 LYS 57 4.179 13.878 -11.711 778 HZ3 LYS 57 HZ3 LYS 57 3.561 12.372 -12.199 779 H ALA 58 HN ALA 58 9.749 12.336 -7.570 780 HA ALA 58 HA ALA 58 10.771 14.281 -6.821 781 HB1 ALA 58 HB1 ALA 58 12.670 13.024 -7.477 782 HB2 ALA 58 HB2 ALA 58 12.928 14.645 -8.128 783 HB3 ALA 58 HB3 ALA 58 12.386 13.344 -9.189 784 H GLY 59 HN GLY 59 8.649 15.346 -7.785 785 HA2 GLY 59 HA2 GLY 59 8.778 16.903 -10.123 786 HA3 GLY 59 HA1 GLY 59 7.730 17.224 -8.744 787 H SER 60 HN SER 60 9.730 17.615 -6.782 788 HA SER 60 HA SER 60 10.593 20.306 -7.520 789 HB2 SER 60 HB2 SER 60 9.507 20.067 -5.368 790 HB3 SER 60 HB1 SER 60 10.640 18.805 -4.892 791 HG SER 60 HG SER 60 12.303 20.459 -5.244 792 H GLN 61 HN GLN 61 12.615 20.810 -8.084 793 HA GLN 61 HA GLN 61 14.602 18.857 -8.508 794 HB2 GLN 61 HB2 GLN 61 14.488 21.021 -9.719 795 HB3 GLN 61 HB1 GLN 61 14.957 21.853 -8.238 796 HG2 GLN 61 HG2 GLN 61 17.070 20.575 -8.186 797 HG3 GLN 61 HG1 GLN 61 16.601 19.743 -9.666 798 HE21 GLN 61 HE21 GLN 61 17.634 20.640 -11.445 799 HE22 GLN 61 HE22 GLN 61 17.985 22.290 -11.641 800 H SER 62 HN SER 62 14.100 21.185 -5.885 801 HA SER 62 HA SER 62 15.865 19.572 -4.185 802 HB2 SER 62 HB2 SER 62 17.140 21.535 -5.245 803 HB3 SER 62 HB1 SER 62 16.136 22.575 -4.238 804 HG SER 62 HG SER 62 17.116 20.501 -2.816 Start of MODEL 8 1 H1 MET 76 HT1 MET 76 13.283 -10.690 -19.932 2 H2 MET 76 HT2 MET 76 13.209 -9.031 -20.293 3 H3 MET 76 HT3 MET 76 13.919 -10.112 -21.394 4 HA MET 76 HA MET 76 11.316 -9.249 -21.393 5 HB2 MET 76 HB2 MET 76 12.929 -10.267 -23.196 6 HB3 MET 76 HB1 MET 76 12.190 -11.798 -22.729 7 HG2 MET 76 HG2 MET 76 10.908 -10.929 -24.573 8 HG3 MET 76 HG1 MET 76 9.933 -10.718 -23.119 9 HE1 MET 76 HE1 MET 76 8.396 -8.999 -24.125 10 HE2 MET 76 HE2 MET 76 9.210 -9.217 -25.673 11 HE3 MET 76 HE3 MET 76 8.908 -7.591 -25.065 12 H LYS 77 HN LYS 77 12.482 -11.349 -19.176 13 HA LYS 77 HA LYS 77 10.659 -13.490 -19.158 14 HB2 LYS 77 HB2 LYS 77 11.288 -13.763 -16.808 15 HB3 LYS 77 HB1 LYS 77 12.713 -13.429 -17.792 16 HG2 LYS 77 HG2 LYS 77 12.569 -11.031 -17.150 17 HG3 LYS 77 HG1 LYS 77 11.193 -11.407 -16.113 18 HD2 LYS 77 HD2 LYS 77 12.566 -12.907 -14.765 19 HD3 LYS 77 HD1 LYS 77 13.945 -12.645 -15.834 20 HE2 LYS 77 HE2 LYS 77 14.156 -11.232 -13.841 21 HE3 LYS 77 HE1 LYS 77 13.901 -10.227 -15.268 22 HZ1 LYS 77 HZ1 LYS 77 11.529 -11.113 -13.820 23 HZ2 LYS 77 HZ2 LYS 77 11.836 -9.639 -14.607 24 HZ3 LYS 77 HZ3 LYS 77 12.490 -9.936 -13.068 25 H ASP 78 HN ASP 78 10.423 -10.204 -17.913 26 HA ASP 78 HA ASP 78 8.647 -8.973 -17.159 27 HB2 ASP 78 HB2 ASP 78 6.916 -11.215 -18.234 28 HB3 ASP 78 HB1 ASP 78 6.406 -9.576 -17.849 29 H THR 79 HN THR 79 7.239 -12.203 -16.693 30 HA THR 79 HA THR 79 6.568 -13.308 -14.795 31 HB THR 79 HB THR 79 8.646 -11.697 -13.315 32 HG1 THR 79 HG1 THR 79 9.278 -14.158 -14.415 33 HG21 THR 79 HG21 THR 79 8.717 -13.562 -11.846 34 HG22 THR 79 HG22 THR 79 7.838 -14.587 -12.981 35 HG23 THR 79 HG23 THR 79 7.001 -13.279 -12.144 36 H ASP 80 HN ASP 80 4.779 -11.590 -15.330 37 HA ASP 80 HA ASP 80 3.998 -9.359 -14.238 38 HB2 ASP 80 HB2 ASP 80 1.779 -10.559 -13.503 39 HB3 ASP 80 HB1 ASP 80 2.232 -10.492 -15.206 40 H SER 81 HN SER 81 5.131 -8.663 -12.469 41 HA SER 81 HA SER 81 5.042 -10.064 -9.936 42 HB2 SER 81 HB2 SER 81 6.116 -7.336 -10.694 43 HB3 SER 81 HB1 SER 81 6.285 -8.072 -9.103 44 HG SER 81 HG SER 81 7.341 -8.920 -11.588 45 H GLU 82 HN GLU 82 2.879 -8.150 -11.575 46 HA GLU 82 HA GLU 82 1.898 -6.364 -9.676 47 HB2 GLU 82 HB2 GLU 82 0.441 -7.963 -11.792 48 HB3 GLU 82 HB1 GLU 82 -0.309 -6.672 -10.855 49 HG2 GLU 82 HG2 GLU 82 1.225 -5.044 -11.729 50 HG3 GLU 82 HG1 GLU 82 2.200 -6.290 -12.501 51 H GLU 83 HN GLU 83 1.377 -9.792 -10.097 52 HA GLU 83 HA GLU 83 -0.685 -10.123 -8.170 53 HB2 GLU 83 HB2 GLU 83 -0.219 -12.485 -8.384 54 HB3 GLU 83 HB1 GLU 83 -0.102 -11.749 -9.983 55 HG2 GLU 83 HG2 GLU 83 2.404 -11.524 -9.567 56 HG3 GLU 83 HG1 GLU 83 2.173 -12.544 -8.148 57 H GLU 84 HN GLU 84 2.804 -9.881 -7.937 58 HA GLU 84 HA GLU 84 3.188 -11.181 -5.467 59 HB2 GLU 84 HB2 GLU 84 5.035 -10.519 -6.984 60 HB3 GLU 84 HB1 GLU 84 4.729 -8.827 -6.589 61 HG2 GLU 84 HG2 GLU 84 5.224 -9.249 -4.231 62 HG3 GLU 84 HG1 GLU 84 5.457 -10.964 -4.567 63 H ILE 85 HN ILE 85 2.521 -7.765 -6.201 64 HA ILE 85 HA ILE 85 2.464 -6.990 -3.442 65 HB ILE 85 HB ILE 85 1.304 -5.483 -5.776 66 HG12 ILE 85 HG12 ILE 85 4.119 -5.960 -4.851 67 HG13 ILE 85 HG11 ILE 85 3.495 -5.820 -6.495 68 HG21 ILE 85 HG21 ILE 85 0.881 -4.827 -3.296 69 HG22 ILE 85 HG22 ILE 85 1.501 -3.582 -4.370 70 HG23 ILE 85 HG23 ILE 85 2.589 -4.413 -3.257 71 HD11 ILE 85 HD11 ILE 85 2.961 -3.366 -5.850 72 HD12 ILE 85 HD12 ILE 85 4.642 -3.792 -6.171 73 HD13 ILE 85 HD13 ILE 85 4.073 -3.639 -4.508 74 H ARG 86 HN ARG 86 0.202 -8.261 -5.729 75 HA ARG 86 HA ARG 86 -2.227 -7.412 -4.557 76 HB2 ARG 86 HB2 ARG 86 -2.011 -8.435 -6.820 77 HB3 ARG 86 HB1 ARG 86 -1.636 -9.976 -6.053 78 HG2 ARG 86 HG2 ARG 86 -3.813 -9.995 -4.947 79 HG3 ARG 86 HG1 ARG 86 -4.196 -8.414 -5.634 80 HD2 ARG 86 HD2 ARG 86 -4.012 -9.348 -7.902 81 HD3 ARG 86 HD1 ARG 86 -3.608 -10.923 -7.231 82 HE ARG 86 HE ARG 86 -6.059 -10.098 -6.117 83 HH11 ARG 86 HH21 ARG 86 -4.652 -10.994 -9.148 84 HH12 ARG 86 HH22 ARG 86 -6.123 -11.633 -9.801 85 HH21 ARG 86 HH11 ARG 86 -7.994 -10.933 -6.968 86 HH22 ARG 86 HH12 ARG 86 -8.016 -11.599 -8.566 87 H GLU 87 HN GLU 87 -0.142 -10.228 -4.062 88 HA GLU 87 HA GLU 87 -1.738 -11.615 -2.204 89 HB2 GLU 87 HB2 GLU 87 0.252 -12.585 -3.319 90 HB3 GLU 87 HB1 GLU 87 1.288 -11.508 -2.383 91 HG2 GLU 87 HG2 GLU 87 0.483 -12.518 -0.293 92 HG3 GLU 87 HG1 GLU 87 -0.606 -13.564 -1.203 93 H ALA 88 HN ALA 88 0.675 -9.068 -1.827 94 HA ALA 88 HA ALA 88 0.772 -9.020 0.994 95 HB1 ALA 88 HB1 ALA 88 1.544 -7.209 -1.217 96 HB2 ALA 88 HB2 ALA 88 2.452 -7.692 0.217 97 HB3 ALA 88 HB3 ALA 88 1.230 -6.426 0.331 98 H PHE 89 HN PHE 89 -1.447 -7.561 -1.340 99 HA PHE 89 HA PHE 89 -2.796 -5.952 0.607 100 HB2 PHE 89 HB2 PHE 89 -3.354 -6.749 -2.226 101 HB3 PHE 89 HB1 PHE 89 -4.606 -5.962 -1.260 102 HD1 PHE 89 HD2 PHE 89 -3.793 -3.860 0.123 103 HD2 PHE 89 HD1 PHE 89 -1.818 -5.392 -3.371 104 HE1 PHE 89 HE2 PHE 89 -2.698 -1.662 -0.221 105 HE2 PHE 89 HE1 PHE 89 -0.718 -3.191 -3.713 106 HZ PHE 89 HZ PHE 89 -1.164 -1.332 -2.135 107 H ARG 90 HN ARG 90 -3.371 -9.092 -0.879 108 HA ARG 90 HA ARG 90 -5.841 -9.782 0.020 109 HB2 ARG 90 HB2 ARG 90 -3.412 -11.297 -0.591 110 HB3 ARG 90 HB1 ARG 90 -4.458 -12.115 0.563 111 HG2 ARG 90 HG2 ARG 90 -5.133 -12.808 -1.643 112 HG3 ARG 90 HG1 ARG 90 -6.383 -11.725 -1.040 113 HD2 ARG 90 HD2 ARG 90 -5.493 -9.884 -2.335 114 HD3 ARG 90 HD1 ARG 90 -4.083 -10.835 -2.790 115 HE ARG 90 HE ARG 90 -6.746 -11.035 -3.937 116 HH11 ARG 90 HH21 ARG 90 -3.639 -12.474 -3.433 117 HH12 ARG 90 HH22 ARG 90 -3.743 -13.517 -4.812 118 HH21 ARG 90 HH11 ARG 90 -6.890 -12.401 -5.750 119 HH22 ARG 90 HH12 ARG 90 -5.584 -13.475 -6.123 120 H VAL 91 HN VAL 91 -2.908 -9.666 2.027 121 HA VAL 91 HA VAL 91 -3.888 -10.983 4.282 122 HB VAL 91 HB VAL 91 -1.522 -10.153 3.943 123 HG11 VAL 91 HG11 VAL 91 -2.646 -7.736 3.516 124 HG12 VAL 91 HG12 VAL 91 -0.986 -7.938 4.070 125 HG13 VAL 91 HG13 VAL 91 -2.268 -7.592 5.229 126 HG21 VAL 91 HG21 VAL 91 -2.514 -10.955 6.158 127 HG22 VAL 91 HG22 VAL 91 -2.762 -9.257 6.569 128 HG23 VAL 91 HG23 VAL 91 -1.133 -9.874 6.304 129 H PHE 92 HN PHE 92 -4.526 -7.761 3.089 130 HA PHE 92 HA PHE 92 -6.029 -7.097 5.520 131 HB2 PHE 92 HB2 PHE 92 -5.541 -5.373 3.078 132 HB3 PHE 92 HB1 PHE 92 -6.111 -4.846 4.662 133 HD1 PHE 92 HD2 PHE 92 -4.511 -5.620 6.684 134 HD2 PHE 92 HD1 PHE 92 -3.271 -5.089 2.627 135 HE1 PHE 92 HE2 PHE 92 -2.163 -5.339 7.437 136 HE2 PHE 92 HE1 PHE 92 -0.923 -4.818 3.367 137 HZ PHE 92 HZ PHE 92 -0.371 -4.946 5.777 138 H ASP 93 HN ASP 93 -6.421 -7.931 2.141 139 HA ASP 93 HA ASP 93 -9.265 -7.342 2.126 140 HB2 ASP 93 HB2 ASP 93 -8.187 -8.941 -0.092 141 HB3 ASP 93 HB1 ASP 93 -9.047 -7.409 -0.123 142 H LYS 94 HN LYS 94 -9.262 -8.948 4.150 143 HA LYS 94 HA LYS 94 -9.100 -11.738 3.590 144 HB2 LYS 94 HB2 LYS 94 -10.038 -12.007 5.808 145 HB3 LYS 94 HB1 LYS 94 -8.797 -10.759 5.839 146 HG2 LYS 94 HG2 LYS 94 -10.565 -9.024 5.666 147 HG3 LYS 94 HG1 LYS 94 -11.792 -10.289 5.716 148 HD2 LYS 94 HD2 LYS 94 -10.901 -11.027 7.921 149 HD3 LYS 94 HD1 LYS 94 -9.770 -9.672 7.886 150 HE2 LYS 94 HE2 LYS 94 -12.790 -9.417 7.753 151 HE3 LYS 94 HE1 LYS 94 -11.814 -9.141 9.195 152 HZ1 LYS 94 HZ1 LYS 94 -10.642 -7.654 7.194 153 HZ2 LYS 94 HZ2 LYS 94 -11.558 -7.068 8.499 154 HZ3 LYS 94 HZ3 LYS 94 -12.309 -7.401 7.011 155 H ASP 95 HN ASP 95 -11.499 -9.347 3.109 156 HA ASP 95 HA ASP 95 -13.777 -11.107 3.173 157 HB2 ASP 95 HB2 ASP 95 -13.368 -8.305 2.121 158 HB3 ASP 95 HB1 ASP 95 -14.911 -9.153 2.028 159 H GLY 96 HN GLY 96 -11.398 -10.146 0.837 160 HA2 GLY 96 HA2 GLY 96 -10.948 -10.962 -1.270 161 HA3 GLY 96 HA1 GLY 96 -12.191 -12.180 -1.000 162 H ASN 97 HN ASN 97 -12.956 -8.805 -0.626 163 HA ASN 97 HA ASN 97 -14.814 -9.008 -2.881 164 HB2 ASN 97 HB2 ASN 97 -15.830 -6.992 -1.985 165 HB3 ASN 97 HB1 ASN 97 -15.616 -8.167 -0.688 166 HD21 ASN 97 HD21 ASN 97 -15.852 -5.557 0.145 167 HD22 ASN 97 HD22 ASN 97 -14.344 -4.937 0.619 168 H GLY 98 HN GLY 98 -11.684 -8.036 -2.426 169 HA2 GLY 98 HA2 GLY 98 -10.333 -7.151 -4.178 170 HA3 GLY 98 HA1 GLY 98 -11.771 -6.398 -4.865 171 H TYR 99 HN TYR 99 -12.025 -5.762 -1.695 172 HA TYR 99 HA TYR 99 -10.469 -3.247 -1.875 173 HB2 TYR 99 HB2 TYR 99 -13.210 -3.599 -0.649 174 HB3 TYR 99 HB1 TYR 99 -12.262 -2.111 -0.679 175 HD1 TYR 99 HD1 TYR 99 -13.552 -4.726 -3.020 176 HD2 TYR 99 HD2 TYR 99 -12.626 -0.583 -2.398 177 HE1 TYR 99 HE1 TYR 99 -14.409 -4.214 -5.279 178 HE2 TYR 99 HE2 TYR 99 -13.493 -0.059 -4.667 179 HH TYR 99 HH TYR 99 -13.844 -1.266 -6.828 180 H ILE 100 HN ILE 100 -9.918 -2.238 0.126 181 HA ILE 100 HA ILE 100 -9.802 -4.050 2.456 182 HB ILE 100 HB ILE 100 -7.516 -3.792 2.704 183 HG12 ILE 100 HG12 ILE 100 -7.870 -1.107 1.348 184 HG13 ILE 100 HG11 ILE 100 -7.470 -1.390 3.041 185 HG21 ILE 100 HG21 ILE 100 -7.584 -2.960 -0.192 186 HG22 ILE 100 HG22 ILE 100 -8.089 -4.584 0.303 187 HG23 ILE 100 HG23 ILE 100 -6.435 -4.036 0.608 188 HD11 ILE 100 HD11 ILE 100 -5.733 -1.815 0.612 189 HD12 ILE 100 HD12 ILE 100 -5.373 -2.587 2.157 190 HD13 ILE 100 HD13 ILE 100 -5.415 -0.829 2.036 191 H SER 101 HN SER 101 -10.143 -2.940 4.450 192 HA SER 101 HA SER 101 -11.593 -0.534 4.286 193 HB2 SER 101 HB2 SER 101 -10.179 -1.789 6.656 194 HB3 SER 101 HB1 SER 101 -11.316 -0.449 6.766 195 HG SER 101 HG SER 101 -12.648 -2.080 5.405 196 H ALA 102 HN ALA 102 -11.001 1.568 4.343 197 HA ALA 102 HA ALA 102 -8.336 2.331 3.794 198 HB1 ALA 102 HB1 ALA 102 -10.698 3.562 3.468 199 HB2 ALA 102 HB2 ALA 102 -9.173 4.441 3.509 200 HB3 ALA 102 HB3 ALA 102 -10.179 4.353 4.956 201 H ALA 103 HN ALA 103 -10.229 2.307 6.760 202 HA ALA 103 HA ALA 103 -8.470 3.740 8.413 203 HB1 ALA 103 HB1 ALA 103 -9.713 2.927 10.229 204 HB2 ALA 103 HB2 ALA 103 -10.075 1.404 9.418 205 HB3 ALA 103 HB3 ALA 103 -10.866 2.891 8.895 206 H GLU 104 HN GLU 104 -8.562 0.280 7.604 207 HA GLU 104 HA GLU 104 -6.515 -0.523 9.384 208 HB2 GLU 104 HB2 GLU 104 -7.769 -2.303 8.583 209 HB3 GLU 104 HB1 GLU 104 -7.772 -1.699 6.930 210 HG2 GLU 104 HG2 GLU 104 -5.175 -2.526 8.208 211 HG3 GLU 104 HG1 GLU 104 -6.264 -3.755 7.576 212 H LEU 105 HN LEU 105 -6.442 0.630 6.027 213 HA LEU 105 HA LEU 105 -3.739 0.075 5.491 214 HB2 LEU 105 HB2 LEU 105 -5.403 0.774 3.781 215 HB3 LEU 105 HB1 LEU 105 -5.393 2.395 4.470 216 HG LEU 105 HG LEU 105 -2.935 2.537 4.019 217 HD11 LEU 105 HD11 LEU 105 -3.449 -0.248 3.068 218 HD12 LEU 105 HD12 LEU 105 -2.056 0.410 3.903 219 HD13 LEU 105 HD13 LEU 105 -2.275 0.722 2.186 220 HD21 LEU 105 HD21 LEU 105 -5.085 2.381 2.034 221 HD22 LEU 105 HD22 LEU 105 -3.492 2.100 1.332 222 HD23 LEU 105 HD23 LEU 105 -3.815 3.592 2.216 223 H ARG 106 HN ARG 106 -5.260 3.018 6.816 224 HA ARG 106 HA ARG 106 -2.941 4.559 7.040 225 HB2 ARG 106 HB2 ARG 106 -5.217 5.459 7.351 226 HB3 ARG 106 HB1 ARG 106 -5.356 4.575 8.870 227 HG2 ARG 106 HG2 ARG 106 -2.928 6.235 8.660 228 HG3 ARG 106 HG1 ARG 106 -4.433 7.152 8.652 229 HD2 ARG 106 HD2 ARG 106 -3.626 5.097 10.733 230 HD3 ARG 106 HD1 ARG 106 -3.609 6.842 10.950 231 HE ARG 106 HE ARG 106 -5.945 5.120 10.966 232 HH11 ARG 106 HH21 ARG 106 -4.661 8.309 10.561 233 HH12 ARG 106 HH22 ARG 106 -6.146 9.105 10.963 234 HH21 ARG 106 HH11 ARG 106 -7.894 6.159 11.494 235 HH22 ARG 106 HH12 ARG 106 -7.975 7.889 11.491 236 H HIS 107 HN HIS 107 -4.435 2.413 9.517 237 HA HIS 107 HA HIS 107 -2.522 2.846 11.517 238 HB2 HIS 107 HB2 HIS 107 -4.613 1.787 12.035 239 HB3 HIS 107 HB1 HIS 107 -4.297 0.480 10.896 240 HD1 HIS 107 HD1 HIS 107 -2.657 1.959 14.017 241 HD2 HIS 107 HD2 HIS 107 -3.174 -1.715 12.109 242 HE1 HIS 107 HE1 HIS 107 -1.619 0.215 15.532 243 HE2 HIS 107 HE2 HIS 107 -1.919 -2.029 14.381 244 H VAL 108 HN VAL 108 -2.705 0.351 9.025 245 HA VAL 108 HA VAL 108 -0.414 -1.106 9.726 246 HB VAL 108 HB VAL 108 -1.913 -0.743 7.125 247 HG11 VAL 108 HG11 VAL 108 -0.720 -2.692 6.261 248 HG12 VAL 108 HG12 VAL 108 0.263 -2.773 7.714 249 HG13 VAL 108 HG13 VAL 108 0.438 -1.418 6.602 250 HG21 VAL 108 HG21 VAL 108 -2.837 -2.903 7.687 251 HG22 VAL 108 HG22 VAL 108 -2.984 -1.873 9.111 252 HG23 VAL 108 HG23 VAL 108 -1.710 -3.088 9.028 253 H MET 109 HN MET 109 -0.808 1.767 7.744 254 HA MET 109 HA MET 109 1.949 1.723 6.800 255 HB2 MET 109 HB2 MET 109 -0.421 3.490 6.386 256 HB3 MET 109 HB1 MET 109 1.185 4.155 6.084 257 HG2 MET 109 HG2 MET 109 -0.092 2.951 4.139 258 HG3 MET 109 HG1 MET 109 1.638 2.648 4.365 259 HE1 MET 109 HE1 MET 109 0.042 -0.617 3.094 260 HE2 MET 109 HE2 MET 109 1.710 -0.084 3.294 261 HE3 MET 109 HE3 MET 109 0.503 1.037 2.664 262 H THR 110 HN THR 110 0.267 3.009 9.526 263 HA THR 110 HA THR 110 2.532 4.810 10.088 264 HB THR 110 HB THR 110 1.081 5.883 11.708 265 HG1 THR 110 HG1 THR 110 -0.136 3.561 11.678 266 HG21 THR 110 HG21 THR 110 0.009 5.410 8.948 267 HG22 THR 110 HG22 THR 110 0.724 6.865 9.633 268 HG23 THR 110 HG23 THR 110 -0.910 6.389 10.088 269 H ASN 111 HN ASN 111 1.033 1.846 11.108 270 HA ASN 111 HA ASN 111 2.693 1.814 13.550 271 HB2 ASN 111 HB2 ASN 111 0.320 1.476 13.960 272 HB3 ASN 111 HB1 ASN 111 0.290 0.143 12.806 273 HD21 ASN 111 HD21 ASN 111 1.680 1.134 15.952 274 HD22 ASN 111 HD22 ASN 111 1.966 -0.449 16.496 275 H LEU 112 HN LEU 112 1.716 -0.314 10.840 276 HA LEU 112 HA LEU 112 3.873 -2.167 11.538 277 HB2 LEU 112 HB2 LEU 112 1.730 -2.344 9.424 278 HB3 LEU 112 HB1 LEU 112 2.865 -3.625 9.827 279 HG LEU 112 HG LEU 112 0.859 -2.393 11.743 280 HD11 LEU 112 HD11 LEU 112 0.512 -4.330 9.699 281 HD12 LEU 112 HD12 LEU 112 -0.630 -3.894 10.972 282 HD13 LEU 112 HD13 LEU 112 0.518 -5.207 11.229 283 HD21 LEU 112 HD21 LEU 112 3.107 -4.332 12.028 284 HD22 LEU 112 HD22 LEU 112 1.615 -4.723 12.880 285 HD23 LEU 112 HD23 LEU 112 2.443 -3.202 13.205 286 H GLY 113 HN GLY 113 5.563 -2.686 10.278 287 HA2 GLY 113 HA2 GLY 113 7.301 -2.365 8.806 288 HA3 GLY 113 HA1 GLY 113 6.036 -2.111 7.609 289 H GLU 114 HN GLU 114 8.742 -0.771 8.757 290 HA GLU 114 HA GLU 114 9.332 1.498 9.333 291 HB2 GLU 114 HB2 GLU 114 8.719 1.354 6.371 292 HB3 GLU 114 HB1 GLU 114 9.788 2.523 7.141 293 HG2 GLU 114 HG2 GLU 114 11.342 0.932 6.503 294 HG3 GLU 114 HG1 GLU 114 10.939 0.334 8.110 295 H LYS 115 HN LYS 115 7.607 2.336 10.605 296 HA LYS 115 HA LYS 115 5.134 3.174 9.833 297 HB2 LYS 115 HB2 LYS 115 7.021 4.602 11.720 298 HB3 LYS 115 HB1 LYS 115 5.273 4.831 11.657 299 HG2 LYS 115 HG2 LYS 115 4.940 2.441 12.190 300 HG3 LYS 115 HG1 LYS 115 6.687 2.216 12.263 301 HD2 LYS 115 HD2 LYS 115 6.822 3.875 14.093 302 HD3 LYS 115 HD1 LYS 115 5.070 4.072 14.035 303 HE2 LYS 115 HE2 LYS 115 4.782 1.683 14.582 304 HE3 LYS 115 HE1 LYS 115 6.532 1.484 14.638 305 HZ1 LYS 115 HZ1 LYS 115 6.706 2.710 16.549 306 HZ2 LYS 115 HZ2 LYS 115 5.214 1.939 16.804 307 HZ3 LYS 115 HZ3 LYS 115 5.260 3.557 16.286 308 H LEU 116 HN LEU 116 4.269 4.725 8.621 309 HA LEU 116 HA LEU 116 6.033 6.612 7.221 310 HB2 LEU 116 HB2 LEU 116 3.226 5.620 6.813 311 HB3 LEU 116 HB1 LEU 116 3.664 7.198 6.176 312 HG LEU 116 HG LEU 116 3.949 5.305 4.529 313 HD11 LEU 116 HD11 LEU 116 6.722 6.098 4.725 314 HD12 LEU 116 HD12 LEU 116 5.688 7.476 5.099 315 HD13 LEU 116 HD13 LEU 116 5.501 6.623 3.568 316 HD21 LEU 116 HD21 LEU 116 5.662 3.687 4.844 317 HD22 LEU 116 HD22 LEU 116 4.788 3.727 6.375 318 HD23 LEU 116 HD23 LEU 116 6.340 4.550 6.219 319 H THR 117 HN THR 117 5.394 8.945 7.163 320 HA THR 117 HA THR 117 4.420 9.758 9.800 321 HB THR 117 HB THR 117 5.312 11.960 9.230 322 HG1 THR 117 HG1 THR 117 5.024 11.029 6.768 323 HG21 THR 117 HG21 THR 117 7.345 11.231 9.851 324 HG22 THR 117 HG22 THR 117 7.615 10.500 8.269 325 HG23 THR 117 HG23 THR 117 6.795 9.585 9.534 326 H ASP 118 HN ASP 118 3.079 11.866 9.741 327 HA ASP 118 HA ASP 118 0.588 11.300 8.593 328 HB2 ASP 118 HB2 ASP 118 0.909 12.787 10.540 329 HB3 ASP 118 HB1 ASP 118 1.652 13.989 9.486 330 H GLU 119 HN GLU 119 3.195 13.450 7.476 331 HA GLU 119 HA GLU 119 1.781 14.576 5.307 332 HB2 GLU 119 HB2 GLU 119 3.866 15.535 6.176 333 HB3 GLU 119 HB1 GLU 119 4.759 14.126 5.613 334 HG2 GLU 119 HG2 GLU 119 4.136 14.628 3.292 335 HG3 GLU 119 HG1 GLU 119 3.171 16.000 3.835 336 H GLU 120 HN GLU 120 3.821 11.667 5.533 337 HA GLU 120 HA GLU 120 3.711 11.041 2.752 338 HB2 GLU 120 HB2 GLU 120 4.416 9.513 5.239 339 HB3 GLU 120 HB1 GLU 120 4.264 8.677 3.694 340 HG2 GLU 120 HG2 GLU 120 6.594 9.634 4.407 341 HG3 GLU 120 HG1 GLU 120 6.056 9.835 2.742 342 H VAL 121 HN VAL 121 1.891 9.899 5.574 343 HA VAL 121 HA VAL 121 0.218 8.072 4.190 344 HB VAL 121 HB VAL 121 -0.173 9.589 6.795 345 HG11 VAL 121 HG11 VAL 121 -1.840 7.455 5.455 346 HG12 VAL 121 HG12 VAL 121 -2.375 9.017 6.077 347 HG13 VAL 121 HG13 VAL 121 -1.897 7.740 7.194 348 HG21 VAL 121 HG21 VAL 121 0.063 6.760 7.074 349 HG22 VAL 121 HG22 VAL 121 1.184 7.997 7.640 350 HG23 VAL 121 HG23 VAL 121 1.372 7.300 6.030 351 H ASP 122 HN ASP 122 -0.246 11.534 5.012 352 HA ASP 122 HA ASP 122 -2.906 11.749 4.188 353 HB2 ASP 122 HB2 ASP 122 -0.637 13.745 4.080 354 HB3 ASP 122 HB1 ASP 122 -2.300 14.162 3.669 355 H GLU 123 HN GLU 123 0.088 11.860 2.331 356 HA GLU 123 HA GLU 123 -1.055 12.525 -0.174 357 HB2 GLU 123 HB2 GLU 123 1.377 12.644 0.303 358 HB3 GLU 123 HB1 GLU 123 1.426 10.886 0.418 359 HG2 GLU 123 HG2 GLU 123 2.149 11.578 -1.810 360 HG3 GLU 123 HG1 GLU 123 0.607 10.739 -1.932 361 H MET 124 HN MET 124 -0.541 9.496 1.554 362 HA MET 124 HA MET 124 -1.301 7.750 -0.584 363 HB2 MET 124 HB2 MET 124 -1.208 7.343 2.423 364 HB3 MET 124 HB1 MET 124 -1.457 6.061 1.241 365 HG2 MET 124 HG2 MET 124 0.698 6.523 0.218 366 HG3 MET 124 HG1 MET 124 0.923 7.910 1.270 367 HE1 MET 124 HE1 MET 124 0.598 4.287 0.777 368 HE2 MET 124 HE2 MET 124 -0.439 4.192 2.198 369 HE3 MET 124 HE3 MET 124 1.175 3.486 2.242 370 H ILE 125 HN ILE 125 -2.998 9.250 2.146 371 HA ILE 125 HA ILE 125 -5.430 7.879 1.942 372 HB ILE 125 HB ILE 125 -4.434 10.252 3.271 373 HG12 ILE 125 HG12 ILE 125 -5.913 9.399 5.074 374 HG13 ILE 125 HG11 ILE 125 -6.535 8.198 3.955 375 HG21 ILE 125 HG21 ILE 125 -6.131 11.477 2.104 376 HG22 ILE 125 HG22 ILE 125 -6.707 11.185 3.741 377 HG23 ILE 125 HG23 ILE 125 -7.324 10.214 2.409 378 HD11 ILE 125 HD11 ILE 125 -4.443 7.738 5.615 379 HD12 ILE 125 HD12 ILE 125 -3.593 8.302 4.181 380 HD13 ILE 125 HD13 ILE 125 -4.661 6.908 4.075 381 H ARG 126 HN ARG 126 -4.244 10.740 0.258 382 HA ARG 126 HA ARG 126 -6.695 11.397 -1.032 383 HB2 ARG 126 HB2 ARG 126 -3.819 12.046 -1.696 384 HB3 ARG 126 HB1 ARG 126 -5.195 12.692 -2.592 385 HG2 ARG 126 HG2 ARG 126 -6.078 13.732 -0.573 386 HG3 ARG 126 HG1 ARG 126 -4.803 12.998 0.400 387 HD2 ARG 126 HD2 ARG 126 -4.219 15.318 -0.097 388 HD3 ARG 126 HD1 ARG 126 -3.108 14.235 -0.931 389 HE ARG 126 HE ARG 126 -5.317 14.892 -2.609 390 HH11 ARG 126 HH21 ARG 126 -2.392 16.130 -1.239 391 HH12 ARG 126 HH22 ARG 126 -2.095 17.246 -2.531 392 HH21 ARG 126 HH11 ARG 126 -4.936 16.351 -4.308 393 HH22 ARG 126 HH12 ARG 126 -3.536 17.371 -4.268 394 H GLU 127 HN GLU 127 -4.190 9.087 -1.681 395 HA GLU 127 HA GLU 127 -5.214 8.572 -4.390 396 HB2 GLU 127 HB2 GLU 127 -2.833 7.398 -2.934 397 HB3 GLU 127 HB1 GLU 127 -3.268 7.080 -4.614 398 HG2 GLU 127 HG2 GLU 127 -2.680 9.836 -3.498 399 HG3 GLU 127 HG1 GLU 127 -1.508 8.847 -4.367 400 H ALA 128 HN ALA 128 -5.648 7.508 -1.221 401 HA ALA 128 HA ALA 128 -6.134 4.721 -1.774 402 HB1 ALA 128 HB1 ALA 128 -7.338 5.924 0.643 403 HB2 ALA 128 HB2 ALA 128 -5.596 6.124 0.481 404 HB3 ALA 128 HB3 ALA 128 -6.292 4.516 0.481 405 H ASP 129 HN ASP 129 -8.397 7.218 -0.543 406 HA ASP 129 HA ASP 129 -10.378 7.331 -2.336 407 HB2 ASP 129 HB2 ASP 129 -10.387 4.600 -1.136 408 HB3 ASP 129 HB1 ASP 129 -11.945 5.385 -1.345 409 H ILE 130 HN ILE 130 -11.614 5.692 0.422 410 HA ILE 130 HA ILE 130 -12.794 6.352 2.241 411 HB ILE 130 HB ILE 130 -11.069 8.836 2.139 412 HG12 ILE 130 HG12 ILE 130 -10.642 6.287 3.722 413 HG13 ILE 130 HG11 ILE 130 -9.847 6.597 2.179 414 HG21 ILE 130 HG21 ILE 130 -12.253 9.442 3.963 415 HG22 ILE 130 HG22 ILE 130 -11.757 7.951 4.761 416 HG23 ILE 130 HG23 ILE 130 -13.245 7.990 3.817 417 HD11 ILE 130 HD11 ILE 130 -8.594 7.246 4.366 418 HD12 ILE 130 HD12 ILE 130 -9.694 8.623 4.402 419 HD13 ILE 130 HD13 ILE 130 -8.609 8.398 3.031 420 H ASP 131 HN ASP 131 -12.691 9.645 2.214 421 HA ASP 131 HA ASP 131 -14.100 11.326 1.496 422 HB2 ASP 131 HB2 ASP 131 -13.968 9.883 -0.733 423 HB3 ASP 131 HB1 ASP 131 -15.630 9.492 -0.300 424 H GLY 132 HN GLY 132 -15.240 8.175 2.364 425 HA2 GLY 132 HA2 GLY 132 -17.007 9.051 4.353 426 HA3 GLY 132 HA1 GLY 132 -17.955 8.745 2.899 427 H ASP 133 HN ASP 133 -17.392 6.590 1.805 428 HA ASP 133 HA ASP 133 -18.198 4.488 3.326 429 HB2 ASP 133 HB2 ASP 133 -16.383 4.495 0.915 430 HB3 ASP 133 HB1 ASP 133 -17.019 3.011 1.623 431 H GLY 134 HN GLY 134 -14.874 5.618 2.927 432 HA2 GLY 134 HA2 GLY 134 -13.053 5.271 4.306 433 HA3 GLY 134 HA1 GLY 134 -14.116 4.403 5.406 434 H GLN 135 HN GLN 135 -13.838 3.501 2.032 435 HA GLN 135 HA GLN 135 -12.263 1.127 2.834 436 HB2 GLN 135 HB2 GLN 135 -14.297 1.161 0.601 437 HB3 GLN 135 HB1 GLN 135 -13.454 -0.229 1.290 438 HG2 GLN 135 HG2 GLN 135 -15.468 1.512 2.737 439 HG3 GLN 135 HG1 GLN 135 -15.749 -0.125 2.145 440 HE21 GLN 135 HE21 GLN 135 -15.111 1.484 4.954 441 HE22 GLN 135 HE22 GLN 135 -14.257 0.279 5.789 442 H VAL 136 HN VAL 136 -10.723 0.392 1.309 443 HA VAL 136 HA VAL 136 -10.139 2.291 -0.867 444 HB VAL 136 HB VAL 136 -8.290 1.115 1.188 445 HG11 VAL 136 HG11 VAL 136 -6.519 2.322 -0.249 446 HG12 VAL 136 HG12 VAL 136 -7.708 2.252 -1.548 447 HG13 VAL 136 HG13 VAL 136 -7.093 0.758 -0.831 448 HG21 VAL 136 HG21 VAL 136 -8.514 3.947 0.203 449 HG22 VAL 136 HG22 VAL 136 -7.864 3.366 1.737 450 HG23 VAL 136 HG23 VAL 136 -9.599 3.328 1.440 451 H ASN 137 HN ASN 137 -9.654 1.468 -2.789 452 HA ASN 137 HA ASN 137 -9.697 -1.445 -3.076 453 HB2 ASN 137 HB2 ASN 137 -10.026 -1.009 -5.449 454 HB3 ASN 137 HB1 ASN 137 -11.154 -0.026 -4.519 455 HD21 ASN 137 HD21 ASN 137 -10.180 0.604 -7.228 456 HD22 ASN 137 HD22 ASN 137 -9.352 2.080 -7.109 457 H TYR 138 HN TYR 138 -7.712 -2.388 -2.897 458 HA TYR 138 HA TYR 138 -5.276 -1.012 -3.147 459 HB2 TYR 138 HB2 TYR 138 -4.207 -3.224 -3.180 460 HB3 TYR 138 HB1 TYR 138 -5.415 -3.096 -1.906 461 HD1 TYR 138 HD1 TYR 138 -4.722 -4.481 -5.283 462 HD2 TYR 138 HD2 TYR 138 -7.392 -4.458 -1.929 463 HE1 TYR 138 HE1 TYR 138 -5.895 -6.466 -6.198 464 HE2 TYR 138 HE2 TYR 138 -8.560 -6.436 -2.823 465 HH TYR 138 HH TYR 138 -8.668 -7.376 -5.650 466 H GLU 139 HN GLU 139 -7.368 -2.005 -5.620 467 HA GLU 139 HA GLU 139 -5.565 -2.821 -7.613 468 HB2 GLU 139 HB2 GLU 139 -8.016 -2.976 -7.858 469 HB3 GLU 139 HB1 GLU 139 -8.114 -1.219 -7.956 470 HG2 GLU 139 HG2 GLU 139 -6.736 -1.227 -9.984 471 HG3 GLU 139 HG1 GLU 139 -6.548 -2.976 -9.869 472 H GLU 140 HN GLU 140 -6.794 0.471 -6.892 473 HA GLU 140 HA GLU 140 -5.290 1.808 -8.836 474 HB2 GLU 140 HB2 GLU 140 -7.162 2.843 -7.614 475 HB3 GLU 140 HB1 GLU 140 -6.209 2.826 -6.133 476 HG2 GLU 140 HG2 GLU 140 -6.112 5.045 -7.172 477 HG3 GLU 140 HG1 GLU 140 -4.521 4.296 -7.221 478 H PHE 141 HN PHE 141 -4.490 1.035 -5.466 479 HA PHE 141 HA PHE 141 -2.023 2.423 -5.387 480 HB2 PHE 141 HB2 PHE 141 -3.306 0.289 -3.785 481 HB3 PHE 141 HB1 PHE 141 -1.546 0.339 -3.716 482 HD1 PHE 141 HD2 PHE 141 -0.561 2.831 -3.534 483 HD2 PHE 141 HD1 PHE 141 -4.469 1.605 -2.224 484 HE1 PHE 141 HE2 PHE 141 -0.641 4.752 -1.970 485 HE2 PHE 141 HE1 PHE 141 -4.529 3.512 -0.652 486 HZ PHE 141 HZ PHE 141 -2.628 5.092 -0.530 487 H VAL 142 HN VAL 142 -2.825 -0.898 -6.362 488 HA VAL 142 HA VAL 142 -0.157 -1.713 -6.841 489 HB VAL 142 HB VAL 142 -2.808 -2.703 -7.885 490 HG11 VAL 142 HG11 VAL 142 -1.323 -4.727 -8.554 491 HG12 VAL 142 HG12 VAL 142 0.015 -3.578 -8.509 492 HG13 VAL 142 HG13 VAL 142 -1.327 -3.327 -9.627 493 HG21 VAL 142 HG21 VAL 142 -2.250 -3.056 -5.493 494 HG22 VAL 142 HG22 VAL 142 -0.727 -3.807 -5.970 495 HG23 VAL 142 HG23 VAL 142 -2.259 -4.585 -6.375 496 H GLN 143 HN GLN 143 -2.592 -0.176 -8.888 497 HA GLN 143 HA GLN 143 -1.121 -0.300 -11.306 498 HB2 GLN 143 HB2 GLN 143 -3.251 1.617 -10.342 499 HB3 GLN 143 HB1 GLN 143 -2.574 1.661 -11.971 500 HG2 GLN 143 HG2 GLN 143 -3.307 -0.585 -12.419 501 HG3 GLN 143 HG1 GLN 143 -3.794 -0.815 -10.742 502 HE21 GLN 143 HE21 GLN 143 -5.491 -0.960 -13.187 503 HE22 GLN 143 HE22 GLN 143 -6.716 0.192 -12.964 504 H MET 144 HN MET 144 -1.216 2.048 -8.666 505 HA MET 144 HA MET 144 0.445 4.032 -9.793 506 HB2 MET 144 HB2 MET 144 0.037 3.149 -6.922 507 HB3 MET 144 HB1 MET 144 0.976 4.565 -7.373 508 HG2 MET 144 HG2 MET 144 -0.906 5.697 -8.218 509 HG3 MET 144 HG1 MET 144 -1.846 4.214 -8.360 510 HE1 MET 144 HE1 MET 144 -0.084 6.684 -6.099 511 HE2 MET 144 HE2 MET 144 0.403 5.248 -5.201 512 HE3 MET 144 HE3 MET 144 -0.716 6.397 -4.469 513 H MET 145 HN MET 145 1.157 1.149 -7.864 514 HA MET 145 HA MET 145 3.986 1.482 -7.828 515 HB2 MET 145 HB2 MET 145 2.221 -0.935 -7.330 516 HB3 MET 145 HB1 MET 145 3.950 -0.850 -6.967 517 HG2 MET 145 HG2 MET 145 3.611 0.921 -5.380 518 HG3 MET 145 HG1 MET 145 1.933 1.116 -5.878 519 HE1 MET 145 HE1 MET 145 2.375 0.581 -2.601 520 HE2 MET 145 HE2 MET 145 0.814 -0.230 -2.698 521 HE3 MET 145 HE3 MET 145 1.142 1.149 -3.735 522 H THR 146 HN THR 146 1.798 0.259 -10.204 523 HA THR 146 HA THR 146 4.059 -0.984 -11.655 524 HB THR 146 HB THR 146 2.386 -2.412 -12.762 525 HG1 THR 146 HG1 THR 146 0.577 -1.129 -12.603 526 HG21 THR 146 HG21 THR 146 1.535 -3.285 -10.262 527 HG22 THR 146 HG22 THR 146 3.028 -2.414 -9.912 528 HG23 THR 146 HG23 THR 146 3.038 -3.750 -11.062 529 H ALA 147 HN ALA 147 2.782 1.838 -11.575 530 HA ALA 147 HA ALA 147 2.536 2.107 -14.511 531 HB1 ALA 147 HB1 ALA 147 1.008 3.657 -12.406 532 HB2 ALA 147 HB2 ALA 147 0.330 2.439 -13.486 533 HB3 ALA 147 HB3 ALA 147 0.947 3.954 -14.142 534 H LYS 148 HN LYS 148 4.988 2.269 -13.390 535 HA LYS 148 HA LYS 148 5.578 5.040 -12.716 536 HB2 LYS 148 HB2 LYS 148 6.746 2.551 -12.124 537 HB3 LYS 148 HB1 LYS 148 7.895 3.373 -13.178 538 HG2 LYS 148 HG2 LYS 148 8.388 3.992 -10.883 539 HG3 LYS 148 HG1 LYS 148 7.724 5.396 -11.713 540 HD2 LYS 148 HD2 LYS 148 5.835 5.421 -10.435 541 HD3 LYS 148 HD1 LYS 148 5.718 3.663 -10.388 542 HE2 LYS 148 HE2 LYS 148 6.222 4.590 -8.153 543 HE3 LYS 148 HE1 LYS 148 7.542 3.577 -8.737 544 HZ1 LYS 148 HZ1 LYS 148 7.451 6.531 -9.009 545 HZ2 LYS 148 HZ2 LYS 148 8.750 5.512 -9.408 546 HZ3 LYS 148 HZ3 LYS 148 8.288 5.709 -7.785 547 H PHE 30 HT1 PHE 30 -9.401 -4.157 13.156 548 HA PHE 30 HA PHE 30 -8.846 -3.717 10.273 549 HB2 PHE 30 HB2 PHE 30 -6.918 -4.952 12.199 550 HB3 PHE 30 HB1 PHE 30 -6.597 -4.023 10.734 551 HD1 PHE 30 HD2 PHE 30 -7.921 -1.551 10.953 552 HD2 PHE 30 HD1 PHE 30 -6.145 -3.857 14.113 553 HE1 PHE 30 HE2 PHE 30 -7.657 0.509 12.309 554 HE2 PHE 30 HE1 PHE 30 -5.882 -1.799 15.467 555 HZ PHE 30 HZ PHE 30 -6.636 0.384 14.566 556 H ASP 31 HN ASP 31 -9.037 -5.973 13.014 557 HA ASP 31 HA ASP 31 -9.448 -8.231 13.115 558 HB2 ASP 31 HB2 ASP 31 -11.046 -7.482 10.662 559 HB3 ASP 31 HB1 ASP 31 -11.120 -9.066 11.430 560 H ILE 32 HN ILE 32 -6.980 -7.606 11.997 561 HA ILE 32 HA ILE 32 -6.682 -9.701 9.919 562 HB ILE 32 HB ILE 32 -4.902 -8.471 8.934 563 HG12 ILE 32 HG12 ILE 32 -5.040 -6.785 11.444 564 HG13 ILE 32 HG11 ILE 32 -3.670 -7.724 10.834 565 HG21 ILE 32 HG21 ILE 32 -6.065 -6.693 8.065 566 HG22 ILE 32 HG22 ILE 32 -6.625 -6.149 9.648 567 HG23 ILE 32 HG23 ILE 32 -7.398 -7.529 8.862 568 HD11 ILE 32 HD11 ILE 32 -4.802 -5.154 9.732 569 HD12 ILE 32 HD12 ILE 32 -3.798 -6.228 8.763 570 HD13 ILE 32 HD13 ILE 32 -3.145 -5.508 10.227 571 H ASP 33 HN ASP 33 -4.558 -10.794 9.974 572 HA ASP 33 HA ASP 33 -3.868 -11.462 12.707 573 HB2 ASP 33 HB2 ASP 33 -2.931 -12.490 10.023 574 HB3 ASP 33 HB1 ASP 33 -2.262 -13.055 11.553 575 H MET 34 HN MET 34 -3.034 -9.354 13.294 576 HA MET 34 HA MET 34 -0.822 -8.174 11.966 577 HB2 MET 34 HB2 MET 34 -1.857 -7.832 14.787 578 HB3 MET 34 HB1 MET 34 -0.583 -6.844 14.074 579 HG2 MET 34 HG2 MET 34 -2.172 -6.252 12.218 580 HG3 MET 34 HG1 MET 34 -3.433 -7.121 13.086 581 HE1 MET 34 HE1 MET 34 -1.734 -3.311 13.031 582 HE2 MET 34 HE2 MET 34 -0.705 -4.727 13.172 583 HE3 MET 34 HE3 MET 34 -0.935 -3.677 14.564 584 H ASP 35 HN ASP 35 -1.112 -10.618 14.449 585 HA ASP 35 HA ASP 35 1.630 -10.485 15.296 586 HB2 ASP 35 HB2 ASP 35 1.122 -12.471 16.587 587 HB3 ASP 35 HB1 ASP 35 -0.209 -11.326 16.741 588 H ALA 36 HN ALA 36 0.348 -11.451 12.429 589 HA ALA 36 HA ALA 36 1.994 -13.820 12.059 590 HB1 ALA 36 HB1 ALA 36 0.123 -12.328 10.229 591 HB2 ALA 36 HB2 ALA 36 -0.148 -13.889 11.003 592 HB3 ALA 36 HB3 ALA 36 1.059 -13.734 9.727 593 HA PRO 37 HA PRO 37 5.500 -11.127 10.874 594 HB2 PRO 37 HB2 PRO 37 6.320 -13.703 9.576 595 HB3 PRO 37 HB1 PRO 37 7.284 -12.584 10.561 596 HG2 PRO 37 HG2 PRO 37 6.403 -14.840 11.595 597 HG3 PRO 37 HG1 PRO 37 6.379 -13.342 12.545 598 HD2 PRO 37 HD2 PRO 37 4.099 -14.786 11.251 599 HD3 PRO 37 HD1 PRO 37 4.145 -13.846 12.762 600 H GLU 38 HN GLU 38 3.660 -13.235 8.747 601 HA GLU 38 HA GLU 38 4.630 -12.355 6.259 602 HB2 GLU 38 HB2 GLU 38 1.918 -13.421 7.071 603 HB3 GLU 38 HB1 GLU 38 2.403 -13.148 5.397 604 HG2 GLU 38 HG2 GLU 38 3.958 -14.891 7.324 605 HG3 GLU 38 HG1 GLU 38 2.746 -15.517 6.208 606 H THR 39 HN THR 39 2.057 -11.086 8.345 607 HA THR 39 HA THR 39 1.067 -9.161 6.525 608 HB THR 39 HB THR 39 1.077 -9.082 9.555 609 HG1 THR 39 HG1 THR 39 -0.895 -10.068 9.356 610 HG21 THR 39 HG21 THR 39 -1.091 -7.710 8.937 611 HG22 THR 39 HG22 THR 39 -0.239 -7.432 7.419 612 HG23 THR 39 HG23 THR 39 0.482 -6.914 8.943 613 H GLU 40 HN GLU 40 3.604 -9.025 8.995 614 HA GLU 40 HA GLU 40 4.184 -6.277 8.801 615 HB2 GLU 40 HB2 GLU 40 5.028 -7.743 10.606 616 HB3 GLU 40 HB1 GLU 40 6.069 -8.557 9.439 617 HG2 GLU 40 HG2 GLU 40 7.361 -6.868 10.636 618 HG3 GLU 40 HG1 GLU 40 7.177 -6.375 8.958 619 H ARG 41 HN ARG 41 5.470 -9.079 7.028 620 HA ARG 41 HA ARG 41 7.383 -7.659 5.511 621 HB2 ARG 41 HB2 ARG 41 5.880 -10.229 4.976 622 HB3 ARG 41 HB1 ARG 41 7.142 -9.618 3.910 623 HG2 ARG 41 HG2 ARG 41 7.727 -9.865 6.842 624 HG3 ARG 41 HG1 ARG 41 7.742 -11.320 5.847 625 HD2 ARG 41 HD2 ARG 41 9.332 -8.815 5.211 626 HD3 ARG 41 HD1 ARG 41 9.988 -10.221 6.038 627 HE ARG 41 HE ARG 41 8.849 -11.176 3.694 628 HH11 ARG 41 HH21 ARG 41 11.291 -8.916 4.646 629 HH12 ARG 41 HH22 ARG 41 12.256 -9.151 3.227 630 HH21 ARG 41 HH11 ARG 41 10.110 -11.490 1.832 631 HH22 ARG 41 HH12 ARG 41 11.587 -10.609 1.634 632 H ALA 42 HN ALA 42 3.971 -8.401 4.953 633 HA ALA 42 HA ALA 42 3.800 -7.395 2.321 634 HB1 ALA 42 HB1 ALA 42 1.397 -7.331 2.691 635 HB2 ALA 42 HB2 ALA 42 1.633 -7.434 4.436 636 HB3 ALA 42 HB3 ALA 42 2.057 -8.801 3.407 637 H ALA 43 HN ALA 43 3.400 -5.861 5.488 638 HA ALA 43 HA ALA 43 2.510 -3.344 4.585 639 HB1 ALA 43 HB1 ALA 43 2.783 -2.639 6.768 640 HB2 ALA 43 HB2 ALA 43 4.282 -3.542 6.991 641 HB3 ALA 43 HB3 ALA 43 2.733 -4.385 7.012 642 H VAL 44 HN VAL 44 5.755 -4.645 5.147 643 HA VAL 44 HA VAL 44 7.199 -2.266 4.688 644 HB VAL 44 HB VAL 44 7.969 -5.172 4.413 645 HG11 VAL 44 HG11 VAL 44 9.459 -2.654 3.836 646 HG12 VAL 44 HG12 VAL 44 9.637 -4.254 3.117 647 HG13 VAL 44 HG13 VAL 44 10.324 -3.921 4.707 648 HG21 VAL 44 HG21 VAL 44 8.639 -5.028 6.609 649 HG22 VAL 44 HG22 VAL 44 7.383 -3.791 6.656 650 HG23 VAL 44 HG23 VAL 44 9.074 -3.324 6.472 651 H ALA 45 HN ALA 45 6.308 -4.913 2.467 652 HA ALA 45 HA ALA 45 7.703 -3.965 0.221 653 HB1 ALA 45 HB1 ALA 45 6.976 -6.079 -0.201 654 HB2 ALA 45 HB2 ALA 45 5.620 -5.223 -0.935 655 HB3 ALA 45 HB3 ALA 45 5.480 -5.859 0.704 656 H ILE 46 HN ILE 46 4.368 -3.324 1.284 657 HA ILE 46 HA ILE 46 3.610 -1.783 -0.957 658 HB ILE 46 HB ILE 46 2.639 -1.760 1.907 659 HG12 ILE 46 HG12 ILE 46 1.340 -2.840 -0.609 660 HG13 ILE 46 HG11 ILE 46 2.337 -3.829 0.458 661 HG21 ILE 46 HG21 ILE 46 0.610 -0.626 0.816 662 HG22 ILE 46 HG22 ILE 46 1.672 -0.293 -0.549 663 HG23 ILE 46 HG23 ILE 46 2.042 0.379 1.035 664 HD11 ILE 46 HD11 ILE 46 -0.131 -3.976 0.943 665 HD12 ILE 46 HD12 ILE 46 -0.088 -2.270 1.390 666 HD13 ILE 46 HD13 ILE 46 0.840 -3.449 2.318 667 H GLN 47 HN GLN 47 4.929 -0.846 2.200 668 HA GLN 47 HA GLN 47 4.935 1.947 1.750 669 HB2 GLN 47 HB2 GLN 47 6.557 0.185 3.588 670 HB3 GLN 47 HB1 GLN 47 6.618 1.947 3.622 671 HG2 GLN 47 HG2 GLN 47 4.212 2.051 4.080 672 HG3 GLN 47 HG1 GLN 47 4.098 0.295 3.962 673 HE21 GLN 47 HE21 GLN 47 3.269 0.584 6.304 674 HE22 GLN 47 HE22 GLN 47 4.436 0.630 7.533 675 H SER 48 HN SER 48 7.396 -0.558 1.203 676 HA SER 48 HA SER 48 9.537 1.150 0.565 677 HB2 SER 48 HB2 SER 48 9.844 -1.244 0.988 678 HB3 SER 48 HB1 SER 48 8.938 -1.633 -0.471 679 HG SER 48 HG SER 48 11.482 -1.261 -0.319 680 H GLN 49 HN GLN 49 7.089 -0.372 -1.515 681 HA GLN 49 HA GLN 49 8.063 0.722 -3.948 682 HB2 GLN 49 HB2 GLN 49 5.318 -0.281 -3.151 683 HB3 GLN 49 HB1 GLN 49 5.754 0.182 -4.794 684 HG2 GLN 49 HG2 GLN 49 7.157 -1.958 -3.167 685 HG3 GLN 49 HG1 GLN 49 5.962 -2.269 -4.421 686 HE21 GLN 49 HE21 GLN 49 9.136 -2.571 -4.075 687 HE22 GLN 49 HE22 GLN 49 9.692 -2.067 -5.597 688 H PHE 50 HN PHE 50 5.738 1.811 -1.539 689 HA PHE 50 HA PHE 50 4.703 4.010 -2.937 690 HB2 PHE 50 HB2 PHE 50 3.648 3.163 -0.897 691 HB3 PHE 50 HB1 PHE 50 5.052 3.652 0.050 692 HD1 PHE 50 HD1 PHE 50 2.761 5.171 -2.520 693 HD2 PHE 50 HD2 PHE 50 4.850 5.675 1.209 694 HE1 PHE 50 HE1 PHE 50 1.858 7.466 -2.324 695 HE2 PHE 50 HE2 PHE 50 3.939 7.976 1.398 696 HZ PHE 50 HZ PHE 50 2.445 8.868 -0.367 697 H ARG 51 HN ARG 51 7.577 3.696 -0.897 698 HA ARG 51 HA ARG 51 8.272 6.408 -0.728 699 HB2 ARG 51 HB2 ARG 51 9.374 4.628 0.585 700 HB3 ARG 51 HB1 ARG 51 10.123 4.015 -0.890 701 HG2 ARG 51 HG2 ARG 51 11.327 6.109 -1.206 702 HG3 ARG 51 HG1 ARG 51 10.499 6.830 0.175 703 HD2 ARG 51 HD2 ARG 51 12.264 4.373 0.345 704 HD3 ARG 51 HD1 ARG 51 12.809 6.007 0.710 705 HE ARG 51 HE ARG 51 10.522 5.542 2.250 706 HH11 ARG 51 HH21 ARG 51 13.730 4.305 1.852 707 HH12 ARG 51 HH22 ARG 51 13.892 3.805 3.502 708 HH21 ARG 51 HH11 ARG 51 10.728 4.889 4.417 709 HH22 ARG 51 HH12 ARG 51 12.192 4.137 4.954 710 H LYS 52 HN LYS 52 9.016 3.972 -3.198 711 HA LYS 52 HA LYS 52 10.727 5.551 -4.789 712 HB2 LYS 52 HB2 LYS 52 10.441 3.094 -5.025 713 HB3 LYS 52 HB1 LYS 52 8.836 3.364 -5.701 714 HG2 LYS 52 HG2 LYS 52 9.872 4.749 -7.509 715 HG3 LYS 52 HG1 LYS 52 11.461 4.351 -6.864 716 HD2 LYS 52 HD2 LYS 52 9.479 2.219 -7.686 717 HD3 LYS 52 HD1 LYS 52 10.625 2.922 -8.826 718 HE2 LYS 52 HE2 LYS 52 12.478 2.272 -7.232 719 HE3 LYS 52 HE1 LYS 52 11.276 1.392 -6.290 720 HZ1 LYS 52 HZ1 LYS 52 11.092 -0.208 -7.832 721 HZ2 LYS 52 HZ2 LYS 52 12.649 0.305 -8.280 722 HZ3 LYS 52 HZ3 LYS 52 11.290 0.854 -9.139 723 H PHE 53 HN PHE 53 7.219 5.177 -4.726 724 HA PHE 53 HA PHE 53 6.573 6.621 -7.043 725 HB2 PHE 53 HB2 PHE 53 4.997 5.217 -5.688 726 HB3 PHE 53 HB1 PHE 53 4.964 6.506 -4.485 727 HD1 PHE 53 HD1 PHE 53 4.042 5.554 -7.929 728 HD2 PHE 53 HD2 PHE 53 3.841 8.619 -4.924 729 HE1 PHE 53 HE1 PHE 53 2.318 6.741 -9.257 730 HE2 PHE 53 HE2 PHE 53 2.115 9.805 -6.253 731 HZ PHE 53 HZ PHE 53 1.354 8.868 -8.419 732 H GLN 54 HN GLN 54 7.186 7.688 -3.731 733 HA GLN 54 HA GLN 54 6.376 10.367 -3.999 734 HB2 GLN 54 HB2 GLN 54 8.463 9.079 -2.233 735 HB3 GLN 54 HB1 GLN 54 7.972 10.766 -2.088 736 HG2 GLN 54 HG2 GLN 54 5.684 10.125 -1.629 737 HG3 GLN 54 HG1 GLN 54 6.051 8.430 -1.952 738 HE21 GLN 54 HE21 GLN 54 8.679 9.898 -0.372 739 HE22 GLN 54 HE22 GLN 54 8.319 9.396 1.208 740 H LYS 55 HN LYS 55 9.456 8.769 -4.702 741 HA LYS 55 HA LYS 55 10.997 11.072 -5.171 742 HB2 LYS 55 HB2 LYS 55 11.186 8.264 -6.270 743 HB3 LYS 55 HB1 LYS 55 12.380 9.513 -6.624 744 HG2 LYS 55 HG2 LYS 55 11.626 9.041 -3.765 745 HG3 LYS 55 HG1 LYS 55 12.696 7.880 -4.550 746 HD2 LYS 55 HD2 LYS 55 13.291 10.801 -4.861 747 HD3 LYS 55 HD1 LYS 55 13.686 10.020 -3.331 748 HE2 LYS 55 HE2 LYS 55 14.516 8.804 -5.963 749 HE3 LYS 55 HE1 LYS 55 15.504 10.029 -5.170 750 HZ1 LYS 55 HZ1 LYS 55 16.179 7.797 -4.537 751 HZ2 LYS 55 HZ2 LYS 55 14.618 7.470 -3.951 752 HZ3 LYS 55 HZ3 LYS 55 15.583 8.648 -3.196 753 H LYS 56 HN LYS 56 8.869 9.207 -7.302 754 HA LYS 56 HA LYS 56 9.525 10.482 -9.721 755 HB2 LYS 56 HB2 LYS 56 7.245 8.884 -8.700 756 HB3 LYS 56 HB1 LYS 56 6.914 9.892 -10.105 757 HG2 LYS 56 HG2 LYS 56 9.247 7.960 -9.916 758 HG3 LYS 56 HG1 LYS 56 7.706 7.563 -10.672 759 HD2 LYS 56 HD2 LYS 56 8.357 9.969 -11.881 760 HD3 LYS 56 HD1 LYS 56 9.927 9.191 -11.698 761 HE2 LYS 56 HE2 LYS 56 8.998 8.503 -13.822 762 HE3 LYS 56 HE1 LYS 56 8.942 7.119 -12.730 763 HZ1 LYS 56 HZ1 LYS 56 6.791 8.574 -13.943 764 HZ2 LYS 56 HZ2 LYS 56 6.595 8.403 -12.264 765 HZ3 LYS 56 HZ3 LYS 56 6.792 7.029 -13.243 766 H LYS 57 HN LYS 57 7.148 11.305 -7.219 767 HA LYS 57 HA LYS 57 5.927 13.458 -8.561 768 HB2 LYS 57 HB2 LYS 57 5.008 12.436 -6.508 769 HB3 LYS 57 HB1 LYS 57 6.359 13.094 -5.584 770 HG2 LYS 57 HG2 LYS 57 5.676 15.381 -6.175 771 HG3 LYS 57 HG1 LYS 57 4.351 14.745 -7.149 772 HD2 LYS 57 HD2 LYS 57 3.383 13.693 -5.130 773 HD3 LYS 57 HD1 LYS 57 4.698 14.358 -4.161 774 HE2 LYS 57 HE2 LYS 57 2.740 16.010 -5.785 775 HE3 LYS 57 HE1 LYS 57 2.649 15.763 -4.041 776 HZ1 LYS 57 HZ1 LYS 57 5.249 16.575 -4.707 777 HZ2 LYS 57 HZ2 LYS 57 4.100 17.387 -3.755 778 HZ3 LYS 57 HZ3 LYS 57 4.159 17.651 -5.432 779 H ALA 58 HN ALA 58 8.735 13.312 -6.404 780 HA ALA 58 HA ALA 58 9.308 16.142 -6.959 781 HB1 ALA 58 HB1 ALA 58 10.568 16.183 -5.012 782 HB2 ALA 58 HB2 ALA 58 10.937 14.460 -5.092 783 HB3 ALA 58 HB3 ALA 58 9.334 14.996 -4.589 784 H GLY 59 HN GLY 59 9.656 14.520 -9.154 785 HA2 GLY 59 HA2 GLY 59 12.202 13.360 -9.461 786 HA3 GLY 59 HA1 GLY 59 11.203 13.980 -10.774 787 H SER 60 HN SER 60 11.049 16.671 -9.981 788 HA SER 60 HA SER 60 13.828 17.603 -9.830 789 HB2 SER 60 HB2 SER 60 13.499 19.105 -11.754 790 HB3 SER 60 HB1 SER 60 13.341 17.418 -12.234 791 HG SER 60 HG SER 60 11.455 19.439 -12.118 792 H GLN 61 HN GLN 61 13.999 19.305 -8.512 793 HA GLN 61 HA GLN 61 11.733 20.354 -7.156 794 HB2 GLN 61 HB2 GLN 61 14.622 21.230 -7.261 795 HB3 GLN 61 HB1 GLN 61 13.415 21.994 -6.227 796 HG2 GLN 61 HG2 GLN 61 12.940 19.819 -5.165 797 HG3 GLN 61 HG1 GLN 61 14.146 19.052 -6.195 798 HE21 GLN 61 HE21 GLN 61 15.756 18.524 -4.658 799 HE22 GLN 61 HE22 GLN 61 16.521 19.671 -3.668 800 H SER 62 HN SER 62 13.755 21.551 -9.794 801 HA SER 62 HA SER 62 12.024 23.926 -10.029 802 HB2 SER 62 HB2 SER 62 14.715 23.322 -11.272 803 HB3 SER 62 HB1 SER 62 13.799 24.807 -11.508 804 HG SER 62 HG SER 62 13.851 24.971 -9.145 Start of MODEL 9 1 H1 MET 76 HT1 MET 76 5.725 -12.589 -21.612 2 H2 MET 76 HT2 MET 76 6.269 -11.352 -22.642 3 H3 MET 76 HT3 MET 76 4.704 -11.986 -22.824 4 HA MET 76 HA MET 76 5.728 -10.066 -20.884 5 HB2 MET 76 HB2 MET 76 3.456 -10.437 -22.732 6 HB3 MET 76 HB1 MET 76 3.029 -9.702 -21.188 7 HG2 MET 76 HG2 MET 76 4.800 -8.010 -21.498 8 HG3 MET 76 HG1 MET 76 5.228 -8.741 -23.045 9 HE1 MET 76 HE1 MET 76 4.307 -7.997 -25.214 10 HE2 MET 76 HE2 MET 76 2.570 -7.872 -25.477 11 HE3 MET 76 HE3 MET 76 3.245 -9.344 -24.785 12 H LYS 77 HN LYS 77 3.472 -12.799 -21.115 13 HA LYS 77 HA LYS 77 2.456 -12.559 -18.471 14 HB2 LYS 77 HB2 LYS 77 1.564 -14.813 -18.827 15 HB3 LYS 77 HB1 LYS 77 1.280 -13.803 -20.243 16 HG2 LYS 77 HG2 LYS 77 3.277 -14.781 -21.333 17 HG3 LYS 77 HG1 LYS 77 3.531 -15.815 -19.927 18 HD2 LYS 77 HD2 LYS 77 1.315 -16.841 -20.275 19 HD3 LYS 77 HD1 LYS 77 1.061 -15.813 -21.685 20 HE2 LYS 77 HE2 LYS 77 3.034 -16.813 -22.775 21 HE3 LYS 77 HE1 LYS 77 3.296 -17.838 -21.365 22 HZ1 LYS 77 HZ1 LYS 77 0.648 -17.892 -22.591 23 HZ2 LYS 77 HZ2 LYS 77 1.536 -19.146 -21.865 24 HZ3 LYS 77 HZ3 LYS 77 1.908 -18.642 -23.444 25 H ASP 78 HN ASP 78 2.887 -13.879 -16.655 26 HA ASP 78 HA ASP 78 4.324 -14.779 -15.078 27 HB2 ASP 78 HB2 ASP 78 4.009 -16.727 -16.660 28 HB3 ASP 78 HB1 ASP 78 5.521 -16.252 -17.432 29 H THR 79 HN THR 79 5.146 -12.424 -15.326 30 HA THR 79 HA THR 79 7.909 -12.376 -14.934 31 HB THR 79 HB THR 79 7.925 -10.791 -17.279 32 HG1 THR 79 HG1 THR 79 7.394 -13.354 -18.127 33 HG21 THR 79 HG21 THR 79 9.151 -13.474 -16.590 34 HG22 THR 79 HG22 THR 79 9.878 -11.884 -16.360 35 HG23 THR 79 HG23 THR 79 9.612 -12.505 -17.988 36 H ASP 80 HN ASP 80 5.101 -11.097 -14.373 37 HA ASP 80 HA ASP 80 5.958 -8.278 -14.383 38 HB2 ASP 80 HB2 ASP 80 3.818 -8.799 -15.522 39 HB3 ASP 80 HB1 ASP 80 3.187 -9.431 -14.003 40 H SER 81 HN SER 81 6.490 -7.338 -12.526 41 HA SER 81 HA SER 81 6.268 -8.800 -10.031 42 HB2 SER 81 HB2 SER 81 7.375 -6.047 -10.649 43 HB3 SER 81 HB1 SER 81 7.462 -6.838 -9.076 44 HG SER 81 HG SER 81 8.819 -7.373 -11.448 45 H GLU 82 HN GLU 82 4.210 -6.864 -11.761 46 HA GLU 82 HA GLU 82 3.081 -5.157 -9.856 47 HB2 GLU 82 HB2 GLU 82 2.520 -5.107 -12.271 48 HB3 GLU 82 HB1 GLU 82 1.665 -6.638 -12.084 49 HG2 GLU 82 HG2 GLU 82 0.123 -5.606 -10.477 50 HG3 GLU 82 HG1 GLU 82 0.996 -4.079 -10.600 51 H GLU 83 HN GLU 83 2.554 -8.559 -10.553 52 HA GLU 83 HA GLU 83 0.382 -8.941 -8.749 53 HB2 GLU 83 HB2 GLU 83 1.187 -11.397 -8.962 54 HB3 GLU 83 HB1 GLU 83 0.571 -10.585 -10.403 55 HG2 GLU 83 HG2 GLU 83 2.618 -10.493 -11.398 56 HG3 GLU 83 HG1 GLU 83 3.482 -10.261 -9.874 57 H GLU 84 HN GLU 84 3.905 -9.058 -8.413 58 HA GLU 84 HA GLU 84 4.017 -10.469 -5.975 59 HB2 GLU 84 HB2 GLU 84 5.867 -8.410 -7.192 60 HB3 GLU 84 HB1 GLU 84 6.232 -9.263 -5.692 61 HG2 GLU 84 HG2 GLU 84 6.148 -11.403 -6.819 62 HG3 GLU 84 HG1 GLU 84 5.568 -10.648 -8.302 63 H ILE 85 HN ILE 85 3.733 -7.001 -6.653 64 HA ILE 85 HA ILE 85 3.718 -6.214 -3.911 65 HB ILE 85 HB ILE 85 2.939 -4.833 -6.478 66 HG12 ILE 85 HG12 ILE 85 5.385 -5.241 -5.554 67 HG13 ILE 85 HG11 ILE 85 4.949 -3.676 -6.236 68 HG21 ILE 85 HG21 ILE 85 2.551 -3.941 -3.620 69 HG22 ILE 85 HG22 ILE 85 1.417 -3.851 -4.967 70 HG23 ILE 85 HG23 ILE 85 2.805 -2.766 -4.913 71 HD11 ILE 85 HD11 ILE 85 4.762 -2.662 -4.120 72 HD12 ILE 85 HD12 ILE 85 6.163 -3.716 -3.935 73 HD13 ILE 85 HD13 ILE 85 4.600 -4.204 -3.284 74 H ARG 86 HN ARG 86 1.327 -7.256 -6.219 75 HA ARG 86 HA ARG 86 -1.017 -6.379 -4.909 76 HB2 ARG 86 HB2 ARG 86 -0.908 -7.166 -7.261 77 HB3 ARG 86 HB1 ARG 86 -0.602 -8.795 -6.671 78 HG2 ARG 86 HG2 ARG 86 -2.750 -8.906 -5.608 79 HG3 ARG 86 HG1 ARG 86 -3.056 -7.199 -5.933 80 HD2 ARG 86 HD2 ARG 86 -2.548 -9.230 -8.115 81 HD3 ARG 86 HD1 ARG 86 -4.168 -8.817 -7.548 82 HE ARG 86 HE ARG 86 -2.837 -6.426 -8.188 83 HH11 ARG 86 HH21 ARG 86 -4.002 -9.316 -9.693 84 HH12 ARG 86 HH22 ARG 86 -4.312 -8.560 -11.221 85 HH21 ARG 86 HH11 ARG 86 -3.242 -5.428 -10.185 86 HH22 ARG 86 HH12 ARG 86 -3.882 -6.358 -11.498 87 H GLU 87 HN GLU 87 0.993 -9.267 -4.611 88 HA GLU 87 HA GLU 87 -0.686 -10.824 -2.990 89 HB2 GLU 87 HB2 GLU 87 2.325 -10.656 -3.156 90 HB3 GLU 87 HB1 GLU 87 1.485 -11.839 -2.154 91 HG2 GLU 87 HG2 GLU 87 0.385 -12.793 -4.077 92 HG3 GLU 87 HG1 GLU 87 0.981 -11.506 -5.120 93 H ALA 88 HN ALA 88 1.554 -8.223 -2.217 94 HA ALA 88 HA ALA 88 1.527 -8.462 0.593 95 HB1 ALA 88 HB1 ALA 88 1.663 -5.714 -0.031 96 HB2 ALA 88 HB2 ALA 88 2.454 -6.557 -1.362 97 HB3 ALA 88 HB3 ALA 88 3.010 -6.805 0.293 98 H PHE 89 HN PHE 89 -0.799 -7.065 -1.661 99 HA PHE 89 HA PHE 89 -2.334 -5.794 0.445 100 HB2 PHE 89 HB2 PHE 89 -2.809 -6.236 -2.501 101 HB3 PHE 89 HB1 PHE 89 -4.040 -5.548 -1.440 102 HD1 PHE 89 HD2 PHE 89 -3.686 -3.378 -0.329 103 HD2 PHE 89 HD1 PHE 89 -0.785 -5.007 -3.035 104 HE1 PHE 89 HE2 PHE 89 -2.567 -1.168 -0.461 105 HE2 PHE 89 HE1 PHE 89 0.345 -2.803 -3.167 106 HZ PHE 89 HZ PHE 89 -0.553 -0.879 -1.879 107 H ARG 90 HN ARG 90 -2.458 -8.787 -1.442 108 HA ARG 90 HA ARG 90 -4.952 -9.752 -0.813 109 HB2 ARG 90 HB2 ARG 90 -2.349 -11.027 -1.391 110 HB3 ARG 90 HB1 ARG 90 -3.525 -12.046 -0.572 111 HG2 ARG 90 HG2 ARG 90 -3.787 -12.295 -2.983 112 HG3 ARG 90 HG1 ARG 90 -5.200 -11.467 -2.336 113 HD2 ARG 90 HD2 ARG 90 -4.195 -9.291 -2.978 114 HD3 ARG 90 HD1 ARG 90 -2.815 -10.148 -3.654 115 HE ARG 90 HE ARG 90 -4.131 -10.744 -5.486 116 HH11 ARG 90 HH21 ARG 90 -6.035 -9.435 -2.909 117 HH12 ARG 90 HH22 ARG 90 -7.480 -9.313 -3.855 118 HH21 ARG 90 HH11 ARG 90 -6.022 -10.586 -6.732 119 HH22 ARG 90 HH12 ARG 90 -7.473 -9.964 -6.019 120 H VAL 91 HN VAL 91 -2.190 -9.429 1.314 121 HA VAL 91 HA VAL 91 -3.011 -11.140 3.380 122 HB VAL 91 HB VAL 91 -1.358 -8.606 3.371 123 HG11 VAL 91 HG11 VAL 91 -0.671 -9.507 5.697 124 HG12 VAL 91 HG12 VAL 91 -2.155 -10.457 5.634 125 HG13 VAL 91 HG13 VAL 91 -2.235 -8.696 5.594 126 HG21 VAL 91 HG21 VAL 91 -0.788 -11.120 2.464 127 HG22 VAL 91 HG22 VAL 91 -0.262 -11.246 4.142 128 HG23 VAL 91 HG23 VAL 91 0.423 -10.004 3.094 129 H PHE 92 HN PHE 92 -3.838 -7.804 2.605 130 HA PHE 92 HA PHE 92 -5.525 -7.594 4.980 131 HB2 PHE 92 HB2 PHE 92 -5.215 -5.581 2.747 132 HB3 PHE 92 HB1 PHE 92 -5.820 -5.294 4.377 133 HD1 PHE 92 HD2 PHE 92 -4.020 -6.370 6.241 134 HD2 PHE 92 HD1 PHE 92 -3.080 -4.719 2.385 135 HE1 PHE 92 HE2 PHE 92 -1.715 -5.897 7.005 136 HE2 PHE 92 HE1 PHE 92 -0.771 -4.250 3.155 137 HZ PHE 92 HZ PHE 92 -0.089 -4.838 5.463 138 H ASP 93 HN ASP 93 -5.782 -8.280 1.574 139 HA ASP 93 HA ASP 93 -8.650 -7.811 1.486 140 HB2 ASP 93 HB2 ASP 93 -7.231 -9.316 -0.672 141 HB3 ASP 93 HB1 ASP 93 -8.495 -8.102 -0.796 142 H LYS 94 HN LYS 94 -8.663 -9.450 3.456 143 HA LYS 94 HA LYS 94 -8.408 -12.220 2.857 144 HB2 LYS 94 HB2 LYS 94 -9.605 -12.534 5.002 145 HB3 LYS 94 HB1 LYS 94 -8.226 -11.447 5.129 146 HG2 LYS 94 HG2 LYS 94 -9.569 -9.555 5.366 147 HG3 LYS 94 HG1 LYS 94 -10.954 -10.307 4.583 148 HD2 LYS 94 HD2 LYS 94 -11.347 -10.117 6.997 149 HD3 LYS 94 HD1 LYS 94 -11.228 -11.813 6.531 150 HE2 LYS 94 HE2 LYS 94 -8.905 -11.893 7.291 151 HE3 LYS 94 HE1 LYS 94 -8.949 -10.172 7.675 152 HZ1 LYS 94 HZ1 LYS 94 -10.999 -10.918 9.089 153 HZ2 LYS 94 HZ2 LYS 94 -9.422 -11.079 9.700 154 HZ3 LYS 94 HZ3 LYS 94 -10.225 -12.427 9.048 155 H ASP 95 HN ASP 95 -10.932 -9.910 2.385 156 HA ASP 95 HA ASP 95 -13.095 -11.787 2.248 157 HB2 ASP 95 HB2 ASP 95 -14.358 -9.917 1.262 158 HB3 ASP 95 HB1 ASP 95 -13.504 -9.420 2.721 159 H GLY 96 HN GLY 96 -10.662 -10.663 0.039 160 HA2 GLY 96 HA2 GLY 96 -10.092 -11.401 -2.069 161 HA3 GLY 96 HA1 GLY 96 -11.278 -12.688 -1.873 162 H ASN 97 HN ASN 97 -12.236 -9.368 -1.476 163 HA ASN 97 HA ASN 97 -13.974 -9.616 -3.823 164 HB2 ASN 97 HB2 ASN 97 -14.743 -8.844 -1.481 165 HB3 ASN 97 HB1 ASN 97 -13.966 -7.314 -1.886 166 HD21 ASN 97 HD21 ASN 97 -15.927 -6.088 -2.132 167 HD22 ASN 97 HD22 ASN 97 -17.044 -6.401 -3.371 168 H GLY 98 HN GLY 98 -10.968 -8.363 -3.078 169 HA2 GLY 98 HA2 GLY 98 -9.568 -7.319 -4.709 170 HA3 GLY 98 HA1 GLY 98 -11.012 -6.696 -5.501 171 H TYR 99 HN TYR 99 -11.274 -6.338 -2.200 172 HA TYR 99 HA TYR 99 -10.125 -3.609 -2.236 173 HB2 TYR 99 HB2 TYR 99 -12.845 -4.315 -1.126 174 HB3 TYR 99 HB1 TYR 99 -12.071 -2.730 -1.094 175 HD1 TYR 99 HD1 TYR 99 -13.036 -5.409 -3.525 176 HD2 TYR 99 HD2 TYR 99 -12.530 -1.208 -2.790 177 HE1 TYR 99 HE1 TYR 99 -13.913 -4.917 -5.786 178 HE2 TYR 99 HE2 TYR 99 -13.417 -0.712 -5.058 179 HH TYR 99 HH TYR 99 -14.886 -1.821 -6.738 180 H ILE 100 HN ILE 100 -9.689 -2.669 -0.190 181 HA ILE 100 HA ILE 100 -9.584 -4.543 2.084 182 HB ILE 100 HB ILE 100 -7.330 -4.298 2.403 183 HG12 ILE 100 HG12 ILE 100 -7.652 -1.472 1.355 184 HG13 ILE 100 HG11 ILE 100 -7.378 -1.951 3.029 185 HG21 ILE 100 HG21 ILE 100 -7.723 -4.834 -0.079 186 HG22 ILE 100 HG22 ILE 100 -6.118 -4.244 0.357 187 HG23 ILE 100 HG23 ILE 100 -7.288 -3.151 -0.389 188 HD11 ILE 100 HD11 ILE 100 -5.459 -2.074 0.706 189 HD12 ILE 100 HD12 ILE 100 -5.202 -3.021 2.172 190 HD13 ILE 100 HD13 ILE 100 -5.260 -1.262 2.256 191 H SER 101 HN SER 101 -10.028 -3.528 4.089 192 HA SER 101 HA SER 101 -11.624 -1.222 4.010 193 HB2 SER 101 HB2 SER 101 -11.757 -2.815 5.853 194 HB3 SER 101 HB1 SER 101 -10.106 -2.438 6.337 195 HG SER 101 HG SER 101 -10.769 -0.608 7.184 196 H ALA 102 HN ALA 102 -11.173 0.940 4.192 197 HA ALA 102 HA ALA 102 -8.560 1.893 3.691 198 HB1 ALA 102 HB1 ALA 102 -10.966 2.999 3.382 199 HB2 ALA 102 HB2 ALA 102 -9.512 3.978 3.556 200 HB3 ALA 102 HB3 ALA 102 -10.563 3.707 4.945 201 H ALA 103 HN ALA 103 -10.448 1.579 6.627 202 HA ALA 103 HA ALA 103 -8.875 3.082 8.379 203 HB1 ALA 103 HB1 ALA 103 -9.879 1.655 10.173 204 HB2 ALA 103 HB2 ALA 103 -10.571 0.641 8.906 205 HB3 ALA 103 HB3 ALA 103 -11.056 2.331 9.046 206 H GLU 104 HN GLU 104 -8.525 -0.374 7.520 207 HA GLU 104 HA GLU 104 -6.462 -0.858 9.423 208 HB2 GLU 104 HB2 GLU 104 -6.192 -2.967 8.432 209 HB3 GLU 104 HB1 GLU 104 -7.893 -2.591 8.179 210 HG2 GLU 104 HG2 GLU 104 -7.366 -3.218 6.042 211 HG3 GLU 104 HG1 GLU 104 -6.908 -1.528 5.939 212 H LEU 105 HN LEU 105 -6.498 0.430 6.197 213 HA LEU 105 HA LEU 105 -3.766 0.112 5.547 214 HB2 LEU 105 HB2 LEU 105 -5.583 0.799 3.945 215 HB3 LEU 105 HB1 LEU 105 -5.611 2.374 4.728 216 HG LEU 105 HG LEU 105 -3.117 2.548 4.194 217 HD11 LEU 105 HD11 LEU 105 -3.557 -0.124 3.300 218 HD12 LEU 105 HD12 LEU 105 -2.074 0.813 3.216 219 HD13 LEU 105 HD13 LEU 105 -3.216 0.855 1.880 220 HD21 LEU 105 HD21 LEU 105 -4.468 3.912 2.869 221 HD22 LEU 105 HD22 LEU 105 -5.343 2.545 2.178 222 HD23 LEU 105 HD23 LEU 105 -3.697 2.896 1.651 223 H ARG 106 HN ARG 106 -5.524 2.822 7.048 224 HA ARG 106 HA ARG 106 -3.350 4.543 7.400 225 HB2 ARG 106 HB2 ARG 106 -5.703 5.211 7.752 226 HB3 ARG 106 HB1 ARG 106 -5.760 4.219 9.208 227 HG2 ARG 106 HG2 ARG 106 -3.492 6.103 9.121 228 HG3 ARG 106 HG1 ARG 106 -5.075 6.878 9.167 229 HD2 ARG 106 HD2 ARG 106 -4.110 4.753 11.108 230 HD3 ARG 106 HD1 ARG 106 -4.186 6.478 11.442 231 HE ARG 106 HE ARG 106 -6.739 5.729 10.631 232 HH11 ARG 106 HH21 ARG 106 -4.469 4.952 13.125 233 HH12 ARG 106 HH22 ARG 106 -5.680 4.558 14.298 234 HH21 ARG 106 HH11 ARG 106 -8.336 5.213 12.166 235 HH22 ARG 106 HH12 ARG 106 -7.869 4.705 13.755 236 H HIS 107 HN HIS 107 -4.690 2.140 9.717 237 HA HIS 107 HA HIS 107 -2.798 2.589 11.750 238 HB2 HIS 107 HB2 HIS 107 -4.830 1.338 12.182 239 HB3 HIS 107 HB1 HIS 107 -4.355 0.098 11.020 240 HD1 HIS 107 HD1 HIS 107 -3.584 1.380 14.468 241 HD2 HIS 107 HD2 HIS 107 -2.307 -1.650 11.909 242 HE1 HIS 107 HE1 HIS 107 -2.122 -0.156 15.854 243 HE2 HIS 107 HE2 HIS 107 -1.336 -2.012 14.308 244 H VAL 108 HN VAL 108 -2.876 0.255 9.114 245 HA VAL 108 HA VAL 108 -0.509 -1.132 9.684 246 HB VAL 108 HB VAL 108 -2.032 -0.632 7.116 247 HG11 VAL 108 HG11 VAL 108 -0.780 -2.571 6.191 248 HG12 VAL 108 HG12 VAL 108 0.262 -2.554 7.607 249 HG13 VAL 108 HG13 VAL 108 0.274 -1.193 6.488 250 HG21 VAL 108 HG21 VAL 108 -2.783 -2.038 9.275 251 HG22 VAL 108 HG22 VAL 108 -1.819 -3.275 8.468 252 HG23 VAL 108 HG23 VAL 108 -3.188 -2.541 7.637 253 H MET 109 HN MET 109 -1.097 1.807 7.830 254 HA MET 109 HA MET 109 1.609 2.001 6.826 255 HB2 MET 109 HB2 MET 109 -0.856 3.661 6.676 256 HB3 MET 109 HB1 MET 109 0.691 4.486 6.453 257 HG2 MET 109 HG2 MET 109 -0.431 3.517 4.345 258 HG3 MET 109 HG1 MET 109 1.277 3.137 4.599 259 HE1 MET 109 HE1 MET 109 0.171 -0.144 3.041 260 HE2 MET 109 HE2 MET 109 1.602 0.825 3.377 261 HE3 MET 109 HE3 MET 109 0.195 1.578 2.633 262 H THR 110 HN THR 110 -0.054 3.070 9.694 263 HA THR 110 HA THR 110 2.230 4.806 10.366 264 HB THR 110 HB THR 110 0.771 5.808 12.027 265 HG1 THR 110 HG1 THR 110 -0.636 3.514 11.548 266 HG21 THR 110 HG21 THR 110 0.571 6.762 9.844 267 HG22 THR 110 HG22 THR 110 -1.068 6.587 10.468 268 HG23 THR 110 HG23 THR 110 -0.447 5.434 9.291 269 H ASN 111 HN ASN 111 0.856 1.734 11.172 270 HA ASN 111 HA ASN 111 2.431 1.668 13.680 271 HB2 ASN 111 HB2 ASN 111 0.124 -0.098 12.857 272 HB3 ASN 111 HB1 ASN 111 0.940 -0.093 14.420 273 HD21 ASN 111 HD21 ASN 111 0.846 2.061 15.645 274 HD22 ASN 111 HD22 ASN 111 -0.549 3.012 15.461 275 H LEU 112 HN LEU 112 1.531 -0.455 10.929 276 HA LEU 112 HA LEU 112 3.664 -2.310 11.648 277 HB2 LEU 112 HB2 LEU 112 1.743 -2.340 9.324 278 HB3 LEU 112 HB1 LEU 112 2.823 -3.653 9.771 279 HG LEU 112 HG LEU 112 0.626 -2.516 11.532 280 HD11 LEU 112 HD11 LEU 112 -0.766 -3.936 10.479 281 HD12 LEU 112 HD12 LEU 112 0.309 -5.283 10.851 282 HD13 LEU 112 HD13 LEU 112 0.530 -4.363 9.363 283 HD21 LEU 112 HD21 LEU 112 1.212 -4.849 12.672 284 HD22 LEU 112 HD22 LEU 112 2.137 -3.398 13.063 285 HD23 LEU 112 HD23 LEU 112 2.779 -4.571 11.914 286 H GLY 113 HN GLY 113 5.441 -2.836 10.354 287 HA2 GLY 113 HA2 GLY 113 7.324 -2.195 9.163 288 HA3 GLY 113 HA1 GLY 113 6.152 -2.083 7.852 289 H GLU 114 HN GLU 114 8.241 -0.317 9.957 290 HA GLU 114 HA GLU 114 8.701 1.922 10.167 291 HB2 GLU 114 HB2 GLU 114 7.749 1.738 7.304 292 HB3 GLU 114 HB1 GLU 114 8.435 3.210 7.994 293 HG2 GLU 114 HG2 GLU 114 10.516 2.083 8.492 294 HG3 GLU 114 HG1 GLU 114 9.835 0.524 8.025 295 H LYS 115 HN LYS 115 7.757 4.157 10.132 296 HA LYS 115 HA LYS 115 4.807 4.053 10.418 297 HB2 LYS 115 HB2 LYS 115 6.811 5.588 12.086 298 HB3 LYS 115 HB1 LYS 115 5.059 5.703 12.242 299 HG2 LYS 115 HG2 LYS 115 4.947 3.289 12.761 300 HG3 LYS 115 HG1 LYS 115 6.700 3.180 12.615 301 HD2 LYS 115 HD2 LYS 115 6.958 4.808 14.453 302 HD3 LYS 115 HD1 LYS 115 5.204 4.911 14.607 303 HE2 LYS 115 HE2 LYS 115 5.102 2.506 15.140 304 HE3 LYS 115 HE1 LYS 115 6.855 2.394 14.978 305 HZ1 LYS 115 HZ1 LYS 115 6.494 4.471 16.692 306 HZ2 LYS 115 HZ2 LYS 115 6.909 2.883 17.132 307 HZ3 LYS 115 HZ3 LYS 115 5.284 3.379 17.164 308 H LEU 116 HN LEU 116 3.820 5.309 8.964 309 HA LEU 116 HA LEU 116 5.278 7.475 7.664 310 HB2 LEU 116 HB2 LEU 116 2.610 6.149 7.227 311 HB3 LEU 116 HB1 LEU 116 2.901 7.749 6.557 312 HG LEU 116 HG LEU 116 3.402 5.896 4.947 313 HD11 LEU 116 HD11 LEU 116 4.937 8.190 5.514 314 HD12 LEU 116 HD12 LEU 116 4.935 7.263 4.017 315 HD13 LEU 116 HD13 LEU 116 6.111 6.899 5.276 316 HD21 LEU 116 HD21 LEU 116 4.262 4.372 6.792 317 HD22 LEU 116 HD22 LEU 116 5.757 5.304 6.756 318 HD23 LEU 116 HD23 LEU 116 5.235 4.414 5.325 319 H THR 117 HN THR 117 4.437 9.696 7.663 320 HA THR 117 HA THR 117 3.279 10.371 10.259 321 HB THR 117 HB THR 117 3.898 12.668 9.708 322 HG1 THR 117 HG1 THR 117 4.808 11.581 7.257 323 HG21 THR 117 HG21 THR 117 5.640 10.553 10.142 324 HG22 THR 117 HG22 THR 117 6.046 12.264 10.276 325 HG23 THR 117 HG23 THR 117 6.359 11.399 8.772 326 H ASP 118 HN ASP 118 1.674 12.292 10.170 327 HA ASP 118 HA ASP 118 -0.695 11.415 8.965 328 HB2 ASP 118 HB2 ASP 118 -0.608 12.947 10.902 329 HB3 ASP 118 HB1 ASP 118 0.004 14.222 9.850 330 H GLU 119 HN GLU 119 1.630 13.886 7.929 331 HA GLU 119 HA GLU 119 0.190 14.824 5.696 332 HB2 GLU 119 HB2 GLU 119 3.152 14.750 6.288 333 HB3 GLU 119 HB1 GLU 119 2.474 15.544 4.866 334 HG2 GLU 119 HG2 GLU 119 1.156 17.031 6.253 335 HG3 GLU 119 HG1 GLU 119 1.632 16.161 7.711 336 H GLU 120 HN GLU 120 2.486 12.144 6.031 337 HA GLU 120 HA GLU 120 2.517 11.509 3.234 338 HB2 GLU 120 HB2 GLU 120 3.430 10.098 5.725 339 HB3 GLU 120 HB1 GLU 120 3.419 9.274 4.165 340 HG2 GLU 120 HG2 GLU 120 5.566 10.581 4.933 341 HG3 GLU 120 HG1 GLU 120 5.036 10.678 3.257 342 H VAL 121 HN VAL 121 0.753 10.360 6.073 343 HA VAL 121 HA VAL 121 -0.617 8.220 4.825 344 HB VAL 121 HB VAL 121 -1.207 9.889 7.279 345 HG11 VAL 121 HG11 VAL 121 -2.733 7.891 7.808 346 HG12 VAL 121 HG12 VAL 121 -2.654 7.534 6.082 347 HG13 VAL 121 HG13 VAL 121 -3.317 9.070 6.637 348 HG21 VAL 121 HG21 VAL 121 0.237 8.490 8.302 349 HG22 VAL 121 HG22 VAL 121 0.606 7.768 6.739 350 HG23 VAL 121 HG23 VAL 121 -0.683 7.102 7.732 351 H ASP 122 HN ASP 122 -1.436 11.636 5.315 352 HA ASP 122 HA ASP 122 -4.093 11.543 4.437 353 HB2 ASP 122 HB2 ASP 122 -3.072 13.489 5.561 354 HB3 ASP 122 HB1 ASP 122 -2.105 13.806 4.121 355 H GLU 123 HN GLU 123 -1.086 11.998 2.601 356 HA GLU 123 HA GLU 123 -2.233 12.536 0.077 357 HB2 GLU 123 HB2 GLU 123 0.381 11.193 0.817 358 HB3 GLU 123 HB1 GLU 123 -0.048 11.683 -0.820 359 HG2 GLU 123 HG2 GLU 123 0.006 13.584 1.531 360 HG3 GLU 123 HG1 GLU 123 1.368 13.344 0.435 361 H MET 124 HN MET 124 -1.484 9.562 1.768 362 HA MET 124 HA MET 124 -2.083 7.807 -0.453 363 HB2 MET 124 HB2 MET 124 -1.774 7.258 2.515 364 HB3 MET 124 HB1 MET 124 -1.776 6.052 1.230 365 HG2 MET 124 HG2 MET 124 0.116 8.147 0.625 366 HG3 MET 124 HG1 MET 124 0.450 7.465 2.217 367 HE1 MET 124 HE1 MET 124 -0.102 5.230 2.658 368 HE2 MET 124 HE2 MET 124 1.334 4.310 2.215 369 HE3 MET 124 HE3 MET 124 -0.229 3.880 1.522 370 H ILE 125 HN ILE 125 -3.733 9.152 2.353 371 HA ILE 125 HA ILE 125 -5.948 7.411 2.325 372 HB ILE 125 HB ILE 125 -5.048 9.509 3.927 373 HG12 ILE 125 HG12 ILE 125 -7.475 8.893 5.046 374 HG13 ILE 125 HG11 ILE 125 -7.173 7.464 4.072 375 HG21 ILE 125 HG21 ILE 125 -6.915 11.011 4.222 376 HG22 ILE 125 HG22 ILE 125 -7.836 10.186 2.971 377 HG23 ILE 125 HG23 ILE 125 -6.379 11.093 2.548 378 HD11 ILE 125 HD11 ILE 125 -5.523 8.612 6.301 379 HD12 ILE 125 HD12 ILE 125 -4.771 7.559 5.102 380 HD13 ILE 125 HD13 ILE 125 -6.095 6.958 6.101 381 H ARG 126 HN ARG 126 -5.311 10.460 0.648 382 HA ARG 126 HA ARG 126 -7.946 10.923 -0.263 383 HB2 ARG 126 HB2 ARG 126 -5.757 12.403 -0.372 384 HB3 ARG 126 HB1 ARG 126 -5.576 11.641 -1.951 385 HG2 ARG 126 HG2 ARG 126 -6.850 13.493 -2.527 386 HG3 ARG 126 HG1 ARG 126 -8.123 12.315 -2.215 387 HD2 ARG 126 HD2 ARG 126 -8.363 13.172 0.086 388 HD3 ARG 126 HD1 ARG 126 -7.074 14.333 -0.208 389 HE ARG 126 HE ARG 126 -9.808 14.490 -1.188 390 HH11 ARG 126 HH21 ARG 126 -6.522 15.546 -1.438 391 HH12 ARG 126 HH22 ARG 126 -6.918 17.040 -2.220 392 HH21 ARG 126 HH11 ARG 126 -10.334 16.446 -2.212 393 HH22 ARG 126 HH12 ARG 126 -9.076 17.549 -2.658 394 H GLU 127 HN GLU 127 -5.185 9.686 -2.177 395 HA GLU 127 HA GLU 127 -6.696 8.786 -4.329 396 HB2 GLU 127 HB2 GLU 127 -4.002 7.932 -3.260 397 HB3 GLU 127 HB1 GLU 127 -4.667 7.323 -4.780 398 HG2 GLU 127 HG2 GLU 127 -4.785 9.548 -5.705 399 HG3 GLU 127 HG1 GLU 127 -4.375 10.272 -4.152 400 H ALA 128 HN ALA 128 -6.697 7.533 -1.207 401 HA ALA 128 HA ALA 128 -6.980 4.741 -1.834 402 HB1 ALA 128 HB1 ALA 128 -6.614 6.262 0.461 403 HB2 ALA 128 HB2 ALA 128 -6.855 4.524 0.399 404 HB3 ALA 128 HB3 ALA 128 -8.229 5.601 0.655 405 H ASP 129 HN ASP 129 -9.398 6.949 -0.368 406 HA ASP 129 HA ASP 129 -11.460 6.963 -2.094 407 HB2 ASP 129 HB2 ASP 129 -11.136 4.210 -1.022 408 HB3 ASP 129 HB1 ASP 129 -12.774 4.848 -1.038 409 H ILE 130 HN ILE 130 -12.084 5.150 0.797 410 HA ILE 130 HA ILE 130 -13.151 5.617 2.749 411 HB ILE 130 HB ILE 130 -12.034 8.401 2.352 412 HG12 ILE 130 HG12 ILE 130 -10.929 6.099 3.985 413 HG13 ILE 130 HG11 ILE 130 -10.362 6.488 2.360 414 HG21 ILE 130 HG21 ILE 130 -12.221 7.686 5.068 415 HG22 ILE 130 HG22 ILE 130 -13.751 7.180 4.350 416 HG23 ILE 130 HG23 ILE 130 -13.224 8.858 4.215 417 HD11 ILE 130 HD11 ILE 130 -10.475 8.845 4.085 418 HD12 ILE 130 HD12 ILE 130 -9.140 8.240 3.104 419 HD13 ILE 130 HD13 ILE 130 -9.405 7.599 4.726 420 H ASP 131 HN ASP 131 -13.749 8.890 2.471 421 HA ASP 131 HA ASP 131 -15.583 10.174 1.945 422 HB2 ASP 131 HB2 ASP 131 -15.520 8.694 -0.216 423 HB3 ASP 131 HB1 ASP 131 -16.884 7.863 0.529 424 H GLY 132 HN GLY 132 -15.619 7.206 3.491 425 HA2 GLY 132 HA2 GLY 132 -16.998 7.565 5.693 426 HA3 GLY 132 HA1 GLY 132 -18.344 7.513 4.559 427 H ASP 133 HN ASP 133 -17.577 5.564 2.810 428 HA ASP 133 HA ASP 133 -18.335 3.219 4.085 429 HB2 ASP 133 HB2 ASP 133 -16.839 3.653 1.499 430 HB3 ASP 133 HB1 ASP 133 -17.390 2.065 2.030 431 H GLY 134 HN GLY 134 -15.108 4.504 3.480 432 HA2 GLY 134 HA2 GLY 134 -13.119 4.003 4.536 433 HA3 GLY 134 HA1 GLY 134 -14.022 2.960 5.627 434 H GLN 135 HN GLN 135 -13.847 2.728 2.090 435 HA GLN 135 HA GLN 135 -12.347 0.207 2.397 436 HB2 GLN 135 HB2 GLN 135 -13.622 -0.706 0.472 437 HB3 GLN 135 HB1 GLN 135 -14.614 -0.429 1.909 438 HG2 GLN 135 HG2 GLN 135 -15.329 1.757 0.960 439 HG3 GLN 135 HG1 GLN 135 -14.380 1.422 -0.486 440 HE21 GLN 135 HE21 GLN 135 -15.662 0.632 -2.150 441 HE22 GLN 135 HE22 GLN 135 -17.030 -0.351 -1.946 442 H VAL 136 HN VAL 136 -10.824 -0.230 0.935 443 HA VAL 136 HA VAL 136 -10.291 1.818 -1.123 444 HB VAL 136 HB VAL 136 -8.388 0.609 0.865 445 HG11 VAL 136 HG11 VAL 136 -7.897 1.989 -1.769 446 HG12 VAL 136 HG12 VAL 136 -7.142 0.523 -1.136 447 HG13 VAL 136 HG13 VAL 136 -6.723 2.098 -0.455 448 HG21 VAL 136 HG21 VAL 136 -8.932 3.476 0.115 449 HG22 VAL 136 HG22 VAL 136 -8.049 2.884 1.524 450 HG23 VAL 136 HG23 VAL 136 -9.791 2.649 1.407 451 H ASN 137 HN ASN 137 -9.731 1.127 -3.072 452 HA ASN 137 HA ASN 137 -9.566 -1.769 -3.507 453 HB2 ASN 137 HB2 ASN 137 -11.104 -0.410 -4.922 454 HB3 ASN 137 HB1 ASN 137 -9.722 0.512 -5.506 455 HD21 ASN 137 HD21 ASN 137 -10.835 -0.590 -7.599 456 HD22 ASN 137 HD22 ASN 137 -10.119 -2.054 -8.073 457 H TYR 138 HN TYR 138 -7.484 -2.513 -3.273 458 HA TYR 138 HA TYR 138 -5.196 -0.886 -3.400 459 HB2 TYR 138 HB2 TYR 138 -3.917 -3.009 -3.467 460 HB3 TYR 138 HB1 TYR 138 -5.150 -2.989 -2.207 461 HD1 TYR 138 HD1 TYR 138 -4.336 -4.264 -5.602 462 HD2 TYR 138 HD2 TYR 138 -6.998 -4.492 -2.254 463 HE1 TYR 138 HE1 TYR 138 -5.357 -6.314 -6.553 464 HE2 TYR 138 HE2 TYR 138 -8.017 -6.538 -3.188 465 HH TYR 138 HH TYR 138 -7.126 -7.726 -6.400 466 H GLU 139 HN GLU 139 -7.096 -1.989 -5.983 467 HA GLU 139 HA GLU 139 -5.134 -2.570 -7.917 468 HB2 GLU 139 HB2 GLU 139 -7.885 -1.343 -8.201 469 HB3 GLU 139 HB1 GLU 139 -6.887 -1.824 -9.574 470 HG2 GLU 139 HG2 GLU 139 -7.633 -3.704 -7.321 471 HG3 GLU 139 HG1 GLU 139 -8.552 -3.575 -8.819 472 H GLU 140 HN GLU 140 -6.731 0.561 -7.178 473 HA GLU 140 HA GLU 140 -5.281 2.090 -9.020 474 HB2 GLU 140 HB2 GLU 140 -6.570 2.830 -6.390 475 HB3 GLU 140 HB1 GLU 140 -5.867 4.018 -7.489 476 HG2 GLU 140 HG2 GLU 140 -7.384 3.361 -9.263 477 HG3 GLU 140 HG1 GLU 140 -8.007 2.029 -8.291 478 H PHE 141 HN PHE 141 -4.547 1.246 -5.654 479 HA PHE 141 HA PHE 141 -2.260 2.890 -5.368 480 HB2 PHE 141 HB2 PHE 141 -3.429 0.573 -3.963 481 HB3 PHE 141 HB1 PHE 141 -1.680 0.726 -3.807 482 HD1 PHE 141 HD2 PHE 141 -0.745 3.038 -3.177 483 HD2 PHE 141 HD1 PHE 141 -4.865 1.927 -2.631 484 HE1 PHE 141 HE2 PHE 141 -1.010 4.841 -1.501 485 HE2 PHE 141 HE1 PHE 141 -5.114 3.727 -0.950 486 HZ PHE 141 HZ PHE 141 -3.198 5.183 -0.391 487 H VAL 142 HN VAL 142 -2.638 -0.465 -6.456 488 HA VAL 142 HA VAL 142 0.116 -0.933 -6.884 489 HB VAL 142 HB VAL 142 -2.355 -2.227 -8.038 490 HG11 VAL 142 HG11 VAL 142 -0.638 -4.040 -8.681 491 HG12 VAL 142 HG12 VAL 142 0.584 -2.782 -8.492 492 HG13 VAL 142 HG13 VAL 142 -0.687 -2.602 -9.700 493 HG21 VAL 142 HG21 VAL 142 -1.166 -2.360 -5.541 494 HG22 VAL 142 HG22 VAL 142 -0.445 -3.731 -6.383 495 HG23 VAL 142 HG23 VAL 142 -2.196 -3.610 -6.237 496 H GLN 143 HN GLN 143 -2.457 0.319 -9.006 497 HA GLN 143 HA GLN 143 -1.000 0.337 -11.393 498 HB2 GLN 143 HB2 GLN 143 -3.492 0.957 -10.943 499 HB3 GLN 143 HB1 GLN 143 -2.866 2.580 -10.663 500 HG2 GLN 143 HG2 GLN 143 -2.357 0.958 -13.170 501 HG3 GLN 143 HG1 GLN 143 -3.576 2.223 -13.024 502 HE21 GLN 143 HE21 GLN 143 -0.302 1.632 -13.764 503 HE22 GLN 143 HE22 GLN 143 0.238 3.240 -13.741 504 H MET 144 HN MET 144 -1.183 2.745 -8.777 505 HA MET 144 HA MET 144 0.478 4.681 -9.971 506 HB2 MET 144 HB2 MET 144 0.027 3.991 -7.052 507 HB3 MET 144 HB1 MET 144 1.010 5.361 -7.573 508 HG2 MET 144 HG2 MET 144 -1.047 6.103 -8.934 509 HG3 MET 144 HG1 MET 144 -1.951 4.917 -7.995 510 HE1 MET 144 HE1 MET 144 -1.802 6.191 -4.366 511 HE2 MET 144 HE2 MET 144 -0.961 4.867 -5.168 512 HE3 MET 144 HE3 MET 144 -2.655 5.175 -5.539 513 H MET 145 HN MET 145 1.189 1.836 -8.012 514 HA MET 145 HA MET 145 4.016 2.242 -7.920 515 HB2 MET 145 HB2 MET 145 2.306 -0.208 -7.434 516 HB3 MET 145 HB1 MET 145 4.031 -0.097 -7.074 517 HG2 MET 145 HG2 MET 145 3.620 1.763 -5.539 518 HG3 MET 145 HG1 MET 145 1.910 1.748 -5.948 519 HE1 MET 145 HE1 MET 145 2.774 1.040 -2.483 520 HE2 MET 145 HE2 MET 145 1.084 0.655 -2.794 521 HE3 MET 145 HE3 MET 145 1.844 2.000 -3.640 522 H THR 146 HN THR 146 1.878 0.970 -10.318 523 HA THR 146 HA THR 146 4.030 -0.527 -11.629 524 HB THR 146 HB THR 146 1.365 -0.268 -12.914 525 HG1 THR 146 HG1 THR 146 0.459 -1.704 -11.467 526 HG21 THR 146 HG21 THR 146 3.333 -1.688 -13.696 527 HG22 THR 146 HG22 THR 146 1.797 -2.537 -13.522 528 HG23 THR 146 HG23 THR 146 3.043 -2.703 -12.282 529 H ALA 147 HN ALA 147 3.913 2.480 -11.393 530 HA ALA 147 HA ALA 147 3.998 3.099 -14.287 531 HB1 ALA 147 HB1 ALA 147 3.418 5.026 -12.025 532 HB2 ALA 147 HB2 ALA 147 2.182 4.292 -13.049 533 HB3 ALA 147 HB3 ALA 147 3.379 5.380 -13.752 534 H LYS 148 HN LYS 148 6.219 2.256 -14.095 535 HA LYS 148 HA LYS 148 8.051 4.412 -13.305 536 HB2 LYS 148 HB2 LYS 148 7.745 2.366 -11.593 537 HB3 LYS 148 HB1 LYS 148 8.931 1.641 -12.681 538 HG2 LYS 148 HG2 LYS 148 10.315 2.729 -11.150 539 HG3 LYS 148 HG1 LYS 148 10.172 3.943 -12.421 540 HD2 LYS 148 HD2 LYS 148 9.600 5.293 -10.665 541 HD3 LYS 148 HD1 LYS 148 8.005 4.589 -10.930 542 HE2 LYS 148 HE2 LYS 148 8.482 4.372 -8.583 543 HE3 LYS 148 HE1 LYS 148 8.656 2.766 -9.291 544 HZ1 LYS 148 HZ1 LYS 148 10.720 2.726 -8.534 545 HZ2 LYS 148 HZ2 LYS 148 10.582 4.312 -7.939 546 HZ3 LYS 148 HZ3 LYS 148 11.112 4.041 -9.531 547 H PHE 30 HT1 PHE 30 -10.373 -4.931 13.008 548 HA PHE 30 HA PHE 30 -9.682 -3.938 10.864 549 HB2 PHE 30 HB2 PHE 30 -6.930 -4.939 11.622 550 HB3 PHE 30 HB1 PHE 30 -7.386 -3.944 10.240 551 HD1 PHE 30 HD2 PHE 30 -8.590 -1.658 10.856 552 HD2 PHE 30 HD1 PHE 30 -6.039 -3.878 13.506 553 HE1 PHE 30 HE2 PHE 30 -8.186 0.394 12.189 554 HE2 PHE 30 HE1 PHE 30 -5.637 -1.826 14.837 555 HZ PHE 30 HZ PHE 30 -6.710 0.310 14.179 556 H ASP 31 HN ASP 31 -9.529 -6.662 12.819 557 HA ASP 31 HA ASP 31 -9.732 -8.919 12.450 558 HB2 ASP 31 HB2 ASP 31 -10.827 -7.860 9.835 559 HB3 ASP 31 HB1 ASP 31 -10.880 -9.559 10.299 560 H ILE 32 HN ILE 32 -7.235 -7.619 11.876 561 HA ILE 32 HA ILE 32 -6.117 -9.505 9.892 562 HB ILE 32 HB ILE 32 -5.480 -6.591 10.349 563 HG12 ILE 32 HG12 ILE 32 -5.990 -8.038 7.753 564 HG13 ILE 32 HG11 ILE 32 -7.326 -7.447 8.745 565 HG21 ILE 32 HG21 ILE 32 -3.328 -7.543 10.177 566 HG22 ILE 32 HG22 ILE 32 -3.721 -7.060 8.526 567 HG23 ILE 32 HG23 ILE 32 -3.861 -8.753 9.008 568 HD11 ILE 32 HD11 ILE 32 -6.210 -5.919 6.865 569 HD12 ILE 32 HD12 ILE 32 -5.077 -5.572 8.174 570 HD13 ILE 32 HD13 ILE 32 -6.794 -5.231 8.379 571 H ASP 33 HN ASP 33 -4.620 -10.828 10.712 572 HA ASP 33 HA ASP 33 -3.769 -10.552 13.446 573 HB2 ASP 33 HB2 ASP 33 -3.079 -12.514 11.258 574 HB3 ASP 33 HB1 ASP 33 -2.387 -12.600 12.877 575 H MET 34 HN MET 34 -1.989 -9.604 14.202 576 HA MET 34 HA MET 34 -0.004 -8.619 12.263 577 HB2 MET 34 HB2 MET 34 -0.589 -7.801 15.118 578 HB3 MET 34 HB1 MET 34 0.691 -7.111 14.118 579 HG2 MET 34 HG2 MET 34 -0.975 -6.388 12.462 580 HG3 MET 34 HG1 MET 34 -2.261 -7.103 13.429 581 HE1 MET 34 HE1 MET 34 -3.288 -4.910 12.969 582 HE2 MET 34 HE2 MET 34 -1.969 -3.853 12.478 583 HE3 MET 34 HE3 MET 34 -2.986 -3.405 13.846 584 H ASP 35 HN ASP 35 -0.484 -11.098 14.452 585 HA ASP 35 HA ASP 35 2.035 -11.341 15.698 586 HB2 ASP 35 HB2 ASP 35 -0.065 -13.382 14.961 587 HB3 ASP 35 HB1 ASP 35 1.395 -13.792 15.861 588 H ALA 36 HN ALA 36 0.817 -12.508 12.583 589 HA ALA 36 HA ALA 36 3.076 -14.071 11.931 590 HB1 ALA 36 HB1 ALA 36 0.620 -13.268 10.666 591 HB2 ALA 36 HB2 ALA 36 1.645 -14.659 10.312 592 HB3 ALA 36 HB3 ALA 36 1.958 -13.111 9.529 593 HA PRO 37 HA PRO 37 5.843 -10.659 11.043 594 HB2 PRO 37 HB2 PRO 37 7.861 -11.987 9.821 595 HB3 PRO 37 HB1 PRO 37 7.582 -12.052 11.573 596 HG2 PRO 37 HG2 PRO 37 6.812 -13.994 9.464 597 HG3 PRO 37 HG1 PRO 37 7.497 -14.288 11.068 598 HD2 PRO 37 HD2 PRO 37 4.843 -14.578 10.534 599 HD3 PRO 37 HD1 PRO 37 5.448 -14.075 12.130 600 H GLU 38 HN GLU 38 4.595 -12.793 8.620 601 HA GLU 38 HA GLU 38 5.619 -11.573 6.293 602 HB2 GLU 38 HB2 GLU 38 3.073 -13.133 6.773 603 HB3 GLU 38 HB1 GLU 38 3.634 -12.641 5.176 604 HG2 GLU 38 HG2 GLU 38 5.310 -14.264 7.108 605 HG3 GLU 38 HG1 GLU 38 4.312 -14.982 5.845 606 H THR 39 HN THR 39 2.749 -10.883 8.251 607 HA THR 39 HA THR 39 1.489 -9.081 6.504 608 HB THR 39 HB THR 39 1.507 -9.098 9.531 609 HG1 THR 39 HG1 THR 39 -0.377 -10.297 9.246 610 HG21 THR 39 HG21 THR 39 -0.893 -8.083 8.812 611 HG22 THR 39 HG22 THR 39 0.099 -7.467 7.491 612 HG23 THR 39 HG23 THR 39 0.511 -7.073 9.161 613 H GLU 40 HN GLU 40 3.908 -8.518 9.051 614 HA GLU 40 HA GLU 40 4.021 -5.709 8.797 615 HB2 GLU 40 HB2 GLU 40 5.004 -6.960 10.699 616 HB3 GLU 40 HB1 GLU 40 6.232 -7.611 9.616 617 HG2 GLU 40 HG2 GLU 40 7.045 -5.349 9.132 618 HG3 GLU 40 HG1 GLU 40 5.780 -4.660 10.147 619 H ARG 41 HN ARG 41 5.729 -8.327 7.164 620 HA ARG 41 HA ARG 41 7.609 -6.827 5.724 621 HB2 ARG 41 HB2 ARG 41 6.397 -9.509 5.538 622 HB3 ARG 41 HB1 ARG 41 7.010 -8.870 4.015 623 HG2 ARG 41 HG2 ARG 41 8.694 -10.195 5.360 624 HG3 ARG 41 HG1 ARG 41 9.215 -8.563 4.941 625 HD2 ARG 41 HD2 ARG 41 7.752 -8.767 7.496 626 HD3 ARG 41 HD1 ARG 41 9.290 -9.616 7.467 627 HE ARG 41 HE ARG 41 9.669 -7.047 6.374 628 HH11 ARG 41 HH21 ARG 41 8.894 -8.629 9.351 629 HH12 ARG 41 HH22 ARG 41 9.597 -7.401 10.349 630 HH21 ARG 41 HH11 ARG 41 10.595 -5.431 7.675 631 HH22 ARG 41 HH12 ARG 41 10.560 -5.590 9.399 632 H ALA 42 HN ALA 42 4.270 -7.737 4.924 633 HA ALA 42 HA ALA 42 4.222 -6.675 2.314 634 HB1 ALA 42 HB1 ALA 42 1.770 -6.692 2.571 635 HB2 ALA 42 HB2 ALA 42 1.957 -6.964 4.303 636 HB3 ALA 42 HB3 ALA 42 2.488 -8.193 3.155 637 H ALA 43 HN ALA 43 3.513 -5.222 5.466 638 HA ALA 43 HA ALA 43 2.535 -2.750 4.530 639 HB1 ALA 43 HB1 ALA 43 2.939 -1.929 6.762 640 HB2 ALA 43 HB2 ALA 43 4.095 -3.223 7.083 641 HB3 ALA 43 HB3 ALA 43 2.382 -3.598 6.893 642 H VAL 44 HN VAL 44 5.811 -3.867 5.274 643 HA VAL 44 HA VAL 44 7.131 -1.395 4.948 644 HB VAL 44 HB VAL 44 8.097 -4.240 4.615 645 HG11 VAL 44 HG11 VAL 44 10.374 -3.000 4.986 646 HG12 VAL 44 HG12 VAL 44 9.508 -1.596 4.361 647 HG13 VAL 44 HG13 VAL 44 9.675 -3.044 3.368 648 HG21 VAL 44 HG21 VAL 44 8.264 -2.175 6.830 649 HG22 VAL 44 HG22 VAL 44 9.238 -3.645 6.807 650 HG23 VAL 44 HG23 VAL 44 7.481 -3.755 6.891 651 H ALA 45 HN ALA 45 6.483 -4.025 2.633 652 HA ALA 45 HA ALA 45 7.903 -2.944 0.463 653 HB1 ALA 45 HB1 ALA 45 5.370 -4.567 0.232 654 HB2 ALA 45 HB2 ALA 45 6.926 -5.276 0.666 655 HB3 ALA 45 HB3 ALA 45 6.718 -4.494 -0.902 656 H ILE 46 HN ILE 46 4.485 -2.538 1.397 657 HA ILE 46 HA ILE 46 3.778 -0.937 -0.828 658 HB ILE 46 HB ILE 46 2.590 -1.116 1.951 659 HG12 ILE 46 HG12 ILE 46 1.583 -2.195 -0.697 660 HG13 ILE 46 HG11 ILE 46 2.567 -3.147 0.416 661 HG21 ILE 46 HG21 ILE 46 1.911 1.008 1.071 662 HG22 ILE 46 HG22 ILE 46 0.574 -0.095 0.748 663 HG23 ILE 46 HG23 ILE 46 1.689 0.341 -0.544 664 HD11 ILE 46 HD11 ILE 46 0.900 -2.932 2.165 665 HD12 ILE 46 HD12 ILE 46 0.098 -3.510 0.704 666 HD13 ILE 46 HD13 ILE 46 -0.048 -1.818 1.179 667 H GLN 47 HN GLN 47 4.813 -0.112 2.469 668 HA GLN 47 HA GLN 47 4.690 2.700 2.167 669 HB2 GLN 47 HB2 GLN 47 6.237 0.915 4.041 670 HB3 GLN 47 HB1 GLN 47 6.265 2.674 4.150 671 HG2 GLN 47 HG2 GLN 47 3.836 2.728 4.426 672 HG3 GLN 47 HG1 GLN 47 3.758 0.979 4.226 673 HE21 GLN 47 HE21 GLN 47 6.006 3.022 6.162 674 HE22 GLN 47 HE22 GLN 47 5.674 2.240 7.631 675 H SER 48 HN SER 48 7.334 0.373 1.698 676 HA SER 48 HA SER 48 9.381 2.257 1.255 677 HB2 SER 48 HB2 SER 48 9.847 -0.116 1.656 678 HB3 SER 48 HB1 SER 48 9.072 -0.538 0.132 679 HG SER 48 HG SER 48 11.241 1.276 0.332 680 H GLN 49 HN GLN 49 7.201 0.594 -0.995 681 HA GLN 49 HA GLN 49 8.233 1.783 -3.349 682 HB2 GLN 49 HB2 GLN 49 6.797 -0.278 -3.259 683 HB3 GLN 49 HB1 GLN 49 5.422 0.762 -2.890 684 HG2 GLN 49 HG2 GLN 49 5.459 0.322 -5.282 685 HG3 GLN 49 HG1 GLN 49 5.855 2.016 -5.003 686 HE21 GLN 49 HE21 GLN 49 7.489 2.640 -6.410 687 HE22 GLN 49 HE22 GLN 49 8.830 1.688 -6.828 688 H PHE 50 HN PHE 50 5.643 2.688 -1.117 689 HA PHE 50 HA PHE 50 4.525 4.778 -2.607 690 HB2 PHE 50 HB2 PHE 50 3.358 3.967 -0.666 691 HB3 PHE 50 HB1 PHE 50 4.705 4.395 0.389 692 HD1 PHE 50 HD1 PHE 50 2.648 6.089 -2.274 693 HD2 PHE 50 HD2 PHE 50 4.393 6.336 1.654 694 HE1 PHE 50 HE1 PHE 50 1.746 8.384 -2.016 695 HE2 PHE 50 HE2 PHE 50 3.494 8.635 1.901 696 HZ PHE 50 HZ PHE 50 2.169 9.664 0.071 697 H ARG 51 HN ARG 51 7.158 4.862 -0.204 698 HA ARG 51 HA ARG 51 7.587 7.641 -0.282 699 HB2 ARG 51 HB2 ARG 51 9.465 5.340 0.286 700 HB3 ARG 51 HB1 ARG 51 9.920 7.033 0.484 701 HG2 ARG 51 HG2 ARG 51 8.166 7.374 2.123 702 HG3 ARG 51 HG1 ARG 51 7.530 5.753 1.840 703 HD2 ARG 51 HD2 ARG 51 9.612 4.764 2.672 704 HD3 ARG 51 HD1 ARG 51 10.305 6.367 2.897 705 HE ARG 51 HE ARG 51 7.940 6.325 4.362 706 HH11 ARG 51 HH21 ARG 51 10.947 4.618 4.230 707 HH12 ARG 51 HH22 ARG 51 10.972 4.251 5.923 708 HH21 ARG 51 HH11 ARG 51 7.965 5.846 6.583 709 HH22 ARG 51 HH12 ARG 51 9.284 4.946 7.254 710 H LYS 52 HN LYS 52 8.894 5.002 -2.243 711 HA LYS 52 HA LYS 52 10.709 6.568 -3.759 712 HB2 LYS 52 HB2 LYS 52 9.331 3.937 -4.333 713 HB3 LYS 52 HB1 LYS 52 10.558 4.637 -5.385 714 HG2 LYS 52 HG2 LYS 52 11.131 4.285 -2.453 715 HG3 LYS 52 HG1 LYS 52 11.275 2.908 -3.542 716 HD2 LYS 52 HD2 LYS 52 12.822 4.258 -4.974 717 HD3 LYS 52 HD1 LYS 52 12.753 5.549 -3.777 718 HE2 LYS 52 HE2 LYS 52 13.629 4.016 -2.059 719 HE3 LYS 52 HE1 LYS 52 13.699 2.719 -3.252 720 HZ1 LYS 52 HZ1 LYS 52 15.013 5.194 -4.001 721 HZ2 LYS 52 HZ2 LYS 52 15.512 3.585 -4.223 722 HZ3 LYS 52 HZ3 LYS 52 15.736 4.347 -2.722 723 H PHE 53 HN PHE 53 7.326 5.676 -4.217 724 HA PHE 53 HA PHE 53 6.986 6.599 -6.844 725 HB2 PHE 53 HB2 PHE 53 5.336 5.199 -5.735 726 HB3 PHE 53 HB1 PHE 53 5.014 6.465 -4.552 727 HD1 PHE 53 HD1 PHE 53 4.857 5.676 -8.195 728 HD2 PHE 53 HD2 PHE 53 3.470 8.200 -5.008 729 HE1 PHE 53 HE1 PHE 53 3.161 6.661 -9.714 730 HE2 PHE 53 HE2 PHE 53 1.772 9.183 -6.526 731 HZ PHE 53 HZ PHE 53 1.620 8.415 -8.880 732 H GLN 54 HN GLN 54 6.387 8.314 -3.757 733 HA GLN 54 HA GLN 54 5.683 10.761 -5.062 734 HB2 GLN 54 HB2 GLN 54 5.808 11.752 -2.816 735 HB3 GLN 54 HB1 GLN 54 4.891 10.247 -2.799 736 HG2 GLN 54 HG2 GLN 54 6.917 9.040 -2.036 737 HG3 GLN 54 HG1 GLN 54 7.798 10.567 -2.000 738 HE21 GLN 54 HE21 GLN 54 6.007 8.468 -0.056 739 HE22 GLN 54 HE22 GLN 54 5.589 9.561 1.173 740 H LYS 55 HN LYS 55 8.667 9.299 -4.054 741 HA LYS 55 HA LYS 55 10.302 11.593 -3.913 742 HB2 LYS 55 HB2 LYS 55 11.005 9.369 -3.105 743 HB3 LYS 55 HB1 LYS 55 11.046 8.783 -4.768 744 HG2 LYS 55 HG2 LYS 55 12.776 10.444 -5.328 745 HG3 LYS 55 HG1 LYS 55 12.720 11.066 -3.679 746 HD2 LYS 55 HD2 LYS 55 13.422 8.864 -2.820 747 HD3 LYS 55 HD1 LYS 55 13.472 8.236 -4.468 748 HE2 LYS 55 HE2 LYS 55 15.196 9.897 -5.056 749 HE3 LYS 55 HE1 LYS 55 15.145 10.537 -3.414 750 HZ1 LYS 55 HZ1 LYS 55 15.900 7.771 -4.188 751 HZ2 LYS 55 HZ2 LYS 55 15.802 8.350 -2.594 752 HZ3 LYS 55 HZ3 LYS 55 16.961 8.985 -3.662 753 H LYS 56 HN LYS 56 9.393 9.486 -6.605 754 HA LYS 56 HA LYS 56 11.054 10.593 -8.579 755 HB2 LYS 56 HB2 LYS 56 9.824 8.477 -8.862 756 HB3 LYS 56 HB1 LYS 56 8.301 9.364 -8.885 757 HG2 LYS 56 HG2 LYS 56 9.015 10.577 -10.904 758 HG3 LYS 56 HG1 LYS 56 10.569 9.744 -10.867 759 HD2 LYS 56 HD2 LYS 56 9.409 7.579 -11.130 760 HD3 LYS 56 HD1 LYS 56 7.859 8.420 -11.182 761 HE2 LYS 56 HE2 LYS 56 10.138 8.873 -13.131 762 HE3 LYS 56 HE1 LYS 56 8.711 7.889 -13.458 763 HZ1 LYS 56 HZ1 LYS 56 8.110 9.916 -14.319 764 HZ2 LYS 56 HZ2 LYS 56 8.921 10.803 -13.120 765 HZ3 LYS 56 HZ3 LYS 56 7.458 10.022 -12.758 766 H LYS 57 HN LYS 57 7.758 11.456 -7.571 767 HA LYS 57 HA LYS 57 7.269 13.425 -9.517 768 HB2 LYS 57 HB2 LYS 57 5.519 12.479 -8.059 769 HB3 LYS 57 HB1 LYS 57 6.247 13.282 -6.668 770 HG2 LYS 57 HG2 LYS 57 5.850 15.480 -7.713 771 HG3 LYS 57 HG1 LYS 57 5.154 14.688 -9.127 772 HD2 LYS 57 HD2 LYS 57 3.374 13.730 -7.737 773 HD3 LYS 57 HD1 LYS 57 4.084 14.462 -6.299 774 HE2 LYS 57 HE2 LYS 57 2.241 15.855 -7.107 775 HE3 LYS 57 HE1 LYS 57 3.769 16.710 -7.314 776 HZ1 LYS 57 HZ1 LYS 57 2.981 15.044 -9.544 777 HZ2 LYS 57 HZ2 LYS 57 3.618 16.619 -9.532 778 HZ3 LYS 57 HZ3 LYS 57 1.961 16.368 -9.255 779 H ALA 58 HN ALA 58 8.695 13.670 -6.273 780 HA ALA 58 HA ALA 58 9.262 16.511 -6.711 781 HB1 ALA 58 HB1 ALA 58 9.974 14.968 -4.234 782 HB2 ALA 58 HB2 ALA 58 8.315 15.491 -4.528 783 HB3 ALA 58 HB3 ALA 58 9.608 16.685 -4.404 784 H GLY 59 HN GLY 59 10.732 14.029 -7.927 785 HA2 GLY 59 HA2 GLY 59 13.341 13.951 -6.878 786 HA3 GLY 59 HA1 GLY 59 12.905 13.547 -8.536 787 H SER 60 HN SER 60 11.928 15.982 -9.435 788 HA SER 60 HA SER 60 12.809 17.794 -10.580 789 HB2 SER 60 HB2 SER 60 13.609 18.442 -7.736 790 HB3 SER 60 HB1 SER 60 13.499 19.601 -9.055 791 HG SER 60 HG SER 60 11.556 18.620 -7.481 792 H GLN 61 HN GLN 61 14.574 15.600 -10.739 793 HA GLN 61 HA GLN 61 17.226 16.233 -9.980 794 HB2 GLN 61 HB2 GLN 61 17.898 14.490 -11.544 795 HB3 GLN 61 HB1 GLN 61 16.482 13.961 -10.636 796 HG2 GLN 61 HG2 GLN 61 15.045 14.728 -12.545 797 HG3 GLN 61 HG1 GLN 61 16.514 15.066 -13.458 798 HE21 GLN 61 HE21 GLN 61 17.258 13.359 -14.716 799 HE22 GLN 61 HE22 GLN 61 16.876 11.725 -14.459 800 H SER 62 HN SER 62 18.968 17.016 -11.222 801 HA SER 62 HA SER 62 19.875 18.746 -12.471 802 HB2 SER 62 HB2 SER 62 18.327 17.504 -14.737 803 HB3 SER 62 HB1 SER 62 19.929 18.236 -14.773 804 HG SER 62 HG SER 62 20.379 16.130 -14.656 Start of MODEL 10 1 H1 MET 76 HT1 MET 76 -0.137 -14.326 -20.120 2 H2 MET 76 HT2 MET 76 0.427 -12.843 -20.727 3 H3 MET 76 HT3 MET 76 1.384 -13.743 -19.650 4 HA MET 76 HA MET 76 0.864 -15.476 -21.707 5 HB2 MET 76 HB2 MET 76 1.644 -12.734 -22.750 6 HB3 MET 76 HB1 MET 76 1.555 -14.215 -23.700 7 HG2 MET 76 HG2 MET 76 -0.772 -12.910 -22.258 8 HG3 MET 76 HG1 MET 76 -0.480 -12.837 -23.993 9 HE1 MET 76 HE1 MET 76 0.459 -16.038 -24.687 10 HE2 MET 76 HE2 MET 76 -0.242 -14.623 -25.467 11 HE3 MET 76 HE3 MET 76 -1.144 -16.136 -25.428 12 H LYS 77 HN LYS 77 3.214 -12.833 -21.890 13 HA LYS 77 HA LYS 77 5.271 -14.624 -20.762 14 HB2 LYS 77 HB2 LYS 77 6.844 -13.880 -22.498 15 HB3 LYS 77 HB1 LYS 77 5.450 -14.693 -23.209 16 HG2 LYS 77 HG2 LYS 77 4.410 -12.493 -23.669 17 HG3 LYS 77 HG1 LYS 77 5.825 -11.689 -22.989 18 HD2 LYS 77 HD2 LYS 77 7.255 -12.750 -24.696 19 HD3 LYS 77 HD1 LYS 77 5.842 -13.552 -25.382 20 HE2 LYS 77 HE2 LYS 77 4.821 -11.360 -25.861 21 HE3 LYS 77 HE1 LYS 77 6.229 -10.551 -25.173 22 HZ1 LYS 77 HZ1 LYS 77 6.584 -10.606 -27.476 23 HZ2 LYS 77 HZ2 LYS 77 6.097 -12.228 -27.608 24 HZ3 LYS 77 HZ3 LYS 77 7.568 -11.839 -26.854 25 H ASP 78 HN ASP 78 3.758 -12.346 -19.636 26 HA ASP 78 HA ASP 78 6.089 -10.730 -18.850 27 HB2 ASP 78 HB2 ASP 78 3.420 -9.677 -19.795 28 HB3 ASP 78 HB1 ASP 78 4.544 -8.710 -18.842 29 H THR 79 HN THR 79 6.296 -11.156 -16.727 30 HA THR 79 HA THR 79 3.967 -11.825 -15.118 31 HB THR 79 HB THR 79 6.851 -11.522 -14.250 32 HG1 THR 79 HG1 THR 79 6.581 -13.040 -15.949 33 HG21 THR 79 HG21 THR 79 4.595 -11.826 -12.721 34 HG22 THR 79 HG22 THR 79 6.201 -12.381 -12.252 35 HG23 THR 79 HG23 THR 79 5.064 -13.503 -12.998 36 H ASP 80 HN ASP 80 6.609 -9.430 -14.882 37 HA ASP 80 HA ASP 80 6.567 -7.223 -14.220 38 HB2 ASP 80 HB2 ASP 80 4.150 -7.416 -15.293 39 HB3 ASP 80 HB1 ASP 80 3.644 -7.297 -13.610 40 H SER 81 HN SER 81 6.884 -6.218 -12.287 41 HA SER 81 HA SER 81 6.753 -7.845 -9.904 42 HB2 SER 81 HB2 SER 81 7.942 -6.026 -8.840 43 HB3 SER 81 HB1 SER 81 8.658 -6.307 -10.425 44 HG SER 81 HG SER 81 6.629 -4.594 -10.676 45 H GLU 82 HN GLU 82 4.551 -5.860 -11.440 46 HA GLU 82 HA GLU 82 3.364 -4.391 -9.401 47 HB2 GLU 82 HB2 GLU 82 2.138 -5.786 -11.782 48 HB3 GLU 82 HB1 GLU 82 1.217 -4.731 -10.713 49 HG2 GLU 82 HG2 GLU 82 2.594 -2.855 -11.244 50 HG3 GLU 82 HG1 GLU 82 3.750 -3.867 -12.114 51 H GLU 83 HN GLU 83 3.104 -7.793 -10.187 52 HA GLU 83 HA GLU 83 0.969 -8.422 -8.422 53 HB2 GLU 83 HB2 GLU 83 1.609 -10.721 -8.774 54 HB3 GLU 83 HB1 GLU 83 1.788 -9.866 -10.305 55 HG2 GLU 83 HG2 GLU 83 4.235 -9.546 -9.751 56 HG3 GLU 83 HG1 GLU 83 3.998 -10.606 -8.362 57 H GLU 84 HN GLU 84 4.466 -8.151 -8.005 58 HA GLU 84 HA GLU 84 4.716 -9.493 -5.543 59 HB2 GLU 84 HB2 GLU 84 6.633 -8.805 -6.964 60 HB3 GLU 84 HB1 GLU 84 6.307 -7.123 -6.559 61 HG2 GLU 84 HG2 GLU 84 8.084 -7.973 -5.117 62 HG3 GLU 84 HG1 GLU 84 6.649 -7.657 -4.151 63 H ILE 85 HN ILE 85 4.146 -6.068 -6.260 64 HA ILE 85 HA ILE 85 3.955 -5.241 -3.555 65 HB ILE 85 HB ILE 85 2.993 -4.003 -6.138 66 HG12 ILE 85 HG12 ILE 85 5.511 -4.210 -5.368 67 HG13 ILE 85 HG11 ILE 85 4.919 -2.689 -6.033 68 HG21 ILE 85 HG21 ILE 85 2.805 -1.920 -4.598 69 HG22 ILE 85 HG22 ILE 85 2.708 -3.088 -3.280 70 HG23 ILE 85 HG23 ILE 85 1.495 -3.101 -4.560 71 HD11 ILE 85 HD11 ILE 85 6.276 -2.597 -3.821 72 HD12 ILE 85 HD12 ILE 85 4.813 -3.212 -3.060 73 HD13 ILE 85 HD13 ILE 85 4.779 -1.673 -3.908 74 H ARG 86 HN ARG 86 1.677 -6.479 -5.901 75 HA ARG 86 HA ARG 86 -0.738 -5.837 -4.620 76 HB2 ARG 86 HB2 ARG 86 -0.524 -6.628 -6.953 77 HB3 ARG 86 HB1 ARG 86 -0.065 -8.217 -6.352 78 HG2 ARG 86 HG2 ARG 86 -2.213 -8.499 -5.272 79 HG3 ARG 86 HG1 ARG 86 -2.678 -6.850 -5.698 80 HD2 ARG 86 HD2 ARG 86 -2.530 -7.400 -8.082 81 HD3 ARG 86 HD1 ARG 86 -2.005 -9.033 -7.690 82 HE ARG 86 HE ARG 86 -4.453 -8.621 -6.398 83 HH11 ARG 86 HH21 ARG 86 -3.142 -8.727 -9.599 84 HH12 ARG 86 HH22 ARG 86 -4.609 -9.282 -10.332 85 HH21 ARG 86 HH11 ARG 86 -6.383 -9.348 -7.354 86 HH22 ARG 86 HH12 ARG 86 -6.445 -9.632 -9.062 87 H GLU 87 HN GLU 87 1.468 -8.585 -4.260 88 HA GLU 87 HA GLU 87 -0.156 -10.217 -2.653 89 HB2 GLU 87 HB2 GLU 87 2.848 -9.902 -2.759 90 HB3 GLU 87 HB1 GLU 87 2.040 -11.130 -1.782 91 HG2 GLU 87 HG2 GLU 87 1.574 -10.808 -4.754 92 HG3 GLU 87 HG1 GLU 87 2.769 -11.912 -4.080 93 H ALA 88 HN ALA 88 1.933 -7.504 -1.847 94 HA ALA 88 HA ALA 88 1.845 -7.740 0.959 95 HB1 ALA 88 HB1 ALA 88 1.881 -5.095 -0.488 96 HB2 ALA 88 HB2 ALA 88 3.283 -6.166 -0.493 97 HB3 ALA 88 HB3 ALA 88 2.665 -5.529 1.031 98 H PHE 89 HN PHE 89 -0.451 -6.367 -1.360 99 HA PHE 89 HA PHE 89 -2.122 -5.247 0.724 100 HB2 PHE 89 HB2 PHE 89 -2.438 -5.542 -2.263 101 HB3 PHE 89 HB1 PHE 89 -3.733 -4.928 -1.232 102 HD1 PHE 89 HD2 PHE 89 -3.376 -2.863 0.131 103 HD2 PHE 89 HD1 PHE 89 -0.510 -4.203 -2.772 104 HE1 PHE 89 HE2 PHE 89 -2.301 -0.629 0.163 105 HE2 PHE 89 HE1 PHE 89 0.571 -1.969 -2.736 106 HZ PHE 89 HZ PHE 89 -0.326 -0.182 -1.271 107 H ARG 90 HN ARG 90 -2.087 -8.117 -1.343 108 HA ARG 90 HA ARG 90 -4.600 -9.130 -0.859 109 HB2 ARG 90 HB2 ARG 90 -1.988 -10.593 -1.203 110 HB3 ARG 90 HB1 ARG 90 -3.532 -11.434 -1.065 111 HG2 ARG 90 HG2 ARG 90 -4.398 -10.102 -2.984 112 HG3 ARG 90 HG1 ARG 90 -2.812 -9.352 -3.149 113 HD2 ARG 90 HD2 ARG 90 -1.802 -11.573 -3.535 114 HD3 ARG 90 HD1 ARG 90 -3.386 -12.319 -3.367 115 HE ARG 90 HE ARG 90 -2.410 -10.825 -5.662 116 HH11 ARG 90 HH21 ARG 90 -5.111 -12.087 -3.905 117 HH12 ARG 90 HH22 ARG 90 -6.169 -12.110 -5.276 118 HH21 ARG 90 HH11 ARG 90 -3.789 -10.859 -7.465 119 HH22 ARG 90 HH12 ARG 90 -5.420 -11.414 -7.292 120 H VAL 91 HN VAL 91 -1.899 -8.979 1.345 121 HA VAL 91 HA VAL 91 -2.778 -10.850 3.265 122 HB VAL 91 HB VAL 91 -1.117 -8.331 3.494 123 HG11 VAL 91 HG11 VAL 91 -0.470 -9.612 5.727 124 HG12 VAL 91 HG12 VAL 91 -2.093 -10.280 5.564 125 HG13 VAL 91 HG13 VAL 91 -1.867 -8.536 5.698 126 HG21 VAL 91 HG21 VAL 91 0.719 -9.738 3.309 127 HG22 VAL 91 HG22 VAL 91 -0.431 -10.596 2.284 128 HG23 VAL 91 HG23 VAL 91 -0.154 -11.134 3.942 129 H PHE 92 HN PHE 92 -3.558 -7.477 2.681 130 HA PHE 92 HA PHE 92 -5.266 -7.316 5.031 131 HB2 PHE 92 HB2 PHE 92 -5.027 -5.296 2.804 132 HB3 PHE 92 HB1 PHE 92 -5.517 -5.021 4.472 133 HD1 PHE 92 HD2 PHE 92 -3.372 -6.635 5.910 134 HD2 PHE 92 HD1 PHE 92 -3.116 -3.922 2.593 135 HE1 PHE 92 HE2 PHE 92 -1.044 -6.129 6.507 136 HE2 PHE 92 HE1 PHE 92 -0.776 -3.425 3.195 137 HZ PHE 92 HZ PHE 92 0.270 -4.529 5.148 138 H ASP 93 HN ASP 93 -5.600 -8.057 1.652 139 HA ASP 93 HA ASP 93 -8.495 -7.612 1.707 140 HB2 ASP 93 HB2 ASP 93 -7.113 -7.105 -0.340 141 HB3 ASP 93 HB1 ASP 93 -6.855 -8.839 -0.508 142 H LYS 94 HN LYS 94 -8.623 -9.257 3.542 143 HA LYS 94 HA LYS 94 -8.137 -12.011 2.984 144 HB2 LYS 94 HB2 LYS 94 -9.242 -12.434 5.057 145 HB3 LYS 94 HB1 LYS 94 -8.286 -10.969 5.267 146 HG2 LYS 94 HG2 LYS 94 -10.403 -9.668 4.659 147 HG3 LYS 94 HG1 LYS 94 -11.275 -11.187 4.847 148 HD2 LYS 94 HD2 LYS 94 -9.507 -10.028 7.017 149 HD3 LYS 94 HD1 LYS 94 -11.235 -9.705 6.909 150 HE2 LYS 94 HE2 LYS 94 -11.648 -12.179 6.975 151 HE3 LYS 94 HE1 LYS 94 -9.923 -12.418 7.247 152 HZ1 LYS 94 HZ1 LYS 94 -10.899 -12.389 9.358 153 HZ2 LYS 94 HZ2 LYS 94 -11.867 -11.040 8.997 154 HZ3 LYS 94 HZ3 LYS 94 -10.189 -10.859 9.185 155 H ASP 95 HN ASP 95 -10.765 -9.836 2.405 156 HA ASP 95 HA ASP 95 -12.809 -11.803 2.042 157 HB2 ASP 95 HB2 ASP 95 -12.558 -8.920 1.182 158 HB3 ASP 95 HB1 ASP 95 -13.984 -9.900 0.846 159 H GLY 96 HN GLY 96 -10.270 -10.525 0.052 160 HA2 GLY 96 HA2 GLY 96 -9.527 -11.152 -2.036 161 HA3 GLY 96 HA1 GLY 96 -10.641 -12.512 -1.949 162 H ASN 97 HN ASN 97 -11.789 -9.244 -1.567 163 HA ASN 97 HA ASN 97 -13.413 -9.551 -3.981 164 HB2 ASN 97 HB2 ASN 97 -14.276 -8.756 -1.680 165 HB3 ASN 97 HB1 ASN 97 -13.510 -7.219 -2.081 166 HD21 ASN 97 HD21 ASN 97 -15.476 -6.026 -2.416 167 HD22 ASN 97 HD22 ASN 97 -16.547 -6.375 -3.686 168 H GLY 98 HN GLY 98 -10.437 -8.291 -3.213 169 HA2 GLY 98 HA2 GLY 98 -9.034 -7.263 -4.860 170 HA3 GLY 98 HA1 GLY 98 -10.478 -6.574 -5.606 171 H TYR 99 HN TYR 99 -11.135 -6.104 -2.535 172 HA TYR 99 HA TYR 99 -9.722 -3.503 -2.382 173 HB2 TYR 99 HB2 TYR 99 -12.504 -4.124 -1.373 174 HB3 TYR 99 HB1 TYR 99 -11.688 -2.558 -1.357 175 HD1 TYR 99 HD1 TYR 99 -12.658 -5.274 -3.743 176 HD2 TYR 99 HD2 TYR 99 -12.051 -1.070 -3.114 177 HE1 TYR 99 HE1 TYR 99 -13.429 -4.832 -6.046 178 HE2 TYR 99 HE2 TYR 99 -12.845 -0.620 -5.429 179 HH TYR 99 HH TYR 99 -14.588 -2.492 -7.169 180 H ILE 100 HN ILE 100 -9.479 -2.607 -0.221 181 HA ILE 100 HA ILE 100 -9.415 -4.628 1.925 182 HB ILE 100 HB ILE 100 -7.189 -4.297 2.411 183 HG12 ILE 100 HG12 ILE 100 -7.579 -1.488 1.361 184 HG13 ILE 100 HG11 ILE 100 -7.300 -1.967 3.032 185 HG21 ILE 100 HG21 ILE 100 -7.470 -4.811 -0.122 186 HG22 ILE 100 HG22 ILE 100 -5.894 -4.267 0.437 187 HG23 ILE 100 HG23 ILE 100 -6.985 -3.131 -0.361 188 HD11 ILE 100 HD11 ILE 100 -5.114 -3.036 1.903 189 HD12 ILE 100 HD12 ILE 100 -5.154 -1.381 2.506 190 HD13 ILE 100 HD13 ILE 100 -5.375 -1.700 0.785 191 H SER 101 HN SER 101 -9.884 -3.722 4.019 192 HA SER 101 HA SER 101 -11.546 -1.455 4.016 193 HB2 SER 101 HB2 SER 101 -11.660 -3.122 5.797 194 HB3 SER 101 HB1 SER 101 -10.023 -2.726 6.310 195 HG SER 101 HG SER 101 -10.876 -1.189 7.444 196 H ALA 102 HN ALA 102 -11.143 0.685 4.197 197 HA ALA 102 HA ALA 102 -8.521 1.693 3.810 198 HB1 ALA 102 HB1 ALA 102 -9.512 3.734 3.554 199 HB2 ALA 102 HB2 ALA 102 -10.628 3.488 4.898 200 HB3 ALA 102 HB3 ALA 102 -10.940 2.723 3.338 201 H ALA 103 HN ALA 103 -10.579 1.413 6.636 202 HA ALA 103 HA ALA 103 -9.117 2.976 8.438 203 HB1 ALA 103 HB1 ALA 103 -10.151 0.850 9.942 204 HB2 ALA 103 HB2 ALA 103 -11.254 1.038 8.578 205 HB3 ALA 103 HB3 ALA 103 -10.917 2.410 9.635 206 H GLU 104 HN GLU 104 -8.693 -0.470 7.629 207 HA GLU 104 HA GLU 104 -6.702 -0.915 9.625 208 HB2 GLU 104 HB2 GLU 104 -6.594 -3.066 8.831 209 HB3 GLU 104 HB1 GLU 104 -8.158 -2.597 8.171 210 HG2 GLU 104 HG2 GLU 104 -6.852 -1.837 6.088 211 HG3 GLU 104 HG1 GLU 104 -5.502 -2.755 6.747 212 H LEU 105 HN LEU 105 -6.632 0.259 6.335 213 HA LEU 105 HA LEU 105 -3.883 -0.089 5.804 214 HB2 LEU 105 HB2 LEU 105 -5.449 0.501 4.032 215 HB3 LEU 105 HB1 LEU 105 -5.790 2.044 4.812 216 HG LEU 105 HG LEU 105 -2.922 1.633 4.409 217 HD11 LEU 105 HD11 LEU 105 -3.553 0.401 2.433 218 HD12 LEU 105 HD12 LEU 105 -3.102 2.024 1.907 219 HD13 LEU 105 HD13 LEU 105 -4.804 1.576 2.032 220 HD21 LEU 105 HD21 LEU 105 -4.811 3.745 3.330 221 HD22 LEU 105 HD22 LEU 105 -3.073 3.897 3.582 222 HD23 LEU 105 HD23 LEU 105 -4.158 3.770 4.967 223 H ARG 106 HN ARG 106 -5.643 2.709 7.152 224 HA ARG 106 HA ARG 106 -3.446 4.397 7.491 225 HB2 ARG 106 HB2 ARG 106 -5.777 5.135 7.787 226 HB3 ARG 106 HB1 ARG 106 -5.898 4.171 9.259 227 HG2 ARG 106 HG2 ARG 106 -3.574 5.985 9.199 228 HG3 ARG 106 HG1 ARG 106 -5.133 6.809 9.188 229 HD2 ARG 106 HD2 ARG 106 -4.399 4.636 11.170 230 HD3 ARG 106 HD1 ARG 106 -4.218 6.355 11.494 231 HE ARG 106 HE ARG 106 -6.717 4.866 11.350 232 HH11 ARG 106 HH21 ARG 106 -5.092 7.924 11.329 233 HH12 ARG 106 HH22 ARG 106 -6.486 8.823 11.827 234 HH21 ARG 106 HH11 ARG 106 -8.549 6.041 12.000 235 HH22 ARG 106 HH12 ARG 106 -8.443 7.758 12.207 236 H HIS 107 HN HIS 107 -4.854 2.037 9.791 237 HA HIS 107 HA HIS 107 -3.027 2.475 11.888 238 HB2 HIS 107 HB2 HIS 107 -5.123 1.258 12.203 239 HB3 HIS 107 HB1 HIS 107 -4.562 -0.022 11.128 240 HD1 HIS 107 HD1 HIS 107 -3.388 1.683 14.338 241 HD2 HIS 107 HD2 HIS 107 -3.299 -2.059 12.494 242 HE1 HIS 107 HE1 HIS 107 -2.294 0.103 15.985 243 HE2 HIS 107 HE2 HIS 107 -2.233 -2.181 14.881 244 H VAL 108 HN VAL 108 -3.028 0.190 9.213 245 HA VAL 108 HA VAL 108 -0.683 -1.228 9.841 246 HB VAL 108 HB VAL 108 -2.097 -0.664 7.224 247 HG11 VAL 108 HG11 VAL 108 0.210 -1.218 6.669 248 HG12 VAL 108 HG12 VAL 108 -0.804 -2.620 6.354 249 HG13 VAL 108 HG13 VAL 108 0.189 -2.569 7.803 250 HG21 VAL 108 HG21 VAL 108 -1.989 -3.363 8.436 251 HG22 VAL 108 HG22 VAL 108 -3.340 -2.519 7.681 252 HG23 VAL 108 HG23 VAL 108 -2.898 -2.160 9.350 253 H MET 109 HN MET 109 -1.235 1.733 8.040 254 HA MET 109 HA MET 109 1.504 1.983 7.128 255 HB2 MET 109 HB2 MET 109 -0.962 3.657 6.941 256 HB3 MET 109 HB1 MET 109 0.609 4.420 6.670 257 HG2 MET 109 HG2 MET 109 -0.626 3.381 4.635 258 HG3 MET 109 HG1 MET 109 1.102 3.058 4.834 259 HE1 MET 109 HE1 MET 109 -1.203 0.645 3.181 260 HE2 MET 109 HE2 MET 109 0.385 -0.092 3.355 261 HE3 MET 109 HE3 MET 109 0.255 1.637 3.037 262 H THR 110 HN THR 110 -0.320 3.103 9.903 263 HA THR 110 HA THR 110 1.941 4.830 10.654 264 HB THR 110 HB THR 110 0.414 5.871 12.219 265 HG1 THR 110 HG1 THR 110 -1.695 4.293 11.292 266 HG21 THR 110 HG21 THR 110 0.279 6.776 10.020 267 HG22 THR 110 HG22 THR 110 -1.381 6.593 10.583 268 HG23 THR 110 HG23 THR 110 -0.701 5.429 9.451 269 H ASN 111 HN ASN 111 0.557 1.767 11.383 270 HA ASN 111 HA ASN 111 1.979 1.692 13.979 271 HB2 ASN 111 HB2 ASN 111 -0.541 1.217 13.812 272 HB3 ASN 111 HB1 ASN 111 -0.072 -0.310 13.064 273 HD21 ASN 111 HD21 ASN 111 -0.694 -1.664 14.855 274 HD22 ASN 111 HD22 ASN 111 0.100 -1.605 16.354 275 H LEU 112 HN LEU 112 1.319 -0.401 11.138 276 HA LEU 112 HA LEU 112 3.525 -2.158 11.916 277 HB2 LEU 112 HB2 LEU 112 1.664 -2.288 9.542 278 HB3 LEU 112 HB1 LEU 112 2.837 -3.521 9.985 279 HG LEU 112 HG LEU 112 0.510 -2.610 11.708 280 HD11 LEU 112 HD11 LEU 112 0.822 -4.646 9.607 281 HD12 LEU 112 HD12 LEU 112 -0.649 -3.965 10.299 282 HD13 LEU 112 HD13 LEU 112 0.183 -5.288 11.120 283 HD21 LEU 112 HD21 LEU 112 1.957 -3.428 13.303 284 HD22 LEU 112 HD22 LEU 112 2.860 -4.396 12.139 285 HD23 LEU 112 HD23 LEU 112 1.309 -4.971 12.746 286 H GLY 113 HN GLY 113 5.055 -2.880 10.179 287 HA2 GLY 113 HA2 GLY 113 6.771 -2.406 8.729 288 HA3 GLY 113 HA1 GLY 113 5.607 -1.402 7.872 289 H GLU 114 HN GLU 114 6.138 0.631 7.683 290 HA GLU 114 HA GLU 114 8.121 1.784 9.519 291 HB2 GLU 114 HB2 GLU 114 7.473 2.182 6.684 292 HB3 GLU 114 HB1 GLU 114 7.672 3.690 7.577 293 HG2 GLU 114 HG2 GLU 114 9.648 1.401 7.701 294 HG3 GLU 114 HG1 GLU 114 9.802 2.753 6.581 295 H LYS 115 HN LYS 115 7.724 4.158 10.028 296 HA LYS 115 HA LYS 115 4.930 4.420 10.918 297 HB2 LYS 115 HB2 LYS 115 7.444 5.780 11.908 298 HB3 LYS 115 HB1 LYS 115 5.828 6.025 12.567 299 HG2 LYS 115 HG2 LYS 115 6.899 3.229 12.356 300 HG3 LYS 115 HG1 LYS 115 7.463 4.260 13.671 301 HD2 LYS 115 HD2 LYS 115 5.094 4.676 14.319 302 HD3 LYS 115 HD1 LYS 115 4.578 3.567 13.050 303 HE2 LYS 115 HE2 LYS 115 4.670 2.411 15.220 304 HE3 LYS 115 HE1 LYS 115 5.872 1.750 14.111 305 HZ1 LYS 115 HZ1 LYS 115 6.522 2.406 16.533 306 HZ2 LYS 115 HZ2 LYS 115 6.638 3.968 15.872 307 HZ3 LYS 115 HZ3 LYS 115 7.587 2.704 15.248 308 H LEU 116 HN LEU 116 3.987 5.335 9.071 309 HA LEU 116 HA LEU 116 5.130 7.727 7.900 310 HB2 LEU 116 HB2 LEU 116 2.504 6.274 7.481 311 HB3 LEU 116 HB1 LEU 116 2.857 7.817 6.712 312 HG LEU 116 HG LEU 116 3.338 5.852 5.239 313 HD11 LEU 116 HD11 LEU 116 6.077 6.788 5.607 314 HD12 LEU 116 HD12 LEU 116 4.933 8.124 5.685 315 HD13 LEU 116 HD13 LEU 116 4.970 7.079 4.269 316 HD21 LEU 116 HD21 LEU 116 4.109 4.452 7.240 317 HD22 LEU 116 HD22 LEU 116 5.650 5.295 7.108 318 HD23 LEU 116 HD23 LEU 116 5.061 4.314 5.767 319 H THR 117 HN THR 117 4.183 9.846 8.073 320 HA THR 117 HA THR 117 2.799 10.226 10.634 321 HB THR 117 HB THR 117 3.482 12.507 10.523 322 HG1 THR 117 HG1 THR 117 3.322 12.048 7.897 323 HG21 THR 117 HG21 THR 117 5.744 12.198 10.732 324 HG22 THR 117 HG22 THR 117 5.873 11.340 9.196 325 HG23 THR 117 HG23 THR 117 5.276 10.501 10.629 326 H ASP 118 HN ASP 118 1.246 12.281 10.454 327 HA ASP 118 HA ASP 118 -1.016 11.426 9.019 328 HB2 ASP 118 HB2 ASP 118 -0.307 14.091 10.250 329 HB3 ASP 118 HB1 ASP 118 -1.874 13.761 9.516 330 H GLU 119 HN GLU 119 1.473 13.824 8.258 331 HA GLU 119 HA GLU 119 0.264 14.908 5.954 332 HB2 GLU 119 HB2 GLU 119 2.185 15.944 7.105 333 HB3 GLU 119 HB1 GLU 119 3.211 14.612 6.578 334 HG2 GLU 119 HG2 GLU 119 2.810 15.190 4.232 335 HG3 GLU 119 HG1 GLU 119 1.703 16.473 4.718 336 H GLU 120 HN GLU 120 2.486 12.147 6.349 337 HA GLU 120 HA GLU 120 2.655 11.608 3.544 338 HB2 GLU 120 HB2 GLU 120 3.407 10.110 6.031 339 HB3 GLU 120 HB1 GLU 120 3.453 9.321 4.452 340 HG2 GLU 120 HG2 GLU 120 5.626 10.415 5.175 341 HG3 GLU 120 HG1 GLU 120 5.018 10.922 3.602 342 H VAL 121 HN VAL 121 0.768 10.230 6.231 343 HA VAL 121 HA VAL 121 -0.529 8.220 4.696 344 HB VAL 121 HB VAL 121 -1.298 9.631 7.280 345 HG11 VAL 121 HG11 VAL 121 -3.345 8.803 6.459 346 HG12 VAL 121 HG12 VAL 121 -2.762 7.517 7.517 347 HG13 VAL 121 HG13 VAL 121 -2.586 7.368 5.767 348 HG21 VAL 121 HG21 VAL 121 0.232 8.244 8.196 349 HG22 VAL 121 HG22 VAL 121 0.562 7.526 6.619 350 HG23 VAL 121 HG23 VAL 121 -0.722 6.875 7.632 351 H ASP 122 HN ASP 122 -1.421 11.588 5.535 352 HA ASP 122 HA ASP 122 -4.011 11.626 4.602 353 HB2 ASP 122 HB2 ASP 122 -2.926 13.533 5.720 354 HB3 ASP 122 HB1 ASP 122 -1.932 13.806 4.290 355 H GLU 123 HN GLU 123 -1.007 11.996 2.761 356 HA GLU 123 HA GLU 123 -2.174 12.524 0.233 357 HB2 GLU 123 HB2 GLU 123 0.450 11.193 0.962 358 HB3 GLU 123 HB1 GLU 123 0.009 11.699 -0.666 359 HG2 GLU 123 HG2 GLU 123 0.106 13.561 1.714 360 HG3 GLU 123 HG1 GLU 123 1.430 13.351 0.567 361 H MET 124 HN MET 124 -1.521 9.586 2.027 362 HA MET 124 HA MET 124 -1.993 7.789 -0.171 363 HB2 MET 124 HB2 MET 124 -1.918 7.329 2.827 364 HB3 MET 124 HB1 MET 124 -1.940 6.070 1.596 365 HG2 MET 124 HG2 MET 124 0.169 6.854 0.682 366 HG3 MET 124 HG1 MET 124 0.163 8.231 1.772 367 HE1 MET 124 HE1 MET 124 -0.717 4.346 2.537 368 HE2 MET 124 HE2 MET 124 0.968 3.853 2.658 369 HE3 MET 124 HE3 MET 124 0.385 4.608 1.181 370 H ILE 125 HN ILE 125 -3.826 9.176 2.492 371 HA ILE 125 HA ILE 125 -6.122 7.586 2.356 372 HB ILE 125 HB ILE 125 -5.303 10.029 3.624 373 HG12 ILE 125 HG12 ILE 125 -6.750 9.140 5.422 374 HG13 ILE 125 HG11 ILE 125 -7.361 7.923 4.304 375 HG21 ILE 125 HG21 ILE 125 -8.192 9.869 2.751 376 HG22 ILE 125 HG22 ILE 125 -7.043 11.155 2.380 377 HG23 ILE 125 HG23 ILE 125 -7.599 10.915 4.033 378 HD11 ILE 125 HD11 ILE 125 -4.411 8.089 4.509 379 HD12 ILE 125 HD12 ILE 125 -5.450 6.671 4.416 380 HD13 ILE 125 HD13 ILE 125 -5.235 7.506 5.953 381 H ARG 126 HN ARG 126 -5.332 10.601 0.611 382 HA ARG 126 HA ARG 126 -7.852 10.970 -0.592 383 HB2 ARG 126 HB2 ARG 126 -5.708 12.486 -0.573 384 HB3 ARG 126 HB1 ARG 126 -5.325 11.623 -2.065 385 HG2 ARG 126 HG2 ARG 126 -7.885 12.172 -2.601 386 HG3 ARG 126 HG1 ARG 126 -7.573 13.504 -1.488 387 HD2 ARG 126 HD2 ARG 126 -5.657 14.213 -2.852 388 HD3 ARG 126 HD1 ARG 126 -5.919 12.857 -3.945 389 HE ARG 126 HE ARG 126 -7.819 13.944 -4.801 390 HH11 ARG 126 HH21 ARG 126 -6.403 15.651 -2.135 391 HH12 ARG 126 HH22 ARG 126 -7.284 17.111 -2.430 392 HH21 ARG 126 HH11 ARG 126 -8.972 15.860 -5.185 393 HH22 ARG 126 HH12 ARG 126 -8.736 17.230 -4.151 394 H GLU 127 HN GLU 127 -4.926 9.691 -2.185 395 HA GLU 127 HA GLU 127 -6.229 8.659 -4.419 396 HB2 GLU 127 HB2 GLU 127 -3.618 7.840 -3.129 397 HB3 GLU 127 HB1 GLU 127 -4.135 7.342 -4.742 398 HG2 GLU 127 HG2 GLU 127 -4.281 9.700 -5.436 399 HG3 GLU 127 HG1 GLU 127 -3.786 10.211 -3.824 400 H ALA 128 HN ALA 128 -6.430 7.531 -1.257 401 HA ALA 128 HA ALA 128 -6.565 4.705 -1.800 402 HB1 ALA 128 HB1 ALA 128 -6.568 6.405 0.473 403 HB2 ALA 128 HB2 ALA 128 -6.430 4.657 0.440 404 HB3 ALA 128 HB3 ALA 128 -8.013 5.421 0.564 405 H ASP 129 HN ASP 129 -9.120 6.823 -0.502 406 HA ASP 129 HA ASP 129 -11.077 6.727 -2.376 407 HB2 ASP 129 HB2 ASP 129 -11.149 4.395 -2.656 408 HB3 ASP 129 HB1 ASP 129 -10.913 4.096 -0.932 409 H ILE 130 HN ILE 130 -11.743 5.050 0.582 410 HA ILE 130 HA ILE 130 -13.330 5.558 2.189 411 HB ILE 130 HB ILE 130 -11.722 8.012 2.761 412 HG12 ILE 130 HG12 ILE 130 -10.392 5.857 3.992 413 HG13 ILE 130 HG11 ILE 130 -10.569 5.374 2.310 414 HG21 ILE 130 HG21 ILE 130 -12.319 7.564 4.948 415 HG22 ILE 130 HG22 ILE 130 -12.376 5.820 4.688 416 HG23 ILE 130 HG23 ILE 130 -13.693 6.841 4.110 417 HD11 ILE 130 HD11 ILE 130 -9.436 8.015 3.262 418 HD12 ILE 130 HD12 ILE 130 -9.573 7.506 1.581 419 HD13 ILE 130 HD13 ILE 130 -8.478 6.658 2.674 420 H ASP 131 HN ASP 131 -14.240 6.514 -0.274 421 HA ASP 131 HA ASP 131 -15.019 9.230 -0.247 422 HB2 ASP 131 HB2 ASP 131 -16.252 6.784 -1.532 423 HB3 ASP 131 HB1 ASP 131 -16.871 8.415 -1.782 424 H GLY 132 HN GLY 132 -16.411 6.303 1.093 425 HA2 GLY 132 HA2 GLY 132 -17.649 7.399 3.287 426 HA3 GLY 132 HA1 GLY 132 -18.855 7.481 2.002 427 H ASP 133 HN ASP 133 -16.431 4.967 2.103 428 HA ASP 133 HA ASP 133 -18.445 3.034 3.041 429 HB2 ASP 133 HB2 ASP 133 -16.743 2.862 0.561 430 HB3 ASP 133 HB1 ASP 133 -17.483 1.441 1.300 431 H GLY 134 HN GLY 134 -15.209 4.166 3.080 432 HA2 GLY 134 HA2 GLY 134 -13.470 3.618 4.493 433 HA3 GLY 134 HA1 GLY 134 -14.541 2.468 5.280 434 H GLN 135 HN GLN 135 -13.833 2.356 1.824 435 HA GLN 135 HA GLN 135 -12.104 0.002 2.291 436 HB2 GLN 135 HB2 GLN 135 -13.130 -0.982 0.195 437 HB3 GLN 135 HB1 GLN 135 -14.178 -0.950 1.619 438 HG2 GLN 135 HG2 GLN 135 -15.215 1.132 0.803 439 HG3 GLN 135 HG1 GLN 135 -14.172 1.101 -0.616 440 HE21 GLN 135 HE21 GLN 135 -15.481 0.495 -2.352 441 HE22 GLN 135 HE22 GLN 135 -16.566 -0.809 -2.331 442 H VAL 136 HN VAL 136 -10.504 -0.371 0.810 443 HA VAL 136 HA VAL 136 -10.005 1.763 -1.164 444 HB VAL 136 HB VAL 136 -8.104 0.613 0.859 445 HG11 VAL 136 HG11 VAL 136 -6.777 0.584 -1.077 446 HG12 VAL 136 HG12 VAL 136 -6.472 2.193 -0.414 447 HG13 VAL 136 HG13 VAL 136 -7.593 1.994 -1.762 448 HG21 VAL 136 HG21 VAL 136 -8.951 3.409 0.115 449 HG22 VAL 136 HG22 VAL 136 -7.776 3.004 1.364 450 HG23 VAL 136 HG23 VAL 136 -9.462 2.528 1.549 451 H ASN 137 HN ASN 137 -9.357 1.155 -3.113 452 HA ASN 137 HA ASN 137 -9.075 -1.711 -3.644 453 HB2 ASN 137 HB2 ASN 137 -10.610 -0.211 -4.995 454 HB3 ASN 137 HB1 ASN 137 -9.168 0.575 -5.626 455 HD21 ASN 137 HD21 ASN 137 -9.835 -0.266 -7.798 456 HD22 ASN 137 HD22 ASN 137 -9.504 -1.882 -8.198 457 H TYR 138 HN TYR 138 -7.006 -2.464 -3.470 458 HA TYR 138 HA TYR 138 -4.739 -0.774 -3.479 459 HB2 TYR 138 HB2 TYR 138 -3.424 -2.892 -3.515 460 HB3 TYR 138 HB1 TYR 138 -4.657 -2.839 -2.259 461 HD1 TYR 138 HD1 TYR 138 -3.814 -4.226 -5.600 462 HD2 TYR 138 HD2 TYR 138 -6.513 -4.364 -2.260 463 HE1 TYR 138 HE1 TYR 138 -4.804 -6.326 -6.480 464 HE2 TYR 138 HE2 TYR 138 -7.492 -6.460 -3.136 465 HH TYR 138 HH TYR 138 -7.066 -7.528 -6.249 466 H GLU 139 HN GLU 139 -6.522 -1.909 -6.126 467 HA GLU 139 HA GLU 139 -4.498 -2.449 -8.006 468 HB2 GLU 139 HB2 GLU 139 -7.342 -1.629 -8.133 469 HB3 GLU 139 HB1 GLU 139 -6.382 -1.301 -9.571 470 HG2 GLU 139 HG2 GLU 139 -7.386 -3.507 -9.770 471 HG3 GLU 139 HG1 GLU 139 -5.646 -3.691 -9.575 472 H GLU 140 HN GLU 140 -6.154 0.665 -7.340 473 HA GLU 140 HA GLU 140 -4.646 2.182 -9.160 474 HB2 GLU 140 HB2 GLU 140 -6.054 2.975 -6.605 475 HB3 GLU 140 HB1 GLU 140 -5.347 4.135 -7.730 476 HG2 GLU 140 HG2 GLU 140 -7.392 2.056 -8.545 477 HG3 GLU 140 HG1 GLU 140 -7.813 3.704 -8.083 478 H PHE 141 HN PHE 141 -4.078 1.413 -5.767 479 HA PHE 141 HA PHE 141 -1.827 3.103 -5.361 480 HB2 PHE 141 HB2 PHE 141 -3.014 0.766 -4.000 481 HB3 PHE 141 HB1 PHE 141 -1.271 0.924 -3.787 482 HD1 PHE 141 HD2 PHE 141 -0.443 3.394 -3.305 483 HD2 PHE 141 HD1 PHE 141 -4.416 1.948 -2.518 484 HE1 PHE 141 HE2 PHE 141 -0.770 5.199 -1.639 485 HE2 PHE 141 HE1 PHE 141 -4.723 3.739 -0.841 486 HZ PHE 141 HZ PHE 141 -2.915 5.370 -0.407 487 H VAL 142 HN VAL 142 -2.067 -0.265 -6.482 488 HA VAL 142 HA VAL 142 0.724 -0.652 -6.784 489 HB VAL 142 HB VAL 142 -1.668 -2.001 -8.050 490 HG11 VAL 142 HG11 VAL 142 0.023 -2.444 -9.622 491 HG12 VAL 142 HG12 VAL 142 0.175 -3.800 -8.505 492 HG13 VAL 142 HG13 VAL 142 1.293 -2.440 -8.398 493 HG21 VAL 142 HG21 VAL 142 -0.459 -2.127 -5.491 494 HG22 VAL 142 HG22 VAL 142 0.051 -3.586 -6.340 495 HG23 VAL 142 HG23 VAL 142 -1.665 -3.232 -6.154 496 H GLN 143 HN GLN 143 -1.787 0.439 -9.053 497 HA GLN 143 HA GLN 143 -0.092 0.604 -11.322 498 HB2 GLN 143 HB2 GLN 143 -2.644 2.059 -10.603 499 HB3 GLN 143 HB1 GLN 143 -1.842 2.222 -12.166 500 HG2 GLN 143 HG2 GLN 143 -2.077 -0.137 -12.610 501 HG3 GLN 143 HG1 GLN 143 -2.678 -0.432 -10.979 502 HE21 GLN 143 HE21 GLN 143 -4.048 -0.893 -13.612 503 HE22 GLN 143 HE22 GLN 143 -5.491 -0.006 -13.525 504 H MET 144 HN MET 144 -0.977 2.931 -8.815 505 HA MET 144 HA MET 144 0.549 5.106 -9.887 506 HB2 MET 144 HB2 MET 144 -1.008 5.966 -8.453 507 HB3 MET 144 HB1 MET 144 -1.017 4.534 -7.436 508 HG2 MET 144 HG2 MET 144 0.890 5.217 -6.243 509 HG3 MET 144 HG1 MET 144 1.321 6.435 -7.447 510 HE1 MET 144 HE1 MET 144 -1.945 5.436 -5.343 511 HE2 MET 144 HE2 MET 144 -1.739 6.647 -4.081 512 HE3 MET 144 HE3 MET 144 -0.470 5.465 -4.370 513 H MET 145 HN MET 145 1.106 2.867 -7.166 514 HA MET 145 HA MET 145 3.663 3.776 -6.492 515 HB2 MET 145 HB2 MET 145 2.298 1.099 -6.133 516 HB3 MET 145 HB1 MET 145 3.854 1.516 -5.421 517 HG2 MET 145 HG2 MET 145 2.931 3.213 -4.067 518 HG3 MET 145 HG1 MET 145 1.456 3.297 -5.023 519 HE1 MET 145 HE1 MET 145 3.477 1.574 -2.289 520 HE2 MET 145 HE2 MET 145 3.554 0.313 -3.521 521 HE3 MET 145 HE3 MET 145 2.669 0.022 -2.037 522 H THR 146 HN THR 146 2.646 1.240 -8.786 523 HA THR 146 HA THR 146 5.286 0.273 -9.272 524 HB THR 146 HB THR 146 2.822 0.077 -11.032 525 HG1 THR 146 HG1 THR 146 2.269 -1.579 -9.808 526 HG21 THR 146 HG21 THR 146 5.434 -0.617 -11.653 527 HG22 THR 146 HG22 THR 146 3.994 -1.344 -12.364 528 HG23 THR 146 HG23 THR 146 4.783 -2.112 -10.988 529 H ALA 147 HN ALA 147 3.217 2.686 -10.832 530 HA ALA 147 HA ALA 147 4.639 3.205 -13.138 531 HB1 ALA 147 HB1 ALA 147 3.856 5.641 -12.734 532 HB2 ALA 147 HB2 ALA 147 3.060 4.985 -11.304 533 HB3 ALA 147 HB3 ALA 147 2.629 4.385 -12.905 534 H LYS 148 HN LYS 148 4.865 5.907 -11.059 535 HA LYS 148 HA LYS 148 7.596 6.378 -11.616 536 HB2 LYS 148 HB2 LYS 148 6.081 7.472 -9.244 537 HB3 LYS 148 HB1 LYS 148 7.425 8.218 -10.103 538 HG2 LYS 148 HG2 LYS 148 4.686 7.684 -11.297 539 HG3 LYS 148 HG1 LYS 148 5.236 9.246 -10.699 540 HD2 LYS 148 HD2 LYS 148 7.127 9.140 -12.360 541 HD3 LYS 148 HD1 LYS 148 6.391 7.682 -13.026 542 HE2 LYS 148 HE2 LYS 148 4.316 8.927 -13.489 543 HE3 LYS 148 HE1 LYS 148 5.055 10.393 -12.845 544 HZ1 LYS 148 HZ1 LYS 148 6.739 9.172 -14.774 545 HZ2 LYS 148 HZ2 LYS 148 6.090 10.742 -14.756 546 HZ3 LYS 148 HZ3 LYS 148 5.202 9.461 -15.433 547 H PHE 30 HT1 PHE 30 -8.721 -3.240 13.316 548 HA PHE 30 HA PHE 30 -8.214 -4.265 10.985 549 HB2 PHE 30 HB2 PHE 30 -6.580 -5.324 13.278 550 HB3 PHE 30 HB1 PHE 30 -6.034 -4.629 11.752 551 HD1 PHE 30 HD2 PHE 30 -7.398 -2.131 11.486 552 HD2 PHE 30 HD1 PHE 30 -5.883 -3.971 15.057 553 HE1 PHE 30 HE2 PHE 30 -7.216 0.098 12.554 554 HE2 PHE 30 HE1 PHE 30 -5.702 -1.742 16.128 555 HZ PHE 30 HZ PHE 30 -6.368 0.292 14.877 556 H ASP 31 HN ASP 31 -8.812 -6.008 9.877 557 HA ASP 31 HA ASP 31 -9.383 -8.515 11.323 558 HB2 ASP 31 HB2 ASP 31 -10.711 -9.136 9.366 559 HB3 ASP 31 HB1 ASP 31 -11.231 -7.573 9.992 560 H ILE 32 HN ILE 32 -6.694 -7.436 10.334 561 HA ILE 32 HA ILE 32 -5.998 -9.551 8.404 562 HB ILE 32 HB ILE 32 -4.146 -8.249 7.790 563 HG12 ILE 32 HG12 ILE 32 -4.477 -6.871 10.477 564 HG13 ILE 32 HG11 ILE 32 -3.117 -7.863 9.950 565 HG21 ILE 32 HG21 ILE 32 -6.416 -7.215 7.333 566 HG22 ILE 32 HG22 ILE 32 -5.068 -6.082 7.318 567 HG23 ILE 32 HG23 ILE 32 -6.128 -6.166 8.722 568 HD11 ILE 32 HD11 ILE 32 -2.388 -5.606 9.725 569 HD12 ILE 32 HD12 ILE 32 -3.892 -5.120 8.947 570 HD13 ILE 32 HD13 ILE 32 -2.755 -6.161 8.095 571 H ASP 33 HN ASP 33 -4.023 -10.781 8.739 572 HA ASP 33 HA ASP 33 -3.802 -11.689 11.476 573 HB2 ASP 33 HB2 ASP 33 -2.253 -12.525 9.010 574 HB3 ASP 33 HB1 ASP 33 -2.257 -13.362 10.561 575 H MET 34 HN MET 34 -3.036 -9.675 12.354 576 HA MET 34 HA MET 34 -0.637 -8.427 11.552 577 HB2 MET 34 HB2 MET 34 -2.036 -8.420 14.236 578 HB3 MET 34 HB1 MET 34 -0.746 -7.316 13.760 579 HG2 MET 34 HG2 MET 34 -2.159 -6.615 11.805 580 HG3 MET 34 HG1 MET 34 -3.465 -7.599 12.455 581 HE1 MET 34 HE1 MET 34 -0.765 -5.003 13.842 582 HE2 MET 34 HE2 MET 34 -1.833 -3.609 13.921 583 HE3 MET 34 HE3 MET 34 -1.581 -4.424 12.384 584 H ASP 35 HN ASP 35 -1.314 -11.057 13.781 585 HA ASP 35 HA ASP 35 1.139 -11.147 15.143 586 HB2 ASP 35 HB2 ASP 35 -0.876 -13.292 14.475 587 HB3 ASP 35 HB1 ASP 35 0.538 -13.589 15.485 588 H ALA 36 HN ALA 36 0.160 -12.573 12.047 589 HA ALA 36 HA ALA 36 2.353 -14.256 11.650 590 HB1 ALA 36 HB1 ALA 36 0.111 -13.543 10.218 591 HB2 ALA 36 HB2 ALA 36 1.370 -14.654 9.676 592 HB3 ALA 36 HB3 ALA 36 1.434 -12.952 9.213 593 HA PRO 37 HA PRO 37 5.634 -11.070 11.353 594 HB2 PRO 37 HB2 PRO 37 7.010 -13.327 9.951 595 HB3 PRO 37 HB1 PRO 37 7.610 -12.266 11.242 596 HG2 PRO 37 HG2 PRO 37 6.886 -14.743 11.777 597 HG3 PRO 37 HG1 PRO 37 6.492 -13.422 12.894 598 HD2 PRO 37 HD2 PRO 37 4.690 -14.878 10.993 599 HD3 PRO 37 HD1 PRO 37 4.355 -14.215 12.612 600 H GLU 38 HN GLU 38 4.494 -13.101 8.722 601 HA GLU 38 HA GLU 38 5.730 -11.819 6.551 602 HB2 GLU 38 HB2 GLU 38 3.096 -13.292 6.750 603 HB3 GLU 38 HB1 GLU 38 3.809 -12.763 5.226 604 HG2 GLU 38 HG2 GLU 38 5.247 -14.528 7.224 605 HG3 GLU 38 HG1 GLU 38 4.341 -15.153 5.848 606 H THR 39 HN THR 39 2.769 -11.087 8.318 607 HA THR 39 HA THR 39 1.684 -9.178 6.572 608 HB THR 39 HB THR 39 1.529 -9.302 9.594 609 HG1 THR 39 HG1 THR 39 -0.322 -10.189 7.651 610 HG21 THR 39 HG21 THR 39 0.433 -7.346 9.400 611 HG22 THR 39 HG22 THR 39 -0.815 -8.223 8.516 612 HG23 THR 39 HG23 THR 39 0.490 -7.424 7.641 613 H GLU 40 HN GLU 40 3.991 -8.794 9.262 614 HA GLU 40 HA GLU 40 4.177 -5.984 9.140 615 HB2 GLU 40 HB2 GLU 40 6.135 -8.090 10.070 616 HB3 GLU 40 HB1 GLU 40 6.421 -6.358 10.246 617 HG2 GLU 40 HG2 GLU 40 4.427 -6.104 11.596 618 HG3 GLU 40 HG1 GLU 40 3.964 -7.779 11.303 619 H ARG 41 HN ARG 41 5.970 -8.539 7.456 620 HA ARG 41 HA ARG 41 7.864 -6.859 6.195 621 HB2 ARG 41 HB2 ARG 41 6.736 -9.548 5.375 622 HB3 ARG 41 HB1 ARG 41 8.098 -8.770 4.577 623 HG2 ARG 41 HG2 ARG 41 8.086 -9.352 7.549 624 HG3 ARG 41 HG1 ARG 41 8.674 -10.517 6.366 625 HD2 ARG 41 HD2 ARG 41 10.299 -8.801 5.548 626 HD3 ARG 41 HD1 ARG 41 9.770 -7.721 6.829 627 HE ARG 41 HE ARG 41 11.402 -10.105 7.149 628 HH11 ARG 41 HH21 ARG 41 9.425 -7.651 8.588 629 HH12 ARG 41 HH22 ARG 41 10.108 -7.836 10.167 630 HH21 ARG 41 HH11 ARG 41 12.299 -10.349 9.218 631 HH22 ARG 41 HH12 ARG 41 11.733 -9.362 10.525 632 H ALA 42 HN ALA 42 4.636 -7.933 5.236 633 HA ALA 42 HA ALA 42 4.675 -6.929 2.604 634 HB1 ALA 42 HB1 ALA 42 2.513 -7.584 4.575 635 HB2 ALA 42 HB2 ALA 42 2.872 -8.336 3.021 636 HB3 ALA 42 HB3 ALA 42 2.099 -6.753 3.075 637 H ALA 43 HN ALA 43 3.799 -5.429 5.684 638 HA ALA 43 HA ALA 43 2.816 -2.994 4.663 639 HB1 ALA 43 HB1 ALA 43 2.463 -3.687 6.986 640 HB2 ALA 43 HB2 ALA 43 3.245 -2.108 6.923 641 HB3 ALA 43 HB3 ALA 43 4.192 -3.547 7.302 642 H VAL 44 HN VAL 44 6.082 -4.039 5.536 643 HA VAL 44 HA VAL 44 7.369 -1.550 5.321 644 HB VAL 44 HB VAL 44 8.386 -4.363 4.901 645 HG11 VAL 44 HG11 VAL 44 9.734 -1.696 4.688 646 HG12 VAL 44 HG12 VAL 44 10.017 -3.170 3.760 647 HG13 VAL 44 HG13 VAL 44 10.624 -3.035 5.411 648 HG21 VAL 44 HG21 VAL 44 9.439 -3.879 7.136 649 HG22 VAL 44 HG22 VAL 44 7.677 -3.904 7.176 650 HG23 VAL 44 HG23 VAL 44 8.537 -2.365 7.180 651 H ALA 45 HN ALA 45 6.872 -4.094 2.861 652 HA ALA 45 HA ALA 45 8.309 -2.832 0.796 653 HB1 ALA 45 HB1 ALA 45 5.853 -4.461 0.236 654 HB2 ALA 45 HB2 ALA 45 7.279 -5.228 0.936 655 HB3 ALA 45 HB3 ALA 45 7.388 -4.427 -0.631 656 H ILE 46 HN ILE 46 4.876 -2.648 1.682 657 HA ILE 46 HA ILE 46 4.083 -0.956 -0.435 658 HB ILE 46 HB ILE 46 2.953 -1.439 2.317 659 HG12 ILE 46 HG12 ILE 46 1.919 -2.228 -0.417 660 HG13 ILE 46 HG11 ILE 46 2.984 -3.259 0.540 661 HG21 ILE 46 HG21 ILE 46 0.863 -0.391 1.081 662 HG22 ILE 46 HG22 ILE 46 2.103 0.439 0.144 663 HG23 ILE 46 HG23 ILE 46 2.037 0.649 1.888 664 HD11 ILE 46 HD11 ILE 46 0.493 -3.713 0.807 665 HD12 ILE 46 HD12 ILE 46 0.386 -2.148 1.614 666 HD13 ILE 46 HD13 ILE 46 1.380 -3.431 2.305 667 H GLN 47 HN GLN 47 5.049 -0.224 2.912 668 HA GLN 47 HA GLN 47 4.769 2.586 2.661 669 HB2 GLN 47 HB2 GLN 47 6.374 0.871 4.559 670 HB3 GLN 47 HB1 GLN 47 6.256 2.624 4.699 671 HG2 GLN 47 HG2 GLN 47 3.786 2.435 4.815 672 HG3 GLN 47 HG1 GLN 47 3.930 0.679 4.731 673 HE21 GLN 47 HE21 GLN 47 3.672 -0.190 6.792 674 HE22 GLN 47 HE22 GLN 47 4.306 0.492 8.211 675 H SER 48 HN SER 48 7.525 0.393 2.221 676 HA SER 48 HA SER 48 9.484 2.392 1.834 677 HB2 SER 48 HB2 SER 48 9.329 -0.448 0.806 678 HB3 SER 48 HB1 SER 48 10.757 0.575 0.677 679 HG SER 48 HG SER 48 9.776 -0.802 2.807 680 H GLN 49 HN GLN 49 7.385 0.645 -0.425 681 HA GLN 49 HA GLN 49 8.416 1.847 -2.775 682 HB2 GLN 49 HB2 GLN 49 7.069 -0.258 -2.729 683 HB3 GLN 49 HB1 GLN 49 5.647 0.706 -2.341 684 HG2 GLN 49 HG2 GLN 49 5.717 0.287 -4.748 685 HG3 GLN 49 HG1 GLN 49 5.983 2.000 -4.441 686 HE21 GLN 49 HE21 GLN 49 7.583 2.771 -5.817 687 HE22 GLN 49 HE22 GLN 49 8.986 1.920 -6.254 688 H PHE 50 HN PHE 50 5.782 2.682 -0.576 689 HA PHE 50 HA PHE 50 4.613 4.739 -2.082 690 HB2 PHE 50 HB2 PHE 50 3.498 3.862 -0.113 691 HB3 PHE 50 HB1 PHE 50 4.812 4.422 0.924 692 HD1 PHE 50 HD1 PHE 50 2.542 5.777 -1.735 693 HD2 PHE 50 HD2 PHE 50 4.495 6.462 2.035 694 HE1 PHE 50 HE1 PHE 50 1.481 8.021 -1.590 695 HE2 PHE 50 HE2 PHE 50 3.440 8.705 2.174 696 HZ PHE 50 HZ PHE 50 1.933 9.489 0.365 697 H ARG 51 HN ARG 51 7.206 4.878 0.351 698 HA ARG 51 HA ARG 51 7.594 7.658 0.295 699 HB2 ARG 51 HB2 ARG 51 8.569 6.175 2.012 700 HB3 ARG 51 HB1 ARG 51 9.646 5.484 0.797 701 HG2 ARG 51 HG2 ARG 51 10.709 7.641 0.438 702 HG3 ARG 51 HG1 ARG 51 9.557 8.428 1.518 703 HD2 ARG 51 HD2 ARG 51 11.445 6.219 2.369 704 HD3 ARG 51 HD1 ARG 51 11.769 7.935 2.597 705 HE ARG 51 HE ARG 51 9.260 7.415 3.715 706 HH11 ARG 51 HH21 ARG 51 12.572 6.494 4.124 707 HH12 ARG 51 HH22 ARG 51 12.430 6.228 5.830 708 HH21 ARG 51 HH11 ARG 51 9.068 7.069 5.952 709 HH22 ARG 51 HH12 ARG 51 10.447 6.553 6.865 710 H LYS 52 HN LYS 52 9.029 5.069 -1.676 711 HA LYS 52 HA LYS 52 10.880 6.664 -3.083 712 HB2 LYS 52 HB2 LYS 52 9.432 4.120 -3.846 713 HB3 LYS 52 HB1 LYS 52 10.698 4.849 -4.836 714 HG2 LYS 52 HG2 LYS 52 12.274 4.696 -2.949 715 HG3 LYS 52 HG1 LYS 52 11.014 3.978 -1.948 716 HD2 LYS 52 HD2 LYS 52 10.842 2.075 -3.493 717 HD3 LYS 52 HD1 LYS 52 12.069 2.797 -4.534 718 HE2 LYS 52 HE2 LYS 52 13.098 1.103 -3.095 719 HE3 LYS 52 HE1 LYS 52 13.690 2.704 -2.653 720 HZ1 LYS 52 HZ1 LYS 52 12.805 1.035 -0.855 721 HZ2 LYS 52 HZ2 LYS 52 11.302 1.691 -1.297 722 HZ3 LYS 52 HZ3 LYS 52 12.534 2.703 -0.711 723 H PHE 53 HN PHE 53 7.480 5.894 -3.691 724 HA PHE 53 HA PHE 53 7.246 7.093 -6.232 725 HB2 PHE 53 HB2 PHE 53 5.523 5.608 -5.253 726 HB3 PHE 53 HB1 PHE 53 5.135 6.857 -4.071 727 HD1 PHE 53 HD1 PHE 53 4.969 5.900 -7.631 728 HD2 PHE 53 HD2 PHE 53 3.984 8.906 -4.723 729 HE1 PHE 53 HE1 PHE 53 3.439 6.980 -9.265 730 HE2 PHE 53 HE2 PHE 53 2.462 9.987 -6.356 731 HZ PHE 53 HZ PHE 53 2.194 9.026 -8.626 732 H GLN 54 HN GLN 54 6.751 8.379 -2.963 733 HA GLN 54 HA GLN 54 5.875 10.950 -3.683 734 HB2 GLN 54 HB2 GLN 54 7.358 9.952 -1.243 735 HB3 GLN 54 HB1 GLN 54 6.711 11.587 -1.389 736 HG2 GLN 54 HG2 GLN 54 4.453 10.676 -1.735 737 HG3 GLN 54 HG1 GLN 54 5.092 9.036 -1.621 738 HE21 GLN 54 HE21 GLN 54 3.403 11.164 0.199 739 HE22 GLN 54 HE22 GLN 54 3.979 10.766 1.745 740 H LYS 55 HN LYS 55 9.141 9.657 -3.169 741 HA LYS 55 HA LYS 55 10.539 12.094 -3.318 742 HB2 LYS 55 HB2 LYS 55 11.562 9.979 -2.553 743 HB3 LYS 55 HB1 LYS 55 11.456 9.343 -4.194 744 HG2 LYS 55 HG2 LYS 55 12.925 11.138 -5.008 745 HG3 LYS 55 HG1 LYS 55 12.998 11.829 -3.387 746 HD2 LYS 55 HD2 LYS 55 14.018 9.736 -2.550 747 HD3 LYS 55 HD1 LYS 55 13.970 9.069 -4.183 748 HE2 LYS 55 HE2 LYS 55 15.445 11.597 -3.390 749 HE3 LYS 55 HE1 LYS 55 16.201 10.022 -3.626 750 HZ1 LYS 55 HZ1 LYS 55 15.297 11.929 -5.574 751 HZ2 LYS 55 HZ2 LYS 55 14.748 10.352 -5.884 752 HZ3 LYS 55 HZ3 LYS 55 16.412 10.661 -5.736 753 H LYS 56 HN LYS 56 9.606 9.777 -5.844 754 HA LYS 56 HA LYS 56 10.853 11.095 -8.003 755 HB2 LYS 56 HB2 LYS 56 8.468 9.245 -7.857 756 HB3 LYS 56 HB1 LYS 56 9.124 9.844 -9.380 757 HG2 LYS 56 HG2 LYS 56 11.005 8.611 -7.399 758 HG3 LYS 56 HG1 LYS 56 9.971 7.546 -8.347 759 HD2 LYS 56 HD2 LYS 56 11.525 9.710 -9.740 760 HD3 LYS 56 HD1 LYS 56 12.343 8.222 -9.271 761 HE2 LYS 56 HE2 LYS 56 10.622 6.915 -10.503 762 HE3 LYS 56 HE1 LYS 56 9.870 8.421 -11.023 763 HZ1 LYS 56 HZ1 LYS 56 11.253 8.284 -12.745 764 HZ2 LYS 56 HZ2 LYS 56 12.245 7.128 -11.992 765 HZ3 LYS 56 HZ3 LYS 56 12.467 8.782 -11.671 766 H LYS 57 HN LYS 57 7.645 11.433 -6.554 767 HA LYS 57 HA LYS 57 6.514 13.148 -8.476 768 HB2 LYS 57 HB2 LYS 57 5.206 12.027 -6.710 769 HB3 LYS 57 HB1 LYS 57 5.988 13.035 -5.494 770 HG2 LYS 57 HG2 LYS 57 5.055 15.057 -6.548 771 HG3 LYS 57 HG1 LYS 57 4.300 14.065 -7.796 772 HD2 LYS 57 HD2 LYS 57 2.970 12.906 -6.074 773 HD3 LYS 57 HD1 LYS 57 3.729 13.891 -4.822 774 HE2 LYS 57 HE2 LYS 57 2.818 15.931 -5.865 775 HE3 LYS 57 HE1 LYS 57 2.065 14.953 -7.125 776 HZ1 LYS 57 HZ1 LYS 57 1.270 13.806 -4.769 777 HZ2 LYS 57 HZ2 LYS 57 0.327 14.794 -5.779 778 HZ3 LYS 57 HZ3 LYS 57 1.172 15.473 -4.470 779 H ALA 58 HN ALA 58 8.367 13.849 -5.525 780 HA ALA 58 HA ALA 58 8.178 16.655 -5.641 781 HB1 ALA 58 HB1 ALA 58 10.575 16.298 -4.444 782 HB2 ALA 58 HB2 ALA 58 9.900 14.679 -4.265 783 HB3 ALA 58 HB3 ALA 58 9.036 16.072 -3.614 784 H GLY 59 HN GLY 59 10.502 14.399 -7.075 785 HA2 GLY 59 HA2 GLY 59 11.087 15.900 -9.327 786 HA3 GLY 59 HA1 GLY 59 12.249 16.406 -8.106 787 H SER 60 HN SER 60 13.738 15.481 -9.789 788 HA SER 60 HA SER 60 15.337 13.895 -10.254 789 HB2 SER 60 HB2 SER 60 14.865 13.347 -7.725 790 HB3 SER 60 HB1 SER 60 14.063 11.926 -8.391 791 HG SER 60 HG SER 60 16.617 12.246 -7.990 792 H GLN 61 HN GLN 61 13.422 14.106 -12.059 793 HA GLN 61 HA GLN 61 12.615 11.331 -12.704 794 HB2 GLN 61 HB2 GLN 61 10.703 12.864 -12.349 795 HB3 GLN 61 HB1 GLN 61 11.332 13.919 -13.614 796 HG2 GLN 61 HG2 GLN 61 11.113 12.124 -15.264 797 HG3 GLN 61 HG1 GLN 61 10.574 11.009 -14.010 798 HE21 GLN 61 HE21 GLN 61 8.771 11.244 -16.006 799 HE22 GLN 61 HE22 GLN 61 7.480 12.259 -15.579 800 H SER 62 HN SER 62 13.515 10.448 -14.453 801 HA SER 62 HA SER 62 14.637 10.216 -16.448 802 HB2 SER 62 HB2 SER 62 12.928 12.345 -16.868 803 HB3 SER 62 HB1 SER 62 14.500 13.011 -17.301 804 HG SER 62 HG SER 62 14.313 10.527 -18.252 Start of MODEL 11 1 H1 MET 76 HT1 MET 76 6.311 -17.558 -19.806 2 H2 MET 76 HT2 MET 76 7.678 -16.931 -19.015 3 H3 MET 76 HT3 MET 76 6.170 -16.169 -18.843 4 HA MET 76 HA MET 76 6.040 -18.914 -18.089 5 HB2 MET 76 HB2 MET 76 8.405 -18.530 -17.498 6 HB3 MET 76 HB1 MET 76 7.945 -17.096 -16.581 7 HG2 MET 76 HG2 MET 76 6.616 -18.445 -15.048 8 HG3 MET 76 HG1 MET 76 6.919 -19.890 -16.010 9 HE1 MET 76 HE1 MET 76 9.561 -16.949 -14.895 10 HE2 MET 76 HE2 MET 76 9.729 -17.585 -13.263 11 HE3 MET 76 HE3 MET 76 8.136 -17.138 -13.865 12 H LYS 77 HN LYS 77 3.861 -18.303 -17.978 13 HA LYS 77 HA LYS 77 1.973 -17.234 -17.170 14 HB2 LYS 77 HB2 LYS 77 2.482 -18.920 -15.451 15 HB3 LYS 77 HB1 LYS 77 3.491 -17.754 -14.600 16 HG2 LYS 77 HG2 LYS 77 1.542 -16.281 -14.275 17 HG3 LYS 77 HG1 LYS 77 0.528 -17.417 -15.164 18 HD2 LYS 77 HD2 LYS 77 0.986 -19.154 -13.476 19 HD3 LYS 77 HD1 LYS 77 2.010 -18.024 -12.588 20 HE2 LYS 77 HE2 LYS 77 0.084 -16.520 -12.266 21 HE3 LYS 77 HE1 LYS 77 -0.944 -17.639 -13.162 22 HZ1 LYS 77 HZ1 LYS 77 -1.211 -18.869 -11.358 23 HZ2 LYS 77 HZ2 LYS 77 -0.393 -17.681 -10.461 24 HZ3 LYS 77 HZ3 LYS 77 0.462 -18.997 -11.113 25 H ASP 78 HN ASP 78 3.854 -16.013 -14.478 26 HA ASP 78 HA ASP 78 2.949 -13.334 -15.017 27 HB2 ASP 78 HB2 ASP 78 4.081 -12.754 -12.950 28 HB3 ASP 78 HB1 ASP 78 3.184 -14.254 -12.716 29 H THR 79 HN THR 79 4.476 -11.487 -15.015 30 HA THR 79 HA THR 79 7.158 -11.991 -16.018 31 HB THR 79 HB THR 79 6.016 -12.161 -18.097 32 HG1 THR 79 HG1 THR 79 7.225 -10.718 -19.017 33 HG21 THR 79 HG21 THR 79 4.613 -9.772 -18.456 34 HG22 THR 79 HG22 THR 79 4.203 -10.279 -16.817 35 HG23 THR 79 HG23 THR 79 3.909 -11.365 -18.176 36 H ASP 80 HN ASP 80 4.741 -9.876 -14.710 37 HA ASP 80 HA ASP 80 6.698 -7.678 -14.533 38 HB2 ASP 80 HB2 ASP 80 3.680 -7.691 -14.440 39 HB3 ASP 80 HB1 ASP 80 4.651 -6.290 -13.992 40 H SER 81 HN SER 81 6.960 -6.602 -12.552 41 HA SER 81 HA SER 81 6.726 -8.313 -10.227 42 HB2 SER 81 HB2 SER 81 7.813 -5.505 -10.553 43 HB3 SER 81 HB1 SER 81 7.893 -6.448 -9.066 44 HG SER 81 HG SER 81 8.760 -7.799 -11.286 45 H GLU 82 HN GLU 82 4.681 -6.202 -11.761 46 HA GLU 82 HA GLU 82 3.521 -4.687 -9.734 47 HB2 GLU 82 HB2 GLU 82 2.970 -4.488 -12.153 48 HB3 GLU 82 HB1 GLU 82 2.106 -6.022 -12.054 49 HG2 GLU 82 HG2 GLU 82 0.585 -5.071 -10.371 50 HG3 GLU 82 HG1 GLU 82 1.466 -3.547 -10.436 51 H GLU 83 HN GLU 83 3.017 -8.015 -10.686 52 HA GLU 83 HA GLU 83 0.822 -8.604 -8.991 53 HB2 GLU 83 HB2 GLU 83 1.413 -10.938 -9.397 54 HB3 GLU 83 HB1 GLU 83 1.559 -10.020 -10.895 55 HG2 GLU 83 HG2 GLU 83 3.576 -11.193 -10.897 56 HG3 GLU 83 HG1 GLU 83 4.055 -9.682 -10.127 57 H GLU 84 HN GLU 84 4.327 -8.612 -8.491 58 HA GLU 84 HA GLU 84 4.372 -10.008 -6.036 59 HB2 GLU 84 HB2 GLU 84 6.391 -9.564 -7.398 60 HB3 GLU 84 HB1 GLU 84 6.262 -7.849 -7.011 61 HG2 GLU 84 HG2 GLU 84 6.529 -8.335 -4.625 62 HG3 GLU 84 HG1 GLU 84 6.586 -10.063 -4.967 63 H ILE 85 HN ILE 85 4.155 -6.548 -6.777 64 HA ILE 85 HA ILE 85 4.074 -5.653 -4.086 65 HB ILE 85 HB ILE 85 3.123 -4.405 -6.673 66 HG12 ILE 85 HG12 ILE 85 5.648 -4.792 -5.989 67 HG13 ILE 85 HG11 ILE 85 5.148 -3.251 -6.681 68 HG21 ILE 85 HG21 ILE 85 3.154 -2.278 -5.184 69 HG22 ILE 85 HG22 ILE 85 3.027 -3.402 -3.829 70 HG23 ILE 85 HG23 ILE 85 1.764 -3.356 -5.061 71 HD11 ILE 85 HD11 ILE 85 5.186 -2.157 -4.600 72 HD12 ILE 85 HD12 ILE 85 6.594 -3.214 -4.517 73 HD13 ILE 85 HD13 ILE 85 5.105 -3.663 -3.691 74 H ARG 86 HN ARG 86 1.649 -6.620 -6.422 75 HA ARG 86 HA ARG 86 -0.685 -5.861 -5.068 76 HB2 ARG 86 HB2 ARG 86 -0.613 -6.562 -7.421 77 HB3 ARG 86 HB1 ARG 86 -0.191 -8.198 -6.923 78 HG2 ARG 86 HG2 ARG 86 -2.319 -8.447 -5.769 79 HG3 ARG 86 HG1 ARG 86 -2.737 -6.768 -6.125 80 HD2 ARG 86 HD2 ARG 86 -2.714 -7.230 -8.518 81 HD3 ARG 86 HD1 ARG 86 -2.176 -8.881 -8.225 82 HE ARG 86 HE ARG 86 -4.565 -8.517 -6.808 83 HH11 ARG 86 HH21 ARG 86 -3.396 -8.494 -10.063 84 HH12 ARG 86 HH22 ARG 86 -4.891 -9.035 -10.751 85 HH21 ARG 86 HH11 ARG 86 -6.530 -9.227 -7.700 86 HH22 ARG 86 HH12 ARG 86 -6.666 -9.450 -9.413 87 H GLU 87 HN GLU 87 1.310 -8.761 -4.842 88 HA GLU 87 HA GLU 87 -0.385 -10.376 -3.312 89 HB2 GLU 87 HB2 GLU 87 1.753 -11.154 -4.293 90 HB3 GLU 87 HB1 GLU 87 2.631 -10.188 -3.106 91 HG2 GLU 87 HG2 GLU 87 1.624 -11.471 -1.277 92 HG3 GLU 87 HG1 GLU 87 0.673 -12.404 -2.432 93 H ALA 88 HN ALA 88 1.849 -7.827 -2.336 94 HA ALA 88 HA ALA 88 1.634 -8.147 0.458 95 HB1 ALA 88 HB1 ALA 88 2.583 -5.962 0.626 96 HB2 ALA 88 HB2 ALA 88 2.007 -5.515 -0.981 97 HB3 ALA 88 HB3 ALA 88 3.299 -6.702 -0.805 98 H PHE 89 HN PHE 89 -0.441 -6.482 -1.878 99 HA PHE 89 HA PHE 89 -2.038 -5.212 0.155 100 HB2 PHE 89 HB2 PHE 89 -2.357 -5.584 -2.815 101 HB3 PHE 89 HB1 PHE 89 -3.636 -4.877 -1.824 102 HD1 PHE 89 HD2 PHE 89 -3.262 -2.764 -0.595 103 HD2 PHE 89 HD1 PHE 89 -0.288 -4.388 -3.231 104 HE1 PHE 89 HE2 PHE 89 -2.070 -0.589 -0.590 105 HE2 PHE 89 HE1 PHE 89 0.911 -2.215 -3.222 106 HZ PHE 89 HZ PHE 89 0.014 -0.316 -1.903 107 H ARG 90 HN ARG 90 -2.283 -8.087 -1.861 108 HA ARG 90 HA ARG 90 -4.829 -8.931 -1.332 109 HB2 ARG 90 HB2 ARG 90 -2.332 -10.599 -1.604 110 HB3 ARG 90 HB1 ARG 90 -3.946 -11.301 -1.501 111 HG2 ARG 90 HG2 ARG 90 -4.635 -9.902 -3.455 112 HG3 ARG 90 HG1 ARG 90 -2.970 -9.337 -3.595 113 HD2 ARG 90 HD2 ARG 90 -2.212 -11.672 -3.906 114 HD3 ARG 90 HD1 ARG 90 -3.877 -12.222 -3.782 115 HE ARG 90 HE ARG 90 -3.692 -10.263 -5.815 116 HH11 ARG 90 HH21 ARG 90 -2.761 -13.506 -5.048 117 HH12 ARG 90 HH22 ARG 90 -2.748 -14.040 -6.695 118 HH21 ARG 90 HH11 ARG 90 -3.678 -10.956 -7.979 119 HH22 ARG 90 HH12 ARG 90 -3.267 -12.596 -8.355 120 H VAL 91 HN VAL 91 -2.151 -8.890 0.904 121 HA VAL 91 HA VAL 91 -3.144 -10.711 2.814 122 HB VAL 91 HB VAL 91 -1.356 -8.286 3.086 123 HG11 VAL 91 HG11 VAL 91 -2.593 -10.072 5.138 124 HG12 VAL 91 HG12 VAL 91 -2.025 -8.409 5.298 125 HG13 VAL 91 HG13 VAL 91 -0.874 -9.743 5.323 126 HG21 VAL 91 HG21 VAL 91 -0.411 -11.019 3.677 127 HG22 VAL 91 HG22 VAL 91 0.351 -9.746 2.724 128 HG23 VAL 91 HG23 VAL 91 -0.892 -10.765 1.999 129 H PHE 92 HN PHE 92 -3.764 -7.260 2.300 130 HA PHE 92 HA PHE 92 -5.441 -7.073 4.660 131 HB2 PHE 92 HB2 PHE 92 -5.169 -5.085 2.402 132 HB3 PHE 92 HB1 PHE 92 -5.762 -4.773 4.032 133 HD1 PHE 92 HD2 PHE 92 -3.969 -5.787 5.910 134 HD2 PHE 92 HD1 PHE 92 -3.034 -4.288 1.998 135 HE1 PHE 92 HE2 PHE 92 -1.644 -5.336 6.634 136 HE2 PHE 92 HE1 PHE 92 -0.711 -3.847 2.722 137 HZ PHE 92 HZ PHE 92 -0.013 -4.370 5.039 138 H ASP 93 HN ASP 93 -5.835 -7.820 1.301 139 HA ASP 93 HA ASP 93 -8.730 -7.360 1.358 140 HB2 ASP 93 HB2 ASP 93 -7.372 -6.821 -0.678 141 HB3 ASP 93 HB1 ASP 93 -7.046 -8.541 -0.853 142 H LYS 94 HN LYS 94 -9.079 -8.991 3.101 143 HA LYS 94 HA LYS 94 -8.493 -11.747 2.590 144 HB2 LYS 94 HB2 LYS 94 -10.038 -12.088 4.554 145 HB3 LYS 94 HB1 LYS 94 -8.642 -11.054 4.859 146 HG2 LYS 94 HG2 LYS 94 -9.929 -9.097 4.873 147 HG3 LYS 94 HG1 LYS 94 -11.239 -9.837 3.957 148 HD2 LYS 94 HD2 LYS 94 -11.938 -9.570 6.276 149 HD3 LYS 94 HD1 LYS 94 -11.749 -11.286 5.925 150 HE2 LYS 94 HE2 LYS 94 -9.538 -11.289 6.979 151 HE3 LYS 94 HE1 LYS 94 -9.652 -9.552 7.264 152 HZ1 LYS 94 HZ1 LYS 94 -11.581 -9.941 8.657 153 HZ2 LYS 94 HZ2 LYS 94 -10.247 -10.822 9.232 154 HZ3 LYS 94 HZ3 LYS 94 -11.483 -11.611 8.373 155 H ASP 95 HN ASP 95 -11.122 -9.612 1.841 156 HA ASP 95 HA ASP 95 -13.075 -11.684 1.424 157 HB2 ASP 95 HB2 ASP 95 -14.374 -9.843 0.319 158 HB3 ASP 95 HB1 ASP 95 -13.880 -9.489 1.973 159 H GLY 96 HN GLY 96 -10.545 -10.233 -0.437 160 HA2 GLY 96 HA2 GLY 96 -9.714 -10.755 -2.521 161 HA3 GLY 96 HA1 GLY 96 -10.773 -12.163 -2.513 162 H ASN 97 HN ASN 97 -12.001 -8.916 -2.089 163 HA ASN 97 HA ASN 97 -13.534 -9.220 -4.573 164 HB2 ASN 97 HB2 ASN 97 -14.556 -8.603 -2.281 165 HB3 ASN 97 HB1 ASN 97 -13.869 -7.005 -2.564 166 HD21 ASN 97 HD21 ASN 97 -16.772 -7.874 -2.537 167 HD22 ASN 97 HD22 ASN 97 -17.384 -7.393 -4.045 168 H GLY 98 HN GLY 98 -10.653 -7.915 -3.665 169 HA2 GLY 98 HA2 GLY 98 -9.243 -6.691 -5.144 170 HA3 GLY 98 HA1 GLY 98 -10.679 -6.072 -5.952 171 H TYR 99 HN TYR 99 -10.889 -5.971 -2.572 172 HA TYR 99 HA TYR 99 -9.885 -3.200 -2.458 173 HB2 TYR 99 HB2 TYR 99 -12.606 -3.991 -1.419 174 HB3 TYR 99 HB1 TYR 99 -11.870 -2.387 -1.375 175 HD1 TYR 99 HD1 TYR 99 -12.882 -5.074 -3.749 176 HD2 TYR 99 HD2 TYR 99 -12.195 -0.884 -3.143 177 HE1 TYR 99 HE1 TYR 99 -13.779 -4.612 -6.011 178 HE2 TYR 99 HE2 TYR 99 -13.092 -0.413 -5.412 179 HH TYR 99 HH TYR 99 -14.538 -1.429 -7.062 180 H ILE 100 HN ILE 100 -9.537 -2.347 -0.349 181 HA ILE 100 HA ILE 100 -9.411 -4.338 1.823 182 HB ILE 100 HB ILE 100 -7.190 -3.965 2.282 183 HG12 ILE 100 HG12 ILE 100 -7.603 -1.194 1.145 184 HG13 ILE 100 HG11 ILE 100 -7.298 -1.623 2.830 185 HG21 ILE 100 HG21 ILE 100 -7.514 -4.530 -0.258 186 HG22 ILE 100 HG22 ILE 100 -5.919 -4.043 0.313 187 HG23 ILE 100 HG23 ILE 100 -6.958 -2.872 -0.507 188 HD11 ILE 100 HD11 ILE 100 -5.397 -1.502 0.530 189 HD12 ILE 100 HD12 ILE 100 -5.114 -2.719 1.775 190 HD13 ILE 100 HD13 ILE 100 -5.165 -1.010 2.208 191 H SER 101 HN SER 101 -9.889 -3.435 3.887 192 HA SER 101 HA SER 101 -11.546 -1.167 3.894 193 HB2 SER 101 HB2 SER 101 -11.700 -2.854 5.641 194 HB3 SER 101 HB1 SER 101 -10.063 -2.489 6.180 195 HG SER 101 HG SER 101 -12.436 -1.047 6.484 196 H ALA 102 HN ALA 102 -11.166 0.957 4.082 197 HA ALA 102 HA ALA 102 -8.554 2.016 3.786 198 HB1 ALA 102 HB1 ALA 102 -11.035 2.994 3.341 199 HB2 ALA 102 HB2 ALA 102 -9.601 4.011 3.470 200 HB3 ALA 102 HB3 ALA 102 -10.659 3.799 4.865 201 H ALA 103 HN ALA 103 -10.687 1.647 6.554 202 HA ALA 103 HA ALA 103 -9.274 3.189 8.420 203 HB1 ALA 103 HB1 ALA 103 -11.239 0.960 8.581 204 HB2 ALA 103 HB2 ALA 103 -11.323 2.591 9.248 205 HB3 ALA 103 HB3 ALA 103 -10.337 1.362 10.043 206 H GLU 104 HN GLU 104 -8.854 -0.237 7.551 207 HA GLU 104 HA GLU 104 -6.916 -0.747 9.587 208 HB2 GLU 104 HB2 GLU 104 -6.843 -2.884 8.777 209 HB3 GLU 104 HB1 GLU 104 -8.355 -2.376 8.032 210 HG2 GLU 104 HG2 GLU 104 -6.930 -1.636 6.029 211 HG3 GLU 104 HG1 GLU 104 -5.623 -2.562 6.759 212 H LEU 105 HN LEU 105 -6.768 0.505 6.334 213 HA LEU 105 HA LEU 105 -4.021 0.137 5.825 214 HB2 LEU 105 HB2 LEU 105 -5.582 0.809 4.070 215 HB3 LEU 105 HB1 LEU 105 -5.880 2.338 4.892 216 HG LEU 105 HG LEU 105 -3.034 1.799 4.432 217 HD11 LEU 105 HD11 LEU 105 -3.305 2.482 1.968 218 HD12 LEU 105 HD12 LEU 105 -4.990 1.986 2.133 219 HD13 LEU 105 HD13 LEU 105 -3.697 0.811 2.370 220 HD21 LEU 105 HD21 LEU 105 -4.764 4.120 3.545 221 HD22 LEU 105 HD22 LEU 105 -3.030 4.129 3.868 222 HD23 LEU 105 HD23 LEU 105 -4.174 3.954 5.199 223 H ARG 106 HN ARG 106 -5.763 2.898 7.253 224 HA ARG 106 HA ARG 106 -3.569 4.567 7.716 225 HB2 ARG 106 HB2 ARG 106 -5.784 5.416 7.997 226 HB3 ARG 106 HB1 ARG 106 -6.167 4.221 9.227 227 HG2 ARG 106 HG2 ARG 106 -3.875 6.139 9.627 228 HG3 ARG 106 HG1 ARG 106 -5.520 6.665 9.952 229 HD2 ARG 106 HD2 ARG 106 -5.377 4.230 11.290 230 HD3 ARG 106 HD1 ARG 106 -3.770 4.905 11.516 231 HE ARG 106 HE ARG 106 -6.242 5.933 12.616 232 HH11 ARG 106 HH21 ARG 106 -2.970 6.572 11.688 233 HH12 ARG 106 HH22 ARG 106 -2.786 7.923 12.756 234 HH21 ARG 106 HH11 ARG 106 -6.008 7.705 14.017 235 HH22 ARG 106 HH12 ARG 106 -4.505 8.564 14.073 236 H HIS 107 HN HIS 107 -5.024 2.128 9.905 237 HA HIS 107 HA HIS 107 -3.187 2.462 12.014 238 HB2 HIS 107 HB2 HIS 107 -5.269 1.309 12.359 239 HB3 HIS 107 HB1 HIS 107 -4.858 0.096 11.149 240 HD1 HIS 107 HD1 HIS 107 -3.427 1.411 14.439 241 HD2 HIS 107 HD2 HIS 107 -3.675 -2.136 12.252 242 HE1 HIS 107 HE1 HIS 107 -2.393 -0.394 15.882 243 HE2 HIS 107 HE2 HIS 107 -2.536 -2.560 14.566 244 H VAL 108 HN VAL 108 -3.242 0.205 9.297 245 HA VAL 108 HA VAL 108 -0.910 -1.240 9.924 246 HB VAL 108 HB VAL 108 -2.333 -0.702 7.313 247 HG11 VAL 108 HG11 VAL 108 -1.035 -2.755 6.557 248 HG12 VAL 108 HG12 VAL 108 0.011 -2.501 7.945 249 HG13 VAL 108 HG13 VAL 108 -0.094 -1.273 6.685 250 HG21 VAL 108 HG21 VAL 108 -2.191 -3.327 8.754 251 HG22 VAL 108 HG22 VAL 108 -3.474 -2.683 7.729 252 HG23 VAL 108 HG23 VAL 108 -3.272 -2.080 9.375 253 H MET 109 HN MET 109 -1.405 1.694 8.039 254 HA MET 109 HA MET 109 1.288 1.877 7.049 255 HB2 MET 109 HB2 MET 109 -1.071 3.714 7.111 256 HB3 MET 109 HB1 MET 109 0.526 4.390 6.788 257 HG2 MET 109 HG2 MET 109 -0.945 3.557 4.786 258 HG3 MET 109 HG1 MET 109 0.780 3.196 4.801 259 HE1 MET 109 HE1 MET 109 0.875 0.561 3.438 260 HE2 MET 109 HE2 MET 109 -0.171 1.900 2.972 261 HE3 MET 109 HE3 MET 109 -0.831 0.269 3.075 262 H THR 110 HN THR 110 -0.333 3.036 9.954 263 HA THR 110 HA THR 110 2.105 4.510 10.700 264 HB THR 110 HB THR 110 0.709 5.625 12.350 265 HG1 THR 110 HG1 THR 110 -0.670 3.968 12.909 266 HG21 THR 110 HG21 THR 110 0.553 5.918 9.642 267 HG22 THR 110 HG22 THR 110 -0.218 6.999 10.805 268 HG23 THR 110 HG23 THR 110 -1.146 5.694 10.062 269 H ASN 111 HN ASN 111 0.488 1.565 11.355 270 HA ASN 111 HA ASN 111 1.812 1.329 13.984 271 HB2 ASN 111 HB2 ASN 111 -0.689 0.898 13.727 272 HB3 ASN 111 HB1 ASN 111 -0.235 -0.573 12.865 273 HD21 ASN 111 HD21 ASN 111 -0.894 -2.074 14.509 274 HD22 ASN 111 HD22 ASN 111 -0.149 -2.146 16.032 275 H LEU 112 HN LEU 112 1.727 -0.044 10.758 276 HA LEU 112 HA LEU 112 3.803 -1.992 11.587 277 HB2 LEU 112 HB2 LEU 112 1.876 -2.209 9.273 278 HB3 LEU 112 HB1 LEU 112 3.088 -3.402 9.722 279 HG LEU 112 HG LEU 112 0.758 -2.522 11.456 280 HD11 LEU 112 HD11 LEU 112 -0.418 -4.053 10.290 281 HD12 LEU 112 HD12 LEU 112 0.698 -5.291 10.868 282 HD13 LEU 112 HD13 LEU 112 1.006 -4.471 9.338 283 HD21 LEU 112 HD21 LEU 112 3.147 -4.280 11.887 284 HD22 LEU 112 HD22 LEU 112 1.618 -4.758 12.622 285 HD23 LEU 112 HD23 LEU 112 2.338 -3.198 13.019 286 H GLY 113 HN GLY 113 4.947 -2.776 9.492 287 HA2 GLY 113 HA2 GLY 113 6.507 -2.341 7.850 288 HA3 GLY 113 HA1 GLY 113 5.478 -0.999 7.367 289 H GLU 114 HN GLU 114 6.527 0.844 7.322 290 HA GLU 114 HA GLU 114 8.831 1.250 9.096 291 HB2 GLU 114 HB2 GLU 114 7.971 2.681 6.578 292 HB3 GLU 114 HB1 GLU 114 9.358 3.157 7.559 293 HG2 GLU 114 HG2 GLU 114 10.379 0.950 7.226 294 HG3 GLU 114 HG1 GLU 114 8.979 0.429 6.289 295 H LYS 115 HN LYS 115 5.808 1.644 9.551 296 HA LYS 115 HA LYS 115 4.419 3.098 10.654 297 HB2 LYS 115 HB2 LYS 115 7.129 3.482 11.827 298 HB3 LYS 115 HB1 LYS 115 5.777 4.450 12.419 299 HG2 LYS 115 HG2 LYS 115 4.515 2.362 12.874 300 HG3 LYS 115 HG1 LYS 115 5.891 1.419 12.301 301 HD2 LYS 115 HD2 LYS 115 7.300 2.369 14.081 302 HD3 LYS 115 HD1 LYS 115 5.941 3.340 14.648 303 HE2 LYS 115 HE2 LYS 115 4.660 1.285 15.113 304 HE3 LYS 115 HE1 LYS 115 6.012 0.309 14.542 305 HZ1 LYS 115 HZ1 LYS 115 7.262 0.798 16.365 306 HZ2 LYS 115 HZ2 LYS 115 5.717 0.865 17.068 307 HZ3 LYS 115 HZ3 LYS 115 6.517 2.298 16.630 308 H LEU 116 HN LEU 116 3.560 4.493 9.251 309 HA LEU 116 HA LEU 116 5.110 6.764 8.251 310 HB2 LEU 116 HB2 LEU 116 2.456 5.543 7.556 311 HB3 LEU 116 HB1 LEU 116 2.790 7.206 7.091 312 HG LEU 116 HG LEU 116 3.362 5.490 5.324 313 HD11 LEU 116 HD11 LEU 116 4.804 7.046 4.586 314 HD12 LEU 116 HD12 LEU 116 6.019 6.508 5.743 315 HD13 LEU 116 HD13 LEU 116 4.854 7.744 6.200 316 HD21 LEU 116 HD21 LEU 116 4.292 3.931 7.227 317 HD22 LEU 116 HD22 LEU 116 5.783 4.839 6.988 318 HD23 LEU 116 HD23 LEU 116 5.077 3.935 5.648 319 H THR 117 HN THR 117 4.292 8.963 8.436 320 HA THR 117 HA THR 117 3.052 9.430 11.044 321 HB THR 117 HB THR 117 3.753 11.750 10.722 322 HG1 THR 117 HG1 THR 117 4.985 12.186 8.786 323 HG21 THR 117 HG21 THR 117 6.114 11.402 10.837 324 HG22 THR 117 HG22 THR 117 6.014 9.941 9.854 325 HG23 THR 117 HG23 THR 117 5.373 9.944 11.497 326 H ASP 118 HN ASP 118 1.481 11.363 11.090 327 HA ASP 118 HA ASP 118 -0.832 10.693 9.662 328 HB2 ASP 118 HB2 ASP 118 -1.712 12.871 10.455 329 HB3 ASP 118 HB1 ASP 118 -0.941 11.944 11.739 330 H GLU 119 HN GLU 119 1.620 13.158 9.038 331 HA GLU 119 HA GLU 119 0.347 14.437 6.870 332 HB2 GLU 119 HB2 GLU 119 2.305 15.372 8.052 333 HB3 GLU 119 HB1 GLU 119 3.314 14.093 7.378 334 HG2 GLU 119 HG2 GLU 119 2.835 14.876 5.104 335 HG3 GLU 119 HG1 GLU 119 1.757 16.117 5.742 336 H GLU 120 HN GLU 120 2.557 11.666 6.985 337 HA GLU 120 HA GLU 120 2.695 11.324 4.148 338 HB2 GLU 120 HB2 GLU 120 3.282 9.459 6.444 339 HB3 GLU 120 HB1 GLU 120 3.564 9.042 4.761 340 HG2 GLU 120 HG2 GLU 120 4.806 11.359 6.265 341 HG3 GLU 120 HG1 GLU 120 5.630 9.886 5.776 342 H VAL 121 HN VAL 121 0.714 9.980 6.737 343 HA VAL 121 HA VAL 121 -0.669 8.061 5.172 344 HB VAL 121 HB VAL 121 -1.366 9.477 7.752 345 HG11 VAL 121 HG11 VAL 121 -2.944 7.490 7.995 346 HG12 VAL 121 HG12 VAL 121 -2.726 7.230 6.266 347 HG13 VAL 121 HG13 VAL 121 -3.436 8.735 6.853 348 HG21 VAL 121 HG21 VAL 121 0.021 7.978 8.697 349 HG22 VAL 121 HG22 VAL 121 0.473 7.411 7.091 350 HG23 VAL 121 HG23 VAL 121 -0.868 6.655 7.946 351 H ASP 122 HN ASP 122 -1.471 11.427 6.112 352 HA ASP 122 HA ASP 122 -4.046 11.525 5.083 353 HB2 ASP 122 HB2 ASP 122 -3.059 13.301 6.464 354 HB3 ASP 122 HB1 ASP 122 -1.975 13.738 5.145 355 H GLU 123 HN GLU 123 -0.977 12.269 3.434 356 HA GLU 123 HA GLU 123 -2.104 12.979 0.935 357 HB2 GLU 123 HB2 GLU 123 0.243 13.470 1.576 358 HB3 GLU 123 HB1 GLU 123 0.605 11.747 1.516 359 HG2 GLU 123 HG2 GLU 123 1.289 12.799 -0.579 360 HG3 GLU 123 HG1 GLU 123 -0.064 11.716 -0.884 361 H MET 124 HN MET 124 -1.178 9.936 2.395 362 HA MET 124 HA MET 124 -1.519 8.298 0.065 363 HB2 MET 124 HB2 MET 124 -1.454 7.688 3.027 364 HB3 MET 124 HB1 MET 124 -1.528 6.462 1.770 365 HG2 MET 124 HG2 MET 124 0.596 8.540 1.534 366 HG3 MET 124 HG1 MET 124 0.807 7.306 2.776 367 HE1 MET 124 HE1 MET 124 0.200 5.101 2.511 368 HE2 MET 124 HE2 MET 124 1.684 4.478 1.792 369 HE3 MET 124 HE3 MET 124 0.133 4.123 1.038 370 H ILE 125 HN ILE 125 -3.505 9.312 2.796 371 HA ILE 125 HA ILE 125 -5.632 7.552 2.430 372 HB ILE 125 HB ILE 125 -4.998 9.604 4.202 373 HG12 ILE 125 HG12 ILE 125 -7.494 8.875 5.037 374 HG13 ILE 125 HG11 ILE 125 -7.090 7.517 3.997 375 HG21 ILE 125 HG21 ILE 125 -7.688 10.245 2.972 376 HG22 ILE 125 HG22 ILE 125 -6.223 11.206 2.736 377 HG23 ILE 125 HG23 ILE 125 -6.924 11.050 4.340 378 HD11 ILE 125 HD11 ILE 125 -5.689 8.490 6.468 379 HD12 ILE 125 HD12 ILE 125 -4.787 7.575 5.257 380 HD13 ILE 125 HD13 ILE 125 -6.183 6.849 6.051 381 H ARG 126 HN ARG 126 -5.010 10.704 0.926 382 HA ARG 126 HA ARG 126 -7.565 11.040 -0.220 383 HB2 ARG 126 HB2 ARG 126 -4.816 12.062 -0.837 384 HB3 ARG 126 HB1 ARG 126 -6.094 12.303 -2.029 385 HG2 ARG 126 HG2 ARG 126 -6.635 12.987 0.842 386 HG3 ARG 126 HG1 ARG 126 -5.687 14.103 -0.139 387 HD2 ARG 126 HD2 ARG 126 -8.450 13.065 -0.854 388 HD3 ARG 126 HD1 ARG 126 -8.100 14.660 -0.202 389 HE ARG 126 HE ARG 126 -7.612 13.753 -2.919 390 HH11 ARG 126 HH21 ARG 126 -6.914 16.031 -0.410 391 HH12 ARG 126 HH22 ARG 126 -6.369 17.268 -1.494 392 HH21 ARG 126 HH11 ARG 126 -6.897 15.370 -4.347 393 HH22 ARG 126 HH12 ARG 126 -6.359 16.893 -3.722 394 H GLU 127 HN GLU 127 -4.583 9.964 -1.873 395 HA GLU 127 HA GLU 127 -5.842 9.000 -4.157 396 HB2 GLU 127 HB2 GLU 127 -3.224 8.241 -2.855 397 HB3 GLU 127 HB1 GLU 127 -3.722 7.655 -4.444 398 HG2 GLU 127 HG2 GLU 127 -3.936 9.966 -5.250 399 HG3 GLU 127 HG1 GLU 127 -3.484 10.575 -3.659 400 H ALA 128 HN ALA 128 -6.132 7.759 -1.052 401 HA ALA 128 HA ALA 128 -6.241 4.957 -1.737 402 HB1 ALA 128 HB1 ALA 128 -6.603 4.606 0.513 403 HB2 ALA 128 HB2 ALA 128 -7.590 6.050 0.699 404 HB3 ALA 128 HB3 ALA 128 -5.841 6.184 0.583 405 H ASP 129 HN ASP 129 -8.827 6.979 -0.322 406 HA ASP 129 HA ASP 129 -10.727 7.038 -2.269 407 HB2 ASP 129 HB2 ASP 129 -10.764 4.681 -2.636 408 HB3 ASP 129 HB1 ASP 129 -10.776 4.349 -0.904 409 H ILE 130 HN ILE 130 -11.687 5.182 0.455 410 HA ILE 130 HA ILE 130 -12.989 5.588 2.269 411 HB ILE 130 HB ILE 130 -11.788 8.363 2.205 412 HG12 ILE 130 HG12 ILE 130 -10.880 5.952 3.804 413 HG13 ILE 130 HG11 ILE 130 -10.130 6.429 2.279 414 HG21 ILE 130 HG21 ILE 130 -13.767 7.050 3.860 415 HG22 ILE 130 HG22 ILE 130 -13.157 8.703 3.968 416 HG23 ILE 130 HG23 ILE 130 -12.328 7.401 4.820 417 HD11 ILE 130 HD11 ILE 130 -9.122 8.268 3.194 418 HD12 ILE 130 HD12 ILE 130 -9.296 7.349 4.690 419 HD13 ILE 130 HD13 ILE 130 -10.473 8.593 4.278 420 H ASP 131 HN ASP 131 -14.446 5.643 0.080 421 HA ASP 131 HA ASP 131 -15.850 8.168 -0.219 422 HB2 ASP 131 HB2 ASP 131 -15.487 6.593 -2.131 423 HB3 ASP 131 HB1 ASP 131 -16.562 5.445 -1.335 424 H GLY 132 HN GLY 132 -16.199 7.993 2.255 425 HA2 GLY 132 HA2 GLY 132 -17.819 7.972 3.897 426 HA3 GLY 132 HA1 GLY 132 -18.964 7.393 2.690 427 H ASP 133 HN ASP 133 -18.090 5.056 1.874 428 HA ASP 133 HA ASP 133 -18.735 3.286 3.931 429 HB2 ASP 133 HB2 ASP 133 -18.011 1.523 2.308 430 HB3 ASP 133 HB1 ASP 133 -19.150 2.695 1.648 431 H GLY 134 HN GLY 134 -15.564 4.377 2.833 432 HA2 GLY 134 HA2 GLY 134 -13.601 4.286 4.102 433 HA3 GLY 134 HA1 GLY 134 -14.422 3.242 5.250 434 H GLN 135 HN GLN 135 -14.048 2.738 1.737 435 HA GLN 135 HA GLN 135 -12.320 0.412 2.338 436 HB2 GLN 135 HB2 GLN 135 -13.444 -0.385 0.025 437 HB3 GLN 135 HB1 GLN 135 -14.095 -0.817 1.609 438 HG2 GLN 135 HG2 GLN 135 -15.754 0.846 1.511 439 HG3 GLN 135 HG1 GLN 135 -14.943 1.713 0.205 440 HE21 GLN 135 HE21 GLN 135 -16.056 1.429 -1.731 441 HE22 GLN 135 HE22 GLN 135 -16.833 -0.003 -2.208 442 H VAL 136 HN VAL 136 -10.644 0.039 0.932 443 HA VAL 136 HA VAL 136 -10.154 2.133 -1.086 444 HB VAL 136 HB VAL 136 -8.309 0.963 0.974 445 HG11 VAL 136 HG11 VAL 136 -6.975 0.858 -0.979 446 HG12 VAL 136 HG12 VAL 136 -6.582 2.427 -0.277 447 HG13 VAL 136 HG13 VAL 136 -7.690 2.328 -1.645 448 HG21 VAL 136 HG21 VAL 136 -8.072 3.215 1.673 449 HG22 VAL 136 HG22 VAL 136 -9.794 3.028 1.348 450 HG23 VAL 136 HG23 VAL 136 -8.761 3.834 0.171 451 H ASN 137 HN ASN 137 -9.514 1.539 -3.038 452 HA ASN 137 HA ASN 137 -9.234 -1.323 -3.568 453 HB2 ASN 137 HB2 ASN 137 -9.225 -0.468 -5.996 454 HB3 ASN 137 HB1 ASN 137 -10.726 -0.313 -5.094 455 HD21 ASN 137 HD21 ASN 137 -11.664 1.658 -5.622 456 HD22 ASN 137 HD22 ASN 137 -10.824 3.126 -5.766 457 H TYR 138 HN TYR 138 -7.191 -2.097 -3.417 458 HA TYR 138 HA TYR 138 -4.898 -0.467 -3.363 459 HB2 TYR 138 HB2 TYR 138 -3.620 -2.593 -3.560 460 HB3 TYR 138 HB1 TYR 138 -4.857 -2.631 -2.305 461 HD1 TYR 138 HD1 TYR 138 -4.048 -3.715 -5.768 462 HD2 TYR 138 HD2 TYR 138 -6.707 -4.129 -2.425 463 HE1 TYR 138 HE1 TYR 138 -5.069 -5.716 -6.823 464 HE2 TYR 138 HE2 TYR 138 -7.727 -6.122 -3.469 465 HH TYR 138 HH TYR 138 -6.478 -7.423 -6.542 466 H GLU 139 HN GLU 139 -6.762 -1.270 -6.044 467 HA GLU 139 HA GLU 139 -4.810 -1.790 -8.004 468 HB2 GLU 139 HB2 GLU 139 -7.234 -2.048 -8.386 469 HB3 GLU 139 HB1 GLU 139 -7.428 -0.297 -8.310 470 HG2 GLU 139 HG2 GLU 139 -5.964 -0.022 -10.252 471 HG3 GLU 139 HG1 GLU 139 -5.682 -1.761 -10.310 472 H GLU 140 HN GLU 140 -6.277 1.354 -7.055 473 HA GLU 140 HA GLU 140 -4.747 2.951 -8.765 474 HB2 GLU 140 HB2 GLU 140 -6.751 3.753 -7.568 475 HB3 GLU 140 HB1 GLU 140 -5.873 3.662 -6.043 476 HG2 GLU 140 HG2 GLU 140 -5.871 5.966 -6.884 477 HG3 GLU 140 HG1 GLU 140 -4.234 5.322 -6.902 478 H PHE 141 HN PHE 141 -4.091 1.845 -5.483 479 HA PHE 141 HA PHE 141 -1.728 3.367 -5.066 480 HB2 PHE 141 HB2 PHE 141 -2.967 0.983 -3.809 481 HB3 PHE 141 HB1 PHE 141 -1.224 1.148 -3.596 482 HD1 PHE 141 HD2 PHE 141 -0.442 3.651 -3.060 483 HD2 PHE 141 HD1 PHE 141 -4.347 2.058 -2.237 484 HE1 PHE 141 HE2 PHE 141 -0.782 5.377 -1.319 485 HE2 PHE 141 HE1 PHE 141 -4.674 3.779 -0.490 486 HZ PHE 141 HZ PHE 141 -2.897 5.441 -0.031 487 H VAL 142 HN VAL 142 -2.289 0.176 -6.509 488 HA VAL 142 HA VAL 142 0.446 -0.456 -6.892 489 HB VAL 142 HB VAL 142 -2.068 -1.420 -8.251 490 HG11 VAL 142 HG11 VAL 142 0.839 -2.056 -8.746 491 HG12 VAL 142 HG12 VAL 142 -0.432 -1.747 -9.929 492 HG13 VAL 142 HG13 VAL 142 -0.411 -3.267 -9.034 493 HG21 VAL 142 HG21 VAL 142 -1.577 -2.008 -5.849 494 HG22 VAL 142 HG22 VAL 142 -0.070 -2.746 -6.391 495 HG23 VAL 142 HG23 VAL 142 -1.618 -3.412 -6.919 496 H GLN 143 HN GLN 143 -1.925 1.248 -8.898 497 HA GLN 143 HA GLN 143 -0.304 1.503 -11.206 498 HB2 GLN 143 HB2 GLN 143 -2.527 3.250 -10.129 499 HB3 GLN 143 HB1 GLN 143 -1.732 3.544 -11.676 500 HG2 GLN 143 HG2 GLN 143 -2.352 1.251 -12.401 501 HG3 GLN 143 HG1 GLN 143 -3.206 1.020 -10.877 502 HE21 GLN 143 HE21 GLN 143 -5.384 1.038 -11.558 503 HE22 GLN 143 HE22 GLN 143 -6.095 2.316 -12.417 504 H MET 144 HN MET 144 -0.643 3.447 -8.280 505 HA MET 144 HA MET 144 1.023 5.600 -9.011 506 HB2 MET 144 HB2 MET 144 0.424 4.346 -6.320 507 HB3 MET 144 HB1 MET 144 1.347 5.831 -6.515 508 HG2 MET 144 HG2 MET 144 -0.504 7.002 -7.402 509 HG3 MET 144 HG1 MET 144 -1.388 5.512 -7.742 510 HE1 MET 144 HE1 MET 144 0.297 7.654 -5.174 511 HE2 MET 144 HE2 MET 144 0.619 6.149 -4.314 512 HE3 MET 144 HE3 MET 144 -0.500 7.323 -3.629 513 H MET 145 HN MET 145 1.717 2.503 -7.401 514 HA MET 145 HA MET 145 4.504 2.950 -7.113 515 HB2 MET 145 HB2 MET 145 2.683 0.575 -6.907 516 HB3 MET 145 HB1 MET 145 4.427 0.314 -6.975 517 HG2 MET 145 HG2 MET 145 3.738 0.492 -4.646 518 HG3 MET 145 HG1 MET 145 4.699 1.904 -5.067 519 HE1 MET 145 HE1 MET 145 2.983 1.480 -2.661 520 HE2 MET 145 HE2 MET 145 1.524 0.756 -3.337 521 HE3 MET 145 HE3 MET 145 1.438 2.340 -2.571 522 H THR 146 HN THR 146 2.585 2.168 -9.832 523 HA THR 146 HA THR 146 4.998 1.322 -11.320 524 HB THR 146 HB THR 146 3.484 0.076 -12.821 525 HG1 THR 146 HG1 THR 146 1.467 0.579 -12.705 526 HG21 THR 146 HG21 THR 146 3.834 -1.699 -11.490 527 HG22 THR 146 HG22 THR 146 2.577 -1.159 -10.378 528 HG23 THR 146 HG23 THR 146 4.233 -0.587 -10.181 529 H ALA 147 HN ALA 147 3.579 3.994 -10.747 530 HA ALA 147 HA ALA 147 3.648 4.917 -13.535 531 HB1 ALA 147 HB1 ALA 147 1.445 5.686 -11.608 532 HB2 ALA 147 HB2 ALA 147 1.260 4.515 -12.914 533 HB3 ALA 147 HB3 ALA 147 1.612 6.202 -13.286 534 H LYS 148 HN LYS 148 5.750 5.284 -11.945 535 HA LYS 148 HA LYS 148 5.567 7.715 -10.413 536 HB2 LYS 148 HB2 LYS 148 8.177 7.448 -10.548 537 HB3 LYS 148 HB1 LYS 148 7.222 6.372 -9.530 538 HG2 LYS 148 HG2 LYS 148 8.885 5.163 -10.952 539 HG3 LYS 148 HG1 LYS 148 7.223 4.659 -11.254 540 HD2 LYS 148 HD2 LYS 148 7.103 5.918 -13.275 541 HD3 LYS 148 HD1 LYS 148 8.565 6.820 -12.882 542 HE2 LYS 148 HE2 LYS 148 8.471 3.839 -13.419 543 HE3 LYS 148 HE1 LYS 148 8.983 5.058 -14.587 544 HZ1 LYS 148 HZ1 LYS 148 10.997 4.899 -13.714 545 HZ2 LYS 148 HZ2 LYS 148 10.451 3.892 -12.459 546 HZ3 LYS 148 HZ3 LYS 148 10.398 5.581 -12.282 547 H PHE 30 HT1 PHE 30 -9.333 -2.493 12.438 548 HA PHE 30 HA PHE 30 -8.494 -3.934 10.928 549 HB2 PHE 30 HB2 PHE 30 -6.487 -4.831 12.919 550 HB3 PHE 30 HB1 PHE 30 -6.252 -4.019 11.371 551 HD1 PHE 30 HD2 PHE 30 -7.850 -1.609 11.578 552 HD2 PHE 30 HD1 PHE 30 -5.439 -3.532 14.569 553 HE1 PHE 30 HE2 PHE 30 -7.581 0.557 12.754 554 HE2 PHE 30 HE1 PHE 30 -5.168 -1.364 15.743 555 HZ PHE 30 HZ PHE 30 -6.239 0.680 14.836 556 H ASP 31 HN ASP 31 -8.227 -6.079 10.201 557 HA ASP 31 HA ASP 31 -8.724 -8.246 12.103 558 HB2 ASP 31 HB2 ASP 31 -10.959 -7.507 11.314 559 HB3 ASP 31 HB1 ASP 31 -10.454 -7.828 9.656 560 H ILE 32 HN ILE 32 -6.329 -8.027 11.141 561 HA ILE 32 HA ILE 32 -6.182 -10.019 8.962 562 HB ILE 32 HB ILE 32 -4.349 -8.892 7.937 563 HG12 ILE 32 HG12 ILE 32 -4.384 -7.056 10.355 564 HG13 ILE 32 HG11 ILE 32 -3.104 -8.183 9.895 565 HG21 ILE 32 HG21 ILE 32 -5.501 -7.157 7.022 566 HG22 ILE 32 HG22 ILE 32 -5.863 -6.437 8.592 567 HG23 ILE 32 HG23 ILE 32 -6.827 -7.790 7.996 568 HD11 ILE 32 HD11 ILE 32 -2.352 -6.070 9.127 569 HD12 ILE 32 HD12 ILE 32 -3.935 -5.658 8.472 570 HD13 ILE 32 HD13 ILE 32 -2.958 -6.906 7.698 571 H ASP 33 HN ASP 33 -4.003 -11.138 8.967 572 HA ASP 33 HA ASP 33 -3.426 -11.938 11.690 573 HB2 ASP 33 HB2 ASP 33 -3.550 -13.570 9.789 574 HB3 ASP 33 HB1 ASP 33 -2.086 -12.842 9.131 575 H MET 34 HN MET 34 -2.661 -9.789 12.311 576 HA MET 34 HA MET 34 -0.382 -8.560 11.205 577 HB2 MET 34 HB2 MET 34 -1.562 -8.419 13.988 578 HB3 MET 34 HB1 MET 34 -0.243 -7.391 13.424 579 HG2 MET 34 HG2 MET 34 -1.674 -6.562 11.587 580 HG3 MET 34 HG1 MET 34 -2.989 -7.587 12.154 581 HE1 MET 34 HE1 MET 34 -0.346 -5.183 14.128 582 HE2 MET 34 HE2 MET 34 -1.333 -3.737 13.954 583 HE3 MET 34 HE3 MET 34 -0.813 -4.610 12.520 584 H ASP 35 HN ASP 35 -0.770 -11.009 13.706 585 HA ASP 35 HA ASP 35 1.846 -11.014 14.726 586 HB2 ASP 35 HB2 ASP 35 -0.067 -12.188 15.775 587 HB3 ASP 35 HB1 ASP 35 -0.048 -13.360 14.459 588 H ALA 36 HN ALA 36 0.431 -12.691 11.938 589 HA ALA 36 HA ALA 36 2.558 -14.398 11.353 590 HB1 ALA 36 HB1 ALA 36 1.662 -14.048 8.918 591 HB2 ALA 36 HB2 ALA 36 0.383 -13.148 9.733 592 HB3 ALA 36 HB3 ALA 36 0.653 -14.847 10.122 593 HA PRO 37 HA PRO 37 5.756 -11.312 10.326 594 HB2 PRO 37 HB2 PRO 37 6.770 -13.589 8.664 595 HB3 PRO 37 HB1 PRO 37 7.650 -12.541 9.795 596 HG2 PRO 37 HG2 PRO 37 7.003 -15.004 10.478 597 HG3 PRO 37 HG1 PRO 37 6.887 -13.678 11.649 598 HD2 PRO 37 HD2 PRO 37 4.691 -15.104 10.197 599 HD3 PRO 37 HD1 PRO 37 4.718 -14.409 11.836 600 H GLU 38 HN GLU 38 4.001 -13.258 7.993 601 HA GLU 38 HA GLU 38 4.834 -12.056 5.605 602 HB2 GLU 38 HB2 GLU 38 3.495 -14.120 5.701 603 HB3 GLU 38 HB1 GLU 38 2.115 -13.201 6.299 604 HG2 GLU 38 HG2 GLU 38 1.895 -13.578 3.887 605 HG3 GLU 38 HG1 GLU 38 2.117 -11.861 4.204 606 H THR 39 HN THR 39 2.188 -11.148 7.833 607 HA THR 39 HA THR 39 1.136 -9.063 6.256 608 HB THR 39 HB THR 39 1.155 -9.320 9.272 609 HG1 THR 39 HG1 THR 39 -0.434 -10.334 7.190 610 HG21 THR 39 HG21 THR 39 0.573 -7.070 8.680 611 HG22 THR 39 HG22 THR 39 -0.937 -7.916 9.021 612 HG23 THR 39 HG23 THR 39 -0.451 -7.621 7.353 613 H GLU 40 HN GLU 40 3.553 -8.965 8.880 614 HA GLU 40 HA GLU 40 4.003 -6.168 8.727 615 HB2 GLU 40 HB2 GLU 40 5.727 -8.443 9.732 616 HB3 GLU 40 HB1 GLU 40 6.182 -6.744 9.876 617 HG2 GLU 40 HG2 GLU 40 4.207 -6.264 11.194 618 HG3 GLU 40 HG1 GLU 40 3.588 -7.894 10.935 619 H ARG 41 HN ARG 41 5.486 -8.958 7.178 620 HA ARG 41 HA ARG 41 7.584 -7.642 5.855 621 HB2 ARG 41 HB2 ARG 41 7.580 -10.037 6.059 622 HB3 ARG 41 HB1 ARG 41 6.032 -10.154 5.241 623 HG2 ARG 41 HG2 ARG 41 7.816 -10.829 3.727 624 HG3 ARG 41 HG1 ARG 41 7.091 -9.342 3.140 625 HD2 ARG 41 HD2 ARG 41 8.950 -8.046 4.138 626 HD3 ARG 41 HD1 ARG 41 9.669 -9.539 4.732 627 HE ARG 41 HE ARG 41 10.392 -9.988 2.557 628 HH11 ARG 41 HH21 ARG 41 8.104 -7.391 2.642 629 HH12 ARG 41 HH22 ARG 41 8.355 -6.933 0.990 630 HH21 ARG 41 HH11 ARG 41 10.726 -9.391 0.392 631 HH22 ARG 41 HH12 ARG 41 9.840 -8.065 -0.283 632 H ALA 42 HN ALA 42 4.272 -8.415 4.814 633 HA ALA 42 HA ALA 42 4.465 -7.381 2.201 634 HB1 ALA 42 HB1 ALA 42 2.198 -7.923 4.088 635 HB2 ALA 42 HB2 ALA 42 2.569 -8.686 2.542 636 HB3 ALA 42 HB3 ALA 42 1.891 -7.058 2.582 637 H ALA 43 HN ALA 43 3.595 -5.883 5.279 638 HA ALA 43 HA ALA 43 2.788 -3.377 4.283 639 HB1 ALA 43 HB1 ALA 43 4.218 -3.540 6.896 640 HB2 ALA 43 HB2 ALA 43 2.722 -4.456 6.714 641 HB3 ALA 43 HB3 ALA 43 2.719 -2.707 6.483 642 H VAL 44 HN VAL 44 5.967 -4.645 5.182 643 HA VAL 44 HA VAL 44 7.406 -2.239 5.042 644 HB VAL 44 HB VAL 44 8.249 -5.096 4.536 645 HG11 VAL 44 HG11 VAL 44 9.991 -4.039 3.463 646 HG12 VAL 44 HG12 VAL 44 10.554 -3.850 5.124 647 HG13 VAL 44 HG13 VAL 44 9.731 -2.517 4.316 648 HG21 VAL 44 HG21 VAL 44 7.458 -4.230 6.846 649 HG22 VAL 44 HG22 VAL 44 8.946 -3.286 6.852 650 HG23 VAL 44 HG23 VAL 44 9.019 -5.047 6.777 651 H ALA 45 HN ALA 45 6.755 -4.667 2.500 652 HA ALA 45 HA ALA 45 8.257 -3.412 0.475 653 HB1 ALA 45 HB1 ALA 45 6.314 -5.562 0.669 654 HB2 ALA 45 HB2 ALA 45 7.671 -5.374 -0.442 655 HB3 ALA 45 HB3 ALA 45 6.115 -4.634 -0.818 656 H ILE 46 HN ILE 46 4.799 -3.109 1.298 657 HA ILE 46 HA ILE 46 4.200 -1.266 -0.772 658 HB ILE 46 HB ILE 46 2.829 -1.857 1.853 659 HG12 ILE 46 HG12 ILE 46 2.027 -2.538 -0.989 660 HG13 ILE 46 HG11 ILE 46 2.975 -3.626 0.024 661 HG21 ILE 46 HG21 ILE 46 2.009 0.277 1.386 662 HG22 ILE 46 HG22 ILE 46 0.880 -0.726 0.477 663 HG23 ILE 46 HG23 ILE 46 2.207 0.081 -0.355 664 HD11 ILE 46 HD11 ILE 46 0.493 -2.503 1.222 665 HD12 ILE 46 HD12 ILE 46 1.208 -4.106 1.406 666 HD13 ILE 46 HD13 ILE 46 0.289 -3.711 -0.047 667 H GLN 47 HN GLN 47 4.917 -0.803 2.681 668 HA GLN 47 HA GLN 47 4.722 2.034 2.601 669 HB2 GLN 47 HB2 GLN 47 6.082 0.173 4.559 670 HB3 GLN 47 HB1 GLN 47 5.858 1.902 4.819 671 HG2 GLN 47 HG2 GLN 47 3.606 -0.065 4.309 672 HG3 GLN 47 HG1 GLN 47 4.070 0.532 5.900 673 HE21 GLN 47 HE21 GLN 47 3.388 2.642 6.491 674 HE22 GLN 47 HE22 GLN 47 2.401 3.608 5.507 675 H SER 48 HN SER 48 7.445 -0.216 2.318 676 HA SER 48 HA SER 48 9.497 1.727 2.316 677 HB2 SER 48 HB2 SER 48 9.977 -0.655 2.618 678 HB3 SER 48 HB1 SER 48 9.417 -0.991 0.981 679 HG SER 48 HG SER 48 11.797 0.033 1.869 680 H GLN 49 HN GLN 49 7.615 0.246 -0.287 681 HA GLN 49 HA GLN 49 8.932 1.503 -2.440 682 HB2 GLN 49 HB2 GLN 49 7.365 -0.475 -2.580 683 HB3 GLN 49 HB1 GLN 49 6.033 0.662 -2.377 684 HG2 GLN 49 HG2 GLN 49 6.350 0.301 -4.749 685 HG3 GLN 49 HG1 GLN 49 6.905 1.931 -4.365 686 HE21 GLN 49 HE21 GLN 49 8.294 -1.408 -4.482 687 HE22 GLN 49 HE22 GLN 49 9.759 -0.919 -5.185 688 H PHE 50 HN PHE 50 6.248 2.483 -0.385 689 HA PHE 50 HA PHE 50 5.329 4.682 -1.845 690 HB2 PHE 50 HB2 PHE 50 4.065 3.861 0.047 691 HB3 PHE 50 HB1 PHE 50 5.389 4.231 1.147 692 HD1 PHE 50 HD1 PHE 50 3.461 6.021 -1.547 693 HD2 PHE 50 HD2 PHE 50 5.112 6.172 2.425 694 HE1 PHE 50 HE1 PHE 50 2.606 8.330 -1.276 695 HE2 PHE 50 HE2 PHE 50 4.258 8.487 2.685 696 HZ PHE 50 HZ PHE 50 3.004 9.562 0.837 697 H ARG 51 HN ARG 51 7.892 4.517 0.626 698 HA ARG 51 HA ARG 51 8.497 7.252 0.719 699 HB2 ARG 51 HB2 ARG 51 9.413 5.585 2.299 700 HB3 ARG 51 HB1 ARG 51 10.400 4.910 1.002 701 HG2 ARG 51 HG2 ARG 51 11.595 7.019 0.752 702 HG3 ARG 51 HG1 ARG 51 10.547 7.788 1.946 703 HD2 ARG 51 HD2 ARG 51 12.315 5.396 2.519 704 HD3 ARG 51 HD1 ARG 51 12.756 7.061 2.883 705 HE ARG 51 HE ARG 51 10.270 6.612 4.066 706 HH11 ARG 51 HH21 ARG 51 13.505 5.394 4.227 707 HH12 ARG 51 HH22 ARG 51 13.408 4.965 5.902 708 HH21 ARG 51 HH11 ARG 51 10.135 6.052 6.264 709 HH22 ARG 51 HH12 ARG 51 11.499 5.338 7.056 710 H LYS 52 HN LYS 52 9.792 4.684 -1.385 711 HA LYS 52 HA LYS 52 11.610 6.309 -2.815 712 HB2 LYS 52 HB2 LYS 52 11.679 3.849 -2.868 713 HB3 LYS 52 HB1 LYS 52 10.152 3.821 -3.744 714 HG2 LYS 52 HG2 LYS 52 11.148 5.046 -5.611 715 HG3 LYS 52 HG1 LYS 52 12.665 5.207 -4.731 716 HD2 LYS 52 HD2 LYS 52 11.517 2.475 -5.244 717 HD3 LYS 52 HD1 LYS 52 12.407 3.304 -6.518 718 HE2 LYS 52 HE2 LYS 52 13.479 2.758 -3.730 719 HE3 LYS 52 HE1 LYS 52 13.881 1.833 -5.172 720 HZ1 LYS 52 HZ1 LYS 52 15.586 3.384 -4.970 721 HZ2 LYS 52 HZ2 LYS 52 14.528 4.651 -4.563 722 HZ3 LYS 52 HZ3 LYS 52 14.569 4.052 -6.153 723 H PHE 53 HN PHE 53 8.212 5.495 -3.343 724 HA PHE 53 HA PHE 53 7.857 6.676 -5.860 725 HB2 PHE 53 HB2 PHE 53 6.171 5.227 -4.853 726 HB3 PHE 53 HB1 PHE 53 5.900 6.399 -3.566 727 HD1 PHE 53 HD1 PHE 53 5.673 5.899 -7.254 728 HD2 PHE 53 HD2 PHE 53 4.450 8.253 -3.875 729 HE1 PHE 53 HE1 PHE 53 4.016 7.077 -8.674 730 HE2 PHE 53 HE2 PHE 53 2.794 9.432 -5.297 731 HZ PHE 53 HZ PHE 53 2.577 8.844 -7.696 732 H GLN 54 HN GLN 54 7.460 8.051 -2.603 733 HA GLN 54 HA GLN 54 6.623 10.617 -3.406 734 HB2 GLN 54 HB2 GLN 54 8.091 9.672 -0.933 735 HB3 GLN 54 HB1 GLN 54 7.481 11.314 -1.133 736 HG2 GLN 54 HG2 GLN 54 5.774 8.814 -1.307 737 HG3 GLN 54 HG1 GLN 54 5.901 9.841 0.120 738 HE21 GLN 54 HE21 GLN 54 3.787 9.260 -2.276 739 HE22 GLN 54 HE22 GLN 54 3.161 10.817 -2.530 740 H LYS 55 HN LYS 55 9.850 9.245 -2.908 741 HA LYS 55 HA LYS 55 11.333 11.622 -3.113 742 HB2 LYS 55 HB2 LYS 55 12.313 9.491 -2.372 743 HB3 LYS 55 HB1 LYS 55 12.097 8.833 -3.994 744 HG2 LYS 55 HG2 LYS 55 13.649 10.408 -4.933 745 HG3 LYS 55 HG1 LYS 55 13.701 11.339 -3.438 746 HD2 LYS 55 HD2 LYS 55 15.709 10.030 -3.492 747 HD3 LYS 55 HD1 LYS 55 14.648 9.269 -2.309 748 HE2 LYS 55 HE2 LYS 55 13.996 7.561 -3.901 749 HE3 LYS 55 HE1 LYS 55 14.858 8.383 -5.202 750 HZ1 LYS 55 HZ1 LYS 55 16.523 7.880 -2.935 751 HZ2 LYS 55 HZ2 LYS 55 16.767 7.475 -4.567 752 HZ3 LYS 55 HZ3 LYS 55 15.863 6.448 -3.559 753 H LYS 56 HN LYS 56 10.299 9.322 -5.629 754 HA LYS 56 HA LYS 56 11.525 10.657 -7.799 755 HB2 LYS 56 HB2 LYS 56 9.147 8.798 -7.663 756 HB3 LYS 56 HB1 LYS 56 9.817 9.402 -9.178 757 HG2 LYS 56 HG2 LYS 56 12.018 8.448 -8.588 758 HG3 LYS 56 HG1 LYS 56 11.344 7.834 -7.078 759 HD2 LYS 56 HD2 LYS 56 9.727 6.467 -8.351 760 HD3 LYS 56 HD1 LYS 56 10.410 7.072 -9.861 761 HE2 LYS 56 HE2 LYS 56 11.960 5.540 -7.753 762 HE3 LYS 56 HE1 LYS 56 11.333 4.845 -9.247 763 HZ1 LYS 56 HZ1 LYS 56 13.629 6.539 -8.823 764 HZ2 LYS 56 HZ2 LYS 56 12.658 7.007 -10.136 765 HZ3 LYS 56 HZ3 LYS 56 13.308 5.439 -10.073 766 H LYS 57 HN LYS 57 8.339 10.970 -6.300 767 HA LYS 57 HA LYS 57 7.170 12.690 -8.194 768 HB2 LYS 57 HB2 LYS 57 5.894 11.556 -6.410 769 HB3 LYS 57 HB1 LYS 57 6.689 12.568 -5.205 770 HG2 LYS 57 HG2 LYS 57 5.734 14.586 -6.243 771 HG3 LYS 57 HG1 LYS 57 4.968 13.593 -7.484 772 HD2 LYS 57 HD2 LYS 57 3.663 12.424 -5.748 773 HD3 LYS 57 HD1 LYS 57 4.430 13.411 -4.504 774 HE2 LYS 57 HE2 LYS 57 3.499 15.448 -5.534 775 HE3 LYS 57 HE1 LYS 57 2.738 14.469 -6.789 776 HZ1 LYS 57 HZ1 LYS 57 2.225 14.027 -3.907 777 HZ2 LYS 57 HZ2 LYS 57 1.329 13.458 -5.234 778 HZ3 LYS 57 HZ3 LYS 57 1.303 15.109 -4.833 779 H ALA 58 HN ALA 58 9.103 13.365 -5.294 780 HA ALA 58 HA ALA 58 8.904 16.172 -5.359 781 HB1 ALA 58 HB1 ALA 58 9.982 14.461 -3.612 782 HB2 ALA 58 HB2 ALA 58 10.464 16.156 -3.676 783 HB3 ALA 58 HB3 ALA 58 11.455 14.927 -4.461 784 H GLY 59 HN GLY 59 11.143 13.933 -6.937 785 HA2 GLY 59 HA2 GLY 59 12.863 15.935 -8.017 786 HA3 GLY 59 HA1 GLY 59 12.757 14.261 -8.552 787 H SER 60 HN SER 60 13.023 16.641 -10.191 788 HA SER 60 HA SER 60 10.554 16.373 -11.795 789 HB2 SER 60 HB2 SER 60 12.156 18.897 -11.325 790 HB3 SER 60 HB1 SER 60 10.813 18.744 -12.454 791 HG SER 60 HG SER 60 10.427 17.911 -9.816 792 H GLN 61 HN GLN 61 10.835 16.657 -14.074 793 HA GLN 61 HA GLN 61 13.607 16.511 -15.047 794 HB2 GLN 61 HB2 GLN 61 12.953 14.633 -16.558 795 HB3 GLN 61 HB1 GLN 61 12.921 14.196 -14.850 796 HG2 GLN 61 HG2 GLN 61 10.443 15.164 -16.289 797 HG3 GLN 61 HG1 GLN 61 10.903 13.465 -16.263 798 HE21 GLN 61 HE21 GLN 61 8.500 14.136 -15.024 799 HE22 GLN 61 HE22 GLN 61 8.670 14.038 -13.338 800 H SER 62 HN SER 62 13.875 17.107 -17.245 801 HA SER 62 HA SER 62 11.686 17.908 -18.898 802 HB2 SER 62 HB2 SER 62 13.237 20.323 -18.294 803 HB3 SER 62 HB1 SER 62 11.500 20.122 -18.496 804 HG SER 62 HG SER 62 11.735 20.552 -16.379 Start of MODEL 12 1 H1 MET 76 HT1 MET 76 5.165 -16.649 -15.473 2 H2 MET 76 HT2 MET 76 3.582 -16.882 -14.902 3 H3 MET 76 HT3 MET 76 4.759 -18.084 -14.666 4 HA MET 76 HA MET 76 4.248 -15.667 -13.163 5 HB2 MET 76 HB2 MET 76 5.287 -18.448 -12.738 6 HB3 MET 76 HB1 MET 76 5.652 -17.213 -11.532 7 HG2 MET 76 HG2 MET 76 2.851 -17.769 -12.539 8 HG3 MET 76 HG1 MET 76 3.528 -18.525 -11.096 9 HE1 MET 76 HE1 MET 76 0.852 -16.739 -11.178 10 HE2 MET 76 HE2 MET 76 1.060 -15.963 -9.610 11 HE3 MET 76 HE3 MET 76 1.514 -17.653 -9.816 12 H LYS 77 HN LYS 77 5.835 -14.351 -12.263 13 HA LYS 77 HA LYS 77 7.867 -13.285 -12.052 14 HB2 LYS 77 HB2 LYS 77 8.639 -15.811 -11.960 15 HB3 LYS 77 HB1 LYS 77 9.279 -15.448 -13.564 16 HG2 LYS 77 HG2 LYS 77 10.507 -13.514 -12.632 17 HG3 LYS 77 HG1 LYS 77 9.887 -13.903 -11.026 18 HD2 LYS 77 HD2 LYS 77 10.940 -16.183 -11.258 19 HD3 LYS 77 HD1 LYS 77 11.706 -15.613 -12.741 20 HE2 LYS 77 HE2 LYS 77 13.289 -15.321 -10.937 21 HE3 LYS 77 HE1 LYS 77 12.707 -13.724 -11.409 22 HZ1 LYS 77 HZ1 LYS 77 12.627 -14.834 -8.892 23 HZ2 LYS 77 HZ2 LYS 77 11.020 -14.883 -9.442 24 HZ3 LYS 77 HZ3 LYS 77 11.862 -13.408 -9.400 25 H ASP 78 HN ASP 78 7.710 -15.023 -15.156 26 HA ASP 78 HA ASP 78 8.698 -12.622 -16.531 27 HB2 ASP 78 HB2 ASP 78 9.737 -14.823 -17.040 28 HB3 ASP 78 HB1 ASP 78 8.179 -15.390 -17.637 29 H THR 79 HN THR 79 6.183 -12.225 -15.523 30 HA THR 79 HA THR 79 4.595 -12.094 -17.996 31 HB THR 79 HB THR 79 2.562 -12.740 -16.756 32 HG1 THR 79 HG1 THR 79 2.635 -13.105 -14.678 33 HG21 THR 79 HG21 THR 79 3.071 -15.134 -16.576 34 HG22 THR 79 HG22 THR 79 4.798 -14.774 -16.539 35 HG23 THR 79 HG23 THR 79 3.860 -14.445 -17.996 36 H ASP 80 HN ASP 80 4.488 -11.193 -14.540 37 HA ASP 80 HA ASP 80 4.598 -8.404 -15.045 38 HB2 ASP 80 HB2 ASP 80 2.249 -9.061 -15.877 39 HB3 ASP 80 HB1 ASP 80 1.858 -9.301 -14.176 40 H SER 81 HN SER 81 5.144 -7.364 -13.210 41 HA SER 81 HA SER 81 5.342 -8.901 -10.751 42 HB2 SER 81 HB2 SER 81 6.162 -6.058 -11.407 43 HB3 SER 81 HB1 SER 81 6.486 -6.875 -9.879 44 HG SER 81 HG SER 81 7.558 -7.308 -12.429 45 H GLU 82 HN GLU 82 2.988 -7.027 -12.178 46 HA GLU 82 HA GLU 82 1.979 -5.466 -10.105 47 HB2 GLU 82 HB2 GLU 82 0.547 -6.937 -12.321 48 HB3 GLU 82 HB1 GLU 82 -0.263 -5.819 -11.226 49 HG2 GLU 82 HG2 GLU 82 1.145 -4.004 -11.937 50 HG3 GLU 82 HG1 GLU 82 2.139 -5.089 -12.909 51 H GLU 83 HN GLU 83 1.645 -8.890 -10.752 52 HA GLU 83 HA GLU 83 -0.331 -9.469 -8.793 53 HB2 GLU 83 HB2 GLU 83 0.297 -11.775 -9.150 54 HB3 GLU 83 HB1 GLU 83 0.330 -10.950 -10.708 55 HG2 GLU 83 HG2 GLU 83 2.826 -10.566 -10.311 56 HG3 GLU 83 HG1 GLU 83 2.689 -11.684 -8.956 57 H GLU 84 HN GLU 84 3.156 -9.049 -8.663 58 HA GLU 84 HA GLU 84 3.676 -10.393 -6.239 59 HB2 GLU 84 HB2 GLU 84 5.438 -9.630 -7.815 60 HB3 GLU 84 HB1 GLU 84 5.095 -7.962 -7.362 61 HG2 GLU 84 HG2 GLU 84 5.689 -8.433 -5.033 62 HG3 GLU 84 HG1 GLU 84 5.970 -10.127 -5.430 63 H ILE 85 HN ILE 85 2.869 -6.988 -6.881 64 HA ILE 85 HA ILE 85 2.901 -6.245 -4.119 65 HB ILE 85 HB ILE 85 1.541 -4.791 -6.380 66 HG12 ILE 85 HG12 ILE 85 4.414 -5.144 -5.610 67 HG13 ILE 85 HG11 ILE 85 3.701 -4.957 -7.212 68 HG21 ILE 85 HG21 ILE 85 2.861 -3.675 -3.896 69 HG22 ILE 85 HG22 ILE 85 1.176 -4.176 -3.889 70 HG23 ILE 85 HG23 ILE 85 1.700 -2.887 -4.964 71 HD11 ILE 85 HD11 ILE 85 4.804 -2.909 -6.840 72 HD12 ILE 85 HD12 ILE 85 4.287 -2.842 -5.156 73 HD13 ILE 85 HD13 ILE 85 3.122 -2.554 -6.451 74 H ARG 86 HN ARG 86 0.550 -7.544 -6.326 75 HA ARG 86 HA ARG 86 -1.822 -6.863 -4.968 76 HB2 ARG 86 HB2 ARG 86 -1.792 -7.771 -7.251 77 HB3 ARG 86 HB1 ARG 86 -1.176 -9.302 -6.637 78 HG2 ARG 86 HG2 ARG 86 -3.192 -9.722 -5.409 79 HG3 ARG 86 HG1 ARG 86 -3.792 -8.093 -5.729 80 HD2 ARG 86 HD2 ARG 86 -3.153 -10.062 -7.931 81 HD3 ARG 86 HD1 ARG 86 -4.760 -9.927 -7.212 82 HE ARG 86 HE ARG 86 -3.920 -7.356 -7.993 83 HH11 ARG 86 HH21 ARG 86 -4.753 -10.431 -9.339 84 HH12 ARG 86 HH22 ARG 86 -5.354 -9.773 -10.825 85 HH21 ARG 86 HH11 ARG 86 -4.708 -6.484 -9.935 86 HH22 ARG 86 HH12 ARG 86 -5.330 -7.537 -11.162 87 H GLU 87 HN GLU 87 0.466 -9.531 -4.604 88 HA GLU 87 HA GLU 87 -0.987 -11.095 -2.774 89 HB2 GLU 87 HB2 GLU 87 1.086 -11.857 -3.888 90 HB3 GLU 87 HB1 GLU 87 2.012 -10.696 -2.938 91 HG2 GLU 87 HG2 GLU 87 1.309 -11.802 -0.860 92 HG3 GLU 87 HG1 GLU 87 0.332 -12.942 -1.784 93 H ALA 88 HN ALA 88 1.260 -8.401 -2.292 94 HA ALA 88 HA ALA 88 1.277 -8.396 0.519 95 HB1 ALA 88 HB1 ALA 88 2.904 -7.109 -0.709 96 HB2 ALA 88 HB2 ALA 88 1.950 -5.995 0.269 97 HB3 ALA 88 HB3 ALA 88 1.638 -6.138 -1.459 98 H PHE 89 HN PHE 89 -0.975 -6.930 -1.795 99 HA PHE 89 HA PHE 89 -2.446 -5.529 0.268 100 HB2 PHE 89 HB2 PHE 89 -2.834 -5.972 -2.677 101 HB3 PHE 89 HB1 PHE 89 -4.144 -5.324 -1.688 102 HD1 PHE 89 HD2 PHE 89 -3.597 -3.315 -0.162 103 HD2 PHE 89 HD1 PHE 89 -1.116 -4.537 -3.452 104 HE1 PHE 89 HE2 PHE 89 -2.547 -1.070 -0.201 105 HE2 PHE 89 HE1 PHE 89 -0.063 -2.281 -3.487 106 HZ PHE 89 HZ PHE 89 -0.782 -0.554 -1.863 107 H ARG 90 HN ARG 90 -2.876 -8.454 -1.677 108 HA ARG 90 HA ARG 90 -5.389 -9.233 -0.921 109 HB2 ARG 90 HB2 ARG 90 -2.936 -10.860 -1.505 110 HB3 ARG 90 HB1 ARG 90 -4.450 -11.643 -1.051 111 HG2 ARG 90 HG2 ARG 90 -5.616 -10.609 -2.904 112 HG3 ARG 90 HG1 ARG 90 -4.209 -9.627 -3.300 113 HD2 ARG 90 HD2 ARG 90 -2.939 -11.591 -3.926 114 HD3 ARG 90 HD1 ARG 90 -4.215 -12.656 -3.347 115 HE ARG 90 HE ARG 90 -5.378 -11.019 -5.271 116 HH11 ARG 90 HH21 ARG 90 -2.799 -13.315 -5.033 117 HH12 ARG 90 HH22 ARG 90 -2.939 -13.849 -6.675 118 HH21 ARG 90 HH11 ARG 90 -5.567 -11.716 -7.425 119 HH22 ARG 90 HH12 ARG 90 -4.506 -12.944 -8.029 120 H VAL 91 HN VAL 91 -2.547 -9.104 1.053 121 HA VAL 91 HA VAL 91 -3.315 -10.875 3.111 122 HB VAL 91 HB VAL 91 -1.586 -8.393 3.111 123 HG11 VAL 91 HG11 VAL 91 -0.758 -9.550 5.309 124 HG12 VAL 91 HG12 VAL 91 -2.352 -10.306 5.307 125 HG13 VAL 91 HG13 VAL 91 -2.209 -8.550 5.368 126 HG21 VAL 91 HG21 VAL 91 -1.087 -10.756 1.938 127 HG22 VAL 91 HG22 VAL 91 -0.588 -11.166 3.580 128 HG23 VAL 91 HG23 VAL 91 0.181 -9.823 2.734 129 H PHE 92 HN PHE 92 -3.992 -7.449 2.516 130 HA PHE 92 HA PHE 92 -5.536 -7.218 4.971 131 HB2 PHE 92 HB2 PHE 92 -5.322 -5.200 2.737 132 HB3 PHE 92 HB1 PHE 92 -5.775 -4.908 4.413 133 HD1 PHE 92 HD2 PHE 92 -3.863 -6.111 6.097 134 HD2 PHE 92 HD1 PHE 92 -3.207 -4.383 2.217 135 HE1 PHE 92 HE2 PHE 92 -1.489 -5.721 6.673 136 HE2 PHE 92 HE1 PHE 92 -0.835 -3.997 2.798 137 HZ PHE 92 HZ PHE 92 0.029 -4.665 5.023 138 H ASP 93 HN ASP 93 -6.114 -7.835 1.588 139 HA ASP 93 HA ASP 93 -8.977 -7.278 1.835 140 HB2 ASP 93 HB2 ASP 93 -7.734 -6.778 -0.291 141 HB3 ASP 93 HB1 ASP 93 -7.522 -8.511 -0.505 142 H LYS 94 HN LYS 94 -9.210 -8.902 3.593 143 HA LYS 94 HA LYS 94 -8.787 -11.671 3.085 144 HB2 LYS 94 HB2 LYS 94 -10.318 -11.903 5.101 145 HB3 LYS 94 HB1 LYS 94 -8.834 -10.987 5.352 146 HG2 LYS 94 HG2 LYS 94 -10.001 -8.895 5.208 147 HG3 LYS 94 HG1 LYS 94 -11.469 -9.686 4.630 148 HD2 LYS 94 HD2 LYS 94 -10.426 -10.666 7.225 149 HD3 LYS 94 HD1 LYS 94 -11.059 -9.019 7.231 150 HE2 LYS 94 HE2 LYS 94 -12.566 -11.380 6.078 151 HE3 LYS 94 HE1 LYS 94 -12.783 -10.799 7.729 152 HZ1 LYS 94 HZ1 LYS 94 -12.895 -8.655 5.874 153 HZ2 LYS 94 HZ2 LYS 94 -14.056 -9.153 7.010 154 HZ3 LYS 94 HZ3 LYS 94 -14.025 -9.851 5.460 155 H ASP 95 HN ASP 95 -11.300 -9.464 2.265 156 HA ASP 95 HA ASP 95 -13.338 -11.507 1.966 157 HB2 ASP 95 HB2 ASP 95 -13.245 -8.573 1.255 158 HB3 ASP 95 HB1 ASP 95 -14.632 -9.607 0.917 159 H GLY 96 HN GLY 96 -10.905 -9.969 0.013 160 HA2 GLY 96 HA2 GLY 96 -10.177 -10.442 -2.129 161 HA3 GLY 96 HA1 GLY 96 -11.215 -11.866 -2.095 162 H ASN 97 HN ASN 97 -12.353 -8.587 -1.558 163 HA ASN 97 HA ASN 97 -14.117 -8.864 -3.891 164 HB2 ASN 97 HB2 ASN 97 -14.926 -8.224 -1.526 165 HB3 ASN 97 HB1 ASN 97 -14.226 -6.642 -1.865 166 HD21 ASN 97 HD21 ASN 97 -16.226 -5.488 -2.087 167 HD22 ASN 97 HD22 ASN 97 -17.333 -5.810 -3.334 168 H GLY 98 HN GLY 98 -11.132 -7.643 -3.268 169 HA2 GLY 98 HA2 GLY 98 -9.841 -6.467 -4.872 170 HA3 GLY 98 HA1 GLY 98 -11.324 -5.794 -5.536 171 H TYR 99 HN TYR 99 -11.452 -5.599 -2.205 172 HA TYR 99 HA TYR 99 -10.187 -2.930 -2.144 173 HB2 TYR 99 HB2 TYR 99 -12.913 -3.533 -0.995 174 HB3 TYR 99 HB1 TYR 99 -12.067 -1.985 -0.975 175 HD1 TYR 99 HD1 TYR 99 -13.321 -4.589 -3.332 176 HD2 TYR 99 HD2 TYR 99 -12.389 -0.448 -2.707 177 HE1 TYR 99 HE1 TYR 99 -14.246 -4.052 -5.567 178 HE2 TYR 99 HE2 TYR 99 -13.313 0.097 -4.949 179 HH TYR 99 HH TYR 99 -15.303 -1.489 -6.546 180 H ILE 100 HN ILE 100 -9.756 -2.094 -0.019 181 HA ILE 100 HA ILE 100 -9.634 -4.114 2.131 182 HB ILE 100 HB ILE 100 -7.372 -3.758 2.559 183 HG12 ILE 100 HG12 ILE 100 -7.793 -1.074 1.230 184 HG13 ILE 100 HG11 ILE 100 -7.347 -1.393 2.907 185 HG21 ILE 100 HG21 ILE 100 -7.866 -4.484 0.056 186 HG22 ILE 100 HG22 ILE 100 -6.220 -4.122 0.573 187 HG23 ILE 100 HG23 ILE 100 -7.158 -2.905 -0.300 188 HD11 ILE 100 HD11 ILE 100 -5.311 -0.776 1.930 189 HD12 ILE 100 HD12 ILE 100 -5.650 -1.637 0.434 190 HD13 ILE 100 HD13 ILE 100 -5.246 -2.535 1.897 191 H SER 101 HN SER 101 -9.834 -3.141 4.269 192 HA SER 101 HA SER 101 -11.445 -0.842 4.364 193 HB2 SER 101 HB2 SER 101 -9.743 -2.101 6.528 194 HB3 SER 101 HB1 SER 101 -10.973 -0.872 6.806 195 HG SER 101 HG SER 101 -12.489 -2.315 6.479 196 H ALA 102 HN ALA 102 -10.970 1.289 4.403 197 HA ALA 102 HA ALA 102 -8.353 2.209 3.815 198 HB1 ALA 102 HB1 ALA 102 -10.399 4.077 4.923 199 HB2 ALA 102 HB2 ALA 102 -10.741 3.280 3.385 200 HB3 ALA 102 HB3 ALA 102 -9.303 4.287 3.558 201 H ALA 103 HN ALA 103 -10.258 2.083 6.779 202 HA ALA 103 HA ALA 103 -8.653 3.697 8.410 203 HB1 ALA 103 HB1 ALA 103 -9.738 2.577 10.289 204 HB2 ALA 103 HB2 ALA 103 -10.299 1.294 9.216 205 HB3 ALA 103 HB3 ALA 103 -10.909 2.937 9.021 206 H GLU 104 HN GLU 104 -8.410 0.177 7.819 207 HA GLU 104 HA GLU 104 -6.337 -0.214 9.743 208 HB2 GLU 104 HB2 GLU 104 -6.221 -2.414 8.974 209 HB3 GLU 104 HB1 GLU 104 -7.885 -1.967 8.600 210 HG2 GLU 104 HG2 GLU 104 -6.873 -1.199 6.317 211 HG3 GLU 104 HG1 GLU 104 -5.546 -2.263 6.746 212 H LEU 105 HN LEU 105 -6.402 0.835 6.433 213 HA LEU 105 HA LEU 105 -3.717 0.318 5.719 214 HB2 LEU 105 HB2 LEU 105 -5.490 1.052 4.110 215 HB3 LEU 105 HB1 LEU 105 -5.429 2.654 4.839 216 HG LEU 105 HG LEU 105 -2.986 2.777 4.277 217 HD11 LEU 105 HD11 LEU 105 -3.604 0.043 3.242 218 HD12 LEU 105 HD12 LEU 105 -2.155 0.644 4.026 219 HD13 LEU 105 HD13 LEU 105 -2.461 1.030 2.337 220 HD21 LEU 105 HD21 LEU 105 -5.090 2.416 2.148 221 HD22 LEU 105 HD22 LEU 105 -3.429 2.809 1.705 222 HD23 LEU 105 HD23 LEU 105 -4.352 3.908 2.730 223 H ARG 106 HN ARG 106 -5.283 3.126 7.207 224 HA ARG 106 HA ARG 106 -3.078 4.811 7.410 225 HB2 ARG 106 HB2 ARG 106 -5.419 5.474 7.917 226 HB3 ARG 106 HB1 ARG 106 -5.365 4.502 9.385 227 HG2 ARG 106 HG2 ARG 106 -4.858 6.619 10.216 228 HG3 ARG 106 HG1 ARG 106 -3.240 5.987 9.936 229 HD2 ARG 106 HD2 ARG 106 -3.024 7.978 8.825 230 HD3 ARG 106 HD1 ARG 106 -3.682 7.004 7.516 231 HE ARG 106 HE ARG 106 -5.904 8.002 8.764 232 HH11 ARG 106 HH21 ARG 106 -2.995 9.351 7.472 233 HH12 ARG 106 HH22 ARG 106 -3.739 10.831 6.967 234 HH21 ARG 106 HH11 ARG 106 -6.889 9.943 8.112 235 HH22 ARG 106 HH12 ARG 106 -5.943 11.167 7.331 236 H HIS 107 HN HIS 107 -4.287 2.446 9.810 237 HA HIS 107 HA HIS 107 -2.226 2.881 11.691 238 HB2 HIS 107 HB2 HIS 107 -4.290 1.714 12.280 239 HB3 HIS 107 HB1 HIS 107 -3.882 0.399 11.176 240 HD1 HIS 107 HD1 HIS 107 -2.682 2.029 14.382 241 HD2 HIS 107 HD2 HIS 107 -2.036 -1.438 12.169 242 HE1 HIS 107 HE1 HIS 107 -1.220 0.532 15.811 243 HE2 HIS 107 HE2 HIS 107 -0.821 -1.592 14.478 244 H VAL 108 HN VAL 108 -2.593 0.576 9.065 245 HA VAL 108 HA VAL 108 -0.269 -0.936 9.470 246 HB VAL 108 HB VAL 108 -1.881 -0.357 6.981 247 HG11 VAL 108 HG11 VAL 108 0.294 -1.076 6.223 248 HG12 VAL 108 HG12 VAL 108 -0.782 -2.465 6.122 249 HG13 VAL 108 HG13 VAL 108 0.361 -2.335 7.454 250 HG21 VAL 108 HG21 VAL 108 -1.830 -3.011 8.303 251 HG22 VAL 108 HG22 VAL 108 -3.186 -2.129 7.602 252 HG23 VAL 108 HG23 VAL 108 -2.607 -1.717 9.215 253 H MET 109 HN MET 109 -0.766 2.089 7.662 254 HA MET 109 HA MET 109 1.938 2.012 6.568 255 HB2 MET 109 HB2 MET 109 -0.428 3.808 6.309 256 HB3 MET 109 HB1 MET 109 1.166 4.505 6.001 257 HG2 MET 109 HG2 MET 109 -0.174 3.390 4.033 258 HG3 MET 109 HG1 MET 109 1.569 3.131 4.171 259 HE1 MET 109 HE1 MET 109 0.340 1.643 2.403 260 HE2 MET 109 HE2 MET 109 -0.052 -0.046 2.715 261 HE3 MET 109 HE3 MET 109 1.616 0.502 2.846 262 H THR 110 HN THR 110 0.403 3.299 9.387 263 HA THR 110 HA THR 110 2.750 5.007 9.900 264 HB THR 110 HB THR 110 1.404 6.105 11.581 265 HG1 THR 110 HG1 THR 110 -0.610 4.234 10.894 266 HG21 THR 110 HG21 THR 110 1.061 6.958 9.380 267 HG22 THR 110 HG22 THR 110 -0.528 6.843 10.133 268 HG23 THR 110 HG23 THR 110 -0.016 5.627 8.966 269 H ASN 111 HN ASN 111 1.354 2.002 10.808 270 HA ASN 111 HA ASN 111 3.000 1.916 13.265 271 HB2 ASN 111 HB2 ASN 111 0.507 1.492 13.431 272 HB3 ASN 111 HB1 ASN 111 0.787 0.008 12.523 273 HD21 ASN 111 HD21 ASN 111 0.677 1.269 15.667 274 HD22 ASN 111 HD22 ASN 111 1.524 0.028 16.457 275 H LEU 112 HN LEU 112 2.049 -0.101 10.471 276 HA LEU 112 HA LEU 112 4.313 -1.889 11.000 277 HB2 LEU 112 HB2 LEU 112 2.118 -2.071 8.932 278 HB3 LEU 112 HB1 LEU 112 3.341 -3.300 9.232 279 HG LEU 112 HG LEU 112 1.304 -2.324 11.261 280 HD11 LEU 112 HD11 LEU 112 1.068 -4.175 9.107 281 HD12 LEU 112 HD12 LEU 112 -0.100 -3.857 10.390 282 HD13 LEU 112 HD13 LEU 112 1.120 -5.115 10.600 283 HD21 LEU 112 HD21 LEU 112 3.632 -4.214 11.356 284 HD22 LEU 112 HD22 LEU 112 2.197 -4.601 12.303 285 HD23 LEU 112 HD23 LEU 112 3.058 -3.087 12.585 286 H GLY 113 HN GLY 113 5.370 -2.747 8.941 287 HA2 GLY 113 HA2 GLY 113 6.691 -2.442 7.086 288 HA3 GLY 113 HA1 GLY 113 5.701 -1.050 6.685 289 H GLU 114 HN GLU 114 6.848 0.721 6.477 290 HA GLU 114 HA GLU 114 9.323 1.032 8.041 291 HB2 GLU 114 HB2 GLU 114 8.448 2.306 5.448 292 HB3 GLU 114 HB1 GLU 114 9.919 2.749 6.315 293 HG2 GLU 114 HG2 GLU 114 10.742 0.447 6.144 294 HG3 GLU 114 HG1 GLU 114 9.256 -0.041 5.332 295 H LYS 115 HN LYS 115 6.375 1.758 8.604 296 HA LYS 115 HA LYS 115 5.203 3.430 9.649 297 HB2 LYS 115 HB2 LYS 115 8.007 3.648 10.626 298 HB3 LYS 115 HB1 LYS 115 6.803 4.809 11.185 299 HG2 LYS 115 HG2 LYS 115 5.373 2.917 11.931 300 HG3 LYS 115 HG1 LYS 115 6.621 1.786 11.405 301 HD2 LYS 115 HD2 LYS 115 8.195 2.668 13.012 302 HD3 LYS 115 HD1 LYS 115 7.096 3.981 13.438 303 HE2 LYS 115 HE2 LYS 115 6.966 2.237 15.142 304 HE3 LYS 115 HE1 LYS 115 5.448 2.294 14.247 305 HZ1 LYS 115 HZ1 LYS 115 6.939 0.078 14.643 306 HZ2 LYS 115 HZ2 LYS 115 7.413 0.549 13.082 307 HZ3 LYS 115 HZ3 LYS 115 5.775 0.263 13.425 308 H LEU 116 HN LEU 116 4.374 4.823 8.224 309 HA LEU 116 HA LEU 116 6.072 6.826 6.920 310 HB2 LEU 116 HB2 LEU 116 3.225 5.922 6.565 311 HB3 LEU 116 HB1 LEU 116 3.732 7.485 5.935 312 HG LEU 116 HG LEU 116 3.877 5.680 4.230 313 HD11 LEU 116 HD11 LEU 116 5.758 7.636 4.783 314 HD12 LEU 116 HD12 LEU 116 5.669 6.691 3.301 315 HD13 LEU 116 HD13 LEU 116 6.738 6.185 4.607 316 HD21 LEU 116 HD21 LEU 116 5.454 3.878 4.486 317 HD22 LEU 116 HD22 LEU 116 4.444 3.894 5.929 318 HD23 LEU 116 HD23 LEU 116 6.078 4.556 5.986 319 H THR 117 HN THR 117 5.456 9.136 7.002 320 HA THR 117 HA THR 117 4.534 9.859 9.684 321 HB THR 117 HB THR 117 5.399 12.080 9.158 322 HG1 THR 117 HG1 THR 117 5.992 10.962 6.621 323 HG21 THR 117 HG21 THR 117 7.483 10.198 8.092 324 HG22 THR 117 HG22 THR 117 6.913 10.023 9.752 325 HG23 THR 117 HG23 THR 117 7.667 11.530 9.232 326 H ASP 118 HN ASP 118 3.101 11.908 9.731 327 HA ASP 118 HA ASP 118 0.648 11.311 8.514 328 HB2 ASP 118 HB2 ASP 118 1.711 13.861 9.733 329 HB3 ASP 118 HB1 ASP 118 0.052 13.694 9.162 330 H GLU 119 HN GLU 119 3.209 13.574 7.548 331 HA GLU 119 HA GLU 119 1.810 14.774 5.407 332 HB2 GLU 119 HB2 GLU 119 4.765 14.378 5.910 333 HB3 GLU 119 HB1 GLU 119 4.132 15.306 4.550 334 HG2 GLU 119 HG2 GLU 119 3.005 16.843 6.047 335 HG3 GLU 119 HG1 GLU 119 3.434 15.859 7.445 336 H GLU 120 HN GLU 120 3.942 11.920 5.519 337 HA GLU 120 HA GLU 120 3.841 11.429 2.714 338 HB2 GLU 120 HB2 GLU 120 4.578 9.697 5.074 339 HB3 GLU 120 HB1 GLU 120 4.654 9.125 3.409 340 HG2 GLU 120 HG2 GLU 120 6.186 10.953 2.827 341 HG3 GLU 120 HG1 GLU 120 6.085 11.581 4.471 342 H VAL 121 HN VAL 121 2.069 10.124 5.476 343 HA VAL 121 HA VAL 121 0.511 8.252 3.997 344 HB VAL 121 HB VAL 121 0.045 9.608 6.675 345 HG11 VAL 121 HG11 VAL 121 -2.118 8.980 5.957 346 HG12 VAL 121 HG12 VAL 121 -1.566 7.631 6.950 347 HG13 VAL 121 HG13 VAL 121 -1.526 7.504 5.192 348 HG21 VAL 121 HG21 VAL 121 1.713 8.125 7.194 349 HG22 VAL 121 HG22 VAL 121 1.445 7.163 5.743 350 HG23 VAL 121 HG23 VAL 121 0.407 6.949 7.143 351 H ASP 122 HN ASP 122 -0.138 11.637 5.003 352 HA ASP 122 HA ASP 122 -2.779 11.795 4.175 353 HB2 ASP 122 HB2 ASP 122 -0.565 13.857 4.122 354 HB3 ASP 122 HB1 ASP 122 -2.241 14.243 3.734 355 H GLU 123 HN GLU 123 0.194 12.061 2.290 356 HA GLU 123 HA GLU 123 -0.985 12.794 -0.179 357 HB2 GLU 123 HB2 GLU 123 1.550 11.278 0.466 358 HB3 GLU 123 HB1 GLU 123 1.111 11.798 -1.159 359 HG2 GLU 123 HG2 GLU 123 1.353 13.675 1.200 360 HG3 GLU 123 HG1 GLU 123 2.657 13.366 0.053 361 H MET 124 HN MET 124 -0.395 9.713 1.422 362 HA MET 124 HA MET 124 -1.096 8.042 -0.785 363 HB2 MET 124 HB2 MET 124 -0.976 7.511 2.195 364 HB3 MET 124 HB1 MET 124 -1.190 6.273 0.961 365 HG2 MET 124 HG2 MET 124 0.948 6.823 -0.044 366 HG3 MET 124 HG1 MET 124 1.137 8.197 1.037 367 HE1 MET 124 HE1 MET 124 0.838 4.577 0.499 368 HE2 MET 124 HE2 MET 124 -0.144 4.442 1.955 369 HE3 MET 124 HE3 MET 124 1.479 3.760 1.930 370 H ILE 125 HN ILE 125 -2.826 9.396 1.976 371 HA ILE 125 HA ILE 125 -5.224 7.969 1.761 372 HB ILE 125 HB ILE 125 -4.240 10.325 3.120 373 HG12 ILE 125 HG12 ILE 125 -5.695 9.446 4.919 374 HG13 ILE 125 HG11 ILE 125 -6.366 8.283 3.784 375 HG21 ILE 125 HG21 ILE 125 -5.942 11.573 1.971 376 HG22 ILE 125 HG22 ILE 125 -6.511 11.264 3.608 377 HG23 ILE 125 HG23 ILE 125 -7.137 10.311 2.270 378 HD11 ILE 125 HD11 ILE 125 -4.328 7.635 5.372 379 HD12 ILE 125 HD12 ILE 125 -3.394 8.384 4.080 380 HD13 ILE 125 HD13 ILE 125 -4.436 7.006 3.730 381 H ARG 126 HN ARG 126 -4.131 10.907 0.130 382 HA ARG 126 HA ARG 126 -6.610 11.490 -1.143 383 HB2 ARG 126 HB2 ARG 126 -3.765 12.268 -1.804 384 HB3 ARG 126 HB1 ARG 126 -5.171 12.875 -2.680 385 HG2 ARG 126 HG2 ARG 126 -6.086 13.836 -0.635 386 HG3 ARG 126 HG1 ARG 126 -4.772 13.140 0.314 387 HD2 ARG 126 HD2 ARG 126 -4.295 15.493 -0.141 388 HD3 ARG 126 HD1 ARG 126 -3.145 14.477 -1.005 389 HE ARG 126 HE ARG 126 -5.394 15.068 -2.652 390 HH11 ARG 126 HH21 ARG 126 -2.515 16.409 -1.281 391 HH12 ARG 126 HH22 ARG 126 -2.280 17.563 -2.552 392 HH21 ARG 126 HH11 ARG 126 -5.094 16.577 -4.322 393 HH22 ARG 126 HH12 ARG 126 -3.741 17.658 -4.275 394 H GLU 127 HN GLU 127 -4.018 9.295 -1.809 395 HA GLU 127 HA GLU 127 -5.006 8.768 -4.527 396 HB2 GLU 127 HB2 GLU 127 -2.600 7.659 -3.058 397 HB3 GLU 127 HB1 GLU 127 -3.008 7.347 -4.746 398 HG2 GLU 127 HG2 GLU 127 -2.525 10.110 -3.596 399 HG3 GLU 127 HG1 GLU 127 -1.308 9.170 -4.457 400 H ALA 128 HN ALA 128 -5.665 7.791 -1.439 401 HA ALA 128 HA ALA 128 -6.009 4.955 -2.017 402 HB1 ALA 128 HB1 ALA 128 -7.064 6.203 0.483 403 HB2 ALA 128 HB2 ALA 128 -5.323 6.161 0.248 404 HB3 ALA 128 HB3 ALA 128 -6.249 4.664 0.255 405 H ASP 129 HN ASP 129 -8.330 7.122 -0.403 406 HA ASP 129 HA ASP 129 -10.368 7.353 -2.215 407 HB2 ASP 129 HB2 ASP 129 -10.543 4.989 -2.594 408 HB3 ASP 129 HB1 ASP 129 -10.485 4.655 -0.866 409 H ILE 130 HN ILE 130 -11.330 5.505 0.500 410 HA ILE 130 HA ILE 130 -12.470 5.979 2.410 411 HB ILE 130 HB ILE 130 -11.170 8.681 2.548 412 HG12 ILE 130 HG12 ILE 130 -9.555 6.763 3.900 413 HG13 ILE 130 HG11 ILE 130 -9.757 6.169 2.260 414 HG21 ILE 130 HG21 ILE 130 -11.373 6.750 4.801 415 HG22 ILE 130 HG22 ILE 130 -12.881 7.439 4.199 416 HG23 ILE 130 HG23 ILE 130 -11.602 8.499 4.792 417 HD11 ILE 130 HD11 ILE 130 -9.137 8.546 1.492 418 HD12 ILE 130 HD12 ILE 130 -7.845 7.574 2.185 419 HD13 ILE 130 HD13 ILE 130 -8.626 8.815 3.158 420 H ASP 131 HN ASP 131 -14.082 6.233 0.416 421 HA ASP 131 HA ASP 131 -15.229 8.901 0.233 422 HB2 ASP 131 HB2 ASP 131 -15.175 7.334 -1.718 423 HB3 ASP 131 HB1 ASP 131 -16.287 6.277 -0.851 424 H GLY 132 HN GLY 132 -15.455 8.844 2.641 425 HA2 GLY 132 HA2 GLY 132 -16.717 8.595 4.578 426 HA3 GLY 132 HA1 GLY 132 -18.065 8.840 3.470 427 H ASP 133 HN ASP 133 -15.906 6.089 3.221 428 HA ASP 133 HA ASP 133 -18.009 4.339 4.337 429 HB2 ASP 133 HB2 ASP 133 -18.112 4.391 1.847 430 HB3 ASP 133 HB1 ASP 133 -16.459 3.787 1.802 431 H GLY 134 HN GLY 134 -14.650 5.066 3.914 432 HA2 GLY 134 HA2 GLY 134 -12.866 4.344 5.200 433 HA3 GLY 134 HA1 GLY 134 -13.955 3.247 6.034 434 H GLN 135 HN GLN 135 -13.690 3.165 2.524 435 HA GLN 135 HA GLN 135 -12.094 0.681 2.753 436 HB2 GLN 135 HB2 GLN 135 -13.435 0.145 0.516 437 HB3 GLN 135 HB1 GLN 135 -14.052 -0.293 2.113 438 HG2 GLN 135 HG2 GLN 135 -15.767 0.855 0.731 439 HG3 GLN 135 HG1 GLN 135 -15.379 1.756 2.196 440 HE21 GLN 135 HE21 GLN 135 -15.111 1.770 -1.324 441 HE22 GLN 135 HE22 GLN 135 -14.510 3.354 -1.450 442 H VAL 136 HN VAL 136 -10.622 0.221 1.105 443 HA VAL 136 HA VAL 136 -10.135 2.372 -0.839 444 HB VAL 136 HB VAL 136 -8.238 1.193 1.160 445 HG11 VAL 136 HG11 VAL 136 -6.467 2.406 -0.316 446 HG12 VAL 136 HG12 VAL 136 -7.642 2.207 -1.615 447 HG13 VAL 136 HG13 VAL 136 -6.984 0.788 -0.792 448 HG21 VAL 136 HG21 VAL 136 -9.495 3.421 1.400 449 HG22 VAL 136 HG22 VAL 136 -8.468 4.007 0.094 450 HG23 VAL 136 HG23 VAL 136 -7.745 3.473 1.612 451 H ASN 137 HN ASN 137 -9.624 1.740 -2.828 452 HA ASN 137 HA ASN 137 -9.575 -1.126 -3.390 453 HB2 ASN 137 HB2 ASN 137 -9.317 0.126 -5.814 454 HB3 ASN 137 HB1 ASN 137 -10.853 -0.303 -5.070 455 HD21 ASN 137 HD21 ASN 137 -12.208 1.408 -4.350 456 HD22 ASN 137 HD22 ASN 137 -11.783 3.047 -4.476 457 H TYR 138 HN TYR 138 -7.592 -2.070 -3.222 458 HA TYR 138 HA TYR 138 -5.149 -0.649 -3.382 459 HB2 TYR 138 HB2 TYR 138 -4.068 -2.852 -3.389 460 HB3 TYR 138 HB1 TYR 138 -5.307 -2.742 -2.144 461 HD1 TYR 138 HD1 TYR 138 -4.574 -4.056 -5.549 462 HD2 TYR 138 HD2 TYR 138 -7.222 -4.172 -2.180 463 HE1 TYR 138 HE1 TYR 138 -5.700 -6.052 -6.498 464 HE2 TYR 138 HE2 TYR 138 -8.343 -6.160 -3.110 465 HH TYR 138 HH TYR 138 -7.407 -7.467 -6.295 466 H GLU 139 HN GLU 139 -7.199 -1.758 -5.839 467 HA GLU 139 HA GLU 139 -5.369 -2.523 -7.828 468 HB2 GLU 139 HB2 GLU 139 -8.057 -1.146 -8.066 469 HB3 GLU 139 HB1 GLU 139 -7.146 -1.739 -9.451 470 HG2 GLU 139 HG2 GLU 139 -8.583 -3.532 -8.960 471 HG3 GLU 139 HG1 GLU 139 -7.084 -4.007 -8.170 472 H GLU 140 HN GLU 140 -6.678 0.756 -7.149 473 HA GLU 140 HA GLU 140 -5.238 2.055 -9.185 474 HB2 GLU 140 HB2 GLU 140 -7.132 3.081 -7.979 475 HB3 GLU 140 HB1 GLU 140 -6.145 3.170 -6.520 476 HG2 GLU 140 HG2 GLU 140 -4.550 4.644 -7.652 477 HG3 GLU 140 HG1 GLU 140 -5.459 4.505 -9.156 478 H PHE 141 HN PHE 141 -4.421 1.438 -5.814 479 HA PHE 141 HA PHE 141 -1.975 2.877 -5.704 480 HB2 PHE 141 HB2 PHE 141 -3.250 0.704 -4.144 481 HB3 PHE 141 HB1 PHE 141 -1.491 0.741 -4.068 482 HD1 PHE 141 HD2 PHE 141 -0.547 3.283 -3.890 483 HD2 PHE 141 HD1 PHE 141 -4.360 1.915 -2.471 484 HE1 PHE 141 HE2 PHE 141 -0.607 5.151 -2.260 485 HE2 PHE 141 HE1 PHE 141 -4.412 3.772 -0.839 486 HZ PHE 141 HZ PHE 141 -2.548 5.397 -0.736 487 H VAL 142 HN VAL 142 -2.618 -0.536 -6.518 488 HA VAL 142 HA VAL 142 0.078 -1.183 -7.057 489 HB VAL 142 HB VAL 142 -2.523 -2.438 -7.930 490 HG11 VAL 142 HG11 VAL 142 0.324 -3.057 -8.628 491 HG12 VAL 142 HG12 VAL 142 -1.137 -3.279 -9.592 492 HG13 VAL 142 HG13 VAL 142 -0.757 -4.409 -8.292 493 HG21 VAL 142 HG21 VAL 142 -1.258 -2.328 -5.493 494 HG22 VAL 142 HG22 VAL 142 -0.578 -3.808 -6.178 495 HG23 VAL 142 HG23 VAL 142 -2.325 -3.640 -6.001 496 H GLN 143 HN GLN 143 -2.548 -0.047 -9.148 497 HA GLN 143 HA GLN 143 -1.097 -0.226 -11.592 498 HB2 GLN 143 HB2 GLN 143 -3.374 1.584 -10.754 499 HB3 GLN 143 HB1 GLN 143 -2.701 1.570 -12.382 500 HG2 GLN 143 HG2 GLN 143 -3.747 -0.908 -11.005 501 HG3 GLN 143 HG1 GLN 143 -4.726 0.096 -12.074 502 HE21 GLN 143 HE21 GLN 143 -2.693 -2.580 -12.035 503 HE22 GLN 143 HE22 GLN 143 -2.280 -2.614 -13.681 504 H MET 144 HN MET 144 -1.428 2.264 -9.140 505 HA MET 144 HA MET 144 0.152 4.257 -10.410 506 HB2 MET 144 HB2 MET 144 -1.111 5.203 -8.757 507 HB3 MET 144 HB1 MET 144 -1.043 3.771 -7.740 508 HG2 MET 144 HG2 MET 144 1.038 4.341 -6.845 509 HG3 MET 144 HG1 MET 144 1.401 5.486 -8.145 510 HE1 MET 144 HE1 MET 144 0.475 6.818 -4.252 511 HE2 MET 144 HE2 MET 144 1.861 6.258 -5.187 512 HE3 MET 144 HE3 MET 144 0.625 5.111 -4.679 513 H MET 145 HN MET 145 0.904 1.854 -7.881 514 HA MET 145 HA MET 145 3.642 2.518 -7.631 515 HB2 MET 145 HB2 MET 145 2.103 0.008 -6.964 516 HB3 MET 145 HB1 MET 145 3.814 0.220 -6.598 517 HG2 MET 145 HG2 MET 145 3.322 2.163 -5.217 518 HG3 MET 145 HG1 MET 145 1.616 2.076 -5.649 519 HE1 MET 145 HE1 MET 145 0.527 1.196 -2.724 520 HE2 MET 145 HE2 MET 145 1.565 2.473 -3.356 521 HE3 MET 145 HE3 MET 145 2.142 1.457 -2.043 522 H THR 146 HN THR 146 1.916 0.281 -9.762 523 HA THR 146 HA THR 146 4.217 -1.130 -10.656 524 HB THR 146 HB THR 146 1.553 -0.714 -12.051 525 HG1 THR 146 HG1 THR 146 0.869 -1.896 -10.472 526 HG21 THR 146 HG21 THR 146 3.288 -3.150 -12.303 527 HG22 THR 146 HG22 THR 146 3.676 -1.736 -13.279 528 HG23 THR 146 HG23 THR 146 2.102 -2.509 -13.436 529 H ALA 147 HN ALA 147 2.497 1.756 -11.799 530 HA ALA 147 HA ALA 147 3.792 2.115 -14.242 531 HB1 ALA 147 HB1 ALA 147 1.846 3.452 -13.342 532 HB2 ALA 147 HB2 ALA 147 3.110 4.411 -14.112 533 HB3 ALA 147 HB3 ALA 147 3.007 4.340 -12.353 534 H LYS 148 HN LYS 148 5.966 1.571 -14.102 535 HA LYS 148 HA LYS 148 7.697 3.697 -13.186 536 HB2 LYS 148 HB2 LYS 148 8.811 2.623 -11.483 537 HB3 LYS 148 HB1 LYS 148 7.191 1.982 -11.250 538 HG2 LYS 148 HG2 LYS 148 8.361 0.008 -11.228 539 HG3 LYS 148 HG1 LYS 148 8.075 0.120 -12.958 540 HD2 LYS 148 HD2 LYS 148 10.367 1.546 -12.815 541 HD3 LYS 148 HD1 LYS 148 10.593 0.503 -11.413 542 HE2 LYS 148 HE2 LYS 148 11.546 -0.659 -13.283 543 HE3 LYS 148 HE1 LYS 148 10.021 -1.463 -12.908 544 HZ1 LYS 148 HZ1 LYS 148 10.520 -0.861 -15.333 545 HZ2 LYS 148 HZ2 LYS 148 10.126 0.728 -14.879 546 HZ3 LYS 148 HZ3 LYS 148 8.976 -0.513 -14.723 547 H PHE 30 HT1 PHE 30 -10.405 -5.015 12.693 548 HA PHE 30 HA PHE 30 -9.255 -3.822 10.806 549 HB2 PHE 30 HB2 PHE 30 -6.792 -5.082 12.028 550 HB3 PHE 30 HB1 PHE 30 -6.884 -3.942 10.687 551 HD1 PHE 30 HD2 PHE 30 -8.115 -1.644 11.283 552 HD2 PHE 30 HD1 PHE 30 -6.215 -4.239 14.132 553 HE1 PHE 30 HE2 PHE 30 -7.899 0.251 12.867 554 HE2 PHE 30 HE1 PHE 30 -6.000 -2.343 15.714 555 HZ PHE 30 HZ PHE 30 -6.841 -0.098 15.083 556 H ASP 31 HN ASP 31 -9.184 -6.767 12.629 557 HA ASP 31 HA ASP 31 -9.348 -8.979 12.052 558 HB2 ASP 31 HB2 ASP 31 -10.439 -7.740 9.513 559 HB3 ASP 31 HB1 ASP 31 -10.436 -9.472 9.832 560 H ILE 32 HN ILE 32 -6.895 -7.581 11.692 561 HA ILE 32 HA ILE 32 -5.645 -9.218 9.572 562 HB ILE 32 HB ILE 32 -5.055 -6.359 10.363 563 HG12 ILE 32 HG12 ILE 32 -5.623 -7.520 7.633 564 HG13 ILE 32 HG11 ILE 32 -6.908 -6.950 8.690 565 HG21 ILE 32 HG21 ILE 32 -3.465 -8.341 8.731 566 HG22 ILE 32 HG22 ILE 32 -2.918 -7.343 10.082 567 HG23 ILE 32 HG23 ILE 32 -3.287 -6.597 8.529 568 HD11 ILE 32 HD11 ILE 32 -6.178 -4.728 8.598 569 HD12 ILE 32 HD12 ILE 32 -5.859 -5.291 6.959 570 HD13 ILE 32 HD13 ILE 32 -4.543 -5.185 8.127 571 H ASP 33 HN ASP 33 -4.030 -10.503 10.277 572 HA ASP 33 HA ASP 33 -3.295 -10.393 13.087 573 HB2 ASP 33 HB2 ASP 33 -2.623 -12.295 10.839 574 HB3 ASP 33 HB1 ASP 33 -1.940 -12.447 12.458 575 H MET 34 HN MET 34 -1.614 -9.310 13.841 576 HA MET 34 HA MET 34 0.440 -8.347 11.983 577 HB2 MET 34 HB2 MET 34 -0.184 -7.630 14.855 578 HB3 MET 34 HB1 MET 34 1.123 -6.917 13.908 579 HG2 MET 34 HG2 MET 34 -0.489 -6.111 12.247 580 HG3 MET 34 HG1 MET 34 -1.808 -6.862 13.143 581 HE1 MET 34 HE1 MET 34 -1.558 -3.689 12.293 582 HE2 MET 34 HE2 MET 34 -2.483 -3.148 13.695 583 HE3 MET 34 HE3 MET 34 -2.918 -4.651 12.888 584 H ASP 35 HN ASP 35 -0.054 -10.963 13.928 585 HA ASP 35 HA ASP 35 2.655 -11.198 14.964 586 HB2 ASP 35 HB2 ASP 35 1.897 -13.299 15.917 587 HB3 ASP 35 HB1 ASP 35 0.697 -12.051 16.246 588 H ALA 36 HN ALA 36 1.437 -11.407 12.000 589 HA ALA 36 HA ALA 36 2.891 -13.834 11.196 590 HB1 ALA 36 HB1 ALA 36 1.559 -13.898 9.297 591 HB2 ALA 36 HB2 ALA 36 1.257 -12.161 9.330 592 HB3 ALA 36 HB3 ALA 36 0.450 -13.217 10.488 593 HA PRO 37 HA PRO 37 6.232 -10.852 10.157 594 HB2 PRO 37 HB2 PRO 37 7.180 -13.326 8.752 595 HB3 PRO 37 HB1 PRO 37 8.089 -12.191 9.769 596 HG2 PRO 37 HG2 PRO 37 7.359 -14.534 10.726 597 HG3 PRO 37 HG1 PRO 37 7.251 -13.077 11.733 598 HD2 PRO 37 HD2 PRO 37 5.048 -14.596 10.382 599 HD3 PRO 37 HD1 PRO 37 5.049 -13.741 11.943 600 H GLU 38 HN GLU 38 4.493 -12.998 7.980 601 HA GLU 38 HA GLU 38 5.337 -11.955 5.511 602 HB2 GLU 38 HB2 GLU 38 4.050 -14.051 5.756 603 HB3 GLU 38 HB1 GLU 38 2.634 -13.116 6.237 604 HG2 GLU 38 HG2 GLU 38 2.619 -11.973 4.067 605 HG3 GLU 38 HG1 GLU 38 4.079 -12.835 3.584 606 H THR 39 HN THR 39 2.691 -10.978 7.676 607 HA THR 39 HA THR 39 1.537 -9.038 5.989 608 HB THR 39 HB THR 39 1.660 -9.097 9.015 609 HG1 THR 39 HG1 THR 39 0.077 -10.474 8.871 610 HG21 THR 39 HG21 THR 39 0.502 -7.231 7.087 611 HG22 THR 39 HG22 THR 39 0.722 -7.055 8.829 612 HG23 THR 39 HG23 THR 39 -0.699 -7.888 8.198 613 H GLU 40 HN GLU 40 4.065 -8.766 8.476 614 HA GLU 40 HA GLU 40 4.446 -5.981 8.270 615 HB2 GLU 40 HB2 GLU 40 5.328 -7.345 10.131 616 HB3 GLU 40 HB1 GLU 40 6.463 -8.111 9.022 617 HG2 GLU 40 HG2 GLU 40 7.514 -5.947 8.555 618 HG3 GLU 40 HG1 GLU 40 6.341 -5.134 9.591 619 H ARG 41 HN ARG 41 6.016 -8.702 6.605 620 HA ARG 41 HA ARG 41 7.873 -7.156 5.140 621 HB2 ARG 41 HB2 ARG 41 6.628 -9.858 4.579 622 HB3 ARG 41 HB1 ARG 41 7.927 -9.165 3.610 623 HG2 ARG 41 HG2 ARG 41 8.252 -9.345 6.592 624 HG3 ARG 41 HG1 ARG 41 8.509 -10.784 5.607 625 HD2 ARG 41 HD2 ARG 41 10.175 -9.561 4.255 626 HD3 ARG 41 HD1 ARG 41 9.927 -8.123 5.237 627 HE ARG 41 HE ARG 41 11.150 -9.124 6.958 628 HH11 ARG 41 HH21 ARG 41 10.433 -11.347 4.404 629 HH12 ARG 41 HH22 ARG 41 11.525 -12.565 4.972 630 HH21 ARG 41 HH11 ARG 41 12.583 -10.716 7.709 631 HH22 ARG 41 HH12 ARG 41 12.742 -12.208 6.843 632 H ALA 42 HN ALA 42 4.565 -8.195 4.450 633 HA ALA 42 HA ALA 42 4.437 -7.298 1.777 634 HB1 ALA 42 HB1 ALA 42 2.663 -8.684 2.407 635 HB2 ALA 42 HB2 ALA 42 1.908 -7.091 2.381 636 HB3 ALA 42 HB3 ALA 42 2.390 -7.813 3.916 637 H ALA 43 HN ALA 43 3.828 -5.693 4.861 638 HA ALA 43 HA ALA 43 2.784 -3.275 3.868 639 HB1 ALA 43 HB1 ALA 43 3.032 -4.233 6.322 640 HB2 ALA 43 HB2 ALA 43 2.959 -2.496 6.032 641 HB3 ALA 43 HB3 ALA 43 4.515 -3.280 6.301 642 H VAL 44 HN VAL 44 6.103 -4.344 4.460 643 HA VAL 44 HA VAL 44 7.399 -1.885 4.038 644 HB VAL 44 HB VAL 44 8.331 -4.731 3.646 645 HG11 VAL 44 HG11 VAL 44 9.881 -3.635 2.319 646 HG12 VAL 44 HG12 VAL 44 10.625 -3.407 3.903 647 HG13 VAL 44 HG13 VAL 44 9.685 -2.104 3.174 648 HG21 VAL 44 HG21 VAL 44 9.587 -4.182 5.754 649 HG22 VAL 44 HG22 VAL 44 7.835 -4.152 5.955 650 HG23 VAL 44 HG23 VAL 44 8.732 -2.641 5.810 651 H ALA 45 HN ALA 45 6.660 -4.511 1.726 652 HA ALA 45 HA ALA 45 7.930 -3.339 -0.496 653 HB1 ALA 45 HB1 ALA 45 5.811 -5.404 -0.121 654 HB2 ALA 45 HB2 ALA 45 7.379 -5.532 -0.919 655 HB3 ALA 45 HB3 ALA 45 6.037 -4.727 -1.735 656 H ILE 46 HN ILE 46 4.584 -3.078 0.668 657 HA ILE 46 HA ILE 46 3.619 -1.493 -1.459 658 HB ILE 46 HB ILE 46 2.734 -1.728 1.430 659 HG12 ILE 46 HG12 ILE 46 1.493 -2.846 -1.095 660 HG13 ILE 46 HG11 ILE 46 2.664 -3.747 -0.132 661 HG21 ILE 46 HG21 ILE 46 1.906 0.392 0.520 662 HG22 ILE 46 HG22 ILE 46 0.583 -0.770 0.583 663 HG23 ILE 46 HG23 ILE 46 1.377 -0.426 -0.950 664 HD11 ILE 46 HD11 ILE 46 0.153 -4.124 0.370 665 HD12 ILE 46 HD12 ILE 46 0.214 -2.538 1.139 666 HD13 ILE 46 HD13 ILE 46 1.234 -3.847 1.736 667 H GLN 47 HN GLN 47 4.943 -0.635 1.725 668 HA GLN 47 HA GLN 47 4.759 2.177 1.381 669 HB2 GLN 47 HB2 GLN 47 6.408 0.439 3.212 670 HB3 GLN 47 HB1 GLN 47 6.458 2.200 3.267 671 HG2 GLN 47 HG2 GLN 47 4.008 2.252 3.625 672 HG3 GLN 47 HG1 GLN 47 3.972 0.491 3.589 673 HE21 GLN 47 HE21 GLN 47 3.326 0.206 5.800 674 HE22 GLN 47 HE22 GLN 47 4.325 0.639 7.101 675 H SER 48 HN SER 48 7.338 -0.165 0.732 676 HA SER 48 HA SER 48 9.393 1.669 0.169 677 HB2 SER 48 HB2 SER 48 9.815 -0.724 0.483 678 HB3 SER 48 HB1 SER 48 8.919 -1.088 -0.989 679 HG SER 48 HG SER 48 11.478 -0.266 -0.674 680 H GLN 49 HN GLN 49 6.993 0.145 -1.965 681 HA GLN 49 HA GLN 49 7.917 1.355 -4.352 682 HB2 GLN 49 HB2 GLN 49 5.528 -0.163 -3.504 683 HB3 GLN 49 HB1 GLN 49 5.300 0.911 -4.885 684 HG2 GLN 49 HG2 GLN 49 6.031 -1.348 -5.596 685 HG3 GLN 49 HG1 GLN 49 7.209 -0.115 -6.032 686 HE21 GLN 49 HE21 GLN 49 6.519 -2.468 -3.385 687 HE22 GLN 49 HE22 GLN 49 8.153 -2.762 -3.033 688 H PHE 50 HN PHE 50 5.618 2.386 -1.878 689 HA PHE 50 HA PHE 50 4.462 4.527 -3.273 690 HB2 PHE 50 HB2 PHE 50 3.472 3.829 -1.197 691 HB3 PHE 50 HB1 PHE 50 4.964 4.157 -0.312 692 HD1 PHE 50 HD1 PHE 50 2.714 5.966 -2.721 693 HD2 PHE 50 HD2 PHE 50 4.997 6.147 0.921 694 HE1 PHE 50 HE1 PHE 50 2.042 8.332 -2.417 695 HE2 PHE 50 HE2 PHE 50 4.333 8.520 1.206 696 HZ PHE 50 HZ PHE 50 2.856 9.612 -0.456 697 H ARG 51 HN ARG 51 7.326 4.476 -1.148 698 HA ARG 51 HA ARG 51 7.944 7.218 -1.403 699 HB2 ARG 51 HB2 ARG 51 9.674 4.815 -0.795 700 HB3 ARG 51 HB1 ARG 51 10.266 6.475 -0.733 701 HG2 ARG 51 HG2 ARG 51 8.548 7.040 0.936 702 HG3 ARG 51 HG1 ARG 51 7.929 5.389 0.866 703 HD2 ARG 51 HD2 ARG 51 10.108 4.533 1.635 704 HD3 ARG 51 HD1 ARG 51 10.734 6.178 1.700 705 HE ARG 51 HE ARG 51 8.403 6.054 3.276 706 HH11 ARG 51 HH21 ARG 51 11.637 4.832 3.148 707 HH12 ARG 51 HH22 ARG 51 11.802 4.695 4.868 708 HH21 ARG 51 HH11 ARG 51 8.610 5.877 5.532 709 HH22 ARG 51 HH12 ARG 51 10.088 5.287 6.217 710 H LYS 52 HN LYS 52 8.895 4.384 -3.299 711 HA LYS 52 HA LYS 52 10.792 5.644 -4.961 712 HB2 LYS 52 HB2 LYS 52 10.535 3.191 -4.799 713 HB3 LYS 52 HB1 LYS 52 8.974 3.309 -5.609 714 HG2 LYS 52 HG2 LYS 52 10.056 4.258 -7.602 715 HG3 LYS 52 HG1 LYS 52 11.620 4.206 -6.792 716 HD2 LYS 52 HD2 LYS 52 11.425 1.746 -6.594 717 HD3 LYS 52 HD1 LYS 52 9.876 1.810 -7.438 718 HE2 LYS 52 HE2 LYS 52 12.511 2.780 -8.583 719 HE3 LYS 52 HE1 LYS 52 11.753 1.236 -8.969 720 HZ1 LYS 52 HZ1 LYS 52 11.132 3.862 -9.931 721 HZ2 LYS 52 HZ2 LYS 52 9.762 3.047 -9.343 722 HZ3 LYS 52 HZ3 LYS 52 10.708 2.349 -10.569 723 H PHE 53 HN PHE 53 7.294 5.240 -5.250 724 HA PHE 53 HA PHE 53 6.957 6.252 -7.844 725 HB2 PHE 53 HB2 PHE 53 5.196 5.088 -6.517 726 HB3 PHE 53 HB1 PHE 53 5.050 6.528 -5.509 727 HD1 PHE 53 HD1 PHE 53 4.492 5.114 -8.870 728 HD2 PHE 53 HD2 PHE 53 4.042 8.574 -6.364 729 HE1 PHE 53 HE1 PHE 53 2.956 6.121 -10.537 730 HE2 PHE 53 HE2 PHE 53 2.509 9.583 -8.032 731 HZ PHE 53 HZ PHE 53 1.966 8.357 -10.118 732 H GLN 54 HN GLN 54 7.019 7.896 -4.699 733 HA GLN 54 HA GLN 54 6.356 10.478 -5.600 734 HB2 GLN 54 HB2 GLN 54 8.026 9.549 -3.255 735 HB3 GLN 54 HB1 GLN 54 7.556 11.229 -3.512 736 HG2 GLN 54 HG2 GLN 54 5.185 10.591 -3.467 737 HG3 GLN 54 HG1 GLN 54 5.635 8.899 -3.255 738 HE21 GLN 54 HE21 GLN 54 6.173 8.190 -1.139 739 HE22 GLN 54 HE22 GLN 54 6.189 9.218 0.212 740 H LYS 55 HN LYS 55 9.477 8.815 -5.341 741 HA LYS 55 HA LYS 55 11.139 11.007 -5.920 742 HB2 LYS 55 HB2 LYS 55 12.003 8.878 -5.060 743 HB3 LYS 55 HB1 LYS 55 11.551 8.075 -6.562 744 HG2 LYS 55 HG2 LYS 55 13.188 10.489 -6.958 745 HG3 LYS 55 HG1 LYS 55 14.012 9.212 -6.064 746 HD2 LYS 55 HD2 LYS 55 13.437 7.599 -7.855 747 HD3 LYS 55 HD1 LYS 55 12.650 8.891 -8.758 748 HE2 LYS 55 HE2 LYS 55 14.786 10.126 -8.854 749 HE3 LYS 55 HE1 LYS 55 15.574 8.824 -7.961 750 HZ1 LYS 55 HZ1 LYS 55 15.888 8.641 -10.371 751 HZ2 LYS 55 HZ2 LYS 55 14.207 8.505 -10.579 752 HZ3 LYS 55 HZ3 LYS 55 15.062 7.303 -9.735 753 H LYS 56 HN LYS 56 9.611 8.624 -8.085 754 HA LYS 56 HA LYS 56 10.748 9.566 -10.481 755 HB2 LYS 56 HB2 LYS 56 9.548 7.421 -10.319 756 HB3 LYS 56 HB1 LYS 56 8.039 8.292 -10.045 757 HG2 LYS 56 HG2 LYS 56 8.142 9.307 -12.240 758 HG3 LYS 56 HG1 LYS 56 9.767 8.682 -12.505 759 HD2 LYS 56 HD2 LYS 56 8.398 7.189 -13.711 760 HD3 LYS 56 HD1 LYS 56 8.693 6.339 -12.197 761 HE2 LYS 56 HE2 LYS 56 6.315 6.219 -12.793 762 HE3 LYS 56 HE1 LYS 56 6.516 7.170 -11.326 763 HZ1 LYS 56 HZ1 LYS 56 6.177 9.150 -12.471 764 HZ2 LYS 56 HZ2 LYS 56 5.030 8.099 -13.155 765 HZ3 LYS 56 HZ3 LYS 56 6.469 8.448 -13.987 766 H LYS 57 HN LYS 57 7.670 10.390 -8.887 767 HA LYS 57 HA LYS 57 6.845 12.284 -10.813 768 HB2 LYS 57 HB2 LYS 57 5.359 11.231 -9.083 769 HB3 LYS 57 HB1 LYS 57 6.155 12.217 -7.863 770 HG2 LYS 57 HG2 LYS 57 4.187 13.421 -8.420 771 HG3 LYS 57 HG1 LYS 57 5.472 14.249 -9.292 772 HD2 LYS 57 HD2 LYS 57 4.861 13.163 -11.368 773 HD3 LYS 57 HD1 LYS 57 3.737 12.092 -10.534 774 HE2 LYS 57 HE2 LYS 57 2.389 14.070 -9.873 775 HE3 LYS 57 HE1 LYS 57 3.499 15.104 -10.773 776 HZ1 LYS 57 HZ1 LYS 57 1.703 14.644 -12.203 777 HZ2 LYS 57 HZ2 LYS 57 1.722 12.985 -11.836 778 HZ3 LYS 57 HZ3 LYS 57 2.981 13.670 -12.749 779 H ALA 58 HN ALA 58 8.637 12.556 -7.780 780 HA ALA 58 HA ALA 58 9.674 14.373 -6.781 781 HB1 ALA 58 HB1 ALA 58 10.681 14.343 -9.624 782 HB2 ALA 58 HB2 ALA 58 11.436 13.640 -8.192 783 HB3 ALA 58 HB3 ALA 58 11.368 15.393 -8.384 784 H GLY 59 HN GLY 59 7.095 15.118 -7.322 785 HA2 GLY 59 HA2 GLY 59 6.759 17.393 -8.946 786 HA3 GLY 59 HA1 GLY 59 5.749 16.967 -7.568 787 H SER 60 HN SER 60 7.721 17.074 -5.539 788 HA SER 60 HA SER 60 8.870 19.758 -5.647 789 HB2 SER 60 HB2 SER 60 6.588 20.171 -4.860 790 HB3 SER 60 HB1 SER 60 6.792 18.966 -3.592 791 HG SER 60 HG SER 60 8.048 20.305 -2.508 792 H GLN 61 HN GLN 61 10.581 20.043 -4.263 793 HA GLN 61 HA GLN 61 11.721 17.638 -3.125 794 HB2 GLN 61 HB2 GLN 61 12.681 20.502 -3.278 795 HB3 GLN 61 HB1 GLN 61 13.603 19.206 -2.515 796 HG2 GLN 61 HG2 GLN 61 13.715 17.971 -4.588 797 HG3 GLN 61 HG1 GLN 61 12.602 19.092 -5.371 798 HE21 GLN 61 HE21 GLN 61 15.439 18.461 -6.134 799 HE22 GLN 61 HE22 GLN 61 16.256 19.948 -6.094 800 H SER 62 HN SER 62 12.176 17.264 -0.953 801 HA SER 62 HA SER 62 11.719 17.254 1.300 802 HB2 SER 62 HB2 SER 62 13.001 19.471 0.959 803 HB3 SER 62 HB1 SER 62 11.428 20.245 1.121 804 HG SER 62 HG SER 62 12.973 18.879 2.992 Start of MODEL 13 1 H1 MET 76 HT1 MET 76 15.562 -16.582 -16.422 2 H2 MET 76 HT2 MET 76 14.411 -15.971 -17.513 3 H3 MET 76 HT3 MET 76 13.993 -17.226 -16.446 4 HA MET 76 HA MET 76 13.228 -15.700 -15.056 5 HB2 MET 76 HB2 MET 76 16.144 -14.866 -14.995 6 HB3 MET 76 HB1 MET 76 14.937 -14.428 -13.785 7 HG2 MET 76 HG2 MET 76 14.576 -16.798 -13.256 8 HG3 MET 76 HG1 MET 76 15.734 -17.267 -14.501 9 HE1 MET 76 HE1 MET 76 17.882 -18.437 -12.269 10 HE2 MET 76 HE2 MET 76 16.153 -18.609 -12.566 11 HE3 MET 76 HE3 MET 76 16.720 -18.080 -10.984 12 H LYS 77 HN LYS 77 12.088 -14.704 -16.907 13 HA LYS 77 HA LYS 77 13.158 -12.037 -17.617 14 HB2 LYS 77 HB2 LYS 77 11.104 -13.768 -19.016 15 HB3 LYS 77 HB1 LYS 77 11.567 -12.145 -19.523 16 HG2 LYS 77 HG2 LYS 77 13.901 -12.893 -19.806 17 HG3 LYS 77 HG1 LYS 77 13.443 -14.518 -19.297 18 HD2 LYS 77 HD2 LYS 77 11.878 -14.676 -21.201 19 HD3 LYS 77 HD1 LYS 77 12.345 -13.056 -21.717 20 HE2 LYS 77 HE2 LYS 77 14.673 -13.812 -22.010 21 HE3 LYS 77 HE1 LYS 77 14.216 -15.433 -21.485 22 HZ1 LYS 77 HZ1 LYS 77 12.911 -15.754 -23.371 23 HZ2 LYS 77 HZ2 LYS 77 14.304 -14.986 -23.971 24 HZ3 LYS 77 HZ3 LYS 77 12.869 -14.103 -23.755 25 H ASP 78 HN ASP 78 12.245 -10.378 -16.599 26 HA ASP 78 HA ASP 78 10.446 -10.224 -14.682 27 HB2 ASP 78 HB2 ASP 78 11.544 -8.251 -15.660 28 HB3 ASP 78 HB1 ASP 78 10.431 -8.313 -17.026 29 H THR 79 HN THR 79 8.453 -10.780 -14.271 30 HA THR 79 HA THR 79 6.510 -11.034 -16.486 31 HB THR 79 HB THR 79 6.782 -12.835 -14.064 32 HG1 THR 79 HG1 THR 79 8.322 -13.087 -15.811 33 HG21 THR 79 HG21 THR 79 4.469 -12.691 -14.609 34 HG22 THR 79 HG22 THR 79 5.042 -14.163 -15.392 35 HG23 THR 79 HG23 THR 79 4.801 -12.696 -16.341 36 H ASP 80 HN ASP 80 4.496 -10.242 -16.130 37 HA ASP 80 HA ASP 80 3.752 -8.119 -14.852 38 HB2 ASP 80 HB2 ASP 80 2.185 -10.696 -14.840 39 HB3 ASP 80 HB1 ASP 80 1.502 -9.168 -14.295 40 H SER 81 HN SER 81 4.913 -7.567 -13.045 41 HA SER 81 HA SER 81 4.847 -9.157 -10.629 42 HB2 SER 81 HB2 SER 81 5.916 -6.384 -11.190 43 HB3 SER 81 HB1 SER 81 6.105 -7.239 -9.662 44 HG SER 81 HG SER 81 7.283 -7.692 -12.147 45 H GLU 82 HN GLU 82 2.683 -7.053 -12.077 46 HA GLU 82 HA GLU 82 1.737 -5.457 -10.003 47 HB2 GLU 82 HB2 GLU 82 -0.362 -5.383 -11.207 48 HB3 GLU 82 HB1 GLU 82 0.955 -5.380 -12.378 49 HG2 GLU 82 HG2 GLU 82 0.684 -7.909 -12.500 50 HG3 GLU 82 HG1 GLU 82 -0.809 -7.706 -11.586 51 H GLU 83 HN GLU 83 1.339 -8.837 -10.638 52 HA GLU 83 HA GLU 83 -0.771 -9.330 -8.777 53 HB2 GLU 83 HB2 GLU 83 -0.252 -11.671 -9.105 54 HB3 GLU 83 HB1 GLU 83 -0.155 -10.854 -10.665 55 HG2 GLU 83 HG2 GLU 83 2.345 -10.590 -10.228 56 HG3 GLU 83 HG1 GLU 83 2.134 -11.703 -8.878 57 H GLU 84 HN GLU 84 2.751 -9.291 -8.600 58 HA GLU 84 HA GLU 84 3.068 -10.531 -6.088 59 HB2 GLU 84 HB2 GLU 84 4.922 -10.131 -7.675 60 HB3 GLU 84 HB1 GLU 84 4.786 -8.399 -7.382 61 HG2 GLU 84 HG2 GLU 84 5.321 -8.726 -5.012 62 HG3 GLU 84 HG1 GLU 84 5.387 -10.471 -5.252 63 H ILE 85 HN ILE 85 2.759 -7.103 -6.975 64 HA ILE 85 HA ILE 85 2.899 -6.110 -4.319 65 HB ILE 85 HB ILE 85 1.731 -4.910 -6.844 66 HG12 ILE 85 HG12 ILE 85 4.303 -5.382 -6.458 67 HG13 ILE 85 HG11 ILE 85 3.783 -3.837 -7.125 68 HG21 ILE 85 HG21 ILE 85 2.026 -2.749 -5.431 69 HG22 ILE 85 HG22 ILE 85 2.024 -3.832 -4.038 70 HG23 ILE 85 HG23 ILE 85 0.620 -3.762 -5.104 71 HD11 ILE 85 HD11 ILE 85 4.119 -2.700 -5.096 72 HD12 ILE 85 HD12 ILE 85 5.480 -3.821 -5.151 73 HD13 ILE 85 HD13 ILE 85 4.084 -4.180 -4.142 74 H ARG 86 HN ARG 86 0.308 -7.153 -6.427 75 HA ARG 86 HA ARG 86 -1.918 -6.289 -4.960 76 HB2 ARG 86 HB2 ARG 86 -1.981 -7.122 -7.283 77 HB3 ARG 86 HB1 ARG 86 -1.587 -8.736 -6.700 78 HG2 ARG 86 HG2 ARG 86 -3.652 -8.878 -5.470 79 HG3 ARG 86 HG1 ARG 86 -4.026 -7.185 -5.806 80 HD2 ARG 86 HD2 ARG 86 -4.183 -7.655 -8.193 81 HD3 ARG 86 HD1 ARG 86 -3.690 -9.326 -7.927 82 HE ARG 86 HE ARG 86 -5.946 -8.939 -6.355 83 HH11 ARG 86 HH21 ARG 86 -5.062 -8.698 -9.692 84 HH12 ARG 86 HH22 ARG 86 -6.634 -9.123 -10.282 85 HH21 ARG 86 HH11 ARG 86 -8.010 -9.499 -7.122 86 HH22 ARG 86 HH12 ARG 86 -8.303 -9.577 -8.827 87 H GLU 87 HN GLU 87 0.067 -9.208 -4.719 88 HA GLU 87 HA GLU 87 -1.545 -10.700 -2.981 89 HB2 GLU 87 HB2 GLU 87 0.481 -11.587 -4.100 90 HB3 GLU 87 HB1 GLU 87 1.480 -10.584 -3.050 91 HG2 GLU 87 HG2 GLU 87 0.606 -11.742 -1.071 92 HG3 GLU 87 HG1 GLU 87 -0.452 -12.714 -2.092 93 H ALA 88 HN ALA 88 0.853 -8.187 -2.336 94 HA ALA 88 HA ALA 88 0.879 -8.353 0.467 95 HB1 ALA 88 HB1 ALA 88 2.498 -7.036 -0.876 96 HB2 ALA 88 HB2 ALA 88 1.770 -6.083 0.418 97 HB3 ALA 88 HB3 ALA 88 1.220 -5.879 -1.245 98 H PHE 89 HN PHE 89 -1.363 -6.741 -1.750 99 HA PHE 89 HA PHE 89 -2.762 -5.386 0.388 100 HB2 PHE 89 HB2 PHE 89 -3.270 -5.721 -2.559 101 HB3 PHE 89 HB1 PHE 89 -4.474 -4.999 -1.489 102 HD1 PHE 89 HD2 PHE 89 -3.986 -2.914 -0.262 103 HD2 PHE 89 HD1 PHE 89 -1.205 -4.565 -3.083 104 HE1 PHE 89 HE2 PHE 89 -2.760 -0.761 -0.313 105 HE2 PHE 89 HE1 PHE 89 0.034 -2.415 -3.133 106 HZ PHE 89 HZ PHE 89 -0.757 -0.510 -1.744 107 H ARG 90 HN ARG 90 -3.222 -8.265 -1.605 108 HA ARG 90 HA ARG 90 -5.773 -8.989 -0.878 109 HB2 ARG 90 HB2 ARG 90 -3.373 -10.701 -1.474 110 HB3 ARG 90 HB1 ARG 90 -4.954 -11.404 -1.127 111 HG2 ARG 90 HG2 ARG 90 -5.945 -10.067 -2.956 112 HG3 ARG 90 HG1 ARG 90 -4.357 -9.388 -3.311 113 HD2 ARG 90 HD2 ARG 90 -3.495 -11.634 -3.817 114 HD3 ARG 90 HD1 ARG 90 -5.058 -12.335 -3.417 115 HE ARG 90 HE ARG 90 -4.376 -10.888 -5.848 116 HH11 ARG 90 HH21 ARG 90 -6.826 -12.093 -3.720 117 HH12 ARG 90 HH22 ARG 90 -8.064 -12.112 -4.932 118 HH21 ARG 90 HH11 ARG 90 -5.995 -10.916 -7.442 119 HH22 ARG 90 HH12 ARG 90 -7.593 -11.445 -7.038 120 H VAL 91 HN VAL 91 -2.917 -9.024 1.078 121 HA VAL 91 HA VAL 91 -3.740 -10.844 3.070 122 HB VAL 91 HB VAL 91 -1.913 -8.436 3.164 123 HG11 VAL 91 HG11 VAL 91 -1.199 -9.947 5.301 124 HG12 VAL 91 HG12 VAL 91 -2.937 -10.231 5.301 125 HG13 VAL 91 HG13 VAL 91 -2.314 -8.586 5.420 126 HG21 VAL 91 HG21 VAL 91 -0.980 -11.229 3.561 127 HG22 VAL 91 HG22 VAL 91 -0.227 -9.906 2.668 128 HG23 VAL 91 HG23 VAL 91 -1.542 -10.828 1.937 129 H PHE 92 HN PHE 92 -4.331 -7.390 2.593 130 HA PHE 92 HA PHE 92 -5.807 -7.178 5.091 131 HB2 PHE 92 HB2 PHE 92 -5.608 -5.127 2.885 132 HB3 PHE 92 HB1 PHE 92 -6.033 -4.852 4.572 133 HD1 PHE 92 HD2 PHE 92 -4.115 -6.099 6.216 134 HD2 PHE 92 HD1 PHE 92 -3.490 -4.350 2.343 135 HE1 PHE 92 HE2 PHE 92 -1.729 -5.760 6.759 136 HE2 PHE 92 HE1 PHE 92 -1.101 -4.022 2.888 137 HZ PHE 92 HZ PHE 92 -0.215 -4.726 5.089 138 H ASP 93 HN ASP 93 -6.479 -7.885 1.781 139 HA ASP 93 HA ASP 93 -9.332 -7.249 2.066 140 HB2 ASP 93 HB2 ASP 93 -8.141 -6.795 -0.100 141 HB3 ASP 93 HB1 ASP 93 -7.929 -8.533 -0.280 142 H LYS 94 HN LYS 94 -9.785 -8.801 3.757 143 HA LYS 94 HA LYS 94 -9.334 -11.606 3.181 144 HB2 LYS 94 HB2 LYS 94 -10.855 -11.662 5.391 145 HB3 LYS 94 HB1 LYS 94 -9.113 -11.409 5.437 146 HG2 LYS 94 HG2 LYS 94 -10.290 -9.739 6.815 147 HG3 LYS 94 HG1 LYS 94 -9.468 -8.967 5.466 148 HD2 LYS 94 HD2 LYS 94 -11.447 -8.461 4.375 149 HD3 LYS 94 HD1 LYS 94 -12.297 -9.844 5.067 150 HE2 LYS 94 HE2 LYS 94 -11.453 -7.396 6.639 151 HE3 LYS 94 HE1 LYS 94 -13.078 -7.668 6.009 152 HZ1 LYS 94 HZ1 LYS 94 -12.900 -9.888 7.259 153 HZ2 LYS 94 HZ2 LYS 94 -13.205 -8.476 8.152 154 HZ3 LYS 94 HZ3 LYS 94 -11.642 -9.142 8.118 155 H ASP 95 HN ASP 95 -11.812 -9.271 2.771 156 HA ASP 95 HA ASP 95 -14.015 -11.133 2.712 157 HB2 ASP 95 HB2 ASP 95 -13.705 -8.277 1.769 158 HB3 ASP 95 HB1 ASP 95 -15.203 -9.190 1.597 159 H GLY 96 HN GLY 96 -11.627 -9.922 0.494 160 HA2 GLY 96 HA2 GLY 96 -11.032 -10.641 -1.612 161 HA3 GLY 96 HA1 GLY 96 -12.222 -11.931 -1.456 162 H ASN 97 HN ASN 97 -13.127 -8.601 -0.982 163 HA ASN 97 HA ASN 97 -14.897 -8.780 -3.309 164 HB2 ASN 97 HB2 ASN 97 -16.033 -6.851 -2.347 165 HB3 ASN 97 HB1 ASN 97 -15.835 -8.105 -1.125 166 HD21 ASN 97 HD21 ASN 97 -16.124 -6.037 0.314 167 HD22 ASN 97 HD22 ASN 97 -14.703 -5.202 0.717 168 H GLY 98 HN GLY 98 -11.818 -7.733 -2.773 169 HA2 GLY 98 HA2 GLY 98 -10.488 -6.653 -4.416 170 HA3 GLY 98 HA1 GLY 98 -11.948 -5.935 -5.088 171 H TYR 99 HN TYR 99 -11.876 -5.701 -1.741 172 HA TYR 99 HA TYR 99 -10.579 -3.045 -1.793 173 HB2 TYR 99 HB2 TYR 99 -13.263 -3.537 -0.503 174 HB3 TYR 99 HB1 TYR 99 -12.364 -2.019 -0.553 175 HD1 TYR 99 HD1 TYR 99 -13.780 -4.621 -2.811 176 HD2 TYR 99 HD2 TYR 99 -12.761 -0.493 -2.273 177 HE1 TYR 99 HE1 TYR 99 -14.827 -4.095 -4.993 178 HE2 TYR 99 HE2 TYR 99 -13.805 0.046 -4.464 179 HH TYR 99 HH TYR 99 -15.402 -0.839 -6.006 180 H ILE 100 HN ILE 100 -10.023 -2.165 0.265 181 HA ILE 100 HA ILE 100 -9.856 -4.120 2.469 182 HB ILE 100 HB ILE 100 -7.579 -3.872 2.735 183 HG12 ILE 100 HG12 ILE 100 -7.933 -1.104 1.560 184 HG13 ILE 100 HG11 ILE 100 -7.511 -1.513 3.223 185 HG21 ILE 100 HG21 ILE 100 -6.493 -4.055 0.663 186 HG22 ILE 100 HG22 ILE 100 -7.553 -2.865 -0.098 187 HG23 ILE 100 HG23 ILE 100 -8.155 -4.488 0.261 188 HD11 ILE 100 HD11 ILE 100 -5.458 -2.707 2.147 189 HD12 ILE 100 HD12 ILE 100 -5.436 -0.951 2.309 190 HD13 ILE 100 HD13 ILE 100 -5.812 -1.688 0.751 191 H SER 101 HN SER 101 -10.093 -3.121 4.551 192 HA SER 101 HA SER 101 -11.628 -0.769 4.601 193 HB2 SER 101 HB2 SER 101 -10.007 -2.059 6.809 194 HB3 SER 101 HB1 SER 101 -11.201 -0.788 7.052 195 HG SER 101 HG SER 101 -12.041 -2.937 5.536 196 H ALA 102 HN ALA 102 -11.088 1.344 4.583 197 HA ALA 102 HA ALA 102 -8.450 2.188 4.026 198 HB1 ALA 102 HB1 ALA 102 -10.828 3.328 3.642 199 HB2 ALA 102 HB2 ALA 102 -9.351 4.284 3.760 200 HB3 ALA 102 HB3 ALA 102 -10.412 4.124 5.160 201 H ALA 103 HN ALA 103 -10.357 2.160 6.981 202 HA ALA 103 HA ALA 103 -8.676 3.697 8.612 203 HB1 ALA 103 HB1 ALA 103 -10.838 1.724 9.058 204 HB2 ALA 103 HB2 ALA 103 -10.658 3.368 9.671 205 HB3 ALA 103 HB3 ALA 103 -9.769 2.044 10.424 206 H GLU 104 HN GLU 104 -8.605 0.162 8.055 207 HA GLU 104 HA GLU 104 -6.577 -0.309 10.007 208 HB2 GLU 104 HB2 GLU 104 -6.581 -2.523 9.289 209 HB3 GLU 104 HB1 GLU 104 -8.206 -1.990 8.868 210 HG2 GLU 104 HG2 GLU 104 -7.118 -1.342 6.589 211 HG3 GLU 104 HG1 GLU 104 -5.850 -2.455 7.071 212 H LEU 105 HN LEU 105 -6.538 0.655 6.660 213 HA LEU 105 HA LEU 105 -3.873 -0.011 6.018 214 HB2 LEU 105 HB2 LEU 105 -5.425 0.674 4.280 215 HB3 LEU 105 HB1 LEU 105 -5.599 2.266 5.013 216 HG LEU 105 HG LEU 105 -2.795 1.554 4.509 217 HD11 LEU 105 HD11 LEU 105 -4.803 1.633 2.246 218 HD12 LEU 105 HD12 LEU 105 -3.556 0.424 2.555 219 HD13 LEU 105 HD13 LEU 105 -3.104 2.038 2.004 220 HD21 LEU 105 HD21 LEU 105 -4.558 3.863 3.626 221 HD22 LEU 105 HD22 LEU 105 -2.795 3.827 3.575 222 HD23 LEU 105 HD23 LEU 105 -3.634 3.808 5.127 223 H ARG 106 HN ARG 106 -5.266 2.985 7.352 224 HA ARG 106 HA ARG 106 -2.915 4.478 7.533 225 HB2 ARG 106 HB2 ARG 106 -5.130 5.437 7.958 226 HB3 ARG 106 HB1 ARG 106 -5.283 4.470 9.426 227 HG2 ARG 106 HG2 ARG 106 -2.793 6.031 9.288 228 HG3 ARG 106 HG1 ARG 106 -4.251 7.021 9.329 229 HD2 ARG 106 HD2 ARG 106 -3.694 4.768 11.278 230 HD3 ARG 106 HD1 ARG 106 -3.320 6.456 11.601 231 HE ARG 106 HE ARG 106 -5.987 6.422 10.875 232 HH11 ARG 106 HH21 ARG 106 -3.966 4.936 13.256 233 HH12 ARG 106 HH22 ARG 106 -5.216 4.825 14.450 234 HH21 ARG 106 HH11 ARG 106 -7.634 6.283 12.435 235 HH22 ARG 106 HH12 ARG 106 -7.292 5.588 13.985 236 H HIS 107 HN HIS 107 -4.389 2.316 10.004 237 HA HIS 107 HA HIS 107 -2.365 2.619 11.941 238 HB2 HIS 107 HB2 HIS 107 -4.514 1.631 12.497 239 HB3 HIS 107 HB1 HIS 107 -4.224 0.296 11.381 240 HD1 HIS 107 HD1 HIS 107 -2.602 1.829 14.480 241 HD2 HIS 107 HD2 HIS 107 -2.978 -1.863 12.576 242 HE1 HIS 107 HE1 HIS 107 -1.501 0.126 15.997 243 HE2 HIS 107 HE2 HIS 107 -1.722 -2.130 14.851 244 H VAL 108 HN VAL 108 -2.817 0.237 9.386 245 HA VAL 108 HA VAL 108 -0.575 -1.374 9.902 246 HB VAL 108 HB VAL 108 -2.125 -0.793 7.373 247 HG11 VAL 108 HG11 VAL 108 0.030 -1.597 6.653 248 HG12 VAL 108 HG12 VAL 108 -1.091 -2.951 6.573 249 HG13 VAL 108 HG13 VAL 108 0.043 -2.833 7.910 250 HG21 VAL 108 HG21 VAL 108 -3.519 -2.470 8.033 251 HG22 VAL 108 HG22 VAL 108 -2.889 -2.111 9.641 252 HG23 VAL 108 HG23 VAL 108 -2.200 -3.434 8.699 253 H MET 109 HN MET 109 -0.986 1.527 7.958 254 HA MET 109 HA MET 109 1.649 1.471 6.802 255 HB2 MET 109 HB2 MET 109 -0.663 3.332 6.824 256 HB3 MET 109 HB1 MET 109 0.925 4.035 6.501 257 HG2 MET 109 HG2 MET 109 -0.395 3.177 4.474 258 HG3 MET 109 HG1 MET 109 1.286 2.650 4.619 259 HE1 MET 109 HE1 MET 109 1.259 -0.094 3.486 260 HE2 MET 109 HE2 MET 109 0.444 1.321 2.826 261 HE3 MET 109 HE3 MET 109 -0.417 -0.213 2.934 262 H THR 110 HN THR 110 0.282 2.811 9.736 263 HA THR 110 HA THR 110 2.808 4.236 10.240 264 HB THR 110 HB THR 110 1.569 5.468 11.932 265 HG1 THR 110 HG1 THR 110 0.076 3.378 12.003 266 HG21 THR 110 HG21 THR 110 -0.462 5.633 9.862 267 HG22 THR 110 HG22 THR 110 1.165 5.541 9.184 268 HG23 THR 110 HG23 THR 110 0.761 6.816 10.333 269 H ASN 111 HN ASN 111 1.153 1.368 11.124 270 HA ASN 111 HA ASN 111 2.670 1.172 13.651 271 HB2 ASN 111 HB2 ASN 111 0.130 0.840 13.567 272 HB3 ASN 111 HB1 ASN 111 0.482 -0.697 12.779 273 HD21 ASN 111 HD21 ASN 111 -0.131 -2.064 14.554 274 HD22 ASN 111 HD22 ASN 111 0.707 -2.070 16.030 275 H LEU 112 HN LEU 112 1.831 -0.803 10.788 276 HA LEU 112 HA LEU 112 3.938 -2.717 11.472 277 HB2 LEU 112 HB2 LEU 112 1.943 -2.701 9.208 278 HB3 LEU 112 HB1 LEU 112 3.038 -4.024 9.588 279 HG LEU 112 HG LEU 112 0.945 -2.914 11.478 280 HD11 LEU 112 HD11 LEU 112 -0.486 -4.112 10.191 281 HD12 LEU 112 HD12 LEU 112 0.296 -5.541 10.869 282 HD13 LEU 112 HD13 LEU 112 0.831 -4.893 9.317 283 HD21 LEU 112 HD21 LEU 112 2.323 -3.957 12.975 284 HD22 LEU 112 HD22 LEU 112 3.146 -4.887 11.723 285 HD23 LEU 112 HD23 LEU 112 1.590 -5.428 12.342 286 H GLY 113 HN GLY 113 5.319 -3.551 9.672 287 HA2 GLY 113 HA2 GLY 113 6.955 -3.236 8.107 288 HA3 GLY 113 HA1 GLY 113 5.853 -2.101 7.339 289 H GLU 114 HN GLU 114 6.512 -0.116 7.185 290 HA GLU 114 HA GLU 114 8.596 0.882 9.040 291 HB2 GLU 114 HB2 GLU 114 8.134 1.488 6.110 292 HB3 GLU 114 HB1 GLU 114 9.221 2.422 7.139 293 HG2 GLU 114 HG2 GLU 114 10.571 0.459 7.592 294 HG3 GLU 114 HG1 GLU 114 9.429 -0.574 6.735 295 H LYS 115 HN LYS 115 7.237 1.854 10.514 296 HA LYS 115 HA LYS 115 4.882 3.090 10.309 297 HB2 LYS 115 HB2 LYS 115 7.220 4.337 11.769 298 HB3 LYS 115 HB1 LYS 115 5.511 4.569 12.130 299 HG2 LYS 115 HG2 LYS 115 5.280 2.195 12.700 300 HG3 LYS 115 HG1 LYS 115 6.964 1.908 12.273 301 HD2 LYS 115 HD2 LYS 115 7.505 2.382 14.406 302 HD3 LYS 115 HD1 LYS 115 7.062 4.054 14.072 303 HE2 LYS 115 HE2 LYS 115 5.085 1.940 14.982 304 HE3 LYS 115 HE1 LYS 115 5.890 3.071 16.067 305 HZ1 LYS 115 HZ1 LYS 115 3.770 3.546 14.143 306 HZ2 LYS 115 HZ2 LYS 115 4.970 4.745 14.228 307 HZ3 LYS 115 HZ3 LYS 115 4.092 4.316 15.619 308 H LEU 116 HN LEU 116 4.050 4.467 8.887 309 HA LEU 116 HA LEU 116 5.742 6.412 7.510 310 HB2 LEU 116 HB2 LEU 116 2.949 5.388 7.174 311 HB3 LEU 116 HB1 LEU 116 3.264 7.038 6.658 312 HG LEU 116 HG LEU 116 3.521 5.406 4.802 313 HD11 LEU 116 HD11 LEU 116 5.285 7.458 5.531 314 HD12 LEU 116 HD12 LEU 116 5.084 6.759 3.930 315 HD13 LEU 116 HD13 LEU 116 6.319 6.130 5.019 316 HD21 LEU 116 HD21 LEU 116 6.056 4.407 6.015 317 HD22 LEU 116 HD22 LEU 116 4.969 3.620 4.876 318 HD23 LEU 116 HD23 LEU 116 4.542 3.699 6.583 319 H THR 117 HN THR 117 5.188 8.767 7.596 320 HA THR 117 HA THR 117 4.305 9.493 10.280 321 HB THR 117 HB THR 117 5.109 11.729 9.703 322 HG1 THR 117 HG1 THR 117 4.908 12.166 7.661 323 HG21 THR 117 HG21 THR 117 7.193 9.868 8.603 324 HG22 THR 117 HG22 THR 117 6.669 9.701 10.279 325 HG23 THR 117 HG23 THR 117 7.384 11.215 9.726 326 H ASP 118 HN ASP 118 2.793 11.404 10.465 327 HA ASP 118 HA ASP 118 0.333 10.828 9.255 328 HB2 ASP 118 HB2 ASP 118 -0.333 13.115 10.078 329 HB3 ASP 118 HB1 ASP 118 0.373 12.070 11.308 330 H GLU 119 HN GLU 119 2.838 13.173 8.404 331 HA GLU 119 HA GLU 119 1.414 14.492 6.347 332 HB2 GLU 119 HB2 GLU 119 4.386 14.065 6.750 333 HB3 GLU 119 HB1 GLU 119 3.712 15.087 5.485 334 HG2 GLU 119 HG2 GLU 119 4.130 16.616 7.214 335 HG3 GLU 119 HG1 GLU 119 2.420 16.258 7.423 336 H GLU 120 HN GLU 120 3.509 11.631 6.324 337 HA GLU 120 HA GLU 120 3.397 11.252 3.497 338 HB2 GLU 120 HB2 GLU 120 4.138 9.444 5.792 339 HB3 GLU 120 HB1 GLU 120 4.206 8.922 4.106 340 HG2 GLU 120 HG2 GLU 120 5.740 10.769 3.579 341 HG3 GLU 120 HG1 GLU 120 5.645 11.343 5.242 342 H VAL 121 HN VAL 121 1.614 9.890 6.231 343 HA VAL 121 HA VAL 121 0.037 8.060 4.721 344 HB VAL 121 HB VAL 121 -0.480 9.452 7.381 345 HG11 VAL 121 HG11 VAL 121 -2.058 7.354 5.886 346 HG12 VAL 121 HG12 VAL 121 -2.640 8.881 6.555 347 HG13 VAL 121 HG13 VAL 121 -2.188 7.562 7.631 348 HG21 VAL 121 HG21 VAL 121 1.041 7.904 8.066 349 HG22 VAL 121 HG22 VAL 121 0.962 7.032 6.535 350 HG23 VAL 121 HG23 VAL 121 -0.237 6.724 7.784 351 H ASP 122 HN ASP 122 -0.519 11.461 5.704 352 HA ASP 122 HA ASP 122 -3.133 11.704 4.798 353 HB2 ASP 122 HB2 ASP 122 -0.868 13.707 4.854 354 HB3 ASP 122 HB1 ASP 122 -2.517 14.142 4.410 355 H GLU 123 HN GLU 123 -0.086 11.914 3.012 356 HA GLU 123 HA GLU 123 -1.177 12.711 0.520 357 HB2 GLU 123 HB2 GLU 123 1.296 11.107 1.207 358 HB3 GLU 123 HB1 GLU 123 0.909 11.640 -0.423 359 HG2 GLU 123 HG2 GLU 123 1.298 13.453 1.970 360 HG3 GLU 123 HG1 GLU 123 2.482 13.175 0.696 361 H MET 124 HN MET 124 -0.694 9.599 2.095 362 HA MET 124 HA MET 124 -1.402 7.971 -0.140 363 HB2 MET 124 HB2 MET 124 -1.371 7.400 2.833 364 HB3 MET 124 HB1 MET 124 -1.579 6.188 1.572 365 HG2 MET 124 HG2 MET 124 0.599 6.714 0.637 366 HG3 MET 124 HG1 MET 124 0.792 8.047 1.766 367 HE1 MET 124 HE1 MET 124 -0.603 4.304 2.470 368 HE2 MET 124 HE2 MET 124 0.999 3.580 2.519 369 HE3 MET 124 HE3 MET 124 0.482 4.451 1.082 370 H ILE 125 HN ILE 125 -3.153 9.296 2.626 371 HA ILE 125 HA ILE 125 -5.567 7.920 2.345 372 HB ILE 125 HB ILE 125 -4.577 10.249 3.743 373 HG12 ILE 125 HG12 ILE 125 -6.060 9.373 5.513 374 HG13 ILE 125 HG11 ILE 125 -6.754 8.243 4.357 375 HG21 ILE 125 HG21 ILE 125 -6.236 11.536 2.580 376 HG22 ILE 125 HG22 ILE 125 -6.848 11.214 4.198 377 HG23 ILE 125 HG23 ILE 125 -7.457 10.288 2.834 378 HD11 ILE 125 HD11 ILE 125 -3.792 8.245 4.618 379 HD12 ILE 125 HD12 ILE 125 -4.888 6.896 4.340 380 HD13 ILE 125 HD13 ILE 125 -4.703 7.563 5.962 381 H ARG 126 HN ARG 126 -4.408 10.865 0.775 382 HA ARG 126 HA ARG 126 -6.849 11.491 -0.545 383 HB2 ARG 126 HB2 ARG 126 -3.982 12.237 -1.176 384 HB3 ARG 126 HB1 ARG 126 -5.384 12.916 -2.000 385 HG2 ARG 126 HG2 ARG 126 -5.225 13.012 1.003 386 HG3 ARG 126 HG1 ARG 126 -4.350 14.199 0.041 387 HD2 ARG 126 HD2 ARG 126 -6.472 14.798 -1.109 388 HD3 ARG 126 HD1 ARG 126 -7.335 13.662 -0.081 389 HE ARG 126 HE ARG 126 -5.909 15.412 1.584 390 HH11 ARG 126 HH21 ARG 126 -8.486 15.422 -0.725 391 HH12 ARG 126 HH22 ARG 126 -9.324 16.747 0.010 392 HH21 ARG 126 HH11 ARG 126 -7.003 17.150 2.553 393 HH22 ARG 126 HH12 ARG 126 -8.484 17.726 1.866 394 H GLU 127 HN GLU 127 -4.242 9.303 -1.215 395 HA GLU 127 HA GLU 127 -5.191 8.842 -3.957 396 HB2 GLU 127 HB2 GLU 127 -2.807 7.699 -2.482 397 HB3 GLU 127 HB1 GLU 127 -3.190 7.427 -4.182 398 HG2 GLU 127 HG2 GLU 127 -2.725 10.160 -2.957 399 HG3 GLU 127 HG1 GLU 127 -1.500 9.243 -3.832 400 H ALA 128 HN ALA 128 -5.767 7.695 -0.864 401 HA ALA 128 HA ALA 128 -6.127 4.903 -1.560 402 HB1 ALA 128 HB1 ALA 128 -5.628 6.172 0.788 403 HB2 ALA 128 HB2 ALA 128 -6.305 4.553 0.680 404 HB3 ALA 128 HB3 ALA 128 -7.366 5.937 0.925 405 H ASP 129 HN ASP 129 -8.478 7.122 -0.060 406 HA ASP 129 HA ASP 129 -10.458 7.389 -1.889 407 HB2 ASP 129 HB2 ASP 129 -10.649 5.049 -2.373 408 HB3 ASP 129 HB1 ASP 129 -10.640 4.637 -0.657 409 H ILE 130 HN ILE 130 -11.526 5.440 0.723 410 HA ILE 130 HA ILE 130 -12.683 5.843 2.624 411 HB ILE 130 HB ILE 130 -11.444 8.557 2.921 412 HG12 ILE 130 HG12 ILE 130 -9.784 6.583 4.157 413 HG13 ILE 130 HG11 ILE 130 -9.923 6.142 2.465 414 HG21 ILE 130 HG21 ILE 130 -13.123 7.201 4.486 415 HG22 ILE 130 HG22 ILE 130 -11.835 8.199 5.164 416 HG23 ILE 130 HG23 ILE 130 -11.621 6.453 5.030 417 HD11 ILE 130 HD11 ILE 130 -8.065 7.617 2.578 418 HD12 ILE 130 HD12 ILE 130 -8.924 8.731 3.640 419 HD13 ILE 130 HD13 ILE 130 -9.378 8.602 1.943 420 H ASP 131 HN ASP 131 -14.503 5.958 1.139 421 HA ASP 131 HA ASP 131 -15.613 8.623 0.655 422 HB2 ASP 131 HB2 ASP 131 -17.362 7.425 -0.580 423 HB3 ASP 131 HB1 ASP 131 -15.767 6.914 -1.127 424 H GLY 132 HN GLY 132 -15.333 8.267 3.257 425 HA2 GLY 132 HA2 GLY 132 -16.611 8.673 5.171 426 HA3 GLY 132 HA1 GLY 132 -18.061 8.295 4.243 427 H ASP 133 HN ASP 133 -17.592 5.775 3.332 428 HA ASP 133 HA ASP 133 -18.247 4.164 5.523 429 HB2 ASP 133 HB2 ASP 133 -17.251 3.472 2.760 430 HB3 ASP 133 HB1 ASP 133 -17.754 2.254 3.928 431 H GLY 134 HN GLY 134 -15.120 4.701 3.922 432 HA2 GLY 134 HA2 GLY 134 -13.066 4.596 5.128 433 HA3 GLY 134 HA1 GLY 134 -13.832 3.521 6.288 434 H GLN 135 HN GLN 135 -13.804 3.270 2.730 435 HA GLN 135 HA GLN 135 -12.242 0.776 3.004 436 HB2 GLN 135 HB2 GLN 135 -13.574 -0.111 1.070 437 HB3 GLN 135 HB1 GLN 135 -14.492 0.089 2.567 438 HG2 GLN 135 HG2 GLN 135 -15.293 2.300 1.740 439 HG3 GLN 135 HG1 GLN 135 -14.435 2.018 0.226 440 HE21 GLN 135 HE21 GLN 135 -17.472 1.783 1.564 441 HE22 GLN 135 HE22 GLN 135 -18.108 0.547 0.590 442 H VAL 136 HN VAL 136 -10.763 0.314 1.448 443 HA VAL 136 HA VAL 136 -10.299 2.358 -0.620 444 HB VAL 136 HB VAL 136 -8.351 1.141 1.320 445 HG11 VAL 136 HG11 VAL 136 -6.650 2.417 -0.171 446 HG12 VAL 136 HG12 VAL 136 -7.881 2.293 -1.426 447 HG13 VAL 136 HG13 VAL 136 -7.195 0.830 -0.712 448 HG21 VAL 136 HG21 VAL 136 -8.555 3.995 0.396 449 HG22 VAL 136 HG22 VAL 136 -7.916 3.369 1.917 450 HG23 VAL 136 HG23 VAL 136 -9.655 3.378 1.625 451 H ASN 137 HN ASN 137 -9.883 1.643 -2.606 452 HA ASN 137 HA ASN 137 -9.850 -1.250 -3.027 453 HB2 ASN 137 HB2 ASN 137 -9.976 -0.500 -5.485 454 HB3 ASN 137 HB1 ASN 137 -11.375 -0.165 -4.475 455 HD21 ASN 137 HD21 ASN 137 -12.171 1.878 -4.961 456 HD22 ASN 137 HD22 ASN 137 -11.215 3.245 -5.275 457 H TYR 138 HN TYR 138 -7.870 -2.189 -3.007 458 HA TYR 138 HA TYR 138 -5.448 -0.772 -3.184 459 HB2 TYR 138 HB2 TYR 138 -4.386 -3.011 -3.410 460 HB3 TYR 138 HB1 TYR 138 -5.506 -2.892 -2.056 461 HD1 TYR 138 HD1 TYR 138 -5.044 -4.214 -5.491 462 HD2 TYR 138 HD2 TYR 138 -7.538 -4.173 -1.998 463 HE1 TYR 138 HE1 TYR 138 -6.318 -6.152 -6.374 464 HE2 TYR 138 HE2 TYR 138 -8.812 -6.101 -2.873 465 HH TYR 138 HH TYR 138 -7.836 -8.120 -5.033 466 H GLU 139 HN GLU 139 -7.550 -1.551 -5.697 467 HA GLU 139 HA GLU 139 -5.776 -2.271 -7.762 468 HB2 GLU 139 HB2 GLU 139 -8.226 -2.379 -7.994 469 HB3 GLU 139 HB1 GLU 139 -8.308 -0.618 -7.961 470 HG2 GLU 139 HG2 GLU 139 -6.970 -0.483 -10.003 471 HG3 GLU 139 HG1 GLU 139 -6.769 -2.234 -10.015 472 H GLU 140 HN GLU 140 -6.933 1.004 -6.832 473 HA GLU 140 HA GLU 140 -5.437 2.411 -8.729 474 HB2 GLU 140 HB2 GLU 140 -6.454 3.214 -6.001 475 HB3 GLU 140 HB1 GLU 140 -5.684 4.346 -7.114 476 HG2 GLU 140 HG2 GLU 140 -7.375 3.911 -8.804 477 HG3 GLU 140 HG1 GLU 140 -8.099 2.651 -7.808 478 H PHE 141 HN PHE 141 -4.558 1.353 -5.479 479 HA PHE 141 HA PHE 141 -2.082 2.746 -5.295 480 HB2 PHE 141 HB2 PHE 141 -3.358 0.466 -3.901 481 HB3 PHE 141 HB1 PHE 141 -1.596 0.477 -3.870 482 HD1 PHE 141 HD2 PHE 141 -0.455 2.732 -3.259 483 HD2 PHE 141 HD1 PHE 141 -4.561 1.819 -2.358 484 HE1 PHE 141 HE2 PHE 141 -0.457 4.470 -1.494 485 HE2 PHE 141 HE1 PHE 141 -4.547 3.545 -0.584 486 HZ PHE 141 HZ PHE 141 -2.503 4.877 -0.156 487 H VAL 142 HN VAL 142 -2.917 -0.471 -6.564 488 HA VAL 142 HA VAL 142 -0.262 -1.206 -7.236 489 HB VAL 142 HB VAL 142 -2.949 -2.162 -8.224 490 HG11 VAL 142 HG11 VAL 142 -1.364 -4.140 -8.989 491 HG12 VAL 142 HG12 VAL 142 -0.150 -2.863 -9.069 492 HG13 VAL 142 HG13 VAL 142 -1.612 -2.752 -10.049 493 HG21 VAL 142 HG21 VAL 142 -1.073 -3.936 -6.811 494 HG22 VAL 142 HG22 VAL 142 -2.787 -3.647 -6.507 495 HG23 VAL 142 HG23 VAL 142 -1.575 -2.539 -5.856 496 H GLN 143 HN GLN 143 -2.872 0.300 -9.183 497 HA GLN 143 HA GLN 143 -1.359 0.412 -11.578 498 HB2 GLN 143 HB2 GLN 143 -3.663 2.094 -10.571 499 HB3 GLN 143 HB1 GLN 143 -2.958 2.285 -12.177 500 HG2 GLN 143 HG2 GLN 143 -3.429 -0.101 -12.650 501 HG3 GLN 143 HG1 GLN 143 -4.180 -0.254 -11.061 502 HE21 GLN 143 HE21 GLN 143 -6.364 -0.541 -11.688 503 HE22 GLN 143 HE22 GLN 143 -7.240 0.607 -12.579 504 H MET 144 HN MET 144 -1.753 2.583 -8.844 505 HA MET 144 HA MET 144 -0.223 4.759 -9.798 506 HB2 MET 144 HB2 MET 144 -1.501 5.258 -7.917 507 HB3 MET 144 HB1 MET 144 -1.110 3.739 -7.127 508 HG2 MET 144 HG2 MET 144 0.863 4.513 -6.275 509 HG3 MET 144 HG1 MET 144 1.121 5.660 -7.595 510 HE1 MET 144 HE1 MET 144 -0.927 6.246 -3.614 511 HE2 MET 144 HE2 MET 144 0.410 5.198 -4.081 512 HE3 MET 144 HE3 MET 144 -1.232 4.794 -4.574 513 H MET 145 HN MET 145 0.658 1.916 -7.835 514 HA MET 145 HA MET 145 3.426 2.587 -7.732 515 HB2 MET 145 HB2 MET 145 1.710 0.323 -6.877 516 HB3 MET 145 HB1 MET 145 3.406 -0.061 -7.192 517 HG2 MET 145 HG2 MET 145 4.109 1.766 -5.687 518 HG3 MET 145 HG1 MET 145 2.419 2.157 -5.373 519 HE1 MET 145 HE1 MET 145 0.823 0.943 -4.180 520 HE2 MET 145 HE2 MET 145 1.853 1.637 -2.929 521 HE3 MET 145 HE3 MET 145 1.259 -0.012 -2.760 522 H THR 146 HN THR 146 1.461 1.085 -10.131 523 HA THR 146 HA THR 146 3.879 0.070 -11.505 524 HB THR 146 HB THR 146 2.353 -1.434 -12.732 525 HG1 THR 146 HG1 THR 146 0.326 -0.976 -12.656 526 HG21 THR 146 HG21 THR 146 3.343 -2.477 -10.878 527 HG22 THR 146 HG22 THR 146 1.622 -2.756 -10.613 528 HG23 THR 146 HG23 THR 146 2.456 -1.480 -9.725 529 H ALA 147 HN ALA 147 2.436 2.819 -11.497 530 HA ALA 147 HA ALA 147 2.128 3.021 -14.439 531 HB1 ALA 147 HB1 ALA 147 0.784 5.104 -13.895 532 HB2 ALA 147 HB2 ALA 147 0.784 4.564 -12.218 533 HB3 ALA 147 HB3 ALA 147 0.024 3.574 -13.466 534 H LYS 148 HN LYS 148 4.628 3.151 -14.084 535 HA LYS 148 HA LYS 148 5.368 5.884 -14.469 536 HB2 LYS 148 HB2 LYS 148 5.210 5.405 -11.861 537 HB3 LYS 148 HB1 LYS 148 6.796 4.684 -12.137 538 HG2 LYS 148 HG2 LYS 148 7.420 6.876 -11.727 539 HG3 LYS 148 HG1 LYS 148 7.212 6.939 -13.478 540 HD2 LYS 148 HD2 LYS 148 4.859 7.717 -13.128 541 HD3 LYS 148 HD1 LYS 148 5.170 7.761 -11.392 542 HE2 LYS 148 HE2 LYS 148 5.516 9.992 -12.216 543 HE3 LYS 148 HE1 LYS 148 7.111 9.316 -11.883 544 HZ1 LYS 148 HZ1 LYS 148 5.777 9.531 -14.524 545 HZ2 LYS 148 HZ2 LYS 148 7.221 8.678 -14.259 546 HZ3 LYS 148 HZ3 LYS 148 7.166 10.357 -14.008 547 H PHE 30 HT1 PHE 30 -9.534 -5.516 13.482 548 HA PHE 30 HA PHE 30 -9.375 -3.870 11.024 549 HB2 PHE 30 HB2 PHE 30 -7.093 -5.308 12.412 550 HB3 PHE 30 HB1 PHE 30 -6.997 -4.309 10.964 551 HD1 PHE 30 HD2 PHE 30 -7.877 -1.845 11.208 552 HD2 PHE 30 HD1 PHE 30 -6.692 -4.330 14.505 553 HE1 PHE 30 HE2 PHE 30 -7.553 0.174 12.613 554 HE2 PHE 30 HE1 PHE 30 -6.369 -2.313 15.910 555 HZ PHE 30 HZ PHE 30 -6.799 -0.061 14.964 556 H ASP 31 HN ASP 31 -9.541 -6.893 12.747 557 HA ASP 31 HA ASP 31 -9.829 -9.067 12.064 558 HB2 ASP 31 HB2 ASP 31 -10.907 -7.619 9.635 559 HB3 ASP 31 HB1 ASP 31 -11.007 -9.364 9.855 560 H ILE 32 HN ILE 32 -7.295 -7.881 11.741 561 HA ILE 32 HA ILE 32 -6.235 -9.406 9.444 562 HB ILE 32 HB ILE 32 -5.445 -6.679 10.465 563 HG12 ILE 32 HG12 ILE 32 -6.005 -7.616 7.648 564 HG13 ILE 32 HG11 ILE 32 -7.283 -7.047 8.716 565 HG21 ILE 32 HG21 ILE 32 -3.918 -8.615 8.721 566 HG22 ILE 32 HG22 ILE 32 -3.358 -7.774 10.169 567 HG23 ILE 32 HG23 ILE 32 -3.633 -6.875 8.678 568 HD11 ILE 32 HD11 ILE 32 -6.101 -5.345 7.116 569 HD12 ILE 32 HD12 ILE 32 -4.818 -5.376 8.325 570 HD13 ILE 32 HD13 ILE 32 -6.443 -4.866 8.775 571 H ASP 33 HN ASP 33 -4.600 -10.798 9.893 572 HA ASP 33 HA ASP 33 -3.959 -11.297 12.659 573 HB2 ASP 33 HB2 ASP 33 -4.217 -13.137 11.041 574 HB3 ASP 33 HB1 ASP 33 -2.828 -12.534 10.138 575 H MET 34 HN MET 34 -2.719 -9.806 13.595 576 HA MET 34 HA MET 34 -0.553 -8.460 12.275 577 HB2 MET 34 HB2 MET 34 -1.277 -8.609 15.214 578 HB3 MET 34 HB1 MET 34 -0.192 -7.435 14.470 579 HG2 MET 34 HG2 MET 34 -3.122 -7.786 13.761 580 HG3 MET 34 HG1 MET 34 -2.484 -6.514 14.799 581 HE1 MET 34 HE1 MET 34 -1.690 -4.340 14.050 582 HE2 MET 34 HE2 MET 34 -0.708 -4.086 12.612 583 HE3 MET 34 HE3 MET 34 -0.164 -5.208 13.853 584 H ASP 35 HN ASP 35 -0.897 -11.251 14.352 585 HA ASP 35 HA ASP 35 1.758 -11.531 15.228 586 HB2 ASP 35 HB2 ASP 35 -0.157 -12.761 16.184 587 HB3 ASP 35 HB1 ASP 35 -0.272 -13.708 14.702 588 H ALA 36 HN ALA 36 0.157 -12.801 12.312 589 HA ALA 36 HA ALA 36 2.233 -14.454 11.453 590 HB1 ALA 36 HB1 ALA 36 -0.052 -13.090 10.113 591 HB2 ALA 36 HB2 ALA 36 0.314 -14.811 10.238 592 HB3 ALA 36 HB3 ALA 36 1.203 -13.801 9.098 593 HA PRO 37 HA PRO 37 5.275 -11.379 10.322 594 HB2 PRO 37 HB2 PRO 37 6.975 -12.893 8.857 595 HB3 PRO 37 HB1 PRO 37 6.873 -12.993 10.628 596 HG2 PRO 37 HG2 PRO 37 5.647 -14.740 8.565 597 HG3 PRO 37 HG1 PRO 37 6.459 -15.180 10.073 598 HD2 PRO 37 HD2 PRO 37 3.750 -15.128 9.837 599 HD3 PRO 37 HD1 PRO 37 4.581 -14.755 11.366 600 H GLU 38 HN GLU 38 3.541 -13.267 7.989 601 HA GLU 38 HA GLU 38 4.466 -12.086 5.602 602 HB2 GLU 38 HB2 GLU 38 1.811 -13.349 6.313 603 HB3 GLU 38 HB1 GLU 38 2.249 -12.850 4.679 604 HG2 GLU 38 HG2 GLU 38 3.920 -14.747 6.347 605 HG3 GLU 38 HG1 GLU 38 2.703 -15.285 5.189 606 H THR 39 HN THR 39 1.874 -11.175 7.850 607 HA THR 39 HA THR 39 0.733 -9.117 6.303 608 HB THR 39 HB THR 39 0.908 -9.389 9.311 609 HG1 THR 39 HG1 THR 39 -0.726 -10.695 9.097 610 HG21 THR 39 HG21 THR 39 -1.426 -8.048 8.635 611 HG22 THR 39 HG22 THR 39 -0.220 -7.345 7.558 612 HG23 THR 39 HG23 THR 39 0.031 -7.310 9.302 613 H GLU 40 HN GLU 40 3.253 -8.973 8.823 614 HA GLU 40 HA GLU 40 3.699 -6.176 8.597 615 HB2 GLU 40 HB2 GLU 40 4.435 -7.526 10.545 616 HB3 GLU 40 HB1 GLU 40 5.615 -8.336 9.515 617 HG2 GLU 40 HG2 GLU 40 6.723 -6.197 9.058 618 HG3 GLU 40 HG1 GLU 40 5.515 -5.349 10.020 619 H ARG 41 HN ARG 41 5.126 -9.013 7.099 620 HA ARG 41 HA ARG 41 7.218 -7.795 5.685 621 HB2 ARG 41 HB2 ARG 41 6.927 -10.241 6.023 622 HB3 ARG 41 HB1 ARG 41 5.544 -10.198 4.942 623 HG2 ARG 41 HG2 ARG 41 7.383 -10.975 3.643 624 HG3 ARG 41 HG1 ARG 41 7.103 -9.311 3.144 625 HD2 ARG 41 HD2 ARG 41 8.968 -8.518 4.439 626 HD3 ARG 41 HD1 ARG 41 9.133 -10.066 5.261 627 HE ARG 41 HE ARG 41 9.427 -10.471 2.485 628 HH11 ARG 41 HH21 ARG 41 10.977 -8.963 5.187 629 HH12 ARG 41 HH22 ARG 41 12.574 -9.119 4.535 630 HH21 ARG 41 HH11 ARG 41 11.519 -10.679 1.624 631 HH22 ARG 41 HH12 ARG 41 12.881 -10.090 2.518 632 H ALA 42 HN ALA 42 3.857 -8.482 4.770 633 HA ALA 42 HA ALA 42 3.982 -7.531 2.121 634 HB1 ALA 42 HB1 ALA 42 1.433 -7.127 2.586 635 HB2 ALA 42 HB2 ALA 42 1.773 -7.957 4.105 636 HB3 ALA 42 HB3 ALA 42 2.066 -8.772 2.569 637 H ALA 43 HN ALA 43 3.309 -5.921 5.185 638 HA ALA 43 HA ALA 43 2.486 -3.430 4.179 639 HB1 ALA 43 HB1 ALA 43 4.013 -3.979 6.735 640 HB2 ALA 43 HB2 ALA 43 2.266 -4.139 6.550 641 HB3 ALA 43 HB3 ALA 43 3.029 -2.558 6.384 642 H VAL 44 HN VAL 44 5.703 -4.740 4.860 643 HA VAL 44 HA VAL 44 7.181 -2.374 4.537 644 HB VAL 44 HB VAL 44 7.914 -5.262 4.043 645 HG11 VAL 44 HG11 VAL 44 9.483 -4.086 2.733 646 HG12 VAL 44 HG12 VAL 44 10.293 -4.253 4.291 647 HG13 VAL 44 HG13 VAL 44 9.531 -2.724 3.853 648 HG21 VAL 44 HG21 VAL 44 9.160 -4.901 6.191 649 HG22 VAL 44 HG22 VAL 44 7.415 -4.731 6.367 650 HG23 VAL 44 HG23 VAL 44 8.436 -3.296 6.295 651 H ALA 45 HN ALA 45 6.286 -4.863 2.130 652 HA ALA 45 HA ALA 45 7.652 -3.707 -0.046 653 HB1 ALA 45 HB1 ALA 45 6.161 -5.049 -1.456 654 HB2 ALA 45 HB2 ALA 45 5.109 -5.347 -0.072 655 HB3 ALA 45 HB3 ALA 45 6.750 -5.994 -0.089 656 H ILE 46 HN ILE 46 4.285 -3.302 1.040 657 HA ILE 46 HA ILE 46 3.539 -1.510 -1.015 658 HB ILE 46 HB ILE 46 2.445 -1.981 1.758 659 HG12 ILE 46 HG12 ILE 46 1.310 -2.678 -0.961 660 HG13 ILE 46 HG11 ILE 46 2.340 -3.779 -0.047 661 HG21 ILE 46 HG21 ILE 46 1.512 -0.160 -0.464 662 HG22 ILE 46 HG22 ILE 46 1.768 0.240 1.231 663 HG23 ILE 46 HG23 ILE 46 0.406 -0.777 0.761 664 HD11 ILE 46 HD11 ILE 46 0.707 -4.263 1.453 665 HD12 ILE 46 HD12 ILE 46 -0.379 -3.681 0.190 666 HD13 ILE 46 HD13 ILE 46 0.117 -2.600 1.494 667 H GLN 47 HN GLN 47 4.662 -0.953 2.311 668 HA GLN 47 HA GLN 47 4.544 1.873 2.194 669 HB2 GLN 47 HB2 GLN 47 6.090 -0.035 3.948 670 HB3 GLN 47 HB1 GLN 47 6.113 1.713 4.176 671 HG2 GLN 47 HG2 GLN 47 3.676 1.739 4.443 672 HG3 GLN 47 HG1 GLN 47 3.605 0.008 4.133 673 HE21 GLN 47 HE21 GLN 47 2.852 -0.639 6.218 674 HE22 GLN 47 HE22 GLN 47 3.766 -0.424 7.631 675 H SER 48 HN SER 48 7.160 -0.433 1.527 676 HA SER 48 HA SER 48 9.219 1.464 1.174 677 HB2 SER 48 HB2 SER 48 9.674 -0.932 1.427 678 HB3 SER 48 HB1 SER 48 8.872 -1.258 -0.107 679 HG SER 48 HG SER 48 10.470 -0.155 -1.163 680 H GLN 49 HN GLN 49 6.963 -0.018 -1.122 681 HA GLN 49 HA GLN 49 7.971 1.243 -3.439 682 HB2 GLN 49 HB2 GLN 49 5.275 0.057 -2.790 683 HB3 GLN 49 HB1 GLN 49 5.691 0.689 -4.382 684 HG2 GLN 49 HG2 GLN 49 7.302 -1.436 -2.950 685 HG3 GLN 49 HG1 GLN 49 6.059 -1.791 -4.145 686 HE21 GLN 49 HE21 GLN 49 9.227 -1.917 -4.059 687 HE22 GLN 49 HE22 GLN 49 9.652 -1.241 -5.557 688 H PHE 50 HN PHE 50 5.512 2.224 -1.088 689 HA PHE 50 HA PHE 50 4.455 4.400 -2.503 690 HB2 PHE 50 HB2 PHE 50 3.377 3.615 -0.473 691 HB3 PHE 50 HB1 PHE 50 4.797 4.037 0.485 692 HD1 PHE 50 HD1 PHE 50 2.530 5.648 -2.039 693 HD2 PHE 50 HD2 PHE 50 4.716 6.075 1.640 694 HE1 PHE 50 HE1 PHE 50 1.703 7.977 -1.817 695 HE2 PHE 50 HE2 PHE 50 3.895 8.408 1.851 696 HZ PHE 50 HZ PHE 50 2.388 9.359 0.128 697 H ARG 51 HN ARG 51 7.201 4.272 -0.238 698 HA ARG 51 HA ARG 51 7.863 7.005 -0.339 699 HB2 ARG 51 HB2 ARG 51 8.776 5.389 1.320 700 HB3 ARG 51 HB1 ARG 51 9.744 4.661 0.038 701 HG2 ARG 51 HG2 ARG 51 10.855 6.844 -0.352 702 HG3 ARG 51 HG1 ARG 51 9.906 7.548 0.958 703 HD2 ARG 51 HD2 ARG 51 11.813 5.211 1.254 704 HD3 ARG 51 HD1 ARG 51 12.175 6.874 1.707 705 HE ARG 51 HE ARG 51 10.460 5.021 3.145 706 HH11 ARG 51 HH21 ARG 51 11.395 8.300 2.550 707 HH12 ARG 51 HH22 ARG 51 10.816 8.887 4.073 708 HH21 ARG 51 HH11 ARG 51 9.700 5.783 5.145 709 HH22 ARG 51 HH12 ARG 51 9.856 7.462 5.543 710 H LYS 52 HN LYS 52 8.855 4.267 -2.360 711 HA LYS 52 HA LYS 52 10.785 5.594 -3.915 712 HB2 LYS 52 HB2 LYS 52 10.490 3.141 -3.907 713 HB3 LYS 52 HB1 LYS 52 8.951 3.335 -4.746 714 HG2 LYS 52 HG2 LYS 52 10.087 4.383 -6.650 715 HG3 LYS 52 HG1 LYS 52 11.633 4.277 -5.806 716 HD2 LYS 52 HD2 LYS 52 11.476 1.828 -5.788 717 HD3 LYS 52 HD1 LYS 52 9.902 1.910 -6.581 718 HE2 LYS 52 HE2 LYS 52 11.652 1.452 -8.239 719 HE3 LYS 52 HE1 LYS 52 10.957 3.049 -8.518 720 HZ1 LYS 52 HZ1 LYS 52 13.039 3.783 -8.431 721 HZ2 LYS 52 HZ2 LYS 52 13.629 2.327 -7.783 722 HZ3 LYS 52 HZ3 LYS 52 12.976 3.514 -6.758 723 H PHE 53 HN PHE 53 7.284 5.330 -4.253 724 HA PHE 53 HA PHE 53 6.998 6.466 -6.800 725 HB2 PHE 53 HB2 PHE 53 5.189 5.349 -5.462 726 HB3 PHE 53 HB1 PHE 53 5.111 6.793 -4.454 727 HD1 PHE 53 HD2 PHE 53 4.351 8.954 -5.402 728 HD2 PHE 53 HD1 PHE 53 4.318 5.336 -7.719 729 HE1 PHE 53 HE2 PHE 53 2.852 10.029 -7.060 730 HE2 PHE 53 HE1 PHE 53 2.812 6.408 -9.378 731 HZ PHE 53 HZ PHE 53 2.086 8.758 -9.047 732 H GLN 54 HN GLN 54 7.166 7.973 -3.586 733 HA GLN 54 HA GLN 54 6.675 10.628 -4.397 734 HB2 GLN 54 HB2 GLN 54 8.202 9.502 -2.047 735 HB3 GLN 54 HB1 GLN 54 7.875 11.222 -2.257 736 HG2 GLN 54 HG2 GLN 54 5.444 10.728 -2.359 737 HG3 GLN 54 HG1 GLN 54 5.796 9.024 -2.079 738 HE21 GLN 54 HE21 GLN 54 5.283 8.564 0.066 739 HE22 GLN 54 HE22 GLN 54 5.684 9.547 1.391 740 H LYS 55 HN LYS 55 9.700 8.778 -4.147 741 HA LYS 55 HA LYS 55 11.460 10.921 -4.615 742 HB2 LYS 55 HB2 LYS 55 11.683 7.951 -5.000 743 HB3 LYS 55 HB1 LYS 55 12.975 9.022 -5.542 744 HG2 LYS 55 HG2 LYS 55 13.107 9.998 -3.262 745 HG3 LYS 55 HG1 LYS 55 11.851 8.881 -2.726 746 HD2 LYS 55 HD2 LYS 55 13.927 7.416 -4.087 747 HD3 LYS 55 HD1 LYS 55 14.641 8.414 -2.821 748 HE2 LYS 55 HE2 LYS 55 13.079 7.490 -1.175 749 HE3 LYS 55 HE1 LYS 55 12.294 6.534 -2.430 750 HZ1 LYS 55 HZ1 LYS 55 14.350 5.697 -0.896 751 HZ2 LYS 55 HZ2 LYS 55 15.147 6.185 -2.315 752 HZ3 LYS 55 HZ3 LYS 55 13.913 5.019 -2.389 753 H LYS 56 HN LYS 56 9.707 8.825 -6.857 754 HA LYS 56 HA LYS 56 11.000 9.656 -9.219 755 HB2 LYS 56 HB2 LYS 56 8.194 8.645 -8.716 756 HB3 LYS 56 HB1 LYS 56 8.831 8.956 -10.330 757 HG2 LYS 56 HG2 LYS 56 10.405 7.229 -8.445 758 HG3 LYS 56 HG1 LYS 56 9.015 6.540 -9.281 759 HD2 LYS 56 HD2 LYS 56 9.996 7.276 -11.454 760 HD3 LYS 56 HD1 LYS 56 11.418 7.860 -10.589 761 HE2 LYS 56 HE2 LYS 56 10.425 5.001 -10.467 762 HE3 LYS 56 HE1 LYS 56 11.700 5.557 -11.551 763 HZ1 LYS 56 HZ1 LYS 56 11.835 4.953 -8.772 764 HZ2 LYS 56 HZ2 LYS 56 12.391 6.528 -9.083 765 HZ3 LYS 56 HZ3 LYS 56 13.094 5.202 -9.880 766 H LYS 57 HN LYS 57 8.266 10.995 -7.425 767 HA LYS 57 HA LYS 57 7.769 13.080 -9.357 768 HB2 LYS 57 HB2 LYS 57 6.786 12.776 -6.508 769 HB3 LYS 57 HB1 LYS 57 6.154 13.906 -7.700 770 HG2 LYS 57 HG2 LYS 57 6.147 10.903 -8.093 771 HG3 LYS 57 HG1 LYS 57 4.792 11.788 -7.404 772 HD2 LYS 57 HD2 LYS 57 4.772 13.205 -9.507 773 HD3 LYS 57 HD1 LYS 57 5.941 12.077 -10.194 774 HE2 LYS 57 HE2 LYS 57 4.379 10.212 -9.839 775 HE3 LYS 57 HE1 LYS 57 3.201 11.327 -9.148 776 HZ1 LYS 57 HZ1 LYS 57 2.498 11.331 -11.287 777 HZ2 LYS 57 HZ2 LYS 57 4.033 10.983 -11.925 778 HZ3 LYS 57 HZ3 LYS 57 3.659 12.561 -11.418 779 H ALA 58 HN ALA 58 9.900 12.612 -6.719 780 HA ALA 58 HA ALA 58 10.180 15.247 -5.769 781 HB1 ALA 58 HB1 ALA 58 12.333 13.128 -5.913 782 HB2 ALA 58 HB2 ALA 58 11.107 13.228 -4.649 783 HB3 ALA 58 HB3 ALA 58 12.291 14.521 -4.835 784 H GLY 59 HN GLY 59 11.763 13.571 -8.470 785 HA2 GLY 59 HA2 GLY 59 13.713 15.502 -9.048 786 HA3 GLY 59 HA1 GLY 59 13.021 14.386 -10.221 787 H SER 60 HN SER 60 13.550 17.531 -9.709 788 HA SER 60 HA SER 60 11.097 18.810 -10.277 789 HB2 SER 60 HB2 SER 60 13.037 20.024 -9.406 790 HB3 SER 60 HB1 SER 60 13.925 19.696 -10.892 791 HG SER 60 HG SER 60 11.521 21.185 -10.604 792 H GLN 61 HN GLN 61 13.714 17.670 -12.388 793 HA GLN 61 HA GLN 61 13.678 17.070 -14.614 794 HB2 GLN 61 HB2 GLN 61 11.176 16.447 -13.874 795 HB3 GLN 61 HB1 GLN 61 10.811 17.772 -14.980 796 HG2 GLN 61 HG2 GLN 61 12.209 16.665 -16.719 797 HG3 GLN 61 HG1 GLN 61 12.465 15.312 -15.618 798 HE21 GLN 61 HE21 GLN 61 10.203 14.450 -14.678 799 HE22 GLN 61 HE22 GLN 61 8.984 14.257 -15.845 800 H SER 62 HN SER 62 13.407 19.978 -13.348 801 HA SER 62 HA SER 62 14.255 21.416 -15.580 802 HB2 SER 62 HB2 SER 62 11.981 22.846 -15.614 803 HB3 SER 62 HB1 SER 62 12.276 21.503 -16.716 804 HG SER 62 HG SER 62 11.316 20.732 -14.271 Start of MODEL 14 1 H1 MET 76 HT1 MET 76 2.334 -16.285 -17.792 2 H2 MET 76 HT2 MET 76 0.916 -17.187 -17.540 3 H3 MET 76 HT3 MET 76 1.575 -16.264 -16.275 4 HA MET 76 HA MET 76 1.248 -14.311 -17.964 5 HB2 MET 76 HB2 MET 76 -1.066 -16.110 -18.675 6 HB3 MET 76 HB1 MET 76 -0.566 -14.610 -19.454 7 HG2 MET 76 HG2 MET 76 0.983 -17.220 -19.475 8 HG3 MET 76 HG1 MET 76 0.080 -16.542 -20.828 9 HE1 MET 76 HE1 MET 76 3.189 -16.232 -22.336 10 HE2 MET 76 HE2 MET 76 2.334 -17.473 -21.422 11 HE3 MET 76 HE3 MET 76 3.876 -16.859 -20.831 12 H LYS 77 HN LYS 77 -1.542 -13.800 -17.891 13 HA LYS 77 HA LYS 77 -3.146 -13.004 -16.462 14 HB2 LYS 77 HB2 LYS 77 -3.532 -15.417 -16.136 15 HB3 LYS 77 HB1 LYS 77 -2.347 -15.428 -14.832 16 HG2 LYS 77 HG2 LYS 77 -3.716 -13.825 -13.555 17 HG3 LYS 77 HG1 LYS 77 -4.892 -13.777 -14.869 18 HD2 LYS 77 HD2 LYS 77 -5.314 -16.190 -14.585 19 HD3 LYS 77 HD1 LYS 77 -4.129 -16.244 -13.278 20 HE2 LYS 77 HE2 LYS 77 -5.475 -14.634 -11.984 21 HE3 LYS 77 HE1 LYS 77 -6.658 -14.569 -13.290 22 HZ1 LYS 77 HZ1 LYS 77 -5.912 -17.144 -12.065 23 HZ2 LYS 77 HZ2 LYS 77 -7.328 -16.733 -12.908 24 HZ3 LYS 77 HZ3 LYS 77 -7.074 -16.150 -11.332 25 H ASP 78 HN ASP 78 -2.079 -11.076 -15.896 26 HA ASP 78 HA ASP 78 -1.246 -9.525 -14.428 27 HB2 ASP 78 HB2 ASP 78 -2.981 -10.680 -12.958 28 HB3 ASP 78 HB1 ASP 78 -1.635 -11.572 -12.251 29 H THR 79 HN THR 79 0.778 -10.422 -15.729 30 HA THR 79 HA THR 79 2.741 -11.799 -14.113 31 HB THR 79 HB THR 79 4.208 -11.517 -16.008 32 HG1 THR 79 HG1 THR 79 3.919 -9.982 -17.448 33 HG21 THR 79 HG21 THR 79 3.053 -12.887 -17.429 34 HG22 THR 79 HG22 THR 79 1.636 -11.836 -17.456 35 HG23 THR 79 HG23 THR 79 1.906 -12.917 -16.089 36 H ASP 80 HN ASP 80 4.892 -10.011 -15.247 37 HA ASP 80 HA ASP 80 6.235 -8.329 -14.460 38 HB2 ASP 80 HB2 ASP 80 3.503 -7.068 -14.223 39 HB3 ASP 80 HB1 ASP 80 4.991 -6.186 -13.891 40 H SER 81 HN SER 81 6.568 -6.779 -12.536 41 HA SER 81 HA SER 81 6.552 -8.360 -10.149 42 HB2 SER 81 HB2 SER 81 7.685 -6.466 -9.126 43 HB3 SER 81 HB1 SER 81 8.372 -6.758 -10.722 44 HG SER 81 HG SER 81 6.598 -4.736 -9.868 45 H GLU 82 HN GLU 82 4.239 -6.441 -11.600 46 HA GLU 82 HA GLU 82 3.042 -5.043 -9.517 47 HB2 GLU 82 HB2 GLU 82 1.802 -6.465 -11.880 48 HB3 GLU 82 HB1 GLU 82 0.888 -5.430 -10.785 49 HG2 GLU 82 HG2 GLU 82 2.176 -3.519 -11.368 50 HG3 GLU 82 HG1 GLU 82 3.361 -4.488 -12.239 51 H GLU 83 HN GLU 83 2.873 -8.440 -10.382 52 HA GLU 83 HA GLU 83 0.825 -9.184 -8.561 53 HB2 GLU 83 HB2 GLU 83 1.527 -11.449 -9.031 54 HB3 GLU 83 HB1 GLU 83 1.600 -10.527 -10.530 55 HG2 GLU 83 HG2 GLU 83 3.676 -11.572 -10.583 56 HG3 GLU 83 HG1 GLU 83 4.091 -10.057 -9.780 57 H GLU 84 HN GLU 84 4.327 -8.791 -8.275 58 HA GLU 84 HA GLU 84 4.690 -10.206 -5.854 59 HB2 GLU 84 HB2 GLU 84 6.546 -9.457 -7.332 60 HB3 GLU 84 HB1 GLU 84 6.230 -7.792 -6.850 61 HG2 GLU 84 HG2 GLU 84 6.738 -9.925 -4.778 62 HG3 GLU 84 HG1 GLU 84 8.079 -9.112 -5.579 63 H ILE 85 HN ILE 85 4.046 -6.786 -6.514 64 HA ILE 85 HA ILE 85 3.935 -5.977 -3.791 65 HB ILE 85 HB ILE 85 2.775 -4.718 -6.289 66 HG12 ILE 85 HG12 ILE 85 5.369 -4.976 -5.813 67 HG13 ILE 85 HG11 ILE 85 4.727 -3.450 -6.412 68 HG21 ILE 85 HG21 ILE 85 2.881 -3.821 -3.404 69 HG22 ILE 85 HG22 ILE 85 1.498 -3.860 -4.493 70 HG23 ILE 85 HG23 ILE 85 2.768 -2.659 -4.730 71 HD11 ILE 85 HD11 ILE 85 6.331 -3.358 -4.384 72 HD12 ILE 85 HD12 ILE 85 4.972 -3.975 -3.447 73 HD13 ILE 85 HD13 ILE 85 4.834 -2.431 -4.283 74 H ARG 86 HN ARG 86 1.627 -7.211 -6.104 75 HA ARG 86 HA ARG 86 -0.785 -6.638 -4.809 76 HB2 ARG 86 HB2 ARG 86 -0.478 -7.535 -7.136 77 HB3 ARG 86 HB1 ARG 86 -0.097 -9.098 -6.425 78 HG2 ARG 86 HG2 ARG 86 -2.331 -9.017 -5.259 79 HG3 ARG 86 HG1 ARG 86 -2.706 -7.595 -6.232 80 HD2 ARG 86 HD2 ARG 86 -3.587 -9.498 -7.414 81 HD3 ARG 86 HD1 ARG 86 -2.145 -8.964 -8.281 82 HE ARG 86 HE ARG 86 -1.482 -10.955 -6.348 83 HH11 ARG 86 HH21 ARG 86 -2.964 -10.445 -9.431 84 HH12 ARG 86 HH22 ARG 86 -2.566 -12.017 -10.037 85 HH21 ARG 86 HH11 ARG 86 -0.957 -13.018 -7.133 86 HH22 ARG 86 HH12 ARG 86 -1.429 -13.475 -8.736 87 H GLU 87 HN GLU 87 1.517 -9.290 -4.412 88 HA GLU 87 HA GLU 87 -0.008 -10.942 -2.728 89 HB2 GLU 87 HB2 GLU 87 2.131 -11.629 -3.766 90 HB3 GLU 87 HB1 GLU 87 2.991 -10.511 -2.707 91 HG2 GLU 87 HG2 GLU 87 2.198 -11.725 -0.732 92 HG3 GLU 87 HG1 GLU 87 1.261 -12.813 -1.755 93 H ALA 88 HN ALA 88 2.114 -8.202 -2.017 94 HA ALA 88 HA ALA 88 1.986 -8.359 0.802 95 HB1 ALA 88 HB1 ALA 88 2.291 -5.706 0.386 96 HB2 ALA 88 HB2 ALA 88 2.756 -6.315 -1.200 97 HB3 ALA 88 HB3 ALA 88 3.610 -6.864 0.240 98 H PHE 89 HN PHE 89 -0.149 -6.837 -1.587 99 HA PHE 89 HA PHE 89 -1.792 -5.563 0.400 100 HB2 PHE 89 HB2 PHE 89 -2.024 -6.023 -2.558 101 HB3 PHE 89 HB1 PHE 89 -3.424 -5.470 -1.635 102 HD1 PHE 89 HD2 PHE 89 -3.263 -3.362 -0.275 103 HD2 PHE 89 HD1 PHE 89 -0.202 -4.552 -3.041 104 HE1 PHE 89 HE2 PHE 89 -2.353 -1.056 -0.258 105 HE2 PHE 89 HE1 PHE 89 0.713 -2.243 -3.022 106 HZ PHE 89 HZ PHE 89 -0.366 -0.497 -1.631 107 H ARG 90 HN ARG 90 -1.965 -8.510 -1.523 108 HA ARG 90 HA ARG 90 -4.443 -9.463 -0.916 109 HB2 ARG 90 HB2 ARG 90 -1.843 -10.927 -1.225 110 HB3 ARG 90 HB1 ARG 90 -3.321 -11.807 -0.833 111 HG2 ARG 90 HG2 ARG 90 -4.424 -10.773 -2.821 112 HG3 ARG 90 HG1 ARG 90 -2.894 -10.001 -3.229 113 HD2 ARG 90 HD2 ARG 90 -1.821 -12.175 -3.485 114 HD3 ARG 90 HD1 ARG 90 -3.283 -12.990 -2.946 115 HE ARG 90 HE ARG 90 -3.877 -11.360 -5.190 116 HH11 ARG 90 HH21 ARG 90 -2.198 -14.240 -4.258 117 HH12 ARG 90 HH22 ARG 90 -2.421 -15.029 -5.783 118 HH21 ARG 90 HH11 ARG 90 -4.175 -12.393 -7.193 119 HH22 ARG 90 HH12 ARG 90 -3.540 -13.985 -7.444 120 H VAL 91 HN VAL 91 -1.784 -9.098 1.285 121 HA VAL 91 HA VAL 91 -2.652 -10.834 3.336 122 HB VAL 91 HB VAL 91 -1.012 -8.293 3.401 123 HG11 VAL 91 HG11 VAL 91 -2.110 -10.000 5.583 124 HG12 VAL 91 HG12 VAL 91 -1.613 -8.309 5.626 125 HG13 VAL 91 HG13 VAL 91 -0.403 -9.586 5.711 126 HG21 VAL 91 HG21 VAL 91 0.848 -9.730 3.433 127 HG22 VAL 91 HG22 VAL 91 -0.242 -10.532 2.301 128 HG23 VAL 91 HG23 VAL 91 -0.110 -11.114 3.961 129 H PHE 92 HN PHE 92 -3.479 -7.470 2.568 130 HA PHE 92 HA PHE 92 -5.173 -7.237 4.917 131 HB2 PHE 92 HB2 PHE 92 -4.990 -5.348 2.566 132 HB3 PHE 92 HB1 PHE 92 -5.597 -4.992 4.179 133 HD1 PHE 92 HD2 PHE 92 -3.778 -5.817 6.098 134 HD2 PHE 92 HD1 PHE 92 -2.878 -4.477 2.127 135 HE1 PHE 92 HE2 PHE 92 -1.489 -5.234 6.823 136 HE2 PHE 92 HE1 PHE 92 -0.584 -3.890 2.850 137 HZ PHE 92 HZ PHE 92 0.116 -4.271 5.192 138 H ASP 93 HN ASP 93 -5.476 -8.135 1.583 139 HA ASP 93 HA ASP 93 -8.404 -7.914 1.637 140 HB2 ASP 93 HB2 ASP 93 -7.096 -7.296 -0.423 141 HB3 ASP 93 HB1 ASP 93 -6.652 -8.990 -0.572 142 H LYS 94 HN LYS 94 -8.658 -9.550 3.377 143 HA LYS 94 HA LYS 94 -7.692 -12.197 3.073 144 HB2 LYS 94 HB2 LYS 94 -9.133 -12.692 4.955 145 HB3 LYS 94 HB1 LYS 94 -8.299 -11.167 5.230 146 HG2 LYS 94 HG2 LYS 94 -10.307 -9.941 4.455 147 HG3 LYS 94 HG1 LYS 94 -11.149 -11.475 4.234 148 HD2 LYS 94 HD2 LYS 94 -10.857 -11.985 6.631 149 HD3 LYS 94 HD1 LYS 94 -10.042 -10.436 6.855 150 HE2 LYS 94 HE2 LYS 94 -12.066 -9.252 6.097 151 HE3 LYS 94 HE1 LYS 94 -12.884 -10.796 5.859 152 HZ1 LYS 94 HZ1 LYS 94 -11.991 -11.006 8.385 153 HZ2 LYS 94 HZ2 LYS 94 -13.554 -10.500 7.954 154 HZ3 LYS 94 HZ3 LYS 94 -12.352 -9.351 8.297 155 H ASP 95 HN ASP 95 -10.369 -10.543 1.721 156 HA ASP 95 HA ASP 95 -11.852 -13.014 1.213 157 HB2 ASP 95 HB2 ASP 95 -12.462 -10.109 0.653 158 HB3 ASP 95 HB1 ASP 95 -13.493 -11.438 0.126 159 H GLY 96 HN GLY 96 -9.641 -10.861 -0.327 160 HA2 GLY 96 HA2 GLY 96 -8.612 -10.988 -2.400 161 HA3 GLY 96 HA1 GLY 96 -9.364 -12.570 -2.605 162 H ASN 97 HN ASN 97 -11.039 -9.551 -1.947 163 HA ASN 97 HA ASN 97 -12.653 -9.932 -4.358 164 HB2 ASN 97 HB2 ASN 97 -13.570 -9.398 -1.998 165 HB3 ASN 97 HB1 ASN 97 -13.036 -7.751 -2.323 166 HD21 ASN 97 HD21 ASN 97 -15.163 -6.838 -2.558 167 HD22 ASN 97 HD22 ASN 97 -16.196 -7.264 -3.837 168 H GLY 98 HN GLY 98 -9.831 -8.390 -3.579 169 HA2 GLY 98 HA2 GLY 98 -8.590 -7.078 -5.102 170 HA3 GLY 98 HA1 GLY 98 -10.092 -6.593 -5.878 171 H TYR 99 HN TYR 99 -10.431 -6.373 -2.545 172 HA TYR 99 HA TYR 99 -9.463 -3.591 -2.457 173 HB2 TYR 99 HB2 TYR 99 -12.203 -4.418 -1.497 174 HB3 TYR 99 HB1 TYR 99 -11.508 -2.797 -1.490 175 HD1 TYR 99 HD1 TYR 99 -12.320 -5.596 -3.820 176 HD2 TYR 99 HD2 TYR 99 -11.890 -1.359 -3.289 177 HE1 TYR 99 HE1 TYR 99 -13.184 -5.229 -6.114 178 HE2 TYR 99 HE2 TYR 99 -12.751 -0.987 -5.593 179 HH TYR 99 HH TYR 99 -13.458 -3.712 -7.751 180 H ILE 100 HN ILE 100 -9.308 -2.693 -0.302 181 HA ILE 100 HA ILE 100 -9.138 -4.712 1.845 182 HB ILE 100 HB ILE 100 -6.976 -4.046 2.476 183 HG12 ILE 100 HG12 ILE 100 -7.492 -1.543 0.851 184 HG13 ILE 100 HG11 ILE 100 -7.283 -1.641 2.600 185 HG21 ILE 100 HG21 ILE 100 -5.658 -4.375 0.564 186 HG22 ILE 100 HG22 ILE 100 -6.730 -3.398 -0.439 187 HG23 ILE 100 HG23 ILE 100 -7.217 -5.025 0.050 188 HD11 ILE 100 HD11 ILE 100 -5.212 -1.997 0.442 189 HD12 ILE 100 HD12 ILE 100 -4.967 -2.660 2.057 190 HD13 ILE 100 HD13 ILE 100 -5.178 -0.924 1.839 191 H SER 101 HN SER 101 -9.712 -3.873 3.929 192 HA SER 101 HA SER 101 -11.509 -1.684 3.888 193 HB2 SER 101 HB2 SER 101 -10.165 -3.084 6.212 194 HB3 SER 101 HB1 SER 101 -11.483 -1.925 6.367 195 HG SER 101 HG SER 101 -11.494 -4.426 5.025 196 H ALA 102 HN ALA 102 -10.651 0.254 3.264 197 HA ALA 102 HA ALA 102 -8.241 1.365 3.549 198 HB1 ALA 102 HB1 ALA 102 -9.246 3.332 3.003 199 HB2 ALA 102 HB2 ALA 102 -10.433 3.195 4.298 200 HB3 ALA 102 HB3 ALA 102 -10.662 2.300 2.797 201 H ALA 103 HN ALA 103 -10.537 0.988 6.215 202 HA ALA 103 HA ALA 103 -9.355 2.813 7.996 203 HB1 ALA 103 HB1 ALA 103 -10.333 1.017 9.705 204 HB2 ALA 103 HB2 ALA 103 -11.136 0.439 8.245 205 HB3 ALA 103 HB3 ALA 103 -11.384 2.098 8.789 206 H GLU 104 HN GLU 104 -8.605 -0.596 7.319 207 HA GLU 104 HA GLU 104 -6.695 -0.804 9.445 208 HB2 GLU 104 HB2 GLU 104 -6.387 -2.984 8.754 209 HB3 GLU 104 HB1 GLU 104 -7.999 -2.667 8.118 210 HG2 GLU 104 HG2 GLU 104 -6.804 -1.919 5.959 211 HG3 GLU 104 HG1 GLU 104 -5.379 -2.711 6.624 212 H LEU 105 HN LEU 105 -6.578 0.151 6.079 213 HA LEU 105 HA LEU 105 -3.806 -0.092 5.646 214 HB2 LEU 105 HB2 LEU 105 -5.306 0.349 3.789 215 HB3 LEU 105 HB1 LEU 105 -5.785 1.893 4.491 216 HG LEU 105 HG LEU 105 -2.870 1.609 4.194 217 HD11 LEU 105 HD11 LEU 105 -4.709 1.416 1.803 218 HD12 LEU 105 HD12 LEU 105 -3.300 0.426 2.184 219 HD13 LEU 105 HD13 LEU 105 -3.088 2.100 1.675 220 HD21 LEU 105 HD21 LEU 105 -3.074 3.879 3.424 221 HD22 LEU 105 HD22 LEU 105 -4.221 3.691 4.751 222 HD23 LEU 105 HD23 LEU 105 -4.792 3.673 3.082 223 H ARG 106 HN ARG 106 -5.721 2.689 6.784 224 HA ARG 106 HA ARG 106 -3.607 4.480 7.133 225 HB2 ARG 106 HB2 ARG 106 -5.950 5.163 7.287 226 HB3 ARG 106 HB1 ARG 106 -6.153 4.210 8.757 227 HG2 ARG 106 HG2 ARG 106 -3.879 6.080 8.851 228 HG3 ARG 106 HG1 ARG 106 -5.448 6.870 8.701 229 HD2 ARG 106 HD2 ARG 106 -4.861 4.723 10.754 230 HD3 ARG 106 HD1 ARG 106 -4.699 6.444 11.081 231 HE ARG 106 HE ARG 106 -7.253 6.099 10.049 232 HH11 ARG 106 HH21 ARG 106 -5.370 4.961 12.719 233 HH12 ARG 106 HH22 ARG 106 -6.731 4.763 13.773 234 HH21 ARG 106 HH11 ARG 106 -9.041 5.845 11.422 235 HH22 ARG 106 HH12 ARG 106 -8.810 5.264 13.038 236 H HIS 107 HN HIS 107 -5.041 2.219 9.543 237 HA HIS 107 HA HIS 107 -3.288 2.812 11.647 238 HB2 HIS 107 HB2 HIS 107 -5.310 1.585 12.051 239 HB3 HIS 107 HB1 HIS 107 -4.839 0.320 10.918 240 HD1 HIS 107 HD1 HIS 107 -3.518 1.863 14.156 241 HD2 HIS 107 HD2 HIS 107 -3.585 -1.802 12.155 242 HE1 HIS 107 HE1 HIS 107 -2.433 0.182 15.707 243 HE2 HIS 107 HE2 HIS 107 -2.459 -2.054 14.501 244 H VAL 108 HN VAL 108 -3.144 0.324 9.148 245 HA VAL 108 HA VAL 108 -0.768 -0.932 9.973 246 HB VAL 108 HB VAL 108 -2.117 -0.710 7.279 247 HG11 VAL 108 HG11 VAL 108 -0.704 -2.746 6.750 248 HG12 VAL 108 HG12 VAL 108 0.269 -2.346 8.155 249 HG13 VAL 108 HG13 VAL 108 0.179 -1.225 6.797 250 HG21 VAL 108 HG21 VAL 108 -3.227 -2.646 7.861 251 HG22 VAL 108 HG22 VAL 108 -3.018 -1.956 9.470 252 HG23 VAL 108 HG23 VAL 108 -1.916 -3.209 8.897 253 H MET 109 HN MET 109 -1.346 1.806 7.831 254 HA MET 109 HA MET 109 1.386 2.006 6.949 255 HB2 MET 109 HB2 MET 109 -1.099 3.595 6.596 256 HB3 MET 109 HB1 MET 109 0.435 4.446 6.386 257 HG2 MET 109 HG2 MET 109 -0.576 3.330 4.301 258 HG3 MET 109 HG1 MET 109 1.126 3.013 4.637 259 HE1 MET 109 HE1 MET 109 -1.005 0.552 2.844 260 HE2 MET 109 HE2 MET 109 0.587 -0.131 3.161 261 HE3 MET 109 HE3 MET 109 0.428 1.588 2.808 262 H THR 110 HN THR 110 -0.407 3.253 9.672 263 HA THR 110 HA THR 110 1.762 5.134 10.285 264 HB THR 110 HB THR 110 0.244 6.083 11.921 265 HG1 THR 110 HG1 THR 110 -0.730 3.738 12.056 266 HG21 THR 110 HG21 THR 110 -0.593 7.219 10.188 267 HG22 THR 110 HG22 THR 110 -1.834 5.981 10.013 268 HG23 THR 110 HG23 THR 110 -0.323 5.848 9.114 269 H ASN 111 HN ASN 111 0.816 1.960 11.142 270 HA ASN 111 HA ASN 111 2.359 2.160 13.669 271 HB2 ASN 111 HB2 ASN 111 0.048 0.372 12.936 272 HB3 ASN 111 HB1 ASN 111 1.069 0.100 14.347 273 HD21 ASN 111 HD21 ASN 111 -1.591 1.953 13.122 274 HD22 ASN 111 HD22 ASN 111 -1.780 2.962 14.472 275 H LEU 112 HN LEU 112 2.015 0.401 10.653 276 HA LEU 112 HA LEU 112 4.232 -1.383 11.487 277 HB2 LEU 112 HB2 LEU 112 2.189 -1.793 9.304 278 HB3 LEU 112 HB1 LEU 112 3.477 -2.914 9.722 279 HG LEU 112 HG LEU 112 1.248 -2.035 11.588 280 HD11 LEU 112 HD11 LEU 112 1.137 -4.800 11.154 281 HD12 LEU 112 HD12 LEU 112 1.438 -4.118 9.555 282 HD13 LEU 112 HD13 LEU 112 0.036 -3.594 10.487 283 HD21 LEU 112 HD21 LEU 112 2.874 -2.659 13.094 284 HD22 LEU 112 HD22 LEU 112 3.738 -3.643 11.915 285 HD23 LEU 112 HD23 LEU 112 2.286 -4.272 12.690 286 H GLY 113 HN GLY 113 5.338 -2.260 9.365 287 HA2 GLY 113 HA2 GLY 113 6.798 -1.846 7.649 288 HA3 GLY 113 HA1 GLY 113 5.684 -0.590 7.134 289 H GLU 114 HN GLU 114 6.640 1.277 6.912 290 HA GLU 114 HA GLU 114 8.988 1.924 8.552 291 HB2 GLU 114 HB2 GLU 114 7.979 3.214 6.010 292 HB3 GLU 114 HB1 GLU 114 9.457 3.658 6.867 293 HG2 GLU 114 HG2 GLU 114 8.891 0.875 5.820 294 HG3 GLU 114 HG1 GLU 114 9.831 2.079 4.941 295 H LYS 115 HN LYS 115 5.999 2.185 9.148 296 HA LYS 115 HA LYS 115 4.554 3.664 10.147 297 HB2 LYS 115 HB2 LYS 115 7.255 4.145 11.268 298 HB3 LYS 115 HB1 LYS 115 5.946 5.225 11.755 299 HG2 LYS 115 HG2 LYS 115 4.606 3.286 12.463 300 HG3 LYS 115 HG1 LYS 115 5.890 2.197 11.938 301 HD2 LYS 115 HD2 LYS 115 7.408 3.059 13.598 302 HD3 LYS 115 HD1 LYS 115 6.295 4.362 14.016 303 HE2 LYS 115 HE2 LYS 115 5.631 1.423 14.336 304 HE3 LYS 115 HE1 LYS 115 6.267 2.429 15.637 305 HZ1 LYS 115 HZ1 LYS 115 3.932 3.385 14.148 306 HZ2 LYS 115 HZ2 LYS 115 4.355 3.633 15.774 307 HZ3 LYS 115 HZ3 LYS 115 3.704 2.144 15.282 308 H LEU 116 HN LEU 116 3.580 4.970 8.740 309 HA LEU 116 HA LEU 116 5.016 7.252 7.591 310 HB2 LEU 116 HB2 LEU 116 2.311 6.013 7.083 311 HB3 LEU 116 HB1 LEU 116 2.703 7.619 6.485 312 HG LEU 116 HG LEU 116 3.107 5.861 4.782 313 HD11 LEU 116 HD11 LEU 116 4.896 6.986 3.961 314 HD12 LEU 116 HD12 LEU 116 5.878 6.657 5.388 315 HD13 LEU 116 HD13 LEU 116 4.721 7.982 5.401 316 HD21 LEU 116 HD21 LEU 116 3.754 4.112 6.501 317 HD22 LEU 116 HD22 LEU 116 5.319 4.917 6.627 318 HD23 LEU 116 HD23 LEU 116 4.815 4.204 5.099 319 H THR 117 HN THR 117 4.155 9.426 7.782 320 HA THR 117 HA THR 117 2.966 9.884 10.415 321 HB THR 117 HB THR 117 3.578 12.223 10.045 322 HG1 THR 117 HG1 THR 117 3.271 12.462 7.884 323 HG21 THR 117 HG21 THR 117 6.091 11.182 9.086 324 HG22 THR 117 HG22 THR 117 5.364 10.044 10.220 325 HG23 THR 117 HG23 THR 117 5.662 11.712 10.713 326 H ASP 118 HN ASP 118 1.282 11.715 10.470 327 HA ASP 118 HA ASP 118 -0.986 10.913 9.039 328 HB2 ASP 118 HB2 ASP 118 -0.333 13.484 10.481 329 HB3 ASP 118 HB1 ASP 118 -1.917 13.156 9.781 330 H GLU 119 HN GLU 119 1.370 13.482 8.389 331 HA GLU 119 HA GLU 119 0.002 14.690 6.237 332 HB2 GLU 119 HB2 GLU 119 1.930 15.725 7.385 333 HB3 GLU 119 HB1 GLU 119 2.987 14.486 6.709 334 HG2 GLU 119 HG2 GLU 119 2.442 15.223 4.435 335 HG3 GLU 119 HG1 GLU 119 1.313 16.416 5.075 336 H GLU 120 HN GLU 120 2.388 12.044 6.327 337 HA GLU 120 HA GLU 120 2.489 11.699 3.498 338 HB2 GLU 120 HB2 GLU 120 3.253 9.908 5.805 339 HB3 GLU 120 HB1 GLU 120 3.460 9.433 4.118 340 HG2 GLU 120 HG2 GLU 120 4.842 11.418 3.703 341 HG3 GLU 120 HG1 GLU 120 4.601 11.957 5.364 342 H VAL 121 HN VAL 121 0.624 10.149 6.083 343 HA VAL 121 HA VAL 121 -0.678 8.233 4.435 344 HB VAL 121 HB VAL 121 -1.458 9.514 7.078 345 HG11 VAL 121 HG11 VAL 121 -3.521 8.799 6.085 346 HG12 VAL 121 HG12 VAL 121 -3.041 7.531 7.212 347 HG13 VAL 121 HG13 VAL 121 -2.779 7.314 5.483 348 HG21 VAL 121 HG21 VAL 121 -0.944 6.662 7.031 349 HG22 VAL 121 HG22 VAL 121 -0.159 7.910 8.000 350 HG23 VAL 121 HG23 VAL 121 0.425 7.551 6.375 351 H ASP 122 HN ASP 122 -1.659 11.516 5.501 352 HA ASP 122 HA ASP 122 -4.189 11.603 4.398 353 HB2 ASP 122 HB2 ASP 122 -3.179 13.445 5.721 354 HB3 ASP 122 HB1 ASP 122 -2.146 13.844 4.349 355 H GLU 123 HN GLU 123 -1.071 12.091 2.812 356 HA GLU 123 HA GLU 123 -2.052 12.769 0.247 357 HB2 GLU 123 HB2 GLU 123 0.307 13.078 0.954 358 HB3 GLU 123 HB1 GLU 123 0.510 11.328 0.984 359 HG2 GLU 123 HG2 GLU 123 1.357 12.199 -1.130 360 HG3 GLU 123 HG1 GLU 123 -0.093 11.251 -1.438 361 H MET 124 HN MET 124 -1.385 9.697 1.858 362 HA MET 124 HA MET 124 -1.800 8.025 -0.428 363 HB2 MET 124 HB2 MET 124 -1.878 7.451 2.551 364 HB3 MET 124 HB1 MET 124 -1.912 6.227 1.287 365 HG2 MET 124 HG2 MET 124 0.255 6.920 0.469 366 HG3 MET 124 HG1 MET 124 0.269 8.295 1.563 367 HE1 MET 124 HE1 MET 124 -0.797 4.451 2.275 368 HE2 MET 124 HE2 MET 124 0.857 3.881 2.477 369 HE3 MET 124 HE3 MET 124 0.381 4.660 0.970 370 H ILE 125 HN ILE 125 -3.831 9.199 2.231 371 HA ILE 125 HA ILE 125 -6.088 7.600 1.793 372 HB ILE 125 HB ILE 125 -5.449 10.015 3.272 373 HG12 ILE 125 HG12 ILE 125 -6.757 8.868 4.998 374 HG13 ILE 125 HG11 ILE 125 -7.288 7.692 3.806 375 HG21 ILE 125 HG21 ILE 125 -8.265 9.598 2.278 376 HG22 ILE 125 HG22 ILE 125 -7.270 11.048 2.116 377 HG23 ILE 125 HG23 ILE 125 -7.865 10.560 3.697 378 HD11 ILE 125 HD11 ILE 125 -5.145 7.286 5.383 379 HD12 ILE 125 HD12 ILE 125 -4.373 8.089 4.019 380 HD13 ILE 125 HD13 ILE 125 -5.282 6.607 3.760 381 H ARG 126 HN ARG 126 -5.211 10.742 0.397 382 HA ARG 126 HA ARG 126 -7.649 11.105 -1.014 383 HB2 ARG 126 HB2 ARG 126 -4.886 12.257 -1.412 384 HB3 ARG 126 HB1 ARG 126 -6.273 12.723 -2.399 385 HG2 ARG 126 HG2 ARG 126 -7.501 13.335 -0.308 386 HG3 ARG 126 HG1 ARG 126 -6.037 12.986 0.613 387 HD2 ARG 126 HD2 ARG 126 -6.144 14.984 -1.658 388 HD3 ARG 126 HD1 ARG 126 -6.353 15.424 0.034 389 HE ARG 126 HE ARG 126 -3.974 13.982 -0.126 390 HH11 ARG 126 HH21 ARG 126 -5.366 16.879 -1.406 391 HH12 ARG 126 HH22 ARG 126 -3.856 17.722 -1.518 392 HH21 ARG 126 HH11 ARG 126 -1.991 15.084 -0.263 393 HH22 ARG 126 HH12 ARG 126 -1.946 16.704 -0.872 394 H GLU 127 HN GLU 127 -4.792 9.250 -1.637 395 HA GLU 127 HA GLU 127 -5.564 8.793 -4.435 396 HB2 GLU 127 HB2 GLU 127 -3.134 7.867 -2.885 397 HB3 GLU 127 HB1 GLU 127 -3.410 7.611 -4.609 398 HG2 GLU 127 HG2 GLU 127 -3.299 10.334 -3.282 399 HG3 GLU 127 HG1 GLU 127 -1.947 9.587 -4.131 400 H ALA 128 HN ALA 128 -6.394 7.561 -1.505 401 HA ALA 128 HA ALA 128 -6.349 4.742 -2.294 402 HB1 ALA 128 HB1 ALA 128 -7.739 5.452 0.203 403 HB2 ALA 128 HB2 ALA 128 -6.067 5.991 0.127 404 HB3 ALA 128 HB3 ALA 128 -6.445 4.289 -0.087 405 H ASP 129 HN ASP 129 -9.009 6.545 -0.690 406 HA ASP 129 HA ASP 129 -10.880 6.606 -2.707 407 HB2 ASP 129 HB2 ASP 129 -10.430 3.867 -1.708 408 HB3 ASP 129 HB1 ASP 129 -12.119 4.358 -1.751 409 H ILE 130 HN ILE 130 -11.854 4.711 0.021 410 HA ILE 130 HA ILE 130 -13.269 5.124 1.746 411 HB ILE 130 HB ILE 130 -11.855 7.777 1.994 412 HG12 ILE 130 HG12 ILE 130 -10.956 5.134 3.162 413 HG13 ILE 130 HG11 ILE 130 -10.274 5.787 1.675 414 HG21 ILE 130 HG21 ILE 130 -13.896 6.553 3.456 415 HG22 ILE 130 HG22 ILE 130 -12.847 7.849 4.032 416 HG23 ILE 130 HG23 ILE 130 -12.437 6.169 4.370 417 HD11 ILE 130 HD11 ILE 130 -9.129 6.323 3.976 418 HD12 ILE 130 HD12 ILE 130 -10.404 7.533 4.105 419 HD13 ILE 130 HD13 ILE 130 -9.279 7.580 2.749 420 H ASP 131 HN ASP 131 -14.647 5.585 -0.496 421 HA ASP 131 HA ASP 131 -15.678 8.202 -0.827 422 HB2 ASP 131 HB2 ASP 131 -16.865 5.478 -1.403 423 HB3 ASP 131 HB1 ASP 131 -17.673 6.987 -1.823 424 H GLY 132 HN GLY 132 -16.555 5.480 1.178 425 HA2 GLY 132 HA2 GLY 132 -17.634 7.060 3.276 426 HA3 GLY 132 HA1 GLY 132 -18.945 6.392 2.310 427 H ASP 133 HN ASP 133 -17.965 3.906 1.647 428 HA ASP 133 HA ASP 133 -18.553 2.410 3.944 429 HB2 ASP 133 HB2 ASP 133 -17.286 1.643 1.319 430 HB3 ASP 133 HB1 ASP 133 -17.676 0.464 2.569 431 H GLY 134 HN GLY 134 -15.434 3.260 2.496 432 HA2 GLY 134 HA2 GLY 134 -13.483 3.571 3.835 433 HA3 GLY 134 HA1 GLY 134 -14.165 2.481 5.034 434 H GLN 135 HN GLN 135 -13.919 1.929 1.537 435 HA GLN 135 HA GLN 135 -12.010 -0.269 2.083 436 HB2 GLN 135 HB2 GLN 135 -13.029 -1.325 -0.025 437 HB3 GLN 135 HB1 GLN 135 -14.001 -1.381 1.450 438 HG2 GLN 135 HG2 GLN 135 -15.248 0.611 0.708 439 HG3 GLN 135 HG1 GLN 135 -14.268 0.684 -0.755 440 HE21 GLN 135 HE21 GLN 135 -16.953 -0.961 0.791 441 HE22 GLN 135 HE22 GLN 135 -17.345 -1.958 -0.526 442 H VAL 136 HN VAL 136 -10.327 -0.546 0.619 443 HA VAL 136 HA VAL 136 -10.018 1.577 -1.402 444 HB VAL 136 HB VAL 136 -8.146 0.635 0.734 445 HG11 VAL 136 HG11 VAL 136 -7.450 1.635 -2.029 446 HG12 VAL 136 HG12 VAL 136 -6.732 0.289 -1.134 447 HG13 VAL 136 HG13 VAL 136 -6.391 1.955 -0.656 448 HG21 VAL 136 HG21 VAL 136 -7.908 2.948 1.137 449 HG22 VAL 136 HG22 VAL 136 -9.622 2.746 0.772 450 HG23 VAL 136 HG23 VAL 136 -8.531 3.366 -0.457 451 H ASN 137 HN ASN 137 -9.376 0.972 -3.355 452 HA ASN 137 HA ASN 137 -8.961 -1.873 -3.856 453 HB2 ASN 137 HB2 ASN 137 -9.161 -1.281 -6.211 454 HB3 ASN 137 HB1 ASN 137 -10.485 -0.551 -5.308 455 HD21 ASN 137 HD21 ASN 137 -9.466 0.465 -7.860 456 HD22 ASN 137 HD22 ASN 137 -8.847 2.017 -7.559 457 H TYR 138 HN TYR 138 -6.881 -2.545 -3.526 458 HA TYR 138 HA TYR 138 -4.647 -0.817 -3.542 459 HB2 TYR 138 HB2 TYR 138 -3.290 -2.896 -3.503 460 HB3 TYR 138 HB1 TYR 138 -4.576 -2.893 -2.299 461 HD1 TYR 138 HD1 TYR 138 -3.667 -4.134 -5.699 462 HD2 TYR 138 HD2 TYR 138 -6.266 -4.567 -2.314 463 HE1 TYR 138 HE1 TYR 138 -4.558 -6.246 -6.644 464 HE2 TYR 138 HE2 TYR 138 -7.151 -6.677 -3.238 465 HH TYR 138 HH TYR 138 -6.978 -7.561 -6.264 466 H GLU 139 HN GLU 139 -6.402 -1.996 -6.146 467 HA GLU 139 HA GLU 139 -4.407 -2.607 -8.026 468 HB2 GLU 139 HB2 GLU 139 -6.803 -3.032 -8.411 469 HB3 GLU 139 HB1 GLU 139 -7.089 -1.296 -8.524 470 HG2 GLU 139 HG2 GLU 139 -5.628 -1.140 -10.476 471 HG3 GLU 139 HG1 GLU 139 -5.211 -2.847 -10.332 472 H GLU 140 HN GLU 140 -6.001 0.565 -7.408 473 HA GLU 140 HA GLU 140 -4.513 1.985 -9.323 474 HB2 GLU 140 HB2 GLU 140 -5.261 3.984 -8.205 475 HB3 GLU 140 HB1 GLU 140 -6.577 2.813 -8.174 476 HG2 GLU 140 HG2 GLU 140 -5.795 2.131 -5.875 477 HG3 GLU 140 HG1 GLU 140 -4.679 3.492 -5.914 478 H PHE 141 HN PHE 141 -3.854 1.250 -5.941 479 HA PHE 141 HA PHE 141 -1.589 2.922 -5.631 480 HB2 PHE 141 HB2 PHE 141 -2.758 0.626 -4.192 481 HB3 PHE 141 HB1 PHE 141 -1.010 0.790 -4.017 482 HD1 PHE 141 HD2 PHE 141 -0.104 3.155 -3.477 483 HD2 PHE 141 HD1 PHE 141 -4.202 1.986 -2.880 484 HE1 PHE 141 HE2 PHE 141 -0.404 5.019 -1.874 485 HE2 PHE 141 HE1 PHE 141 -4.484 3.847 -1.272 486 HZ PHE 141 HZ PHE 141 -2.596 5.365 -0.774 487 H VAL 142 HN VAL 142 -1.950 -0.416 -6.773 488 HA VAL 142 HA VAL 142 0.816 -0.907 -7.124 489 HB VAL 142 HB VAL 142 -1.638 -2.124 -8.400 490 HG11 VAL 142 HG11 VAL 142 0.003 -2.553 -10.035 491 HG12 VAL 142 HG12 VAL 142 0.152 -3.952 -8.970 492 HG13 VAL 142 HG13 VAL 142 1.301 -2.621 -8.843 493 HG21 VAL 142 HG21 VAL 142 -1.262 -2.537 -5.991 494 HG22 VAL 142 HG22 VAL 142 0.382 -3.062 -6.344 495 HG23 VAL 142 HG23 VAL 142 -0.987 -4.011 -6.923 496 H GLN 143 HN GLN 143 -1.687 0.450 -9.230 497 HA GLN 143 HA GLN 143 -0.105 0.668 -11.560 498 HB2 GLN 143 HB2 GLN 143 -2.448 2.308 -10.563 499 HB3 GLN 143 HB1 GLN 143 -1.725 2.506 -12.158 500 HG2 GLN 143 HG2 GLN 143 -2.798 -0.125 -11.125 501 HG3 GLN 143 HG1 GLN 143 -3.733 0.991 -12.121 502 HE21 GLN 143 HE21 GLN 143 -1.736 -1.689 -12.312 503 HE22 GLN 143 HE22 GLN 143 -1.226 -1.523 -13.921 504 H MET 144 HN MET 144 -0.615 2.813 -8.779 505 HA MET 144 HA MET 144 0.878 5.026 -9.699 506 HB2 MET 144 HB2 MET 144 0.361 3.966 -6.905 507 HB3 MET 144 HB1 MET 144 1.179 5.491 -7.222 508 HG2 MET 144 HG2 MET 144 -0.744 6.470 -8.160 509 HG3 MET 144 HG1 MET 144 -1.508 4.908 -8.449 510 HE1 MET 144 HE1 MET 144 0.371 6.022 -5.085 511 HE2 MET 144 HE2 MET 144 -0.928 6.980 -4.377 512 HE3 MET 144 HE3 MET 144 -0.239 7.451 -5.932 513 H MET 145 HN MET 145 1.793 2.143 -7.842 514 HA MET 145 HA MET 145 4.548 2.802 -7.598 515 HB2 MET 145 HB2 MET 145 3.071 0.163 -7.367 516 HB3 MET 145 HB1 MET 145 4.762 0.410 -6.922 517 HG2 MET 145 HG2 MET 145 4.145 2.034 -5.235 518 HG3 MET 145 HG1 MET 145 2.466 2.000 -5.760 519 HE1 MET 145 HE1 MET 145 1.469 0.421 -2.790 520 HE2 MET 145 HE2 MET 145 2.050 1.929 -3.489 521 HE3 MET 145 HE3 MET 145 3.074 1.033 -2.372 522 H THR 146 HN THR 146 2.686 1.544 -10.216 523 HA THR 146 HA THR 146 5.174 0.709 -11.579 524 HB THR 146 HB THR 146 3.794 -0.891 -12.856 525 HG1 THR 146 HG1 THR 146 1.831 0.442 -12.336 526 HG21 THR 146 HG21 THR 146 3.018 -1.737 -10.174 527 HG22 THR 146 HG22 THR 146 4.662 -1.105 -10.210 528 HG23 THR 146 HG23 THR 146 4.211 -2.441 -11.267 529 H ALA 147 HN ALA 147 3.356 3.260 -11.414 530 HA ALA 147 HA ALA 147 3.023 3.605 -14.336 531 HB1 ALA 147 HB1 ALA 147 1.664 4.970 -12.005 532 HB2 ALA 147 HB2 ALA 147 0.919 3.981 -13.261 533 HB3 ALA 147 HB3 ALA 147 1.570 5.570 -13.660 534 H LYS 148 HN LYS 148 5.468 3.859 -14.119 535 HA LYS 148 HA LYS 148 6.113 6.618 -14.361 536 HB2 LYS 148 HB2 LYS 148 6.005 5.983 -11.754 537 HB3 LYS 148 HB1 LYS 148 7.646 5.437 -12.096 538 HG2 LYS 148 HG2 LYS 148 8.040 7.658 -11.557 539 HG3 LYS 148 HG1 LYS 148 7.839 7.784 -13.303 540 HD2 LYS 148 HD2 LYS 148 5.415 8.310 -12.930 541 HD3 LYS 148 HD1 LYS 148 5.725 8.314 -11.194 542 HE2 LYS 148 HE2 LYS 148 5.850 10.600 -11.935 543 HE3 LYS 148 HE1 LYS 148 7.500 10.069 -11.611 544 HZ1 LYS 148 HZ1 LYS 148 7.783 9.618 -13.965 545 HZ2 LYS 148 HZ2 LYS 148 7.344 11.240 -13.718 546 HZ3 LYS 148 HZ3 LYS 148 6.194 10.121 -14.279 547 H PHE 30 HT1 PHE 30 -9.183 -3.120 12.182 548 HA PHE 30 HA PHE 30 -8.267 -4.499 10.427 549 HB2 PHE 30 HB2 PHE 30 -6.127 -4.825 12.399 550 HB3 PHE 30 HB1 PHE 30 -6.201 -3.771 10.989 551 HD1 PHE 30 HD2 PHE 30 -7.906 -1.739 11.218 552 HD2 PHE 30 HD1 PHE 30 -6.118 -3.831 14.516 553 HE1 PHE 30 HE2 PHE 30 -8.333 0.212 12.688 554 HE2 PHE 30 HE1 PHE 30 -6.546 -1.880 15.984 555 HZ PHE 30 HZ PHE 30 -7.654 0.141 15.071 556 H ASP 31 HN ASP 31 -9.272 -6.497 10.103 557 HA ASP 31 HA ASP 31 -8.705 -8.693 11.934 558 HB2 ASP 31 HB2 ASP 31 -10.957 -8.406 10.905 559 HB3 ASP 31 HB1 ASP 31 -10.237 -8.714 9.325 560 H ILE 32 HN ILE 32 -6.305 -8.342 11.362 561 HA ILE 32 HA ILE 32 -5.645 -10.241 9.209 562 HB ILE 32 HB ILE 32 -4.020 -8.889 8.225 563 HG12 ILE 32 HG12 ILE 32 -4.090 -7.254 10.780 564 HG13 ILE 32 HG11 ILE 32 -2.742 -8.205 10.145 565 HG21 ILE 32 HG21 ILE 32 -5.137 -6.936 7.568 566 HG22 ILE 32 HG22 ILE 32 -5.878 -6.710 9.150 567 HG23 ILE 32 HG23 ILE 32 -6.447 -7.994 8.077 568 HD11 ILE 32 HD11 ILE 32 -2.886 -6.683 8.072 569 HD12 ILE 32 HD12 ILE 32 -2.193 -5.997 9.536 570 HD13 ILE 32 HD13 ILE 32 -3.852 -5.613 9.084 571 H ASP 33 HN ASP 33 -3.367 -11.064 9.461 572 HA ASP 33 HA ASP 33 -2.944 -11.700 12.259 573 HB2 ASP 33 HB2 ASP 33 -2.731 -13.407 10.430 574 HB3 ASP 33 HB1 ASP 33 -1.298 -12.548 9.866 575 H MET 34 HN MET 34 -2.397 -9.582 12.986 576 HA MET 34 HA MET 34 -0.279 -8.017 11.991 577 HB2 MET 34 HB2 MET 34 -1.512 -8.214 14.747 578 HB3 MET 34 HB1 MET 34 -0.321 -6.995 14.302 579 HG2 MET 34 HG2 MET 34 -2.932 -7.421 12.825 580 HG3 MET 34 HG1 MET 34 -2.711 -6.218 14.092 581 HE1 MET 34 HE1 MET 34 -0.593 -3.517 12.746 582 HE2 MET 34 HE2 MET 34 0.199 -4.845 13.588 583 HE3 MET 34 HE3 MET 34 -1.399 -4.314 14.101 584 H ASP 35 HN ASP 35 -0.400 -10.561 14.416 585 HA ASP 35 HA ASP 35 2.199 -10.311 15.444 586 HB2 ASP 35 HB2 ASP 35 0.401 -11.660 16.490 587 HB3 ASP 35 HB1 ASP 35 0.548 -12.831 15.180 588 H ALA 36 HN ALA 36 0.980 -12.153 12.659 589 HA ALA 36 HA ALA 36 3.290 -13.633 12.145 590 HB1 ALA 36 HB1 ALA 36 2.405 -13.471 9.687 591 HB2 ALA 36 HB2 ALA 36 1.023 -12.677 10.436 592 HB3 ALA 36 HB3 ALA 36 1.453 -14.323 10.900 593 HA PRO 37 HA PRO 37 6.068 -10.399 10.836 594 HB2 PRO 37 HB2 PRO 37 7.960 -11.860 9.562 595 HB3 PRO 37 HB1 PRO 37 7.794 -11.815 11.329 596 HG2 PRO 37 HG2 PRO 37 6.828 -13.843 9.391 597 HG3 PRO 37 HG1 PRO 37 7.608 -14.070 10.961 598 HD2 PRO 37 HD2 PRO 37 4.923 -14.306 10.627 599 HD3 PRO 37 HD1 PRO 37 5.647 -13.716 12.141 600 H GLU 38 HN GLU 38 4.609 -12.593 8.577 601 HA GLU 38 HA GLU 38 5.563 -11.505 6.157 602 HB2 GLU 38 HB2 GLU 38 2.983 -12.936 6.832 603 HB3 GLU 38 HB1 GLU 38 3.441 -12.492 5.191 604 HG2 GLU 38 HG2 GLU 38 4.223 -14.697 5.369 605 HG3 GLU 38 HG1 GLU 38 5.666 -13.752 5.709 606 H THR 39 HN THR 39 2.794 -10.648 8.196 607 HA THR 39 HA THR 39 1.642 -8.763 6.438 608 HB THR 39 HB THR 39 1.589 -8.826 9.467 609 HG1 THR 39 HG1 THR 39 -0.230 -9.814 7.527 610 HG21 THR 39 HG21 THR 39 0.781 -6.709 8.955 611 HG22 THR 39 HG22 THR 39 -0.698 -7.664 8.858 612 HG23 THR 39 HG23 THR 39 0.158 -7.214 7.385 613 H GLU 40 HN GLU 40 4.011 -8.403 9.060 614 HA GLU 40 HA GLU 40 4.308 -5.602 8.852 615 HB2 GLU 40 HB2 GLU 40 5.107 -6.924 10.785 616 HB3 GLU 40 HB1 GLU 40 6.339 -7.659 9.758 617 HG2 GLU 40 HG2 GLU 40 7.339 -5.460 9.338 618 HG3 GLU 40 HG1 GLU 40 6.075 -4.685 10.291 619 H ARG 41 HN ARG 41 6.024 -8.303 7.318 620 HA ARG 41 HA ARG 41 7.955 -6.758 5.956 621 HB2 ARG 41 HB2 ARG 41 6.758 -9.473 5.367 622 HB3 ARG 41 HB1 ARG 41 8.086 -8.783 4.436 623 HG2 ARG 41 HG2 ARG 41 8.313 -8.893 7.428 624 HG3 ARG 41 HG1 ARG 41 8.591 -10.363 6.496 625 HD2 ARG 41 HD2 ARG 41 10.015 -7.734 5.983 626 HD3 ARG 41 HD1 ARG 41 10.681 -9.055 6.931 627 HE ARG 41 HE ARG 41 9.940 -10.150 4.487 628 HH11 ARG 41 HH21 ARG 41 12.050 -7.692 5.702 629 HH12 ARG 41 HH22 ARG 41 13.216 -7.870 4.433 630 HH21 ARG 41 HH11 ARG 41 11.465 -10.391 2.820 631 HH22 ARG 41 HH12 ARG 41 12.884 -9.399 2.801 632 H ALA 42 HN ALA 42 4.706 -7.830 5.058 633 HA ALA 42 HA ALA 42 4.747 -6.954 2.376 634 HB1 ALA 42 HB1 ALA 42 2.493 -7.324 4.355 635 HB2 ALA 42 HB2 ALA 42 2.980 -8.411 3.054 636 HB3 ALA 42 HB3 ALA 42 2.222 -6.864 2.675 637 H ALA 43 HN ALA 43 3.911 -5.335 5.395 638 HA ALA 43 HA ALA 43 2.921 -2.934 4.312 639 HB1 ALA 43 HB1 ALA 43 4.232 -3.592 6.949 640 HB2 ALA 43 HB2 ALA 43 2.517 -3.362 6.614 641 HB3 ALA 43 HB3 ALA 43 3.615 -1.983 6.572 642 H VAL 44 HN VAL 44 6.204 -3.977 5.137 643 HA VAL 44 HA VAL 44 7.511 -1.510 4.841 644 HB VAL 44 HB VAL 44 8.478 -4.341 4.417 645 HG11 VAL 44 HG11 VAL 44 10.736 -2.954 4.867 646 HG12 VAL 44 HG12 VAL 44 9.815 -1.706 4.028 647 HG13 VAL 44 HG13 VAL 44 10.127 -3.253 3.240 648 HG21 VAL 44 HG21 VAL 44 9.563 -3.938 6.604 649 HG22 VAL 44 HG22 VAL 44 7.815 -3.737 6.717 650 HG23 VAL 44 HG23 VAL 44 8.863 -2.320 6.650 651 H ALA 45 HN ALA 45 6.951 -4.093 2.435 652 HA ALA 45 HA ALA 45 8.316 -2.840 0.313 653 HB1 ALA 45 HB1 ALA 45 5.934 -4.695 0.125 654 HB2 ALA 45 HB2 ALA 45 7.604 -5.223 0.331 655 HB3 ALA 45 HB3 ALA 45 7.122 -4.377 -1.140 656 H ILE 46 HN ILE 46 4.875 -2.737 1.221 657 HA ILE 46 HA ILE 46 4.047 -1.100 -0.929 658 HB ILE 46 HB ILE 46 2.904 -1.530 1.834 659 HG12 ILE 46 HG12 ILE 46 1.939 -2.486 -0.872 660 HG13 ILE 46 HG11 ILE 46 3.026 -3.432 0.145 661 HG21 ILE 46 HG21 ILE 46 1.888 0.484 1.300 662 HG22 ILE 46 HG22 ILE 46 0.797 -0.634 0.482 663 HG23 ILE 46 HG23 ILE 46 2.037 0.219 -0.437 664 HD11 ILE 46 HD11 ILE 46 1.390 -3.951 1.638 665 HD12 ILE 46 HD12 ILE 46 0.313 -3.591 0.288 666 HD13 ILE 46 HD13 ILE 46 0.632 -2.364 1.515 667 H GLN 47 HN GLN 47 4.985 -0.323 2.401 668 HA GLN 47 HA GLN 47 4.667 2.482 2.145 669 HB2 GLN 47 HB2 GLN 47 6.221 0.766 4.079 670 HB3 GLN 47 HB1 GLN 47 6.129 2.521 4.216 671 HG2 GLN 47 HG2 GLN 47 3.647 2.364 4.259 672 HG3 GLN 47 HG1 GLN 47 3.774 0.610 4.188 673 HE21 GLN 47 HE21 GLN 47 3.004 0.091 6.291 674 HE22 GLN 47 HE22 GLN 47 3.761 0.621 7.714 675 H SER 48 HN SER 48 7.451 0.327 1.688 676 HA SER 48 HA SER 48 9.415 2.333 1.420 677 HB2 SER 48 HB2 SER 48 10.759 0.609 0.324 678 HB3 SER 48 HB1 SER 48 9.923 -0.078 1.715 679 HG SER 48 HG SER 48 9.864 -1.039 -0.640 680 H GLN 49 HN GLN 49 7.271 0.792 -0.933 681 HA GLN 49 HA GLN 49 8.369 2.097 -3.215 682 HB2 GLN 49 HB2 GLN 49 5.720 0.728 -2.725 683 HB3 GLN 49 HB1 GLN 49 6.187 1.394 -4.289 684 HG2 GLN 49 HG2 GLN 49 7.801 -0.666 -2.761 685 HG3 GLN 49 HG1 GLN 49 6.695 -1.048 -4.076 686 HE21 GLN 49 HE21 GLN 49 7.198 0.532 -6.123 687 HE22 GLN 49 HE22 GLN 49 8.843 0.605 -6.536 688 H PHE 50 HN PHE 50 5.731 2.857 -0.988 689 HA PHE 50 HA PHE 50 4.585 4.963 -2.438 690 HB2 PHE 50 HB2 PHE 50 3.469 4.032 -0.488 691 HB3 PHE 50 HB1 PHE 50 4.776 4.585 0.561 692 HD1 PHE 50 HD1 PHE 50 2.493 5.961 -2.077 693 HD2 PHE 50 HD2 PHE 50 4.446 6.613 1.696 694 HE1 PHE 50 HE1 PHE 50 1.413 8.186 -1.902 695 HE2 PHE 50 HE2 PHE 50 3.372 8.850 1.864 696 HZ PHE 50 HZ PHE 50 1.851 9.628 0.067 697 H ARG 51 HN ARG 51 7.148 5.058 0.050 698 HA ARG 51 HA ARG 51 7.549 7.849 -0.052 699 HB2 ARG 51 HB2 ARG 51 8.440 6.381 1.745 700 HB3 ARG 51 HB1 ARG 51 9.588 5.699 0.593 701 HG2 ARG 51 HG2 ARG 51 10.551 7.953 0.225 702 HG3 ARG 51 HG1 ARG 51 9.413 8.621 1.396 703 HD2 ARG 51 HD2 ARG 51 11.456 6.467 2.000 704 HD3 ARG 51 HD1 ARG 51 11.648 8.173 2.394 705 HE ARG 51 HE ARG 51 9.942 6.259 3.760 706 HH11 ARG 51 HH21 ARG 51 10.668 9.572 3.072 707 HH12 ARG 51 HH22 ARG 51 9.902 10.180 4.502 708 HH21 ARG 51 HH11 ARG 51 8.937 7.049 5.637 709 HH22 ARG 51 HH12 ARG 51 8.923 8.753 5.954 710 H LYS 52 HN LYS 52 9.109 5.185 -1.819 711 HA LYS 52 HA LYS 52 10.961 6.753 -3.257 712 HB2 LYS 52 HB2 LYS 52 11.083 4.286 -3.114 713 HB3 LYS 52 HB1 LYS 52 9.624 4.167 -4.097 714 HG2 LYS 52 HG2 LYS 52 10.760 5.310 -5.955 715 HG3 LYS 52 HG1 LYS 52 12.214 5.481 -4.972 716 HD2 LYS 52 HD2 LYS 52 12.396 3.028 -4.806 717 HD3 LYS 52 HD1 LYS 52 10.939 2.853 -5.785 718 HE2 LYS 52 HE2 LYS 52 12.049 4.011 -7.656 719 HE3 LYS 52 HE1 LYS 52 13.504 4.201 -6.680 720 HZ1 LYS 52 HZ1 LYS 52 13.296 1.646 -6.432 721 HZ2 LYS 52 HZ2 LYS 52 13.961 2.300 -7.853 722 HZ3 LYS 52 HZ3 LYS 52 12.352 1.756 -7.837 723 H PHE 53 HN PHE 53 7.633 5.791 -3.912 724 HA PHE 53 HA PHE 53 7.386 6.791 -6.521 725 HB2 PHE 53 HB2 PHE 53 5.705 5.335 -5.496 726 HB3 PHE 53 HB1 PHE 53 5.303 6.594 -4.330 727 HD1 PHE 53 HD1 PHE 53 5.343 5.790 -7.969 728 HD2 PHE 53 HD2 PHE 53 3.796 8.342 -4.880 729 HE1 PHE 53 HE1 PHE 53 3.732 6.768 -9.583 730 HE2 PHE 53 HE2 PHE 53 2.188 9.321 -6.493 731 HZ PHE 53 HZ PHE 53 2.155 8.534 -8.845 732 H GLN 54 HN GLN 54 6.784 8.340 -3.376 733 HA GLN 54 HA GLN 54 5.892 10.825 -4.361 734 HB2 GLN 54 HB2 GLN 54 7.276 10.077 -1.779 735 HB3 GLN 54 HB1 GLN 54 6.626 11.684 -2.103 736 HG2 GLN 54 HG2 GLN 54 4.389 10.708 -2.464 737 HG3 GLN 54 HG1 GLN 54 5.043 9.101 -2.144 738 HE21 GLN 54 HE21 GLN 54 3.281 11.435 -0.645 739 HE22 GLN 54 HE22 GLN 54 3.775 11.192 0.960 740 H LYS 55 HN LYS 55 9.150 9.638 -3.589 741 HA LYS 55 HA LYS 55 10.513 12.081 -3.885 742 HB2 LYS 55 HB2 LYS 55 11.395 9.216 -4.257 743 HB3 LYS 55 HB1 LYS 55 12.504 10.579 -4.380 744 HG2 LYS 55 HG2 LYS 55 10.727 10.380 -1.972 745 HG3 LYS 55 HG1 LYS 55 12.146 9.338 -2.062 746 HD2 LYS 55 HD2 LYS 55 12.435 12.275 -2.624 747 HD3 LYS 55 HD1 LYS 55 12.347 11.718 -0.957 748 HE2 LYS 55 HE2 LYS 55 14.237 10.155 -1.416 749 HE3 LYS 55 HE1 LYS 55 14.360 10.818 -3.045 750 HZ1 LYS 55 HZ1 LYS 55 15.720 12.307 -2.146 751 HZ2 LYS 55 HZ2 LYS 55 15.265 11.912 -0.558 752 HZ3 LYS 55 HZ3 LYS 55 14.342 13.019 -1.458 753 H LYS 56 HN LYS 56 9.716 9.559 -6.236 754 HA LYS 56 HA LYS 56 11.115 10.730 -8.411 755 HB2 LYS 56 HB2 LYS 56 8.845 8.740 -8.302 756 HB3 LYS 56 HB1 LYS 56 9.640 9.230 -9.797 757 HG2 LYS 56 HG2 LYS 56 11.821 8.507 -8.866 758 HG3 LYS 56 HG1 LYS 56 11.013 7.997 -7.387 759 HD2 LYS 56 HD2 LYS 56 11.181 5.992 -8.593 760 HD3 LYS 56 HD1 LYS 56 9.547 6.533 -8.974 761 HE2 LYS 56 HE2 LYS 56 10.317 7.476 -11.098 762 HE3 LYS 56 HE1 LYS 56 11.983 7.064 -10.703 763 HZ1 LYS 56 HZ1 LYS 56 10.146 5.479 -12.000 764 HZ2 LYS 56 HZ2 LYS 56 10.287 4.806 -10.447 765 HZ3 LYS 56 HZ3 LYS 56 11.668 5.007 -11.417 766 H LYS 57 HN LYS 57 7.865 11.115 -7.138 767 HA LYS 57 HA LYS 57 6.680 12.444 -9.302 768 HB2 LYS 57 HB2 LYS 57 6.193 12.608 -6.328 769 HB3 LYS 57 HB1 LYS 57 5.185 13.436 -7.509 770 HG2 LYS 57 HG2 LYS 57 5.738 10.524 -7.911 771 HG3 LYS 57 HG1 LYS 57 4.584 10.980 -6.665 772 HD2 LYS 57 HD2 LYS 57 4.382 12.081 -9.475 773 HD3 LYS 57 HD1 LYS 57 3.667 10.530 -9.049 774 HE2 LYS 57 HE2 LYS 57 2.501 11.811 -7.118 775 HE3 LYS 57 HE1 LYS 57 2.958 13.272 -7.989 776 HZ1 LYS 57 HZ1 LYS 57 0.852 11.474 -8.527 777 HZ2 LYS 57 HZ2 LYS 57 1.897 11.543 -9.864 778 HZ3 LYS 57 HZ3 LYS 57 1.194 12.966 -9.257 779 H ALA 58 HN ALA 58 8.617 13.728 -6.598 780 HA ALA 58 HA ALA 58 8.179 16.462 -7.123 781 HB1 ALA 58 HB1 ALA 58 10.644 16.550 -6.096 782 HB2 ALA 58 HB2 ALA 58 10.249 14.883 -5.677 783 HB3 ALA 58 HB3 ALA 58 9.231 16.202 -5.100 784 H GLY 59 HN GLY 59 10.705 14.248 -8.296 785 HA2 GLY 59 HA2 GLY 59 12.121 14.371 -10.103 786 HA3 GLY 59 HA1 GLY 59 10.895 15.391 -10.842 787 H SER 60 HN SER 60 12.586 16.233 -7.850 788 HA SER 60 HA SER 60 14.243 18.159 -9.335 789 HB2 SER 60 HB2 SER 60 12.155 19.331 -8.711 790 HB3 SER 60 HB1 SER 60 12.456 18.936 -7.021 791 HG SER 60 HG SER 60 14.568 20.006 -7.414 792 H GLN 61 HN GLN 61 14.917 15.719 -7.910 793 HA GLN 61 HA GLN 61 16.516 16.853 -5.692 794 HB2 GLN 61 HB2 GLN 61 15.366 14.085 -6.044 795 HB3 GLN 61 HB1 GLN 61 16.596 14.477 -4.839 796 HG2 GLN 61 HG2 GLN 61 15.145 16.112 -3.799 797 HG3 GLN 61 HG1 GLN 61 13.949 15.930 -5.081 798 HE21 GLN 61 HE21 GLN 61 13.648 15.402 -2.132 799 HE22 GLN 61 HE22 GLN 61 13.156 13.783 -2.016 800 H SER 62 HN SER 62 16.928 16.338 -8.757 801 HA SER 62 HA SER 62 19.365 14.704 -8.585 802 HB2 SER 62 HB2 SER 62 17.417 14.711 -10.471 803 HB3 SER 62 HB1 SER 62 18.548 15.859 -11.184 804 HG SER 62 HG SER 62 20.180 14.174 -10.637 Start of MODEL 15 1 H1 MET 76 HT1 MET 76 0.139 -18.227 -11.945 2 H2 MET 76 HT2 MET 76 -0.198 -18.869 -13.481 3 H3 MET 76 HT3 MET 76 -1.459 -18.599 -12.374 4 HA MET 76 HA MET 76 -0.744 -16.904 -14.343 5 HB2 MET 76 HB2 MET 76 -2.834 -17.006 -12.897 6 HB3 MET 76 HB1 MET 76 -1.951 -16.063 -11.697 7 HG2 MET 76 HG2 MET 76 -1.608 -14.263 -13.329 8 HG3 MET 76 HG1 MET 76 -2.423 -15.213 -14.570 9 HE1 MET 76 HE1 MET 76 -4.424 -13.150 -14.969 10 HE2 MET 76 HE2 MET 76 -3.010 -12.511 -14.134 11 HE3 MET 76 HE3 MET 76 -4.624 -12.131 -13.538 12 H LYS 77 HN LYS 77 1.742 -17.178 -13.770 13 HA LYS 77 HA LYS 77 2.562 -14.751 -12.280 14 HB2 LYS 77 HB2 LYS 77 3.236 -16.824 -11.113 15 HB3 LYS 77 HB1 LYS 77 4.085 -17.354 -12.564 16 HG2 LYS 77 HG2 LYS 77 5.561 -15.392 -12.442 17 HG3 LYS 77 HG1 LYS 77 4.691 -14.812 -11.022 18 HD2 LYS 77 HD2 LYS 77 5.327 -16.869 -9.802 19 HD3 LYS 77 HD1 LYS 77 6.221 -17.423 -11.218 20 HE2 LYS 77 HE2 LYS 77 6.778 -14.845 -9.721 21 HE3 LYS 77 HE1 LYS 77 7.703 -16.335 -9.541 22 HZ1 LYS 77 HZ1 LYS 77 7.649 -15.970 -12.218 23 HZ2 LYS 77 HZ2 LYS 77 8.935 -15.532 -11.197 24 HZ3 LYS 77 HZ3 LYS 77 7.771 -14.378 -11.646 25 H ASP 78 HN ASP 78 3.424 -13.249 -13.562 26 HA ASP 78 HA ASP 78 4.958 -14.107 -15.930 27 HB2 ASP 78 HB2 ASP 78 2.793 -12.006 -15.796 28 HB3 ASP 78 HB1 ASP 78 3.977 -12.079 -17.100 29 H THR 79 HN THR 79 6.235 -12.207 -16.824 30 HA THR 79 HA THR 79 8.168 -11.356 -15.106 31 HB THR 79 HB THR 79 8.779 -10.775 -17.222 32 HG1 THR 79 HG1 THR 79 8.913 -8.837 -16.061 33 HG21 THR 79 HG21 THR 79 5.852 -10.183 -17.597 34 HG22 THR 79 HG22 THR 79 6.857 -11.366 -18.433 35 HG23 THR 79 HG23 THR 79 7.034 -9.649 -18.791 36 H ASP 80 HN ASP 80 5.859 -8.944 -16.284 37 HA ASP 80 HA ASP 80 5.957 -6.834 -14.849 38 HB2 ASP 80 HB2 ASP 80 3.510 -6.723 -14.531 39 HB3 ASP 80 HB1 ASP 80 3.952 -7.319 -16.130 40 H SER 81 HN SER 81 6.490 -6.233 -12.897 41 HA SER 81 HA SER 81 6.352 -8.043 -10.644 42 HB2 SER 81 HB2 SER 81 7.302 -5.179 -10.867 43 HB3 SER 81 HB1 SER 81 7.449 -6.178 -9.424 44 HG SER 81 HG SER 81 9.249 -6.779 -10.336 45 H GLU 82 HN GLU 82 4.153 -5.944 -12.035 46 HA GLU 82 HA GLU 82 3.009 -4.581 -9.900 47 HB2 GLU 82 HB2 GLU 82 0.949 -4.568 -11.206 48 HB3 GLU 82 HB1 GLU 82 2.331 -4.302 -12.264 49 HG2 GLU 82 HG2 GLU 82 1.155 -5.929 -13.447 50 HG3 GLU 82 HG1 GLU 82 2.300 -6.902 -12.531 51 H GLU 83 HN GLU 83 2.828 -7.916 -10.820 52 HA GLU 83 HA GLU 83 0.661 -8.661 -9.111 53 HB2 GLU 83 HB2 GLU 83 1.342 -10.947 -9.573 54 HB3 GLU 83 HB1 GLU 83 1.430 -10.011 -11.065 55 HG2 GLU 83 HG2 GLU 83 3.886 -9.647 -10.592 56 HG3 GLU 83 HG1 GLU 83 3.737 -10.788 -9.259 57 H GLU 84 HN GLU 84 4.169 -8.488 -8.760 58 HA GLU 84 HA GLU 84 4.414 -9.873 -6.316 59 HB2 GLU 84 HB2 GLU 84 6.327 -9.303 -7.775 60 HB3 GLU 84 HB1 GLU 84 6.105 -7.598 -7.386 61 HG2 GLU 84 HG2 GLU 84 6.532 -8.052 -5.016 62 HG3 GLU 84 HG1 GLU 84 6.680 -9.775 -5.355 63 H ILE 85 HN ILE 85 4.012 -6.410 -7.008 64 HA ILE 85 HA ILE 85 3.968 -5.572 -4.298 65 HB ILE 85 HB ILE 85 2.904 -4.310 -6.833 66 HG12 ILE 85 HG12 ILE 85 5.458 -4.602 -6.206 67 HG13 ILE 85 HG11 ILE 85 4.879 -3.073 -6.863 68 HG21 ILE 85 HG21 ILE 85 1.539 -3.357 -5.165 69 HG22 ILE 85 HG22 ILE 85 2.875 -2.216 -5.302 70 HG23 ILE 85 HG23 ILE 85 2.832 -3.369 -3.967 71 HD11 ILE 85 HD11 ILE 85 6.363 -3.003 -4.730 72 HD12 ILE 85 HD12 ILE 85 4.916 -3.540 -3.881 73 HD13 ILE 85 HD13 ILE 85 4.905 -2.015 -4.760 74 H ARG 86 HN ARG 86 1.532 -6.590 -6.594 75 HA ARG 86 HA ARG 86 -0.797 -5.959 -5.171 76 HB2 ARG 86 HB2 ARG 86 -0.676 -6.644 -7.562 77 HB3 ARG 86 HB1 ARG 86 -0.305 -8.285 -7.037 78 HG2 ARG 86 HG2 ARG 86 -2.447 -8.409 -5.848 79 HG3 ARG 86 HG1 ARG 86 -2.823 -6.756 -6.334 80 HD2 ARG 86 HD2 ARG 86 -2.717 -7.417 -8.702 81 HD3 ARG 86 HD1 ARG 86 -2.319 -9.066 -8.232 82 HE ARG 86 HE ARG 86 -4.730 -8.343 -6.965 83 HH11 ARG 86 HH21 ARG 86 -3.411 -8.902 -10.116 84 HH12 ARG 86 HH22 ARG 86 -4.906 -9.450 -10.797 85 HH21 ARG 86 HH11 ARG 86 -6.697 -9.061 -7.853 86 HH22 ARG 86 HH12 ARG 86 -6.766 -9.539 -9.516 87 H GLU 87 HN GLU 87 1.362 -8.752 -5.027 88 HA GLU 87 HA GLU 87 -0.220 -10.492 -3.516 89 HB2 GLU 87 HB2 GLU 87 1.936 -11.124 -4.552 90 HB3 GLU 87 HB1 GLU 87 2.783 -10.129 -3.368 91 HG2 GLU 87 HG2 GLU 87 1.902 -11.505 -1.541 92 HG3 GLU 87 HG1 GLU 87 0.977 -12.469 -2.691 93 H ALA 88 HN ALA 88 1.923 -7.865 -2.508 94 HA ALA 88 HA ALA 88 1.767 -8.255 0.277 95 HB1 ALA 88 HB1 ALA 88 2.521 -5.957 0.469 96 HB2 ALA 88 HB2 ALA 88 2.028 -5.618 -1.190 97 HB3 ALA 88 HB3 ALA 88 3.370 -6.719 -0.877 98 H PHE 89 HN PHE 89 -0.432 -6.672 -1.991 99 HA PHE 89 HA PHE 89 -2.067 -5.519 0.083 100 HB2 PHE 89 HB2 PHE 89 -2.403 -5.883 -2.889 101 HB3 PHE 89 HB1 PHE 89 -3.718 -5.280 -1.876 102 HD1 PHE 89 HD2 PHE 89 -3.461 -3.170 -0.603 103 HD2 PHE 89 HD1 PHE 89 -0.446 -4.537 -3.335 104 HE1 PHE 89 HE2 PHE 89 -2.429 -0.916 -0.591 105 HE2 PHE 89 HE1 PHE 89 0.599 -2.285 -3.318 106 HZ PHE 89 HZ PHE 89 -0.402 -0.474 -1.946 107 H ARG 90 HN ARG 90 -2.177 -8.397 -1.967 108 HA ARG 90 HA ARG 90 -4.630 -9.442 -1.451 109 HB2 ARG 90 HB2 ARG 90 -2.041 -10.583 -2.086 110 HB3 ARG 90 HB1 ARG 90 -2.977 -11.666 -1.065 111 HG2 ARG 90 HG2 ARG 90 -3.528 -12.190 -3.347 112 HG3 ARG 90 HG1 ARG 90 -4.918 -11.346 -2.672 113 HD2 ARG 90 HD2 ARG 90 -3.793 -9.201 -3.616 114 HD3 ARG 90 HD1 ARG 90 -2.827 -10.316 -4.578 115 HE ARG 90 HE ARG 90 -5.666 -9.761 -4.899 116 HH11 ARG 90 HH21 ARG 90 -2.973 -11.836 -5.548 117 HH12 ARG 90 HH22 ARG 90 -3.692 -12.558 -6.949 118 HH21 ARG 90 HH11 ARG 90 -6.613 -10.703 -6.735 119 HH22 ARG 90 HH12 ARG 90 -5.753 -11.917 -7.621 120 H VAL 91 HN VAL 91 -1.984 -9.138 0.814 121 HA VAL 91 HA VAL 91 -2.938 -10.862 2.821 122 HB VAL 91 HB VAL 91 -1.209 -8.385 2.932 123 HG11 VAL 91 HG11 VAL 91 -1.825 -8.420 5.151 124 HG12 VAL 91 HG12 VAL 91 -0.660 -9.740 5.218 125 HG13 VAL 91 HG13 VAL 91 -2.376 -10.094 5.076 126 HG21 VAL 91 HG21 VAL 91 -0.678 -10.861 1.920 127 HG22 VAL 91 HG22 VAL 91 -0.215 -11.095 3.606 128 HG23 VAL 91 HG23 VAL 91 0.545 -9.821 2.652 129 H PHE 92 HN PHE 92 -3.613 -7.430 2.152 130 HA PHE 92 HA PHE 92 -5.346 -7.237 4.478 131 HB2 PHE 92 HB2 PHE 92 -5.060 -5.251 2.216 132 HB3 PHE 92 HB1 PHE 92 -5.690 -4.949 3.832 133 HD1 PHE 92 HD2 PHE 92 -3.880 -5.994 5.729 134 HD2 PHE 92 HD1 PHE 92 -2.952 -4.326 1.878 135 HE1 PHE 92 HE2 PHE 92 -1.592 -5.476 6.505 136 HE2 PHE 92 HE1 PHE 92 -0.664 -3.813 2.663 137 HZ PHE 92 HZ PHE 92 0.020 -4.384 4.972 138 H ASP 93 HN ASP 93 -5.612 -7.906 1.068 139 HA ASP 93 HA ASP 93 -8.536 -7.664 1.125 140 HB2 ASP 93 HB2 ASP 93 -7.289 -6.890 -0.880 141 HB3 ASP 93 HB1 ASP 93 -6.717 -8.532 -1.129 142 H LYS 94 HN LYS 94 -9.238 -9.374 2.436 143 HA LYS 94 HA LYS 94 -8.252 -12.075 1.820 144 HB2 LYS 94 HB2 LYS 94 -10.244 -11.416 3.970 145 HB3 LYS 94 HB1 LYS 94 -9.067 -12.730 3.910 146 HG2 LYS 94 HG2 LYS 94 -7.239 -11.038 4.048 147 HG3 LYS 94 HG1 LYS 94 -8.469 -9.786 4.244 148 HD2 LYS 94 HD2 LYS 94 -9.300 -10.903 6.273 149 HD3 LYS 94 HD1 LYS 94 -8.087 -12.169 6.082 150 HE2 LYS 94 HE2 LYS 94 -6.295 -10.485 6.293 151 HE3 LYS 94 HE1 LYS 94 -7.510 -9.221 6.496 152 HZ1 LYS 94 HZ1 LYS 94 -6.400 -10.633 8.504 153 HZ2 LYS 94 HZ2 LYS 94 -7.852 -11.475 8.255 154 HZ3 LYS 94 HZ3 LYS 94 -7.881 -9.813 8.602 155 H ASP 95 HN ASP 95 -10.854 -9.980 1.229 156 HA ASP 95 HA ASP 95 -12.837 -12.058 0.790 157 HB2 ASP 95 HB2 ASP 95 -12.836 -9.119 0.052 158 HB3 ASP 95 HB1 ASP 95 -14.216 -10.204 -0.100 159 H GLY 96 HN GLY 96 -10.418 -10.327 -0.988 160 HA2 GLY 96 HA2 GLY 96 -9.546 -10.678 -3.093 161 HA3 GLY 96 HA1 GLY 96 -10.543 -12.128 -3.205 162 H ASN 97 HN ASN 97 -11.846 -8.957 -2.502 163 HA ASN 97 HA ASN 97 -13.454 -9.109 -4.951 164 HB2 ASN 97 HB2 ASN 97 -13.663 -7.411 -2.460 165 HB3 ASN 97 HB1 ASN 97 -14.697 -7.194 -3.871 166 HD21 ASN 97 HD21 ASN 97 -15.704 -8.008 -1.271 167 HD22 ASN 97 HD22 ASN 97 -16.323 -9.580 -1.437 168 H GLY 98 HN GLY 98 -10.541 -7.837 -4.073 169 HA2 GLY 98 HA2 GLY 98 -9.206 -6.509 -5.509 170 HA3 GLY 98 HA1 GLY 98 -10.674 -5.857 -6.230 171 H TYR 99 HN TYR 99 -10.880 -5.911 -2.860 172 HA TYR 99 HA TYR 99 -9.820 -3.167 -2.613 173 HB2 TYR 99 HB2 TYR 99 -12.538 -4.008 -1.606 174 HB3 TYR 99 HB1 TYR 99 -11.788 -2.421 -1.437 175 HD1 TYR 99 HD1 TYR 99 -12.756 -4.902 -4.050 176 HD2 TYR 99 HD2 TYR 99 -12.200 -0.772 -3.031 177 HE1 TYR 99 HE1 TYR 99 -13.681 -4.244 -6.252 178 HE2 TYR 99 HE2 TYR 99 -13.121 -0.106 -5.238 179 HH TYR 99 HH TYR 99 -13.882 -2.505 -7.714 180 H ILE 100 HN ILE 100 -9.484 -2.419 -0.456 181 HA ILE 100 HA ILE 100 -9.339 -4.524 1.608 182 HB ILE 100 HB ILE 100 -7.127 -4.087 2.148 183 HG12 ILE 100 HG12 ILE 100 -7.561 -1.335 0.965 184 HG13 ILE 100 HG11 ILE 100 -7.287 -1.731 2.662 185 HG21 ILE 100 HG21 ILE 100 -6.830 -3.001 -0.622 186 HG22 ILE 100 HG22 ILE 100 -7.467 -4.638 -0.411 187 HG23 ILE 100 HG23 ILE 100 -5.867 -4.230 0.204 188 HD11 ILE 100 HD11 ILE 100 -5.339 -1.659 0.395 189 HD12 ILE 100 HD12 ILE 100 -5.068 -2.812 1.702 190 HD13 ILE 100 HD13 ILE 100 -5.155 -1.086 2.053 191 H SER 101 HN SER 101 -9.799 -3.709 3.728 192 HA SER 101 HA SER 101 -11.550 -1.521 3.829 193 HB2 SER 101 HB2 SER 101 -11.545 -3.256 5.550 194 HB3 SER 101 HB1 SER 101 -9.928 -2.775 6.058 195 HG SER 101 HG SER 101 -11.129 -1.599 7.381 196 H ALA 102 HN ALA 102 -11.214 0.645 3.995 197 HA ALA 102 HA ALA 102 -8.634 1.746 3.658 198 HB1 ALA 102 HB1 ALA 102 -10.783 3.450 4.812 199 HB2 ALA 102 HB2 ALA 102 -11.093 2.717 3.238 200 HB3 ALA 102 HB3 ALA 102 -9.693 3.765 3.462 201 H ALA 103 HN ALA 103 -10.646 1.240 6.476 202 HA ALA 103 HA ALA 103 -9.258 2.788 8.351 203 HB1 ALA 103 HB1 ALA 103 -10.902 0.284 8.649 204 HB2 ALA 103 HB2 ALA 103 -11.375 1.951 8.978 205 HB3 ALA 103 HB3 ALA 103 -10.221 1.136 10.035 206 H GLU 104 HN GLU 104 -8.651 -0.612 7.427 207 HA GLU 104 HA GLU 104 -6.663 -1.047 9.411 208 HB2 GLU 104 HB2 GLU 104 -6.152 -3.075 8.317 209 HB3 GLU 104 HB1 GLU 104 -7.875 -2.836 8.059 210 HG2 GLU 104 HG2 GLU 104 -7.362 -3.239 5.888 211 HG3 GLU 104 HG1 GLU 104 -6.843 -1.565 5.887 212 H LEU 105 HN LEU 105 -6.598 0.407 6.262 213 HA LEU 105 HA LEU 105 -3.831 0.267 5.743 214 HB2 LEU 105 HB2 LEU 105 -5.542 0.939 4.070 215 HB3 LEU 105 HB1 LEU 105 -5.764 2.454 4.940 216 HG LEU 105 HG LEU 105 -2.953 1.978 4.418 217 HD11 LEU 105 HD11 LEU 105 -3.739 0.736 2.470 218 HD12 LEU 105 HD12 LEU 105 -3.120 2.300 1.939 219 HD13 LEU 105 HD13 LEU 105 -4.860 2.032 2.059 220 HD21 LEU 105 HD21 LEU 105 -4.063 4.147 5.003 221 HD22 LEU 105 HD22 LEU 105 -4.865 4.118 3.432 222 HD23 LEU 105 HD23 LEU 105 -3.109 4.244 3.523 223 H ARG 106 HN ARG 106 -5.776 2.807 7.315 224 HA ARG 106 HA ARG 106 -3.731 4.616 7.875 225 HB2 ARG 106 HB2 ARG 106 -6.016 5.246 8.229 226 HB3 ARG 106 HB1 ARG 106 -6.273 3.934 9.371 227 HG2 ARG 106 HG2 ARG 106 -6.035 6.114 10.514 228 HG3 ARG 106 HG1 ARG 106 -4.746 5.016 10.979 229 HD2 ARG 106 HD2 ARG 106 -3.195 6.120 9.529 230 HD3 ARG 106 HD1 ARG 106 -4.481 7.083 8.803 231 HE ARG 106 HE ARG 106 -3.205 7.529 11.380 232 HH11 ARG 106 HH21 ARG 106 -5.866 8.142 9.257 233 HH12 ARG 106 HH22 ARG 106 -6.328 9.619 10.036 234 HH21 ARG 106 HH11 ARG 106 -3.807 9.463 12.411 235 HH22 ARG 106 HH12 ARG 106 -5.162 10.366 11.822 236 H HIS 107 HN HIS 107 -4.972 1.970 9.961 237 HA HIS 107 HA HIS 107 -3.077 2.352 12.028 238 HB2 HIS 107 HB2 HIS 107 -5.112 1.135 12.441 239 HB3 HIS 107 HB1 HIS 107 -4.705 -0.057 11.208 240 HD1 HIS 107 HD1 HIS 107 -3.237 1.280 14.471 241 HD2 HIS 107 HD2 HIS 107 -3.348 -2.226 12.217 242 HE1 HIS 107 HE1 HIS 107 -2.043 -0.488 15.838 243 HE2 HIS 107 HE2 HIS 107 -2.097 -2.632 14.475 244 H VAL 108 HN VAL 108 -3.141 0.092 9.298 245 HA VAL 108 HA VAL 108 -0.762 -1.284 9.878 246 HB VAL 108 HB VAL 108 -2.255 -0.822 7.298 247 HG11 VAL 108 HG11 VAL 108 -0.051 -1.315 6.569 248 HG12 VAL 108 HG12 VAL 108 -0.871 -2.875 6.578 249 HG13 VAL 108 HG13 VAL 108 0.220 -2.446 7.893 250 HG21 VAL 108 HG21 VAL 108 -2.819 -2.356 9.540 251 HG22 VAL 108 HG22 VAL 108 -2.041 -3.508 8.454 252 HG23 VAL 108 HG23 VAL 108 -3.472 -2.626 7.926 253 H MET 109 HN MET 109 -1.300 1.640 7.980 254 HA MET 109 HA MET 109 1.377 1.745 6.949 255 HB2 MET 109 HB2 MET 109 -0.970 3.562 6.912 256 HB3 MET 109 HB1 MET 109 0.618 4.300 6.699 257 HG2 MET 109 HG2 MET 109 -0.547 3.514 4.561 258 HG3 MET 109 HG1 MET 109 1.110 2.953 4.802 259 HE1 MET 109 HE1 MET 109 1.084 0.162 3.592 260 HE2 MET 109 HE2 MET 109 0.462 1.679 2.948 261 HE3 MET 109 HE3 MET 109 -0.540 0.231 2.895 262 H THR 110 HN THR 110 -0.165 2.918 9.869 263 HA THR 110 HA THR 110 2.285 4.403 10.564 264 HB THR 110 HB THR 110 0.920 5.547 12.211 265 HG1 THR 110 HG1 THR 110 -0.885 4.701 12.862 266 HG21 THR 110 HG21 THR 110 -0.978 5.584 9.966 267 HG22 THR 110 HG22 THR 110 0.710 5.787 9.498 268 HG23 THR 110 HG23 THR 110 -0.024 6.896 10.657 269 H ASN 111 HN ASN 111 0.690 1.459 11.264 270 HA ASN 111 HA ASN 111 2.000 1.265 13.901 271 HB2 ASN 111 HB2 ASN 111 -0.478 0.766 13.633 272 HB3 ASN 111 HB1 ASN 111 0.008 -0.682 12.751 273 HD21 ASN 111 HD21 ASN 111 -0.644 -2.213 14.370 274 HD22 ASN 111 HD22 ASN 111 0.095 -2.297 15.896 275 H LEU 112 HN LEU 112 1.788 -0.367 10.762 276 HA LEU 112 HA LEU 112 4.007 -2.142 11.596 277 HB2 LEU 112 HB2 LEU 112 2.057 -2.485 9.314 278 HB3 LEU 112 HB1 LEU 112 3.305 -3.629 9.791 279 HG LEU 112 HG LEU 112 0.984 -2.744 11.538 280 HD11 LEU 112 HD11 LEU 112 1.075 -5.552 10.922 281 HD12 LEU 112 HD12 LEU 112 1.114 -4.631 9.419 282 HD13 LEU 112 HD13 LEU 112 -0.202 -4.388 10.568 283 HD21 LEU 112 HD21 LEU 112 1.889 -4.931 12.749 284 HD22 LEU 112 HD22 LEU 112 2.623 -3.361 13.077 285 HD23 LEU 112 HD23 LEU 112 3.400 -4.482 11.958 286 H GLY 113 HN GLY 113 5.168 -2.939 9.463 287 HA2 GLY 113 HA2 GLY 113 6.643 -2.468 7.775 288 HA3 GLY 113 HA1 GLY 113 5.572 -1.155 7.322 289 H GLU 114 HN GLU 114 6.582 0.703 7.223 290 HA GLU 114 HA GLU 114 8.931 1.173 8.923 291 HB2 GLU 114 HB2 GLU 114 7.994 2.477 6.368 292 HB3 GLU 114 HB1 GLU 114 9.355 3.078 7.318 293 HG2 GLU 114 HG2 GLU 114 10.550 0.995 7.046 294 HG3 GLU 114 HG1 GLU 114 9.151 0.237 6.287 295 H LYS 115 HN LYS 115 5.905 1.556 9.412 296 HA LYS 115 HA LYS 115 4.520 3.025 10.500 297 HB2 LYS 115 HB2 LYS 115 7.237 3.450 11.653 298 HB3 LYS 115 HB1 LYS 115 5.861 4.372 12.262 299 HG2 LYS 115 HG2 LYS 115 4.666 2.245 12.707 300 HG3 LYS 115 HG1 LYS 115 6.065 1.347 12.119 301 HD2 LYS 115 HD2 LYS 115 7.457 2.332 13.895 302 HD3 LYS 115 HD1 LYS 115 6.068 3.250 14.480 303 HE2 LYS 115 HE2 LYS 115 4.862 1.147 14.936 304 HE3 LYS 115 HE1 LYS 115 6.244 0.225 14.345 305 HZ1 LYS 115 HZ1 LYS 115 6.249 2.080 16.663 306 HZ2 LYS 115 HZ2 LYS 115 7.601 1.232 16.081 307 HZ3 LYS 115 HZ3 LYS 115 6.284 0.386 16.743 308 H LEU 116 HN LEU 116 3.636 4.441 9.134 309 HA LEU 116 HA LEU 116 5.187 6.708 8.118 310 HB2 LEU 116 HB2 LEU 116 2.528 5.486 7.441 311 HB3 LEU 116 HB1 LEU 116 2.849 7.156 6.990 312 HG LEU 116 HG LEU 116 3.407 5.513 5.182 313 HD11 LEU 116 HD11 LEU 116 5.006 6.938 4.475 314 HD12 LEU 116 HD12 LEU 116 6.099 6.465 5.776 315 HD13 LEU 116 HD13 LEU 116 4.891 7.715 6.053 316 HD21 LEU 116 HD21 LEU 116 5.284 4.017 5.453 317 HD22 LEU 116 HD22 LEU 116 4.175 3.727 6.790 318 HD23 LEU 116 HD23 LEU 116 5.643 4.669 7.049 319 H THR 117 HN THR 117 4.330 8.908 8.304 320 HA THR 117 HA THR 117 3.141 9.353 10.938 321 HB THR 117 HB THR 117 3.793 11.685 10.594 322 HG1 THR 117 HG1 THR 117 4.267 12.412 8.677 323 HG21 THR 117 HG21 THR 117 6.016 9.830 9.704 324 HG22 THR 117 HG22 THR 117 5.484 10.011 11.375 325 HG23 THR 117 HG23 THR 117 6.200 11.380 10.524 326 H ASP 118 HN ASP 118 1.508 11.227 11.016 327 HA ASP 118 HA ASP 118 -0.795 10.498 9.593 328 HB2 ASP 118 HB2 ASP 118 -0.067 13.025 11.078 329 HB3 ASP 118 HB1 ASP 118 -1.665 12.747 10.389 330 H GLU 119 HN GLU 119 1.598 13.043 8.987 331 HA GLU 119 HA GLU 119 0.246 14.316 6.857 332 HB2 GLU 119 HB2 GLU 119 2.184 15.309 8.025 333 HB3 GLU 119 HB1 GLU 119 3.228 14.068 7.334 334 HG2 GLU 119 HG2 GLU 119 3.391 16.117 6.007 335 HG3 GLU 119 HG1 GLU 119 2.617 14.858 5.053 336 H GLU 120 HN GLU 120 2.561 11.619 6.909 337 HA GLU 120 HA GLU 120 2.678 11.314 4.075 338 HB2 GLU 120 HB2 GLU 120 3.310 9.426 6.342 339 HB3 GLU 120 HB1 GLU 120 3.575 9.029 4.654 340 HG2 GLU 120 HG2 GLU 120 4.814 11.342 6.159 341 HG3 GLU 120 HG1 GLU 120 5.642 9.878 5.649 342 H VAL 121 HN VAL 121 0.750 9.841 6.634 343 HA VAL 121 HA VAL 121 -0.596 7.946 4.996 344 HB VAL 121 HB VAL 121 -1.371 9.242 7.624 345 HG11 VAL 121 HG11 VAL 121 -3.408 8.373 7.222 346 HG12 VAL 121 HG12 VAL 121 -2.648 6.795 7.435 347 HG13 VAL 121 HG13 VAL 121 -2.839 7.463 5.822 348 HG21 VAL 121 HG21 VAL 121 -0.786 6.460 7.816 349 HG22 VAL 121 HG22 VAL 121 0.117 7.808 8.509 350 HG23 VAL 121 HG23 VAL 121 0.521 7.210 6.901 351 H ASP 122 HN ASP 122 -1.464 11.262 6.050 352 HA ASP 122 HA ASP 122 -4.027 11.314 4.957 353 HB2 ASP 122 HB2 ASP 122 -3.106 13.078 6.436 354 HB3 ASP 122 HB1 ASP 122 -2.053 13.612 5.127 355 H GLU 123 HN GLU 123 -0.894 12.053 3.465 356 HA GLU 123 HA GLU 123 -1.878 12.880 0.945 357 HB2 GLU 123 HB2 GLU 123 0.460 13.240 1.699 358 HB3 GLU 123 HB1 GLU 123 0.744 11.503 1.600 359 HG2 GLU 123 HG2 GLU 123 1.565 12.581 -0.432 360 HG3 GLU 123 HG1 GLU 123 0.174 11.577 -0.825 361 H MET 124 HN MET 124 -1.054 9.745 2.312 362 HA MET 124 HA MET 124 -1.346 8.170 -0.037 363 HB2 MET 124 HB2 MET 124 -1.600 7.514 2.912 364 HB3 MET 124 HB1 MET 124 -1.627 6.312 1.632 365 HG2 MET 124 HG2 MET 124 0.613 8.286 1.670 366 HG3 MET 124 HG1 MET 124 0.652 6.963 2.832 367 HE1 MET 124 HE1 MET 124 -0.007 4.816 2.375 368 HE2 MET 124 HE2 MET 124 1.574 4.267 1.820 369 HE3 MET 124 HE3 MET 124 0.137 3.896 0.870 370 H ILE 125 HN ILE 125 -3.572 9.205 2.520 371 HA ILE 125 HA ILE 125 -5.765 7.633 1.775 372 HB ILE 125 HB ILE 125 -5.243 9.852 3.564 373 HG12 ILE 125 HG12 ILE 125 -7.214 8.622 4.783 374 HG13 ILE 125 HG11 ILE 125 -6.952 7.372 3.572 375 HG21 ILE 125 HG21 ILE 125 -7.635 10.559 3.770 376 HG22 ILE 125 HG22 ILE 125 -7.968 9.732 2.251 377 HG23 ILE 125 HG23 ILE 125 -6.856 11.106 2.290 378 HD11 ILE 125 HD11 ILE 125 -4.880 8.509 5.461 379 HD12 ILE 125 HD12 ILE 125 -4.538 7.323 4.205 380 HD13 ILE 125 HD13 ILE 125 -5.592 6.899 5.555 381 H ARG 126 HN ARG 126 -4.767 10.848 0.712 382 HA ARG 126 HA ARG 126 -7.063 11.460 -0.794 383 HB2 ARG 126 HB2 ARG 126 -5.206 13.066 -0.189 384 HB3 ARG 126 HB1 ARG 126 -4.230 12.307 -1.445 385 HG2 ARG 126 HG2 ARG 126 -5.174 14.115 -2.592 386 HG3 ARG 126 HG1 ARG 126 -6.289 12.812 -2.991 387 HD2 ARG 126 HD2 ARG 126 -7.800 13.554 -1.174 388 HD3 ARG 126 HD1 ARG 126 -6.678 14.847 -0.772 389 HE ARG 126 HE ARG 126 -8.495 14.761 -3.035 390 HH11 ARG 126 HH21 ARG 126 -5.659 16.129 -1.599 391 HH12 ARG 126 HH22 ARG 126 -5.724 17.587 -2.532 392 HH21 ARG 126 HH11 ARG 126 -8.587 16.666 -4.260 393 HH22 ARG 126 HH12 ARG 126 -7.382 17.891 -4.039 394 H GLU 127 HN GLU 127 -4.319 9.441 -1.421 395 HA GLU 127 HA GLU 127 -5.136 9.036 -4.219 396 HB2 GLU 127 HB2 GLU 127 -2.710 8.014 -2.722 397 HB3 GLU 127 HB1 GLU 127 -3.032 7.789 -4.442 398 HG2 GLU 127 HG2 GLU 127 -2.799 10.492 -3.095 399 HG3 GLU 127 HG1 GLU 127 -1.488 9.706 -3.971 400 H ALA 128 HN ALA 128 -5.908 7.838 -1.250 401 HA ALA 128 HA ALA 128 -6.015 5.017 -2.014 402 HB1 ALA 128 HB1 ALA 128 -5.401 5.890 0.312 403 HB2 ALA 128 HB2 ALA 128 -6.574 4.585 0.242 404 HB3 ALA 128 HB3 ALA 128 -7.116 6.235 0.515 405 H ASP 129 HN ASP 129 -8.540 6.926 -0.333 406 HA ASP 129 HA ASP 129 -10.459 7.157 -2.266 407 HB2 ASP 129 HB2 ASP 129 -10.117 4.346 -1.459 408 HB3 ASP 129 HB1 ASP 129 -11.777 4.910 -1.417 409 H ILE 130 HN ILE 130 -11.417 5.137 0.385 410 HA ILE 130 HA ILE 130 -12.753 5.488 2.186 411 HB ILE 130 HB ILE 130 -11.392 8.191 2.250 412 HG12 ILE 130 HG12 ILE 130 -10.881 5.711 3.913 413 HG13 ILE 130 HG11 ILE 130 -9.940 6.113 2.476 414 HG21 ILE 130 HG21 ILE 130 -13.544 6.946 3.819 415 HG22 ILE 130 HG22 ILE 130 -13.021 8.631 3.773 416 HG23 ILE 130 HG23 ILE 130 -12.183 7.477 4.809 417 HD11 ILE 130 HD11 ILE 130 -10.294 8.030 4.788 418 HD12 ILE 130 HD12 ILE 130 -9.145 8.145 3.459 419 HD13 ILE 130 HD13 ILE 130 -8.949 6.896 4.688 420 H ASP 131 HN ASP 131 -14.161 5.621 0.004 421 HA ASP 131 HA ASP 131 -15.545 8.162 -0.263 422 HB2 ASP 131 HB2 ASP 131 -15.155 6.645 -2.213 423 HB3 ASP 131 HB1 ASP 131 -16.234 5.468 -1.465 424 H GLY 132 HN GLY 132 -15.973 8.006 2.138 425 HA2 GLY 132 HA2 GLY 132 -17.377 7.560 3.938 426 HA3 GLY 132 HA1 GLY 132 -18.630 7.795 2.722 427 H ASP 133 HN ASP 133 -16.299 5.201 2.488 428 HA ASP 133 HA ASP 133 -18.388 3.267 3.261 429 HB2 ASP 133 HB2 ASP 133 -16.606 3.251 0.837 430 HB3 ASP 133 HB1 ASP 133 -17.409 1.794 1.424 431 H GLY 134 HN GLY 134 -15.094 4.240 3.429 432 HA2 GLY 134 HA2 GLY 134 -13.447 3.517 4.884 433 HA3 GLY 134 HA1 GLY 134 -14.574 2.319 5.502 434 H GLN 135 HN GLN 135 -13.961 2.431 2.070 435 HA GLN 135 HA GLN 135 -12.190 0.076 2.321 436 HB2 GLN 135 HB2 GLN 135 -13.242 -0.831 0.264 437 HB3 GLN 135 HB1 GLN 135 -14.358 -0.735 1.629 438 HG2 GLN 135 HG2 GLN 135 -15.199 1.425 0.759 439 HG3 GLN 135 HG1 GLN 135 -14.120 1.280 -0.623 440 HE21 GLN 135 HE21 GLN 135 -15.282 0.597 -2.419 441 HE22 GLN 135 HE22 GLN 135 -16.524 -0.558 -2.394 442 H VAL 136 HN VAL 136 -10.622 -0.214 0.759 443 HA VAL 136 HA VAL 136 -10.150 2.056 -1.048 444 HB VAL 136 HB VAL 136 -8.288 0.829 0.961 445 HG11 VAL 136 HG11 VAL 136 -6.943 0.772 -0.993 446 HG12 VAL 136 HG12 VAL 136 -6.552 2.318 -0.239 447 HG13 VAL 136 HG13 VAL 136 -7.651 2.266 -1.617 448 HG21 VAL 136 HG21 VAL 136 -8.099 3.037 1.752 449 HG22 VAL 136 HG22 VAL 136 -9.801 2.900 1.313 450 HG23 VAL 136 HG23 VAL 136 -8.683 3.718 0.236 451 H ASN 137 HN ASN 137 -9.504 1.558 -3.039 452 HA ASN 137 HA ASN 137 -9.234 -1.270 -3.714 453 HB2 ASN 137 HB2 ASN 137 -9.195 -0.320 -6.088 454 HB3 ASN 137 HB1 ASN 137 -10.689 -0.109 -5.183 455 HD21 ASN 137 HD21 ASN 137 -11.506 1.980 -5.249 456 HD22 ASN 137 HD22 ASN 137 -10.582 3.380 -5.502 457 H TYR 138 HN TYR 138 -7.196 -2.084 -3.511 458 HA TYR 138 HA TYR 138 -4.869 -0.499 -3.416 459 HB2 TYR 138 HB2 TYR 138 -3.628 -2.636 -3.611 460 HB3 TYR 138 HB1 TYR 138 -4.896 -2.687 -2.390 461 HD1 TYR 138 HD1 TYR 138 -4.027 -3.698 -5.862 462 HD2 TYR 138 HD2 TYR 138 -6.739 -4.184 -2.580 463 HE1 TYR 138 HE1 TYR 138 -5.023 -5.677 -6.976 464 HE2 TYR 138 HE2 TYR 138 -7.741 -6.156 -3.679 465 HH TYR 138 HH TYR 138 -6.345 -7.849 -6.020 466 H GLU 139 HN GLU 139 -6.731 -1.301 -6.082 467 HA GLU 139 HA GLU 139 -4.797 -1.791 -8.067 468 HB2 GLU 139 HB2 GLU 139 -7.491 -0.429 -8.235 469 HB3 GLU 139 HB1 GLU 139 -6.512 -0.828 -9.648 470 HG2 GLU 139 HG2 GLU 139 -7.341 -2.867 -7.568 471 HG3 GLU 139 HG1 GLU 139 -8.251 -2.565 -9.047 472 H GLU 140 HN GLU 140 -6.236 1.349 -7.064 473 HA GLU 140 HA GLU 140 -4.745 2.946 -8.814 474 HB2 GLU 140 HB2 GLU 140 -5.937 3.560 -6.106 475 HB3 GLU 140 HB1 GLU 140 -5.235 4.785 -7.163 476 HG2 GLU 140 HG2 GLU 140 -7.443 2.904 -8.033 477 HG3 GLU 140 HG1 GLU 140 -7.743 4.514 -7.381 478 H PHE 141 HN PHE 141 -3.991 1.802 -5.569 479 HA PHE 141 HA PHE 141 -1.630 3.349 -5.205 480 HB2 PHE 141 HB2 PHE 141 -2.814 0.948 -3.919 481 HB3 PHE 141 HB1 PHE 141 -1.076 1.171 -3.721 482 HD1 PHE 141 HD2 PHE 141 -0.349 3.668 -3.178 483 HD2 PHE 141 HD1 PHE 141 -4.238 2.024 -2.383 484 HE1 PHE 141 HE2 PHE 141 -0.736 5.407 -1.458 485 HE2 PHE 141 HE1 PHE 141 -4.609 3.751 -0.655 486 HZ PHE 141 HZ PHE 141 -2.865 5.445 -0.192 487 H VAL 142 HN VAL 142 -2.189 0.127 -6.562 488 HA VAL 142 HA VAL 142 0.537 -0.472 -7.026 489 HB VAL 142 HB VAL 142 -2.006 -1.512 -8.277 490 HG11 VAL 142 HG11 VAL 142 0.892 -2.094 -8.859 491 HG12 VAL 142 HG12 VAL 142 -0.456 -1.947 -9.988 492 HG13 VAL 142 HG13 VAL 142 -0.301 -3.388 -8.982 493 HG21 VAL 142 HG21 VAL 142 -1.919 -3.060 -6.608 494 HG22 VAL 142 HG22 VAL 142 -0.849 -1.910 -5.805 495 HG23 VAL 142 HG23 VAL 142 -0.172 -3.237 -6.748 496 H GLN 143 HN GLN 143 -1.923 1.173 -8.978 497 HA GLN 143 HA GLN 143 -0.434 1.323 -11.368 498 HB2 GLN 143 HB2 GLN 143 -2.544 3.156 -10.207 499 HB3 GLN 143 HB1 GLN 143 -1.846 3.392 -11.809 500 HG2 GLN 143 HG2 GLN 143 -3.217 0.846 -10.899 501 HG3 GLN 143 HG1 GLN 143 -3.993 2.104 -11.856 502 HE21 GLN 143 HE21 GLN 143 -2.447 2.727 -13.895 503 HE22 GLN 143 HE22 GLN 143 -1.881 1.378 -14.755 504 H MET 144 HN MET 144 -0.541 3.485 -8.528 505 HA MET 144 HA MET 144 1.226 5.438 -9.563 506 HB2 MET 144 HB2 MET 144 0.682 4.564 -6.715 507 HB3 MET 144 HB1 MET 144 1.736 5.920 -7.120 508 HG2 MET 144 HG2 MET 144 -0.261 6.849 -8.457 509 HG3 MET 144 HG1 MET 144 -1.235 5.648 -7.613 510 HE1 MET 144 HE1 MET 144 -0.155 5.395 -4.751 511 HE2 MET 144 HE2 MET 144 -1.848 5.668 -5.149 512 HE3 MET 144 HE3 MET 144 -1.071 6.649 -3.907 513 H MET 145 HN MET 145 1.759 2.458 -7.737 514 HA MET 145 HA MET 145 4.601 2.724 -7.599 515 HB2 MET 145 HB2 MET 145 2.793 0.322 -7.230 516 HB3 MET 145 HB1 MET 145 4.506 0.381 -6.806 517 HG2 MET 145 HG2 MET 145 4.111 2.135 -5.189 518 HG3 MET 145 HG1 MET 145 2.435 2.293 -5.701 519 HE1 MET 145 HE1 MET 145 1.486 0.798 -2.441 520 HE2 MET 145 HE2 MET 145 1.291 2.044 -3.668 521 HE3 MET 145 HE3 MET 145 2.758 2.000 -2.694 522 H THR 146 HN THR 146 2.407 1.599 -10.020 523 HA THR 146 HA THR 146 4.621 0.288 -11.477 524 HB THR 146 HB THR 146 1.720 -0.031 -12.185 525 HG1 THR 146 HG1 THR 146 2.420 -2.078 -10.762 526 HG21 THR 146 HG21 THR 146 3.986 -0.891 -13.396 527 HG22 THR 146 HG22 THR 146 2.464 -1.779 -13.456 528 HG23 THR 146 HG23 THR 146 3.705 -2.233 -12.288 529 H ALA 147 HN ALA 147 3.374 3.219 -11.278 530 HA ALA 147 HA ALA 147 3.167 3.658 -14.193 531 HB1 ALA 147 HB1 ALA 147 2.174 5.254 -11.829 532 HB2 ALA 147 HB2 ALA 147 1.219 4.493 -13.102 533 HB3 ALA 147 HB3 ALA 147 2.214 5.902 -13.470 534 H LYS 148 HN LYS 148 5.546 3.455 -14.258 535 HA LYS 148 HA LYS 148 6.783 6.031 -14.245 536 HB2 LYS 148 HB2 LYS 148 7.042 4.406 -11.862 537 HB3 LYS 148 HB1 LYS 148 8.613 4.626 -12.630 538 HG2 LYS 148 HG2 LYS 148 6.737 6.951 -12.137 539 HG3 LYS 148 HG1 LYS 148 7.909 6.419 -10.936 540 HD2 LYS 148 HD2 LYS 148 9.718 7.116 -12.175 541 HD3 LYS 148 HD1 LYS 148 8.907 6.844 -13.716 542 HE2 LYS 148 HE2 LYS 148 9.199 9.257 -13.284 543 HE3 LYS 148 HE1 LYS 148 7.490 8.826 -13.326 544 HZ1 LYS 148 HZ1 LYS 148 8.762 10.141 -11.307 545 HZ2 LYS 148 HZ2 LYS 148 8.624 8.555 -10.715 546 HZ3 LYS 148 HZ3 LYS 148 7.238 9.403 -11.209 547 H PHE 30 HT1 PHE 30 -9.802 -4.529 13.283 548 HA PHE 30 HA PHE 30 -9.146 -4.403 10.786 549 HB2 PHE 30 HB2 PHE 30 -6.387 -4.869 11.510 550 HB3 PHE 30 HB1 PHE 30 -7.047 -3.705 10.362 551 HD1 PHE 30 HD2 PHE 30 -8.062 -1.526 11.311 552 HD2 PHE 30 HD1 PHE 30 -5.483 -4.122 13.562 553 HE1 PHE 30 HE2 PHE 30 -7.570 0.327 12.883 554 HE2 PHE 30 HE1 PHE 30 -4.992 -2.267 15.134 555 HZ PHE 30 HZ PHE 30 -6.036 -0.044 14.796 556 H ASP 31 HN ASP 31 -9.845 -6.438 10.490 557 HA ASP 31 HA ASP 31 -9.412 -8.560 12.345 558 HB2 ASP 31 HB2 ASP 31 -11.316 -8.328 10.640 559 HB3 ASP 31 HB1 ASP 31 -10.160 -8.905 9.440 560 H ILE 32 HN ILE 32 -7.242 -7.036 10.589 561 HA ILE 32 HA ILE 32 -5.803 -9.168 9.318 562 HB ILE 32 HB ILE 32 -5.049 -6.317 9.994 563 HG12 ILE 32 HG12 ILE 32 -5.338 -6.022 7.533 564 HG13 ILE 32 HG11 ILE 32 -5.939 -7.671 7.426 565 HG21 ILE 32 HG21 ILE 32 -3.500 -8.581 8.942 566 HG22 ILE 32 HG22 ILE 32 -2.944 -7.045 9.610 567 HG23 ILE 32 HG23 ILE 32 -3.443 -7.144 7.920 568 HD11 ILE 32 HD11 ILE 32 -7.939 -7.140 8.471 569 HD12 ILE 32 HD12 ILE 32 -7.598 -5.615 7.660 570 HD13 ILE 32 HD13 ILE 32 -7.232 -5.799 9.371 571 H ASP 33 HN ASP 33 -4.399 -10.526 10.240 572 HA ASP 33 HA ASP 33 -3.806 -10.305 13.060 573 HB2 ASP 33 HB2 ASP 33 -2.510 -12.426 12.625 574 HB3 ASP 33 HB1 ASP 33 -4.220 -12.507 12.209 575 H MET 34 HN MET 34 -1.924 -9.705 14.004 576 HA MET 34 HA MET 34 0.170 -8.626 12.231 577 HB2 MET 34 HB2 MET 34 -0.162 -8.152 15.198 578 HB3 MET 34 HB1 MET 34 0.843 -7.242 14.070 579 HG2 MET 34 HG2 MET 34 -2.186 -7.383 14.050 580 HG3 MET 34 HG1 MET 34 -1.212 -5.995 14.534 581 HE1 MET 34 HE1 MET 34 -2.919 -4.933 11.268 582 HE2 MET 34 HE2 MET 34 -2.068 -4.136 12.589 583 HE3 MET 34 HE3 MET 34 -3.246 -5.397 12.944 584 H ASP 35 HN ASP 35 -0.539 -11.190 14.343 585 HA ASP 35 HA ASP 35 2.000 -11.752 15.436 586 HB2 ASP 35 HB2 ASP 35 -0.354 -13.524 14.771 587 HB3 ASP 35 HB1 ASP 35 1.097 -14.120 15.576 588 H ALA 36 HN ALA 36 0.481 -12.673 12.374 589 HA ALA 36 HA ALA 36 2.503 -14.458 11.542 590 HB1 ALA 36 HB1 ALA 36 0.128 -13.212 10.389 591 HB2 ALA 36 HB2 ALA 36 0.798 -14.820 10.117 592 HB3 ALA 36 HB3 ALA 36 1.421 -13.441 9.211 593 HA PRO 37 HA PRO 37 5.573 -11.333 10.578 594 HB2 PRO 37 HB2 PRO 37 7.376 -12.839 9.233 595 HB3 PRO 37 HB1 PRO 37 7.181 -12.905 10.996 596 HG2 PRO 37 HG2 PRO 37 6.113 -14.723 8.909 597 HG3 PRO 37 HG1 PRO 37 6.835 -15.110 10.477 598 HD2 PRO 37 HD2 PRO 37 4.143 -15.113 10.059 599 HD3 PRO 37 HD1 PRO 37 4.867 -14.711 11.633 600 H GLU 38 HN GLU 38 3.966 -13.251 8.187 601 HA GLU 38 HA GLU 38 5.022 -12.119 5.832 602 HB2 GLU 38 HB2 GLU 38 2.343 -13.378 6.438 603 HB3 GLU 38 HB1 GLU 38 2.831 -12.878 4.818 604 HG2 GLU 38 HG2 GLU 38 4.729 -14.377 4.858 605 HG3 GLU 38 HG1 GLU 38 4.438 -14.772 6.551 606 H THR 39 HN THR 39 2.312 -11.144 7.901 607 HA THR 39 HA THR 39 1.313 -9.103 6.234 608 HB THR 39 HB THR 39 1.229 -9.312 9.252 609 HG1 THR 39 HG1 THR 39 -0.781 -10.251 8.836 610 HG21 THR 39 HG21 THR 39 -0.174 -7.549 7.247 611 HG22 THR 39 HG22 THR 39 0.644 -7.084 8.740 612 HG23 THR 39 HG23 THR 39 -0.908 -7.918 8.808 613 H GLU 40 HN GLU 40 3.707 -9.023 8.857 614 HA GLU 40 HA GLU 40 4.162 -6.239 8.803 615 HB2 GLU 40 HB2 GLU 40 4.927 -7.719 10.633 616 HB3 GLU 40 HB1 GLU 40 6.097 -8.454 9.536 617 HG2 GLU 40 HG2 GLU 40 7.209 -6.293 9.228 618 HG3 GLU 40 HG1 GLU 40 6.006 -5.507 10.249 619 H ARG 41 HN ARG 41 5.712 -8.926 7.076 620 HA ARG 41 HA ARG 41 7.693 -7.399 5.768 621 HB2 ARG 41 HB2 ARG 41 6.354 -10.016 5.056 622 HB3 ARG 41 HB1 ARG 41 7.695 -9.338 4.133 623 HG2 ARG 41 HG2 ARG 41 7.985 -9.613 7.107 624 HG3 ARG 41 HG1 ARG 41 8.158 -11.049 6.101 625 HD2 ARG 41 HD2 ARG 41 9.706 -8.477 5.664 626 HD3 ARG 41 HD1 ARG 41 10.327 -9.869 6.540 627 HE ARG 41 HE ARG 41 9.471 -10.823 4.074 628 HH11 ARG 41 HH21 ARG 41 11.733 -8.524 5.327 629 HH12 ARG 41 HH22 ARG 41 12.856 -8.710 4.022 630 HH21 ARG 41 HH11 ARG 41 10.939 -11.074 2.359 631 HH22 ARG 41 HH12 ARG 41 12.407 -10.155 2.342 632 H ALA 42 HN ALA 42 4.378 -8.256 4.864 633 HA ALA 42 HA ALA 42 4.435 -7.243 2.233 634 HB1 ALA 42 HB1 ALA 42 2.541 -8.495 2.562 635 HB2 ALA 42 HB2 ALA 42 1.859 -6.895 2.855 636 HB3 ALA 42 HB3 ALA 42 2.318 -7.919 4.214 637 H ALA 43 HN ALA 43 3.682 -5.721 5.332 638 HA ALA 43 HA ALA 43 2.802 -3.235 4.348 639 HB1 ALA 43 HB1 ALA 43 2.787 -2.560 6.539 640 HB2 ALA 43 HB2 ALA 43 4.334 -3.326 6.899 641 HB3 ALA 43 HB3 ALA 43 2.870 -4.304 6.792 642 H VAL 44 HN VAL 44 6.026 -4.453 5.145 643 HA VAL 44 HA VAL 44 7.438 -2.035 4.911 644 HB VAL 44 HB VAL 44 8.291 -4.898 4.469 645 HG11 VAL 44 HG11 VAL 44 9.746 -2.314 4.133 646 HG12 VAL 44 HG12 VAL 44 9.989 -3.855 3.310 647 HG13 VAL 44 HG13 VAL 44 10.602 -3.623 4.947 648 HG21 VAL 44 HG21 VAL 44 7.645 -4.325 6.764 649 HG22 VAL 44 HG22 VAL 44 8.689 -2.904 6.724 650 HG23 VAL 44 HG23 VAL 44 9.394 -4.519 6.671 651 H ALA 45 HN ALA 45 6.725 -4.530 2.458 652 HA ALA 45 HA ALA 45 8.193 -3.364 0.362 653 HB1 ALA 45 HB1 ALA 45 6.212 -4.579 -0.990 654 HB2 ALA 45 HB2 ALA 45 5.999 -5.344 0.586 655 HB3 ALA 45 HB3 ALA 45 7.547 -5.462 -0.250 656 H ILE 46 HN ILE 46 4.762 -2.975 1.248 657 HA ILE 46 HA ILE 46 4.178 -1.159 -0.856 658 HB ILE 46 HB ILE 46 2.807 -1.711 1.776 659 HG12 ILE 46 HG12 ILE 46 1.994 -2.384 -1.065 660 HG13 ILE 46 HG11 ILE 46 2.921 -3.486 -0.045 661 HG21 ILE 46 HG21 ILE 46 2.326 0.341 -0.313 662 HG22 ILE 46 HG22 ILE 46 1.860 0.336 1.387 663 HG23 ILE 46 HG23 ILE 46 0.908 -0.565 0.210 664 HD11 ILE 46 HD11 ILE 46 0.582 -2.383 1.320 665 HD12 ILE 46 HD12 ILE 46 1.101 -4.062 1.161 666 HD13 ILE 46 HD13 ILE 46 0.156 -3.305 -0.122 667 H GLN 47 HN GLN 47 4.948 -0.659 2.586 668 HA GLN 47 HA GLN 47 4.781 2.167 2.494 669 HB2 GLN 47 HB2 GLN 47 6.192 0.279 4.379 670 HB3 GLN 47 HB1 GLN 47 6.156 2.026 4.616 671 HG2 GLN 47 HG2 GLN 47 3.678 1.968 4.576 672 HG3 GLN 47 HG1 GLN 47 3.732 0.217 4.383 673 HE21 GLN 47 HE21 GLN 47 2.892 -0.443 6.411 674 HE22 GLN 47 HE22 GLN 47 3.608 -0.038 7.895 675 H SER 48 HN SER 48 7.487 -0.080 2.061 676 HA SER 48 HA SER 48 9.536 1.859 1.908 677 HB2 SER 48 HB2 SER 48 10.011 -0.535 2.183 678 HB3 SER 48 HB1 SER 48 9.353 -0.859 0.581 679 HG SER 48 HG SER 48 11.798 0.084 1.312 680 H GLN 49 HN GLN 49 7.486 0.359 -0.554 681 HA GLN 49 HA GLN 49 8.644 1.609 -2.802 682 HB2 GLN 49 HB2 GLN 49 7.089 -0.365 -2.855 683 HB3 GLN 49 HB1 GLN 49 5.765 0.737 -2.486 684 HG2 GLN 49 HG2 GLN 49 5.861 0.399 -4.895 685 HG3 GLN 49 HG1 GLN 49 6.340 2.054 -4.526 686 HE21 GLN 49 HE21 GLN 49 8.061 2.642 -5.848 687 HE22 GLN 49 HE22 GLN 49 9.361 1.631 -6.260 688 H PHE 50 HN PHE 50 6.057 2.572 -0.604 689 HA PHE 50 HA PHE 50 5.059 4.756 -2.033 690 HB2 PHE 50 HB2 PHE 50 3.849 3.930 -0.129 691 HB3 PHE 50 HB1 PHE 50 5.206 4.271 0.946 692 HD1 PHE 50 HD1 PHE 50 3.190 6.092 -1.652 693 HD2 PHE 50 HD2 PHE 50 5.018 6.209 2.239 694 HE1 PHE 50 HE1 PHE 50 2.344 8.398 -1.322 695 HE2 PHE 50 HE2 PHE 50 4.176 8.519 2.558 696 HZ PHE 50 HZ PHE 50 2.837 9.611 0.782 697 H ARG 51 HN ARG 51 7.648 4.676 0.428 698 HA ARG 51 HA ARG 51 8.170 7.443 0.391 699 HB2 ARG 51 HB2 ARG 51 9.944 5.078 1.027 700 HB3 ARG 51 HB1 ARG 51 10.442 6.754 1.259 701 HG2 ARG 51 HG2 ARG 51 8.567 7.133 2.784 702 HG3 ARG 51 HG1 ARG 51 7.986 5.489 2.509 703 HD2 ARG 51 HD2 ARG 51 9.260 5.577 4.598 704 HD3 ARG 51 HD1 ARG 51 10.124 4.606 3.408 705 HE ARG 51 HE ARG 51 10.970 7.312 3.260 706 HH11 ARG 51 HH21 ARG 51 11.164 4.455 5.204 707 HH12 ARG 51 HH22 ARG 51 12.712 4.848 5.872 708 HH21 ARG 51 HH11 ARG 51 13.002 7.834 4.132 709 HH22 ARG 51 HH12 ARG 51 13.753 6.760 5.266 710 H LYS 52 HN LYS 52 9.468 4.775 -1.551 711 HA LYS 52 HA LYS 52 11.419 6.262 -2.957 712 HB2 LYS 52 HB2 LYS 52 11.342 3.793 -2.958 713 HB3 LYS 52 HB1 LYS 52 9.840 3.845 -3.882 714 HG2 LYS 52 HG2 LYS 52 10.991 4.993 -5.727 715 HG3 LYS 52 HG1 LYS 52 12.491 5.000 -4.800 716 HD2 LYS 52 HD2 LYS 52 12.528 2.552 -4.790 717 HD3 LYS 52 HD1 LYS 52 10.986 2.507 -5.646 718 HE2 LYS 52 HE2 LYS 52 12.831 2.185 -7.229 719 HE3 LYS 52 HE1 LYS 52 12.024 3.721 -7.545 720 HZ1 LYS 52 HZ1 LYS 52 13.981 4.696 -7.298 721 HZ2 LYS 52 HZ2 LYS 52 14.717 3.241 -6.824 722 HZ3 LYS 52 HZ3 LYS 52 13.982 4.240 -5.664 723 H PHE 53 HN PHE 53 8.009 5.602 -3.558 724 HA PHE 53 HA PHE 53 7.767 6.762 -6.098 725 HB2 PHE 53 HB2 PHE 53 6.017 5.369 -5.095 726 HB3 PHE 53 HB1 PHE 53 5.725 6.599 -3.868 727 HD1 PHE 53 HD1 PHE 53 5.651 5.965 -7.539 728 HD2 PHE 53 HD2 PHE 53 4.326 8.464 -4.307 729 HE1 PHE 53 HE1 PHE 53 4.089 7.124 -9.078 730 HE2 PHE 53 HE2 PHE 53 2.764 9.624 -5.845 731 HZ PHE 53 HZ PHE 53 2.647 8.955 -8.230 732 H GLN 54 HN GLN 54 7.354 8.190 -2.861 733 HA GLN 54 HA GLN 54 6.586 10.760 -3.710 734 HB2 GLN 54 HB2 GLN 54 8.002 9.836 -1.205 735 HB3 GLN 54 HB1 GLN 54 7.436 11.488 -1.450 736 HG2 GLN 54 HG2 GLN 54 5.138 10.623 -1.823 737 HG3 GLN 54 HG1 GLN 54 5.723 8.990 -1.505 738 HE21 GLN 54 HE21 GLN 54 4.175 11.527 -0.011 739 HE22 GLN 54 HE22 GLN 54 4.632 11.221 1.596 740 H LYS 55 HN LYS 55 9.791 9.344 -3.162 741 HA LYS 55 HA LYS 55 11.295 11.711 -3.421 742 HB2 LYS 55 HB2 LYS 55 11.980 8.829 -4.022 743 HB3 LYS 55 HB1 LYS 55 13.156 10.140 -4.109 744 HG2 LYS 55 HG2 LYS 55 12.710 10.704 -1.750 745 HG3 LYS 55 HG1 LYS 55 11.533 9.396 -1.658 746 HD2 LYS 55 HD2 LYS 55 13.297 7.758 -2.191 747 HD3 LYS 55 HD1 LYS 55 14.480 9.064 -2.292 748 HE2 LYS 55 HE2 LYS 55 14.056 9.637 0.068 749 HE3 LYS 55 HE1 LYS 55 12.868 8.339 0.174 750 HZ1 LYS 55 HZ1 LYS 55 14.971 7.588 1.025 751 HZ2 LYS 55 HZ2 LYS 55 15.764 8.036 -0.408 752 HZ3 LYS 55 HZ3 LYS 55 14.635 6.767 -0.420 753 H LYS 56 HN LYS 56 10.080 9.413 -5.819 754 HA LYS 56 HA LYS 56 11.416 10.468 -8.067 755 HB2 LYS 56 HB2 LYS 56 8.792 8.990 -7.792 756 HB3 LYS 56 HB1 LYS 56 9.508 9.403 -9.349 757 HG2 LYS 56 HG2 LYS 56 11.186 7.978 -7.310 758 HG3 LYS 56 HG1 LYS 56 10.007 7.057 -8.240 759 HD2 LYS 56 HD2 LYS 56 11.018 7.920 -10.341 760 HD3 LYS 56 HD1 LYS 56 12.234 8.771 -9.389 761 HE2 LYS 56 HE2 LYS 56 13.153 6.644 -10.151 762 HE3 LYS 56 HE1 LYS 56 12.939 6.595 -8.402 763 HZ1 LYS 56 HZ1 LYS 56 10.758 5.515 -8.815 764 HZ2 LYS 56 HZ2 LYS 56 12.091 4.584 -9.305 765 HZ3 LYS 56 HZ3 LYS 56 11.159 5.412 -10.459 766 H LYS 57 HN LYS 57 8.339 11.282 -6.535 767 HA LYS 57 HA LYS 57 7.391 13.082 -8.477 768 HB2 LYS 57 HB2 LYS 57 5.988 12.199 -6.655 769 HB3 LYS 57 HB1 LYS 57 6.946 13.092 -5.479 770 HG2 LYS 57 HG2 LYS 57 4.879 14.311 -5.994 771 HG3 LYS 57 HG1 LYS 57 6.273 15.223 -6.567 772 HD2 LYS 57 HD2 LYS 57 5.830 14.738 -8.814 773 HD3 LYS 57 HD1 LYS 57 4.882 13.301 -8.419 774 HE2 LYS 57 HE2 LYS 57 3.420 15.143 -9.161 775 HE3 LYS 57 HE1 LYS 57 3.111 14.741 -7.472 776 HZ1 LYS 57 HZ1 LYS 57 3.277 17.035 -7.461 777 HZ2 LYS 57 HZ2 LYS 57 4.550 17.063 -8.586 778 HZ3 LYS 57 HZ3 LYS 57 4.833 16.554 -6.990 779 H ALA 58 HN ALA 58 9.437 13.555 -5.627 780 HA ALA 58 HA ALA 58 9.720 16.397 -6.085 781 HB1 ALA 58 HB1 ALA 58 9.832 15.785 -3.811 782 HB2 ALA 58 HB2 ALA 58 11.508 16.107 -4.255 783 HB3 ALA 58 HB3 ALA 58 10.932 14.445 -4.136 784 H GLY 59 HN GLY 59 10.798 13.963 -7.852 785 HA2 GLY 59 HA2 GLY 59 13.588 14.216 -8.025 786 HA3 GLY 59 HA1 GLY 59 12.538 13.673 -9.331 787 H SER 60 HN SER 60 10.984 16.031 -9.594 788 HA SER 60 HA SER 60 10.992 18.151 -10.490 789 HB2 SER 60 HB2 SER 60 12.929 18.447 -8.735 790 HB3 SER 60 HB1 SER 60 13.959 18.419 -10.161 791 HG SER 60 HG SER 60 12.312 20.016 -10.982 792 H GLN 61 HN GLN 61 10.511 16.944 -12.429 793 HA GLN 61 HA GLN 61 12.446 16.042 -14.265 794 HB2 GLN 61 HB2 GLN 61 10.036 15.451 -14.355 795 HB3 GLN 61 HB1 GLN 61 9.672 17.105 -14.847 796 HG2 GLN 61 HG2 GLN 61 11.043 16.842 -16.858 797 HG3 GLN 61 HG1 GLN 61 11.500 15.216 -16.357 798 HE21 GLN 61 HE21 GLN 61 10.303 15.254 -18.787 799 HE22 GLN 61 HE22 GLN 61 8.684 14.752 -18.701 800 H SER 62 HN SER 62 10.846 19.180 -13.877 801 HA SER 62 HA SER 62 11.220 21.222 -14.875 802 HB2 SER 62 HB2 SER 62 13.226 21.070 -13.490 803 HB3 SER 62 HB1 SER 62 14.054 20.160 -14.751 804 HG SER 62 HG SER 62 14.614 22.319 -14.931 Start of MODEL 16 1 H1 MET 76 HT1 MET 76 0.870 -13.617 -25.330 2 H2 MET 76 HT2 MET 76 1.748 -12.335 -26.018 3 H3 MET 76 HT3 MET 76 0.974 -12.132 -24.519 4 HA MET 76 HA MET 76 2.467 -14.104 -23.786 5 HB2 MET 76 HB2 MET 76 3.545 -13.225 -26.406 6 HB3 MET 76 HB1 MET 76 4.738 -13.449 -25.127 7 HG2 MET 76 HG2 MET 76 3.864 -15.725 -24.710 8 HG3 MET 76 HG1 MET 76 2.686 -15.505 -26.003 9 HE1 MET 76 HE1 MET 76 2.988 -15.802 -28.300 10 HE2 MET 76 HE2 MET 76 4.485 -15.755 -29.224 11 HE3 MET 76 HE3 MET 76 3.888 -14.287 -28.457 12 H LYS 77 HN LYS 77 3.541 -13.369 -22.030 13 HA LYS 77 HA LYS 77 4.682 -10.674 -22.035 14 HB2 LYS 77 HB2 LYS 77 3.509 -10.256 -19.795 15 HB3 LYS 77 HB1 LYS 77 2.519 -10.120 -21.248 16 HG2 LYS 77 HG2 LYS 77 2.679 -12.834 -20.061 17 HG3 LYS 77 HG1 LYS 77 1.826 -11.634 -19.092 18 HD2 LYS 77 HD2 LYS 77 1.207 -11.873 -22.025 19 HD3 LYS 77 HD1 LYS 77 0.506 -13.024 -20.891 20 HE2 LYS 77 HE2 LYS 77 -0.420 -11.153 -19.565 21 HE3 LYS 77 HE1 LYS 77 0.258 -10.005 -20.718 22 HZ1 LYS 77 HZ1 LYS 77 -1.871 -10.268 -21.496 23 HZ2 LYS 77 HZ2 LYS 77 -1.951 -11.913 -21.076 24 HZ3 LYS 77 HZ3 LYS 77 -1.043 -11.421 -22.426 25 H ASP 78 HN ASP 78 6.139 -10.298 -20.279 26 HA ASP 78 HA ASP 78 7.483 -12.719 -19.418 27 HB2 ASP 78 HB2 ASP 78 9.230 -11.243 -18.637 28 HB3 ASP 78 HB1 ASP 78 8.723 -10.718 -20.241 29 H THR 79 HN THR 79 8.498 -12.343 -17.035 30 HA THR 79 HA THR 79 6.463 -12.969 -15.223 31 HB THR 79 HB THR 79 8.809 -13.558 -14.830 32 HG1 THR 79 HG1 THR 79 8.418 -11.852 -12.716 33 HG21 THR 79 HG21 THR 79 10.487 -12.051 -14.894 34 HG22 THR 79 HG22 THR 79 9.627 -10.936 -13.833 35 HG23 THR 79 HG23 THR 79 9.304 -10.930 -15.566 36 H ASP 80 HN ASP 80 5.043 -11.783 -14.125 37 HA ASP 80 HA ASP 80 5.344 -8.849 -14.157 38 HB2 ASP 80 HB2 ASP 80 3.308 -9.763 -15.220 39 HB3 ASP 80 HB1 ASP 80 2.870 -10.529 -13.694 40 H SER 81 HN SER 81 6.252 -8.118 -12.335 41 HA SER 81 HA SER 81 6.112 -9.499 -9.819 42 HB2 SER 81 HB2 SER 81 7.349 -7.601 -8.939 43 HB3 SER 81 HB1 SER 81 8.035 -8.064 -10.495 44 HG SER 81 HG SER 81 7.700 -5.806 -10.339 45 H GLU 82 HN GLU 82 3.942 -7.565 -11.460 46 HA GLU 82 HA GLU 82 2.812 -5.921 -9.534 47 HB2 GLU 82 HB2 GLU 82 2.124 -5.973 -11.920 48 HB3 GLU 82 HB1 GLU 82 1.337 -7.525 -11.637 49 HG2 GLU 82 HG2 GLU 82 -0.146 -6.486 -9.975 50 HG3 GLU 82 HG1 GLU 82 0.662 -4.939 -10.212 51 H GLU 83 HN GLU 83 2.410 -9.348 -10.096 52 HA GLU 83 HA GLU 83 0.309 -9.835 -8.256 53 HB2 GLU 83 HB2 GLU 83 0.911 -12.157 -8.462 54 HB3 GLU 83 HB1 GLU 83 1.127 -11.412 -10.045 55 HG2 GLU 83 HG2 GLU 83 3.577 -11.057 -9.401 56 HG3 GLU 83 HG1 GLU 83 3.270 -12.116 -8.027 57 H GLU 84 HN GLU 84 3.825 -9.635 -7.902 58 HA GLU 84 HA GLU 84 4.048 -10.753 -5.323 59 HB2 GLU 84 HB2 GLU 84 5.977 -10.325 -6.820 60 HB3 GLU 84 HB1 GLU 84 5.758 -8.593 -6.585 61 HG2 GLU 84 HG2 GLU 84 6.150 -8.835 -4.178 62 HG3 GLU 84 HG1 GLU 84 6.305 -10.581 -4.363 63 H ILE 85 HN ILE 85 3.669 -7.372 -6.361 64 HA ILE 85 HA ILE 85 3.605 -6.272 -3.751 65 HB ILE 85 HB ILE 85 2.566 -5.254 -6.404 66 HG12 ILE 85 HG12 ILE 85 5.114 -5.514 -5.745 67 HG13 ILE 85 HG11 ILE 85 4.555 -4.044 -6.539 68 HG21 ILE 85 HG21 ILE 85 2.493 -4.043 -3.642 69 HG22 ILE 85 HG22 ILE 85 1.206 -4.132 -4.842 70 HG23 ILE 85 HG23 ILE 85 2.554 -3.023 -5.081 71 HD11 ILE 85 HD11 ILE 85 6.037 -3.793 -4.420 72 HD12 ILE 85 HD12 ILE 85 4.587 -4.240 -3.527 73 HD13 ILE 85 HD13 ILE 85 4.586 -2.802 -4.537 74 H ARG 86 HN ARG 86 1.159 -7.518 -5.933 75 HA ARG 86 HA ARG 86 -1.161 -6.702 -4.590 76 HB2 ARG 86 HB2 ARG 86 -1.146 -7.622 -6.861 77 HB3 ARG 86 HB1 ARG 86 -0.629 -9.184 -6.231 78 HG2 ARG 86 HG2 ARG 86 -2.693 -9.461 -5.018 79 HG3 ARG 86 HG1 ARG 86 -3.198 -7.813 -5.408 80 HD2 ARG 86 HD2 ARG 86 -2.604 -9.897 -7.518 81 HD3 ARG 86 HD1 ARG 86 -4.223 -9.631 -6.865 82 HE ARG 86 HE ARG 86 -3.202 -7.150 -7.706 83 HH11 ARG 86 HH21 ARG 86 -4.156 -10.221 -8.984 84 HH12 ARG 86 HH22 ARG 86 -4.642 -9.585 -10.520 85 HH21 ARG 86 HH11 ARG 86 -3.839 -6.309 -9.715 86 HH22 ARG 86 HH12 ARG 86 -4.463 -7.370 -10.933 87 H GLU 87 HN GLU 87 0.936 -9.510 -4.144 88 HA GLU 87 HA GLU 87 -0.664 -11.007 -2.406 89 HB2 GLU 87 HB2 GLU 87 1.466 -11.812 -3.401 90 HB3 GLU 87 HB1 GLU 87 2.350 -10.723 -2.333 91 HG2 GLU 87 HG2 GLU 87 2.314 -12.952 -1.349 92 HG3 GLU 87 HG1 GLU 87 1.320 -11.878 -0.371 93 H ALA 88 HN ALA 88 1.506 -8.302 -1.793 94 HA ALA 88 HA ALA 88 1.431 -8.346 1.023 95 HB1 ALA 88 HB1 ALA 88 1.537 -5.740 -0.439 96 HB2 ALA 88 HB2 ALA 88 2.838 -6.901 -0.697 97 HB3 ALA 88 HB3 ALA 88 2.500 -6.302 0.927 98 H PHE 89 HN PHE 89 -0.811 -6.971 -1.358 99 HA PHE 89 HA PHE 89 -2.379 -5.614 0.649 100 HB2 PHE 89 HB2 PHE 89 -2.795 -6.182 -2.281 101 HB3 PHE 89 HB1 PHE 89 -4.036 -5.418 -1.285 102 HD1 PHE 89 HD2 PHE 89 -3.630 -3.224 -0.223 103 HD2 PHE 89 HD1 PHE 89 -0.757 -5.012 -2.866 104 HE1 PHE 89 HE2 PHE 89 -2.466 -1.044 -0.430 105 HE2 PHE 89 HE1 PHE 89 0.413 -2.833 -3.069 106 HZ PHE 89 HZ PHE 89 -0.445 -0.851 -1.852 107 H ARG 90 HN ARG 90 -2.591 -8.634 -1.171 108 HA ARG 90 HA ARG 90 -5.115 -9.482 -0.523 109 HB2 ARG 90 HB2 ARG 90 -2.587 -11.110 -0.754 110 HB3 ARG 90 HB1 ARG 90 -4.177 -11.842 -0.540 111 HG2 ARG 90 HG2 ARG 90 -4.972 -10.633 -2.570 112 HG3 ARG 90 HG1 ARG 90 -3.341 -10.009 -2.805 113 HD2 ARG 90 HD2 ARG 90 -2.481 -12.322 -2.969 114 HD3 ARG 90 HD1 ARG 90 -4.114 -12.938 -2.746 115 HE ARG 90 HE ARG 90 -4.106 -11.146 -4.927 116 HH11 ARG 90 HH21 ARG 90 -2.914 -14.244 -3.949 117 HH12 ARG 90 HH22 ARG 90 -2.904 -14.901 -5.552 118 HH21 ARG 90 HH11 ARG 90 -4.097 -12.000 -7.032 119 HH22 ARG 90 HH12 ARG 90 -3.574 -13.629 -7.298 120 H VAL 91 HN VAL 91 -2.354 -9.251 1.611 121 HA VAL 91 HA VAL 91 -3.253 -10.925 3.685 122 HB VAL 91 HB VAL 91 -1.485 -8.474 3.672 123 HG11 VAL 91 HG11 VAL 91 -2.262 -8.500 5.896 124 HG12 VAL 91 HG12 VAL 91 -0.828 -9.523 5.984 125 HG13 VAL 91 HG13 VAL 91 -2.432 -10.255 5.916 126 HG21 VAL 91 HG21 VAL 91 -0.925 -10.843 2.624 127 HG22 VAL 91 HG22 VAL 91 -0.653 -11.286 4.309 128 HG23 VAL 91 HG23 VAL 91 0.283 -9.982 3.578 129 H PHE 92 HN PHE 92 -3.921 -7.523 2.939 130 HA PHE 92 HA PHE 92 -5.522 -7.227 5.348 131 HB2 PHE 92 HB2 PHE 92 -5.240 -5.283 3.052 132 HB3 PHE 92 HB1 PHE 92 -5.807 -4.935 4.684 133 HD1 PHE 92 HD2 PHE 92 -4.027 -5.952 6.563 134 HD2 PHE 92 HD1 PHE 92 -3.075 -4.550 2.614 135 HE1 PHE 92 HE2 PHE 92 -1.697 -5.530 7.276 136 HE2 PHE 92 HE1 PHE 92 -0.745 -4.129 3.336 137 HZ PHE 92 HZ PHE 92 -0.053 -4.618 5.662 138 H ASP 93 HN ASP 93 -6.005 -8.076 2.032 139 HA ASP 93 HA ASP 93 -8.874 -7.507 2.126 140 HB2 ASP 93 HB2 ASP 93 -7.538 -7.166 0.026 141 HB3 ASP 93 HB1 ASP 93 -7.305 -8.910 -0.042 142 H LYS 94 HN LYS 94 -9.119 -9.006 4.031 143 HA LYS 94 HA LYS 94 -8.708 -11.807 3.697 144 HB2 LYS 94 HB2 LYS 94 -9.963 -11.996 5.778 145 HB3 LYS 94 HB1 LYS 94 -8.780 -10.696 5.895 146 HG2 LYS 94 HG2 LYS 94 -10.559 -9.052 5.359 147 HG3 LYS 94 HG1 LYS 94 -11.738 -10.361 5.305 148 HD2 LYS 94 HD2 LYS 94 -11.240 -10.917 7.655 149 HD3 LYS 94 HD1 LYS 94 -10.065 -9.602 7.715 150 HE2 LYS 94 HE2 LYS 94 -11.850 -7.976 7.208 151 HE3 LYS 94 HE1 LYS 94 -13.028 -9.287 7.144 152 HZ1 LYS 94 HZ1 LYS 94 -12.187 -7.880 9.379 153 HZ2 LYS 94 HZ2 LYS 94 -11.548 -9.446 9.539 154 HZ3 LYS 94 HZ3 LYS 94 -13.220 -9.224 9.333 155 H ASP 95 HN ASP 95 -11.297 -9.610 2.958 156 HA ASP 95 HA ASP 95 -13.358 -11.585 2.717 157 HB2 ASP 95 HB2 ASP 95 -13.105 -8.745 1.728 158 HB3 ASP 95 HB1 ASP 95 -14.536 -9.734 1.447 159 H GLY 96 HN GLY 96 -10.839 -10.386 0.643 160 HA2 GLY 96 HA2 GLY 96 -10.113 -11.129 -1.418 161 HA3 GLY 96 HA1 GLY 96 -11.251 -12.467 -1.268 162 H ASN 97 HN ASN 97 -12.324 -9.161 -0.991 163 HA ASN 97 HA ASN 97 -13.988 -9.523 -3.373 164 HB2 ASN 97 HB2 ASN 97 -13.977 -7.464 -1.161 165 HB3 ASN 97 HB1 ASN 97 -15.040 -7.372 -2.563 166 HD21 ASN 97 HD21 ASN 97 -16.012 -7.705 0.153 167 HD22 ASN 97 HD22 ASN 97 -16.761 -9.226 0.241 168 H GLY 98 HN GLY 98 -10.975 -8.330 -2.719 169 HA2 GLY 98 HA2 GLY 98 -9.593 -7.363 -4.411 170 HA3 GLY 98 HA1 GLY 98 -11.037 -6.658 -5.139 171 H TYR 99 HN TYR 99 -11.542 -6.104 -2.022 172 HA TYR 99 HA TYR 99 -10.084 -3.524 -2.022 173 HB2 TYR 99 HB2 TYR 99 -12.838 -4.048 -0.891 174 HB3 TYR 99 HB1 TYR 99 -11.993 -2.500 -0.959 175 HD1 TYR 99 HD1 TYR 99 -13.122 -5.276 -3.193 176 HD2 TYR 99 HD2 TYR 99 -12.363 -1.072 -2.775 177 HE1 TYR 99 HE1 TYR 99 -14.001 -4.904 -5.472 178 HE2 TYR 99 HE2 TYR 99 -13.261 -0.692 -5.064 179 HH TYR 99 HH TYR 99 -13.782 -3.200 -7.274 180 H ILE 100 HN ILE 100 -9.721 -2.558 0.080 181 HA ILE 100 HA ILE 100 -9.622 -4.484 2.312 182 HB ILE 100 HB ILE 100 -7.372 -4.149 2.730 183 HG12 ILE 100 HG12 ILE 100 -7.754 -1.438 1.449 184 HG13 ILE 100 HG11 ILE 100 -7.386 -1.782 3.139 185 HG21 ILE 100 HG21 ILE 100 -6.158 -4.374 0.735 186 HG22 ILE 100 HG22 ILE 100 -7.189 -3.228 -0.125 187 HG23 ILE 100 HG23 ILE 100 -7.779 -4.853 0.237 188 HD11 ILE 100 HD11 ILE 100 -5.584 -1.976 0.739 189 HD12 ILE 100 HD12 ILE 100 -5.250 -2.927 2.187 190 HD13 ILE 100 HD13 ILE 100 -5.299 -1.169 2.279 191 H SER 101 HN SER 101 -9.995 -3.489 4.368 192 HA SER 101 HA SER 101 -11.629 -1.221 4.369 193 HB2 SER 101 HB2 SER 101 -9.975 -2.402 6.614 194 HB3 SER 101 HB1 SER 101 -11.233 -1.189 6.833 195 HG SER 101 HG SER 101 -11.433 -3.875 6.415 196 H ALA 102 HN ALA 102 -11.237 0.908 4.329 197 HA ALA 102 HA ALA 102 -8.662 1.951 3.806 198 HB1 ALA 102 HB1 ALA 102 -10.833 3.700 4.889 199 HB2 ALA 102 HB2 ALA 102 -11.072 2.915 3.326 200 HB3 ALA 102 HB3 ALA 102 -9.702 3.998 3.570 201 H ALA 103 HN ALA 103 -10.622 1.812 6.710 202 HA ALA 103 HA ALA 103 -9.087 3.453 8.388 203 HB1 ALA 103 HB1 ALA 103 -10.339 0.939 9.452 204 HB2 ALA 103 HB2 ALA 103 -11.360 2.235 8.831 205 HB3 ALA 103 HB3 ALA 103 -10.271 2.542 10.184 206 H GLU 104 HN GLU 104 -8.775 -0.012 7.684 207 HA GLU 104 HA GLU 104 -6.661 -0.602 9.423 208 HB2 GLU 104 HB2 GLU 104 -7.739 -2.450 8.485 209 HB3 GLU 104 HB1 GLU 104 -7.700 -1.777 6.860 210 HG2 GLU 104 HG2 GLU 104 -5.119 -2.407 8.258 211 HG3 GLU 104 HG1 GLU 104 -6.041 -3.707 7.521 212 H LEU 105 HN LEU 105 -6.661 0.688 6.113 213 HA LEU 105 HA LEU 105 -3.916 0.452 5.589 214 HB2 LEU 105 HB2 LEU 105 -5.720 1.063 3.935 215 HB3 LEU 105 HB1 LEU 105 -5.750 2.672 4.647 216 HG LEU 105 HG LEU 105 -3.187 2.687 4.162 217 HD11 LEU 105 HD11 LEU 105 -3.671 0.101 3.355 218 HD12 LEU 105 HD12 LEU 105 -2.293 1.065 2.839 219 HD13 LEU 105 HD13 LEU 105 -3.733 0.972 1.827 220 HD21 LEU 105 HD21 LEU 105 -4.420 4.225 2.925 221 HD22 LEU 105 HD22 LEU 105 -5.460 2.983 2.227 222 HD23 LEU 105 HD23 LEU 105 -3.808 3.182 1.640 223 H ARG 106 HN ARG 106 -5.735 3.181 6.987 224 HA ARG 106 HA ARG 106 -3.608 4.956 7.318 225 HB2 ARG 106 HB2 ARG 106 -5.889 5.670 7.629 226 HB3 ARG 106 HB1 ARG 106 -6.119 4.543 8.957 227 HG2 ARG 106 HG2 ARG 106 -5.800 6.845 9.782 228 HG3 ARG 106 HG1 ARG 106 -4.490 5.806 10.318 229 HD2 ARG 106 HD2 ARG 106 -3.013 6.693 8.672 230 HD3 ARG 106 HD1 ARG 106 -4.320 7.562 7.867 231 HE ARG 106 HE ARG 106 -4.145 9.210 9.514 232 HH11 ARG 106 HH21 ARG 106 -2.387 6.355 10.380 233 HH12 ARG 106 HH22 ARG 106 -1.602 7.087 11.740 234 HH21 ARG 106 HH11 ARG 106 -3.119 10.173 11.292 235 HH22 ARG 106 HH12 ARG 106 -2.015 9.249 12.255 236 H HIS 107 HN HIS 107 -4.869 2.537 9.655 237 HA HIS 107 HA HIS 107 -2.971 3.060 11.679 238 HB2 HIS 107 HB2 HIS 107 -5.015 1.836 12.139 239 HB3 HIS 107 HB1 HIS 107 -4.529 0.543 11.042 240 HD1 HIS 107 HD1 HIS 107 -3.245 2.261 14.197 241 HD2 HIS 107 HD2 HIS 107 -3.054 -1.442 12.291 242 HE1 HIS 107 HE1 HIS 107 -1.992 0.715 15.763 243 HE2 HIS 107 HE2 HIS 107 -1.865 -1.548 14.617 244 H VAL 108 HN VAL 108 -3.033 0.575 9.150 245 HA VAL 108 HA VAL 108 -0.620 -0.703 9.810 246 HB VAL 108 HB VAL 108 -2.209 -0.525 7.256 247 HG11 VAL 108 HG11 VAL 108 -0.789 -2.544 6.603 248 HG12 VAL 108 HG12 VAL 108 0.330 -2.050 7.866 249 HG13 VAL 108 HG13 VAL 108 0.017 -0.982 6.499 250 HG21 VAL 108 HG21 VAL 108 -3.141 -1.717 9.253 251 HG22 VAL 108 HG22 VAL 108 -1.723 -2.764 9.244 252 HG23 VAL 108 HG23 VAL 108 -2.846 -2.794 7.887 253 H MET 109 HN MET 109 -1.250 2.030 7.693 254 HA MET 109 HA MET 109 1.379 2.123 6.564 255 HB2 MET 109 HB2 MET 109 -0.982 3.931 6.583 256 HB3 MET 109 HB1 MET 109 0.595 4.652 6.236 257 HG2 MET 109 HG2 MET 109 -0.734 3.760 4.231 258 HG3 MET 109 HG1 MET 109 0.950 3.253 4.362 259 HE1 MET 109 HE1 MET 109 0.230 1.484 2.587 260 HE2 MET 109 HE2 MET 109 0.209 -0.151 3.243 261 HE3 MET 109 HE3 MET 109 1.490 0.963 3.713 262 H THR 110 HN THR 110 -0.090 3.511 9.446 263 HA THR 110 HA THR 110 2.415 4.965 9.992 264 HB THR 110 HB THR 110 1.109 6.327 11.494 265 HG1 THR 110 HG1 THR 110 -1.249 5.009 10.826 266 HG21 THR 110 HG21 THR 110 0.113 7.491 9.816 267 HG22 THR 110 HG22 THR 110 -0.843 6.101 9.292 268 HG23 THR 110 HG23 THR 110 0.843 6.253 8.794 269 H ASN 111 HN ASN 111 0.757 2.134 10.937 270 HA ASN 111 HA ASN 111 2.061 2.135 13.586 271 HB2 ASN 111 HB2 ASN 111 -0.410 1.639 13.389 272 HB3 ASN 111 HB1 ASN 111 0.036 0.144 12.564 273 HD21 ASN 111 HD21 ASN 111 -0.403 -1.427 14.159 274 HD22 ASN 111 HD22 ASN 111 0.275 -1.408 15.716 275 H LEU 112 HN LEU 112 1.932 0.369 10.539 276 HA LEU 112 HA LEU 112 4.100 -1.397 11.522 277 HB2 LEU 112 HB2 LEU 112 2.111 -1.916 9.312 278 HB3 LEU 112 HB1 LEU 112 3.357 -3.029 9.861 279 HG LEU 112 HG LEU 112 1.067 -1.981 11.557 280 HD11 LEU 112 HD11 LEU 112 -0.138 -3.729 10.809 281 HD12 LEU 112 HD12 LEU 112 1.183 -4.846 11.162 282 HD13 LEU 112 HD13 LEU 112 1.119 -4.019 9.606 283 HD21 LEU 112 HD21 LEU 112 1.991 -4.059 12.943 284 HD22 LEU 112 HD22 LEU 112 2.706 -2.458 13.133 285 HD23 LEU 112 HD23 LEU 112 3.491 -3.658 12.107 286 H GLY 113 HN GLY 113 5.189 -2.400 9.446 287 HA2 GLY 113 HA2 GLY 113 6.670 -2.107 7.716 288 HA3 GLY 113 HA1 GLY 113 5.597 -0.844 7.140 289 H GLU 114 HN GLU 114 6.709 0.928 6.759 290 HA GLU 114 HA GLU 114 9.073 1.556 8.346 291 HB2 GLU 114 HB2 GLU 114 7.988 2.865 5.850 292 HB3 GLU 114 HB1 GLU 114 9.519 3.266 6.630 293 HG2 GLU 114 HG2 GLU 114 8.807 0.500 5.624 294 HG3 GLU 114 HG1 GLU 114 9.760 1.665 4.706 295 H LYS 115 HN LYS 115 6.037 2.007 8.906 296 HA LYS 115 HA LYS 115 4.737 3.509 10.040 297 HB2 LYS 115 HB2 LYS 115 7.476 4.341 10.937 298 HB3 LYS 115 HB1 LYS 115 5.982 4.767 11.755 299 HG2 LYS 115 HG2 LYS 115 6.625 1.881 11.220 300 HG3 LYS 115 HG1 LYS 115 7.406 2.693 12.570 301 HD2 LYS 115 HD2 LYS 115 4.402 2.603 12.151 302 HD3 LYS 115 HD1 LYS 115 5.285 1.491 13.188 303 HE2 LYS 115 HE2 LYS 115 6.217 3.803 14.199 304 HE3 LYS 115 HE1 LYS 115 4.659 4.375 13.604 305 HZ1 LYS 115 HZ1 LYS 115 4.977 1.974 15.311 306 HZ2 LYS 115 HZ2 LYS 115 3.528 2.750 14.878 307 HZ3 LYS 115 HZ3 LYS 115 4.630 3.519 15.920 308 H LEU 116 HN LEU 116 3.799 4.805 8.526 309 HA LEU 116 HA LEU 116 5.312 7.011 7.346 310 HB2 LEU 116 HB2 LEU 116 2.614 5.795 6.818 311 HB3 LEU 116 HB1 LEU 116 2.957 7.425 6.258 312 HG LEU 116 HG LEU 116 3.411 5.666 4.536 313 HD11 LEU 116 HD11 LEU 116 5.010 7.869 5.251 314 HD12 LEU 116 HD12 LEU 116 4.992 7.037 3.701 315 HD13 LEU 116 HD13 LEU 116 6.147 6.560 4.942 316 HD21 LEU 116 HD21 LEU 116 4.202 3.981 6.259 317 HD22 LEU 116 HD22 LEU 116 5.715 4.882 6.343 318 HD23 LEU 116 HD23 LEU 116 5.222 4.121 4.831 319 H THR 117 HN THR 117 4.512 9.215 7.429 320 HA THR 117 HA THR 117 3.345 9.840 10.041 321 HB THR 117 HB THR 117 4.071 12.129 9.579 322 HG1 THR 117 HG1 THR 117 4.162 12.644 7.559 323 HG21 THR 117 HG21 THR 117 6.515 10.841 8.667 324 HG22 THR 117 HG22 THR 117 5.726 9.908 9.938 325 HG23 THR 117 HG23 THR 117 6.161 11.592 10.224 326 H ASP 118 HN ASP 118 1.802 11.803 9.993 327 HA ASP 118 HA ASP 118 -0.540 11.072 8.610 328 HB2 ASP 118 HB2 ASP 118 0.278 13.651 9.955 329 HB3 ASP 118 HB1 ASP 118 -1.325 13.396 9.269 330 H GLU 119 HN GLU 119 1.950 13.476 7.899 331 HA GLU 119 HA GLU 119 0.695 14.704 5.695 332 HB2 GLU 119 HB2 GLU 119 2.685 15.630 6.827 333 HB3 GLU 119 HB1 GLU 119 3.656 14.302 6.192 334 HG2 GLU 119 HG2 GLU 119 3.179 15.016 3.894 335 HG3 GLU 119 HG1 GLU 119 2.136 16.304 4.494 336 H GLU 120 HN GLU 120 2.858 11.886 5.881 337 HA GLU 120 HA GLU 120 2.965 11.467 3.058 338 HB2 GLU 120 HB2 GLU 120 3.626 9.791 5.464 339 HB3 GLU 120 HB1 GLU 120 3.647 9.088 3.853 340 HG2 GLU 120 HG2 GLU 120 5.177 11.585 4.624 341 HG3 GLU 120 HG1 GLU 120 5.873 9.968 4.615 342 H VAL 121 HN VAL 121 1.056 10.053 5.677 343 HA VAL 121 HA VAL 121 -0.371 8.191 4.070 344 HB VAL 121 HB VAL 121 -1.143 9.508 6.692 345 HG11 VAL 121 HG11 VAL 121 -2.464 7.123 6.551 346 HG12 VAL 121 HG12 VAL 121 -2.509 7.638 4.877 347 HG13 VAL 121 HG13 VAL 121 -3.184 8.678 6.134 348 HG21 VAL 121 HG21 VAL 121 0.452 8.127 7.511 349 HG22 VAL 121 HG22 VAL 121 0.652 7.318 5.957 350 HG23 VAL 121 HG23 VAL 121 -0.615 6.796 7.066 351 H ASP 122 HN ASP 122 -1.138 11.537 5.096 352 HA ASP 122 HA ASP 122 -3.712 11.725 4.217 353 HB2 ASP 122 HB2 ASP 122 -1.473 13.747 4.087 354 HB3 ASP 122 HB1 ASP 122 -3.142 14.151 3.686 355 H GLU 123 HN GLU 123 -0.764 11.973 2.265 356 HA GLU 123 HA GLU 123 -2.052 12.587 -0.204 357 HB2 GLU 123 HB2 GLU 123 0.601 11.226 0.357 358 HB3 GLU 123 HB1 GLU 123 0.080 11.805 -1.224 359 HG2 GLU 123 HG2 GLU 123 0.298 13.569 1.222 360 HG3 GLU 123 HG1 GLU 123 1.575 13.399 0.017 361 H MET 124 HN MET 124 -1.382 9.648 1.560 362 HA MET 124 HA MET 124 -1.952 7.863 -0.627 363 HB2 MET 124 HB2 MET 124 -1.736 7.385 2.358 364 HB3 MET 124 HB1 MET 124 -1.867 6.131 1.134 365 HG2 MET 124 HG2 MET 124 0.213 6.831 0.101 366 HG3 MET 124 HG1 MET 124 0.315 8.223 1.174 367 HE1 MET 124 HE1 MET 124 -0.651 4.371 1.999 368 HE2 MET 124 HE2 MET 124 1.016 3.818 2.090 369 HE3 MET 124 HE3 MET 124 0.425 4.572 0.614 370 H ILE 125 HN ILE 125 -3.698 9.421 1.965 371 HA ILE 125 HA ILE 125 -5.997 7.815 2.033 372 HB ILE 125 HB ILE 125 -5.123 10.267 3.171 373 HG12 ILE 125 HG12 ILE 125 -6.818 9.657 4.882 374 HG13 ILE 125 HG11 ILE 125 -7.433 8.419 3.790 375 HG21 ILE 125 HG21 ILE 125 -7.260 11.473 3.337 376 HG22 ILE 125 HG22 ILE 125 -7.980 10.363 2.180 377 HG23 ILE 125 HG23 ILE 125 -6.673 11.440 1.679 378 HD11 ILE 125 HD11 ILE 125 -5.382 8.086 5.649 379 HD12 ILE 125 HD12 ILE 125 -4.541 8.248 4.110 380 HD13 ILE 125 HD13 ILE 125 -5.760 6.994 4.319 381 H ARG 126 HN ARG 126 -5.194 10.630 0.012 382 HA ARG 126 HA ARG 126 -7.725 10.895 -1.195 383 HB2 ARG 126 HB2 ARG 126 -4.938 11.744 -1.847 384 HB3 ARG 126 HB1 ARG 126 -6.131 11.797 -3.149 385 HG2 ARG 126 HG2 ARG 126 -6.828 12.964 -0.470 386 HG3 ARG 126 HG1 ARG 126 -5.810 13.887 -1.575 387 HD2 ARG 126 HD2 ARG 126 -8.552 12.767 -2.242 388 HD3 ARG 126 HD1 ARG 126 -8.195 14.450 -1.877 389 HE ARG 126 HE ARG 126 -7.600 13.049 -4.352 390 HH11 ARG 126 HH21 ARG 126 -6.965 15.736 -2.269 391 HH12 ARG 126 HH22 ARG 126 -6.342 16.746 -3.530 392 HH21 ARG 126 HH11 ARG 126 -6.785 14.366 -6.014 393 HH22 ARG 126 HH12 ARG 126 -6.240 15.969 -5.653 394 H GLU 127 HN GLU 127 -4.791 9.482 -2.677 395 HA GLU 127 HA GLU 127 -6.106 8.270 -4.809 396 HB2 GLU 127 HB2 GLU 127 -3.548 7.405 -3.444 397 HB3 GLU 127 HB1 GLU 127 -4.068 6.907 -5.054 398 HG2 GLU 127 HG2 GLU 127 -3.641 9.789 -4.221 399 HG3 GLU 127 HG1 GLU 127 -2.446 8.821 -5.082 400 H ALA 128 HN ALA 128 -6.408 7.460 -1.567 401 HA ALA 128 HA ALA 128 -6.624 4.595 -1.873 402 HB1 ALA 128 HB1 ALA 128 -6.450 4.710 0.363 403 HB2 ALA 128 HB2 ALA 128 -8.000 5.542 0.457 404 HB3 ALA 128 HB3 ALA 128 -6.521 6.462 0.268 405 H ASP 129 HN ASP 129 -9.116 6.808 -0.626 406 HA ASP 129 HA ASP 129 -11.091 6.683 -2.497 407 HB2 ASP 129 HB2 ASP 129 -11.230 4.347 -2.666 408 HB3 ASP 129 HB1 ASP 129 -10.961 4.116 -0.934 409 H ILE 130 HN ILE 130 -11.696 5.182 0.574 410 HA ILE 130 HA ILE 130 -13.214 5.789 2.204 411 HB ILE 130 HB ILE 130 -11.751 8.357 2.549 412 HG12 ILE 130 HG12 ILE 130 -10.069 6.533 3.764 413 HG13 ILE 130 HG11 ILE 130 -10.406 5.749 2.228 414 HG21 ILE 130 HG21 ILE 130 -13.503 7.151 4.083 415 HG22 ILE 130 HG22 ILE 130 -12.076 7.889 4.814 416 HG23 ILE 130 HG23 ILE 130 -12.129 6.147 4.550 417 HD11 ILE 130 HD11 ILE 130 -9.757 7.817 1.033 418 HD12 ILE 130 HD12 ILE 130 -8.439 7.232 2.048 419 HD13 ILE 130 HD13 ILE 130 -9.422 8.596 2.577 420 H ASP 131 HN ASP 131 -14.300 6.447 -0.257 421 HA ASP 131 HA ASP 131 -15.134 9.133 -0.506 422 HB2 ASP 131 HB2 ASP 131 -16.400 6.531 -1.392 423 HB3 ASP 131 HB1 ASP 131 -17.070 8.111 -1.797 424 H GLY 132 HN GLY 132 -16.417 6.367 1.246 425 HA2 GLY 132 HA2 GLY 132 -17.490 7.677 3.400 426 HA3 GLY 132 HA1 GLY 132 -18.776 7.703 2.194 427 H ASP 133 HN ASP 133 -16.419 5.111 2.448 428 HA ASP 133 HA ASP 133 -18.439 3.381 3.693 429 HB2 ASP 133 HB2 ASP 133 -16.991 2.832 1.105 430 HB3 ASP 133 HB1 ASP 133 -17.795 1.578 2.049 431 H GLY 134 HN GLY 134 -15.243 4.444 3.514 432 HA2 GLY 134 HA2 GLY 134 -13.417 3.915 4.812 433 HA3 GLY 134 HA1 GLY 134 -14.443 2.789 5.690 434 H GLN 135 HN GLN 135 -13.879 2.626 2.197 435 HA GLN 135 HA GLN 135 -12.201 0.229 2.637 436 HB2 GLN 135 HB2 GLN 135 -13.319 -0.681 0.519 437 HB3 GLN 135 HB1 GLN 135 -14.260 -0.720 2.016 438 HG2 GLN 135 HG2 GLN 135 -15.723 0.874 1.287 439 HG3 GLN 135 HG1 GLN 135 -14.480 1.767 0.417 440 HE21 GLN 135 HE21 GLN 135 -15.385 1.869 -1.678 441 HE22 GLN 135 HE22 GLN 135 -15.825 0.502 -2.581 442 H VAL 136 HN VAL 136 -10.705 -0.258 1.065 443 HA VAL 136 HA VAL 136 -10.198 1.820 -0.957 444 HB VAL 136 HB VAL 136 -8.287 0.731 1.088 445 HG11 VAL 136 HG11 VAL 136 -7.001 0.447 -0.861 446 HG12 VAL 136 HG12 VAL 136 -6.598 2.094 -0.361 447 HG13 VAL 136 HG13 VAL 136 -7.756 1.827 -1.666 448 HG21 VAL 136 HG21 VAL 136 -8.937 3.500 0.067 449 HG22 VAL 136 HG22 VAL 136 -7.823 3.124 1.381 450 HG23 VAL 136 HG23 VAL 136 -9.547 2.804 1.564 451 H ASN 137 HN ASN 137 -9.650 1.127 -2.904 452 HA ASN 137 HA ASN 137 -9.482 -1.758 -3.351 453 HB2 ASN 137 HB2 ASN 137 -10.996 -0.346 -4.741 454 HB3 ASN 137 HB1 ASN 137 -9.592 0.521 -5.346 455 HD21 ASN 137 HD21 ASN 137 -9.248 -2.911 -4.716 456 HD22 ASN 137 HD22 ASN 137 -9.239 -3.398 -6.340 457 H TYR 138 HN TYR 138 -7.436 -2.578 -3.165 458 HA TYR 138 HA TYR 138 -5.102 -0.992 -3.293 459 HB2 TYR 138 HB2 TYR 138 -3.880 -3.153 -3.295 460 HB3 TYR 138 HB1 TYR 138 -5.108 -3.051 -2.036 461 HD1 TYR 138 HD1 TYR 138 -4.407 -4.415 -5.434 462 HD2 TYR 138 HD2 TYR 138 -6.932 -4.581 -1.965 463 HE1 TYR 138 HE1 TYR 138 -5.474 -6.478 -6.304 464 HE2 TYR 138 HE2 TYR 138 -7.993 -6.643 -2.826 465 HH TYR 138 HH TYR 138 -7.709 -7.664 -5.995 466 H GLU 139 HN GLU 139 -7.007 -2.124 -5.856 467 HA GLU 139 HA GLU 139 -5.053 -2.827 -7.755 468 HB2 GLU 139 HB2 GLU 139 -7.770 -1.560 -8.118 469 HB3 GLU 139 HB1 GLU 139 -6.781 -2.152 -9.450 470 HG2 GLU 139 HG2 GLU 139 -7.587 -3.864 -7.087 471 HG3 GLU 139 HG1 GLU 139 -8.492 -3.808 -8.600 472 H GLU 140 HN GLU 140 -6.569 0.406 -7.222 473 HA GLU 140 HA GLU 140 -5.052 1.720 -9.197 474 HB2 GLU 140 HB2 GLU 140 -5.756 3.784 -8.122 475 HB3 GLU 140 HB1 GLU 140 -7.101 2.646 -8.158 476 HG2 GLU 140 HG2 GLU 140 -6.436 1.943 -5.825 477 HG3 GLU 140 HG1 GLU 140 -5.311 3.296 -5.809 478 H PHE 141 HN PHE 141 -4.401 1.101 -5.798 479 HA PHE 141 HA PHE 141 -2.103 2.764 -5.543 480 HB2 PHE 141 HB2 PHE 141 -3.312 0.529 -4.031 481 HB3 PHE 141 HB1 PHE 141 -1.564 0.669 -3.866 482 HD1 PHE 141 HD2 PHE 141 -0.756 3.251 -3.644 483 HD2 PHE 141 HD1 PHE 141 -4.596 1.712 -2.463 484 HE1 PHE 141 HE2 PHE 141 -1.026 5.133 -2.053 485 HE2 PHE 141 HE1 PHE 141 -4.844 3.581 -0.870 486 HZ PHE 141 HZ PHE 141 -3.076 5.299 -0.670 487 H VAL 142 HN VAL 142 -2.493 -0.655 -6.396 488 HA VAL 142 HA VAL 142 0.250 -1.200 -6.790 489 HB VAL 142 HB VAL 142 -2.255 -2.478 -7.889 490 HG11 VAL 142 HG11 VAL 142 0.655 -3.120 -8.276 491 HG12 VAL 142 HG12 VAL 142 -0.659 -3.159 -9.453 492 HG13 VAL 142 HG13 VAL 142 -0.532 -4.423 -8.229 493 HG21 VAL 142 HG21 VAL 142 -2.325 -3.430 -5.851 494 HG22 VAL 142 HG22 VAL 142 -0.882 -2.540 -5.361 495 HG23 VAL 142 HG23 VAL 142 -0.732 -4.124 -6.130 496 H GLN 143 HN GLN 143 -2.290 -0.144 -9.039 497 HA GLN 143 HA GLN 143 -0.671 -0.205 -11.369 498 HB2 GLN 143 HB2 GLN 143 -3.100 1.454 -10.651 499 HB3 GLN 143 HB1 GLN 143 -2.348 1.474 -12.247 500 HG2 GLN 143 HG2 GLN 143 -2.759 -0.879 -12.550 501 HG3 GLN 143 HG1 GLN 143 -3.305 -1.050 -10.884 502 HE21 GLN 143 HE21 GLN 143 -4.823 -1.576 -13.405 503 HE22 GLN 143 HE22 GLN 143 -6.199 -0.587 -13.320 504 H MET 144 HN MET 144 -1.321 2.218 -8.916 505 HA MET 144 HA MET 144 0.193 4.344 -10.027 506 HB2 MET 144 HB2 MET 144 -1.249 5.072 -8.377 507 HB3 MET 144 HB1 MET 144 -0.992 3.652 -7.377 508 HG2 MET 144 HG2 MET 144 0.880 4.521 -6.371 509 HG3 MET 144 HG1 MET 144 1.302 5.535 -7.753 510 HE1 MET 144 HE1 MET 144 -1.544 4.971 -5.060 511 HE2 MET 144 HE2 MET 144 -1.300 6.471 -4.172 512 HE3 MET 144 HE3 MET 144 0.035 5.338 -4.351 513 H MET 145 HN MET 145 0.988 1.843 -7.611 514 HA MET 145 HA MET 145 3.701 2.647 -7.288 515 HB2 MET 145 HB2 MET 145 2.250 0.069 -6.650 516 HB3 MET 145 HB1 MET 145 3.937 0.369 -6.227 517 HG2 MET 145 HG2 MET 145 3.290 2.305 -4.885 518 HG3 MET 145 HG1 MET 145 1.611 2.111 -5.368 519 HE1 MET 145 HE1 MET 145 0.357 1.196 -2.633 520 HE2 MET 145 HE2 MET 145 1.418 2.526 -3.091 521 HE3 MET 145 HE3 MET 145 1.846 1.498 -1.729 522 H THR 146 HN THR 146 2.053 0.537 -9.549 523 HA THR 146 HA THR 146 4.600 -0.526 -10.539 524 HB THR 146 HB THR 146 1.871 -1.167 -11.644 525 HG1 THR 146 HG1 THR 146 1.429 -2.037 -9.803 526 HG21 THR 146 HG21 THR 146 2.943 -2.869 -12.709 527 HG22 THR 146 HG22 THR 146 3.987 -3.203 -11.327 528 HG23 THR 146 HG23 THR 146 4.385 -1.890 -12.435 529 H ALA 147 HN ALA 147 3.639 2.308 -10.813 530 HA ALA 147 HA ALA 147 4.061 2.516 -13.712 531 HB1 ALA 147 HB1 ALA 147 2.316 4.225 -13.905 532 HB2 ALA 147 HB2 ALA 147 1.909 4.020 -12.202 533 HB3 ALA 147 HB3 ALA 147 1.626 2.704 -13.342 534 H LYS 148 HN LYS 148 4.404 4.941 -14.254 535 HA LYS 148 HA LYS 148 5.492 6.952 -13.870 536 HB2 LYS 148 HB2 LYS 148 4.412 6.542 -11.451 537 HB3 LYS 148 HB1 LYS 148 6.106 6.308 -11.025 538 HG2 LYS 148 HG2 LYS 148 5.921 8.602 -10.748 539 HG3 LYS 148 HG1 LYS 148 6.432 8.531 -12.433 540 HD2 LYS 148 HD2 LYS 148 4.057 8.638 -13.145 541 HD3 LYS 148 HD1 LYS 148 3.568 8.748 -11.455 542 HE2 LYS 148 HE2 LYS 148 3.627 10.994 -12.319 543 HE3 LYS 148 HE1 LYS 148 5.029 10.807 -11.266 544 HZ1 LYS 148 HZ1 LYS 148 5.920 11.760 -13.151 545 HZ2 LYS 148 HZ2 LYS 148 4.919 10.885 -14.209 546 HZ3 LYS 148 HZ3 LYS 148 6.212 10.111 -13.423 547 H PHE 30 HT1 PHE 30 -10.095 -3.270 12.865 548 HA PHE 30 HA PHE 30 -9.426 -3.931 10.851 549 HB2 PHE 30 HB2 PHE 30 -6.865 -4.882 12.117 550 HB3 PHE 30 HB1 PHE 30 -7.094 -3.924 10.654 551 HD1 PHE 30 HD2 PHE 30 -8.482 -1.629 11.136 552 HD2 PHE 30 HD1 PHE 30 -6.022 -3.730 13.963 553 HE1 PHE 30 HE2 PHE 30 -8.204 0.458 12.447 554 HE2 PHE 30 HE1 PHE 30 -5.746 -1.645 15.273 555 HZ PHE 30 HZ PHE 30 -6.836 0.449 14.516 556 H ASP 31 HN ASP 31 -9.238 -6.321 13.347 557 HA ASP 31 HA ASP 31 -9.404 -8.610 13.351 558 HB2 ASP 31 HB2 ASP 31 -10.468 -8.191 10.543 559 HB3 ASP 31 HB1 ASP 31 -10.622 -9.663 11.497 560 H ILE 32 HN ILE 32 -6.976 -7.303 12.536 561 HA ILE 32 HA ILE 32 -5.763 -9.445 10.897 562 HB ILE 32 HB ILE 32 -5.233 -6.468 10.842 563 HG12 ILE 32 HG12 ILE 32 -5.855 -8.278 8.518 564 HG13 ILE 32 HG11 ILE 32 -7.156 -7.635 9.518 565 HG21 ILE 32 HG21 ILE 32 -3.534 -8.773 10.134 566 HG22 ILE 32 HG22 ILE 32 -3.091 -7.092 10.434 567 HG23 ILE 32 HG23 ILE 32 -3.707 -7.574 8.853 568 HD11 ILE 32 HD11 ILE 32 -6.187 -6.316 7.381 569 HD12 ILE 32 HD12 ILE 32 -5.094 -5.695 8.619 570 HD13 ILE 32 HD13 ILE 32 -6.836 -5.487 8.793 571 H ASP 33 HN ASP 33 -4.205 -10.515 11.951 572 HA ASP 33 HA ASP 33 -3.363 -9.722 14.566 573 HB2 ASP 33 HB2 ASP 33 -2.474 -11.917 12.695 574 HB3 ASP 33 HB1 ASP 33 -1.779 -11.686 14.299 575 H MET 34 HN MET 34 -1.518 -8.776 15.247 576 HA MET 34 HA MET 34 0.232 -7.616 13.187 577 HB2 MET 34 HB2 MET 34 -0.047 -6.998 16.141 578 HB3 MET 34 HB1 MET 34 1.036 -6.163 15.030 579 HG2 MET 34 HG2 MET 34 -1.974 -6.317 14.690 580 HG3 MET 34 HG1 MET 34 -1.120 -4.943 15.395 581 HE1 MET 34 HE1 MET 34 -2.024 -3.162 13.505 582 HE2 MET 34 HE2 MET 34 -3.044 -4.578 13.269 583 HE3 MET 34 HE3 MET 34 -2.327 -3.773 11.873 584 H ASP 35 HN ASP 35 0.101 -10.312 15.054 585 HA ASP 35 HA ASP 35 2.919 -10.396 15.807 586 HB2 ASP 35 HB2 ASP 35 0.616 -12.307 16.197 587 HB3 ASP 35 HB1 ASP 35 2.269 -12.681 16.680 588 H ALA 36 HN ALA 36 1.317 -10.844 12.992 589 HA ALA 36 HA ALA 36 2.701 -13.270 12.142 590 HB1 ALA 36 HB1 ALA 36 1.259 -11.704 10.124 591 HB2 ALA 36 HB2 ALA 36 0.273 -12.208 11.496 592 HB3 ALA 36 HB3 ALA 36 1.129 -13.414 10.537 593 HA PRO 37 HA PRO 37 6.179 -10.560 10.840 594 HB2 PRO 37 HB2 PRO 37 6.880 -13.107 9.425 595 HB3 PRO 37 HB1 PRO 37 7.916 -12.028 10.382 596 HG2 PRO 37 HG2 PRO 37 7.085 -14.304 11.404 597 HG3 PRO 37 HG1 PRO 37 7.114 -12.834 12.397 598 HD2 PRO 37 HD2 PRO 37 4.761 -14.214 11.150 599 HD3 PRO 37 HD1 PRO 37 4.894 -13.378 12.714 600 H GLU 38 HN GLU 38 4.333 -12.724 8.730 601 HA GLU 38 HA GLU 38 5.099 -11.643 6.248 602 HB2 GLU 38 HB2 GLU 38 2.545 -13.011 7.130 603 HB3 GLU 38 HB1 GLU 38 2.896 -12.600 5.454 604 HG2 GLU 38 HG2 GLU 38 4.609 -14.382 7.211 605 HG3 GLU 38 HG1 GLU 38 3.497 -14.950 5.969 606 H THR 39 HN THR 39 2.511 -10.738 8.496 607 HA THR 39 HA THR 39 1.242 -8.842 6.835 608 HB THR 39 HB THR 39 1.458 -8.898 9.857 609 HG1 THR 39 HG1 THR 39 -0.107 -10.305 9.762 610 HG21 THR 39 HG21 THR 39 0.233 -7.027 7.995 611 HG22 THR 39 HG22 THR 39 0.406 -6.908 9.747 612 HG23 THR 39 HG23 THR 39 -0.971 -7.763 9.053 613 H GLU 40 HN GLU 40 3.829 -8.489 9.252 614 HA GLU 40 HA GLU 40 4.150 -5.691 8.957 615 HB2 GLU 40 HB2 GLU 40 6.030 -7.855 9.916 616 HB3 GLU 40 HB1 GLU 40 6.430 -6.137 9.958 617 HG2 GLU 40 HG2 GLU 40 4.537 -5.671 11.398 618 HG3 GLU 40 HG1 GLU 40 3.967 -7.333 11.253 619 H ARG 41 HN ARG 41 5.663 -8.463 7.358 620 HA ARG 41 HA ARG 41 7.589 -7.018 5.881 621 HB2 ARG 41 HB2 ARG 41 6.233 -9.671 5.367 622 HB3 ARG 41 HB1 ARG 41 7.544 -9.046 4.369 623 HG2 ARG 41 HG2 ARG 41 7.913 -9.173 7.346 624 HG3 ARG 41 HG1 ARG 41 8.080 -10.650 6.398 625 HD2 ARG 41 HD2 ARG 41 9.763 -9.533 4.968 626 HD3 ARG 41 HD1 ARG 41 9.615 -8.072 5.937 627 HE ARG 41 HE ARG 41 10.219 -10.193 7.672 628 HH11 ARG 41 HH21 ARG 41 11.594 -8.416 5.040 629 HH12 ARG 41 HH22 ARG 41 13.228 -8.625 5.570 630 HH21 ARG 41 HH11 ARG 41 12.363 -10.472 8.374 631 HH22 ARG 41 HH12 ARG 41 13.665 -9.789 7.458 632 H ALA 42 HN ALA 42 4.242 -7.917 5.190 633 HA ALA 42 HA ALA 42 4.164 -7.078 2.501 634 HB1 ALA 42 HB1 ALA 42 1.652 -6.745 3.065 635 HB2 ALA 42 HB2 ALA 42 2.078 -7.401 4.645 636 HB3 ALA 42 HB3 ALA 42 2.331 -8.368 3.192 637 H ALA 43 HN ALA 43 3.604 -5.355 5.537 638 HA ALA 43 HA ALA 43 2.708 -2.919 4.440 639 HB1 ALA 43 HB1 ALA 43 3.408 -1.943 6.615 640 HB2 ALA 43 HB2 ALA 43 4.205 -3.466 7.012 641 HB3 ALA 43 HB3 ALA 43 2.454 -3.414 6.808 642 H VAL 44 HN VAL 44 5.959 -4.125 5.171 643 HA VAL 44 HA VAL 44 7.370 -1.739 4.696 644 HB VAL 44 HB VAL 44 8.191 -4.632 4.409 645 HG11 VAL 44 HG11 VAL 44 10.536 -3.464 4.648 646 HG12 VAL 44 HG12 VAL 44 9.695 -2.069 3.972 647 HG13 VAL 44 HG13 VAL 44 9.777 -3.575 3.060 648 HG21 VAL 44 HG21 VAL 44 8.641 -2.501 6.522 649 HG22 VAL 44 HG22 VAL 44 9.415 -4.085 6.531 650 HG23 VAL 44 HG23 VAL 44 7.664 -3.960 6.689 651 H ALA 45 HN ALA 45 6.610 -4.437 2.480 652 HA ALA 45 HA ALA 45 7.926 -3.362 0.228 653 HB1 ALA 45 HB1 ALA 45 6.959 -5.733 0.606 654 HB2 ALA 45 HB2 ALA 45 6.871 -5.045 -1.016 655 HB3 ALA 45 HB3 ALA 45 5.444 -5.046 0.021 656 H ILE 46 HN ILE 46 4.543 -3.095 1.295 657 HA ILE 46 HA ILE 46 3.630 -1.593 -0.914 658 HB ILE 46 HB ILE 46 2.646 -1.794 1.938 659 HG12 ILE 46 HG12 ILE 46 1.514 -2.926 -0.633 660 HG13 ILE 46 HG11 ILE 46 2.646 -3.817 0.385 661 HG21 ILE 46 HG21 ILE 46 0.501 -0.879 0.932 662 HG22 ILE 46 HG22 ILE 46 1.447 -0.425 -0.484 663 HG23 ILE 46 HG23 ILE 46 1.804 0.299 1.084 664 HD11 ILE 46 HD11 ILE 46 0.483 -2.680 1.960 665 HD12 ILE 46 HD12 ILE 46 1.025 -4.356 1.846 666 HD13 ILE 46 HD13 ILE 46 -0.136 -3.723 0.679 667 H GLN 47 HN GLN 47 4.826 -0.599 2.274 668 HA GLN 47 HA GLN 47 4.563 2.191 1.850 669 HB2 GLN 47 HB2 GLN 47 6.228 0.561 3.761 670 HB3 GLN 47 HB1 GLN 47 6.220 2.324 3.768 671 HG2 GLN 47 HG2 GLN 47 3.770 2.315 4.070 672 HG3 GLN 47 HG1 GLN 47 3.774 0.554 4.061 673 HE21 GLN 47 HE21 GLN 47 3.112 0.233 6.245 674 HE22 GLN 47 HE22 GLN 47 4.045 0.731 7.571 675 H SER 48 HN SER 48 7.206 -0.084 1.256 676 HA SER 48 HA SER 48 9.234 1.779 0.731 677 HB2 SER 48 HB2 SER 48 9.678 -0.615 0.995 678 HB3 SER 48 HB1 SER 48 8.797 -0.957 -0.492 679 HG SER 48 HG SER 48 11.034 -0.815 -0.875 680 H GLN 49 HN GLN 49 6.869 0.283 -1.481 681 HA GLN 49 HA GLN 49 7.824 1.588 -3.804 682 HB2 GLN 49 HB2 GLN 49 5.405 0.040 -3.077 683 HB3 GLN 49 HB1 GLN 49 5.247 1.141 -4.444 684 HG2 GLN 49 HG2 GLN 49 5.974 -1.061 -5.230 685 HG3 GLN 49 HG1 GLN 49 7.254 0.116 -5.487 686 HE21 GLN 49 HE21 GLN 49 9.269 -0.644 -4.851 687 HE22 GLN 49 HE22 GLN 49 9.539 -1.777 -3.616 688 H PHE 50 HN PHE 50 5.457 2.532 -1.348 689 HA PHE 50 HA PHE 50 4.337 4.719 -2.710 690 HB2 PHE 50 HB2 PHE 50 3.341 3.919 -0.639 691 HB3 PHE 50 HB1 PHE 50 4.795 4.355 0.262 692 HD1 PHE 50 HD1 PHE 50 2.398 5.932 -2.164 693 HD2 PHE 50 HD2 PHE 50 4.768 6.411 1.395 694 HE1 PHE 50 HE1 PHE 50 1.539 8.244 -1.902 695 HE2 PHE 50 HE2 PHE 50 3.915 8.726 1.639 696 HZ PHE 50 HZ PHE 50 2.299 9.647 -0.001 697 H ARG 51 HN ARG 51 7.155 4.566 -0.534 698 HA ARG 51 HA ARG 51 7.821 7.300 -0.673 699 HB2 ARG 51 HB2 ARG 51 9.499 4.838 -0.155 700 HB3 ARG 51 HB1 ARG 51 10.114 6.484 -0.001 701 HG2 ARG 51 HG2 ARG 51 8.468 7.003 1.703 702 HG3 ARG 51 HG1 ARG 51 7.678 5.443 1.470 703 HD2 ARG 51 HD2 ARG 51 9.128 5.363 3.445 704 HD3 ARG 51 HD1 ARG 51 9.752 4.297 2.189 705 HE ARG 51 HE ARG 51 10.921 6.881 1.967 706 HH11 ARG 51 HH21 ARG 51 10.917 3.991 3.871 707 HH12 ARG 51 HH22 ARG 51 12.560 4.164 4.388 708 HH21 ARG 51 HH11 ARG 51 13.078 7.114 2.641 709 HH22 ARG 51 HH12 ARG 51 13.785 5.932 3.692 710 H LYS 52 HN LYS 52 8.754 4.523 -2.668 711 HA LYS 52 HA LYS 52 10.657 5.874 -4.267 712 HB2 LYS 52 HB2 LYS 52 8.961 3.429 -4.779 713 HB3 LYS 52 HB1 LYS 52 10.179 4.011 -5.913 714 HG2 LYS 52 HG2 LYS 52 11.905 3.832 -4.160 715 HG3 LYS 52 HG1 LYS 52 10.691 3.249 -3.023 716 HD2 LYS 52 HD2 LYS 52 10.269 1.290 -4.426 717 HD3 LYS 52 HD1 LYS 52 11.407 1.886 -5.635 718 HE2 LYS 52 HE2 LYS 52 12.493 0.201 -4.220 719 HE3 LYS 52 HE1 LYS 52 13.227 1.782 -3.949 720 HZ1 LYS 52 HZ1 LYS 52 12.842 0.858 -1.836 721 HZ2 LYS 52 HZ2 LYS 52 11.264 0.369 -2.238 722 HZ3 LYS 52 HZ3 LYS 52 11.625 2.019 -2.050 723 H PHE 53 HN PHE 53 7.159 5.460 -4.563 724 HA PHE 53 HA PHE 53 6.831 6.426 -7.171 725 HB2 PHE 53 HB2 PHE 53 5.040 5.323 -5.895 726 HB3 PHE 53 HB1 PHE 53 4.953 6.713 -4.815 727 HD1 PHE 53 HD1 PHE 53 4.283 5.483 -8.226 728 HD2 PHE 53 HD2 PHE 53 4.000 8.834 -5.552 729 HE1 PHE 53 HE1 PHE 53 2.745 6.615 -9.810 730 HE2 PHE 53 HE2 PHE 53 2.468 9.969 -7.139 731 HZ PHE 53 HZ PHE 53 1.843 8.862 -9.267 732 H GLN 54 HN GLN 54 6.694 8.224 -4.075 733 HA GLN 54 HA GLN 54 6.283 10.741 -5.362 734 HB2 GLN 54 HB2 GLN 54 6.726 11.706 -3.126 735 HB3 GLN 54 HB1 GLN 54 5.542 10.401 -3.075 736 HG2 GLN 54 HG2 GLN 54 7.310 8.826 -2.386 737 HG3 GLN 54 HG1 GLN 54 8.489 10.137 -2.412 738 HE21 GLN 54 HE21 GLN 54 8.572 9.289 0.010 739 HE22 GLN 54 HE22 GLN 54 7.535 10.085 1.093 740 H LYS 55 HN LYS 55 9.171 9.053 -4.169 741 HA LYS 55 HA LYS 55 10.957 11.226 -4.488 742 HB2 LYS 55 HB2 LYS 55 11.391 8.241 -4.474 743 HB3 LYS 55 HB1 LYS 55 12.715 9.396 -4.627 744 HG2 LYS 55 HG2 LYS 55 12.068 10.451 -2.507 745 HG3 LYS 55 HG1 LYS 55 10.713 9.337 -2.348 746 HD2 LYS 55 HD2 LYS 55 12.247 7.435 -2.236 747 HD3 LYS 55 HD1 LYS 55 13.624 8.503 -2.501 748 HE2 LYS 55 HE2 LYS 55 13.400 8.002 -0.111 749 HE3 LYS 55 HE1 LYS 55 13.071 9.709 -0.404 750 HZ1 LYS 55 HZ1 LYS 55 11.418 7.879 0.836 751 HZ2 LYS 55 HZ2 LYS 55 10.705 8.179 -0.677 752 HZ3 LYS 55 HZ3 LYS 55 11.031 9.467 0.383 753 H LYS 56 HN LYS 56 9.888 8.678 -6.701 754 HA LYS 56 HA LYS 56 11.668 9.271 -8.812 755 HB2 LYS 56 HB2 LYS 56 8.915 8.021 -8.781 756 HB3 LYS 56 HB1 LYS 56 9.886 8.162 -10.244 757 HG2 LYS 56 HG2 LYS 56 11.100 6.932 -7.785 758 HG3 LYS 56 HG1 LYS 56 10.017 5.967 -8.786 759 HD2 LYS 56 HD2 LYS 56 11.440 6.508 -10.772 760 HD3 LYS 56 HD1 LYS 56 12.561 7.349 -9.702 761 HE2 LYS 56 HE2 LYS 56 12.917 5.274 -8.426 762 HE3 LYS 56 HE1 LYS 56 11.787 4.428 -9.482 763 HZ1 LYS 56 HZ1 LYS 56 13.416 4.089 -10.918 764 HZ2 LYS 56 HZ2 LYS 56 14.512 4.870 -9.881 765 HZ3 LYS 56 HZ3 LYS 56 13.680 5.759 -11.065 766 H LYS 57 HN LYS 57 8.477 10.526 -7.966 767 HA LYS 57 HA LYS 57 8.028 12.065 -10.280 768 HB2 LYS 57 HB2 LYS 57 6.280 11.576 -8.606 769 HB3 LYS 57 HB1 LYS 57 7.114 12.605 -7.442 770 HG2 LYS 57 HG2 LYS 57 6.820 14.550 -8.918 771 HG3 LYS 57 HG1 LYS 57 6.035 13.529 -10.124 772 HD2 LYS 57 HD2 LYS 57 4.256 12.985 -8.493 773 HD3 LYS 57 HD1 LYS 57 5.034 14.031 -7.305 774 HE2 LYS 57 HE2 LYS 57 4.025 14.942 -10.015 775 HE3 LYS 57 HE1 LYS 57 3.174 15.183 -8.489 776 HZ1 LYS 57 HZ1 LYS 57 4.341 17.146 -8.786 777 HZ2 LYS 57 HZ2 LYS 57 5.724 16.365 -9.390 778 HZ3 LYS 57 HZ3 LYS 57 5.346 16.271 -7.736 779 H ALA 58 HN ALA 58 9.617 12.848 -7.205 780 HA ALA 58 HA ALA 58 10.472 15.435 -8.326 781 HB1 ALA 58 HB1 ALA 58 10.690 14.433 -5.478 782 HB2 ALA 58 HB2 ALA 58 9.358 15.413 -6.091 783 HB3 ALA 58 HB3 ALA 58 10.992 16.075 -6.048 784 H GLY 59 HN GLY 59 11.800 13.564 -9.605 785 HA2 GLY 59 HA2 GLY 59 14.086 12.449 -8.400 786 HA3 GLY 59 HA1 GLY 59 13.903 12.780 -10.120 787 H SER 60 HN SER 60 13.542 15.577 -9.966 788 HA SER 60 HA SER 60 16.215 16.478 -9.969 789 HB2 SER 60 HB2 SER 60 13.613 18.014 -9.840 790 HB3 SER 60 HB1 SER 60 15.188 18.759 -10.092 791 HG SER 60 HG SER 60 15.249 17.975 -12.063 792 H GLN 61 HN GLN 61 13.645 16.676 -7.550 793 HA GLN 61 HA GLN 61 13.675 17.190 -5.315 794 HB2 GLN 61 HB2 GLN 61 15.485 15.436 -5.355 795 HB3 GLN 61 HB1 GLN 61 16.662 16.744 -5.477 796 HG2 GLN 61 HG2 GLN 61 15.798 17.715 -3.377 797 HG3 GLN 61 HG1 GLN 61 14.638 16.393 -3.248 798 HE21 GLN 61 HE21 GLN 61 15.354 14.803 -1.834 799 HE22 GLN 61 HE22 GLN 61 16.977 14.361 -1.603 800 H SER 62 HN SER 62 13.080 19.350 -5.604 801 HA SER 62 HA SER 62 15.278 21.282 -5.194 802 HB2 SER 62 HB2 SER 62 14.020 22.901 -6.587 803 HB3 SER 62 HB1 SER 62 14.531 21.488 -7.507 804 HG SER 62 HG SER 62 12.499 21.223 -7.936 Start of MODEL 17 1 H1 MET 76 HT1 MET 76 10.256 -13.686 -18.917 2 H2 MET 76 HT2 MET 76 11.103 -14.880 -18.056 3 H3 MET 76 HT3 MET 76 9.406 -14.824 -17.990 4 HA MET 76 HA MET 76 11.030 -15.427 -20.398 5 HB2 MET 76 HB2 MET 76 10.979 -17.219 -18.653 6 HB3 MET 76 HB1 MET 76 9.218 -17.209 -18.739 7 HG2 MET 76 HG2 MET 76 10.067 -19.007 -20.155 8 HG3 MET 76 HG1 MET 76 9.369 -17.752 -21.171 9 HE1 MET 76 HE1 MET 76 12.226 -19.050 -19.363 10 HE2 MET 76 HE2 MET 76 13.597 -18.060 -19.848 11 HE3 MET 76 HE3 MET 76 13.256 -19.558 -20.706 12 H LYS 77 HN LYS 77 7.955 -14.683 -18.910 13 HA LYS 77 HA LYS 77 6.754 -14.452 -21.600 14 HB2 LYS 77 HB2 LYS 77 5.423 -15.564 -19.116 15 HB3 LYS 77 HB1 LYS 77 4.612 -15.223 -20.645 16 HG2 LYS 77 HG2 LYS 77 5.946 -16.858 -21.808 17 HG3 LYS 77 HG1 LYS 77 6.993 -17.077 -20.407 18 HD2 LYS 77 HD2 LYS 77 5.486 -18.943 -20.430 19 HD3 LYS 77 HD1 LYS 77 4.947 -17.877 -19.134 20 HE2 LYS 77 HE2 LYS 77 3.172 -16.984 -20.520 21 HE3 LYS 77 HE1 LYS 77 3.786 -17.839 -21.935 22 HZ1 LYS 77 HZ1 LYS 77 2.306 -18.852 -19.633 23 HZ2 LYS 77 HZ2 LYS 77 3.487 -19.873 -20.302 24 HZ3 LYS 77 HZ3 LYS 77 2.210 -19.301 -21.265 25 H ASP 78 HN ASP 78 4.375 -13.854 -19.499 26 HA ASP 78 HA ASP 78 4.839 -10.956 -19.590 27 HB2 ASP 78 HB2 ASP 78 2.442 -10.750 -19.190 28 HB3 ASP 78 HB1 ASP 78 2.734 -11.836 -20.547 29 H THR 79 HN THR 79 5.802 -13.139 -17.560 30 HA THR 79 HA THR 79 4.671 -12.826 -15.071 31 HB THR 79 HB THR 79 6.948 -13.224 -14.146 32 HG1 THR 79 HG1 THR 79 7.654 -12.856 -16.866 33 HG21 THR 79 HG21 THR 79 5.659 -15.133 -14.908 34 HG22 THR 79 HG22 THR 79 7.340 -15.366 -15.384 35 HG23 THR 79 HG23 THR 79 6.150 -14.845 -16.577 36 H ASP 80 HN ASP 80 4.005 -10.969 -14.215 37 HA ASP 80 HA ASP 80 5.808 -8.627 -14.311 38 HB2 ASP 80 HB2 ASP 80 2.800 -8.817 -14.162 39 HB3 ASP 80 HB1 ASP 80 3.685 -7.322 -13.864 40 H SER 81 HN SER 81 5.929 -7.295 -12.446 41 HA SER 81 HA SER 81 5.874 -8.802 -9.964 42 HB2 SER 81 HB2 SER 81 6.740 -5.961 -10.559 43 HB3 SER 81 HB1 SER 81 6.920 -6.769 -9.003 44 HG SER 81 HG SER 81 8.460 -8.010 -9.812 45 H GLU 82 HN GLU 82 3.612 -7.015 -11.640 46 HA GLU 82 HA GLU 82 2.417 -5.440 -9.652 47 HB2 GLU 82 HB2 GLU 82 0.381 -5.591 -11.011 48 HB3 GLU 82 HB1 GLU 82 1.792 -5.313 -12.027 49 HG2 GLU 82 HG2 GLU 82 0.717 -7.047 -13.166 50 HG3 GLU 82 HG1 GLU 82 1.892 -7.913 -12.183 51 H GLU 83 HN GLU 83 2.217 -8.835 -10.389 52 HA GLU 83 HA GLU 83 0.053 -9.453 -8.639 53 HB2 GLU 83 HB2 GLU 83 1.220 -11.812 -8.782 54 HB3 GLU 83 HB1 GLU 83 0.395 -11.139 -10.187 55 HG2 GLU 83 HG2 GLU 83 2.362 -10.625 -11.275 56 HG3 GLU 83 HG1 GLU 83 3.292 -10.474 -9.780 57 H GLU 84 HN GLU 84 3.556 -9.300 -8.258 58 HA GLU 84 HA GLU 84 3.712 -10.521 -5.716 59 HB2 GLU 84 HB2 GLU 84 5.469 -8.484 -7.103 60 HB3 GLU 84 HB1 GLU 84 5.866 -9.182 -5.531 61 HG2 GLU 84 HG2 GLU 84 5.904 -11.414 -6.466 62 HG3 GLU 84 HG1 GLU 84 5.295 -10.824 -8.012 63 H ILE 85 HN ILE 85 3.194 -7.178 -6.736 64 HA ILE 85 HA ILE 85 3.218 -6.015 -4.157 65 HB ILE 85 HB ILE 85 1.873 -5.140 -6.718 66 HG12 ILE 85 HG12 ILE 85 4.328 -5.276 -6.842 67 HG13 ILE 85 HG11 ILE 85 3.791 -3.601 -6.887 68 HG21 ILE 85 HG21 ILE 85 2.062 -2.849 -5.465 69 HG22 ILE 85 HG22 ILE 85 2.096 -3.852 -4.015 70 HG23 ILE 85 HG23 ILE 85 0.711 -3.926 -5.107 71 HD11 ILE 85 HD11 ILE 85 4.156 -3.788 -4.239 72 HD12 ILE 85 HD12 ILE 85 5.492 -3.432 -5.330 73 HD13 ILE 85 HD13 ILE 85 5.261 -5.070 -4.734 74 H ARG 86 HN ARG 86 0.624 -7.333 -6.172 75 HA ARG 86 HA ARG 86 -1.549 -6.606 -4.552 76 HB2 ARG 86 HB2 ARG 86 -1.160 -8.898 -6.477 77 HB3 ARG 86 HB1 ARG 86 -2.694 -8.581 -5.664 78 HG2 ARG 86 HG2 ARG 86 -2.783 -6.339 -6.627 79 HG3 ARG 86 HG1 ARG 86 -1.202 -6.566 -7.370 80 HD2 ARG 86 HD2 ARG 86 -2.086 -8.414 -8.727 81 HD3 ARG 86 HD1 ARG 86 -3.662 -8.233 -7.962 82 HE ARG 86 HE ARG 86 -2.955 -5.750 -9.061 83 HH11 ARG 86 HH21 ARG 86 -3.679 -8.989 -10.039 84 HH12 ARG 86 HH22 ARG 86 -4.335 -8.527 -11.574 85 HH21 ARG 86 HH11 ARG 86 -3.814 -5.136 -11.072 86 HH22 ARG 86 HH12 ARG 86 -4.412 -6.345 -12.159 87 H GLU 87 HN GLU 87 0.645 -9.375 -4.370 88 HA GLU 87 HA GLU 87 -0.792 -10.958 -2.569 89 HB2 GLU 87 HB2 GLU 87 1.302 -11.679 -3.682 90 HB3 GLU 87 HB1 GLU 87 2.208 -10.551 -2.675 91 HG2 GLU 87 HG2 GLU 87 1.477 -11.723 -0.652 92 HG3 GLU 87 HG1 GLU 87 0.497 -12.821 -1.624 93 H ALA 88 HN ALA 88 1.336 -8.197 -2.041 94 HA ALA 88 HA ALA 88 1.372 -8.260 0.780 95 HB1 ALA 88 HB1 ALA 88 2.847 -6.863 -0.748 96 HB2 ALA 88 HB2 ALA 88 2.206 -6.026 0.666 97 HB3 ALA 88 HB3 ALA 88 1.479 -5.763 -0.920 98 H PHE 89 HN PHE 89 -0.944 -6.897 -1.528 99 HA PHE 89 HA PHE 89 -2.477 -5.568 0.523 100 HB2 PHE 89 HB2 PHE 89 -2.949 -6.101 -2.402 101 HB3 PHE 89 HB1 PHE 89 -4.181 -5.367 -1.371 102 HD1 PHE 89 HD2 PHE 89 -3.742 -3.205 -0.230 103 HD2 PHE 89 HD1 PHE 89 -0.970 -4.885 -3.039 104 HE1 PHE 89 HE2 PHE 89 -2.588 -1.018 -0.398 105 HE2 PHE 89 HE1 PHE 89 0.199 -2.702 -3.203 106 HZ PHE 89 HZ PHE 89 -0.623 -0.769 -1.883 107 H ARG 90 HN ARG 90 -2.766 -8.540 -1.364 108 HA ARG 90 HA ARG 90 -5.239 -9.425 -0.597 109 HB2 ARG 90 HB2 ARG 90 -2.713 -11.017 -1.011 110 HB3 ARG 90 HB1 ARG 90 -4.273 -11.782 -0.701 111 HG2 ARG 90 HG2 ARG 90 -5.234 -10.599 -2.648 112 HG3 ARG 90 HG1 ARG 90 -3.668 -9.863 -2.970 113 HD2 ARG 90 HD2 ARG 90 -2.679 -12.103 -3.283 114 HD3 ARG 90 HD1 ARG 90 -4.244 -12.838 -2.957 115 HE ARG 90 HE ARG 90 -4.548 -10.990 -5.062 116 HH11 ARG 90 HH21 ARG 90 -3.005 -13.995 -4.312 117 HH12 ARG 90 HH22 ARG 90 -3.068 -14.591 -5.937 118 HH21 ARG 90 HH11 ARG 90 -4.632 -11.764 -7.195 119 HH22 ARG 90 HH12 ARG 90 -3.989 -13.329 -7.569 120 H VAL 91 HN VAL 91 -2.429 -9.101 1.408 121 HA VAL 91 HA VAL 91 -3.150 -10.840 3.510 122 HB VAL 91 HB VAL 91 -1.501 -8.305 3.453 123 HG11 VAL 91 HG11 VAL 91 -2.331 -10.099 5.718 124 HG12 VAL 91 HG12 VAL 91 -2.086 -8.353 5.714 125 HG13 VAL 91 HG13 VAL 91 -0.696 -9.438 5.722 126 HG21 VAL 91 HG21 VAL 91 -0.984 -10.840 2.503 127 HG22 VAL 91 HG22 VAL 91 -0.306 -10.911 4.129 128 HG23 VAL 91 HG23 VAL 91 0.249 -9.679 2.995 129 H PHE 92 HN PHE 92 -4.000 -7.477 2.797 130 HA PHE 92 HA PHE 92 -5.552 -7.247 5.256 131 HB2 PHE 92 HB2 PHE 92 -5.382 -5.273 2.976 132 HB3 PHE 92 HB1 PHE 92 -5.878 -4.956 4.639 133 HD1 PHE 92 HD2 PHE 92 -4.027 -5.924 6.422 134 HD2 PHE 92 HD1 PHE 92 -3.242 -4.554 2.438 135 HE1 PHE 92 HE2 PHE 92 -1.660 -5.515 7.032 136 HE2 PHE 92 HE1 PHE 92 -0.881 -4.147 3.043 137 HZ PHE 92 HZ PHE 92 -0.084 -4.629 5.336 138 H ASP 93 HN ASP 93 -6.047 -7.927 1.876 139 HA ASP 93 HA ASP 93 -8.942 -7.531 2.062 140 HB2 ASP 93 HB2 ASP 93 -7.591 -6.995 -0.029 141 HB3 ASP 93 HB1 ASP 93 -7.414 -8.731 -0.246 142 H LYS 94 HN LYS 94 -8.948 -9.200 3.881 143 HA LYS 94 HA LYS 94 -8.436 -11.933 3.275 144 HB2 LYS 94 HB2 LYS 94 -9.500 -12.369 5.410 145 HB3 LYS 94 HB1 LYS 94 -8.408 -10.997 5.557 146 HG2 LYS 94 HG2 LYS 94 -10.343 -9.460 5.279 147 HG3 LYS 94 HG1 LYS 94 -11.420 -10.856 5.227 148 HD2 LYS 94 HD2 LYS 94 -10.606 -11.536 7.479 149 HD3 LYS 94 HD1 LYS 94 -9.623 -10.071 7.538 150 HE2 LYS 94 HE2 LYS 94 -12.639 -10.134 7.219 151 HE3 LYS 94 HE1 LYS 94 -11.785 -9.772 8.719 152 HZ1 LYS 94 HZ1 LYS 94 -10.598 -8.064 7.088 153 HZ2 LYS 94 HZ2 LYS 94 -12.006 -7.677 7.957 154 HZ3 LYS 94 HZ3 LYS 94 -12.111 -8.146 6.327 155 H ASP 95 HN ASP 95 -11.061 -9.829 2.636 156 HA ASP 95 HA ASP 95 -13.067 -11.911 2.470 157 HB2 ASP 95 HB2 ASP 95 -13.048 -9.001 1.656 158 HB3 ASP 95 HB1 ASP 95 -14.435 -10.064 1.423 159 H GLY 96 HN GLY 96 -10.760 -10.372 0.376 160 HA2 GLY 96 HA2 GLY 96 -10.085 -10.905 -1.766 161 HA3 GLY 96 HA1 GLY 96 -11.101 -12.341 -1.664 162 H ASN 97 HN ASN 97 -12.355 -9.116 -1.128 163 HA ASN 97 HA ASN 97 -14.110 -9.458 -3.456 164 HB2 ASN 97 HB2 ASN 97 -15.456 -7.681 -2.481 165 HB3 ASN 97 HB1 ASN 97 -15.125 -8.909 -1.261 166 HD21 ASN 97 HD21 ASN 97 -15.672 -6.847 0.142 167 HD22 ASN 97 HD22 ASN 97 -14.348 -5.874 0.569 168 H GLY 98 HN GLY 98 -11.167 -8.152 -2.869 169 HA2 GLY 98 HA2 GLY 98 -9.911 -6.947 -4.470 170 HA3 GLY 98 HA1 GLY 98 -11.411 -6.339 -5.158 171 H TYR 99 HN TYR 99 -11.479 -6.102 -1.807 172 HA TYR 99 HA TYR 99 -10.337 -3.384 -1.815 173 HB2 TYR 99 HB2 TYR 99 -13.026 -4.052 -0.616 174 HB3 TYR 99 HB1 TYR 99 -12.231 -2.477 -0.646 175 HD1 TYR 99 HD1 TYR 99 -13.425 -5.174 -2.924 176 HD2 TYR 99 HD2 TYR 99 -12.643 -0.989 -2.402 177 HE1 TYR 99 HE1 TYR 99 -14.404 -4.723 -5.157 178 HE2 TYR 99 HE2 TYR 99 -13.624 -0.530 -4.641 179 HH TYR 99 HH TYR 99 -14.211 -1.548 -6.636 180 H ILE 100 HN ILE 100 -9.880 -2.501 0.289 181 HA ILE 100 HA ILE 100 -9.697 -4.498 2.450 182 HB ILE 100 HB ILE 100 -7.445 -4.214 2.771 183 HG12 ILE 100 HG12 ILE 100 -7.825 -1.389 1.751 184 HG13 ILE 100 HG11 ILE 100 -7.472 -1.885 3.407 185 HG21 ILE 100 HG21 ILE 100 -7.381 -3.044 -0.004 186 HG22 ILE 100 HG22 ILE 100 -7.905 -4.711 0.265 187 HG23 ILE 100 HG23 ILE 100 -6.279 -4.217 0.725 188 HD11 ILE 100 HD11 ILE 100 -5.363 -1.250 2.660 189 HD12 ILE 100 HD12 ILE 100 -5.655 -1.832 1.020 190 HD13 ILE 100 HD13 ILE 100 -5.348 -2.981 2.323 191 H SER 101 HN SER 101 -9.982 -3.570 4.554 192 HA SER 101 HA SER 101 -11.633 -1.302 4.669 193 HB2 SER 101 HB2 SER 101 -11.619 -2.939 6.466 194 HB3 SER 101 HB1 SER 101 -9.932 -2.581 6.827 195 HG SER 101 HG SER 101 -10.530 -0.825 7.837 196 H ALA 102 HN ALA 102 -11.216 0.826 4.700 197 HA ALA 102 HA ALA 102 -8.630 1.831 4.162 198 HB1 ALA 102 HB1 ALA 102 -11.120 2.836 3.869 199 HB2 ALA 102 HB2 ALA 102 -9.665 3.835 3.850 200 HB3 ALA 102 HB3 ALA 102 -10.616 3.687 5.330 201 H ALA 103 HN ALA 103 -10.514 1.592 7.128 202 HA ALA 103 HA ALA 103 -8.922 3.192 8.790 203 HB1 ALA 103 HB1 ALA 103 -10.835 0.946 9.262 204 HB2 ALA 103 HB2 ALA 103 -10.936 2.633 9.767 205 HB3 ALA 103 HB3 ALA 103 -9.847 1.525 10.605 206 H GLU 104 HN GLU 104 -8.619 -0.295 8.060 207 HA GLU 104 HA GLU 104 -6.523 -0.729 9.934 208 HB2 GLU 104 HB2 GLU 104 -6.514 -2.895 9.185 209 HB3 GLU 104 HB1 GLU 104 -8.095 -2.406 8.588 210 HG2 GLU 104 HG2 GLU 104 -6.875 -1.734 6.428 211 HG3 GLU 104 HG1 GLU 104 -5.513 -2.657 7.048 212 H LEU 105 HN LEU 105 -6.628 0.362 6.618 213 HA LEU 105 HA LEU 105 -3.923 -0.043 5.936 214 HB2 LEU 105 HB2 LEU 105 -5.574 0.529 4.243 215 HB3 LEU 105 HB1 LEU 105 -5.859 2.090 5.009 216 HG LEU 105 HG LEU 105 -3.026 1.593 4.429 217 HD11 LEU 105 HD11 LEU 105 -3.422 2.114 1.949 218 HD12 LEU 105 HD12 LEU 105 -5.090 1.608 2.218 219 HD13 LEU 105 HD13 LEU 105 -3.771 0.463 2.465 220 HD21 LEU 105 HD21 LEU 105 -3.100 3.882 3.758 221 HD22 LEU 105 HD22 LEU 105 -4.212 3.759 5.121 222 HD23 LEU 105 HD23 LEU 105 -4.840 3.817 3.474 223 H ARG 106 HN ARG 106 -5.566 2.814 7.304 224 HA ARG 106 HA ARG 106 -3.321 4.456 7.487 225 HB2 ARG 106 HB2 ARG 106 -5.199 5.669 7.945 226 HB3 ARG 106 HB1 ARG 106 -5.978 4.346 8.802 227 HG2 ARG 106 HG2 ARG 106 -5.380 6.305 10.258 228 HG3 ARG 106 HG1 ARG 106 -4.687 4.786 10.803 229 HD2 ARG 106 HD2 ARG 106 -2.607 5.637 10.641 230 HD3 ARG 106 HD1 ARG 106 -2.872 6.107 8.970 231 HE ARG 106 HE ARG 106 -3.402 8.263 9.692 232 HH11 ARG 106 HH21 ARG 106 -3.161 6.029 12.324 233 HH12 ARG 106 HH22 ARG 106 -3.204 7.254 13.548 234 HH21 ARG 106 HH11 ARG 106 -3.453 9.874 11.287 235 HH22 ARG 106 HH12 ARG 106 -3.372 9.433 12.960 236 H HIS 107 HN HIS 107 -4.680 2.253 9.985 237 HA HIS 107 HA HIS 107 -2.706 2.697 11.928 238 HB2 HIS 107 HB2 HIS 107 -4.758 1.556 12.480 239 HB3 HIS 107 HB1 HIS 107 -4.419 0.279 11.314 240 HD1 HIS 107 HD1 HIS 107 -2.781 1.780 14.423 241 HD2 HIS 107 HD2 HIS 107 -3.147 -1.884 12.453 242 HE1 HIS 107 HE1 HIS 107 -1.627 0.064 15.884 243 HE2 HIS 107 HE2 HIS 107 -1.836 -2.172 14.698 244 H VAL 108 HN VAL 108 -2.931 0.283 9.361 245 HA VAL 108 HA VAL 108 -0.551 -1.113 9.916 246 HB VAL 108 HB VAL 108 -2.139 -0.733 7.375 247 HG11 VAL 108 HG11 VAL 108 0.279 -2.443 7.968 248 HG12 VAL 108 HG12 VAL 108 0.045 -1.322 6.628 249 HG13 VAL 108 HG13 VAL 108 -0.854 -2.832 6.682 250 HG21 VAL 108 HG21 VAL 108 -1.899 -3.301 8.882 251 HG22 VAL 108 HG22 VAL 108 -3.272 -2.650 7.989 252 HG23 VAL 108 HG23 VAL 108 -2.891 -2.030 9.596 253 H MET 109 HN MET 109 -1.220 1.694 7.912 254 HA MET 109 HA MET 109 1.398 1.841 6.742 255 HB2 MET 109 HB2 MET 109 -1.037 3.541 6.745 256 HB3 MET 109 HB1 MET 109 0.497 4.345 6.409 257 HG2 MET 109 HG2 MET 109 -0.779 3.377 4.395 258 HG3 MET 109 HG1 MET 109 0.936 2.981 4.528 259 HE1 MET 109 HE1 MET 109 0.443 0.039 3.044 260 HE2 MET 109 HE2 MET 109 -0.032 1.705 2.729 261 HE3 MET 109 HE3 MET 109 -1.264 0.451 2.837 262 H THR 110 HN THR 110 -0.050 3.120 9.674 263 HA THR 110 HA THR 110 2.372 4.733 10.150 264 HB THR 110 HB THR 110 1.062 5.867 11.866 265 HG1 THR 110 HG1 THR 110 -0.604 3.715 11.368 266 HG21 THR 110 HG21 THR 110 -0.576 5.572 9.344 267 HG22 THR 110 HG22 THR 110 0.912 6.513 9.436 268 HG23 THR 110 HG23 THR 110 -0.488 6.977 10.406 269 H ASN 111 HN ASN 111 0.878 1.794 11.131 270 HA ASN 111 HA ASN 111 2.419 1.771 13.652 271 HB2 ASN 111 HB2 ASN 111 -0.099 1.285 13.588 272 HB3 ASN 111 HB1 ASN 111 0.348 -0.257 12.860 273 HD21 ASN 111 HD21 ASN 111 -0.171 -1.591 14.689 274 HD22 ASN 111 HD22 ASN 111 0.666 -1.484 16.163 275 H LEU 112 HN LEU 112 2.149 0.199 10.543 276 HA LEU 112 HA LEU 112 4.309 -1.672 11.345 277 HB2 LEU 112 HB2 LEU 112 2.188 -2.110 9.240 278 HB3 LEU 112 HB1 LEU 112 3.442 -3.251 9.706 279 HG LEU 112 HG LEU 112 1.257 -2.201 11.529 280 HD11 LEU 112 HD11 LEU 112 1.179 -4.203 9.545 281 HD12 LEU 112 HD12 LEU 112 -0.004 -3.932 10.826 282 HD13 LEU 112 HD13 LEU 112 1.325 -5.064 11.079 283 HD21 LEU 112 HD21 LEU 112 2.909 -2.738 13.049 284 HD22 LEU 112 HD22 LEU 112 3.709 -3.857 11.945 285 HD23 LEU 112 HD23 LEU 112 2.248 -4.353 12.797 286 H GLY 113 HN GLY 113 5.257 -2.619 9.191 287 HA2 GLY 113 HA2 GLY 113 6.638 -2.288 7.388 288 HA3 GLY 113 HA1 GLY 113 5.525 -1.022 6.896 289 H GLU 114 HN GLU 114 6.513 0.816 6.560 290 HA GLU 114 HA GLU 114 8.986 1.435 8.000 291 HB2 GLU 114 HB2 GLU 114 7.756 2.745 5.571 292 HB3 GLU 114 HB1 GLU 114 9.318 3.163 6.277 293 HG2 GLU 114 HG2 GLU 114 8.603 0.388 5.301 294 HG3 GLU 114 HG1 GLU 114 9.469 1.574 4.326 295 H LYS 115 HN LYS 115 6.017 1.795 8.797 296 HA LYS 115 HA LYS 115 4.720 3.309 9.940 297 HB2 LYS 115 HB2 LYS 115 7.531 3.713 10.834 298 HB3 LYS 115 HB1 LYS 115 6.253 4.729 11.506 299 HG2 LYS 115 HG2 LYS 115 5.015 2.701 12.187 300 HG3 LYS 115 HG1 LYS 115 6.294 1.693 11.507 301 HD2 LYS 115 HD2 LYS 115 7.901 2.526 13.101 302 HD3 LYS 115 HD1 LYS 115 6.770 3.750 13.680 303 HE2 LYS 115 HE2 LYS 115 6.832 1.854 15.239 304 HE3 LYS 115 HE1 LYS 115 5.250 1.954 14.465 305 HZ1 LYS 115 HZ1 LYS 115 5.547 -0.121 13.794 306 HZ2 LYS 115 HZ2 LYS 115 7.137 -0.151 14.391 307 HZ3 LYS 115 HZ3 LYS 115 6.830 0.399 12.813 308 H LEU 116 HN LEU 116 3.705 4.705 8.634 309 HA LEU 116 HA LEU 116 5.179 6.914 7.410 310 HB2 LEU 116 HB2 LEU 116 2.449 5.726 7.019 311 HB3 LEU 116 HB1 LEU 116 2.752 7.376 6.489 312 HG LEU 116 HG LEU 116 3.106 5.683 4.681 313 HD11 LEU 116 HD11 LEU 116 4.640 7.072 3.800 314 HD12 LEU 116 HD12 LEU 116 5.864 6.547 4.954 315 HD13 LEU 116 HD13 LEU 116 4.756 7.849 5.377 316 HD21 LEU 116 HD21 LEU 116 4.981 4.152 4.813 317 HD22 LEU 116 HD22 LEU 116 3.964 3.901 6.231 318 HD23 LEU 116 HD23 LEU 116 5.467 4.811 6.374 319 H THR 117 HN THR 117 4.428 9.135 7.626 320 HA THR 117 HA THR 117 3.487 9.685 10.340 321 HB THR 117 HB THR 117 4.202 11.979 9.891 322 HG1 THR 117 HG1 THR 117 3.732 12.230 7.763 323 HG21 THR 117 HG21 THR 117 6.271 11.298 10.436 324 HG22 THR 117 HG22 THR 117 6.576 10.851 8.758 325 HG23 THR 117 HG23 THR 117 5.875 9.675 9.869 326 H ASP 118 HN ASP 118 1.947 11.642 10.512 327 HA ASP 118 HA ASP 118 -0.501 10.976 9.348 328 HB2 ASP 118 HB2 ASP 118 0.476 13.528 10.628 329 HB3 ASP 118 HB1 ASP 118 -1.194 13.293 10.116 330 H GLU 119 HN GLU 119 1.885 13.427 8.412 331 HA GLU 119 HA GLU 119 0.360 14.623 6.345 332 HB2 GLU 119 HB2 GLU 119 2.394 15.652 7.307 333 HB3 GLU 119 HB1 GLU 119 3.374 14.386 6.570 334 HG2 GLU 119 HG2 GLU 119 2.651 15.083 4.337 335 HG3 GLU 119 HG1 GLU 119 1.588 16.301 5.041 336 H GLU 120 HN GLU 120 2.653 11.909 6.326 337 HA GLU 120 HA GLU 120 2.548 11.490 3.507 338 HB2 GLU 120 HB2 GLU 120 3.294 9.662 5.788 339 HB3 GLU 120 HB1 GLU 120 3.406 9.193 4.102 340 HG2 GLU 120 HG2 GLU 120 4.848 11.506 5.412 341 HG3 GLU 120 HG1 GLU 120 5.573 9.990 4.896 342 H VAL 121 HN VAL 121 0.774 10.249 6.267 343 HA VAL 121 HA VAL 121 -0.740 8.258 4.983 344 HB VAL 121 HB VAL 121 -1.250 10.003 7.396 345 HG11 VAL 121 HG11 VAL 121 -2.961 8.150 7.912 346 HG12 VAL 121 HG12 VAL 121 -2.895 7.791 6.187 347 HG13 VAL 121 HG13 VAL 121 -3.419 9.384 6.743 348 HG21 VAL 121 HG21 VAL 121 -0.891 7.085 7.616 349 HG22 VAL 121 HG22 VAL 121 -0.179 8.382 8.576 350 HG23 VAL 121 HG23 VAL 121 0.523 7.951 7.017 351 H ASP 122 HN ASP 122 -1.411 11.719 5.554 352 HA ASP 122 HA ASP 122 -4.014 11.746 4.521 353 HB2 ASP 122 HB2 ASP 122 -2.997 13.640 5.752 354 HB3 ASP 122 HB1 ASP 122 -1.910 13.942 4.398 355 H GLU 123 HN GLU 123 -0.872 12.113 2.896 356 HA GLU 123 HA GLU 123 -1.882 12.651 0.301 357 HB2 GLU 123 HB2 GLU 123 0.682 11.305 1.196 358 HB3 GLU 123 HB1 GLU 123 0.344 11.789 -0.465 359 HG2 GLU 123 HG2 GLU 123 0.306 13.693 1.889 360 HG3 GLU 123 HG1 GLU 123 1.698 13.458 0.833 361 H MET 124 HN MET 124 -1.119 9.705 2.060 362 HA MET 124 HA MET 124 -1.520 7.839 -0.034 363 HB2 MET 124 HB2 MET 124 -1.727 7.585 2.974 364 HB3 MET 124 HB1 MET 124 -1.752 6.228 1.856 365 HG2 MET 124 HG2 MET 124 0.461 8.202 1.573 366 HG3 MET 124 HG1 MET 124 0.529 7.102 2.945 367 HE1 MET 124 HE1 MET 124 1.055 3.702 1.652 368 HE2 MET 124 HE2 MET 124 -0.403 4.417 2.335 369 HE3 MET 124 HE3 MET 124 1.173 4.885 2.963 370 H ILE 125 HN ILE 125 -3.681 9.190 2.447 371 HA ILE 125 HA ILE 125 -5.908 7.565 1.794 372 HB ILE 125 HB ILE 125 -5.351 9.829 3.555 373 HG12 ILE 125 HG12 ILE 125 -7.186 8.532 4.895 374 HG13 ILE 125 HG11 ILE 125 -6.939 7.273 3.694 375 HG21 ILE 125 HG21 ILE 125 -7.784 10.372 3.866 376 HG22 ILE 125 HG22 ILE 125 -8.104 9.536 2.349 377 HG23 ILE 125 HG23 ILE 125 -7.081 10.979 2.370 378 HD11 ILE 125 HD11 ILE 125 -5.161 8.213 5.851 379 HD12 ILE 125 HD12 ILE 125 -4.360 7.877 4.321 380 HD13 ILE 125 HD13 ILE 125 -5.285 6.612 5.128 381 H ARG 126 HN ARG 126 -4.761 10.659 0.637 382 HA ARG 126 HA ARG 126 -7.058 11.501 -0.755 383 HB2 ARG 126 HB2 ARG 126 -5.051 12.919 -0.319 384 HB3 ARG 126 HB1 ARG 126 -4.171 11.985 -1.529 385 HG2 ARG 126 HG2 ARG 126 -5.832 12.627 -3.240 386 HG3 ARG 126 HG1 ARG 126 -6.715 13.560 -2.030 387 HD2 ARG 126 HD2 ARG 126 -5.307 15.083 -3.280 388 HD3 ARG 126 HD1 ARG 126 -4.641 14.922 -1.658 389 HE ARG 126 HE ARG 126 -3.442 13.020 -3.397 390 HH11 ARG 126 HH21 ARG 126 -3.562 16.397 -2.656 391 HH12 ARG 126 HH22 ARG 126 -1.949 16.714 -3.200 392 HH21 ARG 126 HH11 ARG 126 -1.326 13.429 -4.114 393 HH22 ARG 126 HH12 ARG 126 -0.683 15.034 -4.025 394 H GLU 127 HN GLU 127 -4.526 9.238 -1.556 395 HA GLU 127 HA GLU 127 -5.605 8.850 -4.267 396 HB2 GLU 127 HB2 GLU 127 -3.129 7.721 -2.943 397 HB3 GLU 127 HB1 GLU 127 -3.602 7.449 -4.621 398 HG2 GLU 127 HG2 GLU 127 -3.118 10.186 -3.413 399 HG3 GLU 127 HG1 GLU 127 -1.918 9.289 -4.342 400 H ALA 128 HN ALA 128 -6.133 7.677 -1.208 401 HA ALA 128 HA ALA 128 -6.423 4.872 -1.921 402 HB1 ALA 128 HB1 ALA 128 -5.681 5.761 0.355 403 HB2 ALA 128 HB2 ALA 128 -6.893 4.495 0.359 404 HB3 ALA 128 HB3 ALA 128 -7.373 6.166 0.628 405 H ASP 129 HN ASP 129 -8.799 6.948 -0.231 406 HA ASP 129 HA ASP 129 -10.819 7.012 -2.108 407 HB2 ASP 129 HB2 ASP 129 -10.469 4.322 -0.979 408 HB3 ASP 129 HB1 ASP 129 -12.118 4.920 -0.888 409 H ILE 130 HN ILE 130 -11.602 5.375 0.839 410 HA ILE 130 HA ILE 130 -13.121 5.960 2.458 411 HB ILE 130 HB ILE 130 -11.206 8.284 2.742 412 HG12 ILE 130 HG12 ILE 130 -11.154 5.606 4.143 413 HG13 ILE 130 HG11 ILE 130 -10.189 5.938 2.704 414 HG21 ILE 130 HG21 ILE 130 -13.581 7.393 4.179 415 HG22 ILE 130 HG22 ILE 130 -12.615 8.852 4.418 416 HG23 ILE 130 HG23 ILE 130 -12.158 7.352 5.221 417 HD11 ILE 130 HD11 ILE 130 -9.177 7.889 3.880 418 HD12 ILE 130 HD12 ILE 130 -8.839 6.361 4.698 419 HD13 ILE 130 HD13 ILE 130 -10.075 7.446 5.333 420 H ASP 131 HN ASP 131 -14.106 6.780 -0.002 421 HA ASP 131 HA ASP 131 -14.806 9.508 -0.156 422 HB2 ASP 131 HB2 ASP 131 -15.140 7.878 -2.007 423 HB3 ASP 131 HB1 ASP 131 -16.421 7.109 -1.072 424 H GLY 132 HN GLY 132 -16.319 6.725 1.353 425 HA2 GLY 132 HA2 GLY 132 -17.298 7.933 3.628 426 HA3 GLY 132 HA1 GLY 132 -18.574 8.121 2.425 427 H ASP 133 HN ASP 133 -16.425 5.398 2.271 428 HA ASP 133 HA ASP 133 -18.609 3.657 3.200 429 HB2 ASP 133 HB2 ASP 133 -16.544 3.085 1.076 430 HB3 ASP 133 HB1 ASP 133 -17.797 1.967 1.616 431 H GLY 134 HN GLY 134 -15.252 4.442 3.489 432 HA2 GLY 134 HA2 GLY 134 -13.834 3.850 5.243 433 HA3 GLY 134 HA1 GLY 134 -15.048 2.707 5.803 434 H GLN 135 HN GLN 135 -14.316 2.418 2.473 435 HA GLN 135 HA GLN 135 -12.403 0.229 3.024 436 HB2 GLN 135 HB2 GLN 135 -13.449 -0.903 0.973 437 HB3 GLN 135 HB1 GLN 135 -14.368 -0.946 2.482 438 HG2 GLN 135 HG2 GLN 135 -15.663 1.027 1.717 439 HG3 GLN 135 HG1 GLN 135 -14.777 1.001 0.194 440 HE21 GLN 135 HE21 GLN 135 -17.619 -0.078 1.639 441 HE22 GLN 135 HE22 GLN 135 -17.972 -1.360 0.585 442 H VAL 136 HN VAL 136 -10.872 -0.204 1.431 443 HA VAL 136 HA VAL 136 -10.499 1.920 -0.581 444 HB VAL 136 HB VAL 136 -8.525 0.742 1.359 445 HG11 VAL 136 HG11 VAL 136 -6.866 2.206 0.073 446 HG12 VAL 136 HG12 VAL 136 -8.053 2.223 -1.232 447 HG13 VAL 136 HG13 VAL 136 -7.336 0.696 -0.706 448 HG21 VAL 136 HG21 VAL 136 -8.995 3.625 0.664 449 HG22 VAL 136 HG22 VAL 136 -8.319 2.948 2.140 450 HG23 VAL 136 HG23 VAL 136 -10.043 2.796 1.805 451 H ASN 137 HN ASN 137 -9.965 1.279 -2.579 452 HA ASN 137 HA ASN 137 -9.715 -1.597 -3.053 453 HB2 ASN 137 HB2 ASN 137 -10.114 -1.070 -5.388 454 HB3 ASN 137 HB1 ASN 137 -11.322 -0.256 -4.400 455 HD21 ASN 137 HD21 ASN 137 -10.512 0.618 -7.068 456 HD22 ASN 137 HD22 ASN 137 -9.810 2.154 -6.893 457 H TYR 138 HN TYR 138 -7.661 -2.353 -2.929 458 HA TYR 138 HA TYR 138 -5.355 -0.763 -3.095 459 HB2 TYR 138 HB2 TYR 138 -4.122 -2.918 -3.300 460 HB3 TYR 138 HB1 TYR 138 -5.274 -2.888 -1.968 461 HD1 TYR 138 HD1 TYR 138 -4.706 -4.119 -5.427 462 HD2 TYR 138 HD2 TYR 138 -7.163 -4.352 -1.916 463 HE1 TYR 138 HE1 TYR 138 -5.817 -6.138 -6.340 464 HE2 TYR 138 HE2 TYR 138 -8.279 -6.369 -2.826 465 HH TYR 138 HH TYR 138 -7.693 -7.462 -6.111 466 H GLU 139 HN GLU 139 -7.389 -1.666 -5.593 467 HA GLU 139 HA GLU 139 -5.592 -2.262 -7.678 468 HB2 GLU 139 HB2 GLU 139 -8.286 -0.892 -7.717 469 HB3 GLU 139 HB1 GLU 139 -7.402 -1.323 -9.181 470 HG2 GLU 139 HG2 GLU 139 -7.412 -3.669 -8.566 471 HG3 GLU 139 HG1 GLU 139 -8.126 -3.296 -6.998 472 H GLU 140 HN GLU 140 -6.939 0.924 -6.706 473 HA GLU 140 HA GLU 140 -5.549 2.447 -8.596 474 HB2 GLU 140 HB2 GLU 140 -7.428 3.305 -7.238 475 HB3 GLU 140 HB1 GLU 140 -6.397 3.270 -5.807 476 HG2 GLU 140 HG2 GLU 140 -4.863 4.881 -6.834 477 HG3 GLU 140 HG1 GLU 140 -5.815 4.871 -8.318 478 H PHE 141 HN PHE 141 -4.606 1.466 -5.326 479 HA PHE 141 HA PHE 141 -2.197 2.960 -5.169 480 HB2 PHE 141 HB2 PHE 141 -3.312 0.567 -3.799 481 HB3 PHE 141 HB1 PHE 141 -1.562 0.760 -3.740 482 HD1 PHE 141 HD2 PHE 141 -0.597 2.957 -2.919 483 HD2 PHE 141 HD1 PHE 141 -4.741 1.919 -2.435 484 HE1 PHE 141 HE2 PHE 141 -0.817 4.663 -1.134 485 HE2 PHE 141 HE1 PHE 141 -4.953 3.620 -0.646 486 HZ PHE 141 HZ PHE 141 -2.996 4.994 0.002 487 H VAL 142 HN VAL 142 -2.836 -0.353 -6.306 488 HA VAL 142 HA VAL 142 -0.167 -0.927 -7.045 489 HB VAL 142 HB VAL 142 -2.813 -2.060 -7.961 490 HG11 VAL 142 HG11 VAL 142 -1.250 -3.969 -8.756 491 HG12 VAL 142 HG12 VAL 142 0.022 -2.748 -8.728 492 HG13 VAL 142 HG13 VAL 142 -1.381 -2.537 -9.778 493 HG21 VAL 142 HG21 VAL 142 -1.091 -3.883 -6.585 494 HG22 VAL 142 HG22 VAL 142 -2.640 -3.240 -6.048 495 HG23 VAL 142 HG23 VAL 142 -1.149 -2.391 -5.641 496 H GLN 143 HN GLN 143 -2.894 0.409 -8.952 497 HA GLN 143 HA GLN 143 -1.478 0.498 -11.397 498 HB2 GLN 143 HB2 GLN 143 -3.755 2.178 -10.322 499 HB3 GLN 143 HB1 GLN 143 -3.143 2.314 -11.972 500 HG2 GLN 143 HG2 GLN 143 -3.682 0.011 -12.435 501 HG3 GLN 143 HG1 GLN 143 -4.104 -0.279 -10.748 502 HE21 GLN 143 HE21 GLN 143 -5.828 -0.500 -13.199 503 HE22 GLN 143 HE22 GLN 143 -7.147 0.528 -12.910 504 H MET 144 HN MET 144 -1.799 2.685 -8.686 505 HA MET 144 HA MET 144 -0.327 4.877 -9.701 506 HB2 MET 144 HB2 MET 144 -1.569 5.411 -7.823 507 HB3 MET 144 HB1 MET 144 -1.214 3.887 -7.029 508 HG2 MET 144 HG2 MET 144 0.774 4.630 -6.162 509 HG3 MET 144 HG1 MET 144 1.042 5.795 -7.461 510 HE1 MET 144 HE1 MET 144 -1.607 6.155 -3.763 511 HE2 MET 144 HE2 MET 144 -0.821 4.730 -4.437 512 HE3 MET 144 HE3 MET 144 -2.303 5.336 -5.171 513 H MET 145 HN MET 145 0.654 2.081 -7.703 514 HA MET 145 HA MET 145 3.412 2.797 -7.618 515 HB2 MET 145 HB2 MET 145 1.969 0.191 -7.093 516 HB3 MET 145 HB1 MET 145 3.702 0.427 -6.831 517 HG2 MET 145 HG2 MET 145 3.247 2.236 -5.254 518 HG3 MET 145 HG1 MET 145 1.522 2.095 -5.555 519 HE1 MET 145 HE1 MET 145 2.258 1.167 -2.049 520 HE2 MET 145 HE2 MET 145 0.645 0.968 -2.730 521 HE3 MET 145 HE3 MET 145 1.652 2.314 -3.247 522 H THR 146 HN THR 146 1.475 1.156 -9.996 523 HA THR 146 HA THR 146 3.890 0.107 -11.311 524 HB THR 146 HB THR 146 2.312 -1.149 -12.737 525 HG1 THR 146 HG1 THR 146 0.109 -1.083 -12.136 526 HG21 THR 146 HG21 THR 146 2.976 -2.436 -10.917 527 HG22 THR 146 HG22 THR 146 1.225 -2.438 -10.721 528 HG23 THR 146 HG23 THR 146 2.220 -1.356 -9.747 529 H ALA 147 HN ALA 147 2.948 2.985 -11.213 530 HA ALA 147 HA ALA 147 2.590 3.439 -14.110 531 HB1 ALA 147 HB1 ALA 147 1.629 5.539 -13.589 532 HB2 ALA 147 HB2 ALA 147 2.247 5.504 -11.938 533 HB3 ALA 147 HB3 ALA 147 0.932 4.428 -12.410 534 H LYS 148 HN LYS 148 4.967 2.791 -14.067 535 HA LYS 148 HA LYS 148 6.561 5.168 -14.279 536 HB2 LYS 148 HB2 LYS 148 6.486 4.059 -11.740 537 HB3 LYS 148 HB1 LYS 148 7.931 3.336 -12.445 538 HG2 LYS 148 HG2 LYS 148 7.356 6.319 -12.459 539 HG3 LYS 148 HG1 LYS 148 8.364 5.510 -11.262 540 HD2 LYS 148 HD2 LYS 148 9.971 4.856 -12.902 541 HD3 LYS 148 HD1 LYS 148 8.895 5.282 -14.233 542 HE2 LYS 148 HE2 LYS 148 10.562 7.037 -13.976 543 HE3 LYS 148 HE1 LYS 148 8.988 7.666 -13.488 544 HZ1 LYS 148 HZ1 LYS 148 9.581 7.151 -11.177 545 HZ2 LYS 148 HZ2 LYS 148 10.641 8.279 -11.877 546 HZ3 LYS 148 HZ3 LYS 148 11.122 6.661 -11.686 547 H PHE 30 HT1 PHE 30 -8.631 -2.575 11.514 548 HA PHE 30 HA PHE 30 -7.383 -4.455 10.696 549 HB2 PHE 30 HB2 PHE 30 -5.457 -4.199 12.540 550 HB3 PHE 30 HB1 PHE 30 -5.846 -2.895 11.418 551 HD1 PHE 30 HD2 PHE 30 -7.307 -1.015 12.125 552 HD2 PHE 30 HD1 PHE 30 -5.986 -4.022 14.892 553 HE1 PHE 30 HE2 PHE 30 -7.950 0.449 14.017 554 HE2 PHE 30 HE1 PHE 30 -6.631 -2.559 16.788 555 HZ PHE 30 HZ PHE 30 -7.611 -0.322 16.352 556 H ASP 31 HN ASP 31 -8.791 -6.323 11.099 557 HA ASP 31 HA ASP 31 -8.325 -7.773 13.600 558 HB2 ASP 31 HB2 ASP 31 -10.129 -8.286 11.229 559 HB3 ASP 31 HB1 ASP 31 -9.960 -9.407 12.578 560 H ILE 32 HN ILE 32 -6.684 -7.383 10.813 561 HA ILE 32 HA ILE 32 -6.113 -9.990 9.918 562 HB ILE 32 HB ILE 32 -4.440 -9.032 8.621 563 HG12 ILE 32 HG12 ILE 32 -4.034 -7.044 10.883 564 HG13 ILE 32 HG11 ILE 32 -2.909 -8.300 10.351 565 HG21 ILE 32 HG21 ILE 32 -5.477 -7.235 7.672 566 HG22 ILE 32 HG22 ILE 32 -5.656 -6.390 9.210 567 HG23 ILE 32 HG23 ILE 32 -6.777 -7.684 8.773 568 HD11 ILE 32 HD11 ILE 32 -2.078 -6.334 9.356 569 HD12 ILE 32 HD12 ILE 32 -3.688 -5.775 8.905 570 HD13 ILE 32 HD13 ILE 32 -2.963 -7.146 8.066 571 H ASP 33 HN ASP 33 -3.842 -10.943 10.086 572 HA ASP 33 HA ASP 33 -3.269 -11.323 12.914 573 HB2 ASP 33 HB2 ASP 33 -2.027 -12.614 10.471 574 HB3 ASP 33 HB1 ASP 33 -1.785 -13.117 12.143 575 H MET 34 HN MET 34 -2.433 -9.214 13.344 576 HA MET 34 HA MET 34 -0.237 -8.099 11.941 577 HB2 MET 34 HB2 MET 34 -1.306 -7.593 14.722 578 HB3 MET 34 HB1 MET 34 -0.017 -6.647 13.980 579 HG2 MET 34 HG2 MET 34 -1.538 -6.109 12.082 580 HG3 MET 34 HG1 MET 34 -2.820 -7.014 12.881 581 HE1 MET 34 HE1 MET 34 -0.449 -3.638 14.593 582 HE2 MET 34 HE2 MET 34 -1.177 -3.084 13.089 583 HE3 MET 34 HE3 MET 34 -0.186 -4.535 13.093 584 H ASP 35 HN ASP 35 -0.496 -10.426 14.518 585 HA ASP 35 HA ASP 35 2.223 -10.220 15.406 586 HB2 ASP 35 HB2 ASP 35 1.753 -12.238 16.671 587 HB3 ASP 35 HB1 ASP 35 0.382 -11.140 16.810 588 H ALA 36 HN ALA 36 1.004 -11.159 12.530 589 HA ALA 36 HA ALA 36 2.710 -13.479 12.095 590 HB1 ALA 36 HB1 ALA 36 1.340 -12.193 9.816 591 HB2 ALA 36 HB2 ALA 36 0.296 -12.825 11.091 592 HB3 ALA 36 HB3 ALA 36 1.430 -13.895 10.267 593 HA PRO 37 HA PRO 37 6.086 -10.578 10.964 594 HB2 PRO 37 HB2 PRO 37 7.096 -13.136 9.767 595 HB3 PRO 37 HB1 PRO 37 7.961 -11.930 10.741 596 HG2 PRO 37 HG2 PRO 37 7.197 -14.200 11.827 597 HG3 PRO 37 HG1 PRO 37 7.036 -12.678 12.724 598 HD2 PRO 37 HD2 PRO 37 4.905 -14.306 11.385 599 HD3 PRO 37 HD1 PRO 37 4.835 -13.346 12.882 600 H GLU 38 HN GLU 38 4.544 -12.919 8.811 601 HA GLU 38 HA GLU 38 5.506 -11.958 6.351 602 HB2 GLU 38 HB2 GLU 38 2.932 -13.360 7.088 603 HB3 GLU 38 HB1 GLU 38 3.398 -13.007 5.424 604 HG2 GLU 38 HG2 GLU 38 5.415 -14.329 5.641 605 HG3 GLU 38 HG1 GLU 38 5.129 -14.559 7.365 606 H THR 39 HN THR 39 2.724 -10.975 8.313 607 HA THR 39 HA THR 39 1.539 -9.233 6.439 608 HB THR 39 HB THR 39 1.537 -9.051 9.464 609 HG1 THR 39 HG1 THR 39 -0.389 -10.157 7.707 610 HG21 THR 39 HG21 THR 39 -0.859 -8.091 8.394 611 HG22 THR 39 HG22 THR 39 0.393 -7.398 7.365 612 HG23 THR 39 HG23 THR 39 0.431 -7.123 9.106 613 H GLU 40 HN GLU 40 3.985 -8.677 8.952 614 HA GLU 40 HA GLU 40 4.218 -5.889 8.623 615 HB2 GLU 40 HB2 GLU 40 6.183 -7.973 9.590 616 HB3 GLU 40 HB1 GLU 40 6.510 -6.239 9.635 617 HG2 GLU 40 HG2 GLU 40 4.598 -5.852 11.071 618 HG3 GLU 40 HG1 GLU 40 4.086 -7.532 10.912 619 H ARG 41 HN ARG 41 5.862 -8.592 7.020 620 HA ARG 41 HA ARG 41 7.728 -7.045 5.568 621 HB2 ARG 41 HB2 ARG 41 6.492 -9.749 5.006 622 HB3 ARG 41 HB1 ARG 41 7.783 -9.052 4.028 623 HG2 ARG 41 HG2 ARG 41 8.131 -9.216 7.008 624 HG3 ARG 41 HG1 ARG 41 8.377 -10.664 6.034 625 HD2 ARG 41 HD2 ARG 41 10.018 -9.433 4.642 626 HD3 ARG 41 HD1 ARG 41 9.796 -8.007 5.646 627 HE ARG 41 HE ARG 41 10.487 -10.164 7.316 628 HH11 ARG 41 HH21 ARG 41 11.784 -8.173 4.800 629 HH12 ARG 41 HH22 ARG 41 13.421 -8.307 5.348 630 HH21 ARG 41 HH11 ARG 41 12.634 -10.345 8.041 631 HH22 ARG 41 HH12 ARG 41 13.903 -9.536 7.182 632 H ALA 42 HN ALA 42 4.425 -8.077 4.857 633 HA ALA 42 HA ALA 42 4.310 -7.186 2.183 634 HB1 ALA 42 HB1 ALA 42 1.777 -6.967 2.787 635 HB2 ALA 42 HB2 ALA 42 2.260 -7.706 4.314 636 HB3 ALA 42 HB3 ALA 42 2.529 -8.561 2.795 637 H ALA 43 HN ALA 43 3.695 -5.566 5.258 638 HA ALA 43 HA ALA 43 2.652 -3.154 4.255 639 HB1 ALA 43 HB1 ALA 43 3.363 -2.195 6.430 640 HB2 ALA 43 HB2 ALA 43 4.266 -3.673 6.762 641 HB3 ALA 43 HB3 ALA 43 2.510 -3.727 6.617 642 H VAL 44 HN VAL 44 5.971 -4.226 4.834 643 HA VAL 44 HA VAL 44 7.276 -1.777 4.401 644 HB VAL 44 HB VAL 44 8.183 -4.628 3.981 645 HG11 VAL 44 HG11 VAL 44 9.628 -2.001 3.666 646 HG12 VAL 44 HG12 VAL 44 9.647 -3.404 2.599 647 HG13 VAL 44 HG13 VAL 44 10.498 -3.460 4.143 648 HG21 VAL 44 HG21 VAL 44 7.707 -4.066 6.299 649 HG22 VAL 44 HG22 VAL 44 8.616 -2.561 6.160 650 HG23 VAL 44 HG23 VAL 44 9.457 -4.110 6.084 651 H ALA 45 HN ALA 45 6.505 -4.403 2.103 652 HA ALA 45 HA ALA 45 7.737 -3.238 -0.144 653 HB1 ALA 45 HB1 ALA 45 5.978 -4.661 -1.405 654 HB2 ALA 45 HB2 ALA 45 5.511 -5.229 0.199 655 HB3 ALA 45 HB3 ALA 45 7.154 -5.494 -0.387 656 H ILE 46 HN ILE 46 4.385 -3.019 1.024 657 HA ILE 46 HA ILE 46 3.437 -1.400 -1.089 658 HB ILE 46 HB ILE 46 2.483 -1.794 1.750 659 HG12 ILE 46 HG12 ILE 46 1.339 -2.753 -0.884 660 HG13 ILE 46 HG11 ILE 46 2.477 -3.703 0.070 661 HG21 ILE 46 HG21 ILE 46 1.627 0.355 1.049 662 HG22 ILE 46 HG22 ILE 46 0.325 -0.817 0.854 663 HG23 ILE 46 HG23 ILE 46 1.234 -0.271 -0.551 664 HD11 ILE 46 HD11 ILE 46 0.890 -4.299 1.555 665 HD12 ILE 46 HD12 ILE 46 -0.279 -3.701 0.378 666 HD13 ILE 46 HD13 ILE 46 0.278 -2.649 1.679 667 H GLN 47 HN GLN 47 4.646 -0.575 2.150 668 HA GLN 47 HA GLN 47 4.340 2.229 1.864 669 HB2 GLN 47 HB2 GLN 47 6.040 0.542 3.698 670 HB3 GLN 47 HB1 GLN 47 5.972 2.302 3.798 671 HG2 GLN 47 HG2 GLN 47 3.518 2.189 4.071 672 HG3 GLN 47 HG1 GLN 47 3.595 0.430 3.991 673 HE21 GLN 47 HE21 GLN 47 2.972 -0.054 6.148 674 HE22 GLN 47 HE22 GLN 47 3.862 0.442 7.503 675 H SER 48 HN SER 48 7.038 0.032 1.201 676 HA SER 48 HA SER 48 9.006 1.985 0.725 677 HB2 SER 48 HB2 SER 48 8.673 -0.792 -0.423 678 HB3 SER 48 HB1 SER 48 10.116 0.196 -0.631 679 HG SER 48 HG SER 48 10.671 -0.617 1.225 680 H GLN 49 HN GLN 49 6.638 0.471 -1.443 681 HA GLN 49 HA GLN 49 7.549 1.707 -3.824 682 HB2 GLN 49 HB2 GLN 49 4.856 0.583 -3.038 683 HB3 GLN 49 HB1 GLN 49 5.221 1.185 -4.652 684 HG2 GLN 49 HG2 GLN 49 6.807 -0.984 -3.260 685 HG3 GLN 49 HG1 GLN 49 5.523 -1.291 -4.424 686 HE21 GLN 49 HE21 GLN 49 8.756 -1.363 -4.328 687 HE22 GLN 49 HE22 GLN 49 9.138 -0.779 -5.875 688 H PHE 50 HN PHE 50 5.204 2.674 -1.359 689 HA PHE 50 HA PHE 50 4.121 4.895 -2.684 690 HB2 PHE 50 HB2 PHE 50 3.066 4.071 -0.678 691 HB3 PHE 50 HB1 PHE 50 4.516 4.394 0.272 692 HD1 PHE 50 HD1 PHE 50 2.296 6.244 -2.137 693 HD2 PHE 50 HD2 PHE 50 4.473 6.338 1.574 694 HE1 PHE 50 HE1 PHE 50 1.515 8.562 -1.738 695 HE2 PHE 50 HE2 PHE 50 3.704 8.661 1.957 696 HZ PHE 50 HZ PHE 50 2.222 9.778 0.310 697 H ARG 51 HN ARG 51 6.923 4.688 -0.490 698 HA ARG 51 HA ARG 51 7.561 7.431 -0.516 699 HB2 ARG 51 HB2 ARG 51 9.297 4.982 -0.142 700 HB3 ARG 51 HB1 ARG 51 9.883 6.630 0.076 701 HG2 ARG 51 HG2 ARG 51 8.143 7.019 1.790 702 HG3 ARG 51 HG1 ARG 51 7.577 5.361 1.583 703 HD2 ARG 51 HD2 ARG 51 10.400 6.108 2.392 704 HD3 ARG 51 HD1 ARG 51 9.135 5.646 3.529 705 HE ARG 51 HE ARG 51 9.261 3.611 1.639 706 HH11 ARG 51 HH21 ARG 51 11.331 5.139 3.954 707 HH12 ARG 51 HH22 ARG 51 12.285 3.722 4.242 708 HH21 ARG 51 HH11 ARG 51 10.513 1.750 2.007 709 HH22 ARG 51 HH12 ARG 51 11.821 1.803 3.140 710 H LYS 52 HN LYS 52 8.506 4.766 -2.649 711 HA LYS 52 HA LYS 52 10.362 6.230 -4.214 712 HB2 LYS 52 HB2 LYS 52 8.726 3.759 -4.798 713 HB3 LYS 52 HB1 LYS 52 9.926 4.410 -5.914 714 HG2 LYS 52 HG2 LYS 52 11.661 4.215 -4.171 715 HG3 LYS 52 HG1 LYS 52 10.463 3.558 -3.054 716 HD2 LYS 52 HD2 LYS 52 10.087 1.644 -4.534 717 HD3 LYS 52 HD1 LYS 52 11.216 2.311 -5.714 718 HE2 LYS 52 HE2 LYS 52 12.335 0.599 -4.360 719 HE3 LYS 52 HE1 LYS 52 13.030 2.185 -4.024 720 HZ1 LYS 52 HZ1 LYS 52 10.853 1.001 -2.399 721 HZ2 LYS 52 HZ2 LYS 52 11.819 2.349 -2.025 722 HZ3 LYS 52 HZ3 LYS 52 12.495 0.790 -2.031 723 H PHE 53 HN PHE 53 6.876 5.694 -4.496 724 HA PHE 53 HA PHE 53 6.488 6.766 -7.058 725 HB2 PHE 53 HB2 PHE 53 4.767 5.497 -5.853 726 HB3 PHE 53 HB1 PHE 53 4.607 6.812 -4.689 727 HD1 PHE 53 HD1 PHE 53 4.028 5.783 -8.189 728 HD2 PHE 53 HD2 PHE 53 3.497 8.893 -5.274 729 HE1 PHE 53 HE1 PHE 53 2.422 6.923 -9.700 730 HE2 PHE 53 HE2 PHE 53 1.898 10.035 -6.785 731 HZ PHE 53 HZ PHE 53 1.362 9.053 -8.999 732 H GLN 54 HN GLN 54 6.244 8.400 -3.877 733 HA GLN 54 HA GLN 54 5.653 10.945 -5.006 734 HB2 GLN 54 HB2 GLN 54 6.125 11.829 -2.754 735 HB3 GLN 54 HB1 GLN 54 5.064 10.421 -2.695 736 HG2 GLN 54 HG2 GLN 54 6.987 8.986 -2.170 737 HG3 GLN 54 HG1 GLN 54 8.060 10.383 -2.232 738 HE21 GLN 54 HE21 GLN 54 8.518 11.158 -0.172 739 HE22 GLN 54 HE22 GLN 54 7.445 11.127 1.142 740 H LYS 55 HN LYS 55 8.635 9.252 -4.361 741 HA LYS 55 HA LYS 55 10.395 11.462 -4.391 742 HB2 LYS 55 HB2 LYS 55 10.761 8.548 -5.087 743 HB3 LYS 55 HB1 LYS 55 12.083 9.710 -5.178 744 HG2 LYS 55 HG2 LYS 55 10.440 9.640 -2.680 745 HG3 LYS 55 HG1 LYS 55 11.607 8.344 -2.937 746 HD2 LYS 55 HD2 LYS 55 12.454 11.206 -3.315 747 HD3 LYS 55 HD1 LYS 55 12.349 10.539 -1.687 748 HE2 LYS 55 HE2 LYS 55 13.852 8.673 -2.395 749 HE3 LYS 55 HE1 LYS 55 14.022 9.441 -3.971 750 HZ1 LYS 55 HZ1 LYS 55 15.404 10.970 -3.163 751 HZ2 LYS 55 HZ2 LYS 55 15.598 9.916 -1.844 752 HZ3 LYS 55 HZ3 LYS 55 14.497 11.207 -1.750 753 H LYS 56 HN LYS 56 9.003 9.480 -6.955 754 HA LYS 56 HA LYS 56 10.513 10.446 -9.117 755 HB2 LYS 56 HB2 LYS 56 9.101 8.497 -9.361 756 HB3 LYS 56 HB1 LYS 56 7.659 9.446 -9.008 757 HG2 LYS 56 HG2 LYS 56 9.315 10.522 -11.203 758 HG3 LYS 56 HG1 LYS 56 8.612 8.942 -11.537 759 HD2 LYS 56 HD2 LYS 56 6.892 11.136 -10.393 760 HD3 LYS 56 HD1 LYS 56 7.237 11.092 -12.120 761 HE2 LYS 56 HE2 LYS 56 6.385 8.759 -12.215 762 HE3 LYS 56 HE1 LYS 56 5.976 8.856 -10.502 763 HZ1 LYS 56 HZ1 LYS 56 4.711 10.972 -11.246 764 HZ2 LYS 56 HZ2 LYS 56 4.011 9.444 -11.491 765 HZ3 LYS 56 HZ3 LYS 56 4.761 10.254 -12.783 766 H LYS 57 HN LYS 57 7.466 11.615 -7.706 767 HA LYS 57 HA LYS 57 6.991 13.683 -9.553 768 HB2 LYS 57 HB2 LYS 57 5.346 12.822 -7.863 769 HB3 LYS 57 HB1 LYS 57 6.264 13.654 -6.611 770 HG2 LYS 57 HG2 LYS 57 4.625 15.237 -7.105 771 HG3 LYS 57 HG1 LYS 57 5.926 15.759 -8.170 772 HD2 LYS 57 HD2 LYS 57 4.907 14.526 -10.044 773 HD3 LYS 57 HD1 LYS 57 3.623 13.957 -8.978 774 HE2 LYS 57 HE2 LYS 57 4.211 16.863 -9.612 775 HE3 LYS 57 HE1 LYS 57 2.899 15.915 -10.309 776 HZ1 LYS 57 HZ1 LYS 57 2.028 17.141 -8.490 777 HZ2 LYS 57 HZ2 LYS 57 3.277 16.634 -7.457 778 HZ3 LYS 57 HZ3 LYS 57 2.114 15.520 -8.001 779 H ALA 58 HN ALA 58 8.813 13.605 -6.514 780 HA ALA 58 HA ALA 58 9.434 16.349 -6.371 781 HB1 ALA 58 HB1 ALA 58 11.472 14.406 -5.434 782 HB2 ALA 58 HB2 ALA 58 9.862 14.258 -4.731 783 HB3 ALA 58 HB3 ALA 58 10.748 15.777 -4.594 784 H GLY 59 HN GLY 59 11.040 13.647 -7.993 785 HA2 GLY 59 HA2 GLY 59 12.416 13.710 -9.869 786 HA3 GLY 59 HA1 GLY 59 12.350 15.469 -9.823 787 H SER 60 HN SER 60 14.708 15.036 -10.358 788 HA SER 60 HA SER 60 16.259 14.854 -7.843 789 HB2 SER 60 HB2 SER 60 16.678 12.857 -9.173 790 HB3 SER 60 HB1 SER 60 17.028 13.842 -10.591 791 HG SER 60 HG SER 60 18.533 13.387 -8.287 792 H GLN 61 HN GLN 61 17.617 16.501 -7.442 793 HA GLN 61 HA GLN 61 18.438 18.655 -7.632 794 HB2 GLN 61 HB2 GLN 61 19.835 16.937 -9.239 795 HB3 GLN 61 HB1 GLN 61 19.379 18.199 -10.385 796 HG2 GLN 61 HG2 GLN 61 21.478 18.861 -9.420 797 HG3 GLN 61 HG1 GLN 61 20.237 19.893 -8.712 798 HE21 GLN 61 HE21 GLN 61 21.723 16.668 -8.009 799 HE22 GLN 61 HE22 GLN 61 21.832 16.931 -6.336 800 H SER 62 HN SER 62 15.689 18.106 -8.753 801 HA SER 62 HA SER 62 15.353 20.690 -10.021 802 HB2 SER 62 HB2 SER 62 15.924 19.213 -11.935 803 HB3 SER 62 HB1 SER 62 14.562 18.177 -11.514 804 HG SER 62 HG SER 62 14.608 20.775 -12.564 Start of MODEL 18 1 H1 MET 76 HT1 MET 76 -0.063 -18.595 -15.790 2 H2 MET 76 HT2 MET 76 0.663 -18.443 -14.261 3 H3 MET 76 HT3 MET 76 1.440 -19.321 -15.491 4 HA MET 76 HA MET 76 1.487 -17.190 -16.813 5 HB2 MET 76 HB2 MET 76 1.020 -16.018 -14.057 6 HB3 MET 76 HB1 MET 76 1.219 -15.137 -15.572 7 HG2 MET 76 HG2 MET 76 -1.063 -17.017 -14.902 8 HG3 MET 76 HG1 MET 76 -1.161 -15.259 -14.958 9 HE1 MET 76 HE1 MET 76 -0.650 -13.865 -16.753 10 HE2 MET 76 HE2 MET 76 -0.950 -14.193 -18.457 11 HE3 MET 76 HE3 MET 76 0.630 -14.548 -17.766 12 H LYS 77 HN LYS 77 3.603 -16.712 -17.103 13 HA LYS 77 HA LYS 77 5.514 -17.776 -15.182 14 HB2 LYS 77 HB2 LYS 77 5.859 -16.501 -17.906 15 HB3 LYS 77 HB1 LYS 77 7.184 -17.140 -16.932 16 HG2 LYS 77 HG2 LYS 77 6.116 -19.364 -16.930 17 HG3 LYS 77 HG1 LYS 77 4.793 -18.728 -17.910 18 HD2 LYS 77 HD2 LYS 77 6.372 -18.170 -19.709 19 HD3 LYS 77 HD1 LYS 77 7.713 -18.766 -18.730 20 HE2 LYS 77 HE2 LYS 77 7.020 -20.491 -20.325 21 HE3 LYS 77 HE1 LYS 77 6.649 -21.013 -18.681 22 HZ1 LYS 77 HZ1 LYS 77 4.404 -20.605 -18.969 23 HZ2 LYS 77 HZ2 LYS 77 4.856 -21.253 -20.473 24 HZ3 LYS 77 HZ3 LYS 77 4.643 -19.576 -20.297 25 H ASP 78 HN ASP 78 6.529 -16.605 -13.688 26 HA ASP 78 HA ASP 78 5.963 -14.032 -12.975 27 HB2 ASP 78 HB2 ASP 78 8.248 -14.000 -11.891 28 HB3 ASP 78 HB1 ASP 78 7.241 -15.388 -11.484 29 H THR 79 HN THR 79 5.783 -12.620 -14.682 30 HA THR 79 HA THR 79 8.342 -11.769 -15.911 31 HB THR 79 HB THR 79 7.063 -11.097 -17.907 32 HG1 THR 79 HG1 THR 79 4.879 -12.575 -17.008 33 HG21 THR 79 HG21 THR 79 7.436 -13.827 -16.966 34 HG22 THR 79 HG22 THR 79 7.742 -13.142 -18.561 35 HG23 THR 79 HG23 THR 79 6.127 -13.712 -18.142 36 H ASP 80 HN ASP 80 5.235 -10.880 -14.554 37 HA ASP 80 HA ASP 80 6.060 -8.044 -14.569 38 HB2 ASP 80 HB2 ASP 80 3.698 -7.501 -14.254 39 HB3 ASP 80 HB1 ASP 80 3.927 -8.499 -15.684 40 H SER 81 HN SER 81 6.327 -6.924 -12.745 41 HA SER 81 HA SER 81 6.409 -8.383 -10.229 42 HB2 SER 81 HB2 SER 81 7.155 -5.526 -10.908 43 HB3 SER 81 HB1 SER 81 7.376 -6.276 -9.330 44 HG SER 81 HG SER 81 8.346 -7.740 -11.449 45 H GLU 82 HN GLU 82 4.078 -6.727 -11.912 46 HA GLU 82 HA GLU 82 2.810 -5.147 -9.994 47 HB2 GLU 82 HB2 GLU 82 2.156 -5.223 -12.388 48 HB3 GLU 82 HB1 GLU 82 1.497 -6.840 -12.134 49 HG2 GLU 82 HG2 GLU 82 -0.091 -5.956 -10.483 50 HG3 GLU 82 HG1 GLU 82 0.588 -4.342 -10.676 51 H GLU 83 HN GLU 83 2.671 -8.596 -10.607 52 HA GLU 83 HA GLU 83 0.606 -9.242 -8.787 53 HB2 GLU 83 HB2 GLU 83 1.391 -11.516 -9.016 54 HB3 GLU 83 HB1 GLU 83 1.506 -10.733 -10.592 55 HG2 GLU 83 HG2 GLU 83 3.931 -10.185 -10.006 56 HG3 GLU 83 HG1 GLU 83 3.749 -11.274 -8.633 57 H GLU 84 HN GLU 84 4.125 -8.934 -8.447 58 HA GLU 84 HA GLU 84 4.366 -10.016 -5.856 59 HB2 GLU 84 HB2 GLU 84 6.046 -8.021 -7.385 60 HB3 GLU 84 HB1 GLU 84 6.498 -8.635 -5.793 61 HG2 GLU 84 HG2 GLU 84 6.545 -10.910 -6.617 62 HG3 GLU 84 HG1 GLU 84 5.882 -10.408 -8.171 63 H ILE 85 HN ILE 85 3.927 -6.643 -6.922 64 HA ILE 85 HA ILE 85 3.906 -5.561 -4.287 65 HB ILE 85 HB ILE 85 2.878 -4.490 -6.924 66 HG12 ILE 85 HG12 ILE 85 5.424 -4.793 -6.272 67 HG13 ILE 85 HG11 ILE 85 4.884 -3.306 -7.048 68 HG21 ILE 85 HG21 ILE 85 2.908 -2.276 -5.562 69 HG22 ILE 85 HG22 ILE 85 2.827 -3.322 -4.143 70 HG23 ILE 85 HG23 ILE 85 1.537 -3.363 -5.345 71 HD11 ILE 85 HD11 ILE 85 4.910 -3.535 -4.036 72 HD12 ILE 85 HD12 ILE 85 4.940 -2.085 -5.034 73 HD13 ILE 85 HD13 ILE 85 6.372 -3.109 -4.923 74 H ARG 86 HN ARG 86 1.475 -6.753 -6.501 75 HA ARG 86 HA ARG 86 -0.860 -5.984 -5.145 76 HB2 ARG 86 HB2 ARG 86 -0.808 -6.838 -7.454 77 HB3 ARG 86 HB1 ARG 86 -0.321 -8.419 -6.850 78 HG2 ARG 86 HG2 ARG 86 -2.407 -8.699 -5.682 79 HG3 ARG 86 HG1 ARG 86 -2.885 -7.038 -6.037 80 HD2 ARG 86 HD2 ARG 86 -2.294 -9.088 -8.183 81 HD3 ARG 86 HD1 ARG 86 -3.918 -8.795 -7.553 82 HE ARG 86 HE ARG 86 -2.817 -6.324 -8.332 83 HH11 ARG 86 HH21 ARG 86 -3.845 -9.344 -9.676 84 HH12 ARG 86 HH22 ARG 86 -4.298 -8.666 -11.205 85 HH21 ARG 86 HH11 ARG 86 -3.409 -5.430 -10.332 86 HH22 ARG 86 HH12 ARG 86 -4.051 -6.450 -11.576 87 H GLU 87 HN GLU 87 1.278 -8.754 -4.798 88 HA GLU 87 HA GLU 87 -0.282 -10.360 -3.124 89 HB2 GLU 87 HB2 GLU 87 1.870 -11.078 -4.124 90 HB3 GLU 87 HB1 GLU 87 2.723 -9.992 -3.028 91 HG2 GLU 87 HG2 GLU 87 1.843 -11.212 -1.091 92 HG3 GLU 87 HG1 GLU 87 0.919 -12.270 -2.158 93 H ALA 88 HN ALA 88 1.830 -7.626 -2.375 94 HA ALA 88 HA ALA 88 1.731 -7.781 0.426 95 HB1 ALA 88 HB1 ALA 88 1.781 -5.169 -1.070 96 HB2 ALA 88 HB2 ALA 88 3.170 -6.256 -1.086 97 HB3 ALA 88 HB3 ALA 88 2.588 -5.592 0.440 98 H PHE 89 HN PHE 89 -0.583 -6.524 -1.918 99 HA PHE 89 HA PHE 89 -2.235 -5.286 0.132 100 HB2 PHE 89 HB2 PHE 89 -2.610 -5.734 -2.831 101 HB3 PHE 89 HB1 PHE 89 -3.852 -5.017 -1.800 102 HD1 PHE 89 HD2 PHE 89 -3.477 -2.848 -0.686 103 HD2 PHE 89 HD1 PHE 89 -0.551 -4.541 -3.327 104 HE1 PHE 89 HE2 PHE 89 -2.308 -0.663 -0.789 105 HE2 PHE 89 HE1 PHE 89 0.632 -2.359 -3.432 106 HZ PHE 89 HZ PHE 89 -0.257 -0.419 -2.161 107 H ARG 90 HN ARG 90 -2.218 -8.234 -1.816 108 HA ARG 90 HA ARG 90 -4.713 -9.250 -1.188 109 HB2 ARG 90 HB2 ARG 90 -2.115 -10.726 -1.616 110 HB3 ARG 90 HB1 ARG 90 -3.672 -11.538 -1.453 111 HG2 ARG 90 HG2 ARG 90 -4.542 -10.192 -3.356 112 HG3 ARG 90 HG1 ARG 90 -2.946 -9.469 -3.544 113 HD2 ARG 90 HD2 ARG 90 -1.983 -11.717 -3.931 114 HD3 ARG 90 HD1 ARG 90 -3.585 -12.425 -3.763 115 HE ARG 90 HE ARG 90 -3.677 -10.434 -5.762 116 HH11 ARG 90 HH21 ARG 90 -2.333 -13.551 -5.090 117 HH12 ARG 90 HH22 ARG 90 -2.301 -14.049 -6.749 118 HH21 ARG 90 HH11 ARG 90 -3.636 -11.081 -7.944 119 HH22 ARG 90 HH12 ARG 90 -3.038 -12.651 -8.363 120 H VAL 91 HN VAL 91 -1.924 -8.969 0.868 121 HA VAL 91 HA VAL 91 -2.609 -10.868 2.842 122 HB VAL 91 HB VAL 91 -1.101 -8.248 3.018 123 HG11 VAL 91 HG11 VAL 91 -2.013 -10.149 5.118 124 HG12 VAL 91 HG12 VAL 91 -1.588 -8.443 5.256 125 HG13 VAL 91 HG13 VAL 91 -0.320 -9.667 5.205 126 HG21 VAL 91 HG21 VAL 91 -0.113 -11.104 3.230 127 HG22 VAL 91 HG22 VAL 91 0.850 -9.643 3.008 128 HG23 VAL 91 HG23 VAL 91 -0.177 -10.229 1.700 129 H PHE 92 HN PHE 92 -3.598 -7.547 2.257 130 HA PHE 92 HA PHE 92 -5.279 -7.512 4.647 131 HB2 PHE 92 HB2 PHE 92 -5.156 -5.387 2.509 132 HB3 PHE 92 HB1 PHE 92 -5.606 -5.207 4.205 133 HD1 PHE 92 HD2 PHE 92 -3.581 -6.434 5.765 134 HD2 PHE 92 HD1 PHE 92 -3.122 -4.337 2.053 135 HE1 PHE 92 HE2 PHE 92 -1.228 -5.959 6.337 136 HE2 PHE 92 HE1 PHE 92 -0.756 -3.863 2.620 137 HZ PHE 92 HZ PHE 92 0.193 -4.676 4.760 138 H ASP 93 HN ASP 93 -5.528 -8.099 1.226 139 HA ASP 93 HA ASP 93 -8.422 -7.765 1.186 140 HB2 ASP 93 HB2 ASP 93 -7.023 -9.104 -1.075 141 HB3 ASP 93 HB1 ASP 93 -8.266 -7.859 -1.096 142 H LYS 94 HN LYS 94 -8.701 -9.371 2.956 143 HA LYS 94 HA LYS 94 -8.296 -12.165 2.180 144 HB2 LYS 94 HB2 LYS 94 -9.694 -11.322 4.690 145 HB3 LYS 94 HB1 LYS 94 -8.629 -12.699 4.408 146 HG2 LYS 94 HG2 LYS 94 -6.735 -11.069 4.093 147 HG3 LYS 94 HG1 LYS 94 -7.836 -9.786 4.595 148 HD2 LYS 94 HD2 LYS 94 -6.789 -10.330 6.615 149 HD3 LYS 94 HD1 LYS 94 -8.246 -11.317 6.686 150 HE2 LYS 94 HE2 LYS 94 -7.003 -13.276 5.912 151 HE3 LYS 94 HE1 LYS 94 -5.553 -12.300 5.687 152 HZ1 LYS 94 HZ1 LYS 94 -6.830 -12.272 8.317 153 HZ2 LYS 94 HZ2 LYS 94 -5.185 -12.164 7.906 154 HZ3 LYS 94 HZ3 LYS 94 -5.974 -13.667 7.874 155 H ASP 95 HN ASP 95 -10.674 -9.725 2.170 156 HA ASP 95 HA ASP 95 -13.002 -11.396 2.306 157 HB2 ASP 95 HB2 ASP 95 -12.979 -8.911 2.727 158 HB3 ASP 95 HB1 ASP 95 -12.749 -8.680 0.994 159 H GLY 96 HN GLY 96 -10.764 -10.404 -0.165 160 HA2 GLY 96 HA2 GLY 96 -10.422 -11.213 -2.288 161 HA3 GLY 96 HA1 GLY 96 -11.677 -12.410 -1.983 162 H ASN 97 HN ASN 97 -12.542 -9.115 -1.446 163 HA ASN 97 HA ASN 97 -14.368 -9.246 -3.723 164 HB2 ASN 97 HB2 ASN 97 -15.460 -7.329 -2.723 165 HB3 ASN 97 HB1 ASN 97 -15.180 -8.546 -1.478 166 HD21 ASN 97 HD21 ASN 97 -15.521 -5.937 -0.593 167 HD22 ASN 97 HD22 ASN 97 -14.036 -5.291 -0.084 168 H GLY 98 HN GLY 98 -11.265 -8.171 -3.235 169 HA2 GLY 98 HA2 GLY 98 -9.975 -7.134 -4.950 170 HA3 GLY 98 HA1 GLY 98 -11.453 -6.402 -5.578 171 H TYR 99 HN TYR 99 -11.798 -5.916 -2.434 172 HA TYR 99 HA TYR 99 -10.291 -3.359 -2.426 173 HB2 TYR 99 HB2 TYR 99 -13.038 -3.872 -1.263 174 HB3 TYR 99 HB1 TYR 99 -12.150 -2.348 -1.218 175 HD1 TYR 99 HD1 TYR 99 -13.340 -4.905 -3.668 176 HD2 TYR 99 HD2 TYR 99 -12.540 -0.766 -2.892 177 HE1 TYR 99 HE1 TYR 99 -14.212 -4.335 -5.908 178 HE2 TYR 99 HE2 TYR 99 -13.430 -0.180 -5.139 179 HH TYR 99 HH TYR 99 -14.710 -0.991 -6.874 180 H ILE 100 HN ILE 100 -9.868 -2.455 -0.297 181 HA ILE 100 HA ILE 100 -9.728 -4.460 1.866 182 HB ILE 100 HB ILE 100 -7.481 -4.130 2.225 183 HG12 ILE 100 HG12 ILE 100 -7.906 -1.298 1.229 184 HG13 ILE 100 HG11 ILE 100 -7.609 -1.798 2.893 185 HG21 ILE 100 HG21 ILE 100 -7.496 -2.938 -0.553 186 HG22 ILE 100 HG22 ILE 100 -7.844 -4.649 -0.261 187 HG23 ILE 100 HG23 ILE 100 -6.267 -3.979 0.175 188 HD11 ILE 100 HD11 ILE 100 -5.416 -2.836 1.865 189 HD12 ILE 100 HD12 ILE 100 -5.484 -1.118 2.256 190 HD13 ILE 100 HD13 ILE 100 -5.700 -1.653 0.588 191 H SER 101 HN SER 101 -10.269 -3.592 3.917 192 HA SER 101 HA SER 101 -11.870 -1.282 3.936 193 HB2 SER 101 HB2 SER 101 -10.458 -2.659 6.237 194 HB3 SER 101 HB1 SER 101 -11.722 -1.447 6.412 195 HG SER 101 HG SER 101 -12.169 -3.663 4.758 196 H ALA 102 HN ALA 102 -11.450 0.834 4.285 197 HA ALA 102 HA ALA 102 -8.833 1.835 3.927 198 HB1 ALA 102 HB1 ALA 102 -9.771 3.967 4.032 199 HB2 ALA 102 HB2 ALA 102 -11.024 3.470 5.172 200 HB3 ALA 102 HB3 ALA 102 -11.122 2.980 3.480 201 H ALA 103 HN ALA 103 -10.782 1.280 6.819 202 HA ALA 103 HA ALA 103 -9.240 2.709 8.667 203 HB1 ALA 103 HB1 ALA 103 -10.825 0.169 9.099 204 HB2 ALA 103 HB2 ALA 103 -11.463 1.812 9.178 205 HB3 ALA 103 HB3 ALA 103 -10.278 1.268 10.365 206 H GLU 104 HN GLU 104 -8.885 -0.672 7.562 207 HA GLU 104 HA GLU 104 -6.810 -1.289 9.412 208 HB2 GLU 104 HB2 GLU 104 -6.749 -3.359 8.430 209 HB3 GLU 104 HB1 GLU 104 -8.325 -2.827 7.853 210 HG2 GLU 104 HG2 GLU 104 -7.085 -1.909 5.803 211 HG3 GLU 104 HG1 GLU 104 -5.703 -2.849 6.355 212 H LEU 105 HN LEU 105 -6.871 0.152 6.226 213 HA LEU 105 HA LEU 105 -4.126 -0.086 5.598 214 HB2 LEU 105 HB2 LEU 105 -5.778 0.598 3.927 215 HB3 LEU 105 HB1 LEU 105 -6.098 2.079 4.829 216 HG LEU 105 HG LEU 105 -3.245 1.717 4.306 217 HD11 LEU 105 HD11 LEU 105 -3.905 0.628 2.268 218 HD12 LEU 105 HD12 LEU 105 -3.517 2.295 1.840 219 HD13 LEU 105 HD13 LEU 105 -5.201 1.791 1.992 220 HD21 LEU 105 HD21 LEU 105 -4.333 3.816 5.055 221 HD22 LEU 105 HD22 LEU 105 -5.251 3.869 3.550 222 HD23 LEU 105 HD23 LEU 105 -3.496 4.040 3.518 223 H ARG 106 HN ARG 106 -5.960 2.493 7.194 224 HA ARG 106 HA ARG 106 -3.905 4.304 7.657 225 HB2 ARG 106 HB2 ARG 106 -6.260 4.810 8.068 226 HB3 ARG 106 HB1 ARG 106 -6.311 3.634 9.375 227 HG2 ARG 106 HG2 ARG 106 -6.099 5.911 10.271 228 HG3 ARG 106 HG1 ARG 106 -4.651 4.984 10.634 229 HD2 ARG 106 HD2 ARG 106 -3.387 6.096 9.010 230 HD3 ARG 106 HD1 ARG 106 -4.820 6.686 8.167 231 HE ARG 106 HE ARG 106 -4.838 8.485 9.624 232 HH11 ARG 106 HH21 ARG 106 -3.014 5.865 10.964 233 HH12 ARG 106 HH22 ARG 106 -2.441 6.777 12.320 234 HH21 ARG 106 HH11 ARG 106 -4.093 9.685 11.398 235 HH22 ARG 106 HH12 ARG 106 -3.052 8.941 12.564 236 H HIS 107 HN HIS 107 -5.051 1.678 9.815 237 HA HIS 107 HA HIS 107 -3.107 2.058 11.827 238 HB2 HIS 107 HB2 HIS 107 -5.128 0.787 12.246 239 HB3 HIS 107 HB1 HIS 107 -4.684 -0.391 11.012 240 HD1 HIS 107 HD1 HIS 107 -3.220 1.005 14.252 241 HD2 HIS 107 HD2 HIS 107 -3.297 -2.530 12.042 242 HE1 HIS 107 HE1 HIS 107 -1.991 -0.727 15.631 243 HE2 HIS 107 HE2 HIS 107 -2.018 -2.886 14.294 244 H VAL 108 HN VAL 108 -3.238 -0.115 9.054 245 HA VAL 108 HA VAL 108 -0.834 -1.513 9.474 246 HB VAL 108 HB VAL 108 -2.449 -0.892 6.994 247 HG11 VAL 108 HG11 VAL 108 -0.151 -2.836 7.317 248 HG12 VAL 108 HG12 VAL 108 -0.172 -1.422 6.265 249 HG13 VAL 108 HG13 VAL 108 -1.241 -2.778 5.941 250 HG21 VAL 108 HG21 VAL 108 -3.119 -2.410 9.119 251 HG22 VAL 108 HG22 VAL 108 -2.219 -3.604 8.182 252 HG23 VAL 108 HG23 VAL 108 -3.618 -2.799 7.472 253 H MET 109 HN MET 109 -1.497 1.466 7.654 254 HA MET 109 HA MET 109 1.170 1.699 6.605 255 HB2 MET 109 HB2 MET 109 -1.277 3.382 6.584 256 HB3 MET 109 HB1 MET 109 0.269 4.215 6.379 257 HG2 MET 109 HG2 MET 109 -0.893 3.366 4.246 258 HG3 MET 109 HG1 MET 109 0.818 2.981 4.442 259 HE1 MET 109 HE1 MET 109 -0.039 -0.171 2.720 260 HE2 MET 109 HE2 MET 109 0.520 1.498 2.636 261 HE3 MET 109 HE3 MET 109 -1.187 1.137 2.401 262 H THR 110 HN THR 110 -0.392 2.758 9.554 263 HA THR 110 HA THR 110 1.975 4.382 10.208 264 HB THR 110 HB THR 110 0.592 5.381 11.957 265 HG1 THR 110 HG1 THR 110 -0.707 3.238 11.937 266 HG21 THR 110 HG21 THR 110 -1.064 5.299 9.441 267 HG22 THR 110 HG22 THR 110 0.518 6.077 9.474 268 HG23 THR 110 HG23 THR 110 -0.771 6.662 10.524 269 H ASN 111 HN ASN 111 0.495 1.360 10.948 270 HA ASN 111 HA ASN 111 2.032 1.169 13.463 271 HB2 ASN 111 HB2 ASN 111 -0.496 0.722 13.377 272 HB3 ASN 111 HB1 ASN 111 -0.066 -0.787 12.572 273 HD21 ASN 111 HD21 ASN 111 -0.558 -2.226 14.316 274 HD22 ASN 111 HD22 ASN 111 0.269 -2.190 15.798 275 H LEU 112 HN LEU 112 1.268 -0.773 10.550 276 HA LEU 112 HA LEU 112 3.458 -2.602 11.200 277 HB2 LEU 112 HB2 LEU 112 1.397 -2.608 8.999 278 HB3 LEU 112 HB1 LEU 112 2.623 -3.851 9.192 279 HG LEU 112 HG LEU 112 0.620 -3.104 11.344 280 HD11 LEU 112 HD11 LEU 112 0.372 -4.767 8.942 281 HD12 LEU 112 HD12 LEU 112 -0.882 -4.168 10.029 282 HD13 LEU 112 HD13 LEU 112 -0.002 -5.644 10.426 283 HD21 LEU 112 HD21 LEU 112 1.516 -5.764 11.605 284 HD22 LEU 112 HD22 LEU 112 1.974 -4.400 12.623 285 HD23 LEU 112 HD23 LEU 112 2.965 -4.839 11.235 286 H GLY 113 HN GLY 113 5.341 -2.817 10.075 287 HA2 GLY 113 HA2 GLY 113 7.088 -2.251 8.712 288 HA3 GLY 113 HA1 GLY 113 5.865 -1.967 7.480 289 H GLU 114 HN GLU 114 8.402 -0.552 8.886 290 HA GLU 114 HA GLU 114 8.715 1.677 9.775 291 HB2 GLU 114 HB2 GLU 114 10.052 1.606 7.892 292 HB3 GLU 114 HB1 GLU 114 8.694 1.338 6.805 293 HG2 GLU 114 HG2 GLU 114 8.125 3.603 6.745 294 HG3 GLU 114 HG1 GLU 114 8.933 3.953 8.275 295 H LYS 115 HN LYS 115 6.995 2.467 10.935 296 HA LYS 115 HA LYS 115 4.469 3.076 10.052 297 HB2 LYS 115 HB2 LYS 115 6.089 4.544 12.146 298 HB3 LYS 115 HB1 LYS 115 4.331 4.558 12.005 299 HG2 LYS 115 HG2 LYS 115 4.327 2.074 12.301 300 HG3 LYS 115 HG1 LYS 115 6.069 2.133 12.543 301 HD2 LYS 115 HD2 LYS 115 5.764 3.627 14.482 302 HD3 LYS 115 HD1 LYS 115 4.017 3.571 14.250 303 HE2 LYS 115 HE2 LYS 115 4.651 1.974 15.986 304 HE3 LYS 115 HE1 LYS 115 4.090 1.097 14.564 305 HZ1 LYS 115 HZ1 LYS 115 6.944 1.718 14.790 306 HZ2 LYS 115 HZ2 LYS 115 6.180 0.394 14.047 307 HZ3 LYS 115 HZ3 LYS 115 6.318 0.459 15.740 308 H LEU 116 HN LEU 116 3.486 4.707 9.015 309 HA LEU 116 HA LEU 116 5.157 6.749 7.745 310 HB2 LEU 116 HB2 LEU 116 2.397 5.661 7.294 311 HB3 LEU 116 HB1 LEU 116 2.751 7.295 6.751 312 HG LEU 116 HG LEU 116 3.096 5.593 4.962 313 HD11 LEU 116 HD11 LEU 116 4.780 7.704 5.696 314 HD12 LEU 116 HD12 LEU 116 4.689 6.933 4.118 315 HD13 LEU 116 HD13 LEU 116 5.873 6.381 5.303 316 HD21 LEU 116 HD21 LEU 116 3.844 3.711 6.325 317 HD22 LEU 116 HD22 LEU 116 5.276 4.603 6.838 318 HD23 LEU 116 HD23 LEU 116 5.097 4.123 5.163 319 H THR 117 HN THR 117 4.472 9.054 7.818 320 HA THR 117 HA THR 117 3.482 9.731 10.484 321 HB THR 117 HB THR 117 4.298 11.978 9.984 322 HG1 THR 117 HG1 THR 117 5.421 11.214 7.583 323 HG21 THR 117 HG21 THR 117 6.523 11.456 10.225 324 HG22 THR 117 HG22 THR 117 6.497 10.279 8.912 325 HG23 THR 117 HG23 THR 117 5.840 9.851 10.492 326 H ASP 118 HN ASP 118 2.012 11.724 10.572 327 HA ASP 118 HA ASP 118 -0.430 11.141 9.367 328 HB2 ASP 118 HB2 ASP 118 -0.178 12.528 11.391 329 HB3 ASP 118 HB1 ASP 118 0.518 13.817 10.409 330 H GLU 119 HN GLU 119 2.063 13.485 8.410 331 HA GLU 119 HA GLU 119 0.627 14.663 6.279 332 HB2 GLU 119 HB2 GLU 119 3.601 14.329 6.728 333 HB3 GLU 119 HB1 GLU 119 2.909 15.296 5.425 334 HG2 GLU 119 HG2 GLU 119 2.242 15.717 8.348 335 HG3 GLU 119 HG1 GLU 119 3.503 16.611 7.500 336 H GLU 120 HN GLU 120 2.787 11.853 6.398 337 HA GLU 120 HA GLU 120 2.690 11.356 3.584 338 HB2 GLU 120 HB2 GLU 120 3.509 9.656 5.942 339 HB3 GLU 120 HB1 GLU 120 3.583 9.084 4.272 340 HG2 GLU 120 HG2 GLU 120 5.039 10.964 3.667 341 HG3 GLU 120 HG1 GLU 120 4.932 11.601 5.305 342 H VAL 121 HN VAL 121 0.871 10.183 6.392 343 HA VAL 121 HA VAL 121 -0.671 8.222 5.048 344 HB VAL 121 HB VAL 121 -1.101 9.865 7.559 345 HG11 VAL 121 HG11 VAL 121 -3.315 9.242 6.792 346 HG12 VAL 121 HG12 VAL 121 -2.851 8.189 8.117 347 HG13 VAL 121 HG13 VAL 121 -2.772 7.593 6.464 348 HG21 VAL 121 HG21 VAL 121 -0.881 6.996 7.840 349 HG22 VAL 121 HG22 VAL 121 0.115 8.258 8.566 350 HG23 VAL 121 HG23 VAL 121 0.500 7.639 6.963 351 H ASP 122 HN ASP 122 -1.293 11.679 5.777 352 HA ASP 122 HA ASP 122 -3.901 11.800 4.801 353 HB2 ASP 122 HB2 ASP 122 -2.790 13.641 6.029 354 HB3 ASP 122 HB1 ASP 122 -1.768 13.952 4.626 355 H GLU 123 HN GLU 123 -0.824 12.165 3.072 356 HA GLU 123 HA GLU 123 -1.923 12.771 0.537 357 HB2 GLU 123 HB2 GLU 123 0.474 13.069 1.098 358 HB3 GLU 123 HB1 GLU 123 0.658 11.318 1.187 359 HG2 GLU 123 HG2 GLU 123 1.396 12.103 -1.004 360 HG3 GLU 123 HG1 GLU 123 -0.073 11.151 -1.191 361 H MET 124 HN MET 124 -1.234 9.768 2.227 362 HA MET 124 HA MET 124 -1.772 7.985 0.065 363 HB2 MET 124 HB2 MET 124 -1.771 7.609 3.071 364 HB3 MET 124 HB1 MET 124 -1.903 6.301 1.903 365 HG2 MET 124 HG2 MET 124 0.328 8.259 1.606 366 HG3 MET 124 HG1 MET 124 0.470 7.023 2.850 367 HE1 MET 124 HE1 MET 124 1.282 4.223 1.922 368 HE2 MET 124 HE2 MET 124 -0.266 3.853 1.166 369 HE3 MET 124 HE3 MET 124 -0.216 4.870 2.605 370 H ILE 125 HN ILE 125 -3.720 9.355 2.699 371 HA ILE 125 HA ILE 125 -6.017 7.780 2.296 372 HB ILE 125 HB ILE 125 -5.300 10.119 3.855 373 HG12 ILE 125 HG12 ILE 125 -6.805 8.985 5.491 374 HG13 ILE 125 HG11 ILE 125 -7.205 7.812 4.247 375 HG21 ILE 125 HG21 ILE 125 -8.131 9.873 2.834 376 HG22 ILE 125 HG22 ILE 125 -7.056 11.267 2.687 377 HG23 ILE 125 HG23 ILE 125 -7.677 10.794 4.265 378 HD11 ILE 125 HD11 ILE 125 -5.303 7.250 5.945 379 HD12 ILE 125 HD12 ILE 125 -4.342 8.319 4.935 380 HD13 ILE 125 HD13 ILE 125 -5.066 6.878 4.239 381 H ARG 126 HN ARG 126 -4.976 10.815 0.848 382 HA ARG 126 HA ARG 126 -7.414 11.410 -0.480 383 HB2 ARG 126 HB2 ARG 126 -4.559 12.198 -1.069 384 HB3 ARG 126 HB1 ARG 126 -5.946 12.820 -1.964 385 HG2 ARG 126 HG2 ARG 126 -6.927 13.579 0.225 386 HG3 ARG 126 HG1 ARG 126 -5.412 13.118 1.001 387 HD2 ARG 126 HD2 ARG 126 -4.181 14.674 -0.445 388 HD3 ARG 126 HD1 ARG 126 -5.676 15.108 -1.267 389 HE ARG 126 HE ARG 126 -6.341 16.318 0.634 390 HH11 ARG 126 HH21 ARG 126 -3.367 14.603 1.123 391 HH12 ARG 126 HH22 ARG 126 -2.963 15.450 2.577 392 HH21 ARG 126 HH11 ARG 126 -5.812 17.422 2.542 393 HH22 ARG 126 HH12 ARG 126 -4.345 17.043 3.381 394 H GLU 127 HN GLU 127 -4.789 9.254 -1.164 395 HA GLU 127 HA GLU 127 -5.733 8.788 -3.906 396 HB2 GLU 127 HB2 GLU 127 -3.313 7.705 -2.447 397 HB3 GLU 127 HB1 GLU 127 -3.699 7.429 -4.145 398 HG2 GLU 127 HG2 GLU 127 -3.310 10.171 -2.917 399 HG3 GLU 127 HG1 GLU 127 -2.057 9.292 -3.791 400 H ALA 128 HN ALA 128 -6.331 7.634 -0.838 401 HA ALA 128 HA ALA 128 -6.607 4.825 -1.547 402 HB1 ALA 128 HB1 ALA 128 -7.819 5.833 0.964 403 HB2 ALA 128 HB2 ALA 128 -6.085 6.076 0.787 404 HB3 ALA 128 HB3 ALA 128 -6.752 4.459 0.694 405 H ASP 129 HN ASP 129 -9.010 6.993 -0.000 406 HA ASP 129 HA ASP 129 -10.973 7.183 -1.857 407 HB2 ASP 129 HB2 ASP 129 -10.777 4.386 -0.928 408 HB3 ASP 129 HB1 ASP 129 -12.399 5.057 -0.945 409 H ILE 130 HN ILE 130 -12.079 5.302 0.829 410 HA ILE 130 HA ILE 130 -13.301 5.782 2.657 411 HB ILE 130 HB ILE 130 -11.728 8.366 2.698 412 HG12 ILE 130 HG12 ILE 130 -11.234 5.779 4.196 413 HG13 ILE 130 HG11 ILE 130 -10.394 6.202 2.703 414 HG21 ILE 130 HG21 ILE 130 -12.409 7.421 5.277 415 HG22 ILE 130 HG22 ILE 130 -13.883 7.296 4.319 416 HG23 ILE 130 HG23 ILE 130 -13.054 8.847 4.469 417 HD11 ILE 130 HD11 ILE 130 -10.431 8.015 5.126 418 HD12 ILE 130 HD12 ILE 130 -9.393 8.131 3.707 419 HD13 ILE 130 HD13 ILE 130 -9.176 6.808 4.855 420 H ASP 131 HN ASP 131 -13.375 9.096 2.708 421 HA ASP 131 HA ASP 131 -14.921 10.690 2.102 422 HB2 ASP 131 HB2 ASP 131 -14.733 9.388 -0.192 423 HB3 ASP 131 HB1 ASP 131 -16.331 8.797 0.259 424 H GLY 132 HN GLY 132 -15.790 7.441 2.913 425 HA2 GLY 132 HA2 GLY 132 -17.515 8.088 4.987 426 HA3 GLY 132 HA1 GLY 132 -18.524 7.879 3.559 427 H ASP 133 HN ASP 133 -17.971 5.810 2.278 428 HA ASP 133 HA ASP 133 -18.686 3.611 3.738 429 HB2 ASP 133 HB2 ASP 133 -17.970 2.254 1.820 430 HB3 ASP 133 HB1 ASP 133 -18.829 3.703 1.311 431 H GLY 134 HN GLY 134 -15.450 4.872 3.329 432 HA2 GLY 134 HA2 GLY 134 -13.531 4.380 4.506 433 HA3 GLY 134 HA1 GLY 134 -14.496 3.329 5.525 434 H GLN 135 HN GLN 135 -14.221 2.894 2.021 435 HA GLN 135 HA GLN 135 -12.576 0.473 2.524 436 HB2 GLN 135 HB2 GLN 135 -13.655 -0.362 0.339 437 HB3 GLN 135 HB1 GLN 135 -14.637 -0.405 1.808 438 HG2 GLN 135 HG2 GLN 135 -16.042 1.235 1.066 439 HG3 GLN 135 HG1 GLN 135 -14.749 2.125 0.268 440 HE21 GLN 135 HE21 GLN 135 -16.627 -0.939 -0.106 441 HE22 GLN 135 HE22 GLN 135 -16.618 -0.899 -1.803 442 H VAL 136 HN VAL 136 -10.967 -0.023 0.969 443 HA VAL 136 HA VAL 136 -10.391 2.115 -0.965 444 HB VAL 136 HB VAL 136 -8.542 0.883 1.060 445 HG11 VAL 136 HG11 VAL 136 -6.803 2.319 -0.185 446 HG12 VAL 136 HG12 VAL 136 -7.939 2.310 -1.532 447 HG13 VAL 136 HG13 VAL 136 -7.260 0.792 -0.937 448 HG21 VAL 136 HG21 VAL 136 -9.992 2.984 1.465 449 HG22 VAL 136 HG22 VAL 136 -8.915 3.777 0.327 450 HG23 VAL 136 HG23 VAL 136 -8.273 3.097 1.823 451 H ASN 137 HN ASN 137 -9.761 1.486 -2.918 452 HA ASN 137 HA ASN 137 -9.579 -1.396 -3.429 453 HB2 ASN 137 HB2 ASN 137 -9.402 -0.211 -5.877 454 HB3 ASN 137 HB1 ASN 137 -10.917 -0.675 -5.117 455 HD21 ASN 137 HD21 ASN 137 -12.318 1.015 -4.364 456 HD22 ASN 137 HD22 ASN 137 -11.972 2.661 -4.596 457 H TYR 138 HN TYR 138 -7.537 -2.177 -3.224 458 HA TYR 138 HA TYR 138 -5.206 -0.625 -3.301 459 HB2 TYR 138 HB2 TYR 138 -3.985 -2.762 -3.478 460 HB3 TYR 138 HB1 TYR 138 -5.232 -2.809 -2.236 461 HD1 TYR 138 HD1 TYR 138 -4.352 -3.895 -5.675 462 HD2 TYR 138 HD2 TYR 138 -7.134 -4.244 -2.431 463 HE1 TYR 138 HE1 TYR 138 -5.379 -5.874 -6.764 464 HE2 TYR 138 HE2 TYR 138 -8.162 -6.219 -3.507 465 HH TYR 138 HH TYR 138 -6.823 -7.569 -6.514 466 H GLU 139 HN GLU 139 -7.172 -1.566 -5.902 467 HA GLU 139 HA GLU 139 -5.258 -2.061 -7.906 468 HB2 GLU 139 HB2 GLU 139 -8.005 -0.804 -8.047 469 HB3 GLU 139 HB1 GLU 139 -7.041 -1.185 -9.475 470 HG2 GLU 139 HG2 GLU 139 -6.989 -3.533 -8.892 471 HG3 GLU 139 HG1 GLU 139 -7.765 -3.211 -7.342 472 H GLU 140 HN GLU 140 -6.810 1.031 -6.959 473 HA GLU 140 HA GLU 140 -5.410 2.666 -8.732 474 HB2 GLU 140 HB2 GLU 140 -7.378 3.398 -7.425 475 HB3 GLU 140 HB1 GLU 140 -6.398 3.375 -5.958 476 HG2 GLU 140 HG2 GLU 140 -4.905 5.076 -6.892 477 HG3 GLU 140 HG1 GLU 140 -5.805 5.062 -8.408 478 H PHE 141 HN PHE 141 -4.556 1.618 -5.454 479 HA PHE 141 HA PHE 141 -2.217 3.205 -5.210 480 HB2 PHE 141 HB2 PHE 141 -3.340 0.842 -3.820 481 HB3 PHE 141 HB1 PHE 141 -1.591 1.033 -3.713 482 HD1 PHE 141 HD2 PHE 141 -0.807 3.553 -3.281 483 HD2 PHE 141 HD1 PHE 141 -4.647 1.949 -2.203 484 HE1 PHE 141 HE2 PHE 141 -1.064 5.319 -1.562 485 HE2 PHE 141 HE1 PHE 141 -4.890 3.707 -0.481 486 HZ PHE 141 HZ PHE 141 -3.108 5.397 -0.161 487 H VAL 142 HN VAL 142 -2.771 -0.054 -6.522 488 HA VAL 142 HA VAL 142 -0.043 -0.619 -7.030 489 HB VAL 142 HB VAL 142 -2.586 -1.686 -8.256 490 HG11 VAL 142 HG11 VAL 142 0.306 -2.181 -8.917 491 HG12 VAL 142 HG12 VAL 142 -1.081 -2.091 -10.004 492 HG13 VAL 142 HG13 VAL 142 -0.836 -3.521 -9.001 493 HG21 VAL 142 HG21 VAL 142 -1.916 -3.682 -6.942 494 HG22 VAL 142 HG22 VAL 142 -2.093 -2.268 -5.904 495 HG23 VAL 142 HG23 VAL 142 -0.486 -2.815 -6.376 496 H GLN 143 HN GLN 143 -2.560 0.970 -8.956 497 HA GLN 143 HA GLN 143 -1.076 1.215 -11.341 498 HB2 GLN 143 HB2 GLN 143 -3.254 2.952 -10.157 499 HB3 GLN 143 HB1 GLN 143 -2.586 3.191 -11.770 500 HG2 GLN 143 HG2 GLN 143 -3.787 0.581 -10.833 501 HG3 GLN 143 HG1 GLN 143 -4.689 1.809 -11.722 502 HE21 GLN 143 HE21 GLN 143 -2.875 -0.974 -12.146 503 HE22 GLN 143 HE22 GLN 143 -2.428 -0.753 -13.767 504 H MET 144 HN MET 144 -1.299 3.224 -8.445 505 HA MET 144 HA MET 144 0.286 5.392 -9.310 506 HB2 MET 144 HB2 MET 144 -0.152 4.198 -6.561 507 HB3 MET 144 HB1 MET 144 0.714 5.703 -6.841 508 HG2 MET 144 HG2 MET 144 -1.208 6.801 -7.647 509 HG3 MET 144 HG1 MET 144 -2.055 5.283 -7.945 510 HE1 MET 144 HE1 MET 144 -0.399 7.550 -5.443 511 HE2 MET 144 HE2 MET 144 0.062 6.062 -4.619 512 HE3 MET 144 HE3 MET 144 -1.097 7.155 -3.865 513 H MET 145 HN MET 145 1.136 2.374 -7.615 514 HA MET 145 HA MET 145 3.940 2.933 -7.573 515 HB2 MET 145 HB2 MET 145 2.223 0.534 -6.954 516 HB3 MET 145 HB1 MET 145 3.973 0.355 -7.074 517 HG2 MET 145 HG2 MET 145 3.553 0.783 -4.773 518 HG3 MET 145 HG1 MET 145 4.131 2.313 -5.408 519 HE1 MET 145 HE1 MET 145 0.813 1.935 -2.776 520 HE2 MET 145 HE2 MET 145 2.535 1.563 -2.791 521 HE3 MET 145 HE3 MET 145 1.396 0.461 -3.561 522 H THR 146 HN THR 146 1.841 1.845 -10.021 523 HA THR 146 HA THR 146 4.148 0.825 -11.568 524 HB THR 146 HB THR 146 2.544 -0.563 -12.829 525 HG1 THR 146 HG1 THR 146 0.538 -0.044 -12.638 526 HG21 THR 146 HG21 THR 146 2.040 -2.165 -10.980 527 HG22 THR 146 HG22 THR 146 2.504 -0.921 -9.820 528 HG23 THR 146 HG23 THR 146 3.701 -1.571 -10.940 529 H ALA 147 HN ALA 147 2.722 3.541 -11.176 530 HA ALA 147 HA ALA 147 2.132 4.077 -14.024 531 HB1 ALA 147 HB1 ALA 147 1.231 5.395 -11.471 532 HB2 ALA 147 HB2 ALA 147 0.251 4.778 -12.802 533 HB3 ALA 147 HB3 ALA 147 1.182 6.261 -13.007 534 H LYS 148 HN LYS 148 4.550 3.978 -14.209 535 HA LYS 148 HA LYS 148 5.631 6.551 -14.506 536 HB2 LYS 148 HB2 LYS 148 5.839 5.509 -11.830 537 HB3 LYS 148 HB1 LYS 148 7.451 5.610 -12.542 538 HG2 LYS 148 HG2 LYS 148 5.466 7.901 -12.640 539 HG3 LYS 148 HG1 LYS 148 6.659 7.714 -11.358 540 HD2 LYS 148 HD2 LYS 148 8.404 8.300 -12.703 541 HD3 LYS 148 HD1 LYS 148 7.724 7.491 -14.113 542 HE2 LYS 148 HE2 LYS 148 7.751 9.936 -14.432 543 HE3 LYS 148 HE1 LYS 148 6.096 9.327 -14.388 544 HZ1 LYS 148 HZ1 LYS 148 6.178 11.224 -13.005 545 HZ2 LYS 148 HZ2 LYS 148 7.583 10.688 -12.214 546 HZ3 LYS 148 HZ3 LYS 148 6.107 9.884 -11.967 547 H PHE 30 HT1 PHE 30 -9.659 -5.147 12.056 548 HA PHE 30 HA PHE 30 -8.039 -4.927 10.125 549 HB2 PHE 30 HB2 PHE 30 -5.709 -5.179 11.747 550 HB3 PHE 30 HB1 PHE 30 -6.089 -3.905 10.595 551 HD1 PHE 30 HD2 PHE 30 -7.734 -2.044 11.423 552 HD2 PHE 30 HD1 PHE 30 -5.538 -4.658 14.028 553 HE1 PHE 30 HE2 PHE 30 -8.030 -0.433 13.283 554 HE2 PHE 30 HE1 PHE 30 -5.835 -3.048 15.892 555 HZ PHE 30 HZ PHE 30 -7.081 -0.936 15.519 556 H ASP 31 HN ASP 31 -9.063 -6.955 9.989 557 HA ASP 31 HA ASP 31 -8.294 -9.066 11.846 558 HB2 ASP 31 HB2 ASP 31 -10.628 -8.868 11.008 559 HB3 ASP 31 HB1 ASP 31 -10.041 -9.212 9.381 560 H ILE 32 HN ILE 32 -5.969 -8.809 11.145 561 HA ILE 32 HA ILE 32 -5.454 -10.658 8.908 562 HB ILE 32 HB ILE 32 -3.824 -9.290 7.921 563 HG12 ILE 32 HG12 ILE 32 -3.875 -7.690 10.499 564 HG13 ILE 32 HG11 ILE 32 -2.528 -8.634 9.852 565 HG21 ILE 32 HG21 ILE 32 -5.689 -7.165 8.943 566 HG22 ILE 32 HG22 ILE 32 -6.266 -8.426 7.854 567 HG23 ILE 32 HG23 ILE 32 -4.984 -7.335 7.339 568 HD11 ILE 32 HD11 ILE 32 -3.661 -6.044 8.793 569 HD12 ILE 32 HD12 ILE 32 -2.655 -7.100 7.801 570 HD13 ILE 32 HD13 ILE 32 -2.003 -6.401 9.280 571 H ASP 33 HN ASP 33 -3.259 -11.617 9.027 572 HA ASP 33 HA ASP 33 -2.667 -12.340 11.763 573 HB2 ASP 33 HB2 ASP 33 -1.474 -13.146 9.105 574 HB3 ASP 33 HB1 ASP 33 -0.849 -13.724 10.649 575 H MET 34 HN MET 34 -2.056 -10.250 12.537 576 HA MET 34 HA MET 34 0.118 -8.787 11.423 577 HB2 MET 34 HB2 MET 34 -1.094 -8.680 14.196 578 HB3 MET 34 HB1 MET 34 0.012 -7.488 13.520 579 HG2 MET 34 HG2 MET 34 -1.615 -7.103 11.655 580 HG3 MET 34 HG1 MET 34 -2.728 -8.215 12.448 581 HE1 MET 34 HE1 MET 34 -0.983 -4.381 14.091 582 HE2 MET 34 HE2 MET 34 -1.743 -4.198 12.512 583 HE3 MET 34 HE3 MET 34 -0.465 -5.380 12.731 584 H ASP 35 HN ASP 35 -0.067 -11.565 13.409 585 HA ASP 35 HA ASP 35 2.496 -11.186 14.703 586 HB2 ASP 35 HB2 ASP 35 2.105 -13.367 15.679 587 HB3 ASP 35 HB1 ASP 35 0.629 -12.411 15.788 588 H ALA 36 HN ALA 36 1.750 -11.855 11.588 589 HA ALA 36 HA ALA 36 3.864 -13.874 11.247 590 HB1 ALA 36 HB1 ALA 36 2.641 -13.171 8.764 591 HB2 ALA 36 HB2 ALA 36 1.367 -13.417 9.958 592 HB3 ALA 36 HB3 ALA 36 2.538 -14.696 9.642 593 HA PRO 37 HA PRO 37 6.683 -10.791 9.784 594 HB2 PRO 37 HB2 PRO 37 8.237 -12.226 8.080 595 HB3 PRO 37 HB1 PRO 37 8.335 -12.375 9.847 596 HG2 PRO 37 HG2 PRO 37 6.910 -14.092 7.884 597 HG3 PRO 37 HG1 PRO 37 7.891 -14.557 9.282 598 HD2 PRO 37 HD2 PRO 37 5.177 -14.560 9.367 599 HD3 PRO 37 HD1 PRO 37 6.167 -14.169 10.792 600 H GLU 38 HN GLU 38 4.887 -12.684 7.457 601 HA GLU 38 HA GLU 38 5.539 -11.253 5.111 602 HB2 GLU 38 HB2 GLU 38 3.096 -12.854 5.888 603 HB3 GLU 38 HB1 GLU 38 3.331 -12.170 4.280 604 HG2 GLU 38 HG2 GLU 38 5.373 -13.439 3.976 605 HG3 GLU 38 HG1 GLU 38 5.311 -14.017 5.639 606 H THR 39 HN THR 39 2.991 -10.786 7.543 607 HA THR 39 HA THR 39 1.582 -8.745 6.205 608 HB THR 39 HB THR 39 1.885 -9.240 9.176 609 HG1 THR 39 HG1 THR 39 0.109 -10.153 7.177 610 HG21 THR 39 HG21 THR 39 1.026 -7.016 8.824 611 HG22 THR 39 HG22 THR 39 -0.339 -8.049 9.244 612 HG23 THR 39 HG23 THR 39 -0.071 -7.584 7.565 613 H GLU 40 HN GLU 40 4.149 -8.521 8.683 614 HA GLU 40 HA GLU 40 4.272 -5.678 8.647 615 HB2 GLU 40 HB2 GLU 40 5.167 -7.048 10.505 616 HB3 GLU 40 HB1 GLU 40 6.416 -7.672 9.428 617 HG2 GLU 40 HG2 GLU 40 7.301 -5.410 9.097 618 HG3 GLU 40 HG1 GLU 40 6.015 -4.742 10.103 619 H ARG 41 HN ARG 41 6.059 -8.226 7.001 620 HA ARG 41 HA ARG 41 7.933 -6.624 5.659 621 HB2 ARG 41 HB2 ARG 41 8.243 -9.003 5.835 622 HB3 ARG 41 HB1 ARG 41 6.722 -9.310 5.013 623 HG2 ARG 41 HG2 ARG 41 8.619 -9.687 3.502 624 HG3 ARG 41 HG1 ARG 41 7.639 -8.346 2.931 625 HD2 ARG 41 HD2 ARG 41 9.223 -6.732 3.799 626 HD3 ARG 41 HD1 ARG 41 10.134 -7.997 4.620 627 HE ARG 41 HE ARG 41 10.127 -8.683 1.935 628 HH11 ARG 41 HH21 ARG 41 11.099 -6.006 3.900 629 HH12 ARG 41 HH22 ARG 41 12.404 -5.539 2.861 630 HH21 ARG 41 HH11 ARG 41 11.837 -8.076 0.567 631 HH22 ARG 41 HH12 ARG 41 12.822 -6.711 0.975 632 H ALA 42 HN ALA 42 4.713 -7.774 4.698 633 HA ALA 42 HA ALA 42 4.712 -6.740 2.082 634 HB1 ALA 42 HB1 ALA 42 2.121 -6.658 2.588 635 HB2 ALA 42 HB2 ALA 42 2.597 -7.542 4.038 636 HB3 ALA 42 HB3 ALA 42 2.958 -8.203 2.443 637 H ALA 43 HN ALA 43 3.793 -5.296 5.182 638 HA ALA 43 HA ALA 43 2.697 -2.903 4.179 639 HB1 ALA 43 HB1 ALA 43 3.220 -1.986 6.439 640 HB2 ALA 43 HB2 ALA 43 4.128 -3.457 6.790 641 HB3 ALA 43 HB3 ALA 43 2.390 -3.541 6.502 642 H VAL 44 HN VAL 44 6.010 -3.801 5.052 643 HA VAL 44 HA VAL 44 7.193 -1.261 4.699 644 HB VAL 44 HB VAL 44 8.327 -4.056 4.497 645 HG11 VAL 44 HG11 VAL 44 9.931 -2.887 3.297 646 HG12 VAL 44 HG12 VAL 44 10.500 -2.595 4.941 647 HG13 VAL 44 HG13 VAL 44 9.567 -1.358 4.098 648 HG21 VAL 44 HG21 VAL 44 7.537 -3.420 6.719 649 HG22 VAL 44 HG22 VAL 44 8.405 -1.889 6.621 650 HG23 VAL 44 HG23 VAL 44 9.300 -3.406 6.708 651 H ALA 45 HN ALA 45 6.752 -3.982 2.426 652 HA ALA 45 HA ALA 45 8.197 -2.884 0.278 653 HB1 ALA 45 HB1 ALA 45 6.650 -4.373 -1.121 654 HB2 ALA 45 HB2 ALA 45 5.917 -4.846 0.412 655 HB3 ALA 45 HB3 ALA 45 7.626 -5.168 0.115 656 H ILE 46 HN ILE 46 4.723 -2.642 1.055 657 HA ILE 46 HA ILE 46 4.046 -1.069 -1.201 658 HB ILE 46 HB ILE 46 2.741 -1.362 1.510 659 HG12 ILE 46 HG12 ILE 46 1.887 -2.389 -1.209 660 HG13 ILE 46 HG11 ILE 46 2.880 -3.333 -0.099 661 HG21 ILE 46 HG21 ILE 46 1.934 0.720 0.762 662 HG22 ILE 46 HG22 ILE 46 0.734 -0.416 0.146 663 HG23 ILE 46 HG23 ILE 46 1.972 0.230 -0.931 664 HD11 ILE 46 HD11 ILE 46 1.114 -3.828 1.223 665 HD12 ILE 46 HD12 ILE 46 0.110 -3.266 -0.114 666 HD13 ILE 46 HD13 ILE 46 0.529 -2.164 1.198 667 H GLN 47 HN GLN 47 4.884 -0.242 2.131 668 HA GLN 47 HA GLN 47 4.635 2.561 1.887 669 HB2 GLN 47 HB2 GLN 47 6.213 0.797 3.750 670 HB3 GLN 47 HB1 GLN 47 6.156 2.547 3.911 671 HG2 GLN 47 HG2 GLN 47 3.753 2.504 4.223 672 HG3 GLN 47 HG1 GLN 47 3.689 0.791 3.829 673 HE21 GLN 47 HE21 GLN 47 2.638 0.754 6.116 674 HE22 GLN 47 HE22 GLN 47 3.695 0.604 7.436 675 H SER 48 HN SER 48 7.402 0.377 1.454 676 HA SER 48 HA SER 48 9.372 2.363 1.149 677 HB2 SER 48 HB2 SER 48 9.215 -0.438 0.025 678 HB3 SER 48 HB1 SER 48 10.653 0.578 -0.050 679 HG SER 48 HG SER 48 10.613 0.664 2.227 680 H GLN 49 HN GLN 49 7.299 0.725 -1.219 681 HA GLN 49 HA GLN 49 8.404 2.029 -3.492 682 HB2 GLN 49 HB2 GLN 49 6.980 -0.083 -3.493 683 HB3 GLN 49 HB1 GLN 49 5.586 0.978 -3.275 684 HG2 GLN 49 HG2 GLN 49 5.801 0.650 -5.639 685 HG3 GLN 49 HG1 GLN 49 6.410 2.273 -5.305 686 HE21 GLN 49 HE21 GLN 49 7.741 -1.089 -5.391 687 HE22 GLN 49 HE22 GLN 49 9.182 -0.641 -6.169 688 H PHE 50 HN PHE 50 5.749 2.728 -1.285 689 HA PHE 50 HA PHE 50 4.563 4.854 -2.667 690 HB2 PHE 50 HB2 PHE 50 3.420 3.885 -0.783 691 HB3 PHE 50 HB1 PHE 50 4.746 4.300 0.303 692 HD1 PHE 50 HD1 PHE 50 2.623 6.056 -2.258 693 HD2 PHE 50 HD2 PHE 50 4.363 6.161 1.682 694 HE1 PHE 50 HE1 PHE 50 1.614 8.283 -1.869 695 HE2 PHE 50 HE2 PHE 50 3.357 8.402 2.053 696 HZ PHE 50 HZ PHE 50 1.982 9.455 0.282 697 H ARG 51 HN ARG 51 7.144 4.913 -0.205 698 HA ARG 51 HA ARG 51 7.463 7.703 -0.127 699 HB2 ARG 51 HB2 ARG 51 8.473 6.172 1.521 700 HB3 ARG 51 HB1 ARG 51 9.560 5.554 0.278 701 HG2 ARG 51 HG2 ARG 51 10.586 7.737 0.012 702 HG3 ARG 51 HG1 ARG 51 9.418 8.464 1.116 703 HD2 ARG 51 HD2 ARG 51 11.341 6.255 1.891 704 HD3 ARG 51 HD1 ARG 51 11.634 7.967 2.186 705 HE ARG 51 HE ARG 51 9.129 7.362 3.269 706 HH11 ARG 51 HH21 ARG 51 12.453 6.489 3.661 707 HH12 ARG 51 HH22 ARG 51 12.309 6.155 5.355 708 HH21 ARG 51 HH11 ARG 51 8.931 6.925 5.490 709 HH22 ARG 51 HH12 ARG 51 10.315 6.401 6.390 710 H LYS 52 HN LYS 52 9.054 5.245 -2.149 711 HA LYS 52 HA LYS 52 10.779 7.001 -3.537 712 HB2 LYS 52 HB2 LYS 52 11.027 4.539 -3.557 713 HB3 LYS 52 HB1 LYS 52 9.545 4.407 -4.505 714 HG2 LYS 52 HG2 LYS 52 10.562 5.720 -6.316 715 HG3 LYS 52 HG1 LYS 52 12.034 5.915 -5.365 716 HD2 LYS 52 HD2 LYS 52 12.336 3.458 -5.348 717 HD3 LYS 52 HD1 LYS 52 10.883 3.281 -6.333 718 HE2 LYS 52 HE2 LYS 52 13.345 4.852 -7.150 719 HE3 LYS 52 HE1 LYS 52 12.956 3.224 -7.707 720 HZ1 LYS 52 HZ1 LYS 52 12.234 4.916 -9.283 721 HZ2 LYS 52 HZ2 LYS 52 11.253 5.626 -8.092 722 HZ3 LYS 52 HZ3 LYS 52 10.910 4.061 -8.656 723 H PHE 53 HN PHE 53 7.477 5.927 -4.136 724 HA PHE 53 HA PHE 53 7.082 7.036 -6.677 725 HB2 PHE 53 HB2 PHE 53 5.504 5.467 -5.642 726 HB3 PHE 53 HB1 PHE 53 5.081 6.677 -4.433 727 HD1 PHE 53 HD1 PHE 53 4.997 5.905 -8.069 728 HD2 PHE 53 HD2 PHE 53 3.553 8.445 -4.920 729 HE1 PHE 53 HE1 PHE 53 3.310 6.864 -9.615 730 HE2 PHE 53 HE2 PHE 53 1.867 9.403 -6.466 731 HZ PHE 53 HZ PHE 53 1.747 8.613 -8.813 732 H GLN 54 HN GLN 54 6.601 8.444 -3.448 733 HA GLN 54 HA GLN 54 5.476 10.884 -4.258 734 HB2 GLN 54 HB2 GLN 54 7.171 10.171 -1.858 735 HB3 GLN 54 HB1 GLN 54 6.386 11.737 -2.062 736 HG2 GLN 54 HG2 GLN 54 4.193 10.631 -2.217 737 HG3 GLN 54 HG1 GLN 54 4.970 9.058 -2.040 738 HE21 GLN 54 HE21 GLN 54 3.229 11.196 -0.264 739 HE22 GLN 54 HE22 GLN 54 3.911 10.936 1.269 740 H LYS 55 HN LYS 55 8.876 9.914 -3.886 741 HA LYS 55 HA LYS 55 10.007 12.465 -4.299 742 HB2 LYS 55 HB2 LYS 55 11.080 9.686 -4.796 743 HB3 LYS 55 HB1 LYS 55 12.044 11.143 -5.029 744 HG2 LYS 55 HG2 LYS 55 11.635 11.793 -2.682 745 HG3 LYS 55 HG1 LYS 55 10.680 10.328 -2.448 746 HD2 LYS 55 HD2 LYS 55 12.619 8.931 -2.903 747 HD3 LYS 55 HD1 LYS 55 13.588 10.348 -3.306 748 HE2 LYS 55 HE2 LYS 55 14.080 9.619 -1.016 749 HE3 LYS 55 HE1 LYS 55 13.286 11.193 -0.993 750 HZ1 LYS 55 HZ1 LYS 55 11.176 9.601 -0.876 751 HZ2 LYS 55 HZ2 LYS 55 11.988 10.158 0.507 752 HZ3 LYS 55 HZ3 LYS 55 12.307 8.604 -0.101 753 H LYS 56 HN LYS 56 9.046 9.914 -6.557 754 HA LYS 56 HA LYS 56 10.125 11.070 -8.894 755 HB2 LYS 56 HB2 LYS 56 7.781 9.209 -8.465 756 HB3 LYS 56 HB1 LYS 56 8.360 9.675 -10.062 757 HG2 LYS 56 HG2 LYS 56 10.309 8.593 -8.048 758 HG3 LYS 56 HG1 LYS 56 9.270 7.475 -8.929 759 HD2 LYS 56 HD2 LYS 56 10.082 8.482 -11.074 760 HD3 LYS 56 HD1 LYS 56 11.202 9.476 -10.147 761 HE2 LYS 56 HE2 LYS 56 11.131 6.451 -10.035 762 HE3 LYS 56 HE1 LYS 56 12.243 7.380 -11.039 763 HZ1 LYS 56 HZ1 LYS 56 12.025 7.512 -8.082 764 HZ2 LYS 56 HZ2 LYS 56 13.054 8.478 -9.028 765 HZ3 LYS 56 HZ3 LYS 56 13.286 6.797 -8.961 766 H LYS 57 HN LYS 57 7.014 11.480 -7.267 767 HA LYS 57 HA LYS 57 5.730 13.016 -9.244 768 HB2 LYS 57 HB2 LYS 57 4.592 12.015 -7.286 769 HB3 LYS 57 HB1 LYS 57 5.390 13.184 -6.238 770 HG2 LYS 57 HG2 LYS 57 4.330 15.033 -7.541 771 HG3 LYS 57 HG1 LYS 57 3.476 13.832 -8.504 772 HD2 LYS 57 HD2 LYS 57 3.249 13.938 -5.491 773 HD3 LYS 57 HD1 LYS 57 2.181 14.862 -6.544 774 HE2 LYS 57 HE2 LYS 57 1.593 12.689 -7.703 775 HE3 LYS 57 HE1 LYS 57 2.488 11.848 -6.439 776 HZ1 LYS 57 HZ1 LYS 57 0.916 12.255 -4.917 777 HZ2 LYS 57 HZ2 LYS 57 -0.097 12.435 -6.270 778 HZ3 LYS 57 HZ3 LYS 57 0.566 13.804 -5.513 779 H ALA 58 HN ALA 58 7.805 13.956 -6.520 780 HA ALA 58 HA ALA 58 7.570 16.747 -6.820 781 HB1 ALA 58 HB1 ALA 58 10.152 16.322 -5.898 782 HB2 ALA 58 HB2 ALA 58 9.281 14.885 -5.365 783 HB3 ALA 58 HB3 ALA 58 8.710 16.487 -4.897 784 H GLY 59 HN GLY 59 9.753 14.388 -8.299 785 HA2 GLY 59 HA2 GLY 59 10.664 14.595 -10.472 786 HA3 GLY 59 HA1 GLY 59 10.371 16.331 -10.407 787 H SER 60 HN SER 60 11.624 17.314 -8.350 788 HA SER 60 HA SER 60 13.700 18.026 -7.657 789 HB2 SER 60 HB2 SER 60 14.977 16.407 -6.540 790 HB3 SER 60 HB1 SER 60 13.354 15.723 -6.516 791 HG SER 60 HG SER 60 14.989 15.168 -8.710 792 H GLN 61 HN GLN 61 16.169 17.732 -8.104 793 HA GLN 61 HA GLN 61 16.501 17.978 -10.974 794 HB2 GLN 61 HB2 GLN 61 18.547 18.198 -8.753 795 HB3 GLN 61 HB1 GLN 61 18.776 18.687 -10.433 796 HG2 GLN 61 HG2 GLN 61 18.223 20.683 -9.240 797 HG3 GLN 61 HG1 GLN 61 16.768 20.226 -10.126 798 HE21 GLN 61 HE21 GLN 61 18.209 19.239 -6.955 799 HE22 GLN 61 HE22 GLN 61 16.768 19.445 -6.083 800 H SER 62 HN SER 62 17.785 16.688 -12.284 801 HA SER 62 HA SER 62 18.077 13.937 -11.393 802 HB2 SER 62 HB2 SER 62 18.660 15.227 -14.068 803 HB3 SER 62 HB1 SER 62 18.695 13.498 -13.740 804 HG SER 62 HG SER 62 16.681 14.321 -14.619 Start of MODEL 19 1 H1 MET 76 HT1 MET 76 10.272 -17.930 -13.316 2 H2 MET 76 HT2 MET 76 11.532 -17.571 -14.400 3 H3 MET 76 HT3 MET 76 10.088 -18.264 -14.969 4 HA MET 76 HA MET 76 9.405 -15.932 -13.598 5 HB2 MET 76 HB2 MET 76 11.606 -15.583 -15.658 6 HB3 MET 76 HB1 MET 76 10.656 -14.275 -14.952 7 HG2 MET 76 HG2 MET 76 11.487 -14.849 -12.715 8 HG3 MET 76 HG1 MET 76 12.400 -16.200 -13.386 9 HE1 MET 76 HE1 MET 76 14.812 -13.465 -12.128 10 HE2 MET 76 HE2 MET 76 15.092 -15.134 -12.619 11 HE3 MET 76 HE3 MET 76 13.669 -14.732 -11.661 12 H LYS 77 HN LYS 77 8.050 -17.895 -14.910 13 HA LYS 77 HA LYS 77 7.591 -17.482 -17.662 14 HB2 LYS 77 HB2 LYS 77 5.848 -18.643 -15.483 15 HB3 LYS 77 HB1 LYS 77 5.393 -18.639 -17.188 16 HG2 LYS 77 HG2 LYS 77 7.456 -19.876 -17.743 17 HG3 LYS 77 HG1 LYS 77 7.906 -19.887 -16.037 18 HD2 LYS 77 HD2 LYS 77 5.890 -21.167 -15.485 19 HD3 LYS 77 HD1 LYS 77 5.375 -21.113 -17.172 20 HE2 LYS 77 HE2 LYS 77 6.455 -23.263 -16.700 21 HE3 LYS 77 HE1 LYS 77 7.443 -22.327 -17.822 22 HZ1 LYS 77 HZ1 LYS 77 8.679 -23.373 -15.941 23 HZ2 LYS 77 HZ2 LYS 77 7.862 -22.320 -14.886 24 HZ3 LYS 77 HZ3 LYS 77 8.895 -21.697 -16.082 25 H ASP 78 HN ASP 78 6.118 -16.069 -14.776 26 HA ASP 78 HA ASP 78 4.376 -14.394 -16.447 27 HB2 ASP 78 HB2 ASP 78 4.542 -14.823 -13.457 28 HB3 ASP 78 HB1 ASP 78 3.472 -13.644 -14.214 29 H THR 79 HN THR 79 7.032 -14.185 -14.136 30 HA THR 79 HA THR 79 8.563 -12.530 -13.703 31 HB THR 79 HB THR 79 7.657 -11.045 -16.150 32 HG1 THR 79 HG1 THR 79 8.118 -12.690 -17.338 33 HG21 THR 79 HG21 THR 79 9.982 -10.474 -16.298 34 HG22 THR 79 HG22 THR 79 10.420 -11.695 -15.104 35 HG23 THR 79 HG23 THR 79 9.518 -10.261 -14.611 36 H ASP 80 HN ASP 80 5.999 -10.704 -15.345 37 HA ASP 80 HA ASP 80 5.769 -8.370 -14.291 38 HB2 ASP 80 HB2 ASP 80 3.520 -10.377 -14.297 39 HB3 ASP 80 HB1 ASP 80 3.268 -8.674 -13.921 40 H SER 81 HN SER 81 6.342 -7.526 -12.444 41 HA SER 81 HA SER 81 6.108 -8.941 -9.933 42 HB2 SER 81 HB2 SER 81 7.080 -6.149 -10.591 43 HB3 SER 81 HB1 SER 81 7.153 -6.886 -8.991 44 HG SER 81 HG SER 81 9.080 -7.086 -10.373 45 H GLU 82 HN GLU 82 3.990 -7.156 -11.762 46 HA GLU 82 HA GLU 82 2.723 -5.480 -9.917 47 HB2 GLU 82 HB2 GLU 82 2.226 -5.547 -12.360 48 HB3 GLU 82 HB1 GLU 82 1.416 -7.093 -12.122 49 HG2 GLU 82 HG2 GLU 82 0.624 -4.666 -10.513 50 HG3 GLU 82 HG1 GLU 82 -0.034 -4.935 -12.123 51 H GLU 83 HN GLU 83 2.425 -8.910 -10.553 52 HA GLU 83 HA GLU 83 0.229 -9.412 -8.817 53 HB2 GLU 83 HB2 GLU 83 0.834 -11.748 -9.083 54 HB3 GLU 83 HB1 GLU 83 0.993 -10.932 -10.637 55 HG2 GLU 83 HG2 GLU 83 3.032 -11.999 -10.609 56 HG3 GLU 83 HG1 GLU 83 3.492 -10.531 -9.746 57 H GLU 84 HN GLU 84 3.748 -9.329 -8.369 58 HA GLU 84 HA GLU 84 3.833 -10.529 -5.808 59 HB2 GLU 84 HB2 GLU 84 5.674 -8.531 -7.139 60 HB3 GLU 84 HB1 GLU 84 6.031 -9.318 -5.603 61 HG2 GLU 84 HG2 GLU 84 5.414 -10.819 -8.159 62 HG3 GLU 84 HG1 GLU 84 7.048 -10.461 -7.605 63 H ILE 85 HN ILE 85 3.578 -7.137 -6.818 64 HA ILE 85 HA ILE 85 3.531 -6.072 -4.179 65 HB ILE 85 HB ILE 85 2.644 -4.952 -6.845 66 HG12 ILE 85 HG12 ILE 85 5.147 -5.362 -6.094 67 HG13 ILE 85 HG11 ILE 85 4.700 -3.852 -6.887 68 HG21 ILE 85 HG21 ILE 85 2.711 -2.742 -5.481 69 HG22 ILE 85 HG22 ILE 85 2.530 -3.782 -4.066 70 HG23 ILE 85 HG23 ILE 85 1.290 -3.774 -5.321 71 HD11 ILE 85 HD11 ILE 85 4.596 -4.085 -3.878 72 HD12 ILE 85 HD12 ILE 85 4.726 -2.638 -4.870 73 HD13 ILE 85 HD13 ILE 85 6.109 -3.718 -4.704 74 H ARG 86 HN ARG 86 1.106 -7.144 -6.464 75 HA ARG 86 HA ARG 86 -1.219 -6.248 -5.166 76 HB2 ARG 86 HB2 ARG 86 -1.101 -7.104 -7.491 77 HB3 ARG 86 HB1 ARG 86 -0.801 -8.720 -6.856 78 HG2 ARG 86 HG2 ARG 86 -2.966 -8.693 -5.710 79 HG3 ARG 86 HG1 ARG 86 -3.269 -7.059 -6.298 80 HD2 ARG 86 HD2 ARG 86 -3.166 -7.852 -8.615 81 HD3 ARG 86 HD1 ARG 86 -2.811 -9.484 -8.058 82 HE ARG 86 HE ARG 86 -5.215 -8.630 -6.854 83 HH11 ARG 86 HH21 ARG 86 -3.884 -9.424 -9.948 84 HH12 ARG 86 HH22 ARG 86 -5.390 -9.971 -10.609 85 HH21 ARG 86 HH11 ARG 86 -7.191 -9.345 -7.713 86 HH22 ARG 86 HH12 ARG 86 -7.262 -9.926 -9.342 87 H GLU 87 HN GLU 87 0.726 -9.160 -4.808 88 HA GLU 87 HA GLU 87 -0.966 -10.669 -3.163 89 HB2 GLU 87 HB2 GLU 87 1.117 -11.542 -4.180 90 HB3 GLU 87 HB1 GLU 87 2.059 -10.544 -3.073 91 HG2 GLU 87 HG2 GLU 87 1.094 -11.718 -1.149 92 HG3 GLU 87 HG1 GLU 87 0.080 -12.678 -2.225 93 H ALA 88 HN ALA 88 1.325 -8.105 -2.391 94 HA ALA 88 HA ALA 88 1.257 -8.310 0.416 95 HB1 ALA 88 HB1 ALA 88 2.069 -6.004 0.421 96 HB2 ALA 88 HB2 ALA 88 1.598 -5.815 -1.268 97 HB3 ALA 88 HB3 ALA 88 2.893 -6.928 -0.834 98 H PHE 89 HN PHE 89 -0.964 -6.794 -1.875 99 HA PHE 89 HA PHE 89 -2.468 -5.459 0.193 100 HB2 PHE 89 HB2 PHE 89 -2.957 -5.948 -2.741 101 HB3 PHE 89 HB1 PHE 89 -4.156 -5.176 -1.699 102 HD1 PHE 89 HD2 PHE 89 -3.668 -3.013 -0.596 103 HD2 PHE 89 HD1 PHE 89 -0.900 -4.816 -3.336 104 HE1 PHE 89 HE2 PHE 89 -2.439 -0.865 -0.768 105 HE2 PHE 89 HE1 PHE 89 0.341 -2.672 -3.502 106 HZ PHE 89 HZ PHE 89 -0.436 -0.695 -2.221 107 H ARG 90 HN ARG 90 -2.741 -8.455 -1.669 108 HA ARG 90 HA ARG 90 -5.243 -9.335 -1.042 109 HB2 ARG 90 HB2 ARG 90 -2.697 -10.678 -1.596 110 HB3 ARG 90 HB1 ARG 90 -3.802 -11.646 -0.629 111 HG2 ARG 90 HG2 ARG 90 -4.246 -12.119 -2.954 112 HG3 ARG 90 HG1 ARG 90 -5.596 -11.165 -2.347 113 HD2 ARG 90 HD2 ARG 90 -4.569 -9.123 -3.281 114 HD3 ARG 90 HD1 ARG 90 -3.214 -10.081 -3.872 115 HE ARG 90 HE ARG 90 -5.870 -9.939 -5.032 116 HH11 ARG 90 HH21 ARG 90 -2.918 -11.715 -4.706 117 HH12 ARG 90 HH22 ARG 90 -3.112 -12.574 -6.198 118 HH21 ARG 90 HH11 ARG 90 -6.129 -11.062 -6.986 119 HH22 ARG 90 HH12 ARG 90 -4.929 -12.205 -7.488 120 H VAL 91 HN VAL 91 -2.517 -9.054 1.132 121 HA VAL 91 HA VAL 91 -3.474 -10.636 3.244 122 HB VAL 91 HB VAL 91 -1.645 -8.229 3.171 123 HG11 VAL 91 HG11 VAL 91 -2.807 -9.759 5.464 124 HG12 VAL 91 HG12 VAL 91 -2.251 -8.086 5.402 125 HG13 VAL 91 HG13 VAL 91 -1.085 -9.399 5.540 126 HG21 VAL 91 HG21 VAL 91 -1.210 -11.208 3.570 127 HG22 VAL 91 HG22 VAL 91 0.056 -9.982 3.629 128 HG23 VAL 91 HG23 VAL 91 -0.808 -10.286 2.122 129 H PHE 92 HN PHE 92 -4.082 -7.242 2.403 130 HA PHE 92 HA PHE 92 -5.737 -6.877 4.778 131 HB2 PHE 92 HB2 PHE 92 -5.396 -4.949 2.482 132 HB3 PHE 92 HB1 PHE 92 -5.878 -4.589 4.139 133 HD1 PHE 92 HD2 PHE 92 -4.041 -5.788 5.904 134 HD2 PHE 92 HD1 PHE 92 -3.248 -4.210 1.989 135 HE1 PHE 92 HE2 PHE 92 -1.666 -5.476 6.509 136 HE2 PHE 92 HE1 PHE 92 -0.871 -3.904 2.601 137 HZ PHE 92 HZ PHE 92 -0.077 -4.536 4.857 138 H ASP 93 HN ASP 93 -6.092 -7.603 1.398 139 HA ASP 93 HA ASP 93 -8.978 -7.098 1.436 140 HB2 ASP 93 HB2 ASP 93 -7.629 -6.542 -0.585 141 HB3 ASP 93 HB1 ASP 93 -7.259 -8.251 -0.767 142 H LYS 94 HN LYS 94 -9.054 -8.763 3.272 143 HA LYS 94 HA LYS 94 -8.736 -11.527 2.556 144 HB2 LYS 94 HB2 LYS 94 -9.645 -11.964 4.762 145 HB3 LYS 94 HB1 LYS 94 -8.439 -10.687 4.862 146 HG2 LYS 94 HG2 LYS 94 -10.259 -8.996 4.810 147 HG3 LYS 94 HG1 LYS 94 -11.446 -10.299 4.797 148 HD2 LYS 94 HD2 LYS 94 -10.502 -11.139 6.944 149 HD3 LYS 94 HD1 LYS 94 -9.412 -9.754 6.975 150 HE2 LYS 94 HE2 LYS 94 -12.438 -9.583 6.907 151 HE3 LYS 94 HE1 LYS 94 -11.442 -9.352 8.344 152 HZ1 LYS 94 HZ1 LYS 94 -11.469 -7.699 5.883 153 HZ2 LYS 94 HZ2 LYS 94 -10.278 -7.559 7.087 154 HZ3 LYS 94 HZ3 LYS 94 -11.904 -7.224 7.452 155 H ASP 95 HN ASP 95 -11.185 -9.169 2.229 156 HA ASP 95 HA ASP 95 -13.435 -10.959 2.216 157 HB2 ASP 95 HB2 ASP 95 -13.551 -8.479 2.682 158 HB3 ASP 95 HB1 ASP 95 -13.260 -8.215 0.964 159 H GLY 96 HN GLY 96 -11.107 -9.803 -0.113 160 HA2 GLY 96 HA2 GLY 96 -10.618 -10.589 -2.222 161 HA3 GLY 96 HA1 GLY 96 -11.867 -11.811 -2.013 162 H ASN 97 HN ASN 97 -12.734 -8.495 -1.489 163 HA ASN 97 HA ASN 97 -14.489 -8.609 -3.829 164 HB2 ASN 97 HB2 ASN 97 -14.309 -6.716 -1.483 165 HB3 ASN 97 HB1 ASN 97 -15.402 -6.464 -2.842 166 HD21 ASN 97 HD21 ASN 97 -16.357 -6.933 -0.159 167 HD22 ASN 97 HD22 ASN 97 -17.164 -8.427 -0.151 168 H GLY 98 HN GLY 98 -11.400 -7.554 -3.210 169 HA2 GLY 98 HA2 GLY 98 -10.025 -6.507 -4.844 170 HA3 GLY 98 HA1 GLY 98 -11.467 -5.809 -5.570 171 H TYR 99 HN TYR 99 -11.474 -5.526 -2.221 172 HA TYR 99 HA TYR 99 -10.216 -2.853 -2.284 173 HB2 TYR 99 HB2 TYR 99 -12.928 -3.381 -1.069 174 HB3 TYR 99 HB1 TYR 99 -12.050 -1.849 -1.079 175 HD1 TYR 99 HD1 TYR 99 -13.367 -4.458 -3.394 176 HD2 TYR 99 HD2 TYR 99 -12.375 -0.324 -2.818 177 HE1 TYR 99 HE1 TYR 99 -14.302 -3.933 -5.629 178 HE2 TYR 99 HE2 TYR 99 -13.310 0.209 -5.059 179 HH TYR 99 HH TYR 99 -15.342 -1.443 -6.640 180 H ILE 100 HN ILE 100 -9.680 -1.944 -0.228 181 HA ILE 100 HA ILE 100 -9.550 -3.888 1.990 182 HB ILE 100 HB ILE 100 -7.289 -3.590 2.337 183 HG12 ILE 100 HG12 ILE 100 -7.634 -0.866 1.070 184 HG13 ILE 100 HG11 ILE 100 -7.267 -1.214 2.760 185 HG21 ILE 100 HG21 ILE 100 -6.158 -3.851 0.310 186 HG22 ILE 100 HG22 ILE 100 -7.156 -2.645 -0.507 187 HG23 ILE 100 HG23 ILE 100 -7.814 -4.250 -0.153 188 HD11 ILE 100 HD11 ILE 100 -5.161 -0.680 1.925 189 HD12 ILE 100 HD12 ILE 100 -5.480 -1.422 0.357 190 HD13 ILE 100 HD13 ILE 100 -5.174 -2.437 1.767 191 H SER 101 HN SER 101 -9.959 -2.953 4.026 192 HA SER 101 HA SER 101 -11.474 -0.595 4.067 193 HB2 SER 101 HB2 SER 101 -9.976 -1.965 6.315 194 HB3 SER 101 HB1 SER 101 -11.170 -0.690 6.539 195 HG SER 101 HG SER 101 -11.645 -3.126 5.158 196 H ALA 102 HN ALA 102 -10.948 1.498 4.141 197 HA ALA 102 HA ALA 102 -8.303 2.386 3.721 198 HB1 ALA 102 HB1 ALA 102 -10.347 4.227 4.865 199 HB2 ALA 102 HB2 ALA 102 -10.665 3.515 3.282 200 HB3 ALA 102 HB3 ALA 102 -9.218 4.494 3.534 201 H ALA 103 HN ALA 103 -10.305 2.189 6.611 202 HA ALA 103 HA ALA 103 -8.730 3.694 8.364 203 HB1 ALA 103 HB1 ALA 103 -10.092 1.315 9.483 204 HB2 ALA 103 HB2 ALA 103 -11.102 2.443 8.577 205 HB3 ALA 103 HB3 ALA 103 -10.182 3.007 9.971 206 H GLU 104 HN GLU 104 -8.487 0.220 7.570 207 HA GLU 104 HA GLU 104 -6.521 -0.317 9.565 208 HB2 GLU 104 HB2 GLU 104 -6.502 -2.470 8.757 209 HB3 GLU 104 HB1 GLU 104 -8.065 -1.934 8.156 210 HG2 GLU 104 HG2 GLU 104 -6.768 -1.208 6.038 211 HG3 GLU 104 HG1 GLU 104 -5.479 -2.237 6.646 212 H LEU 105 HN LEU 105 -6.406 0.886 6.299 213 HA LEU 105 HA LEU 105 -3.703 0.347 5.709 214 HB2 LEU 105 HB2 LEU 105 -5.295 1.138 4.009 215 HB3 LEU 105 HB1 LEU 105 -5.403 2.696 4.826 216 HG LEU 105 HG LEU 105 -2.632 1.913 4.300 217 HD11 LEU 105 HD11 LEU 105 -3.436 0.855 2.312 218 HD12 LEU 105 HD12 LEU 105 -2.884 2.452 1.810 219 HD13 LEU 105 HD13 LEU 105 -4.607 2.140 2.013 220 HD21 LEU 105 HD21 LEU 105 -2.564 4.215 3.420 221 HD22 LEU 105 HD22 LEU 105 -3.395 4.172 4.975 222 HD23 LEU 105 HD23 LEU 105 -4.325 4.299 3.481 223 H ARG 106 HN ARG 106 -5.228 3.208 7.183 224 HA ARG 106 HA ARG 106 -2.935 4.730 7.584 225 HB2 ARG 106 HB2 ARG 106 -4.900 5.876 8.027 226 HB3 ARG 106 HB1 ARG 106 -5.602 4.544 8.933 227 HG2 ARG 106 HG2 ARG 106 -5.057 6.429 10.403 228 HG3 ARG 106 HG1 ARG 106 -4.093 5.033 10.834 229 HD2 ARG 106 HD2 ARG 106 -2.579 6.832 10.879 230 HD3 ARG 106 HD1 ARG 106 -2.279 6.087 9.317 231 HE ARG 106 HE ARG 106 -4.181 7.970 8.769 232 HH11 ARG 106 HH21 ARG 106 -1.154 7.981 10.436 233 HH12 ARG 106 HH22 ARG 106 -0.765 9.611 10.010 234 HH21 ARG 106 HH11 ARG 106 -3.685 10.119 8.211 235 HH22 ARG 106 HH12 ARG 106 -2.196 10.823 8.749 236 H HIS 107 HN HIS 107 -4.445 2.379 9.862 237 HA HIS 107 HA HIS 107 -2.469 2.583 11.856 238 HB2 HIS 107 HB2 HIS 107 -4.579 1.537 12.340 239 HB3 HIS 107 HB1 HIS 107 -4.315 0.312 11.101 240 HD1 HIS 107 HD1 HIS 107 -2.623 1.531 14.301 241 HD2 HIS 107 HD2 HIS 107 -3.115 -1.970 12.085 242 HE1 HIS 107 HE1 HIS 107 -1.544 -0.325 15.645 243 HE2 HIS 107 HE2 HIS 107 -1.833 -2.465 14.308 244 H VAL 108 HN VAL 108 -2.800 0.307 9.170 245 HA VAL 108 HA VAL 108 -0.548 -1.285 9.692 246 HB VAL 108 HB VAL 108 -2.040 -0.629 7.147 247 HG11 VAL 108 HG11 VAL 108 -0.914 -2.768 6.327 248 HG12 VAL 108 HG12 VAL 108 0.226 -2.563 7.650 249 HG13 VAL 108 HG13 VAL 108 0.108 -1.336 6.390 250 HG21 VAL 108 HG21 VAL 108 -2.873 -2.025 9.303 251 HG22 VAL 108 HG22 VAL 108 -2.031 -3.311 8.435 252 HG23 VAL 108 HG23 VAL 108 -3.353 -2.439 7.657 253 H MET 109 HN MET 109 -0.888 1.658 7.766 254 HA MET 109 HA MET 109 1.780 1.609 6.712 255 HB2 MET 109 HB2 MET 109 -0.505 3.503 6.692 256 HB3 MET 109 HB1 MET 109 1.100 4.185 6.429 257 HG2 MET 109 HG2 MET 109 -0.161 3.386 4.342 258 HG3 MET 109 HG1 MET 109 1.497 2.810 4.534 259 HE1 MET 109 HE1 MET 109 0.649 1.556 2.692 260 HE2 MET 109 HE2 MET 109 -0.412 0.152 2.714 261 HE3 MET 109 HE3 MET 109 1.257 -0.006 3.254 262 H THR 110 HN THR 110 0.354 2.916 9.642 263 HA THR 110 HA THR 110 2.869 4.334 10.220 264 HB THR 110 HB THR 110 1.631 5.544 11.894 265 HG1 THR 110 HG1 THR 110 -0.418 3.695 11.256 266 HG21 THR 110 HG21 THR 110 0.105 5.201 9.321 267 HG22 THR 110 HG22 THR 110 1.388 6.364 9.640 268 HG23 THR 110 HG23 THR 110 -0.164 6.512 10.463 269 H ASN 111 HN ASN 111 1.306 1.399 10.995 270 HA ASN 111 HA ASN 111 2.805 1.201 13.540 271 HB2 ASN 111 HB2 ASN 111 0.353 0.884 13.690 272 HB3 ASN 111 HB1 ASN 111 0.486 -0.484 12.585 273 HD21 ASN 111 HD21 ASN 111 1.006 0.560 15.892 274 HD22 ASN 111 HD22 ASN 111 1.498 -0.950 16.488 275 H LEU 112 HN LEU 112 1.934 -0.753 10.671 276 HA LEU 112 HA LEU 112 4.054 -2.657 11.328 277 HB2 LEU 112 HB2 LEU 112 2.026 -2.661 9.091 278 HB3 LEU 112 HB1 LEU 112 3.150 -3.968 9.443 279 HG LEU 112 HG LEU 112 1.043 -2.912 11.356 280 HD11 LEU 112 HD11 LEU 112 -0.394 -4.293 10.311 281 HD12 LEU 112 HD12 LEU 112 0.682 -5.655 10.632 282 HD13 LEU 112 HD13 LEU 112 0.857 -4.721 9.144 283 HD21 LEU 112 HD21 LEU 112 2.535 -3.860 12.827 284 HD22 LEU 112 HD22 LEU 112 3.296 -4.850 11.582 285 HD23 LEU 112 HD23 LEU 112 1.766 -5.354 12.293 286 H GLY 113 HN GLY 113 5.486 -3.443 9.625 287 HA2 GLY 113 HA2 GLY 113 7.123 -3.141 8.049 288 HA3 GLY 113 HA1 GLY 113 6.028 -2.016 7.257 289 H GLU 114 HN GLU 114 6.718 -0.031 7.085 290 HA GLU 114 HA GLU 114 8.757 0.965 8.986 291 HB2 GLU 114 HB2 GLU 114 8.297 1.782 6.108 292 HB3 GLU 114 HB1 GLU 114 9.529 2.445 7.185 293 HG2 GLU 114 HG2 GLU 114 9.309 -0.490 6.486 294 HG3 GLU 114 HG1 GLU 114 10.381 0.635 5.654 295 H LYS 115 HN LYS 115 7.307 1.833 10.466 296 HA LYS 115 HA LYS 115 4.977 3.081 10.280 297 HB2 LYS 115 HB2 LYS 115 7.348 4.185 11.804 298 HB3 LYS 115 HB1 LYS 115 5.657 4.567 12.125 299 HG2 LYS 115 HG2 LYS 115 5.211 2.169 12.574 300 HG3 LYS 115 HG1 LYS 115 6.911 1.810 12.283 301 HD2 LYS 115 HD2 LYS 115 7.561 3.284 14.142 302 HD3 LYS 115 HD1 LYS 115 5.866 3.677 14.432 303 HE2 LYS 115 HE2 LYS 115 6.590 1.936 15.994 304 HE3 LYS 115 HE1 LYS 115 5.407 1.272 14.866 305 HZ1 LYS 115 HZ1 LYS 115 7.079 0.210 13.642 306 HZ2 LYS 115 HZ2 LYS 115 7.477 -0.089 15.266 307 HZ3 LYS 115 HZ3 LYS 115 8.321 1.093 14.385 308 H LEU 116 HN LEU 116 4.135 4.511 8.912 309 HA LEU 116 HA LEU 116 5.818 6.520 7.616 310 HB2 LEU 116 HB2 LEU 116 3.070 5.422 7.182 311 HB3 LEU 116 HB1 LEU 116 3.336 7.096 6.721 312 HG LEU 116 HG LEU 116 3.697 5.566 4.814 313 HD11 LEU 116 HD11 LEU 116 5.371 7.616 5.642 314 HD12 LEU 116 HD12 LEU 116 5.336 6.902 4.035 315 HD13 LEU 116 HD13 LEU 116 6.489 6.319 5.236 316 HD21 LEU 116 HD21 LEU 116 6.213 4.501 5.951 317 HD22 LEU 116 HD22 LEU 116 5.025 3.717 4.911 318 HD23 LEU 116 HD23 LEU 116 4.728 3.847 6.644 319 H THR 117 HN THR 117 5.217 8.845 7.719 320 HA THR 117 HA THR 117 4.241 9.540 10.378 321 HB THR 117 HB THR 117 5.018 11.796 9.822 322 HG1 THR 117 HG1 THR 117 5.355 10.607 7.286 323 HG21 THR 117 HG21 THR 117 7.112 11.166 10.351 324 HG22 THR 117 HG22 THR 117 7.345 10.425 8.768 325 HG23 THR 117 HG23 THR 117 6.609 9.499 10.075 326 H ASP 118 HN ASP 118 2.685 11.425 10.529 327 HA ASP 118 HA ASP 118 0.283 10.812 9.217 328 HB2 ASP 118 HB2 ASP 118 1.196 13.297 10.673 329 HB3 ASP 118 HB1 ASP 118 -0.445 13.090 10.064 330 H GLU 119 HN GLU 119 2.763 13.226 8.531 331 HA GLU 119 HA GLU 119 1.394 14.584 6.466 332 HB2 GLU 119 HB2 GLU 119 4.354 14.170 6.948 333 HB3 GLU 119 HB1 GLU 119 3.704 15.246 5.710 334 HG2 GLU 119 HG2 GLU 119 2.985 15.448 8.645 335 HG3 GLU 119 HG1 GLU 119 4.271 16.388 7.892 336 H GLU 120 HN GLU 120 3.498 11.733 6.435 337 HA GLU 120 HA GLU 120 3.467 11.419 3.592 338 HB2 GLU 120 HB2 GLU 120 4.195 9.596 5.876 339 HB3 GLU 120 HB1 GLU 120 4.270 9.070 4.192 340 HG2 GLU 120 HG2 GLU 120 5.792 10.926 3.665 341 HG3 GLU 120 HG1 GLU 120 5.691 11.502 5.328 342 H VAL 121 HN VAL 121 1.623 9.967 6.260 343 HA VAL 121 HA VAL 121 0.106 8.184 4.635 344 HB VAL 121 HB VAL 121 -0.487 9.415 7.350 345 HG11 VAL 121 HG11 VAL 121 -2.613 8.776 6.681 346 HG12 VAL 121 HG12 VAL 121 -2.030 7.257 7.358 347 HG13 VAL 121 HG13 VAL 121 -2.008 7.509 5.616 348 HG21 VAL 121 HG21 VAL 121 1.150 7.935 7.929 349 HG22 VAL 121 HG22 VAL 121 1.039 7.066 6.399 350 HG23 VAL 121 HG23 VAL 121 -0.105 6.726 7.689 351 H ASP 122 HN ASP 122 -0.583 11.496 5.838 352 HA ASP 122 HA ASP 122 -3.191 11.705 4.901 353 HB2 ASP 122 HB2 ASP 122 -0.993 13.781 5.104 354 HB3 ASP 122 HB1 ASP 122 -2.655 14.184 4.673 355 H GLU 123 HN GLU 123 -0.126 12.116 3.211 356 HA GLU 123 HA GLU 123 -1.178 13.005 0.737 357 HB2 GLU 123 HB2 GLU 123 1.227 13.136 1.337 358 HB3 GLU 123 HB1 GLU 123 1.325 11.377 1.258 359 HG2 GLU 123 HG2 GLU 123 0.673 11.424 -1.108 360 HG3 GLU 123 HG1 GLU 123 0.508 13.178 -1.041 361 H MET 124 HN MET 124 -0.635 9.821 2.160 362 HA MET 124 HA MET 124 -1.245 8.295 -0.179 363 HB2 MET 124 HB2 MET 124 -1.257 7.575 2.763 364 HB3 MET 124 HB1 MET 124 -1.451 6.421 1.449 365 HG2 MET 124 HG2 MET 124 0.727 6.960 0.565 366 HG3 MET 124 HG1 MET 124 0.904 8.288 1.699 367 HE1 MET 124 HE1 MET 124 0.668 4.686 0.988 368 HE2 MET 124 HE2 MET 124 -0.451 4.526 2.340 369 HE3 MET 124 HE3 MET 124 1.157 3.816 2.446 370 H ILE 125 HN ILE 125 -3.110 9.455 2.604 371 HA ILE 125 HA ILE 125 -5.481 8.044 2.131 372 HB ILE 125 HB ILE 125 -4.650 10.311 3.744 373 HG12 ILE 125 HG12 ILE 125 -6.094 9.174 5.396 374 HG13 ILE 125 HG11 ILE 125 -6.646 8.087 4.131 375 HG21 ILE 125 HG21 ILE 125 -7.499 10.177 2.763 376 HG22 ILE 125 HG22 ILE 125 -6.389 11.547 2.653 377 HG23 ILE 125 HG23 ILE 125 -7.003 11.033 4.220 378 HD11 ILE 125 HD11 ILE 125 -3.743 8.232 4.260 379 HD12 ILE 125 HD12 ILE 125 -4.788 6.818 4.260 380 HD13 ILE 125 HD13 ILE 125 -4.450 7.663 5.770 381 H ARG 126 HN ARG 126 -4.303 11.087 0.808 382 HA ARG 126 HA ARG 126 -6.712 11.813 -0.524 383 HB2 ARG 126 HB2 ARG 126 -3.824 12.582 -0.983 384 HB3 ARG 126 HB1 ARG 126 -5.168 13.277 -1.889 385 HG2 ARG 126 HG2 ARG 126 -6.197 14.046 0.218 386 HG3 ARG 126 HG1 ARG 126 -4.856 13.350 1.127 387 HD2 ARG 126 HD2 ARG 126 -3.280 14.835 -0.050 388 HD3 ARG 126 HD1 ARG 126 -4.612 15.525 -0.971 389 HE ARG 126 HE ARG 126 -5.192 15.782 1.776 390 HH11 ARG 126 HH21 ARG 126 -2.994 16.925 -0.641 391 HH12 ARG 126 HH22 ARG 126 -2.740 18.461 0.120 392 HH21 ARG 126 HH11 ARG 126 -4.863 17.793 2.778 393 HH22 ARG 126 HH12 ARG 126 -3.799 18.952 2.055 394 H GLU 127 HN GLU 127 -4.118 9.634 -1.259 395 HA GLU 127 HA GLU 127 -4.998 9.340 -4.049 396 HB2 GLU 127 HB2 GLU 127 -2.660 8.093 -2.584 397 HB3 GLU 127 HB1 GLU 127 -3.004 7.920 -4.306 398 HG2 GLU 127 HG2 GLU 127 -2.541 10.572 -2.915 399 HG3 GLU 127 HG1 GLU 127 -1.306 9.694 -3.815 400 H ALA 128 HN ALA 128 -5.570 7.993 -1.013 401 HA ALA 128 HA ALA 128 -5.964 5.258 -1.862 402 HB1 ALA 128 HB1 ALA 128 -6.194 4.810 0.352 403 HB2 ALA 128 HB2 ALA 128 -7.240 6.195 0.640 404 HB3 ALA 128 HB3 ALA 128 -5.495 6.408 0.538 405 H ASP 129 HN ASP 129 -8.347 7.485 -0.352 406 HA ASP 129 HA ASP 129 -10.241 7.703 -2.292 407 HB2 ASP 129 HB2 ASP 129 -10.139 4.921 -1.302 408 HB3 ASP 129 HB1 ASP 129 -11.746 5.632 -1.340 409 H ILE 130 HN ILE 130 -11.378 5.924 0.444 410 HA ILE 130 HA ILE 130 -12.788 6.479 2.145 411 HB ILE 130 HB ILE 130 -10.927 8.853 2.374 412 HG12 ILE 130 HG12 ILE 130 -10.850 6.199 3.815 413 HG13 ILE 130 HG11 ILE 130 -9.877 6.535 2.383 414 HG21 ILE 130 HG21 ILE 130 -12.378 9.449 4.009 415 HG22 ILE 130 HG22 ILE 130 -11.836 8.018 4.884 416 HG23 ILE 130 HG23 ILE 130 -13.273 7.933 3.862 417 HD11 ILE 130 HD11 ILE 130 -9.824 8.155 4.945 418 HD12 ILE 130 HD12 ILE 130 -8.822 8.432 3.522 419 HD13 ILE 130 HD13 ILE 130 -8.616 6.961 4.477 420 H ASP 131 HN ASP 131 -13.993 7.137 -0.175 421 HA ASP 131 HA ASP 131 -14.717 9.851 -0.488 422 HB2 ASP 131 HB2 ASP 131 -16.169 7.286 -1.174 423 HB3 ASP 131 HB1 ASP 131 -16.775 8.883 -1.613 424 H GLY 132 HN GLY 132 -16.076 7.205 1.376 425 HA2 GLY 132 HA2 GLY 132 -17.118 8.952 3.403 426 HA3 GLY 132 HA1 GLY 132 -18.397 8.301 2.383 427 H ASP 133 HN ASP 133 -17.666 5.761 1.900 428 HA ASP 133 HA ASP 133 -18.372 4.420 4.250 429 HB2 ASP 133 HB2 ASP 133 -17.168 3.441 1.665 430 HB3 ASP 133 HB1 ASP 133 -17.656 2.350 2.962 431 H GLY 134 HN GLY 134 -15.177 4.949 2.806 432 HA2 GLY 134 HA2 GLY 134 -13.214 5.117 4.153 433 HA3 GLY 134 HA1 GLY 134 -14.010 4.145 5.385 434 H GLN 135 HN GLN 135 -13.761 3.491 1.909 435 HA GLN 135 HA GLN 135 -12.116 1.111 2.528 436 HB2 GLN 135 HB2 GLN 135 -13.265 0.066 0.511 437 HB3 GLN 135 HB1 GLN 135 -14.258 0.241 1.963 438 HG2 GLN 135 HG2 GLN 135 -15.181 2.359 1.044 439 HG3 GLN 135 HG1 GLN 135 -14.225 2.121 -0.419 440 HE21 GLN 135 HE21 GLN 135 -16.785 2.230 -1.081 441 HE22 GLN 135 HE22 GLN 135 -17.492 0.701 -1.281 442 H VAL 136 HN VAL 136 -10.551 0.552 0.999 443 HA VAL 136 HA VAL 136 -10.006 2.588 -1.065 444 HB VAL 136 HB VAL 136 -8.150 1.344 0.946 445 HG11 VAL 136 HG11 VAL 136 -6.382 2.639 -0.430 446 HG12 VAL 136 HG12 VAL 136 -7.556 2.579 -1.744 447 HG13 VAL 136 HG13 VAL 136 -6.917 1.081 -1.057 448 HG21 VAL 136 HG21 VAL 136 -7.741 3.579 1.583 449 HG22 VAL 136 HG22 VAL 136 -9.477 3.535 1.283 450 HG23 VAL 136 HG23 VAL 136 -8.396 4.215 0.073 451 H ASN 137 HN ASN 137 -9.539 1.863 -3.034 452 HA ASN 137 HA ASN 137 -9.480 -1.031 -3.448 453 HB2 ASN 137 HB2 ASN 137 -9.740 -0.470 -5.833 454 HB3 ASN 137 HB1 ASN 137 -10.983 0.309 -4.859 455 HD21 ASN 137 HD21 ASN 137 -10.350 1.393 -7.384 456 HD22 ASN 137 HD22 ASN 137 -9.550 2.874 -7.170 457 H TYR 138 HN TYR 138 -7.497 -1.946 -3.343 458 HA TYR 138 HA TYR 138 -5.075 -0.520 -3.470 459 HB2 TYR 138 HB2 TYR 138 -3.997 -2.751 -3.627 460 HB3 TYR 138 HB1 TYR 138 -5.196 -2.656 -2.338 461 HD1 TYR 138 HD1 TYR 138 -4.601 -3.879 -5.805 462 HD2 TYR 138 HD2 TYR 138 -7.156 -4.004 -2.366 463 HE1 TYR 138 HE1 TYR 138 -5.821 -5.809 -6.778 464 HE2 TYR 138 HE2 TYR 138 -8.374 -5.920 -3.324 465 HH TYR 138 HH TYR 138 -8.442 -6.726 -6.346 466 H GLU 139 HN GLU 139 -7.124 -1.343 -6.039 467 HA GLU 139 HA GLU 139 -5.285 -2.077 -8.034 468 HB2 GLU 139 HB2 GLU 139 -7.753 -2.186 -8.281 469 HB3 GLU 139 HB1 GLU 139 -7.806 -0.428 -8.356 470 HG2 GLU 139 HG2 GLU 139 -6.047 -1.995 -10.238 471 HG3 GLU 139 HG1 GLU 139 -7.757 -1.761 -10.592 472 H GLU 140 HN GLU 140 -6.536 1.192 -7.209 473 HA GLU 140 HA GLU 140 -4.972 2.580 -9.071 474 HB2 GLU 140 HB2 GLU 140 -6.106 3.450 -6.405 475 HB3 GLU 140 HB1 GLU 140 -5.352 4.555 -7.556 476 HG2 GLU 140 HG2 GLU 140 -7.675 2.742 -8.257 477 HG3 GLU 140 HG1 GLU 140 -7.870 4.415 -7.737 478 H PHE 141 HN PHE 141 -4.270 1.639 -5.731 479 HA PHE 141 HA PHE 141 -1.821 3.048 -5.465 480 HB2 PHE 141 HB2 PHE 141 -3.180 0.832 -4.064 481 HB3 PHE 141 HB1 PHE 141 -1.420 0.804 -3.957 482 HD1 PHE 141 HD2 PHE 141 -0.296 3.148 -3.470 483 HD2 PHE 141 HD1 PHE 141 -4.370 2.150 -2.524 484 HE1 PHE 141 HE2 PHE 141 -0.338 4.940 -1.757 485 HE2 PHE 141 HE1 PHE 141 -4.397 3.932 -0.809 486 HZ PHE 141 HZ PHE 141 -2.391 5.334 -0.427 487 H VAL 142 HN VAL 142 -2.529 -0.263 -6.571 488 HA VAL 142 HA VAL 142 0.165 -0.957 -7.077 489 HB VAL 142 HB VAL 142 -2.435 -2.016 -8.196 490 HG11 VAL 142 HG11 VAL 142 0.434 -2.724 -8.774 491 HG12 VAL 142 HG12 VAL 142 -0.933 -2.635 -9.886 492 HG13 VAL 142 HG13 VAL 142 -0.792 -3.992 -8.769 493 HG21 VAL 142 HG21 VAL 142 -2.401 -3.378 -6.384 494 HG22 VAL 142 HG22 VAL 142 -1.195 -2.275 -5.717 495 HG23 VAL 142 HG23 VAL 142 -0.683 -3.725 -6.583 496 H GLN 143 HN GLN 143 -2.363 0.439 -9.187 497 HA GLN 143 HA GLN 143 -0.798 0.471 -11.540 498 HB2 GLN 143 HB2 GLN 143 -3.270 0.874 -11.454 499 HB3 GLN 143 HB1 GLN 143 -2.949 2.444 -10.723 500 HG2 GLN 143 HG2 GLN 143 -3.260 2.741 -13.119 501 HG3 GLN 143 HG1 GLN 143 -1.573 3.046 -12.718 502 HE21 GLN 143 HE21 GLN 143 -3.647 0.251 -13.701 503 HE22 GLN 143 HE22 GLN 143 -2.475 -0.434 -14.722 504 H MET 144 HN MET 144 -1.228 2.757 -8.891 505 HA MET 144 HA MET 144 0.423 4.838 -9.900 506 HB2 MET 144 HB2 MET 144 -0.916 5.573 -8.168 507 HB3 MET 144 HB1 MET 144 -0.771 4.066 -7.277 508 HG2 MET 144 HG2 MET 144 1.230 4.670 -6.299 509 HG3 MET 144 HG1 MET 144 1.650 5.805 -7.584 510 HE1 MET 144 HE1 MET 144 0.575 5.309 -4.163 511 HE2 MET 144 HE2 MET 144 -1.074 5.140 -4.756 512 HE3 MET 144 HE3 MET 144 -0.646 6.522 -3.755 513 H MET 145 HN MET 145 1.069 2.147 -7.651 514 HA MET 145 HA MET 145 3.776 2.693 -7.202 515 HB2 MET 145 HB2 MET 145 2.035 0.896 -6.213 516 HB3 MET 145 HB1 MET 145 2.914 -0.146 -7.324 517 HG2 MET 145 HG2 MET 145 4.137 -0.280 -5.302 518 HG3 MET 145 HG1 MET 145 5.046 0.858 -6.295 519 HE1 MET 145 HE1 MET 145 2.626 1.609 -2.509 520 HE2 MET 145 HE2 MET 145 2.932 0.100 -3.361 521 HE3 MET 145 HE3 MET 145 1.695 1.204 -3.955 522 H THR 146 HN THR 146 2.143 1.196 -9.899 523 HA THR 146 HA THR 146 4.742 0.453 -11.095 524 HB THR 146 HB THR 146 3.438 -1.099 -12.510 525 HG1 THR 146 HG1 THR 146 1.411 -0.586 -12.632 526 HG21 THR 146 HG21 THR 146 2.931 -1.396 -9.537 527 HG22 THR 146 HG22 THR 146 4.405 -1.876 -10.378 528 HG23 THR 146 HG23 THR 146 2.883 -2.700 -10.723 529 H ALA 147 HN ALA 147 3.285 3.134 -11.125 530 HA ALA 147 HA ALA 147 3.271 3.439 -14.068 531 HB1 ALA 147 HB1 ALA 147 0.966 3.597 -13.427 532 HB2 ALA 147 HB2 ALA 147 1.534 5.238 -13.727 533 HB3 ALA 147 HB3 ALA 147 1.355 4.657 -12.072 534 H LYS 148 HN LYS 148 5.594 3.818 -12.782 535 HA LYS 148 HA LYS 148 6.165 6.564 -13.284 536 HB2 LYS 148 HB2 LYS 148 5.420 5.838 -10.582 537 HB3 LYS 148 HB1 LYS 148 7.094 6.384 -10.629 538 HG2 LYS 148 HG2 LYS 148 4.887 7.953 -11.983 539 HG3 LYS 148 HG1 LYS 148 5.277 8.182 -10.281 540 HD2 LYS 148 HD2 LYS 148 7.630 8.668 -10.891 541 HD3 LYS 148 HD1 LYS 148 7.214 8.503 -12.596 542 HE2 LYS 148 HE2 LYS 148 5.585 10.346 -12.378 543 HE3 LYS 148 HE1 LYS 148 6.006 10.513 -10.673 544 HZ1 LYS 148 HZ1 LYS 148 7.716 11.772 -11.239 545 HZ2 LYS 148 HZ2 LYS 148 7.282 11.650 -12.877 546 HZ3 LYS 148 HZ3 LYS 148 8.362 10.530 -12.195 547 H PHE 30 HT1 PHE 30 -8.851 -3.684 12.524 548 HA PHE 30 HA PHE 30 -8.124 -3.830 9.744 549 HB2 PHE 30 HB2 PHE 30 -6.605 -5.213 11.885 550 HB3 PHE 30 HB1 PHE 30 -6.037 -4.091 10.647 551 HD1 PHE 30 HD2 PHE 30 -7.689 -1.734 11.018 552 HD2 PHE 30 HD1 PHE 30 -5.975 -4.341 13.970 553 HE1 PHE 30 HE2 PHE 30 -7.724 0.115 12.670 554 HE2 PHE 30 HE1 PHE 30 -6.012 -2.493 15.623 555 HZ PHE 30 HZ PHE 30 -6.886 -0.265 14.973 556 H ASP 31 HN ASP 31 -8.392 -6.238 12.366 557 HA ASP 31 HA ASP 31 -8.813 -8.494 12.322 558 HB2 ASP 31 HB2 ASP 31 -11.006 -7.545 11.510 559 HB3 ASP 31 HB1 ASP 31 -10.456 -7.865 9.866 560 H ILE 32 HN ILE 32 -6.378 -7.970 11.269 561 HA ILE 32 HA ILE 32 -6.223 -9.819 8.960 562 HB ILE 32 HB ILE 32 -4.423 -8.569 8.028 563 HG12 ILE 32 HG12 ILE 32 -4.472 -6.951 10.596 564 HG13 ILE 32 HG11 ILE 32 -3.178 -8.020 10.044 565 HG21 ILE 32 HG21 ILE 32 -5.957 -6.206 8.901 566 HG22 ILE 32 HG22 ILE 32 -6.927 -7.524 8.238 567 HG23 ILE 32 HG23 ILE 32 -5.635 -6.805 7.274 568 HD11 ILE 32 HD11 ILE 32 -2.399 -5.918 9.393 569 HD12 ILE 32 HD12 ILE 32 -4.006 -5.362 8.921 570 HD13 ILE 32 HD13 ILE 32 -3.152 -6.540 7.927 571 H ASP 33 HN ASP 33 -4.104 -10.960 8.840 572 HA ASP 33 HA ASP 33 -3.419 -11.966 11.460 573 HB2 ASP 33 HB2 ASP 33 -2.457 -12.618 8.671 574 HB3 ASP 33 HB1 ASP 33 -1.792 -13.383 10.113 575 H MET 34 HN MET 34 -2.674 -9.832 12.221 576 HA MET 34 HA MET 34 -0.408 -8.532 11.147 577 HB2 MET 34 HB2 MET 34 -1.514 -8.526 13.967 578 HB3 MET 34 HB1 MET 34 -0.284 -7.415 13.367 579 HG2 MET 34 HG2 MET 34 -1.896 -6.695 11.576 580 HG3 MET 34 HG1 MET 34 -3.115 -7.712 12.338 581 HE1 MET 34 HE1 MET 34 -0.526 -5.204 12.677 582 HE2 MET 34 HE2 MET 34 -0.736 -4.425 14.239 583 HE3 MET 34 HE3 MET 34 -1.589 -3.802 12.829 584 H ASP 35 HN ASP 35 -0.788 -11.054 13.581 585 HA ASP 35 HA ASP 35 1.843 -11.097 14.567 586 HB2 ASP 35 HB2 ASP 35 -0.285 -13.228 14.389 587 HB3 ASP 35 HB1 ASP 35 1.264 -13.490 15.187 588 H ALA 36 HN ALA 36 0.381 -12.758 11.791 589 HA ALA 36 HA ALA 36 2.496 -14.497 11.225 590 HB1 ALA 36 HB1 ALA 36 1.535 -14.733 9.043 591 HB2 ALA 36 HB2 ALA 36 0.690 -13.192 9.195 592 HB3 ALA 36 HB3 ALA 36 0.220 -14.563 10.202 593 HA PRO 37 HA PRO 37 5.684 -11.427 10.120 594 HB2 PRO 37 HB2 PRO 37 6.709 -13.774 8.562 595 HB3 PRO 37 HB1 PRO 37 7.585 -12.665 9.638 596 HG2 PRO 37 HG2 PRO 37 6.960 -15.085 10.456 597 HG3 PRO 37 HG1 PRO 37 6.806 -13.698 11.550 598 HD2 PRO 37 HD2 PRO 37 4.651 -15.224 10.134 599 HD3 PRO 37 HD1 PRO 37 4.648 -14.465 11.743 600 H GLU 38 HN GLU 38 4.150 -13.568 7.742 601 HA GLU 38 HA GLU 38 4.979 -12.360 5.380 602 HB2 GLU 38 HB2 GLU 38 3.045 -13.357 4.345 603 HB3 GLU 38 HB1 GLU 38 3.638 -14.470 5.577 604 HG2 GLU 38 HG2 GLU 38 1.957 -13.411 7.167 605 HG3 GLU 38 HG1 GLU 38 1.264 -12.606 5.762 606 H THR 39 HN THR 39 2.325 -11.447 7.544 607 HA THR 39 HA THR 39 1.218 -9.450 5.871 608 HB THR 39 HB THR 39 1.193 -9.606 8.898 609 HG1 THR 39 HG1 THR 39 -0.182 -10.872 6.857 610 HG21 THR 39 HG21 THR 39 -1.140 -8.400 7.921 611 HG22 THR 39 HG22 THR 39 0.167 -7.666 6.993 612 HG23 THR 39 HG23 THR 39 0.189 -7.594 8.754 613 H GLU 40 HN GLU 40 3.673 -9.328 8.427 614 HA GLU 40 HA GLU 40 4.077 -6.536 8.393 615 HB2 GLU 40 HB2 GLU 40 5.888 -8.831 9.164 616 HB3 GLU 40 HB1 GLU 40 6.325 -7.137 9.388 617 HG2 GLU 40 HG2 GLU 40 4.429 -6.772 10.844 618 HG3 GLU 40 HG1 GLU 40 3.797 -8.381 10.501 619 H ARG 41 HN ARG 41 5.610 -9.176 6.582 620 HA ARG 41 HA ARG 41 7.564 -7.593 5.280 621 HB2 ARG 41 HB2 ARG 41 6.249 -10.204 4.504 622 HB3 ARG 41 HB1 ARG 41 7.590 -9.491 3.612 623 HG2 ARG 41 HG2 ARG 41 7.668 -10.178 6.570 624 HG3 ARG 41 HG1 ARG 41 8.330 -11.198 5.296 625 HD2 ARG 41 HD2 ARG 41 10.242 -10.039 5.801 626 HD3 ARG 41 HD1 ARG 41 9.559 -8.884 4.662 627 HE ARG 41 HE ARG 41 8.605 -8.368 7.297 628 HH11 ARG 41 HH21 ARG 41 11.381 -8.124 5.244 629 HH12 ARG 41 HH22 ARG 41 12.045 -6.757 6.074 630 HH21 ARG 41 HH11 ARG 41 9.469 -6.574 8.388 631 HH22 ARG 41 HH12 ARG 41 10.962 -5.879 7.854 632 H ALA 42 HN ALA 42 4.243 -8.464 4.463 633 HA ALA 42 HA ALA 42 4.185 -7.422 1.847 634 HB1 ALA 42 HB1 ALA 42 2.360 -8.777 2.426 635 HB2 ALA 42 HB2 ALA 42 1.665 -7.156 2.412 636 HB3 ALA 42 HB3 ALA 42 2.086 -7.922 3.943 637 H ALA 43 HN ALA 43 3.562 -5.940 4.994 638 HA ALA 43 HA ALA 43 2.663 -3.434 4.076 639 HB1 ALA 43 HB1 ALA 43 3.436 -4.635 6.592 640 HB2 ALA 43 HB2 ALA 43 2.320 -3.304 6.287 641 HB3 ALA 43 HB3 ALA 43 4.043 -2.984 6.472 642 H VAL 44 HN VAL 44 5.899 -4.692 4.746 643 HA VAL 44 HA VAL 44 7.327 -2.284 4.498 644 HB VAL 44 HB VAL 44 8.137 -5.149 3.980 645 HG11 VAL 44 HG11 VAL 44 10.478 -3.924 4.385 646 HG12 VAL 44 HG12 VAL 44 9.613 -2.570 3.657 647 HG13 VAL 44 HG13 VAL 44 9.790 -4.083 2.768 648 HG21 VAL 44 HG21 VAL 44 9.333 -4.799 6.146 649 HG22 VAL 44 HG22 VAL 44 7.585 -4.626 6.303 650 HG23 VAL 44 HG23 VAL 44 8.612 -3.193 6.251 651 H ALA 45 HN ALA 45 6.478 -4.730 2.045 652 HA ALA 45 HA ALA 45 7.879 -3.561 -0.093 653 HB1 ALA 45 HB1 ALA 45 6.346 -4.846 -1.541 654 HB2 ALA 45 HB2 ALA 45 5.326 -5.183 -0.142 655 HB3 ALA 45 HB3 ALA 45 6.967 -5.825 -0.212 656 H ILE 46 HN ILE 46 4.491 -3.119 0.939 657 HA ILE 46 HA ILE 46 3.860 -1.260 -1.111 658 HB ILE 46 HB ILE 46 2.602 -1.792 1.582 659 HG12 ILE 46 HG12 ILE 46 1.640 -2.426 -1.221 660 HG13 ILE 46 HG11 ILE 46 2.578 -3.560 -0.249 661 HG21 ILE 46 HG21 ILE 46 1.825 0.083 -0.659 662 HG22 ILE 46 HG22 ILE 46 1.976 0.445 1.060 663 HG23 ILE 46 HG23 ILE 46 0.639 -0.549 0.482 664 HD11 ILE 46 HD11 ILE 46 0.372 -2.438 1.276 665 HD12 ILE 46 HD12 ILE 46 0.774 -4.128 0.971 666 HD13 ILE 46 HD13 ILE 46 -0.200 -3.229 -0.192 667 H GLN 47 HN GLN 47 4.825 -0.830 2.284 668 HA GLN 47 HA GLN 47 4.732 2.002 2.269 669 HB2 GLN 47 HB2 GLN 47 6.219 0.025 4.004 670 HB3 GLN 47 HB1 GLN 47 6.222 1.764 4.298 671 HG2 GLN 47 HG2 GLN 47 3.793 1.774 4.515 672 HG3 GLN 47 HG1 GLN 47 3.722 0.062 4.104 673 HE21 GLN 47 HE21 GLN 47 5.378 2.195 6.508 674 HE22 GLN 47 HE22 GLN 47 5.222 1.099 7.793 675 H SER 48 HN SER 48 7.355 -0.302 1.650 676 HA SER 48 HA SER 48 9.451 1.570 1.463 677 HB2 SER 48 HB2 SER 48 9.857 -0.833 1.677 678 HB3 SER 48 HB1 SER 48 9.136 -1.109 0.093 679 HG SER 48 HG SER 48 11.104 -0.794 -0.584 680 H GLN 49 HN GLN 49 7.346 0.174 -1.036 681 HA GLN 49 HA GLN 49 8.543 1.516 -3.219 682 HB2 GLN 49 HB2 GLN 49 5.783 0.337 -2.861 683 HB3 GLN 49 HB1 GLN 49 6.374 1.001 -4.383 684 HG2 GLN 49 HG2 GLN 49 7.772 -1.206 -2.856 685 HG3 GLN 49 HG1 GLN 49 6.664 -1.486 -4.198 686 HE21 GLN 49 HE21 GLN 49 9.867 -1.479 -3.626 687 HE22 GLN 49 HE22 GLN 49 10.447 -0.859 -5.096 688 H PHE 50 HN PHE 50 5.889 2.396 -1.046 689 HA PHE 50 HA PHE 50 4.925 4.618 -2.454 690 HB2 PHE 50 HB2 PHE 50 3.693 3.743 -0.560 691 HB3 PHE 50 HB1 PHE 50 5.022 4.138 0.533 692 HD1 PHE 50 HD1 PHE 50 2.876 5.785 -2.062 693 HD2 PHE 50 HD2 PHE 50 4.908 6.169 1.706 694 HE1 PHE 50 HE1 PHE 50 1.983 8.085 -1.815 695 HE2 PHE 50 HE2 PHE 50 4.016 8.479 1.951 696 HZ PHE 50 HZ PHE 50 2.554 9.430 0.188 697 H ARG 51 HN ARG 51 7.451 4.455 0.054 698 HA ARG 51 HA ARG 51 8.033 7.205 0.112 699 HB2 ARG 51 HB2 ARG 51 8.833 5.628 1.818 700 HB3 ARG 51 HB1 ARG 51 9.883 4.865 0.625 701 HG2 ARG 51 HG2 ARG 51 11.185 6.875 0.371 702 HG3 ARG 51 HG1 ARG 51 10.034 7.806 1.332 703 HD2 ARG 51 HD2 ARG 51 11.996 7.209 2.687 704 HD3 ARG 51 HD1 ARG 51 10.553 6.409 3.302 705 HE ARG 51 HE ARG 51 11.896 4.734 1.434 706 HH11 ARG 51 HH21 ARG 51 12.063 6.010 4.646 707 HH12 ARG 51 HH22 ARG 51 12.950 4.666 5.283 708 HH21 ARG 51 HH11 ARG 51 13.060 2.967 2.262 709 HH22 ARG 51 HH12 ARG 51 13.514 2.943 3.933 710 H LYS 52 HN LYS 52 9.354 4.578 -1.875 711 HA LYS 52 HA LYS 52 11.321 6.091 -3.227 712 HB2 LYS 52 HB2 LYS 52 11.233 3.617 -3.255 713 HB3 LYS 52 HB1 LYS 52 9.766 3.692 -4.230 714 HG2 LYS 52 HG2 LYS 52 10.985 4.864 -6.015 715 HG3 LYS 52 HG1 LYS 52 12.452 4.852 -5.035 716 HD2 LYS 52 HD2 LYS 52 12.413 2.374 -5.030 717 HD3 LYS 52 HD1 LYS 52 10.973 2.405 -6.047 718 HE2 LYS 52 HE2 LYS 52 13.647 3.622 -6.796 719 HE3 LYS 52 HE1 LYS 52 13.047 2.068 -7.377 720 HZ1 LYS 52 HZ1 LYS 52 11.115 4.128 -7.724 721 HZ2 LYS 52 HZ2 LYS 52 11.786 3.076 -8.877 722 HZ3 LYS 52 HZ3 LYS 52 12.572 4.531 -8.492 723 H PHE 53 HN PHE 53 7.904 5.493 -3.881 724 HA PHE 53 HA PHE 53 7.705 6.645 -6.430 725 HB2 PHE 53 HB2 PHE 53 5.914 5.322 -5.308 726 HB3 PHE 53 HB1 PHE 53 5.628 6.682 -4.225 727 HD1 PHE 53 HD2 PHE 53 4.846 8.877 -5.157 728 HD2 PHE 53 HD1 PHE 53 5.068 5.318 -7.557 729 HE1 PHE 53 HE2 PHE 53 3.356 9.919 -6.841 730 HE2 PHE 53 HE1 PHE 53 3.565 6.361 -9.242 731 HZ PHE 53 HZ PHE 53 2.719 8.665 -8.883 732 H GLN 54 HN GLN 54 7.440 8.085 -3.202 733 HA GLN 54 HA GLN 54 6.691 10.679 -3.976 734 HB2 GLN 54 HB2 GLN 54 8.235 9.678 -1.578 735 HB3 GLN 54 HB1 GLN 54 7.694 11.346 -1.759 736 HG2 GLN 54 HG2 GLN 54 5.367 10.605 -1.925 737 HG3 GLN 54 HG1 GLN 54 5.879 8.920 -1.822 738 HE21 GLN 54 HE21 GLN 54 6.320 8.059 0.265 739 HE22 GLN 54 HE22 GLN 54 6.188 8.967 1.693 740 H LYS 55 HN LYS 55 9.901 9.192 -3.621 741 HA LYS 55 HA LYS 55 11.427 11.538 -3.893 742 HB2 LYS 55 HB2 LYS 55 12.031 8.665 -4.606 743 HB3 LYS 55 HB1 LYS 55 13.228 9.956 -4.703 744 HG2 LYS 55 HG2 LYS 55 12.889 10.459 -2.313 745 HG3 LYS 55 HG1 LYS 55 11.686 9.172 -2.211 746 HD2 LYS 55 HD2 LYS 55 13.399 7.518 -2.869 747 HD3 LYS 55 HD1 LYS 55 14.603 8.803 -2.957 748 HE2 LYS 55 HE2 LYS 55 13.037 8.065 -0.466 749 HE3 LYS 55 HE1 LYS 55 14.699 7.578 -0.793 750 HZ1 LYS 55 HZ1 LYS 55 15.193 9.469 0.271 751 HZ2 LYS 55 HZ2 LYS 55 13.653 10.145 0.029 752 HZ3 LYS 55 HZ3 LYS 55 14.820 10.218 -1.204 753 H LYS 56 HN LYS 56 10.194 9.278 -6.356 754 HA LYS 56 HA LYS 56 11.433 10.592 -8.555 755 HB2 LYS 56 HB2 LYS 56 9.065 8.720 -8.385 756 HB3 LYS 56 HB1 LYS 56 9.715 9.334 -9.907 757 HG2 LYS 56 HG2 LYS 56 11.902 8.374 -9.415 758 HG3 LYS 56 HG1 LYS 56 11.352 7.863 -7.822 759 HD2 LYS 56 HD2 LYS 56 11.251 5.916 -9.196 760 HD3 LYS 56 HD1 LYS 56 9.586 6.464 -9.023 761 HE2 LYS 56 HE2 LYS 56 9.610 7.465 -11.218 762 HE3 LYS 56 HE1 LYS 56 11.348 7.210 -11.374 763 HZ1 LYS 56 HZ1 LYS 56 11.073 4.945 -11.620 764 HZ2 LYS 56 HZ2 LYS 56 9.747 5.563 -12.482 765 HZ3 LYS 56 HZ3 LYS 56 9.529 4.936 -10.918 766 H LYS 57 HN LYS 57 8.302 10.905 -6.973 767 HA LYS 57 HA LYS 57 7.077 12.659 -8.806 768 HB2 LYS 57 HB2 LYS 57 5.861 11.486 -6.999 769 HB3 LYS 57 HB1 LYS 57 6.698 12.475 -5.804 770 HG2 LYS 57 HG2 LYS 57 5.703 14.512 -6.776 771 HG3 LYS 57 HG1 LYS 57 4.882 13.534 -7.993 772 HD2 LYS 57 HD2 LYS 57 3.663 12.336 -6.215 773 HD3 LYS 57 HD1 LYS 57 4.484 13.309 -4.995 774 HE2 LYS 57 HE2 LYS 57 3.492 15.355 -5.950 775 HE3 LYS 57 HE1 LYS 57 2.673 14.388 -7.176 776 HZ1 LYS 57 HZ1 LYS 57 1.905 13.133 -4.965 777 HZ2 LYS 57 HZ2 LYS 57 1.027 14.409 -5.664 778 HZ3 LYS 57 HZ3 LYS 57 2.067 14.707 -4.355 779 H ALA 58 HN ALA 58 9.166 13.215 -6.018 780 HA ALA 58 HA ALA 58 8.973 16.010 -5.882 781 HB1 ALA 58 HB1 ALA 58 11.393 14.335 -5.200 782 HB2 ALA 58 HB2 ALA 58 9.986 14.514 -4.151 783 HB3 ALA 58 HB3 ALA 58 10.976 15.920 -4.548 784 H GLY 59 HN GLY 59 11.135 13.940 -7.802 785 HA2 GLY 59 HA2 GLY 59 12.881 15.944 -8.717 786 HA3 GLY 59 HA1 GLY 59 12.540 14.438 -9.565 787 H SER 60 HN SER 60 9.775 14.817 -9.996 788 HA SER 60 HA SER 60 9.828 16.427 -12.347 789 HB2 SER 60 HB2 SER 60 8.358 14.432 -12.048 790 HB3 SER 60 HB1 SER 60 7.418 15.343 -10.870 791 HG SER 60 HG SER 60 7.880 16.654 -13.246 792 H GLN 61 HN GLN 61 9.454 17.156 -9.074 793 HA GLN 61 HA GLN 61 8.878 19.050 -7.915 794 HB2 GLN 61 HB2 GLN 61 9.132 20.371 -10.633 795 HB3 GLN 61 HB1 GLN 61 9.080 21.206 -9.083 796 HG2 GLN 61 HG2 GLN 61 11.191 19.202 -9.919 797 HG3 GLN 61 HG1 GLN 61 11.401 20.947 -9.891 798 HE21 GLN 61 HE21 GLN 61 12.230 18.311 -8.134 799 HE22 GLN 61 HE22 GLN 61 12.215 18.972 -6.571 800 H SER 62 HN SER 62 6.786 17.390 -8.720 801 HA SER 62 HA SER 62 4.520 17.340 -9.214 802 HB2 SER 62 HB2 SER 62 4.709 19.846 -7.528 803 HB3 SER 62 HB1 SER 62 3.243 18.912 -7.814 804 HG SER 62 HG SER 62 5.603 18.158 -6.441 Start of MODEL 20 1 H1 MET 76 HT1 MET 76 4.795 -11.665 -23.730 2 H2 MET 76 HT2 MET 76 4.497 -13.194 -23.053 3 H3 MET 76 HT3 MET 76 4.145 -12.903 -24.690 4 HA MET 76 HA MET 76 6.222 -14.202 -24.287 5 HB2 MET 76 HB2 MET 76 7.508 -12.918 -25.956 6 HB3 MET 76 HB1 MET 76 5.801 -12.984 -26.393 7 HG2 MET 76 HG2 MET 76 5.475 -10.743 -25.357 8 HG3 MET 76 HG1 MET 76 7.205 -10.670 -25.023 9 HE1 MET 76 HE1 MET 76 5.802 -8.493 -26.380 10 HE2 MET 76 HE2 MET 76 6.617 -8.126 -27.899 11 HE3 MET 76 HE3 MET 76 7.567 -8.403 -26.442 12 H LYS 77 HN LYS 77 5.756 -12.557 -21.848 13 HA LYS 77 HA LYS 77 8.559 -12.198 -21.140 14 HB2 LYS 77 HB2 LYS 77 8.192 -9.938 -20.226 15 HB3 LYS 77 HB1 LYS 77 7.941 -9.980 -21.971 16 HG2 LYS 77 HG2 LYS 77 5.496 -10.184 -21.600 17 HG3 LYS 77 HG1 LYS 77 5.766 -10.085 -19.859 18 HD2 LYS 77 HD2 LYS 77 6.694 -7.854 -20.070 19 HD3 LYS 77 HD1 LYS 77 6.627 -7.949 -21.830 20 HE2 LYS 77 HE2 LYS 77 4.722 -6.655 -20.989 21 HE3 LYS 77 HE1 LYS 77 4.157 -8.164 -21.705 22 HZ1 LYS 77 HZ1 LYS 77 3.149 -7.620 -19.518 23 HZ2 LYS 77 HZ2 LYS 77 4.680 -7.808 -18.807 24 HZ3 LYS 77 HZ3 LYS 77 3.923 -9.128 -19.563 25 H ASP 78 HN ASP 78 8.850 -11.892 -18.796 26 HA ASP 78 HA ASP 78 6.546 -12.793 -17.195 27 HB2 ASP 78 HB2 ASP 78 7.914 -14.435 -16.048 28 HB3 ASP 78 HB1 ASP 78 7.959 -14.755 -17.780 29 H THR 79 HN THR 79 8.228 -13.130 -14.854 30 HA THR 79 HA THR 79 9.328 -11.925 -13.203 31 HB THR 79 HB THR 79 9.251 -9.370 -14.736 32 HG1 THR 79 HG1 THR 79 11.271 -11.214 -15.299 33 HG21 THR 79 HG21 THR 79 10.322 -9.905 -12.411 34 HG22 THR 79 HG22 THR 79 11.231 -8.936 -13.571 35 HG23 THR 79 HG23 THR 79 11.602 -10.649 -13.370 36 H ASP 80 HN ASP 80 6.447 -11.210 -14.756 37 HA ASP 80 HA ASP 80 5.139 -9.128 -13.835 38 HB2 ASP 80 HB2 ASP 80 4.228 -11.990 -13.561 39 HB3 ASP 80 HB1 ASP 80 3.165 -10.622 -13.243 40 H SER 81 HN SER 81 6.153 -8.181 -12.063 41 HA SER 81 HA SER 81 6.156 -9.480 -9.476 42 HB2 SER 81 HB2 SER 81 7.218 -7.460 -8.680 43 HB3 SER 81 HB1 SER 81 7.962 -7.913 -10.212 44 HG SER 81 HG SER 81 6.850 -6.315 -11.224 45 H GLU 82 HN GLU 82 3.803 -7.910 -11.268 46 HA GLU 82 HA GLU 82 2.548 -6.239 -9.416 47 HB2 GLU 82 HB2 GLU 82 0.512 -6.595 -10.720 48 HB3 GLU 82 HB1 GLU 82 1.895 -6.408 -11.797 49 HG2 GLU 82 HG2 GLU 82 2.072 -8.899 -11.926 50 HG3 GLU 82 HG1 GLU 82 0.598 -9.020 -10.965 51 H GLU 83 HN GLU 83 2.485 -9.700 -9.799 52 HA GLU 83 HA GLU 83 0.377 -10.241 -7.968 53 HB2 GLU 83 HB2 GLU 83 1.699 -12.518 -7.819 54 HB3 GLU 83 HB1 GLU 83 0.838 -12.079 -9.294 55 HG2 GLU 83 HG2 GLU 83 2.774 -11.570 -10.443 56 HG3 GLU 83 HG1 GLU 83 3.683 -11.184 -8.980 57 H GLU 84 HN GLU 84 3.864 -9.839 -7.614 58 HA GLU 84 HA GLU 84 4.087 -10.710 -4.939 59 HB2 GLU 84 HB2 GLU 84 6.026 -10.350 -6.435 60 HB3 GLU 84 HB1 GLU 84 5.724 -8.615 -6.395 61 HG2 GLU 84 HG2 GLU 84 6.081 -8.579 -3.969 62 HG3 GLU 84 HG1 GLU 84 6.314 -10.326 -3.963 63 H ILE 85 HN ILE 85 3.481 -7.515 -6.351 64 HA ILE 85 HA ILE 85 3.367 -6.109 -3.887 65 HB ILE 85 HB ILE 85 2.207 -5.477 -6.605 66 HG12 ILE 85 HG12 ILE 85 4.667 -5.643 -6.525 67 HG13 ILE 85 HG11 ILE 85 4.153 -3.982 -6.790 68 HG21 ILE 85 HG21 ILE 85 2.347 -3.867 -4.056 69 HG22 ILE 85 HG22 ILE 85 0.949 -4.165 -5.091 70 HG23 ILE 85 HG23 ILE 85 2.240 -3.094 -5.639 71 HD11 ILE 85 HD11 ILE 85 5.721 -3.630 -5.126 72 HD12 ILE 85 HD12 ILE 85 5.458 -5.210 -4.398 73 HD13 ILE 85 HD13 ILE 85 4.312 -3.906 -4.102 74 H ARG 86 HN ARG 86 0.888 -7.589 -5.944 75 HA ARG 86 HA ARG 86 -1.368 -6.739 -4.501 76 HB2 ARG 86 HB2 ARG 86 -0.884 -9.148 -6.249 77 HB3 ARG 86 HB1 ARG 86 -2.455 -8.799 -5.525 78 HG2 ARG 86 HG2 ARG 86 -2.585 -6.672 -6.656 79 HG3 ARG 86 HG1 ARG 86 -0.925 -6.815 -7.229 80 HD2 ARG 86 HD2 ARG 86 -1.526 -8.738 -8.606 81 HD3 ARG 86 HD1 ARG 86 -3.166 -8.719 -7.964 82 HE ARG 86 HE ARG 86 -2.740 -6.201 -9.056 83 HH11 ARG 86 HH21 ARG 86 -2.708 -9.504 -10.087 84 HH12 ARG 86 HH22 ARG 86 -3.207 -9.148 -11.707 85 HH21 ARG 86 HH11 ARG 86 -3.395 -5.725 -11.180 86 HH22 ARG 86 HH12 ARG 86 -3.595 -7.008 -12.326 87 H GLU 87 HN GLU 87 0.798 -9.470 -4.040 88 HA GLU 87 HA GLU 87 -0.696 -10.954 -2.204 89 HB2 GLU 87 HB2 GLU 87 1.488 -11.664 -3.200 90 HB3 GLU 87 HB1 GLU 87 2.302 -10.525 -2.132 91 HG2 GLU 87 HG2 GLU 87 0.421 -12.614 -1.029 92 HG3 GLU 87 HG1 GLU 87 2.108 -12.996 -1.358 93 H ALA 88 HN ALA 88 1.382 -8.141 -1.738 94 HA ALA 88 HA ALA 88 1.324 -8.038 1.065 95 HB1 ALA 88 HB1 ALA 88 2.696 -6.649 -0.679 96 HB2 ALA 88 HB2 ALA 88 2.250 -5.911 0.861 97 HB3 ALA 88 HB3 ALA 88 1.327 -5.540 -0.595 98 H PHE 89 HN PHE 89 -1.008 -6.914 -1.345 99 HA PHE 89 HA PHE 89 -2.617 -5.537 0.645 100 HB2 PHE 89 HB2 PHE 89 -3.061 -6.166 -2.276 101 HB3 PHE 89 HB1 PHE 89 -4.247 -5.330 -1.271 102 HD1 PHE 89 HD2 PHE 89 -3.771 -3.097 -0.342 103 HD2 PHE 89 HD1 PHE 89 -0.971 -5.104 -2.891 104 HE1 PHE 89 HE2 PHE 89 -2.522 -0.975 -0.641 105 HE2 PHE 89 HE1 PHE 89 0.295 -2.990 -3.190 106 HZ PHE 89 HZ PHE 89 -0.493 -0.923 -2.066 107 H ARG 90 HN ARG 90 -2.714 -8.575 -1.168 108 HA ARG 90 HA ARG 90 -5.198 -9.519 -0.473 109 HB2 ARG 90 HB2 ARG 90 -2.609 -11.026 -0.790 110 HB3 ARG 90 HB1 ARG 90 -4.153 -11.838 -0.518 111 HG2 ARG 90 HG2 ARG 90 -5.090 -10.696 -2.511 112 HG3 ARG 90 HG1 ARG 90 -3.527 -9.937 -2.798 113 HD2 ARG 90 HD2 ARG 90 -2.489 -12.163 -3.047 114 HD3 ARG 90 HD1 ARG 90 -4.049 -12.921 -2.754 115 HE ARG 90 HE ARG 90 -4.323 -11.109 -4.895 116 HH11 ARG 90 HH21 ARG 90 -2.764 -14.083 -4.057 117 HH12 ARG 90 HH22 ARG 90 -2.773 -14.704 -5.673 118 HH21 ARG 90 HH11 ARG 90 -4.340 -11.916 -7.017 119 HH22 ARG 90 HH12 ARG 90 -3.666 -13.476 -7.351 120 H VAL 91 HN VAL 91 -2.446 -9.077 1.579 121 HA VAL 91 HA VAL 91 -3.161 -10.797 3.703 122 HB VAL 91 HB VAL 91 -1.588 -8.212 3.645 123 HG11 VAL 91 HG11 VAL 91 -2.092 -8.201 5.893 124 HG12 VAL 91 HG12 VAL 91 -0.828 -9.428 5.947 125 HG13 VAL 91 HG13 VAL 91 -2.522 -9.911 5.909 126 HG21 VAL 91 HG21 VAL 91 0.312 -9.602 3.618 127 HG22 VAL 91 HG22 VAL 91 -0.807 -10.446 2.547 128 HG23 VAL 91 HG23 VAL 91 -0.587 -11.000 4.206 129 H PHE 92 HN PHE 92 -4.081 -7.472 2.904 130 HA PHE 92 HA PHE 92 -5.704 -7.238 5.318 131 HB2 PHE 92 HB2 PHE 92 -5.587 -5.294 3.013 132 HB3 PHE 92 HB1 PHE 92 -6.055 -4.974 4.681 133 HD1 PHE 92 HD2 PHE 92 -4.073 -6.000 6.401 134 HD2 PHE 92 HD1 PHE 92 -3.523 -4.374 2.459 135 HE1 PHE 92 HE2 PHE 92 -1.712 -5.476 6.936 136 HE2 PHE 92 HE1 PHE 92 -1.168 -3.856 3.013 137 HZ PHE 92 HZ PHE 92 -0.262 -4.408 5.244 138 H ASP 93 HN ASP 93 -6.085 -8.031 1.955 139 HA ASP 93 HA ASP 93 -9.011 -7.788 2.111 140 HB2 ASP 93 HB2 ASP 93 -7.899 -7.010 0.039 141 HB3 ASP 93 HB1 ASP 93 -7.278 -8.634 -0.220 142 H LYS 94 HN LYS 94 -9.940 -9.490 3.160 143 HA LYS 94 HA LYS 94 -8.750 -12.172 2.858 144 HB2 LYS 94 HB2 LYS 94 -11.068 -11.348 4.616 145 HB3 LYS 94 HB1 LYS 94 -10.093 -12.814 4.739 146 HG2 LYS 94 HG2 LYS 94 -8.094 -11.378 5.183 147 HG3 LYS 94 HG1 LYS 94 -9.168 -9.977 5.204 148 HD2 LYS 94 HD2 LYS 94 -10.476 -11.046 7.037 149 HD3 LYS 94 HD1 LYS 94 -9.314 -12.373 7.057 150 HE2 LYS 94 HE2 LYS 94 -8.694 -10.801 8.795 151 HE3 LYS 94 HE1 LYS 94 -7.500 -10.693 7.502 152 HZ1 LYS 94 HZ1 LYS 94 -9.431 -8.741 8.399 153 HZ2 LYS 94 HZ2 LYS 94 -9.334 -8.906 6.711 154 HZ3 LYS 94 HZ3 LYS 94 -7.947 -8.517 7.609 155 H ASP 95 HN ASP 95 -11.922 -10.600 2.727 156 HA ASP 95 HA ASP 95 -13.308 -12.799 1.647 157 HB2 ASP 95 HB2 ASP 95 -14.303 -10.762 2.766 158 HB3 ASP 95 HB1 ASP 95 -14.032 -9.894 1.255 159 H GLY 96 HN GLY 96 -11.128 -10.592 0.140 160 HA2 GLY 96 HA2 GLY 96 -10.398 -10.463 -2.037 161 HA3 GLY 96 HA1 GLY 96 -11.251 -11.977 -2.327 162 H ASN 97 HN ASN 97 -12.583 -8.871 -1.259 163 HA ASN 97 HA ASN 97 -14.516 -8.985 -3.454 164 HB2 ASN 97 HB2 ASN 97 -15.644 -7.165 -2.314 165 HB3 ASN 97 HB1 ASN 97 -15.251 -8.414 -1.132 166 HD21 ASN 97 HD21 ASN 97 -15.671 -5.755 -0.255 167 HD22 ASN 97 HD22 ASN 97 -14.191 -5.105 0.263 168 H GLY 98 HN GLY 98 -11.470 -7.855 -2.929 169 HA2 GLY 98 HA2 GLY 98 -10.153 -6.730 -4.542 170 HA3 GLY 98 HA1 GLY 98 -11.624 -6.052 -5.234 171 H TYR 99 HN TYR 99 -11.758 -5.756 -1.894 172 HA TYR 99 HA TYR 99 -10.420 -3.132 -1.894 173 HB2 TYR 99 HB2 TYR 99 -13.176 -3.598 -0.748 174 HB3 TYR 99 HB1 TYR 99 -12.286 -2.077 -0.815 175 HD1 TYR 99 HD1 TYR 99 -13.605 -4.767 -3.026 176 HD2 TYR 99 HD2 TYR 99 -12.615 -0.618 -2.610 177 HE1 TYR 99 HE1 TYR 99 -14.552 -4.329 -5.276 178 HE2 TYR 99 HE2 TYR 99 -13.563 -0.167 -4.864 179 HH TYR 99 HH TYR 99 -13.988 -2.193 -7.121 180 H ILE 100 HN ILE 100 -9.994 -2.287 0.243 181 HA ILE 100 HA ILE 100 -10.042 -4.307 2.395 182 HB ILE 100 HB ILE 100 -7.793 -4.052 2.908 183 HG12 ILE 100 HG12 ILE 100 -8.040 -1.329 1.623 184 HG13 ILE 100 HG11 ILE 100 -7.704 -1.693 3.315 185 HG21 ILE 100 HG21 ILE 100 -8.192 -4.725 0.394 186 HG22 ILE 100 HG22 ILE 100 -6.556 -4.379 0.957 187 HG23 ILE 100 HG23 ILE 100 -7.463 -3.146 0.069 188 HD11 ILE 100 HD11 ILE 100 -5.602 -2.915 2.392 189 HD12 ILE 100 HD12 ILE 100 -5.588 -1.156 2.477 190 HD13 ILE 100 HD13 ILE 100 -5.881 -1.958 0.937 191 H SER 101 HN SER 101 -10.342 -3.353 4.507 192 HA SER 101 HA SER 101 -11.912 -1.031 4.537 193 HB2 SER 101 HB2 SER 101 -12.001 -2.645 6.361 194 HB3 SER 101 HB1 SER 101 -10.321 -2.318 6.773 195 HG SER 101 HG SER 101 -10.920 -0.202 7.291 196 H ALA 102 HN ALA 102 -11.434 1.088 4.624 197 HA ALA 102 HA ALA 102 -8.814 2.003 4.085 198 HB1 ALA 102 HB1 ALA 102 -9.723 4.131 3.971 199 HB2 ALA 102 HB2 ALA 102 -10.932 3.800 5.211 200 HB3 ALA 102 HB3 ALA 102 -11.116 3.119 3.594 201 H ALA 103 HN ALA 103 -10.692 1.800 7.053 202 HA ALA 103 HA ALA 103 -9.122 3.417 8.700 203 HB1 ALA 103 HB1 ALA 103 -10.420 2.653 10.409 204 HB2 ALA 103 HB2 ALA 103 -10.284 0.968 9.904 205 HB3 ALA 103 HB3 ALA 103 -11.398 2.052 9.070 206 H GLU 104 HN GLU 104 -8.707 -0.051 7.934 207 HA GLU 104 HA GLU 104 -6.608 -0.437 9.826 208 HB2 GLU 104 HB2 GLU 104 -6.427 -2.584 8.982 209 HB3 GLU 104 HB1 GLU 104 -8.081 -2.182 8.526 210 HG2 GLU 104 HG2 GLU 104 -7.025 -1.310 6.324 211 HG3 GLU 104 HG1 GLU 104 -5.623 -2.251 6.795 212 H LEU 105 HN LEU 105 -6.746 0.770 6.565 213 HA LEU 105 HA LEU 105 -4.039 0.447 5.825 214 HB2 LEU 105 HB2 LEU 105 -5.922 1.177 4.298 215 HB3 LEU 105 HB1 LEU 105 -5.855 2.752 5.077 216 HG LEU 105 HG LEU 105 -3.399 2.872 4.450 217 HD11 LEU 105 HD11 LEU 105 -3.362 1.171 2.226 218 HD12 LEU 105 HD12 LEU 105 -4.015 0.178 3.526 219 HD13 LEU 105 HD13 LEU 105 -2.457 0.962 3.718 220 HD21 LEU 105 HD21 LEU 105 -4.021 3.093 1.895 221 HD22 LEU 105 HD22 LEU 105 -4.746 4.186 3.074 222 HD23 LEU 105 HD23 LEU 105 -5.661 2.802 2.475 223 H ARG 106 HN ARG 106 -5.748 3.144 7.378 224 HA ARG 106 HA ARG 106 -3.607 4.898 7.684 225 HB2 ARG 106 HB2 ARG 106 -5.960 5.486 8.153 226 HB3 ARG 106 HB1 ARG 106 -5.947 4.427 9.558 227 HG2 ARG 106 HG2 ARG 106 -5.615 6.701 10.321 228 HG3 ARG 106 HG1 ARG 106 -4.102 5.834 10.531 229 HD2 ARG 106 HD2 ARG 106 -3.020 7.170 9.093 230 HD3 ARG 106 HD1 ARG 106 -4.313 7.087 7.898 231 HE ARG 106 HE ARG 106 -5.197 9.056 8.783 232 HH11 ARG 106 HH21 ARG 106 -2.742 7.726 10.829 233 HH12 ARG 106 HH22 ARG 106 -2.655 9.118 11.857 234 HH21 ARG 106 HH11 ARG 106 -5.091 10.877 10.125 235 HH22 ARG 106 HH12 ARG 106 -3.986 10.902 11.458 236 H HIS 107 HN HIS 107 -4.789 2.414 10.001 237 HA HIS 107 HA HIS 107 -2.759 2.809 11.913 238 HB2 HIS 107 HB2 HIS 107 -4.745 1.618 12.520 239 HB3 HIS 107 HB1 HIS 107 -4.488 0.422 11.249 240 HD1 HIS 107 HD1 HIS 107 -2.707 1.695 14.379 241 HD2 HIS 107 HD2 HIS 107 -3.058 -1.770 12.089 242 HE1 HIS 107 HE1 HIS 107 -1.406 -0.103 15.601 243 HE2 HIS 107 HE2 HIS 107 -1.602 -2.222 14.214 244 H VAL 108 HN VAL 108 -3.039 0.529 9.231 245 HA VAL 108 HA VAL 108 -0.688 -0.928 9.665 246 HB VAL 108 HB VAL 108 -2.291 -0.366 7.165 247 HG11 VAL 108 HG11 VAL 108 -0.009 -2.315 7.594 248 HG12 VAL 108 HG12 VAL 108 -0.045 -0.987 6.438 249 HG13 VAL 108 HG13 VAL 108 -1.115 -2.363 6.229 250 HG21 VAL 108 HG21 VAL 108 -3.011 -1.759 9.344 251 HG22 VAL 108 HG22 VAL 108 -2.102 -3.018 8.507 252 HG23 VAL 108 HG23 VAL 108 -3.480 -2.252 7.718 253 H MET 109 HN MET 109 -1.217 2.049 7.808 254 HA MET 109 HA MET 109 1.503 2.082 6.790 255 HB2 MET 109 HB2 MET 109 -0.904 3.821 6.536 256 HB3 MET 109 HB1 MET 109 0.673 4.567 6.267 257 HG2 MET 109 HG2 MET 109 -0.585 3.481 4.247 258 HG3 MET 109 HG1 MET 109 1.152 3.209 4.427 259 HE1 MET 109 HE1 MET 109 1.279 0.286 3.256 260 HE2 MET 109 HE2 MET 109 0.471 1.742 2.682 261 HE3 MET 109 HE3 MET 109 -0.426 0.231 2.795 262 H THR 110 HN THR 110 -0.053 3.109 9.656 263 HA THR 110 HA THR 110 2.198 4.918 10.278 264 HB THR 110 HB THR 110 0.761 5.923 11.947 265 HG1 THR 110 HG1 THR 110 -1.421 4.410 11.121 266 HG21 THR 110 HG21 THR 110 -0.453 5.532 9.230 267 HG22 THR 110 HG22 THR 110 0.496 6.896 9.814 268 HG23 THR 110 HG23 THR 110 -1.142 6.639 10.414 269 H ASN 111 HN ASN 111 0.817 1.858 11.089 270 HA ASN 111 HA ASN 111 2.447 1.757 13.557 271 HB2 ASN 111 HB2 ASN 111 0.011 1.378 13.851 272 HB3 ASN 111 HB1 ASN 111 0.130 -0.023 12.789 273 HD21 ASN 111 HD21 ASN 111 0.721 1.131 16.030 274 HD22 ASN 111 HD22 ASN 111 1.336 -0.328 16.645 275 H LEU 112 HN LEU 112 1.796 0.093 10.505 276 HA LEU 112 HA LEU 112 3.877 -1.894 11.195 277 HB2 LEU 112 HB2 LEU 112 1.766 -1.987 9.040 278 HB3 LEU 112 HB1 LEU 112 2.916 -3.267 9.406 279 HG LEU 112 HG LEU 112 0.846 -2.172 11.338 280 HD11 LEU 112 HD11 LEU 112 -0.596 -3.645 10.436 281 HD12 LEU 112 HD12 LEU 112 0.552 -4.957 10.702 282 HD13 LEU 112 HD13 LEU 112 0.600 -4.034 9.200 283 HD21 LEU 112 HD21 LEU 112 1.585 -4.476 12.441 284 HD22 LEU 112 HD22 LEU 112 2.502 -3.000 12.742 285 HD23 LEU 112 HD23 LEU 112 3.075 -4.168 11.552 286 H GLY 113 HN GLY 113 5.666 -2.149 10.006 287 HA2 GLY 113 HA2 GLY 113 7.383 -1.635 8.571 288 HA3 GLY 113 HA1 GLY 113 6.120 -1.437 7.361 289 H GLU 114 HN GLU 114 8.688 0.087 8.630 290 HA GLU 114 HA GLU 114 9.053 2.362 9.311 291 HB2 GLU 114 HB2 GLU 114 8.533 2.320 6.331 292 HB3 GLU 114 HB1 GLU 114 9.502 3.513 7.196 293 HG2 GLU 114 HG2 GLU 114 11.019 1.711 7.964 294 HG3 GLU 114 HG1 GLU 114 10.064 0.536 7.061 295 H LYS 115 HN LYS 115 7.269 3.019 10.568 296 HA LYS 115 HA LYS 115 4.736 3.663 9.805 297 HB2 LYS 115 HB2 LYS 115 6.478 5.221 11.728 298 HB3 LYS 115 HB1 LYS 115 4.715 5.254 11.680 299 HG2 LYS 115 HG2 LYS 115 4.676 2.809 12.127 300 HG3 LYS 115 HG1 LYS 115 6.434 2.815 12.225 301 HD2 LYS 115 HD2 LYS 115 6.333 4.413 14.102 302 HD3 LYS 115 HD1 LYS 115 4.572 4.402 14.015 303 HE2 LYS 115 HE2 LYS 115 5.307 2.871 15.772 304 HE3 LYS 115 HE1 LYS 115 4.599 1.947 14.447 305 HZ1 LYS 115 HZ1 LYS 115 7.461 2.473 14.310 306 HZ2 LYS 115 HZ2 LYS 115 6.586 1.091 13.852 307 HZ3 LYS 115 HZ3 LYS 115 6.949 1.366 15.488 308 H LEU 116 HN LEU 116 3.731 5.207 8.667 309 HA LEU 116 HA LEU 116 5.363 7.192 7.266 310 HB2 LEU 116 HB2 LEU 116 2.623 6.039 6.901 311 HB3 LEU 116 HB1 LEU 116 2.894 7.682 6.331 312 HG LEU 116 HG LEU 116 3.267 5.989 4.549 313 HD11 LEU 116 HD11 LEU 116 6.029 6.854 4.847 314 HD12 LEU 116 HD12 LEU 116 4.903 8.151 5.232 315 HD13 LEU 116 HD13 LEU 116 4.821 7.353 3.664 316 HD21 LEU 116 HD21 LEU 116 5.686 5.128 6.155 317 HD22 LEU 116 HD22 LEU 116 5.035 4.385 4.694 318 HD23 LEU 116 HD23 LEU 116 4.153 4.257 6.217 319 H THR 117 HN THR 117 4.712 9.500 7.277 320 HA THR 117 HA THR 117 3.809 10.302 9.925 321 HB THR 117 HB THR 117 4.453 12.552 9.216 322 HG1 THR 117 HG1 THR 117 4.415 12.988 7.183 323 HG21 THR 117 HG21 THR 117 6.218 11.019 10.010 324 HG22 THR 117 HG22 THR 117 6.841 12.134 8.793 325 HG23 THR 117 HG23 THR 117 6.476 10.465 8.356 326 H ASP 118 HN ASP 118 2.157 12.075 10.083 327 HA ASP 118 HA ASP 118 -0.275 11.296 8.945 328 HB2 ASP 118 HB2 ASP 118 -0.057 12.686 10.990 329 HB3 ASP 118 HB1 ASP 118 0.481 14.036 9.993 330 H GLU 119 HN GLU 119 2.017 13.809 7.991 331 HA GLU 119 HA GLU 119 0.487 14.922 5.891 332 HB2 GLU 119 HB2 GLU 119 3.484 14.774 6.311 333 HB3 GLU 119 HB1 GLU 119 2.729 15.688 5.010 334 HG2 GLU 119 HG2 GLU 119 2.992 17.309 6.684 335 HG3 GLU 119 HG1 GLU 119 1.324 16.798 6.911 336 H GLU 120 HN GLU 120 2.800 12.233 5.952 337 HA GLU 120 HA GLU 120 2.741 11.781 3.132 338 HB2 GLU 120 HB2 GLU 120 3.597 10.080 5.474 339 HB3 GLU 120 HB1 GLU 120 3.722 9.534 3.803 340 HG2 GLU 120 HG2 GLU 120 5.121 11.480 3.253 341 HG3 GLU 120 HG1 GLU 120 4.963 12.078 4.902 342 H VAL 121 HN VAL 121 1.089 10.303 5.889 343 HA VAL 121 HA VAL 121 -0.345 8.356 4.377 344 HB VAL 121 HB VAL 121 -0.936 9.612 7.080 345 HG11 VAL 121 HG11 VAL 121 -2.986 8.693 6.823 346 HG12 VAL 121 HG12 VAL 121 -2.163 7.139 6.995 347 HG13 VAL 121 HG13 VAL 121 -2.494 7.782 5.394 348 HG21 VAL 121 HG21 VAL 121 -0.275 7.097 7.638 349 HG22 VAL 121 HG22 VAL 121 0.958 8.332 7.467 350 HG23 VAL 121 HG23 VAL 121 0.619 7.231 6.131 351 H ASP 122 HN ASP 122 -1.226 11.655 5.478 352 HA ASP 122 HA ASP 122 -3.884 11.607 4.688 353 HB2 ASP 122 HB2 ASP 122 -1.871 13.865 4.695 354 HB3 ASP 122 HB1 ASP 122 -3.581 14.109 4.342 355 H GLU 123 HN GLU 123 -0.968 12.223 2.803 356 HA GLU 123 HA GLU 123 -2.225 12.951 0.376 357 HB2 GLU 123 HB2 GLU 123 0.185 13.304 0.845 358 HB3 GLU 123 HB1 GLU 123 0.434 11.560 0.796 359 HG2 GLU 123 HG2 GLU 123 1.029 12.530 -1.365 360 HG3 GLU 123 HG1 GLU 123 -0.409 11.534 -1.548 361 H MET 124 HN MET 124 -1.359 9.855 1.825 362 HA MET 124 HA MET 124 -1.927 8.226 -0.451 363 HB2 MET 124 HB2 MET 124 -1.827 7.593 2.512 364 HB3 MET 124 HB1 MET 124 -1.957 6.390 1.235 365 HG2 MET 124 HG2 MET 124 0.167 7.057 0.299 366 HG3 MET 124 HG1 MET 124 0.265 8.427 1.396 367 HE1 MET 124 HE1 MET 124 0.826 4.006 2.247 368 HE2 MET 124 HE2 MET 124 0.201 4.798 0.805 369 HE3 MET 124 HE3 MET 124 -0.835 4.603 2.217 370 H ILE 125 HN ILE 125 -3.768 9.350 2.339 371 HA ILE 125 HA ILE 125 -6.074 7.798 2.051 372 HB ILE 125 HB ILE 125 -5.243 10.169 3.485 373 HG12 ILE 125 HG12 ILE 125 -6.646 9.140 5.253 374 HG13 ILE 125 HG11 ILE 125 -7.198 7.950 4.083 375 HG21 ILE 125 HG21 ILE 125 -7.571 10.932 4.012 376 HG22 ILE 125 HG22 ILE 125 -8.136 9.985 2.641 377 HG23 ILE 125 HG23 ILE 125 -7.030 11.337 2.387 378 HD11 ILE 125 HD11 ILE 125 -4.338 8.064 3.980 379 HD12 ILE 125 HD12 ILE 125 -5.362 6.707 4.444 380 HD13 ILE 125 HD13 ILE 125 -4.835 7.870 5.660 381 H ARG 126 HN ARG 126 -5.197 10.895 0.575 382 HA ARG 126 HA ARG 126 -7.700 11.364 -0.684 383 HB2 ARG 126 HB2 ARG 126 -4.908 12.348 -1.305 384 HB3 ARG 126 HB1 ARG 126 -6.349 12.908 -2.154 385 HG2 ARG 126 HG2 ARG 126 -7.318 13.723 -0.077 386 HG3 ARG 126 HG1 ARG 126 -5.977 13.050 0.851 387 HD2 ARG 126 HD2 ARG 126 -5.624 15.447 0.511 388 HD3 ARG 126 HD1 ARG 126 -4.410 14.532 -0.377 389 HE ARG 126 HE ARG 126 -6.675 15.091 -2.024 390 HH11 ARG 126 HH21 ARG 126 -3.850 16.475 -0.582 391 HH12 ARG 126 HH22 ARG 126 -3.650 17.686 -1.804 392 HH21 ARG 126 HH11 ARG 126 -6.420 16.675 -3.630 393 HH22 ARG 126 HH12 ARG 126 -5.105 17.799 -3.531 394 H GLU 127 HN GLU 127 -4.991 9.361 -1.444 395 HA GLU 127 HA GLU 127 -5.938 8.911 -4.190 396 HB2 GLU 127 HB2 GLU 127 -3.434 8.064 -2.724 397 HB3 GLU 127 HB1 GLU 127 -3.841 7.515 -4.351 398 HG2 GLU 127 HG2 GLU 127 -3.828 9.767 -5.199 399 HG3 GLU 127 HG1 GLU 127 -3.693 10.436 -3.575 400 H ALA 128 HN ALA 128 -6.264 7.647 -1.087 401 HA ALA 128 HA ALA 128 -6.527 4.860 -1.801 402 HB1 ALA 128 HB1 ALA 128 -5.958 6.041 0.514 403 HB2 ALA 128 HB2 ALA 128 -6.758 4.476 0.451 404 HB3 ALA 128 HB3 ALA 128 -7.702 5.934 0.725 405 H ASP 129 HN ASP 129 -8.967 6.908 -0.211 406 HA ASP 129 HA ASP 129 -11.000 6.984 -2.053 407 HB2 ASP 129 HB2 ASP 129 -11.045 4.587 -2.308 408 HB3 ASP 129 HB1 ASP 129 -11.059 4.349 -0.563 409 H ILE 130 HN ILE 130 -12.159 5.261 0.628 410 HA ILE 130 HA ILE 130 -13.384 5.809 2.453 411 HB ILE 130 HB ILE 130 -11.791 8.353 2.695 412 HG12 ILE 130 HG12 ILE 130 -10.574 6.287 4.201 413 HG13 ILE 130 HG11 ILE 130 -10.746 5.663 2.563 414 HG21 ILE 130 HG21 ILE 130 -12.548 8.348 4.839 415 HG22 ILE 130 HG22 ILE 130 -12.356 6.602 5.001 416 HG23 ILE 130 HG23 ILE 130 -13.794 7.262 4.220 417 HD11 ILE 130 HD11 ILE 130 -8.637 6.823 2.672 418 HD12 ILE 130 HD12 ILE 130 -9.395 8.228 3.418 419 HD13 ILE 130 HD13 ILE 130 -9.735 7.834 1.734 420 H ASP 131 HN ASP 131 -13.424 8.984 2.927 421 HA ASP 131 HA ASP 131 -14.772 10.759 2.331 422 HB2 ASP 131 HB2 ASP 131 -15.564 10.952 0.226 423 HB3 ASP 131 HB1 ASP 131 -14.650 9.483 -0.091 424 H GLY 132 HN GLY 132 -15.814 7.547 2.913 425 HA2 GLY 132 HA2 GLY 132 -17.695 8.233 4.865 426 HA3 GLY 132 HA1 GLY 132 -18.577 7.975 3.361 427 H ASP 133 HN ASP 133 -18.045 5.898 2.205 428 HA ASP 133 HA ASP 133 -18.760 3.715 3.663 429 HB2 ASP 133 HB2 ASP 133 -18.600 3.941 1.142 430 HB3 ASP 133 HB1 ASP 133 -16.897 3.523 1.303 431 H GLY 134 HN GLY 134 -15.454 4.894 3.173 432 HA2 GLY 134 HA2 GLY 134 -13.606 4.538 4.523 433 HA3 GLY 134 HA1 GLY 134 -14.601 3.527 5.554 434 H GLN 135 HN GLN 135 -14.255 2.876 2.107 435 HA GLN 135 HA GLN 135 -12.506 0.574 2.771 436 HB2 GLN 135 HB2 GLN 135 -13.615 -0.505 0.708 437 HB3 GLN 135 HB1 GLN 135 -14.537 -0.467 2.216 438 HG2 GLN 135 HG2 GLN 135 -15.714 1.539 1.460 439 HG3 GLN 135 HG1 GLN 135 -14.770 1.561 -0.025 440 HE21 GLN 135 HE21 GLN 135 -16.456 1.109 -1.528 441 HE22 GLN 135 HE22 GLN 135 -17.357 -0.329 -1.505 442 H VAL 136 HN VAL 136 -10.919 0.027 1.235 443 HA VAL 136 HA VAL 136 -10.425 2.089 -0.818 444 HB VAL 136 HB VAL 136 -8.560 0.842 1.179 445 HG11 VAL 136 HG11 VAL 136 -6.831 2.232 -0.209 446 HG12 VAL 136 HG12 VAL 136 -7.993 2.034 -1.521 447 HG13 VAL 136 HG13 VAL 136 -7.271 0.611 -0.758 448 HG21 VAL 136 HG21 VAL 136 -8.109 3.119 1.763 449 HG22 VAL 136 HG22 VAL 136 -9.861 2.975 1.634 450 HG23 VAL 136 HG23 VAL 136 -8.943 3.716 0.326 451 H ASN 137 HN ASN 137 -9.885 1.418 -2.797 452 HA ASN 137 HA ASN 137 -9.814 -1.463 -3.295 453 HB2 ASN 137 HB2 ASN 137 -9.565 -0.262 -5.746 454 HB3 ASN 137 HB1 ASN 137 -11.096 -0.715 -5.004 455 HD21 ASN 137 HD21 ASN 137 -9.305 1.931 -6.217 456 HD22 ASN 137 HD22 ASN 137 -10.276 3.174 -5.588 457 H TYR 138 HN TYR 138 -7.813 -2.321 -3.018 458 HA TYR 138 HA TYR 138 -5.407 -0.861 -3.210 459 HB2 TYR 138 HB2 TYR 138 -4.289 -3.068 -3.159 460 HB3 TYR 138 HB1 TYR 138 -5.522 -2.911 -1.911 461 HD1 TYR 138 HD1 TYR 138 -4.763 -4.394 -5.232 462 HD2 TYR 138 HD2 TYR 138 -7.479 -4.294 -1.912 463 HE1 TYR 138 HE1 TYR 138 -5.895 -6.427 -6.091 464 HE2 TYR 138 HE2 TYR 138 -8.608 -6.322 -2.759 465 HH TYR 138 HH TYR 138 -7.557 -8.400 -4.542 466 H GLU 139 HN GLU 139 -7.406 -2.113 -5.678 467 HA GLU 139 HA GLU 139 -5.507 -2.833 -7.627 468 HB2 GLU 139 HB2 GLU 139 -7.928 -3.253 -7.864 469 HB3 GLU 139 HB1 GLU 139 -8.208 -1.521 -8.033 470 HG2 GLU 139 HG2 GLU 139 -8.145 -2.567 -10.242 471 HG3 GLU 139 HG1 GLU 139 -6.754 -1.507 -10.053 472 H GLU 140 HN GLU 140 -7.076 0.345 -7.056 473 HA GLU 140 HA GLU 140 -5.681 1.741 -9.046 474 HB2 GLU 140 HB2 GLU 140 -7.677 2.620 -7.884 475 HB3 GLU 140 HB1 GLU 140 -6.730 2.797 -6.407 476 HG2 GLU 140 HG2 GLU 140 -5.229 4.381 -7.531 477 HG3 GLU 140 HG1 GLU 140 -6.112 4.167 -9.042 478 H PHE 141 HN PHE 141 -4.887 1.164 -5.652 479 HA PHE 141 HA PHE 141 -2.570 2.790 -5.521 480 HB2 PHE 141 HB2 PHE 141 -3.734 0.605 -3.934 481 HB3 PHE 141 HB1 PHE 141 -1.975 0.657 -3.880 482 HD1 PHE 141 HD2 PHE 141 -1.051 3.214 -3.748 483 HD2 PHE 141 HD1 PHE 141 -4.832 1.821 -2.260 484 HE1 PHE 141 HE2 PHE 141 -1.117 5.106 -2.150 485 HE2 PHE 141 HE1 PHE 141 -4.883 3.702 -0.653 486 HZ PHE 141 HZ PHE 141 -3.036 5.351 -0.600 487 H VAL 142 HN VAL 142 -2.941 -0.664 -6.299 488 HA VAL 142 HA VAL 142 -0.204 -1.119 -6.826 489 HB VAL 142 HB VAL 142 -2.699 -2.520 -7.810 490 HG11 VAL 142 HG11 VAL 142 -0.801 -4.380 -8.092 491 HG12 VAL 142 HG12 VAL 142 0.202 -2.957 -8.370 492 HG13 VAL 142 HG13 VAL 142 -1.198 -3.263 -9.398 493 HG21 VAL 142 HG21 VAL 142 -2.672 -3.335 -5.703 494 HG22 VAL 142 HG22 VAL 142 -1.140 -2.534 -5.346 495 HG23 VAL 142 HG23 VAL 142 -1.153 -4.133 -6.097 496 H GLN 143 HN GLN 143 -2.896 -0.160 -8.971 497 HA GLN 143 HA GLN 143 -1.381 -0.189 -11.362 498 HB2 GLN 143 HB2 GLN 143 -3.880 -0.003 -11.245 499 HB3 GLN 143 HB1 GLN 143 -3.688 1.650 -10.661 500 HG2 GLN 143 HG2 GLN 143 -4.064 1.707 -13.064 501 HG3 GLN 143 HG1 GLN 143 -2.401 2.186 -12.736 502 HE21 GLN 143 HE21 GLN 143 -4.239 -0.859 -13.394 503 HE22 GLN 143 HE22 GLN 143 -3.039 -1.529 -14.392 504 H MET 144 HN MET 144 -1.989 2.275 -8.912 505 HA MET 144 HA MET 144 -0.567 4.404 -10.125 506 HB2 MET 144 HB2 MET 144 -1.927 5.159 -8.428 507 HB3 MET 144 HB1 MET 144 -1.630 3.752 -7.418 508 HG2 MET 144 HG2 MET 144 0.314 4.620 -6.529 509 HG3 MET 144 HG1 MET 144 0.620 5.670 -7.915 510 HE1 MET 144 HE1 MET 144 -1.756 6.481 -4.150 511 HE2 MET 144 HE2 MET 144 -0.434 5.359 -4.451 512 HE3 MET 144 HE3 MET 144 -2.046 4.996 -5.061 513 H MET 145 HN MET 145 0.412 1.951 -7.730 514 HA MET 145 HA MET 145 3.093 2.844 -7.504 515 HB2 MET 145 HB2 MET 145 1.769 0.192 -6.889 516 HB3 MET 145 HB1 MET 145 3.465 0.539 -6.529 517 HG2 MET 145 HG2 MET 145 2.797 2.448 -5.133 518 HG3 MET 145 HG1 MET 145 1.111 2.162 -5.524 519 HE1 MET 145 HE1 MET 145 1.727 1.577 -1.917 520 HE2 MET 145 HE2 MET 145 0.159 1.242 -2.650 521 HE3 MET 145 HE3 MET 145 1.131 2.590 -3.236 522 H THR 146 HN THR 146 1.445 0.846 -9.824 523 HA THR 146 HA THR 146 4.023 0.030 -11.008 524 HB THR 146 HB THR 146 2.687 -1.661 -12.230 525 HG1 THR 146 HG1 THR 146 0.495 -1.883 -11.163 526 HG21 THR 146 HG21 THR 146 2.278 -3.101 -10.318 527 HG22 THR 146 HG22 THR 146 2.189 -1.707 -9.242 528 HG23 THR 146 HG23 THR 146 3.721 -2.137 -10.002 529 H ALA 147 HN ALA 147 2.506 2.677 -11.269 530 HA ALA 147 HA ALA 147 2.527 2.726 -14.222 531 HB1 ALA 147 HB1 ALA 147 0.652 4.374 -14.129 532 HB2 ALA 147 HB2 ALA 147 0.490 4.035 -12.407 533 HB3 ALA 147 HB3 ALA 147 0.192 2.760 -13.590 534 H LYS 148 HN LYS 148 4.795 3.409 -13.439 535 HA LYS 148 HA LYS 148 5.184 6.112 -13.985 536 HB2 LYS 148 HB2 LYS 148 4.445 5.623 -11.235 537 HB3 LYS 148 HB1 LYS 148 6.095 6.231 -11.311 538 HG2 LYS 148 HG2 LYS 148 3.847 7.569 -12.836 539 HG3 LYS 148 HG1 LYS 148 4.209 7.980 -11.164 540 HD2 LYS 148 HD2 LYS 148 6.556 8.482 -11.810 541 HD3 LYS 148 HD1 LYS 148 6.148 8.153 -13.492 542 HE2 LYS 148 HE2 LYS 148 4.463 9.952 -13.443 543 HE3 LYS 148 HE1 LYS 148 4.860 10.280 -11.757 544 HZ1 LYS 148 HZ1 LYS 148 6.253 11.757 -12.700 545 HZ2 LYS 148 HZ2 LYS 148 6.346 10.917 -14.174 546 HZ3 LYS 148 HZ3 LYS 148 7.272 10.408 -12.843 547 H PHE 30 HT1 PHE 30 -8.522 -3.940 12.922 548 HA PHE 30 HA PHE 30 -8.077 -4.437 10.104 549 HB2 PHE 30 HB2 PHE 30 -6.163 -5.256 12.215 550 HB3 PHE 30 HB1 PHE 30 -5.892 -4.299 10.758 551 HD1 PHE 30 HD2 PHE 30 -7.773 -2.109 10.973 552 HD2 PHE 30 HD1 PHE 30 -5.444 -3.990 14.051 553 HE1 PHE 30 HE2 PHE 30 -7.871 -0.027 12.319 554 HE2 PHE 30 HE1 PHE 30 -5.542 -1.910 15.397 555 HZ PHE 30 HZ PHE 30 -6.755 0.072 14.531 556 H ASP 31 HN ASP 31 -7.769 -6.357 13.104 557 HA ASP 31 HA ASP 31 -7.892 -8.618 13.479 558 HB2 ASP 31 HB2 ASP 31 -10.265 -8.034 12.739 559 HB3 ASP 31 HB1 ASP 31 -9.824 -8.684 11.161 560 H ILE 32 HN ILE 32 -5.666 -8.024 12.084 561 HA ILE 32 HA ILE 32 -5.513 -10.163 10.038 562 HB ILE 32 HB ILE 32 -3.918 -8.895 8.813 563 HG12 ILE 32 HG12 ILE 32 -3.887 -7.026 11.202 564 HG13 ILE 32 HG11 ILE 32 -2.548 -8.010 10.601 565 HG21 ILE 32 HG21 ILE 32 -5.610 -6.596 9.598 566 HG22 ILE 32 HG22 ILE 32 -6.469 -8.051 9.088 567 HG23 ILE 32 HG23 ILE 32 -5.310 -7.282 8.001 568 HD11 ILE 32 HD11 ILE 32 -3.718 -5.516 9.446 569 HD12 ILE 32 HD12 ILE 32 -3.027 -6.718 8.357 570 HD13 ILE 32 HD13 ILE 32 -2.026 -5.990 9.613 571 H ASP 33 HN ASP 33 -3.311 -11.122 9.855 572 HA ASP 33 HA ASP 33 -2.365 -11.805 12.490 573 HB2 ASP 33 HB2 ASP 33 -1.523 -12.626 9.709 574 HB3 ASP 33 HB1 ASP 33 -0.697 -13.193 11.159 575 H MET 34 HN MET 34 -1.747 -9.549 13.021 576 HA MET 34 HA MET 34 0.354 -8.210 11.700 577 HB2 MET 34 HB2 MET 34 -0.666 -8.033 14.536 578 HB3 MET 34 HB1 MET 34 0.627 -7.006 13.919 579 HG2 MET 34 HG2 MET 34 -0.874 -6.211 12.119 580 HG3 MET 34 HG1 MET 34 -2.167 -7.219 12.769 581 HE1 MET 34 HE1 MET 34 -1.893 -3.763 12.400 582 HE2 MET 34 HE2 MET 34 -3.190 -3.563 13.577 583 HE3 MET 34 HE3 MET 34 -3.260 -4.888 12.417 584 H ASP 35 HN ASP 35 0.316 -10.575 14.325 585 HA ASP 35 HA ASP 35 3.013 -10.374 15.088 586 HB2 ASP 35 HB2 ASP 35 2.714 -12.629 16.032 587 HB3 ASP 35 HB1 ASP 35 1.359 -11.575 16.429 588 H ALA 36 HN ALA 36 1.485 -12.000 12.385 589 HA ALA 36 HA ALA 36 3.648 -13.707 11.727 590 HB1 ALA 36 HB1 ALA 36 1.458 -12.539 9.994 591 HB2 ALA 36 HB2 ALA 36 1.437 -14.106 10.803 592 HB3 ALA 36 HB3 ALA 36 2.567 -13.811 9.481 593 HA PRO 37 HA PRO 37 6.465 -10.657 10.142 594 HB2 PRO 37 HB2 PRO 37 7.965 -12.169 8.446 595 HB3 PRO 37 HB1 PRO 37 8.128 -12.222 10.213 596 HG2 PRO 37 HG2 PRO 37 6.654 -14.051 8.395 597 HG3 PRO 37 HG1 PRO 37 7.673 -14.431 9.791 598 HD2 PRO 37 HD2 PRO 37 4.962 -14.443 9.941 599 HD3 PRO 37 HD1 PRO 37 5.985 -13.971 11.320 600 H GLU 38 HN GLU 38 4.572 -12.611 7.951 601 HA GLU 38 HA GLU 38 5.186 -11.291 5.529 602 HB2 GLU 38 HB2 GLU 38 2.717 -12.794 6.419 603 HB3 GLU 38 HB1 GLU 38 2.980 -12.228 4.770 604 HG2 GLU 38 HG2 GLU 38 4.927 -14.011 6.252 605 HG3 GLU 38 HG1 GLU 38 3.674 -14.625 5.176 606 H THR 39 HN THR 39 2.664 -10.672 7.981 607 HA THR 39 HA THR 39 1.306 -8.663 6.531 608 HB THR 39 HB THR 39 1.544 -9.003 9.531 609 HG1 THR 39 HG1 THR 39 0.589 -10.659 7.907 610 HG21 THR 39 HG21 THR 39 0.421 -7.045 9.581 611 HG22 THR 39 HG22 THR 39 -0.933 -7.915 8.858 612 HG23 THR 39 HG23 THR 39 0.206 -7.047 7.830 613 H GLU 40 HN GLU 40 3.850 -8.397 9.028 614 HA GLU 40 HA GLU 40 4.044 -5.565 8.904 615 HB2 GLU 40 HB2 GLU 40 4.928 -6.907 10.791 616 HB3 GLU 40 HB1 GLU 40 6.154 -7.583 9.719 617 HG2 GLU 40 HG2 GLU 40 7.081 -5.352 9.320 618 HG3 GLU 40 HG1 GLU 40 5.817 -4.629 10.315 619 H ARG 41 HN ARG 41 5.769 -8.195 7.318 620 HA ARG 41 HA ARG 41 7.635 -6.650 5.893 621 HB2 ARG 41 HB2 ARG 41 7.986 -9.003 6.121 622 HB3 ARG 41 HB1 ARG 41 6.423 -9.367 5.411 623 HG2 ARG 41 HG2 ARG 41 8.291 -9.776 3.832 624 HG3 ARG 41 HG1 ARG 41 7.179 -8.553 3.232 625 HD2 ARG 41 HD2 ARG 41 9.596 -7.943 2.955 626 HD3 ARG 41 HD1 ARG 41 8.685 -6.769 3.892 627 HE ARG 41 HE ARG 41 9.907 -8.739 5.578 628 HH11 ARG 41 HH21 ARG 41 10.485 -5.900 3.684 629 HH12 ARG 41 HH22 ARG 41 11.844 -5.383 4.623 630 HH21 ARG 41 HH11 ARG 41 11.690 -8.063 6.816 631 HH22 ARG 41 HH12 ARG 41 12.526 -6.606 6.396 632 H ALA 42 HN ALA 42 4.381 -7.784 5.098 633 HA ALA 42 HA ALA 42 4.283 -6.919 2.427 634 HB1 ALA 42 HB1 ALA 42 2.535 -8.338 3.046 635 HB2 ALA 42 HB2 ALA 42 1.737 -6.765 2.984 636 HB3 ALA 42 HB3 ALA 42 2.214 -7.452 4.535 637 H ALA 43 HN ALA 43 3.546 -5.250 5.463 638 HA ALA 43 HA ALA 43 2.465 -2.898 4.349 639 HB1 ALA 43 HB1 ALA 43 2.494 -3.646 6.813 640 HB2 ALA 43 HB2 ALA 43 2.737 -1.929 6.492 641 HB3 ALA 43 HB3 ALA 43 4.118 -2.957 6.880 642 H VAL 44 HN VAL 44 5.794 -3.843 5.109 643 HA VAL 44 HA VAL 44 7.025 -1.366 4.596 644 HB VAL 44 HB VAL 44 8.060 -4.197 4.403 645 HG11 VAL 44 HG11 VAL 44 9.354 -1.554 3.852 646 HG12 VAL 44 HG12 VAL 44 9.629 -3.116 3.083 647 HG13 VAL 44 HG13 VAL 44 10.298 -2.792 4.681 648 HG21 VAL 44 HG21 VAL 44 7.372 -3.373 6.644 649 HG22 VAL 44 HG22 VAL 44 8.451 -1.992 6.453 650 HG23 VAL 44 HG23 VAL 44 9.115 -3.623 6.546 651 H ALA 45 HN ALA 45 6.444 -4.146 2.429 652 HA ALA 45 HA ALA 45 7.754 -3.084 0.174 653 HB1 ALA 45 HB1 ALA 45 5.426 -5.007 0.357 654 HB2 ALA 45 HB2 ALA 45 7.137 -5.424 0.263 655 HB3 ALA 45 HB3 ALA 45 6.334 -4.678 -1.119 656 H ILE 46 HN ILE 46 4.367 -2.851 1.211 657 HA ILE 46 HA ILE 46 3.433 -1.416 -1.038 658 HB ILE 46 HB ILE 46 2.439 -1.593 1.812 659 HG12 ILE 46 HG12 ILE 46 1.342 -2.783 -0.749 660 HG13 ILE 46 HG11 ILE 46 2.485 -3.635 0.289 661 HG21 ILE 46 HG21 ILE 46 1.234 -0.272 -0.630 662 HG22 ILE 46 HG22 ILE 46 1.563 0.473 0.935 663 HG23 ILE 46 HG23 ILE 46 0.283 -0.729 0.779 664 HD11 ILE 46 HD11 ILE 46 -0.044 -4.061 0.663 665 HD12 ILE 46 HD12 ILE 46 -0.050 -2.468 1.420 666 HD13 ILE 46 HD13 ILE 46 0.964 -3.753 2.076 667 H GLN 47 HN GLN 47 4.623 -0.364 2.129 668 HA GLN 47 HA GLN 47 4.300 2.421 1.736 669 HB2 GLN 47 HB2 GLN 47 6.135 0.807 3.508 670 HB3 GLN 47 HB1 GLN 47 6.050 2.569 3.558 671 HG2 GLN 47 HG2 GLN 47 3.728 2.522 4.176 672 HG3 GLN 47 HG1 GLN 47 3.624 0.788 3.875 673 HE21 GLN 47 HE21 GLN 47 3.241 2.406 6.449 674 HE22 GLN 47 HE22 GLN 47 4.283 1.662 7.563 675 H SER 48 HN SER 48 6.940 0.179 1.034 676 HA SER 48 HA SER 48 8.907 2.066 0.357 677 HB2 SER 48 HB2 SER 48 8.447 -0.744 -0.667 678 HB3 SER 48 HB1 SER 48 9.896 0.203 -0.993 679 HG SER 48 HG SER 48 8.997 -0.978 1.366 680 H GLN 49 HN GLN 49 6.360 0.531 -1.588 681 HA GLN 49 HA GLN 49 7.130 1.633 -4.080 682 HB2 GLN 49 HB2 GLN 49 4.441 0.732 -3.039 683 HB3 GLN 49 HB1 GLN 49 4.714 1.265 -4.692 684 HG2 GLN 49 HG2 GLN 49 6.420 -0.504 -4.969 685 HG3 GLN 49 HG1 GLN 49 6.080 -1.061 -3.329 686 HE21 GLN 49 HE21 GLN 49 5.201 -1.513 -6.566 687 HE22 GLN 49 HE22 GLN 49 3.714 -2.289 -6.309 688 H PHE 50 HN PHE 50 4.988 2.780 -1.509 689 HA PHE 50 HA PHE 50 3.932 5.004 -2.844 690 HB2 PHE 50 HB2 PHE 50 2.961 4.190 -0.765 691 HB3 PHE 50 HB1 PHE 50 4.432 4.603 0.115 692 HD1 PHE 50 HD1 PHE 50 2.049 6.247 -2.284 693 HD2 PHE 50 HD2 PHE 50 4.398 6.622 1.299 694 HE1 PHE 50 HE1 PHE 50 1.229 8.566 -1.990 695 HE2 PHE 50 HE2 PHE 50 3.583 8.946 1.577 696 HZ PHE 50 HZ PHE 50 1.996 9.916 -0.057 697 H ARG 51 HN ARG 51 6.796 4.782 -0.720 698 HA ARG 51 HA ARG 51 7.489 7.513 -0.894 699 HB2 ARG 51 HB2 ARG 51 9.159 5.054 -0.352 700 HB3 ARG 51 HB1 ARG 51 9.792 6.697 -0.249 701 HG2 ARG 51 HG2 ARG 51 8.161 7.271 1.464 702 HG3 ARG 51 HG1 ARG 51 7.387 5.694 1.300 703 HD2 ARG 51 HD2 ARG 51 10.278 6.083 2.116 704 HD3 ARG 51 HD1 ARG 51 8.957 5.848 3.256 705 HE ARG 51 HE ARG 51 8.821 3.741 1.438 706 HH11 ARG 51 HH21 ARG 51 11.033 5.062 3.749 707 HH12 ARG 51 HH22 ARG 51 11.755 3.536 4.136 708 HH21 ARG 51 HH11 ARG 51 9.763 1.734 1.943 709 HH22 ARG 51 HH12 ARG 51 11.036 1.652 3.115 710 H LYS 52 HN LYS 52 8.413 4.709 -2.862 711 HA LYS 52 HA LYS 52 10.271 6.098 -4.502 712 HB2 LYS 52 HB2 LYS 52 8.712 3.551 -4.909 713 HB3 LYS 52 HB1 LYS 52 9.886 4.148 -6.081 714 HG2 LYS 52 HG2 LYS 52 11.592 4.210 -4.214 715 HG3 LYS 52 HG1 LYS 52 10.414 3.390 -3.192 716 HD2 LYS 52 HD2 LYS 52 11.320 2.288 -5.862 717 HD3 LYS 52 HD1 LYS 52 12.111 1.879 -4.342 718 HE2 LYS 52 HE2 LYS 52 9.873 1.101 -3.476 719 HE3 LYS 52 HE1 LYS 52 9.226 1.337 -5.098 720 HZ1 LYS 52 HZ1 LYS 52 10.064 -0.591 -5.717 721 HZ2 LYS 52 HZ2 LYS 52 10.596 -0.869 -4.128 722 HZ3 LYS 52 HZ3 LYS 52 11.625 -0.120 -5.253 723 H PHE 53 HN PHE 53 6.798 5.468 -4.786 724 HA PHE 53 HA PHE 53 6.433 6.358 -7.424 725 HB2 PHE 53 HB2 PHE 53 4.705 5.156 -6.156 726 HB3 PHE 53 HB1 PHE 53 4.522 6.542 -5.081 727 HD1 PHE 53 HD1 PHE 53 3.966 5.274 -8.505 728 HD2 PHE 53 HD2 PHE 53 3.413 8.576 -5.813 729 HE1 PHE 53 HE1 PHE 53 2.345 6.290 -10.087 730 HE2 PHE 53 HE2 PHE 53 1.798 9.595 -7.396 731 HZ PHE 53 HZ PHE 53 1.268 8.456 -9.533 732 H GLN 54 HN GLN 54 6.131 8.169 -4.355 733 HA GLN 54 HA GLN 54 5.621 10.660 -5.669 734 HB2 GLN 54 HB2 GLN 54 5.888 11.652 -3.445 735 HB3 GLN 54 HB1 GLN 54 4.865 10.219 -3.366 736 HG2 GLN 54 HG2 GLN 54 6.845 8.881 -2.681 737 HG3 GLN 54 HG1 GLN 54 7.813 10.353 -2.669 738 HE21 GLN 54 HE21 GLN 54 7.935 11.352 -0.659 739 HE22 GLN 54 HE22 GLN 54 6.786 11.190 0.580 740 H LYS 55 HN LYS 55 8.488 8.956 -4.633 741 HA LYS 55 HA LYS 55 10.317 11.100 -4.633 742 HB2 LYS 55 HB2 LYS 55 10.851 8.866 -3.727 743 HB3 LYS 55 HB1 LYS 55 10.801 8.207 -5.363 744 HG2 LYS 55 HG2 LYS 55 12.675 9.552 -6.050 745 HG3 LYS 55 HG1 LYS 55 12.630 10.479 -4.552 746 HD2 LYS 55 HD2 LYS 55 14.421 8.907 -4.311 747 HD3 LYS 55 HD1 LYS 55 13.094 8.296 -3.326 748 HE2 LYS 55 HE2 LYS 55 12.483 6.689 -5.031 749 HE3 LYS 55 HE1 LYS 55 13.628 7.394 -6.171 750 HZ1 LYS 55 HZ1 LYS 55 14.568 5.436 -5.182 751 HZ2 LYS 55 HZ2 LYS 55 14.279 6.028 -3.616 752 HZ3 LYS 55 HZ3 LYS 55 15.417 6.792 -4.620 753 H LYS 56 HN LYS 56 9.260 8.900 -7.202 754 HA LYS 56 HA LYS 56 10.965 9.833 -9.229 755 HB2 LYS 56 HB2 LYS 56 9.680 7.742 -9.403 756 HB3 LYS 56 HB1 LYS 56 8.180 8.660 -9.452 757 HG2 LYS 56 HG2 LYS 56 8.849 8.002 -11.719 758 HG3 LYS 56 HG1 LYS 56 8.929 9.752 -11.554 759 HD2 LYS 56 HD2 LYS 56 11.278 9.765 -11.498 760 HD3 LYS 56 HD1 LYS 56 11.370 8.064 -11.034 761 HE2 LYS 56 HE2 LYS 56 10.376 9.078 -13.713 762 HE3 LYS 56 HE1 LYS 56 11.994 8.441 -13.418 763 HZ1 LYS 56 HZ1 LYS 56 11.138 6.453 -13.843 764 HZ2 LYS 56 HZ2 LYS 56 9.544 7.039 -13.819 765 HZ3 LYS 56 HZ3 LYS 56 10.299 6.564 -12.373 766 H LYS 57 HN LYS 57 7.711 10.849 -8.250 767 HA LYS 57 HA LYS 57 7.275 12.742 -10.286 768 HB2 LYS 57 HB2 LYS 57 5.561 11.848 -8.661 769 HB3 LYS 57 HB1 LYS 57 6.263 12.899 -7.437 770 HG2 LYS 57 HG2 LYS 57 4.580 14.278 -8.245 771 HG3 LYS 57 HG1 LYS 57 5.911 14.766 -9.288 772 HD2 LYS 57 HD2 LYS 57 4.231 14.392 -10.856 773 HD3 LYS 57 HD1 LYS 57 5.025 12.821 -10.836 774 HE2 LYS 57 HE2 LYS 57 3.346 11.959 -9.267 775 HE3 LYS 57 HE1 LYS 57 2.578 13.544 -9.195 776 HZ1 LYS 57 HZ1 LYS 57 2.190 13.381 -11.599 777 HZ2 LYS 57 HZ2 LYS 57 1.405 12.148 -10.730 778 HZ3 LYS 57 HZ3 LYS 57 2.831 11.810 -11.590 779 H ALA 58 HN ALA 58 8.758 13.036 -7.076 780 HA ALA 58 HA ALA 58 9.164 15.826 -7.107 781 HB1 ALA 58 HB1 ALA 58 9.996 15.415 -5.065 782 HB2 ALA 58 HB2 ALA 58 11.297 14.434 -5.740 783 HB3 ALA 58 HB3 ALA 58 9.739 13.696 -5.368 784 H GLY 59 HN GLY 59 11.129 13.134 -8.282 785 HA2 GLY 59 HA2 GLY 59 12.544 13.309 -10.194 786 HA3 GLY 59 HA1 GLY 59 12.696 15.036 -9.888 787 H SER 60 HN SER 60 14.787 12.999 -10.281 788 HA SER 60 HA SER 60 16.044 12.447 -7.778 789 HB2 SER 60 HB2 SER 60 17.930 11.715 -9.102 790 HB3 SER 60 HB1 SER 60 16.451 11.161 -9.881 791 HG SER 60 HG SER 60 16.820 12.464 -11.505 792 H GLN 61 HN GLN 61 15.864 15.227 -9.778 793 HA GLN 61 HA GLN 61 18.330 16.463 -9.183 794 HB2 GLN 61 HB2 GLN 61 15.620 17.604 -9.892 795 HB3 GLN 61 HB1 GLN 61 17.068 18.595 -9.715 796 HG2 GLN 61 HG2 GLN 61 16.881 18.078 -12.048 797 HG3 GLN 61 HG1 GLN 61 18.183 17.072 -11.421 798 HE21 GLN 61 HE21 GLN 61 18.011 15.121 -12.559 799 HE22 GLN 61 HE22 GLN 61 16.574 14.235 -12.732 800 H SER 62 HN SER 62 15.212 16.468 -7.511 801 HA SER 62 HA SER 62 14.645 17.054 -5.362 802 HB2 SER 62 HB2 SER 62 16.162 16.557 -3.718 803 HB3 SER 62 HB1 SER 62 16.985 15.787 -5.072 804 HG SER 62 HG SER 62 18.191 17.359 -3.676
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