NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
532153 | 2lbv | 17577 | cing | 1-original | 8 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 HT1 MET 1 6.119 15.414 -17.495 2 H2 MET 1 HT2 MET 1 7.747 15.047 -17.813 3 H3 MET 1 HT3 MET 1 6.564 14.769 -19.000 4 HA MET 1 HA MET 1 7.305 17.439 -17.936 5 HB2 MET 1 HB2 MET 1 8.060 15.990 -20.488 6 HB3 MET 1 HB1 MET 1 8.283 17.722 -20.247 7 HG2 MET 1 HG2 MET 1 9.651 17.208 -18.211 8 HG3 MET 1 HG1 MET 1 9.521 15.495 -18.606 9 HE1 MET 1 HE1 MET 1 12.571 17.167 -18.502 10 HE2 MET 1 HE2 MET 1 11.868 15.571 -18.249 11 HE3 MET 1 HE3 MET 1 13.074 15.819 -19.519 12 H THR 2 HN THR 2 5.420 15.406 -20.116 13 HA THR 2 HA THR 2 3.999 17.610 -21.310 14 HB THR 2 HB THR 2 4.192 15.671 -22.664 15 HG1 THR 2 HG1 THR 2 1.605 15.337 -21.617 16 HG21 THR 2 HG21 THR 2 3.200 14.200 -20.217 17 HG22 THR 2 HG22 THR 2 3.230 13.463 -21.819 18 HG23 THR 2 HG23 THR 2 4.734 13.989 -21.062 19 H VAL 3 HN VAL 3 3.995 16.912 -18.271 20 HA VAL 3 HA VAL 3 1.158 17.545 -17.898 21 HB VAL 3 HB VAL 3 1.107 15.804 -16.009 22 HG11 VAL 3 HG11 VAL 3 0.426 14.029 -17.561 23 HG12 VAL 3 HG12 VAL 3 -0.134 15.594 -18.152 24 HG13 VAL 3 HG13 VAL 3 1.281 14.832 -18.879 25 HG21 VAL 3 HG21 VAL 3 2.631 13.919 -16.243 26 HG22 VAL 3 HG22 VAL 3 3.371 14.649 -17.668 27 HG23 VAL 3 HG23 VAL 3 3.584 15.394 -16.084 28 HA PRO 4 HA PRO 4 4.313 20.017 -15.412 29 HB2 PRO 4 HB2 PRO 4 2.050 21.926 -15.898 30 HB3 PRO 4 HB1 PRO 4 3.801 22.222 -15.935 31 HG2 PRO 4 HG2 PRO 4 2.400 22.001 -18.184 32 HG3 PRO 4 HG1 PRO 4 4.040 21.340 -18.053 33 HD2 PRO 4 HD2 PRO 4 1.426 19.891 -18.085 34 HD3 PRO 4 HD1 PRO 4 3.018 19.357 -18.667 35 H ASP 5 HN ASP 5 0.942 19.205 -15.157 36 HA ASP 5 HA ASP 5 0.302 20.284 -12.652 37 HB2 ASP 5 HB2 ASP 5 -0.658 17.715 -13.932 38 HB3 ASP 5 HB1 ASP 5 -1.414 18.499 -12.547 39 H ARG 6 HN ARG 6 1.899 17.247 -13.525 40 HA ARG 6 HA ARG 6 1.960 16.069 -10.974 41 HB2 ARG 6 HB2 ARG 6 2.518 14.787 -12.948 42 HB3 ARG 6 HB1 ARG 6 3.892 15.835 -13.293 43 HG2 ARG 6 HG2 ARG 6 3.924 14.669 -10.567 44 HG3 ARG 6 HG1 ARG 6 4.040 13.477 -11.858 45 HD2 ARG 6 HD2 ARG 6 5.822 15.911 -11.550 46 HD3 ARG 6 HD1 ARG 6 6.275 14.253 -11.172 47 HE ARG 6 HE ARG 6 5.388 14.314 -13.834 48 HH11 ARG 6 HH21 ARG 6 7.916 15.574 -11.836 49 HH12 ARG 6 HH22 ARG 6 9.084 15.636 -13.113 50 HH21 ARG 6 HH11 ARG 6 6.914 14.392 -15.515 51 HH22 ARG 6 HH12 ARG 6 8.517 14.966 -15.196 52 H SER 7 HN SER 7 4.376 18.113 -12.611 53 HA SER 7 HA SER 7 6.263 18.178 -10.534 54 HB2 SER 7 HB2 SER 7 7.190 20.107 -11.657 55 HB3 SER 7 HB1 SER 7 6.651 18.957 -12.876 56 HG SER 7 HG SER 7 4.737 20.186 -13.069 57 H GLU 8 HN GLU 8 3.318 19.974 -11.060 58 HA GLU 8 HA GLU 8 3.772 22.053 -9.187 59 HB2 GLU 8 HB2 GLU 8 2.022 22.018 -11.010 60 HB3 GLU 8 HB1 GLU 8 1.087 20.930 -9.985 61 HG2 GLU 8 HG2 GLU 8 0.295 23.155 -9.541 62 HG3 GLU 8 HG1 GLU 8 1.261 22.667 -8.150 63 H ILE 9 HN ILE 9 2.052 18.935 -8.891 64 HA ILE 9 HA ILE 9 1.607 19.408 -6.052 65 HB ILE 9 HB ILE 9 -0.015 18.270 -7.683 66 HG12 ILE 9 HG12 ILE 9 0.203 18.167 -4.964 67 HG13 ILE 9 HG11 ILE 9 -1.125 17.457 -5.847 68 HG21 ILE 9 HG21 ILE 9 1.866 15.963 -7.190 69 HG22 ILE 9 HG22 ILE 9 0.256 15.813 -7.881 70 HG23 ILE 9 HG23 ILE 9 1.500 16.721 -8.735 71 HD11 ILE 9 HD11 ILE 9 -0.015 15.290 -5.819 72 HD12 ILE 9 HD12 ILE 9 1.400 16.023 -5.054 73 HD13 ILE 9 HD13 ILE 9 -0.120 15.919 -4.178 74 H ALA 10 HN ALA 10 3.755 17.618 -8.100 75 HA ALA 10 HA ALA 10 4.693 15.785 -6.161 76 HB1 ALA 10 HB1 ALA 10 6.835 15.802 -7.600 77 HB2 ALA 10 HB2 ALA 10 5.925 16.861 -8.674 78 HB3 ALA 10 HB3 ALA 10 5.342 15.232 -8.343 79 H GLY 11 HN GLY 11 6.364 15.911 -4.629 80 HA2 GLY 11 HA2 GLY 11 8.258 17.180 -3.752 81 HA3 GLY 11 HA1 GLY 11 7.360 18.650 -4.130 82 H LYS 12 HN LYS 12 4.790 17.418 -3.337 83 HA LYS 12 HA LYS 12 4.991 16.752 -0.537 84 HB2 LYS 12 HB2 LYS 12 5.386 19.166 -0.434 85 HB3 LYS 12 HB1 LYS 12 3.906 19.456 -1.346 86 HG2 LYS 12 HG2 LYS 12 2.549 18.544 0.436 87 HG3 LYS 12 HG1 LYS 12 3.981 18.002 1.310 88 HD2 LYS 12 HD2 LYS 12 3.078 20.115 2.253 89 HD3 LYS 12 HD1 LYS 12 4.707 20.325 1.617 90 HE2 LYS 12 HE2 LYS 12 2.882 22.090 1.005 91 HE3 LYS 12 HE1 LYS 12 3.956 21.508 -0.266 92 HZ1 LYS 12 HZ1 LYS 12 1.191 20.594 0.304 93 HZ2 LYS 12 HZ2 LYS 12 1.735 21.428 -1.074 94 HZ3 LYS 12 HZ3 LYS 12 2.230 19.829 -0.801 95 H TRP 13 HN TRP 13 3.455 15.121 -0.513 96 HA TRP 13 HA TRP 13 0.797 15.688 -1.715 97 HB2 TRP 13 HB2 TRP 13 2.335 13.095 -1.369 98 HB3 TRP 13 HB1 TRP 13 0.640 13.125 -1.814 99 HD1 TRP 13 HD1 TRP 13 3.812 14.910 -3.087 100 HE1 TRP 13 HE1 TRP 13 3.755 14.730 -5.657 101 HE3 TRP 13 HE3 TRP 13 -0.627 12.469 -3.773 102 HZ2 TRP 13 HZ2 TRP 13 2.166 13.725 -7.667 103 HZ3 TRP 13 HZ3 TRP 13 -1.401 11.930 -6.070 104 HH2 TRP 13 HH2 TRP 13 -0.016 12.566 -8.032 105 H TYR 14 HN TYR 14 -0.836 15.780 -0.198 106 HA TYR 14 HA TYR 14 -0.197 14.894 2.546 107 HB2 TYR 14 HB2 TYR 14 -1.835 17.027 1.301 108 HB3 TYR 14 HB1 TYR 14 -2.499 16.318 2.763 109 HD1 TYR 14 HD2 TYR 14 1.126 16.729 1.990 110 HD2 TYR 14 HD1 TYR 14 -2.249 18.130 4.238 111 HE1 TYR 14 HE2 TYR 14 2.622 18.145 3.363 112 HE2 TYR 14 HE1 TYR 14 -0.759 19.541 5.616 113 HH TYR 14 HH TYR 14 1.625 19.606 6.268 114 H VAL 15 HN VAL 15 -1.327 13.350 3.577 115 HA VAL 15 HA VAL 15 -3.679 12.143 2.228 116 HB VAL 15 HB VAL 15 -1.530 11.029 4.038 117 HG11 VAL 15 HG11 VAL 15 -4.345 9.996 3.655 118 HG12 VAL 15 HG12 VAL 15 -3.015 8.933 4.114 119 HG13 VAL 15 HG13 VAL 15 -3.482 10.266 5.170 120 HG21 VAL 15 HG21 VAL 15 -1.523 9.239 2.320 121 HG22 VAL 15 HG22 VAL 15 -2.829 10.070 1.476 122 HG23 VAL 15 HG23 VAL 15 -1.241 10.826 1.606 123 H VAL 16 HN VAL 16 -5.597 12.744 3.199 124 HA VAL 16 HA VAL 16 -5.507 13.306 6.110 125 HB VAL 16 HB VAL 16 -6.711 15.268 5.891 126 HG11 VAL 16 HG11 VAL 16 -5.042 15.313 3.378 127 HG12 VAL 16 HG12 VAL 16 -5.280 16.603 4.549 128 HG13 VAL 16 HG13 VAL 16 -4.304 15.202 4.963 129 HG21 VAL 16 HG21 VAL 16 -7.363 14.284 3.102 130 HG22 VAL 16 HG22 VAL 16 -8.485 14.690 4.401 131 HG23 VAL 16 HG23 VAL 16 -7.599 15.968 3.570 132 H ALA 17 HN ALA 17 -6.709 11.110 4.155 133 HA ALA 17 HA ALA 17 -8.710 10.387 5.997 134 HB1 ALA 17 HB1 ALA 17 -9.585 12.278 3.986 135 HB2 ALA 17 HB2 ALA 17 -10.487 11.625 5.344 136 HB3 ALA 17 HB3 ALA 17 -10.465 10.764 3.816 137 H LEU 18 HN LEU 18 -9.064 8.227 5.797 138 HA LEU 18 HA LEU 18 -8.494 7.006 3.184 139 HB2 LEU 18 HB2 LEU 18 -7.608 5.075 4.697 140 HB3 LEU 18 HB1 LEU 18 -6.576 6.463 4.371 141 HG LEU 18 HG LEU 18 -6.659 5.758 6.782 142 HD11 LEU 18 HD11 LEU 18 -6.578 8.324 5.713 143 HD12 LEU 18 HD12 LEU 18 -7.778 8.457 6.996 144 HD13 LEU 18 HD13 LEU 18 -6.156 7.875 7.361 145 HD21 LEU 18 HD21 LEU 18 -9.430 6.961 6.808 146 HD22 LEU 18 HD22 LEU 18 -9.160 5.227 6.665 147 HD23 LEU 18 HD23 LEU 18 -8.618 6.090 8.097 148 H ALA 19 HN ALA 19 -9.156 4.687 3.167 149 HA ALA 19 HA ALA 19 -11.624 4.145 4.654 150 HB1 ALA 19 HB1 ALA 19 -13.013 4.049 2.830 151 HB2 ALA 19 HB2 ALA 19 -11.727 3.544 1.739 152 HB3 ALA 19 HB3 ALA 19 -11.880 5.239 2.200 153 H SER 20 HN SER 20 -11.902 1.989 5.079 154 HA SER 20 HA SER 20 -10.558 -0.077 3.609 155 HB2 SER 20 HB2 SER 20 -8.559 0.444 4.671 156 HB3 SER 20 HB1 SER 20 -9.360 0.975 6.145 157 HG SER 20 HG SER 20 -8.290 -1.333 5.741 158 H ASN 21 HN ASN 21 -10.568 -2.160 5.039 159 HA ASN 21 HA ASN 21 -13.032 -2.254 6.661 160 HB2 ASN 21 HB2 ASN 21 -12.324 -4.359 4.633 161 HB3 ASN 21 HB1 ASN 21 -13.831 -4.180 5.522 162 HD21 ASN 21 HD21 ASN 21 -14.465 -1.504 5.177 163 HD22 ASN 21 HD22 ASN 21 -14.648 -1.150 3.527 164 H THR 22 HN THR 22 -9.765 -3.144 6.148 165 HA THR 22 HA THR 22 -9.799 -5.460 7.881 166 HB THR 22 HB THR 22 -8.084 -5.097 6.068 167 HG1 THR 22 HG1 THR 22 -7.223 -6.527 7.319 168 HG21 THR 22 HG21 THR 22 -6.469 -3.463 6.217 169 HG22 THR 22 HG22 THR 22 -7.811 -2.599 6.956 170 HG23 THR 22 HG23 THR 22 -6.583 -3.355 7.972 171 H GLU 23 HN GLU 23 -10.236 -5.221 9.956 172 HA GLU 23 HA GLU 23 -10.338 -2.844 11.331 173 HB2 GLU 23 HB2 GLU 23 -9.957 -5.635 12.401 174 HB3 GLU 23 HB1 GLU 23 -10.364 -4.240 13.400 175 HG2 GLU 23 HG2 GLU 23 -12.006 -5.126 11.015 176 HG3 GLU 23 HG1 GLU 23 -12.356 -5.608 12.674 177 H PHE 24 HN PHE 24 -7.599 -5.081 11.210 178 HA PHE 24 HA PHE 24 -6.073 -3.994 13.224 179 HB2 PHE 24 HB2 PHE 24 -4.619 -4.610 10.698 180 HB3 PHE 24 HB1 PHE 24 -4.319 -5.182 12.338 181 HD1 PHE 24 HD1 PHE 24 -6.971 -6.247 13.099 182 HD2 PHE 24 HD2 PHE 24 -4.815 -6.563 9.398 183 HE1 PHE 24 HE1 PHE 24 -8.178 -8.348 12.574 184 HE2 PHE 24 HE2 PHE 24 -6.021 -8.664 8.873 185 HZ PHE 24 HZ PHE 24 -7.703 -9.558 10.462 186 H PHE 25 HN PHE 25 -6.019 -2.948 9.796 187 HA PHE 25 HA PHE 25 -4.376 -0.664 10.409 188 HB2 PHE 25 HB2 PHE 25 -5.897 -1.162 7.854 189 HB3 PHE 25 HB1 PHE 25 -4.449 -0.190 8.079 190 HD1 PHE 25 HD2 PHE 25 -3.409 -2.594 10.157 191 HD2 PHE 25 HD1 PHE 25 -4.572 -2.301 6.019 192 HE1 PHE 25 HE2 PHE 25 -2.052 -4.578 9.631 193 HE2 PHE 25 HE1 PHE 25 -3.204 -4.304 5.512 194 HZ PHE 25 HZ PHE 25 -1.945 -5.439 7.314 195 H LEU 26 HN LEU 26 -7.785 -1.121 9.613 196 HA LEU 26 HA LEU 26 -8.530 1.606 9.506 197 HB2 LEU 26 HB2 LEU 26 -9.975 -0.150 8.672 198 HB3 LEU 26 HB1 LEU 26 -10.062 -0.888 10.262 199 HG LEU 26 HG LEU 26 -11.252 1.061 11.136 200 HD11 LEU 26 HD11 LEU 26 -10.685 2.133 8.369 201 HD12 LEU 26 HD12 LEU 26 -12.050 2.734 9.307 202 HD13 LEU 26 HD13 LEU 26 -10.411 2.910 9.928 203 HD21 LEU 26 HD21 LEU 26 -12.486 0.212 8.500 204 HD22 LEU 26 HD22 LEU 26 -12.426 -0.841 9.911 205 HD23 LEU 26 HD23 LEU 26 -13.329 0.672 9.981 206 H ARG 27 HN ARG 27 -8.177 -0.689 12.019 207 HA ARG 27 HA ARG 27 -9.292 0.729 14.213 208 HB2 ARG 27 HB2 ARG 27 -8.734 -1.595 14.544 209 HB3 ARG 27 HB1 ARG 27 -7.032 -1.290 14.183 210 HG2 ARG 27 HG2 ARG 27 -6.742 -0.022 16.191 211 HG3 ARG 27 HG1 ARG 27 -8.482 0.056 16.472 212 HD2 ARG 27 HD2 ARG 27 -8.535 -2.397 16.780 213 HD3 ARG 27 HD1 ARG 27 -6.795 -2.463 16.519 214 HE ARG 27 HE ARG 27 -6.490 -1.664 18.685 215 HH11 ARG 27 HH21 ARG 27 -9.758 -1.239 17.631 216 HH12 ARG 27 HH22 ARG 27 -10.342 -0.751 19.187 217 HH21 ARG 27 HH11 ARG 27 -7.248 -1.026 20.728 218 HH22 ARG 27 HH12 ARG 27 -8.921 -0.631 20.940 219 H GLU 28 HN GLU 28 -5.987 0.654 12.907 220 HA GLU 28 HA GLU 28 -5.068 2.644 14.791 221 HB2 GLU 28 HB2 GLU 28 -3.745 1.348 12.409 222 HB3 GLU 28 HB1 GLU 28 -2.940 2.472 13.506 223 HG2 GLU 28 HG2 GLU 28 -3.502 0.968 15.410 224 HG3 GLU 28 HG1 GLU 28 -4.202 -0.177 14.268 225 H LYS 29 HN LYS 29 -5.807 2.751 11.211 226 HA LYS 29 HA LYS 29 -4.718 5.210 10.715 227 HB2 LYS 29 HB2 LYS 29 -7.178 3.850 9.642 228 HB3 LYS 29 HB1 LYS 29 -6.680 5.435 9.065 229 HG2 LYS 29 HG2 LYS 29 -4.939 4.589 7.852 230 HG3 LYS 29 HG1 LYS 29 -4.429 3.537 9.164 231 HD2 LYS 29 HD2 LYS 29 -5.043 1.998 7.522 232 HD3 LYS 29 HD1 LYS 29 -6.510 2.091 8.483 233 HE2 LYS 29 HE2 LYS 29 -7.513 3.633 6.900 234 HE3 LYS 29 HE1 LYS 29 -6.009 3.719 5.980 235 HZ1 LYS 29 HZ1 LYS 29 -6.203 1.454 5.379 236 HZ2 LYS 29 HZ2 LYS 29 -7.506 1.204 6.441 237 HZ3 LYS 29 HZ3 LYS 29 -7.710 2.175 5.064 238 H ASP 30 HN ASP 30 -7.616 4.400 12.444 239 HA ASP 30 HA ASP 30 -8.805 6.944 12.517 240 HB2 ASP 30 HB2 ASP 30 -8.933 4.695 14.534 241 HB3 ASP 30 HB1 ASP 30 -10.016 6.086 14.494 242 H LYS 31 HN LYS 31 -6.035 5.692 14.321 243 HA LYS 31 HA LYS 31 -6.277 7.905 16.210 244 HB2 LYS 31 HB2 LYS 31 -4.707 6.846 17.621 245 HB3 LYS 31 HB1 LYS 31 -5.818 5.607 17.056 246 HG2 LYS 31 HG2 LYS 31 -3.756 4.560 16.787 247 HG3 LYS 31 HG1 LYS 31 -4.048 5.209 15.193 248 HD2 LYS 31 HD2 LYS 31 -2.705 7.273 16.637 249 HD3 LYS 31 HD1 LYS 31 -1.862 5.780 17.008 250 HE2 LYS 31 HE2 LYS 31 -2.556 6.322 14.137 251 HE3 LYS 31 HE1 LYS 31 -1.210 7.193 14.856 252 HZ1 LYS 31 HZ1 LYS 31 -0.035 5.380 14.388 253 HZ2 LYS 31 HZ2 LYS 31 -0.817 4.661 15.715 254 HZ3 LYS 31 HZ3 LYS 31 -1.416 4.420 14.146 255 H MET 32 HN MET 32 -4.388 7.260 13.350 256 HA MET 32 HA MET 32 -2.244 8.995 14.211 257 HB2 MET 32 HB2 MET 32 -1.687 9.000 11.672 258 HB3 MET 32 HB1 MET 32 -1.460 7.521 12.582 259 HG2 MET 32 HG2 MET 32 -3.982 7.081 11.800 260 HG3 MET 32 HG1 MET 32 -3.514 8.173 10.513 261 HE1 MET 32 HE1 MET 32 -3.122 5.095 12.396 262 HE2 MET 32 HE2 MET 32 -2.138 3.985 11.466 263 HE3 MET 32 HE3 MET 32 -1.375 5.225 12.464 264 H LYS 33 HN LYS 33 -1.609 10.773 12.647 265 HA LYS 33 HA LYS 33 -3.881 12.643 12.368 266 HB2 LYS 33 HB2 LYS 33 -0.992 13.458 12.602 267 HB3 LYS 33 HB1 LYS 33 -2.439 14.414 12.918 268 HG2 LYS 33 HG2 LYS 33 -1.510 12.038 14.561 269 HG3 LYS 33 HG1 LYS 33 -1.349 13.731 15.025 270 HD2 LYS 33 HD2 LYS 33 -3.902 13.879 14.724 271 HD3 LYS 33 HD1 LYS 33 -3.884 12.117 14.712 272 HE2 LYS 33 HE2 LYS 33 -2.741 13.849 16.923 273 HE3 LYS 33 HE1 LYS 33 -4.298 13.021 16.988 274 HZ1 LYS 33 HZ1 LYS 33 -2.808 11.594 18.048 275 HZ2 LYS 33 HZ2 LYS 33 -2.973 10.933 16.493 276 HZ3 LYS 33 HZ3 LYS 33 -1.592 11.834 16.887 277 H MET 34 HN MET 34 -3.213 14.435 10.555 278 HA MET 34 HA MET 34 -3.196 13.261 8.098 279 HB2 MET 34 HB2 MET 34 -3.862 15.511 8.479 280 HB3 MET 34 HB1 MET 34 -2.312 15.939 9.175 281 HG2 MET 34 HG2 MET 34 -1.218 15.677 7.011 282 HG3 MET 34 HG1 MET 34 -2.730 15.159 6.286 283 HE1 MET 34 HE1 MET 34 -4.865 16.403 6.782 284 HE2 MET 34 HE2 MET 34 -4.814 17.706 7.951 285 HE3 MET 34 HE3 MET 34 -5.012 18.068 6.239 286 H ALA 35 HN ALA 35 -1.601 12.758 6.599 287 HA ALA 35 HA ALA 35 1.210 12.781 7.543 288 HB1 ALA 35 HB1 ALA 35 1.391 10.796 5.880 289 HB2 ALA 35 HB2 ALA 35 -0.367 10.740 6.003 290 HB3 ALA 35 HB3 ALA 35 0.623 10.520 7.442 291 H MET 36 HN MET 36 2.840 12.754 5.771 292 HA MET 36 HA MET 36 1.953 14.272 3.392 293 HB2 MET 36 HB2 MET 36 4.583 15.131 4.035 294 HB3 MET 36 HB1 MET 36 3.101 16.072 4.105 295 HG2 MET 36 HG2 MET 36 3.981 14.272 6.370 296 HG3 MET 36 HG1 MET 36 4.446 15.967 6.262 297 HE1 MET 36 HE1 MET 36 1.847 16.180 9.027 298 HE2 MET 36 HE2 MET 36 3.292 15.225 8.707 299 HE3 MET 36 HE3 MET 36 3.282 16.961 8.368 300 H ALA 37 HN ALA 37 3.486 14.208 1.600 301 HA ALA 37 HA ALA 37 5.549 12.174 1.600 302 HB1 ALA 37 HB1 ALA 37 2.874 11.697 0.348 303 HB2 ALA 37 HB2 ALA 37 3.895 10.594 1.262 304 HB3 ALA 37 HB3 ALA 37 4.314 11.008 -0.402 305 H ARG 38 HN ARG 38 6.663 11.981 -0.488 306 HA ARG 38 HA ARG 38 6.303 14.323 -2.284 307 HB2 ARG 38 HB2 ARG 38 8.183 14.927 -0.939 308 HB3 ARG 38 HB1 ARG 38 8.850 13.297 -1.013 309 HG2 ARG 38 HG2 ARG 38 9.531 13.536 -3.253 310 HG3 ARG 38 HG1 ARG 38 8.441 14.891 -3.539 311 HD2 ARG 38 HD2 ARG 38 10.736 15.712 -3.354 312 HD3 ARG 38 HD1 ARG 38 9.792 16.276 -1.978 313 HE ARG 38 HE ARG 38 10.922 13.934 -1.104 314 HH11 ARG 38 HH21 ARG 38 12.063 16.875 -2.527 315 HH12 ARG 38 HH22 ARG 38 13.598 16.830 -1.728 316 HH21 ARG 38 HH11 ARG 38 12.935 13.867 -0.051 317 HH22 ARG 38 HH12 ARG 38 14.092 15.126 -0.325 318 H ILE 39 HN ILE 39 6.287 13.730 -4.525 319 HA ILE 39 HA ILE 39 7.154 11.027 -5.172 320 HB ILE 39 HB ILE 39 4.730 11.421 -5.030 321 HG12 ILE 39 HG12 ILE 39 5.575 10.857 -7.870 322 HG13 ILE 39 HG11 ILE 39 5.742 9.673 -6.576 323 HG21 ILE 39 HG21 ILE 39 4.856 13.682 -5.823 324 HG22 ILE 39 HG22 ILE 39 5.182 13.078 -7.439 325 HG23 ILE 39 HG23 ILE 39 3.682 12.681 -6.645 326 HD11 ILE 39 HD11 ILE 39 3.493 9.274 -6.492 327 HD12 ILE 39 HD12 ILE 39 3.090 10.985 -6.649 328 HD13 ILE 39 HD13 ILE 39 3.452 10.026 -8.076 329 H SER 40 HN SER 40 8.248 10.698 -7.077 330 HA SER 40 HA SER 40 8.896 13.076 -8.696 331 HB2 SER 40 HB2 SER 40 10.970 13.159 -7.785 332 HB3 SER 40 HB1 SER 40 10.718 11.645 -6.924 333 HG SER 40 HG SER 40 12.371 11.860 -8.754 334 H PHE 41 HN PHE 41 9.357 12.636 -10.860 335 HA PHE 41 HA PHE 41 8.431 10.023 -11.768 336 HB2 PHE 41 HB2 PHE 41 8.597 12.743 -12.878 337 HB3 PHE 41 HB1 PHE 41 8.945 11.473 -14.046 338 HD1 PHE 41 HD2 PHE 41 6.637 11.430 -11.096 339 HD2 PHE 41 HD1 PHE 41 7.008 11.312 -15.376 340 HE1 PHE 41 HE2 PHE 41 4.214 10.936 -11.294 341 HE2 PHE 41 HE1 PHE 41 4.586 10.820 -15.572 342 HZ PHE 41 HZ PHE 41 3.190 10.631 -13.532 343 H LEU 42 HN LEU 42 9.846 8.524 -11.823 344 HA LEU 42 HA LEU 42 12.649 8.955 -12.597 345 HB2 LEU 42 HB2 LEU 42 11.115 6.478 -11.790 346 HB3 LEU 42 HB1 LEU 42 12.767 6.424 -12.357 347 HG LEU 42 HG LEU 42 11.798 8.024 -9.974 348 HD11 LEU 42 HD11 LEU 42 13.020 5.279 -10.262 349 HD12 LEU 42 HD12 LEU 42 13.261 6.212 -8.787 350 HD13 LEU 42 HD13 LEU 42 11.630 5.777 -9.298 351 HD21 LEU 42 HD21 LEU 42 14.450 7.690 -11.349 352 HD22 LEU 42 HD22 LEU 42 13.754 9.123 -10.593 353 HD23 LEU 42 HD23 LEU 42 14.437 7.844 -9.592 354 H GLY 43 HN GLY 43 9.702 7.558 -13.713 355 HA2 GLY 43 HA2 GLY 43 10.112 7.967 -16.460 356 HA3 GLY 43 HA1 GLY 43 10.494 6.285 -16.079 357 H GLU 44 HN GLU 44 8.201 7.348 -17.650 358 HA GLU 44 HA GLU 44 5.809 7.405 -16.231 359 HB2 GLU 44 HB2 GLU 44 6.283 6.135 -18.946 360 HB3 GLU 44 HB1 GLU 44 4.725 6.656 -18.305 361 HG2 GLU 44 HG2 GLU 44 7.105 8.485 -18.729 362 HG3 GLU 44 HG1 GLU 44 5.750 8.336 -19.845 363 H ASP 45 HN ASP 45 7.915 4.727 -16.915 364 HA ASP 45 HA ASP 45 5.923 2.810 -15.872 365 HB2 ASP 45 HB2 ASP 45 8.588 1.979 -16.970 366 HB3 ASP 45 HB1 ASP 45 7.047 1.123 -17.002 367 H GLU 46 HN GLU 46 7.851 4.846 -14.493 368 HA GLU 46 HA GLU 46 8.374 3.230 -12.187 369 HB2 GLU 46 HB2 GLU 46 10.244 2.549 -13.708 370 HB3 GLU 46 HB1 GLU 46 10.782 4.228 -13.729 371 HG2 GLU 46 HG2 GLU 46 10.914 4.106 -11.195 372 HG3 GLU 46 HG1 GLU 46 10.639 2.374 -11.343 373 H LEU 47 HN LEU 47 8.244 4.548 -10.451 374 HA LEU 47 HA LEU 47 9.248 7.287 -10.644 375 HB2 LEU 47 HB2 LEU 47 7.165 8.150 -9.512 376 HB3 LEU 47 HB1 LEU 47 7.011 7.738 -11.209 377 HG LEU 47 HG LEU 47 6.180 5.964 -8.902 378 HD11 LEU 47 HD11 LEU 47 4.805 7.997 -9.147 379 HD12 LEU 47 HD12 LEU 47 4.523 7.588 -10.839 380 HD13 LEU 47 HD13 LEU 47 3.898 6.543 -9.564 381 HD21 LEU 47 HD21 LEU 47 4.861 4.997 -11.069 382 HD22 LEU 47 HD22 LEU 47 6.317 5.591 -11.866 383 HD23 LEU 47 HD23 LEU 47 6.437 4.391 -10.579 384 H LYS 48 HN LYS 48 9.660 8.284 -8.670 385 HA LYS 48 HA LYS 48 10.073 6.350 -6.464 386 HB2 LYS 48 HB2 LYS 48 11.979 7.771 -7.656 387 HB3 LYS 48 HB1 LYS 48 11.432 9.022 -6.544 388 HG2 LYS 48 HG2 LYS 48 11.768 7.493 -4.643 389 HG3 LYS 48 HG1 LYS 48 12.290 6.222 -5.751 390 HD2 LYS 48 HD2 LYS 48 14.032 8.032 -6.556 391 HD3 LYS 48 HD1 LYS 48 13.703 8.765 -4.985 392 HE2 LYS 48 HE2 LYS 48 14.119 6.399 -4.020 393 HE3 LYS 48 HE1 LYS 48 14.855 6.045 -5.584 394 HZ1 LYS 48 HZ1 LYS 48 16.298 6.968 -3.662 395 HZ2 LYS 48 HZ2 LYS 48 16.533 7.555 -5.239 396 HZ3 LYS 48 HZ3 LYS 48 15.647 8.469 -4.120 397 H VAL 49 HN VAL 49 8.793 6.570 -4.691 398 HA VAL 49 HA VAL 49 7.933 9.269 -3.999 399 HB VAL 49 HB VAL 49 6.143 7.891 -5.325 400 HG11 VAL 49 HG11 VAL 49 5.693 6.853 -2.527 401 HG12 VAL 49 HG12 VAL 49 4.498 6.797 -3.823 402 HG13 VAL 49 HG13 VAL 49 6.009 5.904 -3.972 403 HG21 VAL 49 HG21 VAL 49 4.649 9.429 -4.583 404 HG22 VAL 49 HG22 VAL 49 4.945 9.065 -2.901 405 HG23 VAL 49 HG23 VAL 49 6.024 10.100 -3.768 406 H SER 50 HN SER 50 7.618 9.766 -2.001 407 HA SER 50 HA SER 50 8.729 7.890 0.025 408 HB2 SER 50 HB2 SER 50 8.897 10.894 -0.197 409 HB3 SER 50 HB1 SER 50 9.333 10.018 1.264 410 HG SER 50 HG SER 50 10.675 8.716 -0.288 411 H TYR 51 HN TYR 51 7.813 7.735 2.071 412 HA TYR 51 HA TYR 51 5.077 8.848 2.335 413 HB2 TYR 51 HB2 TYR 51 6.312 6.393 3.616 414 HB3 TYR 51 HB1 TYR 51 4.662 6.944 3.839 415 HD1 TYR 51 HD1 TYR 51 6.883 6.376 0.814 416 HD2 TYR 51 HD2 TYR 51 3.139 5.579 2.768 417 HE1 TYR 51 HE1 TYR 51 6.164 5.009 -1.111 418 HE2 TYR 51 HE2 TYR 51 2.433 4.200 0.836 419 HH TYR 51 HH TYR 51 4.434 2.982 -1.378 420 H ALA 52 HN ALA 52 4.765 10.259 4.018 421 HA ALA 52 HA ALA 52 6.645 10.154 6.301 422 HB1 ALA 52 HB1 ALA 52 5.435 12.751 5.420 423 HB2 ALA 52 HB2 ALA 52 6.853 12.134 4.577 424 HB3 ALA 52 HB3 ALA 52 6.928 12.457 6.309 425 H VAL 53 HN VAL 53 5.484 9.394 7.960 426 HA VAL 53 HA VAL 53 2.764 10.490 8.393 427 HB VAL 53 HB VAL 53 3.726 7.713 9.090 428 HG11 VAL 53 HG11 VAL 53 1.065 9.141 9.288 429 HG12 VAL 53 HG12 VAL 53 1.215 7.386 9.369 430 HG13 VAL 53 HG13 VAL 53 1.988 8.396 10.591 431 HG21 VAL 53 HG21 VAL 53 3.505 8.164 6.619 432 HG22 VAL 53 HG22 VAL 53 2.384 6.945 7.223 433 HG23 VAL 53 HG23 VAL 53 1.816 8.583 6.899 434 HA PRO 54 HA PRO 54 4.776 11.522 12.309 435 HB2 PRO 54 HB2 PRO 54 2.884 13.139 13.330 436 HB3 PRO 54 HB1 PRO 54 3.860 13.637 11.932 437 HG2 PRO 54 HG2 PRO 54 1.077 12.555 12.001 438 HG3 PRO 54 HG1 PRO 54 1.739 13.897 11.047 439 HD2 PRO 54 HD2 PRO 54 1.373 11.334 10.056 440 HD3 PRO 54 HD1 PRO 54 2.552 12.496 9.407 441 H LYS 55 HN LYS 55 4.813 9.651 13.525 442 HA LYS 55 HA LYS 55 2.296 8.734 14.773 443 HB2 LYS 55 HB2 LYS 55 3.727 7.139 13.393 444 HB3 LYS 55 HB1 LYS 55 4.911 7.241 14.696 445 HG2 LYS 55 HG2 LYS 55 3.051 6.593 16.296 446 HG3 LYS 55 HG1 LYS 55 2.057 6.249 14.878 447 HD2 LYS 55 HD2 LYS 55 3.944 4.727 14.086 448 HD3 LYS 55 HD1 LYS 55 4.643 4.907 15.695 449 HE2 LYS 55 HE2 LYS 55 2.364 4.172 16.605 450 HE3 LYS 55 HE1 LYS 55 1.977 3.690 14.953 451 HZ1 LYS 55 HZ1 LYS 55 3.958 2.287 14.954 452 HZ2 LYS 55 HZ2 LYS 55 4.274 2.719 16.565 453 HZ3 LYS 55 HZ3 LYS 55 2.876 1.837 16.184 454 HA PRO 56 HA PRO 56 4.051 11.038 18.332 455 HB2 PRO 56 HB2 PRO 56 1.755 9.546 19.569 456 HB3 PRO 56 HB1 PRO 56 2.248 11.237 19.790 457 HG2 PRO 56 HG2 PRO 56 0.186 10.620 18.243 458 HG3 PRO 56 HG1 PRO 56 1.314 11.910 17.787 459 HD2 PRO 56 HD2 PRO 56 1.039 9.164 16.644 460 HD3 PRO 56 HD1 PRO 56 1.561 10.668 15.851 461 H ASN 57 HN ASN 57 3.258 7.621 18.088 462 HA ASN 57 HA ASN 57 4.691 6.833 20.456 463 HB2 ASN 57 HB2 ASN 57 2.786 5.549 19.374 464 HB3 ASN 57 HB1 ASN 57 3.930 5.078 18.120 465 HD21 ASN 57 HD21 ASN 57 3.364 2.825 19.098 466 HD22 ASN 57 HD22 ASN 57 4.314 2.305 20.406 467 H GLY 58 HN GLY 58 5.470 7.414 17.132 468 HA2 GLY 58 HA2 GLY 58 8.208 7.577 17.438 469 HA3 GLY 58 HA1 GLY 58 7.889 5.897 17.015 470 H CYS 59 HN CYS 59 7.869 9.196 15.902 471 HA CYS 59 HA CYS 59 6.519 9.063 13.504 472 HB2 CYS 59 HB2 CYS 59 9.177 10.464 13.789 473 HB3 CYS 59 HB1 CYS 59 7.799 10.933 12.794 474 H ARG 60 HN ARG 60 6.937 8.336 11.456 475 HA ARG 60 HA ARG 60 9.463 6.854 11.017 476 HB2 ARG 60 HB2 ARG 60 7.417 5.394 11.545 477 HB3 ARG 60 HB1 ARG 60 6.796 5.904 9.975 478 HG2 ARG 60 HG2 ARG 60 8.816 5.043 8.874 479 HG3 ARG 60 HG1 ARG 60 9.480 4.568 10.438 480 HD2 ARG 60 HD2 ARG 60 7.332 3.178 10.730 481 HD3 ARG 60 HD1 ARG 60 7.080 3.428 9.005 482 HE ARG 60 HE ARG 60 8.975 1.642 10.203 483 HH11 ARG 60 HH21 ARG 60 8.378 3.757 7.529 484 HH12 ARG 60 HH22 ARG 60 9.429 2.908 6.445 485 HH21 ARG 60 HH11 ARG 60 10.354 0.524 8.788 486 HH22 ARG 60 HH12 ARG 60 10.547 1.077 7.158 487 H LYS 61 HN LYS 61 10.506 7.569 9.307 488 HA LYS 61 HA LYS 61 8.994 8.609 6.987 489 HB2 LYS 61 HB2 LYS 61 10.692 10.386 6.722 490 HB3 LYS 61 HB1 LYS 61 9.820 10.544 8.247 491 HG2 LYS 61 HG2 LYS 61 11.707 9.230 9.330 492 HG3 LYS 61 HG1 LYS 61 12.598 9.422 7.820 493 HD2 LYS 61 HD2 LYS 61 12.287 11.906 8.026 494 HD3 LYS 61 HD1 LYS 61 11.574 11.638 9.617 495 HE2 LYS 61 HE2 LYS 61 13.894 12.135 9.981 496 HE3 LYS 61 HE1 LYS 61 13.700 10.402 10.242 497 HZ1 LYS 61 HZ1 LYS 61 14.182 10.620 7.571 498 HZ2 LYS 61 HZ2 LYS 61 15.221 11.781 8.251 499 HZ3 LYS 61 HZ3 LYS 61 15.314 10.163 8.753 500 H TRP 62 HN TRP 62 9.681 7.804 5.071 501 HA TRP 62 HA TRP 62 12.410 6.887 4.720 502 HB2 TRP 62 HB2 TRP 62 12.031 4.588 4.504 503 HB3 TRP 62 HB1 TRP 62 11.071 5.018 5.918 504 HD1 TRP 62 HD1 TRP 62 8.510 6.176 4.709 505 HE1 TRP 62 HE1 TRP 62 6.903 4.737 3.297 506 HE3 TRP 62 HE3 TRP 62 11.686 2.438 3.288 507 HZ2 TRP 62 HZ2 TRP 62 6.960 2.333 1.768 508 HZ3 TRP 62 HZ3 TRP 62 10.881 0.583 1.855 509 HH2 TRP 62 HH2 TRP 62 8.520 0.522 1.095 510 H GLU 63 HN GLU 63 12.524 5.646 2.534 511 HA GLU 63 HA GLU 63 10.884 7.123 0.551 512 HB2 GLU 63 HB2 GLU 63 13.326 7.746 0.659 513 HB3 GLU 63 HB1 GLU 63 13.704 6.096 0.165 514 HG2 GLU 63 HG2 GLU 63 12.511 6.373 -1.916 515 HG3 GLU 63 HG1 GLU 63 11.887 7.941 -1.406 516 H THR 64 HN THR 64 10.509 5.988 -1.480 517 HA THR 64 HA THR 64 10.926 3.103 -1.514 518 HB THR 64 HB THR 64 8.084 4.000 -1.872 519 HG1 THR 64 HG1 THR 64 8.011 4.542 0.137 520 HG21 THR 64 HG21 THR 64 9.394 1.459 -0.864 521 HG22 THR 64 HG22 THR 64 7.661 1.696 -1.089 522 HG23 THR 64 HG23 THR 64 8.742 1.711 -2.483 523 H THR 65 HN THR 65 10.863 2.234 -3.554 524 HA THR 65 HA THR 65 10.525 4.168 -5.769 525 HB THR 65 HB THR 65 12.055 1.556 -5.762 526 HG1 THR 65 HG1 THR 65 13.344 2.763 -4.599 527 HG21 THR 65 HG21 THR 65 11.749 3.832 -7.727 528 HG22 THR 65 HG22 THR 65 13.090 2.690 -7.809 529 HG23 THR 65 HG23 THR 65 11.431 2.117 -7.991 530 H PHE 66 HN PHE 66 9.241 3.673 -7.510 531 HA PHE 66 HA PHE 66 7.473 1.296 -7.261 532 HB2 PHE 66 HB2 PHE 66 7.099 4.071 -8.367 533 HB3 PHE 66 HB1 PHE 66 6.000 2.796 -8.755 534 HD1 PHE 66 HD2 PHE 66 7.081 2.243 -5.390 535 HD2 PHE 66 HD1 PHE 66 4.526 4.747 -7.776 536 HE1 PHE 66 HE2 PHE 66 5.751 2.792 -3.392 537 HE2 PHE 66 HE1 PHE 66 3.204 5.296 -5.764 538 HZ PHE 66 HZ PHE 66 3.807 4.318 -3.575 539 H LYS 67 HN LYS 67 7.887 -0.258 -8.806 540 HA LYS 67 HA LYS 67 9.054 0.661 -11.376 541 HB2 LYS 67 HB2 LYS 67 9.553 -1.998 -10.045 542 HB3 LYS 67 HB1 LYS 67 10.391 -1.309 -11.434 543 HG2 LYS 67 HG2 LYS 67 11.007 0.640 -9.842 544 HG3 LYS 67 HG1 LYS 67 10.534 -0.456 -8.544 545 HD2 LYS 67 HD2 LYS 67 12.107 -2.168 -9.592 546 HD3 LYS 67 HD1 LYS 67 12.719 -0.854 -10.596 547 HE2 LYS 67 HE2 LYS 67 13.158 0.442 -8.467 548 HE3 LYS 67 HE1 LYS 67 12.776 -1.029 -7.574 549 HZ1 LYS 67 HZ1 LYS 67 14.683 -2.012 -8.192 550 HZ2 LYS 67 HZ2 LYS 67 14.681 -1.320 -9.744 551 HZ3 LYS 67 HZ3 LYS 67 15.220 -0.416 -8.415 552 H LYS 68 HN LYS 68 8.633 -0.547 -13.236 553 HA LYS 68 HA LYS 68 7.241 -1.574 -14.767 554 HB2 LYS 68 HB2 LYS 68 7.920 -3.579 -13.357 555 HB3 LYS 68 HB1 LYS 68 6.408 -3.364 -12.473 556 HG2 LYS 68 HG2 LYS 68 5.176 -3.517 -14.652 557 HG3 LYS 68 HG1 LYS 68 6.707 -3.892 -15.444 558 HD2 LYS 68 HD2 LYS 68 6.967 -5.911 -14.156 559 HD3 LYS 68 HD1 LYS 68 5.600 -5.492 -13.122 560 HE2 LYS 68 HE2 LYS 68 4.956 -7.166 -14.826 561 HE3 LYS 68 HE1 LYS 68 4.077 -5.653 -15.048 562 HZ1 LYS 68 HZ1 LYS 68 5.995 -5.069 -16.620 563 HZ2 LYS 68 HZ2 LYS 68 6.318 -6.737 -16.628 564 HZ3 LYS 68 HZ3 LYS 68 4.814 -6.163 -17.165 565 H THR 69 HN THR 69 6.270 0.653 -14.082 566 HA THR 69 HA THR 69 3.574 0.301 -13.036 567 HB THR 69 HB THR 69 3.758 2.611 -12.454 568 HG1 THR 69 HG1 THR 69 4.966 3.890 -13.555 569 HG21 THR 69 HG21 THR 69 5.250 0.665 -11.322 570 HG22 THR 69 HG22 THR 69 6.543 1.720 -11.882 571 HG23 THR 69 HG23 THR 69 5.326 2.338 -10.776 572 H SER 70 HN SER 70 2.928 -0.583 -15.168 573 HA SER 70 HA SER 70 1.774 1.509 -16.798 574 HB2 SER 70 HB2 SER 70 2.836 1.019 -18.846 575 HB3 SER 70 HB1 SER 70 4.156 1.082 -17.682 576 HG SER 70 HG SER 70 2.797 -1.252 -18.574 577 H ASP 71 HN ASP 71 1.457 -1.226 -15.215 578 HA ASP 71 HA ASP 71 0.372 -3.184 -16.811 579 HB2 ASP 71 HB2 ASP 71 -0.176 -2.267 -14.007 580 HB3 ASP 71 HB1 ASP 71 -1.124 -3.572 -14.705 581 H ASP 72 HN ASP 72 -1.875 -1.340 -14.825 582 HA ASP 72 HA ASP 72 -3.850 -1.447 -16.999 583 HB2 ASP 72 HB2 ASP 72 -4.053 -0.811 -14.055 584 HB3 ASP 72 HB1 ASP 72 -5.404 -0.623 -15.170 585 H GLY 73 HN GLY 73 -2.613 0.180 -18.209 586 HA2 GLY 73 HA2 GLY 73 -2.621 2.333 -19.066 587 HA3 GLY 73 HA1 GLY 73 -3.699 2.810 -17.751 588 H GLU 74 HN GLU 74 -2.830 3.532 -15.778 589 HA GLU 74 HA GLU 74 0.101 3.775 -15.647 590 HB2 GLU 74 HB2 GLU 74 -1.966 5.918 -15.127 591 HB3 GLU 74 HB1 GLU 74 -0.304 6.024 -14.545 592 HG2 GLU 74 HG2 GLU 74 -1.031 5.593 -17.454 593 HG3 GLU 74 HG1 GLU 74 -0.712 7.181 -16.758 594 H VAL 75 HN VAL 75 0.267 2.052 -14.084 595 HA VAL 75 HA VAL 75 -0.804 2.768 -11.451 596 HB VAL 75 HB VAL 75 -0.865 -0.013 -12.650 597 HG11 VAL 75 HG11 VAL 75 -1.442 1.141 -9.926 598 HG12 VAL 75 HG12 VAL 75 -2.331 -0.281 -10.474 599 HG13 VAL 75 HG13 VAL 75 -0.574 -0.331 -10.351 600 HG21 VAL 75 HG21 VAL 75 -3.424 0.455 -12.209 601 HG22 VAL 75 HG22 VAL 75 -2.937 2.144 -12.330 602 HG23 VAL 75 HG23 VAL 75 -2.666 1.050 -13.683 603 H TYR 76 HN TYR 76 0.516 1.990 -9.733 604 HA TYR 76 HA TYR 76 3.273 1.378 -10.644 605 HB2 TYR 76 HB2 TYR 76 3.788 3.087 -9.246 606 HB3 TYR 76 HB1 TYR 76 2.168 3.079 -8.567 607 HD1 TYR 76 HD1 TYR 76 5.190 0.797 -8.497 608 HD2 TYR 76 HD2 TYR 76 2.059 2.699 -6.267 609 HE1 TYR 76 HE1 TYR 76 6.021 -0.245 -6.422 610 HE2 TYR 76 HE2 TYR 76 2.910 1.661 -4.188 611 HH TYR 76 HH TYR 76 4.845 0.685 -3.291 612 H TYR 77 HN TYR 77 4.510 -0.393 -9.901 613 HA TYR 77 HA TYR 77 3.232 -2.051 -7.862 614 HB2 TYR 77 HB2 TYR 77 2.381 -3.022 -9.883 615 HB3 TYR 77 HB1 TYR 77 3.983 -3.011 -10.617 616 HD1 TYR 77 HD1 TYR 77 1.899 -4.548 -7.953 617 HD2 TYR 77 HD2 TYR 77 5.591 -4.722 -10.141 618 HE1 TYR 77 HE1 TYR 77 2.357 -6.792 -7.003 619 HE2 TYR 77 HE2 TYR 77 6.048 -6.966 -9.192 620 HH TYR 77 HH TYR 77 4.491 -8.905 -8.229 621 H SER 78 HN SER 78 4.657 -2.727 -6.359 622 HA SER 78 HA SER 78 7.532 -2.721 -7.076 623 HB2 SER 78 HB2 SER 78 6.040 -1.838 -4.705 624 HB3 SER 78 HB1 SER 78 7.427 -2.847 -4.319 625 HG SER 78 HG SER 78 8.077 -1.122 -6.260 626 H GLU 79 HN GLU 79 7.933 -4.734 -7.728 627 HA GLU 79 HA GLU 79 6.754 -7.117 -6.972 628 HB2 GLU 79 HB2 GLU 79 8.478 -6.770 -8.797 629 HB3 GLU 79 HB1 GLU 79 9.710 -6.848 -7.537 630 HG2 GLU 79 HG2 GLU 79 8.829 -9.079 -6.860 631 HG3 GLU 79 HG1 GLU 79 7.691 -9.006 -8.204 632 H GLU 80 HN GLU 80 9.232 -5.275 -5.298 633 HA GLU 80 HA GLU 80 9.753 -7.350 -3.349 634 HB2 GLU 80 HB2 GLU 80 10.602 -4.454 -3.503 635 HB3 GLU 80 HB1 GLU 80 11.137 -5.582 -2.258 636 HG2 GLU 80 HG2 GLU 80 12.834 -5.594 -3.950 637 HG3 GLU 80 HG1 GLU 80 11.935 -7.098 -4.138 638 H ALA 81 HN ALA 81 8.020 -4.231 -3.344 639 HA ALA 81 HA ALA 81 7.238 -4.595 -0.562 640 HB1 ALA 81 HB1 ALA 81 6.217 -2.417 -2.368 641 HB2 ALA 81 HB2 ALA 81 7.855 -2.367 -1.719 642 HB3 ALA 81 HB3 ALA 81 6.474 -2.382 -0.624 643 H LYS 82 HN LYS 82 6.105 -6.022 -3.242 644 HA LYS 82 HA LYS 82 3.971 -6.578 -4.059 645 HB2 LYS 82 HB2 LYS 82 3.883 -7.383 -1.141 646 HB3 LYS 82 HB1 LYS 82 2.856 -8.043 -2.415 647 HG2 LYS 82 HG2 LYS 82 4.914 -8.782 -3.628 648 HG3 LYS 82 HG1 LYS 82 5.877 -8.234 -2.256 649 HD2 LYS 82 HD2 LYS 82 4.517 -9.761 -0.786 650 HD3 LYS 82 HD1 LYS 82 3.760 -10.401 -2.244 651 HE2 LYS 82 HE2 LYS 82 5.939 -11.114 -3.101 652 HE3 LYS 82 HE1 LYS 82 6.743 -10.409 -1.698 653 HZ1 LYS 82 HZ1 LYS 82 6.467 -12.741 -1.342 654 HZ2 LYS 82 HZ2 LYS 82 5.412 -11.920 -0.294 655 HZ3 LYS 82 HZ3 LYS 82 4.807 -12.659 -1.695 656 H LYS 83 HN LYS 83 3.688 -4.062 -3.974 657 HA LYS 83 HA LYS 83 0.974 -3.624 -3.043 658 HB2 LYS 83 HB2 LYS 83 2.479 -3.013 -1.092 659 HB3 LYS 83 HB1 LYS 83 3.118 -1.716 -2.102 660 HG2 LYS 83 HG2 LYS 83 0.616 -1.066 -2.451 661 HG3 LYS 83 HG1 LYS 83 0.321 -2.062 -1.027 662 HD2 LYS 83 HD2 LYS 83 2.195 0.317 -1.197 663 HD3 LYS 83 HD1 LYS 83 0.650 0.264 -0.349 664 HE2 LYS 83 HE2 LYS 83 3.233 -1.109 0.353 665 HE3 LYS 83 HE1 LYS 83 2.183 -0.134 1.377 666 HZ1 LYS 83 HZ1 LYS 83 1.958 -2.939 0.620 667 HZ2 LYS 83 HZ2 LYS 83 1.572 -2.172 2.086 668 HZ3 LYS 83 HZ3 LYS 83 0.510 -2.062 0.769 669 H LYS 84 HN LYS 84 -0.094 -2.344 -4.420 670 HA LYS 84 HA LYS 84 1.455 -0.604 -6.239 671 HB2 LYS 84 HB2 LYS 84 -0.326 -1.283 -7.987 672 HB3 LYS 84 HB1 LYS 84 0.952 -2.442 -7.631 673 HG2 LYS 84 HG2 LYS 84 -0.566 -3.577 -6.017 674 HG3 LYS 84 HG1 LYS 84 -1.841 -2.442 -6.462 675 HD2 LYS 84 HD2 LYS 84 -1.750 -3.215 -8.788 676 HD3 LYS 84 HD1 LYS 84 -0.436 -4.319 -8.383 677 HE2 LYS 84 HE2 LYS 84 -3.256 -4.406 -7.275 678 HE3 LYS 84 HE1 LYS 84 -2.542 -5.552 -8.409 679 HZ1 LYS 84 HZ1 LYS 84 -2.230 -5.352 -5.553 680 HZ2 LYS 84 HZ2 LYS 84 -1.993 -6.683 -6.582 681 HZ3 LYS 84 HZ3 LYS 84 -0.761 -5.534 -6.387 682 H VAL 85 HN VAL 85 0.463 1.237 -6.986 683 HA VAL 85 HA VAL 85 -2.176 1.854 -5.849 684 HB VAL 85 HB VAL 85 -1.585 3.808 -4.842 685 HG11 VAL 85 HG11 VAL 85 0.727 1.930 -4.537 686 HG12 VAL 85 HG12 VAL 85 0.596 3.399 -3.579 687 HG13 VAL 85 HG13 VAL 85 -0.652 2.161 -3.471 688 HG21 VAL 85 HG21 VAL 85 -0.353 5.358 -6.006 689 HG22 VAL 85 HG22 VAL 85 1.068 4.574 -5.346 690 HG23 VAL 85 HG23 VAL 85 0.468 4.121 -6.930 691 H GLU 86 HN GLU 86 -3.529 2.746 -7.192 692 HA GLU 86 HA GLU 86 -2.496 3.640 -9.829 693 HB2 GLU 86 HB2 GLU 86 -3.657 1.603 -10.180 694 HB3 GLU 86 HB1 GLU 86 -4.943 2.047 -9.066 695 HG2 GLU 86 HG2 GLU 86 -5.901 3.571 -10.576 696 HG3 GLU 86 HG1 GLU 86 -4.424 3.713 -11.525 697 H VAL 87 HN VAL 87 -2.982 5.580 -10.476 698 HA VAL 87 HA VAL 87 -4.272 7.495 -8.875 699 HB VAL 87 HB VAL 87 -2.882 8.368 -10.555 700 HG11 VAL 87 HG11 VAL 87 -3.353 7.811 -13.017 701 HG12 VAL 87 HG12 VAL 87 -2.647 6.528 -12.035 702 HG13 VAL 87 HG13 VAL 87 -4.368 6.504 -12.411 703 HG21 VAL 87 HG21 VAL 87 -5.209 9.473 -10.334 704 HG22 VAL 87 HG22 VAL 87 -4.256 9.879 -11.760 705 HG23 VAL 87 HG23 VAL 87 -5.575 8.716 -11.884 706 H LEU 88 HN LEU 88 -6.279 7.047 -8.130 707 HA LEU 88 HA LEU 88 -8.347 6.039 -9.937 708 HB2 LEU 88 HB2 LEU 88 -7.792 5.427 -7.366 709 HB3 LEU 88 HB1 LEU 88 -8.960 6.712 -7.095 710 HG LEU 88 HG LEU 88 -10.123 4.580 -7.160 711 HD11 LEU 88 HD11 LEU 88 -11.810 5.126 -8.720 712 HD12 LEU 88 HD12 LEU 88 -11.075 6.672 -8.303 713 HD13 LEU 88 HD13 LEU 88 -10.665 5.880 -9.827 714 HD21 LEU 88 HD21 LEU 88 -8.203 3.696 -8.858 715 HD22 LEU 88 HD22 LEU 88 -9.776 2.920 -8.706 716 HD23 LEU 88 HD23 LEU 88 -9.477 4.048 -10.026 717 H ASP 89 HN ASP 89 -7.254 9.002 -8.598 718 HA ASP 89 HA ASP 89 -8.900 10.624 -10.109 719 HB2 ASP 89 HB2 ASP 89 -10.455 9.623 -8.078 720 HB3 ASP 89 HB1 ASP 89 -9.798 11.064 -7.318 721 H THR 90 HN THR 90 -7.673 12.408 -10.281 722 HA THR 90 HA THR 90 -6.350 13.520 -7.935 723 HB THR 90 HB THR 90 -5.019 11.643 -9.452 724 HG1 THR 90 HG1 THR 90 -3.209 12.324 -8.320 725 HG21 THR 90 HG21 THR 90 -4.013 14.376 -10.299 726 HG22 THR 90 HG22 THR 90 -3.285 12.825 -10.705 727 HG23 THR 90 HG23 THR 90 -4.871 13.244 -11.346 728 H ASP 91 HN ASP 91 -6.327 15.668 -8.031 729 HA ASP 91 HA ASP 91 -6.472 17.000 -10.686 730 HB2 ASP 91 HB2 ASP 91 -8.782 16.792 -9.716 731 HB3 ASP 91 HB1 ASP 91 -8.238 17.765 -8.350 732 H TYR 92 HN TYR 92 -5.453 16.844 -7.472 733 HA TYR 92 HA TYR 92 -4.074 18.086 -6.150 734 HB2 TYR 92 HB2 TYR 92 -3.019 19.290 -8.702 735 HB3 TYR 92 HB1 TYR 92 -2.156 19.008 -7.196 736 HD1 TYR 92 HD2 TYR 92 -2.931 16.217 -6.528 737 HD2 TYR 92 HD1 TYR 92 -1.935 17.990 -10.317 738 HE1 TYR 92 HE2 TYR 92 -2.192 14.013 -7.367 739 HE2 TYR 92 HE1 TYR 92 -1.203 15.777 -11.154 740 HH TYR 92 HH TYR 92 -1.892 12.872 -9.510 741 H LYS 93 HN LYS 93 -6.494 19.459 -7.871 742 HA LYS 93 HA LYS 93 -5.898 22.240 -7.512 743 HB2 LYS 93 HB2 LYS 93 -7.491 21.327 -9.233 744 HB3 LYS 93 HB1 LYS 93 -8.609 20.958 -7.919 745 HG2 LYS 93 HG2 LYS 93 -8.579 23.352 -7.250 746 HG3 LYS 93 HG1 LYS 93 -7.527 23.703 -8.622 747 HD2 LYS 93 HD2 LYS 93 -9.299 22.735 -10.130 748 HD3 LYS 93 HD1 LYS 93 -10.359 22.633 -8.724 749 HE2 LYS 93 HE2 LYS 93 -10.016 25.098 -8.369 750 HE3 LYS 93 HE1 LYS 93 -9.135 25.144 -9.896 751 HZ1 LYS 93 HZ1 LYS 93 -11.749 25.537 -9.713 752 HZ2 LYS 93 HZ2 LYS 93 -11.007 24.879 -11.092 753 HZ3 LYS 93 HZ3 LYS 93 -11.739 23.856 -9.953 754 H SER 94 HN SER 94 -7.654 19.771 -5.758 755 HA SER 94 HA SER 94 -7.495 21.336 -3.321 756 HB2 SER 94 HB2 SER 94 -9.987 20.981 -2.911 757 HB3 SER 94 HB1 SER 94 -9.563 22.228 -4.080 758 HG SER 94 HG SER 94 -10.626 21.120 -5.501 759 H TYR 95 HN TYR 95 -8.007 18.388 -5.081 760 HA TYR 95 HA TYR 95 -7.182 16.826 -2.842 761 HB2 TYR 95 HB2 TYR 95 -9.285 15.511 -2.637 762 HB3 TYR 95 HB1 TYR 95 -9.445 17.185 -2.103 763 HD1 TYR 95 HD1 TYR 95 -10.207 14.801 -4.831 764 HD2 TYR 95 HD2 TYR 95 -10.805 18.774 -3.311 765 HE1 TYR 95 HE1 TYR 95 -12.012 15.165 -6.492 766 HE2 TYR 95 HE2 TYR 95 -12.613 19.137 -4.970 767 HH TYR 95 HH TYR 95 -14.275 17.279 -6.310 768 H ALA 96 HN ALA 96 -7.328 14.495 -3.256 769 HA ALA 96 HA ALA 96 -7.621 13.642 -6.019 770 HB1 ALA 96 HB1 ALA 96 -5.301 14.376 -6.041 771 HB2 ALA 96 HB2 ALA 96 -5.342 12.613 -6.047 772 HB3 ALA 96 HB3 ALA 96 -4.968 13.480 -4.563 773 H VAL 97 HN VAL 97 -8.170 11.500 -6.147 774 HA VAL 97 HA VAL 97 -8.216 9.996 -3.569 775 HB VAL 97 HB VAL 97 -10.214 9.500 -5.769 776 HG11 VAL 97 HG11 VAL 97 -9.827 7.944 -3.781 777 HG12 VAL 97 HG12 VAL 97 -10.479 9.234 -2.771 778 HG13 VAL 97 HG13 VAL 97 -11.485 8.498 -4.019 779 HG21 VAL 97 HG21 VAL 97 -10.363 11.910 -5.228 780 HG22 VAL 97 HG22 VAL 97 -11.765 11.040 -4.604 781 HG23 VAL 97 HG23 VAL 97 -10.464 11.517 -3.513 782 H ILE 98 HN ILE 98 -7.173 8.050 -3.592 783 HA ILE 98 HA ILE 98 -6.441 6.958 -6.233 784 HB ILE 98 HB ILE 98 -4.628 8.197 -5.183 785 HG12 ILE 98 HG12 ILE 98 -4.164 5.228 -4.834 786 HG13 ILE 98 HG11 ILE 98 -4.151 6.049 -6.398 787 HG21 ILE 98 HG21 ILE 98 -4.966 6.272 -2.870 788 HG22 ILE 98 HG22 ILE 98 -3.773 7.563 -2.996 789 HG23 ILE 98 HG23 ILE 98 -5.485 7.957 -2.848 790 HD11 ILE 98 HD11 ILE 98 -2.506 7.508 -4.502 791 HD12 ILE 98 HD12 ILE 98 -2.004 5.835 -4.581 792 HD13 ILE 98 HD13 ILE 98 -2.064 6.789 -6.055 793 H TYR 99 HN TYR 99 -6.285 4.759 -6.396 794 HA TYR 99 HA TYR 99 -7.626 3.197 -4.287 795 HB2 TYR 99 HB2 TYR 99 -8.456 3.021 -6.623 796 HB3 TYR 99 HB1 TYR 99 -6.882 2.393 -7.112 797 HD1 TYR 99 HD1 TYR 99 -9.889 1.728 -5.050 798 HD2 TYR 99 HD2 TYR 99 -6.213 0.138 -6.604 799 HE1 TYR 99 HE1 TYR 99 -10.578 -0.550 -4.350 800 HE2 TYR 99 HE2 TYR 99 -6.903 -2.139 -5.903 801 HH TYR 99 HH TYR 99 -10.126 -2.772 -4.623 802 H ALA 100 HN ALA 100 -6.240 2.518 -2.792 803 HA ALA 100 HA ALA 100 -3.597 1.469 -3.615 804 HB1 ALA 100 HB1 ALA 100 -3.163 1.629 -1.084 805 HB2 ALA 100 HB2 ALA 100 -4.649 2.576 -1.016 806 HB3 ALA 100 HB3 ALA 100 -3.286 3.142 -1.981 807 H THR 101 HN THR 101 -3.058 -0.622 -3.286 808 HA THR 101 HA THR 101 -4.784 -2.322 -1.621 809 HB THR 101 HB THR 101 -5.735 -2.524 -3.857 810 HG1 THR 101 HG1 THR 101 -4.174 -4.822 -3.678 811 HG21 THR 101 HG21 THR 101 -3.057 -3.518 -4.819 812 HG22 THR 101 HG22 THR 101 -4.464 -3.064 -5.779 813 HG23 THR 101 HG23 THR 101 -3.517 -1.820 -4.962 814 H ARG 102 HN ARG 102 -3.641 -3.688 -0.430 815 HA ARG 102 HA ARG 102 -0.833 -4.262 -1.182 816 HB2 ARG 102 HB2 ARG 102 -1.096 -2.866 0.872 817 HB3 ARG 102 HB1 ARG 102 -2.034 -4.174 1.592 818 HG2 ARG 102 HG2 ARG 102 -0.104 -5.701 1.313 819 HG3 ARG 102 HG1 ARG 102 0.837 -4.373 0.632 820 HD2 ARG 102 HD2 ARG 102 1.483 -4.367 2.890 821 HD3 ARG 102 HD1 ARG 102 0.241 -3.120 2.833 822 HE ARG 102 HE ARG 102 -1.156 -4.503 4.098 823 HH11 ARG 102 HH21 ARG 102 1.646 -6.189 2.964 824 HH12 ARG 102 HH22 ARG 102 1.379 -7.584 3.956 825 HH21 ARG 102 HH11 ARG 102 -1.512 -6.328 5.402 826 HH22 ARG 102 HH12 ARG 102 -0.410 -7.662 5.337 827 H VAL 103 HN VAL 103 -0.408 -6.457 -1.599 828 HA VAL 103 HA VAL 103 -2.406 -8.357 -0.522 829 HB VAL 103 HB VAL 103 -2.582 -8.109 -2.952 830 HG11 VAL 103 HG11 VAL 103 -0.066 -7.438 -3.107 831 HG12 VAL 103 HG12 VAL 103 0.227 -9.175 -3.218 832 HG13 VAL 103 HG13 VAL 103 -0.773 -8.368 -4.427 833 HG21 VAL 103 HG21 VAL 103 -1.196 -10.708 -2.219 834 HG22 VAL 103 HG22 VAL 103 -2.888 -10.352 -1.876 835 HG23 VAL 103 HG23 VAL 103 -2.332 -10.457 -3.545 836 H LYS 104 HN LYS 104 -1.610 -9.655 0.963 837 HA LYS 104 HA LYS 104 1.277 -10.220 1.014 838 HB2 LYS 104 HB2 LYS 104 -0.032 -9.271 3.046 839 HB3 LYS 104 HB1 LYS 104 -0.707 -10.892 3.187 840 HG2 LYS 104 HG2 LYS 104 1.502 -11.857 3.443 841 HG3 LYS 104 HG1 LYS 104 2.266 -10.302 3.108 842 HD2 LYS 104 HD2 LYS 104 1.149 -9.359 5.128 843 HD3 LYS 104 HD1 LYS 104 0.504 -10.962 5.486 844 HE2 LYS 104 HE2 LYS 104 2.741 -11.871 5.725 845 HE3 LYS 104 HE1 LYS 104 3.459 -10.349 5.196 846 HZ1 LYS 104 HZ1 LYS 104 3.521 -9.856 7.353 847 HZ2 LYS 104 HZ2 LYS 104 1.847 -9.597 7.234 848 HZ3 LYS 104 HZ3 LYS 104 2.436 -11.092 7.775 849 H ASP 105 HN ASP 105 1.760 -12.522 1.812 850 HA ASP 105 HA ASP 105 0.834 -14.351 -0.081 851 HB2 ASP 105 HB2 ASP 105 2.934 -14.602 1.221 852 HB3 ASP 105 HB1 ASP 105 1.975 -14.979 2.651 853 H GLY 106 HN GLY 106 -1.175 -15.008 -0.314 854 HA2 GLY 106 HA2 GLY 106 -3.057 -16.279 0.181 855 HA3 GLY 106 HA1 GLY 106 -2.535 -16.356 1.856 856 H ARG 107 HN ARG 107 -2.391 -13.145 1.230 857 HA ARG 107 HA ARG 107 -5.271 -12.700 1.782 858 HB2 ARG 107 HB2 ARG 107 -2.990 -11.343 3.228 859 HB3 ARG 107 HB1 ARG 107 -4.713 -11.106 3.519 860 HG2 ARG 107 HG2 ARG 107 -4.930 -13.490 4.144 861 HG3 ARG 107 HG1 ARG 107 -3.199 -13.709 3.881 862 HD2 ARG 107 HD2 ARG 107 -3.446 -13.360 6.225 863 HD3 ARG 107 HD1 ARG 107 -2.840 -11.838 5.578 864 HE ARG 107 HE ARG 107 -5.527 -11.476 5.516 865 HH11 ARG 107 HH21 ARG 107 -3.308 -12.601 7.922 866 HH12 ARG 107 HH22 ARG 107 -4.238 -12.005 9.256 867 HH21 ARG 107 HH11 ARG 107 -6.751 -10.692 7.262 868 HH22 ARG 107 HH12 ARG 107 -6.187 -10.924 8.883 869 H THR 108 HN THR 108 -6.198 -10.983 0.866 870 HA THR 108 HA THR 108 -4.513 -9.126 -0.722 871 HB THR 108 HB THR 108 -7.332 -10.027 -1.358 872 HG1 THR 108 HG1 THR 108 -6.049 -11.026 -3.156 873 HG21 THR 108 HG21 THR 108 -6.819 -8.966 -3.548 874 HG22 THR 108 HG22 THR 108 -6.772 -7.809 -2.218 875 HG23 THR 108 HG23 THR 108 -5.269 -8.430 -2.900 876 H LEU 109 HN LEU 109 -5.233 -6.916 -0.797 877 HA LEU 109 HA LEU 109 -7.433 -6.185 1.004 878 HB2 LEU 109 HB2 LEU 109 -5.435 -6.265 2.414 879 HB3 LEU 109 HB1 LEU 109 -4.618 -5.150 1.345 880 HG LEU 109 HG LEU 109 -6.374 -3.453 1.823 881 HD11 LEU 109 HD11 LEU 109 -8.317 -4.614 2.432 882 HD12 LEU 109 HD12 LEU 109 -7.445 -5.722 3.491 883 HD13 LEU 109 HD13 LEU 109 -7.731 -4.056 3.995 884 HD21 LEU 109 HD21 LEU 109 -5.512 -2.853 3.959 885 HD22 LEU 109 HD22 LEU 109 -5.222 -4.537 4.395 886 HD23 LEU 109 HD23 LEU 109 -4.218 -3.757 3.171 887 H HIS 110 HN HIS 110 -8.272 -4.203 0.689 888 HA HIS 110 HA HIS 110 -7.084 -2.495 -1.367 889 HB2 HIS 110 HB2 HIS 110 -9.364 -2.131 -2.364 890 HB3 HIS 110 HB1 HIS 110 -8.735 -3.761 -2.604 891 HD1 HIS 110 HD1 HIS 110 -9.599 -5.583 -0.760 892 HD2 HIS 110 HD2 HIS 110 -11.822 -2.071 -1.079 893 HE1 HIS 110 HE1 HIS 110 -11.833 -6.047 0.337 894 H MET 111 HN MET 111 -7.487 -0.248 -1.063 895 HA MET 111 HA MET 111 -9.367 0.600 0.949 896 HB2 MET 111 HB2 MET 111 -7.448 1.824 2.196 897 HB3 MET 111 HB1 MET 111 -7.712 0.115 2.534 898 HG2 MET 111 HG2 MET 111 -5.930 -0.504 0.981 899 HG3 MET 111 HG1 MET 111 -5.697 1.188 0.541 900 HE1 MET 111 HE1 MET 111 -4.134 2.935 3.304 901 HE2 MET 111 HE2 MET 111 -5.308 2.958 1.992 902 HE3 MET 111 HE3 MET 111 -5.844 2.706 3.659 903 H MET 112 HN MET 112 -9.719 2.851 0.901 904 HA MET 112 HA MET 112 -8.613 4.198 -1.496 905 HB2 MET 112 HB2 MET 112 -11.121 3.856 -1.285 906 HB3 MET 112 HB1 MET 112 -11.076 4.983 0.066 907 HG2 MET 112 HG2 MET 112 -11.597 6.318 -1.825 908 HG3 MET 112 HG1 MET 112 -9.885 6.603 -1.516 909 HE1 MET 112 HE1 MET 112 -11.938 4.493 -4.951 910 HE2 MET 112 HE2 MET 112 -12.561 4.842 -3.341 911 HE3 MET 112 HE3 MET 112 -12.209 6.163 -4.464 912 H ARG 113 HN ARG 113 -7.727 6.262 -1.336 913 HA ARG 113 HA ARG 113 -7.404 7.367 1.390 914 HB2 ARG 113 HB2 ARG 113 -5.275 7.018 -0.714 915 HB3 ARG 113 HB1 ARG 113 -5.087 8.038 0.710 916 HG2 ARG 113 HG2 ARG 113 -5.518 6.087 2.164 917 HG3 ARG 113 HG1 ARG 113 -5.682 5.065 0.735 918 HD2 ARG 113 HD2 ARG 113 -3.402 5.303 0.160 919 HD3 ARG 113 HD1 ARG 113 -3.196 6.711 1.197 920 HE ARG 113 HE ARG 113 -3.053 3.938 2.005 921 HH11 ARG 113 HH21 ARG 113 -3.693 7.204 2.954 922 HH12 ARG 113 HH22 ARG 113 -3.289 6.945 4.619 923 HH21 ARG 113 HH11 ARG 113 -2.519 3.593 4.188 924 HH22 ARG 113 HH12 ARG 113 -2.625 4.902 5.317 925 H LEU 114 HN LEU 114 -7.803 9.482 1.590 926 HA LEU 114 HA LEU 114 -8.260 11.048 -0.870 927 HB2 LEU 114 HB2 LEU 114 -10.259 10.875 0.469 928 HB3 LEU 114 HB1 LEU 114 -9.375 11.321 1.922 929 HG LEU 114 HG LEU 114 -8.880 13.555 0.892 930 HD11 LEU 114 HD11 LEU 114 -10.493 14.095 -1.081 931 HD12 LEU 114 HD12 LEU 114 -9.003 13.218 -1.429 932 HD13 LEU 114 HD13 LEU 114 -10.531 12.347 -1.321 933 HD21 LEU 114 HD21 LEU 114 -11.339 14.330 0.949 934 HD22 LEU 114 HD22 LEU 114 -11.726 12.645 1.298 935 HD23 LEU 114 HD23 LEU 114 -10.695 13.559 2.398 936 H TYR 115 HN TYR 115 -6.929 12.581 -1.332 937 HA TYR 115 HA TYR 115 -5.021 13.587 0.672 938 HB2 TYR 115 HB2 TYR 115 -4.988 13.529 -2.342 939 HB3 TYR 115 HB1 TYR 115 -3.814 14.435 -1.400 940 HD1 TYR 115 HD1 TYR 115 -5.343 10.992 -1.401 941 HD2 TYR 115 HD2 TYR 115 -1.788 13.374 -1.011 942 HE1 TYR 115 HE1 TYR 115 -3.992 8.937 -1.128 943 HE2 TYR 115 HE2 TYR 115 -0.441 11.315 -0.739 944 HH TYR 115 HH TYR 115 -1.991 8.121 -0.603 945 H SER 116 HN SER 116 -4.423 15.838 0.561 946 HA SER 116 HA SER 116 -6.496 17.663 -0.509 947 HB2 SER 116 HB2 SER 116 -6.788 17.424 1.952 948 HB3 SER 116 HB1 SER 116 -5.102 17.896 2.182 949 HG SER 116 HG SER 116 -7.290 19.427 1.727 950 H ARG 117 HN ARG 117 -5.603 19.473 -1.582 951 HA ARG 117 HA ARG 117 -2.780 19.398 -2.067 952 HB2 ARG 117 HB2 ARG 117 -4.628 20.191 -3.668 953 HB3 ARG 117 HB1 ARG 117 -4.644 21.680 -2.727 954 HG2 ARG 117 HG2 ARG 117 -3.149 22.017 -4.593 955 HG3 ARG 117 HG1 ARG 117 -2.169 21.891 -3.135 956 HD2 ARG 117 HD2 ARG 117 -2.699 19.337 -4.581 957 HD3 ARG 117 HD1 ARG 117 -1.632 20.483 -5.383 958 HE ARG 117 HE ARG 117 -1.039 18.964 -3.008 959 HH11 ARG 117 HH21 ARG 117 -0.435 21.869 -4.789 960 HH12 ARG 117 HH22 ARG 117 1.142 22.116 -4.118 961 HH21 ARG 117 HH11 ARG 117 1.029 19.282 -2.123 962 HH22 ARG 117 HH12 ARG 117 1.971 20.652 -2.609 963 H SER 118 HN SER 118 -4.805 20.811 0.286 964 HA SER 118 HA SER 118 -2.530 22.349 1.360 965 HB2 SER 118 HB2 SER 118 -3.962 23.980 0.268 966 HB3 SER 118 HB1 SER 118 -5.382 23.327 1.081 967 HG SER 118 HG SER 118 -4.122 23.826 3.077 968 HA PRO 119 HA PRO 119 -3.151 20.231 5.199 969 HB2 PRO 119 HB2 PRO 119 -3.408 23.013 6.309 970 HB3 PRO 119 HB1 PRO 119 -2.459 21.641 6.920 971 HG2 PRO 119 HG2 PRO 119 -1.347 23.649 5.514 972 HG3 PRO 119 HG1 PRO 119 -0.752 21.984 5.433 973 HD2 PRO 119 HD2 PRO 119 -2.152 23.547 3.363 974 HD3 PRO 119 HD1 PRO 119 -1.223 22.042 3.198 975 H GLU 120 HN GLU 120 -5.373 22.664 4.055 976 HA GLU 120 HA GLU 120 -7.437 22.033 5.984 977 HB2 GLU 120 HB2 GLU 120 -7.633 23.695 3.467 978 HB3 GLU 120 HB1 GLU 120 -8.745 23.699 4.836 979 HG2 GLU 120 HG2 GLU 120 -6.906 24.496 6.303 980 HG3 GLU 120 HG1 GLU 120 -5.838 24.556 4.901 981 H VAL 121 HN VAL 121 -9.568 21.389 5.255 982 HA VAL 121 HA VAL 121 -9.474 19.450 3.012 983 HB VAL 121 HB VAL 121 -11.148 19.285 5.530 984 HG11 VAL 121 HG11 VAL 121 -10.667 17.379 3.220 985 HG12 VAL 121 HG12 VAL 121 -11.516 16.949 4.705 986 HG13 VAL 121 HG13 VAL 121 -12.187 18.175 3.629 987 HG21 VAL 121 HG21 VAL 121 -9.605 17.418 6.115 988 HG22 VAL 121 HG22 VAL 121 -8.615 17.824 4.713 989 HG23 VAL 121 HG23 VAL 121 -8.772 18.971 6.044 990 H SER 122 HN SER 122 -10.845 19.826 1.390 991 HA SER 122 HA SER 122 -12.789 21.968 1.618 992 HB2 SER 122 HB2 SER 122 -11.299 21.621 -0.389 993 HB3 SER 122 HB1 SER 122 -12.257 20.191 -0.762 994 HG SER 122 HG SER 122 -12.853 22.857 -1.043 995 HA PRO 123 HA PRO 123 -16.150 19.248 2.907 996 HB2 PRO 123 HB2 PRO 123 -17.676 21.184 1.188 997 HB3 PRO 123 HB1 PRO 123 -18.075 20.557 2.801 998 HG2 PRO 123 HG2 PRO 123 -17.053 22.998 2.478 999 HG3 PRO 123 HG1 PRO 123 -16.618 21.986 3.866 1000 HD2 PRO 123 HD2 PRO 123 -14.973 22.723 1.502 1001 HD3 PRO 123 HD1 PRO 123 -14.456 22.231 3.131 1002 H ALA 124 HN ALA 124 -15.569 20.240 -0.419 1003 HA ALA 124 HA ALA 124 -17.255 18.226 -1.600 1004 HB1 ALA 124 HB1 ALA 124 -16.423 18.999 -3.697 1005 HB2 ALA 124 HB2 ALA 124 -14.999 19.717 -2.945 1006 HB3 ALA 124 HB3 ALA 124 -16.590 20.429 -2.679 1007 H ALA 125 HN ALA 125 -13.851 18.552 -0.789 1008 HA ALA 125 HA ALA 125 -12.851 16.309 -2.168 1009 HB1 ALA 125 HB1 ALA 125 -11.914 17.545 0.432 1010 HB2 ALA 125 HB2 ALA 125 -11.397 18.022 -1.184 1011 HB3 ALA 125 HB3 ALA 125 -10.982 16.425 -0.559 1012 H THR 126 HN THR 126 -14.335 16.671 0.984 1013 HA THR 126 HA THR 126 -13.867 13.943 1.793 1014 HB THR 126 HB THR 126 -16.039 15.571 3.054 1015 HG1 THR 126 HG1 THR 126 -14.401 16.725 4.178 1016 HG21 THR 126 HG21 THR 126 -13.728 14.117 4.345 1017 HG22 THR 126 HG22 THR 126 -15.304 14.503 5.036 1018 HG23 THR 126 HG23 THR 126 -15.166 13.255 3.798 1019 H ALA 127 HN ALA 127 -16.413 15.711 0.154 1020 HA ALA 127 HA ALA 127 -18.426 13.705 0.398 1021 HB1 ALA 127 HB1 ALA 127 -19.589 15.086 -1.267 1022 HB2 ALA 127 HB2 ALA 127 -18.119 16.041 -1.470 1023 HB3 ALA 127 HB3 ALA 127 -18.962 16.038 0.080 1024 H ILE 128 HN ILE 128 -16.343 14.703 -2.359 1025 HA ILE 128 HA ILE 128 -17.381 12.799 -4.174 1026 HB ILE 128 HB ILE 128 -15.751 14.865 -4.484 1027 HG12 ILE 128 HG12 ILE 128 -16.677 13.651 -6.348 1028 HG13 ILE 128 HG11 ILE 128 -14.951 13.855 -6.609 1029 HG21 ILE 128 HG21 ILE 128 -13.937 13.811 -3.086 1030 HG22 ILE 128 HG22 ILE 128 -13.738 12.603 -4.356 1031 HG23 ILE 128 HG23 ILE 128 -13.420 14.303 -4.696 1032 HD11 ILE 128 HD11 ILE 128 -16.448 11.366 -5.825 1033 HD12 ILE 128 HD12 ILE 128 -15.302 11.589 -7.144 1034 HD13 ILE 128 HD13 ILE 128 -14.726 11.518 -5.479 1035 H PHE 129 HN PHE 129 -14.929 12.867 -1.805 1036 HA PHE 129 HA PHE 129 -13.702 10.378 -2.147 1037 HB2 PHE 129 HB2 PHE 129 -12.752 12.081 -0.732 1038 HB3 PHE 129 HB1 PHE 129 -14.162 12.054 0.322 1039 HD1 PHE 129 HD1 PHE 129 -12.211 9.193 -1.186 1040 HD2 PHE 129 HD2 PHE 129 -13.409 11.257 2.390 1041 HE1 PHE 129 HE1 PHE 129 -11.200 7.407 0.189 1042 HE2 PHE 129 HE2 PHE 129 -12.381 9.469 3.747 1043 HZ PHE 129 HZ PHE 129 -11.274 7.546 2.655 1044 H ARG 130 HN ARG 130 -16.478 11.319 -0.129 1045 HA ARG 130 HA ARG 130 -16.913 8.711 0.950 1046 HB2 ARG 130 HB2 ARG 130 -18.533 11.244 0.820 1047 HB3 ARG 130 HB1 ARG 130 -19.266 9.750 1.404 1048 HG2 ARG 130 HG2 ARG 130 -17.594 9.538 3.146 1049 HG3 ARG 130 HG1 ARG 130 -16.691 10.910 2.505 1050 HD2 ARG 130 HD2 ARG 130 -18.553 12.412 3.002 1051 HD3 ARG 130 HD1 ARG 130 -19.531 11.054 3.553 1052 HE ARG 130 HE ARG 130 -17.036 11.299 4.979 1053 HH11 ARG 130 HH21 ARG 130 -20.312 12.381 4.702 1054 HH12 ARG 130 HH22 ARG 130 -20.444 12.844 6.364 1055 HH21 ARG 130 HH11 ARG 130 -17.203 11.906 7.161 1056 HH22 ARG 130 HH12 ARG 130 -18.684 12.576 7.757 1057 H LYS 131 HN LYS 131 -18.089 10.441 -1.880 1058 HA LYS 131 HA LYS 131 -20.217 8.807 -2.632 1059 HB2 LYS 131 HB2 LYS 131 -19.530 10.940 -3.762 1060 HB3 LYS 131 HB1 LYS 131 -18.204 10.054 -4.518 1061 HG2 LYS 131 HG2 LYS 131 -19.852 8.486 -5.519 1062 HG3 LYS 131 HG1 LYS 131 -21.159 9.439 -4.816 1063 HD2 LYS 131 HD2 LYS 131 -20.375 11.423 -6.076 1064 HD3 LYS 131 HD1 LYS 131 -19.103 10.444 -6.807 1065 HE2 LYS 131 HE2 LYS 131 -20.964 8.889 -7.621 1066 HE3 LYS 131 HE1 LYS 131 -22.093 10.162 -7.156 1067 HZ1 LYS 131 HZ1 LYS 131 -21.538 10.428 -9.448 1068 HZ2 LYS 131 HZ2 LYS 131 -20.802 11.692 -8.583 1069 HZ3 LYS 131 HZ3 LYS 131 -19.873 10.376 -9.114 1070 H LEU 132 HN LEU 132 -16.791 8.537 -3.565 1071 HA LEU 132 HA LEU 132 -17.007 6.130 -5.001 1072 HB2 LEU 132 HB2 LEU 132 -14.812 7.681 -3.714 1073 HB3 LEU 132 HB1 LEU 132 -14.471 5.990 -4.050 1074 HG LEU 132 HG LEU 132 -13.878 7.737 -5.863 1075 HD11 LEU 132 HD11 LEU 132 -14.796 6.124 -7.677 1076 HD12 LEU 132 HD12 LEU 132 -13.677 5.486 -6.474 1077 HD13 LEU 132 HD13 LEU 132 -15.406 5.182 -6.317 1078 HD21 LEU 132 HD21 LEU 132 -16.366 8.667 -5.604 1079 HD22 LEU 132 HD22 LEU 132 -15.536 8.697 -7.156 1080 HD23 LEU 132 HD23 LEU 132 -16.708 7.428 -6.812 1081 H ALA 133 HN ALA 133 -16.143 6.715 -1.592 1082 HA ALA 133 HA ALA 133 -15.730 4.063 -0.847 1083 HB1 ALA 133 HB1 ALA 133 -15.269 6.105 0.558 1084 HB2 ALA 133 HB2 ALA 133 -16.017 4.758 1.414 1085 HB3 ALA 133 HB3 ALA 133 -16.992 6.146 0.932 1086 H GLY 134 HN GLY 134 -18.761 5.899 -1.196 1087 HA2 GLY 134 HA2 GLY 134 -20.440 3.987 0.055 1088 HA3 GLY 134 HA1 GLY 134 -20.947 5.241 -1.072 1089 H GLU 135 HN GLU 135 -19.339 4.471 -3.281 1090 HA GLU 135 HA GLU 135 -20.992 2.591 -4.544 1091 HB2 GLU 135 HB2 GLU 135 -18.139 3.400 -5.170 1092 HB3 GLU 135 HB1 GLU 135 -19.158 2.438 -6.240 1093 HG2 GLU 135 HG2 GLU 135 -19.919 5.183 -5.213 1094 HG3 GLU 135 HG1 GLU 135 -19.157 4.898 -6.776 1095 H ARG 136 HN ARG 136 -18.265 2.259 -2.444 1096 HA ARG 136 HA ARG 136 -17.959 -0.599 -3.028 1097 HB2 ARG 136 HB2 ARG 136 -16.060 1.188 -2.529 1098 HB3 ARG 136 HB1 ARG 136 -16.449 0.811 -0.853 1099 HG2 ARG 136 HG2 ARG 136 -14.811 -0.788 -1.289 1100 HG3 ARG 136 HG1 ARG 136 -16.266 -1.697 -1.693 1101 HD2 ARG 136 HD2 ARG 136 -15.939 -0.870 -4.094 1102 HD3 ARG 136 HD1 ARG 136 -14.344 -0.324 -3.584 1103 HE ARG 136 HE ARG 136 -13.648 -2.536 -3.591 1104 HH11 ARG 136 HH21 ARG 136 -17.102 -2.322 -3.568 1105 HH12 ARG 136 HH22 ARG 136 -17.347 -4.022 -3.795 1106 HH21 ARG 136 HH11 ARG 136 -13.962 -4.766 -3.887 1107 HH22 ARG 136 HH12 ARG 136 -15.568 -5.405 -3.976 1108 H ASN 137 HN ASN 137 -20.171 1.031 -1.470 1109 HA ASN 137 HA ASN 137 -21.673 0.596 0.221 1110 HB2 ASN 137 HB2 ASN 137 -20.338 -2.073 0.208 1111 HB3 ASN 137 HB1 ASN 137 -21.930 -1.726 0.867 1112 HD21 ASN 137 HD21 ASN 137 -21.717 0.211 -1.807 1113 HD22 ASN 137 HD22 ASN 137 -22.390 -0.827 -2.971 1114 H TYR 138 HN TYR 138 -19.262 1.799 0.982 1115 HA TYR 138 HA TYR 138 -18.322 0.538 3.432 1116 HB2 TYR 138 HB2 TYR 138 -17.574 2.983 1.878 1117 HB3 TYR 138 HB1 TYR 138 -17.155 2.928 3.583 1118 HD1 TYR 138 HD1 TYR 138 -17.341 -0.037 1.354 1119 HD2 TYR 138 HD2 TYR 138 -14.793 2.759 3.370 1120 HE1 TYR 138 HE1 TYR 138 -15.384 -1.472 0.856 1121 HE2 TYR 138 HE2 TYR 138 -12.827 1.331 2.866 1122 HH TYR 138 HH TYR 138 -12.789 -1.007 0.596 1123 H THR 139 HN THR 139 -18.303 1.688 5.461 1124 HA THR 139 HA THR 139 -20.680 3.405 5.897 1125 HB THR 139 HB THR 139 -21.331 2.176 7.715 1126 HG1 THR 139 HG1 THR 139 -19.216 2.697 8.689 1127 HG21 THR 139 HG21 THR 139 -20.854 0.563 5.715 1128 HG22 THR 139 HG22 THR 139 -19.528 -0.017 6.721 1129 HG23 THR 139 HG23 THR 139 -21.187 -0.125 7.304 1130 H ASP 140 HN ASP 140 -20.428 4.960 7.669 1131 HA ASP 140 HA ASP 140 -18.268 6.573 7.478 1132 HB2 ASP 140 HB2 ASP 140 -18.856 7.513 9.668 1133 HB3 ASP 140 HB1 ASP 140 -20.293 7.187 8.701 1134 H GLU 141 HN GLU 141 -18.552 4.128 10.135 1135 HA GLU 141 HA GLU 141 -16.077 4.617 11.270 1136 HB2 GLU 141 HB2 GLU 141 -16.240 2.127 11.964 1137 HB3 GLU 141 HB1 GLU 141 -17.504 3.232 12.501 1138 HG2 GLU 141 HG2 GLU 141 -18.986 2.504 10.736 1139 HG3 GLU 141 HG1 GLU 141 -17.707 1.544 9.998 1140 H MET 142 HN MET 142 -16.760 3.069 8.259 1141 HA MET 142 HA MET 142 -14.276 1.608 8.103 1142 HB2 MET 142 HB2 MET 142 -16.034 2.352 5.779 1143 HB3 MET 142 HB1 MET 142 -14.991 0.940 5.962 1144 HG2 MET 142 HG2 MET 142 -16.628 0.673 8.150 1145 HG3 MET 142 HG1 MET 142 -17.727 1.399 6.985 1146 HE1 MET 142 HE1 MET 142 -16.048 -1.847 8.198 1147 HE2 MET 142 HE2 MET 142 -15.362 -2.476 6.703 1148 HE3 MET 142 HE3 MET 142 -14.835 -0.910 7.333 1149 H VAL 143 HN VAL 143 -15.283 4.793 7.541 1150 HA VAL 143 HA VAL 143 -12.709 5.424 6.214 1151 HB VAL 143 HB VAL 143 -14.903 5.610 4.826 1152 HG11 VAL 143 HG11 VAL 143 -16.090 6.832 6.705 1153 HG12 VAL 143 HG12 VAL 143 -15.088 8.230 6.325 1154 HG13 VAL 143 HG13 VAL 143 -16.205 7.591 5.120 1155 HG21 VAL 143 HG21 VAL 143 -12.793 7.742 5.117 1156 HG22 VAL 143 HG22 VAL 143 -12.924 6.486 3.887 1157 HG23 VAL 143 HG23 VAL 143 -14.040 7.852 3.872 1158 H ALA 144 HN ALA 144 -11.438 6.652 7.446 1159 HA ALA 144 HA ALA 144 -12.682 8.286 9.587 1160 HB1 ALA 144 HB1 ALA 144 -9.850 7.267 9.679 1161 HB2 ALA 144 HB2 ALA 144 -11.191 6.211 10.118 1162 HB3 ALA 144 HB3 ALA 144 -10.918 7.706 11.013 1163 H MET 145 HN MET 145 -12.484 10.428 9.388 1164 HA MET 145 HA MET 145 -10.643 11.624 7.511 1165 HB2 MET 145 HB2 MET 145 -12.156 13.183 9.598 1166 HB3 MET 145 HB1 MET 145 -11.713 13.668 7.964 1167 HG2 MET 145 HG2 MET 145 -13.703 11.463 8.550 1168 HG3 MET 145 HG1 MET 145 -14.164 13.138 8.311 1169 HE1 MET 145 HE1 MET 145 -12.165 10.114 5.976 1170 HE2 MET 145 HE2 MET 145 -13.458 9.927 7.151 1171 HE3 MET 145 HE3 MET 145 -13.831 9.973 5.428 1172 H LEU 146 HN LEU 146 -8.721 12.731 7.992 1173 HA LEU 146 HA LEU 146 -7.825 12.467 10.761 1174 HB2 LEU 146 HB2 LEU 146 -6.824 11.277 8.521 1175 HB3 LEU 146 HB1 LEU 146 -5.813 12.716 8.611 1176 HG LEU 146 HG LEU 146 -5.253 12.185 10.897 1177 HD11 LEU 146 HD11 LEU 146 -5.953 9.543 11.342 1178 HD12 LEU 146 HD12 LEU 146 -6.757 10.933 12.065 1179 HD13 LEU 146 HD13 LEU 146 -7.406 10.204 10.596 1180 HD21 LEU 146 HD21 LEU 146 -4.855 9.740 9.202 1181 HD22 LEU 146 HD22 LEU 146 -3.962 11.242 8.971 1182 HD23 LEU 146 HD23 LEU 146 -3.802 10.343 10.475 1183 HA PRO 147 HA PRO 147 -7.421 16.934 10.771 1184 HB2 PRO 147 HB2 PRO 147 -6.257 17.236 13.180 1185 HB3 PRO 147 HB1 PRO 147 -7.930 16.648 13.034 1186 HG2 PRO 147 HG2 PRO 147 -5.408 15.053 13.363 1187 HG3 PRO 147 HG1 PRO 147 -6.913 14.955 14.299 1188 HD2 PRO 147 HD2 PRO 147 -6.406 13.248 12.299 1189 HD3 PRO 147 HD1 PRO 147 -8.052 13.833 12.608 1190 H ARG 148 HN ARG 148 -5.782 18.615 10.869 1191 HA ARG 148 HA ARG 148 -3.369 17.961 9.506 1192 HB2 ARG 148 HB2 ARG 148 -2.867 20.392 9.819 1193 HB3 ARG 148 HB1 ARG 148 -4.437 20.075 9.080 1194 HG2 ARG 148 HG2 ARG 148 -5.531 20.333 11.275 1195 HG3 ARG 148 HG1 ARG 148 -3.964 20.639 12.024 1196 HD2 ARG 148 HD2 ARG 148 -4.809 22.337 9.696 1197 HD3 ARG 148 HD1 ARG 148 -5.507 22.655 11.279 1198 HE ARG 148 HE ARG 148 -3.379 23.299 12.068 1199 HH11 ARG 148 HH21 ARG 148 -3.312 22.157 8.795 1200 HH12 ARG 148 HH22 ARG 148 -1.732 22.786 8.468 1201 HH21 ARG 148 HH11 ARG 148 -1.311 24.119 11.638 1202 HH22 ARG 148 HH12 ARG 148 -0.601 23.894 10.075 1203 H GLN 149 HN GLN 149 -4.131 17.902 12.821 1204 HA GLN 149 HA GLN 149 -2.047 18.848 14.246 1205 HB2 GLN 149 HB2 GLN 149 -3.284 16.099 14.447 1206 HB3 GLN 149 HB1 GLN 149 -2.170 16.749 15.650 1207 HG2 GLN 149 HG2 GLN 149 -3.668 18.654 16.038 1208 HG3 GLN 149 HG1 GLN 149 -4.769 18.058 14.797 1209 HE21 GLN 149 HE21 GLN 149 -6.101 18.261 17.066 1210 HE22 GLN 149 HE22 GLN 149 -6.227 16.792 17.909 1211 H GLU 150 HN GLU 150 0.114 18.747 14.165 1212 HA GLU 150 HA GLU 150 1.386 16.400 12.872 1213 HB2 GLU 150 HB2 GLU 150 3.007 17.895 11.829 1214 HB3 GLU 150 HB1 GLU 150 1.371 18.325 11.329 1215 HG2 GLU 150 HG2 GLU 150 1.353 20.050 13.173 1216 HG3 GLU 150 HG1 GLU 150 3.063 19.708 13.426 1217 H GLU 151 HN GLU 151 3.125 15.576 13.850 1218 HA GLU 151 HA GLU 151 4.216 16.988 16.221 1219 HB2 GLU 151 HB2 GLU 151 3.884 14.003 15.797 1220 HB3 GLU 151 HB1 GLU 151 4.624 14.765 17.205 1221 HG2 GLU 151 HG2 GLU 151 1.773 15.244 16.292 1222 HG3 GLU 151 HG1 GLU 151 2.236 14.145 17.590 1223 H CYS 152 HN CYS 152 4.764 15.116 13.345 1224 HA CYS 152 HA CYS 152 7.638 15.779 13.449 1225 HB2 CYS 152 HB2 CYS 152 6.385 13.082 12.951 1226 HB3 CYS 152 HB1 CYS 152 7.974 13.487 12.301 1227 H THR 153 HN THR 153 8.630 15.834 11.314 1228 HA THR 153 HA THR 153 6.845 15.804 9.004 1229 HB THR 153 HB THR 153 7.484 18.119 8.351 1230 HG1 THR 153 HG1 THR 153 8.211 19.362 10.300 1231 HG21 THR 153 HG21 THR 153 6.183 18.105 11.079 1232 HG22 THR 153 HG22 THR 153 5.858 19.190 9.727 1233 HG23 THR 153 HG23 THR 153 5.361 17.500 9.641 1234 H VAL 154 HN VAL 154 8.021 16.063 6.967 1235 HA VAL 154 HA VAL 154 10.787 15.057 7.207 1236 HB VAL 154 HB VAL 154 9.572 13.480 6.003 1237 HG11 VAL 154 HG11 VAL 154 7.990 14.137 4.152 1238 HG12 VAL 154 HG12 VAL 154 7.484 14.663 5.759 1239 HG13 VAL 154 HG13 VAL 154 8.214 15.816 4.642 1240 HG21 VAL 154 HG21 VAL 154 10.399 13.538 3.749 1241 HG22 VAL 154 HG22 VAL 154 10.527 15.294 3.776 1242 HG23 VAL 154 HG23 VAL 154 11.614 14.313 4.762 1243 H ASP 155 HN ASP 155 12.294 15.720 5.576 1244 HA ASP 155 HA ASP 155 11.990 18.586 4.908 1245 HB2 ASP 155 HB2 ASP 155 13.862 18.208 6.353 1246 HB3 ASP 155 HB1 ASP 155 14.477 16.931 5.316 1247 H GLU 156 HN GLU 156 13.203 19.288 3.027 1248 HA GLU 156 HA GLU 156 12.355 17.786 0.708 1249 HB2 GLU 156 HB2 GLU 156 13.092 19.693 -0.570 1250 HB3 GLU 156 HB1 GLU 156 12.256 20.282 0.866 1251 HG2 GLU 156 HG2 GLU 156 14.537 20.435 1.986 1252 HG3 GLU 156 HG1 GLU 156 15.240 20.150 0.395 1253 H VAL 157 HN VAL 157 14.566 16.779 2.525 1254 HA VAL 157 HA VAL 157 17.079 16.901 1.407 1255 HB VAL 157 HB VAL 157 17.168 14.408 2.222 1256 HG11 VAL 157 HG11 VAL 157 16.479 16.656 4.133 1257 HG12 VAL 157 HG12 VAL 157 17.351 15.179 4.543 1258 HG13 VAL 157 HG13 VAL 157 18.079 16.360 3.453 1259 HG21 VAL 157 HG21 VAL 157 15.361 13.705 3.609 1260 HG22 VAL 157 HG22 VAL 157 14.615 15.302 3.566 1261 HG23 VAL 157 HG23 VAL 157 14.613 14.287 2.122 1262 HN1 EB4 200 H17 EB4 200 -0.009 -0.276 5.573 1263 H8 EB4 200 H8 EB4 200 4.622 1.347 0.791 1264 HN2 EB4 200 H25 EB4 200 3.144 0.405 6.155 1265 H9 EB4 200 H9 EB4 200 0.670 6.591 2.875 1266 H10 EB4 200 H10 EB4 200 -2.958 -0.227 0.435 1267 HN3 EB4 200 H32 EB4 200 0.645 2.542 7.036 1268 H7 EB4 200 H7 EB4 200 -1.323 1.629 0.269 1269 H11 EB4 200 H11 EB4 200 6.426 -0.229 1.430 1270 H12 EB4 200 H12 EB4 200 -0.194 7.946 4.766 1271 H15 EB4 200 H15 EB4 200 -0.355 6.954 7.032 1272 H14 EB4 200 H14 EB4 200 6.584 -1.054 3.763 1273 H13 EB4 200 H13 EB4 200 -3.054 -1.614 2.490 1274 H22 EB4 200 H22 EB4 200 -1.381 -2.511 6.930 1275 H30 EB4 200 H30 EB4 200 -0.737 0.775 9.969 1276 H30A EB4 200 H9N EB4 200 -1.677 1.861 8.831 1277 H24 EB4 200 H24 EB4 200 0.139 3.099 9.904 1278 H28 EB4 200 H28 EB4 200 0.756 -3.027 8.010 1279 H28A EB4 200 H9L EB4 200 0.795 -3.236 6.251 1280 H23 EB4 200 H23 EB4 200 4.718 -1.095 8.196 1281 H29 EB4 200 H29 EB4 200 3.642 0.362 9.869 1282 H29A EB4 200 H9M EB4 200 4.593 1.338 8.645 1283 H21 ACD 300 HA3 ACD 300 1.267 9.887 -10.400 1284 H22 ACD 300 HA4 ACD 300 1.343 11.424 -9.508 1285 H31 ACD 300 HA1 ACD 300 -1.164 11.443 -9.409 1286 H32 ACD 300 HA2 ACD 300 -1.179 9.852 -10.202 1287 H41 ACD 300 HA0 ACD 300 0.192 10.455 -7.544 1288 H42 ACD 300 HAZ ACD 300 0.053 8.863 -8.325 1289 H5 ACD 300 HAY ACD 300 -2.702 9.686 -8.161 1290 H6 ACD 300 HAX ACD 300 -2.917 9.266 -5.589 1291 H71 ACD 300 HAV ACD 300 0.022 10.086 -5.504 1292 H72 ACD 300 HAW ACD 300 -0.947 9.525 -4.124 1293 H8 ACD 300 HAU ACD 300 0.239 7.560 -6.260 1294 H9 ACD 300 HAT ACD 300 0.621 6.077 -4.150 1295 H101 ACD 300 HAR ACD 300 0.678 7.750 -2.068 1296 H102 ACD 300 HAS ACD 300 -0.798 8.481 -2.736 1297 H11 ACD 300 HAQ ACD 300 -2.029 6.201 -2.359 1298 H12 ACD 300 HAP ACD 300 -1.192 5.091 -0.152 1299 H131 ACD 300 HAN ACD 300 1.595 6.263 -0.748 1300 H132 ACD 300 HAO ACD 300 0.963 5.608 0.841 1301 H14 ACD 300 HAM ACD 300 -0.337 7.990 0.889 1302 H15 ACD 300 HAL ACD 300 1.705 9.624 0.891 1303 H161 ACD 300 HAJ ACD 300 3.928 8.917 0.163 1304 H162 ACD 300 HAK ACD 300 3.474 7.228 0.465 1305 H171 ACD 300 HAH ACD 300 4.064 7.613 -1.911 1306 H172 ACD 300 HAI ACD 300 2.373 7.105 -1.741 1307 H181 ACD 300 HAF ACD 300 1.684 9.519 -1.827 1308 H182 ACD 300 HAG ACD 300 3.380 9.963 -2.127 1309 H191 ACD 300 HAD ACD 300 3.372 8.459 -4.141 1310 H192 ACD 300 HAE ACD 300 1.665 8.121 -3.849 1311 H201 ACD 300 HAA ACD 300 1.865 9.867 -5.556 1312 H202 ACD 300 HAB ACD 300 2.880 10.850 -4.481 1313 H203 ACD 300 HAC ACD 300 1.169 10.576 -4.081 Start of MODEL 2 1 H1 MET 1 HT1 MET 1 1.835 18.037 -21.391 2 H2 MET 1 HT2 MET 1 2.093 19.122 -20.109 3 H3 MET 1 HT3 MET 1 3.056 19.209 -21.506 4 HA MET 1 HA MET 1 0.984 20.800 -21.087 5 HB2 MET 1 HB2 MET 1 2.697 20.819 -22.948 6 HB3 MET 1 HB1 MET 1 1.679 19.662 -23.807 7 HG2 MET 1 HG2 MET 1 -0.217 21.287 -23.654 8 HG3 MET 1 HG1 MET 1 0.890 22.455 -22.932 9 HE1 MET 1 HE1 MET 1 0.470 24.023 -26.369 10 HE2 MET 1 HE2 MET 1 -0.803 23.018 -25.679 11 HE3 MET 1 HE3 MET 1 0.158 24.075 -24.635 12 H THR 2 HN THR 2 0.744 17.548 -22.426 13 HA THR 2 HA THR 2 -1.967 17.723 -23.269 14 HB THR 2 HB THR 2 -1.874 15.295 -23.419 15 HG1 THR 2 HG1 THR 2 0.128 14.313 -22.651 16 HG21 THR 2 HG21 THR 2 -0.712 16.569 -25.161 17 HG22 THR 2 HG22 THR 2 0.752 16.605 -24.178 18 HG23 THR 2 HG23 THR 2 0.159 15.073 -24.820 19 H VAL 3 HN VAL 3 -0.514 17.527 -20.193 20 HA VAL 3 HA VAL 3 -3.136 17.278 -18.930 21 HB VAL 3 HB VAL 3 -2.089 15.592 -17.279 22 HG11 VAL 3 HG11 VAL 3 -3.854 15.052 -18.962 23 HG12 VAL 3 HG12 VAL 3 -2.585 14.689 -20.132 24 HG13 VAL 3 HG13 VAL 3 -2.751 13.705 -18.678 25 HG21 VAL 3 HG21 VAL 3 -0.276 14.229 -18.168 26 HG22 VAL 3 HG22 VAL 3 -0.266 15.162 -19.665 27 HG23 VAL 3 HG23 VAL 3 0.236 15.917 -18.151 28 HA PRO 4 HA PRO 4 -1.844 20.442 -16.137 29 HB2 PRO 4 HB2 PRO 4 -2.225 18.350 -14.008 30 HB3 PRO 4 HB1 PRO 4 -2.756 20.045 -14.023 31 HG2 PRO 4 HG2 PRO 4 -4.435 18.028 -14.578 32 HG3 PRO 4 HG1 PRO 4 -4.566 19.610 -15.364 33 HD2 PRO 4 HD2 PRO 4 -3.726 17.031 -16.532 34 HD3 PRO 4 HD1 PRO 4 -4.257 18.514 -17.352 35 H ASP 5 HN ASP 5 -0.070 21.024 -14.714 36 HA ASP 5 HA ASP 5 2.355 19.626 -15.319 37 HB2 ASP 5 HB2 ASP 5 2.172 22.108 -15.013 38 HB3 ASP 5 HB1 ASP 5 1.927 21.828 -13.290 39 H ARG 6 HN ARG 6 3.040 17.848 -14.322 40 HA ARG 6 HA ARG 6 1.905 16.885 -11.901 41 HB2 ARG 6 HB2 ARG 6 3.466 15.065 -12.071 42 HB3 ARG 6 HB1 ARG 6 2.900 15.439 -13.696 43 HG2 ARG 6 HG2 ARG 6 5.514 16.435 -12.505 44 HG3 ARG 6 HG1 ARG 6 5.361 15.074 -13.608 45 HD2 ARG 6 HD2 ARG 6 4.143 16.773 -15.168 46 HD3 ARG 6 HD1 ARG 6 4.911 17.996 -14.158 47 HE ARG 6 HE ARG 6 6.826 16.071 -15.009 48 HH11 ARG 6 HH21 ARG 6 4.892 18.731 -16.086 49 HH12 ARG 6 HH22 ARG 6 5.993 19.205 -17.336 50 HH21 ARG 6 HH11 ARG 6 8.275 16.687 -16.646 51 HH22 ARG 6 HH12 ARG 6 7.909 18.048 -17.652 52 H SER 7 HN SER 7 4.594 18.936 -12.631 53 HA SER 7 HA SER 7 6.160 18.624 -10.333 54 HB2 SER 7 HB2 SER 7 5.640 21.201 -11.829 55 HB3 SER 7 HB1 SER 7 7.033 20.833 -10.815 56 HG SER 7 HG SER 7 6.798 20.398 -13.369 57 H GLU 8 HN GLU 8 3.148 20.332 -10.866 58 HA GLU 8 HA GLU 8 3.120 21.981 -8.605 59 HB2 GLU 8 HB2 GLU 8 1.513 22.108 -10.501 60 HB3 GLU 8 HB1 GLU 8 0.749 20.631 -9.911 61 HG2 GLU 8 HG2 GLU 8 0.182 21.707 -7.806 62 HG3 GLU 8 HG1 GLU 8 1.063 23.161 -8.272 63 H ILE 9 HN ILE 9 1.708 18.698 -8.985 64 HA ILE 9 HA ILE 9 1.140 18.580 -6.141 65 HB ILE 9 HB ILE 9 -0.345 17.508 -7.868 66 HG12 ILE 9 HG12 ILE 9 0.891 15.823 -5.664 67 HG13 ILE 9 HG11 ILE 9 -0.511 16.868 -5.532 68 HG21 ILE 9 HG21 ILE 9 0.350 15.483 -8.942 69 HG22 ILE 9 HG22 ILE 9 1.652 16.642 -9.201 70 HG23 ILE 9 HG23 ILE 9 1.818 15.390 -7.970 71 HD11 ILE 9 HD11 ILE 9 -0.829 14.272 -5.810 72 HD12 ILE 9 HD12 ILE 9 -1.896 15.373 -6.659 73 HD13 ILE 9 HD13 ILE 9 -0.568 14.604 -7.515 74 H ALA 10 HN ALA 10 3.597 17.389 -8.343 75 HA ALA 10 HA ALA 10 4.686 15.525 -6.469 76 HB1 ALA 10 HB1 ALA 10 6.134 16.738 -8.821 77 HB2 ALA 10 HB2 ALA 10 5.075 15.332 -8.928 78 HB3 ALA 10 HB3 ALA 10 6.549 15.253 -7.964 79 H GLY 11 HN GLY 11 6.192 15.747 -4.948 80 HA2 GLY 11 HA2 GLY 11 8.203 17.013 -4.192 81 HA3 GLY 11 HA1 GLY 11 7.254 18.470 -4.470 82 H LYS 12 HN LYS 12 4.763 17.284 -3.516 83 HA LYS 12 HA LYS 12 5.146 16.414 -0.808 84 HB2 LYS 12 HB2 LYS 12 5.709 18.846 -0.653 85 HB3 LYS 12 HB1 LYS 12 4.073 19.214 -1.199 86 HG2 LYS 12 HG2 LYS 12 3.137 18.019 0.728 87 HG3 LYS 12 HG1 LYS 12 4.761 17.584 1.264 88 HD2 LYS 12 HD2 LYS 12 5.312 20.009 1.454 89 HD3 LYS 12 HD1 LYS 12 3.645 20.393 1.023 90 HE2 LYS 12 HE2 LYS 12 4.085 20.380 3.506 91 HE3 LYS 12 HE1 LYS 12 2.806 19.278 2.996 92 HZ1 LYS 12 HZ1 LYS 12 4.354 17.458 3.050 93 HZ2 LYS 12 HZ2 LYS 12 5.636 18.501 3.445 94 HZ3 LYS 12 HZ3 LYS 12 4.376 18.251 4.553 95 H TRP 13 HN TRP 13 3.527 14.909 -0.763 96 HA TRP 13 HA TRP 13 0.838 15.686 -1.764 97 HB2 TRP 13 HB2 TRP 13 2.254 13.018 -1.490 98 HB3 TRP 13 HB1 TRP 13 0.536 13.105 -1.781 99 HD1 TRP 13 HD1 TRP 13 3.431 15.033 -3.460 100 HE1 TRP 13 HE1 TRP 13 3.239 14.549 -5.984 101 HE3 TRP 13 HE3 TRP 13 -0.652 11.979 -3.485 102 HZ2 TRP 13 HZ2 TRP 13 1.626 13.067 -7.750 103 HZ3 TRP 13 HZ3 TRP 13 -1.515 11.055 -5.618 104 HH2 TRP 13 HH2 TRP 13 -0.394 11.610 -7.759 105 H TYR 14 HN TYR 14 -0.664 15.959 -0.094 106 HA TYR 14 HA TYR 14 0.108 15.022 2.580 107 HB2 TYR 14 HB2 TYR 14 -1.087 17.388 1.532 108 HB3 TYR 14 HB1 TYR 14 -2.291 16.620 2.555 109 HD1 TYR 14 HD1 TYR 14 1.460 16.891 2.767 110 HD2 TYR 14 HD2 TYR 14 -2.331 17.656 4.642 111 HE1 TYR 14 HE1 TYR 14 2.620 17.769 4.772 112 HE2 TYR 14 HE2 TYR 14 -1.162 18.538 6.642 113 HH TYR 14 HH TYR 14 0.795 19.066 7.541 114 H VAL 15 HN VAL 15 -0.819 13.351 3.503 115 HA VAL 15 HA VAL 15 -3.270 12.178 2.339 116 HB VAL 15 HB VAL 15 -1.212 11.050 4.250 117 HG11 VAL 15 HG11 VAL 15 -3.328 10.072 4.817 118 HG12 VAL 15 HG12 VAL 15 -3.767 9.888 3.119 119 HG13 VAL 15 HG13 VAL 15 -2.484 8.895 3.811 120 HG21 VAL 15 HG21 VAL 15 -1.775 10.726 1.304 121 HG22 VAL 15 HG22 VAL 15 -0.235 11.023 2.107 122 HG23 VAL 15 HG23 VAL 15 -0.989 9.433 2.208 123 H VAL 16 HN VAL 16 -5.180 12.637 3.367 124 HA VAL 16 HA VAL 16 -5.052 13.175 6.282 125 HB VAL 16 HB VAL 16 -6.580 14.948 6.099 126 HG11 VAL 16 HG11 VAL 16 -4.922 15.684 3.745 127 HG12 VAL 16 HG12 VAL 16 -5.081 16.492 5.294 128 HG13 VAL 16 HG13 VAL 16 -4.027 15.097 5.127 129 HG21 VAL 16 HG21 VAL 16 -6.852 14.039 3.231 130 HG22 VAL 16 HG22 VAL 16 -8.121 14.272 4.433 131 HG23 VAL 16 HG23 VAL 16 -7.317 15.669 3.718 132 H ALA 17 HN ALA 17 -6.194 10.911 4.315 133 HA ALA 17 HA ALA 17 -8.019 9.969 6.191 134 HB1 ALA 17 HB1 ALA 17 -10.125 10.648 5.613 135 HB2 ALA 17 HB2 ALA 17 -9.765 10.675 3.902 136 HB3 ALA 17 HB3 ALA 17 -9.292 12.029 4.913 137 H LEU 18 HN LEU 18 -8.422 7.845 5.830 138 HA LEU 18 HA LEU 18 -8.244 6.854 3.075 139 HB2 LEU 18 HB2 LEU 18 -6.003 6.567 3.611 140 HB3 LEU 18 HB1 LEU 18 -6.331 6.342 5.321 141 HG LEU 18 HG LEU 18 -7.435 4.245 3.506 142 HD11 LEU 18 HD11 LEU 18 -5.186 4.695 2.534 143 HD12 LEU 18 HD12 LEU 18 -4.476 4.393 4.121 144 HD13 LEU 18 HD13 LEU 18 -5.308 3.097 3.263 145 HD21 LEU 18 HD21 LEU 18 -6.603 2.788 5.348 146 HD22 LEU 18 HD22 LEU 18 -5.947 4.216 6.145 147 HD23 LEU 18 HD23 LEU 18 -7.687 4.048 5.930 148 H ALA 19 HN ALA 19 -9.330 4.965 2.742 149 HA ALA 19 HA ALA 19 -10.893 3.933 5.025 150 HB1 ALA 19 HB1 ALA 19 -11.636 4.175 2.108 151 HB2 ALA 19 HB2 ALA 19 -12.412 4.969 3.474 152 HB3 ALA 19 HB3 ALA 19 -12.561 3.226 3.269 153 H SER 20 HN SER 20 -11.463 1.652 4.849 154 HA SER 20 HA SER 20 -9.974 -0.027 3.044 155 HB2 SER 20 HB2 SER 20 -9.158 -0.183 5.940 156 HB3 SER 20 HB1 SER 20 -8.434 -1.006 4.562 157 HG SER 20 HG SER 20 -7.839 1.070 3.769 158 H ASN 21 HN ASN 21 -10.003 -2.367 3.972 159 HA ASN 21 HA ASN 21 -12.675 -2.861 5.152 160 HB2 ASN 21 HB2 ASN 21 -12.385 -3.454 2.676 161 HB3 ASN 21 HB1 ASN 21 -11.268 -4.703 3.218 162 HD21 ASN 21 HD21 ASN 21 -12.237 -6.690 3.634 163 HD22 ASN 21 HD22 ASN 21 -13.871 -6.908 4.036 164 H THR 22 HN THR 22 -9.287 -3.304 5.279 165 HA THR 22 HA THR 22 -9.419 -5.668 6.982 166 HB THR 22 HB THR 22 -7.532 -5.212 5.334 167 HG1 THR 22 HG1 THR 22 -7.571 -6.446 7.517 168 HG21 THR 22 HG21 THR 22 -6.360 -3.465 7.463 169 HG22 THR 22 HG22 THR 22 -5.926 -3.582 5.761 170 HG23 THR 22 HG23 THR 22 -7.401 -2.739 6.237 171 H GLU 23 HN GLU 23 -10.259 -5.303 8.924 172 HA GLU 23 HA GLU 23 -10.626 -2.974 10.250 173 HB2 GLU 23 HB2 GLU 23 -11.494 -5.197 10.961 174 HB3 GLU 23 HB1 GLU 23 -9.901 -5.563 11.622 175 HG2 GLU 23 HG2 GLU 23 -10.057 -3.616 13.117 176 HG3 GLU 23 HG1 GLU 23 -11.636 -3.215 12.443 177 H PHE 24 HN PHE 24 -7.628 -4.777 10.121 178 HA PHE 24 HA PHE 24 -6.283 -3.615 12.257 179 HB2 PHE 24 HB2 PHE 24 -4.873 -4.177 9.668 180 HB3 PHE 24 HB1 PHE 24 -4.320 -4.454 11.319 181 HD1 PHE 24 HD1 PHE 24 -6.466 -5.881 12.617 182 HD2 PHE 24 HD2 PHE 24 -5.056 -6.237 8.574 183 HE1 PHE 24 HE1 PHE 24 -7.336 -8.198 12.517 184 HE2 PHE 24 HE2 PHE 24 -5.927 -8.556 8.476 185 HZ PHE 24 HZ PHE 24 -7.067 -9.536 10.447 186 H PHE 25 HN PHE 25 -6.345 -2.437 8.852 187 HA PHE 25 HA PHE 25 -4.711 -0.197 9.442 188 HB2 PHE 25 HB2 PHE 25 -5.316 -1.467 7.173 189 HB3 PHE 25 HB1 PHE 25 -6.473 -0.146 7.040 190 HD1 PHE 25 HD1 PHE 25 -5.590 2.250 7.366 191 HD2 PHE 25 HD2 PHE 25 -3.044 -1.136 6.671 192 HE1 PHE 25 HE1 PHE 25 -3.751 3.772 6.674 193 HE2 PHE 25 HE2 PHE 25 -1.207 0.387 5.980 194 HZ PHE 25 HZ PHE 25 -1.564 2.839 5.982 195 H LEU 26 HN LEU 26 -8.252 -0.425 8.936 196 HA LEU 26 HA LEU 26 -8.623 2.404 9.203 197 HB2 LEU 26 HB2 LEU 26 -11.043 1.828 9.502 198 HB3 LEU 26 HB1 LEU 26 -10.316 1.178 8.038 199 HG LEU 26 HG LEU 26 -9.847 -0.883 9.789 200 HD11 LEU 26 HD11 LEU 26 -11.969 -1.251 11.031 201 HD12 LEU 26 HD12 LEU 26 -11.116 0.183 11.600 202 HD13 LEU 26 HD13 LEU 26 -12.516 0.351 10.542 203 HD21 LEU 26 HD21 LEU 26 -10.770 -1.331 7.649 204 HD22 LEU 26 HD22 LEU 26 -12.024 -1.855 8.773 205 HD23 LEU 26 HD23 LEU 26 -12.173 -0.305 7.946 206 H ARG 27 HN ARG 27 -8.611 -0.291 11.369 207 HA ARG 27 HA ARG 27 -9.691 0.943 13.672 208 HB2 ARG 27 HB2 ARG 27 -9.347 -1.449 13.667 209 HB3 ARG 27 HB1 ARG 27 -7.609 -1.245 13.449 210 HG2 ARG 27 HG2 ARG 27 -8.703 0.198 15.795 211 HG3 ARG 27 HG1 ARG 27 -8.863 -1.553 15.895 212 HD2 ARG 27 HD2 ARG 27 -6.465 -1.827 15.486 213 HD3 ARG 27 HD1 ARG 27 -6.277 -0.088 15.291 214 HE ARG 27 HE ARG 27 -7.398 -0.375 17.781 215 HH11 ARG 27 HH21 ARG 27 -4.631 -1.630 16.126 216 HH12 ARG 27 HH22 ARG 27 -3.669 -1.780 17.558 217 HH21 ARG 27 HH11 ARG 27 -6.143 -0.569 19.665 218 HH22 ARG 27 HH12 ARG 27 -4.525 -1.179 19.562 219 H GLU 28 HN GLU 28 -6.324 0.662 12.556 220 HA GLU 28 HA GLU 28 -5.354 2.361 14.681 221 HB2 GLU 28 HB2 GLU 28 -4.122 0.408 13.532 222 HB3 GLU 28 HB1 GLU 28 -3.782 1.562 12.243 223 HG2 GLU 28 HG2 GLU 28 -1.917 1.715 13.709 224 HG3 GLU 28 HG1 GLU 28 -2.908 3.122 14.084 225 H LYS 29 HN LYS 29 -5.864 2.803 11.113 226 HA LYS 29 HA LYS 29 -4.591 5.200 10.804 227 HB2 LYS 29 HB2 LYS 29 -5.801 3.903 9.025 228 HB3 LYS 29 HB1 LYS 29 -7.313 4.549 9.658 229 HG2 LYS 29 HG2 LYS 29 -6.582 5.924 7.783 230 HG3 LYS 29 HG1 LYS 29 -6.453 6.859 9.272 231 HD2 LYS 29 HD2 LYS 29 -4.136 6.839 9.251 232 HD3 LYS 29 HD1 LYS 29 -4.043 5.299 8.405 233 HE2 LYS 29 HE2 LYS 29 -4.247 6.282 6.321 234 HE3 LYS 29 HE1 LYS 29 -5.214 7.627 6.930 235 HZ1 LYS 29 HZ1 LYS 29 -3.060 8.249 8.162 236 HZ2 LYS 29 HZ2 LYS 29 -2.295 7.253 7.019 237 HZ3 LYS 29 HZ3 LYS 29 -3.186 8.601 6.505 238 H ASP 30 HN ASP 30 -7.558 4.524 12.478 239 HA ASP 30 HA ASP 30 -8.524 7.174 12.666 240 HB2 ASP 30 HB2 ASP 30 -9.866 5.102 13.066 241 HB3 ASP 30 HB1 ASP 30 -9.016 4.906 14.597 242 H LYS 31 HN LYS 31 -6.014 5.488 14.455 243 HA LYS 31 HA LYS 31 -6.141 7.489 16.570 244 HB2 LYS 31 HB2 LYS 31 -4.701 6.170 17.872 245 HB3 LYS 31 HB1 LYS 31 -5.805 5.049 17.091 246 HG2 LYS 31 HG2 LYS 31 -3.748 4.002 16.787 247 HG3 LYS 31 HG1 LYS 31 -3.959 4.854 15.277 248 HD2 LYS 31 HD2 LYS 31 -2.655 6.682 17.049 249 HD3 LYS 31 HD1 LYS 31 -1.842 5.137 17.228 250 HE2 LYS 31 HE2 LYS 31 -2.422 6.003 14.429 251 HE3 LYS 31 HE1 LYS 31 -1.172 6.888 15.294 252 HZ1 LYS 31 HZ1 LYS 31 -0.236 4.651 15.902 253 HZ2 LYS 31 HZ2 LYS 31 -1.291 3.984 14.749 254 HZ3 LYS 31 HZ3 LYS 31 -0.100 5.092 14.267 255 H MET 32 HN MET 32 -4.288 7.025 13.649 256 HA MET 32 HA MET 32 -2.115 8.702 14.659 257 HB2 MET 32 HB2 MET 32 -1.372 8.707 12.208 258 HB3 MET 32 HB1 MET 32 -1.317 7.164 13.026 259 HG2 MET 32 HG2 MET 32 -3.793 6.957 12.051 260 HG3 MET 32 HG1 MET 32 -3.166 8.108 10.885 261 HE1 MET 32 HE1 MET 32 -3.078 4.884 12.563 262 HE2 MET 32 HE2 MET 32 -2.136 3.772 11.589 263 HE3 MET 32 HE3 MET 32 -1.329 4.872 12.710 264 H LYS 33 HN LYS 33 -1.443 10.445 12.948 265 HA LYS 33 HA LYS 33 -3.757 12.255 12.578 266 HB2 LYS 33 HB2 LYS 33 -0.889 13.002 13.190 267 HB3 LYS 33 HB1 LYS 33 -2.252 14.109 13.030 268 HG2 LYS 33 HG2 LYS 33 -3.314 13.226 14.991 269 HG3 LYS 33 HG1 LYS 33 -2.188 11.870 15.067 270 HD2 LYS 33 HD2 LYS 33 -0.369 13.285 15.682 271 HD3 LYS 33 HD1 LYS 33 -1.270 14.743 15.267 272 HE2 LYS 33 HE2 LYS 33 -2.898 14.201 17.086 273 HE3 LYS 33 HE1 LYS 33 -1.879 12.835 17.543 274 HZ1 LYS 33 HZ1 LYS 33 -1.103 15.701 17.538 275 HZ2 LYS 33 HZ2 LYS 33 -1.344 14.718 18.903 276 HZ3 LYS 33 HZ3 LYS 33 -0.040 14.415 17.861 277 H MET 34 HN MET 34 -3.143 14.003 10.908 278 HA MET 34 HA MET 34 -2.992 13.016 8.407 279 HB2 MET 34 HB2 MET 34 -3.409 15.389 9.310 280 HB3 MET 34 HB1 MET 34 -1.671 15.617 9.170 281 HG2 MET 34 HG2 MET 34 -1.725 15.228 6.816 282 HG3 MET 34 HG1 MET 34 -3.388 14.660 6.902 283 HE1 MET 34 HE1 MET 34 -5.219 15.801 7.713 284 HE2 MET 34 HE2 MET 34 -4.885 17.083 8.860 285 HE3 MET 34 HE3 MET 34 -5.620 17.465 7.303 286 H ALA 35 HN ALA 35 -1.489 12.512 6.938 287 HA ALA 35 HA ALA 35 1.355 12.413 7.759 288 HB1 ALA 35 HB1 ALA 35 1.394 10.412 6.123 289 HB2 ALA 35 HB2 ALA 35 -0.361 10.425 6.288 290 HB3 ALA 35 HB3 ALA 35 0.652 10.169 7.703 291 H MET 36 HN MET 36 2.848 12.260 5.827 292 HA MET 36 HA MET 36 1.840 13.853 3.546 293 HB2 MET 36 HB2 MET 36 4.561 14.557 3.916 294 HB3 MET 36 HB1 MET 36 3.151 15.584 4.158 295 HG2 MET 36 HG2 MET 36 4.171 13.695 6.286 296 HG3 MET 36 HG1 MET 36 4.715 15.365 6.154 297 HE1 MET 36 HE1 MET 36 3.075 15.736 9.083 298 HE2 MET 36 HE2 MET 36 2.208 14.209 8.986 299 HE3 MET 36 HE3 MET 36 3.898 14.303 8.479 300 H ALA 37 HN ALA 37 3.342 13.774 1.668 301 HA ALA 37 HA ALA 37 5.103 11.468 1.494 302 HB1 ALA 37 HB1 ALA 37 3.198 10.204 1.054 303 HB2 ALA 37 HB2 ALA 37 3.709 10.669 -0.571 304 HB3 ALA 37 HB3 ALA 37 2.388 11.527 0.222 305 H ARG 38 HN ARG 38 6.210 11.318 -0.574 306 HA ARG 38 HA ARG 38 6.153 13.804 -2.193 307 HB2 ARG 38 HB2 ARG 38 8.044 14.305 -0.961 308 HB3 ARG 38 HB1 ARG 38 8.381 12.619 -0.596 309 HG2 ARG 38 HG2 ARG 38 10.095 13.620 -2.084 310 HG3 ARG 38 HG1 ARG 38 9.272 12.271 -2.855 311 HD2 ARG 38 HD2 ARG 38 8.404 13.611 -4.482 312 HD3 ARG 38 HD1 ARG 38 7.959 14.869 -3.333 313 HE ARG 38 HE ARG 38 10.642 15.143 -3.453 314 HH11 ARG 38 HH21 ARG 38 8.184 14.806 -5.866 315 HH12 ARG 38 HH22 ARG 38 9.039 15.721 -7.062 316 HH21 ARG 38 HH11 ARG 38 11.769 16.345 -5.016 317 HH22 ARG 38 HH12 ARG 38 11.069 16.592 -6.581 318 H ILE 39 HN ILE 39 6.024 13.339 -4.402 319 HA ILE 39 HA ILE 39 6.697 10.632 -5.275 320 HB ILE 39 HB ILE 39 4.338 11.281 -5.207 321 HG12 ILE 39 HG12 ILE 39 5.045 11.171 -8.122 322 HG13 ILE 39 HG11 ILE 39 5.459 9.800 -7.099 323 HG21 ILE 39 HG21 ILE 39 3.609 12.934 -6.816 324 HG22 ILE 39 HG22 ILE 39 4.663 13.610 -5.578 325 HG23 ILE 39 HG23 ILE 39 5.256 13.311 -7.206 326 HD11 ILE 39 HD11 ILE 39 3.051 9.940 -8.215 327 HD12 ILE 39 HD12 ILE 39 3.239 9.334 -6.575 328 HD13 ILE 39 HD13 ILE 39 2.710 10.991 -6.853 329 H SER 40 HN SER 40 7.937 10.504 -7.198 330 HA SER 40 HA SER 40 8.449 12.953 -8.674 331 HB2 SER 40 HB2 SER 40 10.748 11.529 -7.390 332 HB3 SER 40 HB1 SER 40 10.797 13.013 -8.321 333 HG SER 40 HG SER 40 10.576 12.846 -5.772 334 H PHE 41 HN PHE 41 9.754 12.570 -10.620 335 HA PHE 41 HA PHE 41 9.132 9.905 -11.673 336 HB2 PHE 41 HB2 PHE 41 9.844 12.496 -13.038 337 HB3 PHE 41 HB1 PHE 41 9.541 10.979 -13.884 338 HD1 PHE 41 HD2 PHE 41 8.002 13.343 -11.425 339 HD2 PHE 41 HD1 PHE 41 7.339 10.341 -14.425 340 HE1 PHE 41 HE2 PHE 41 5.562 13.769 -11.312 341 HE2 PHE 41 HE1 PHE 41 4.898 10.767 -14.311 342 HZ PHE 41 HZ PHE 41 4.010 12.481 -12.755 343 H LEU 42 HN LEU 42 10.874 8.740 -10.775 344 HA LEU 42 HA LEU 42 13.620 9.336 -11.128 345 HB2 LEU 42 HB2 LEU 42 12.155 6.688 -11.005 346 HB3 LEU 42 HB1 LEU 42 13.903 6.798 -11.109 347 HG LEU 42 HG LEU 42 12.410 8.298 -8.962 348 HD11 LEU 42 HD11 LEU 42 13.023 5.351 -9.103 349 HD12 LEU 42 HD12 LEU 42 13.080 6.175 -7.547 350 HD13 LEU 42 HD13 LEU 42 11.585 6.160 -8.481 351 HD21 LEU 42 HD21 LEU 42 14.589 7.862 -7.756 352 HD22 LEU 42 HD22 LEU 42 15.206 7.141 -9.240 353 HD23 LEU 42 HD23 LEU 42 14.764 8.847 -9.206 354 H GLY 43 HN GLY 43 11.179 7.858 -13.071 355 HA2 GLY 43 HA2 GLY 43 12.363 8.545 -15.572 356 HA3 GLY 43 HA1 GLY 43 12.483 6.812 -15.249 357 H GLU 44 HN GLU 44 10.880 7.921 -17.355 358 HA GLU 44 HA GLU 44 8.207 8.360 -16.784 359 HB2 GLU 44 HB2 GLU 44 9.231 8.472 -19.060 360 HB3 GLU 44 HB1 GLU 44 9.258 6.709 -19.098 361 HG2 GLU 44 HG2 GLU 44 6.798 6.678 -18.790 362 HG3 GLU 44 HG1 GLU 44 6.785 8.441 -18.801 363 H ASP 45 HN ASP 45 10.014 5.371 -16.661 364 HA ASP 45 HA ASP 45 7.533 3.907 -15.983 365 HB2 ASP 45 HB2 ASP 45 10.130 2.539 -16.583 366 HB3 ASP 45 HB1 ASP 45 8.484 1.955 -16.809 367 H GLU 46 HN GLU 46 9.749 5.594 -14.438 368 HA GLU 46 HA GLU 46 9.755 3.784 -12.108 369 HB2 GLU 46 HB2 GLU 46 12.142 5.368 -13.091 370 HB3 GLU 46 HB1 GLU 46 12.071 4.432 -11.598 371 HG2 GLU 46 HG2 GLU 46 13.096 2.950 -13.111 372 HG3 GLU 46 HG1 GLU 46 11.410 2.439 -13.121 373 H LEU 47 HN LEU 47 8.760 4.777 -10.491 374 HA LEU 47 HA LEU 47 9.124 7.700 -10.148 375 HB2 LEU 47 HB2 LEU 47 6.585 6.269 -9.381 376 HB3 LEU 47 HB1 LEU 47 6.855 7.996 -9.583 377 HG LEU 47 HG LEU 47 7.018 6.005 -11.863 378 HD11 LEU 47 HD11 LEU 47 4.765 6.053 -10.847 379 HD12 LEU 47 HD12 LEU 47 4.733 7.807 -11.030 380 HD13 LEU 47 HD13 LEU 47 4.772 6.774 -12.457 381 HD21 LEU 47 HD21 LEU 47 6.549 8.209 -13.135 382 HD22 LEU 47 HD22 LEU 47 7.000 9.023 -11.638 383 HD23 LEU 47 HD23 LEU 47 8.164 7.996 -12.472 384 H LYS 48 HN LYS 48 9.444 8.396 -8.066 385 HA LYS 48 HA LYS 48 9.761 6.286 -6.020 386 HB2 LYS 48 HB2 LYS 48 11.705 7.854 -6.778 387 HB3 LYS 48 HB1 LYS 48 10.885 9.070 -5.807 388 HG2 LYS 48 HG2 LYS 48 11.061 7.697 -3.821 389 HG3 LYS 48 HG1 LYS 48 11.684 6.339 -4.759 390 HD2 LYS 48 HD2 LYS 48 13.551 7.460 -3.669 391 HD3 LYS 48 HD1 LYS 48 13.649 7.737 -5.407 392 HE2 LYS 48 HE2 LYS 48 12.960 9.972 -5.222 393 HE3 LYS 48 HE1 LYS 48 12.212 9.715 -3.646 394 HZ1 LYS 48 HZ1 LYS 48 14.397 9.404 -2.686 395 HZ2 LYS 48 HZ2 LYS 48 15.127 9.628 -4.204 396 HZ3 LYS 48 HZ3 LYS 48 14.305 10.913 -3.462 397 H VAL 49 HN VAL 49 8.175 6.195 -4.514 398 HA VAL 49 HA VAL 49 6.857 8.733 -3.775 399 HB VAL 49 HB VAL 49 5.652 6.155 -4.579 400 HG11 VAL 49 HG11 VAL 49 5.085 5.988 -2.215 401 HG12 VAL 49 HG12 VAL 49 4.591 7.682 -2.184 402 HG13 VAL 49 HG13 VAL 49 3.659 6.508 -3.113 403 HG21 VAL 49 HG21 VAL 49 3.739 7.757 -4.985 404 HG22 VAL 49 HG22 VAL 49 4.791 9.048 -4.408 405 HG23 VAL 49 HG23 VAL 49 5.227 8.126 -5.842 406 H SER 50 HN SER 50 6.625 9.212 -1.755 407 HA SER 50 HA SER 50 7.868 7.413 0.253 408 HB2 SER 50 HB2 SER 50 9.164 9.416 -0.529 409 HB3 SER 50 HB1 SER 50 7.903 10.418 0.164 410 HG SER 50 HG SER 50 8.697 10.035 2.077 411 H TYR 51 HN TYR 51 7.080 7.457 2.368 412 HA TYR 51 HA TYR 51 4.498 8.859 2.783 413 HB2 TYR 51 HB2 TYR 51 5.166 6.272 4.168 414 HB3 TYR 51 HB1 TYR 51 3.593 7.017 3.908 415 HD1 TYR 51 HD1 TYR 51 3.414 7.584 1.120 416 HD2 TYR 51 HD2 TYR 51 5.296 4.245 3.049 417 HE1 TYR 51 HE1 TYR 51 3.077 6.205 -0.907 418 HE2 TYR 51 HE2 TYR 51 4.970 2.882 1.009 419 HH TYR 51 HH TYR 51 3.561 2.810 -0.939 420 H ALA 52 HN ALA 52 4.393 10.080 4.575 421 HA ALA 52 HA ALA 52 6.443 9.703 6.681 422 HB1 ALA 52 HB1 ALA 52 5.566 12.169 5.243 423 HB2 ALA 52 HB2 ALA 52 7.160 11.739 5.859 424 HB3 ALA 52 HB3 ALA 52 5.913 12.310 6.967 425 H VAL 53 HN VAL 53 5.330 8.790 8.339 426 HA VAL 53 HA VAL 53 2.612 9.792 8.878 427 HB VAL 53 HB VAL 53 3.722 7.193 9.899 428 HG11 VAL 53 HG11 VAL 53 1.595 7.998 10.831 429 HG12 VAL 53 HG12 VAL 53 0.938 8.183 9.204 430 HG13 VAL 53 HG13 VAL 53 1.321 6.576 9.824 431 HG21 VAL 53 HG21 VAL 53 2.581 7.815 7.164 432 HG22 VAL 53 HG22 VAL 53 4.112 7.026 7.542 433 HG23 VAL 53 HG23 VAL 53 2.590 6.187 7.843 434 HA PRO 54 HA PRO 54 4.422 11.239 12.730 435 HB2 PRO 54 HB2 PRO 54 2.217 12.328 13.840 436 HB3 PRO 54 HB1 PRO 54 2.996 13.067 12.423 437 HG2 PRO 54 HG2 PRO 54 0.581 11.313 12.550 438 HG3 PRO 54 HG1 PRO 54 0.844 12.797 11.615 439 HD2 PRO 54 HD2 PRO 54 1.097 10.272 10.543 440 HD3 PRO 54 HD1 PRO 54 1.979 11.692 9.930 441 H LYS 55 HN LYS 55 4.130 10.822 15.069 442 HA LYS 55 HA LYS 55 2.249 8.784 15.886 443 HB2 LYS 55 HB2 LYS 55 4.147 7.548 14.733 444 HB3 LYS 55 HB1 LYS 55 5.180 8.100 16.050 445 HG2 LYS 55 HG2 LYS 55 3.744 7.004 17.691 446 HG3 LYS 55 HG1 LYS 55 2.614 6.530 16.423 447 HD2 LYS 55 HD2 LYS 55 4.468 5.240 15.331 448 HD3 LYS 55 HD1 LYS 55 5.486 5.611 16.724 449 HE2 LYS 55 HE2 LYS 55 4.559 3.462 17.176 450 HE3 LYS 55 HE1 LYS 55 3.632 4.590 18.165 451 HZ1 LYS 55 HZ1 LYS 55 1.968 4.665 16.367 452 HZ2 LYS 55 HZ2 LYS 55 2.832 3.459 15.540 453 HZ3 LYS 55 HZ3 LYS 55 2.135 3.118 17.048 454 HA PRO 56 HA PRO 56 3.154 11.962 19.149 455 HB2 PRO 56 HB2 PRO 56 1.078 10.132 20.330 456 HB3 PRO 56 HB1 PRO 56 1.223 11.897 20.462 457 HG2 PRO 56 HG2 PRO 56 -0.504 10.773 18.766 458 HG3 PRO 56 HG1 PRO 56 0.365 12.262 18.354 459 HD2 PRO 56 HD2 PRO 56 0.727 9.531 17.265 460 HD3 PRO 56 HD1 PRO 56 1.176 11.094 16.546 461 H ASN 57 HN ASN 57 3.323 8.494 19.093 462 HA ASN 57 HA ASN 57 4.874 8.422 21.609 463 HB2 ASN 57 HB2 ASN 57 2.928 6.864 21.347 464 HB3 ASN 57 HB1 ASN 57 3.781 6.103 20.005 465 HD21 ASN 57 HD21 ASN 57 3.943 4.073 21.250 466 HD22 ASN 57 HD22 ASN 57 5.054 3.934 22.526 467 H GLY 58 HN GLY 58 5.797 9.343 18.873 468 HA2 GLY 58 HA2 GLY 58 8.400 8.816 18.796 469 HA3 GLY 58 HA1 GLY 58 7.768 7.314 18.127 470 H CYS 59 HN CYS 59 8.931 7.874 16.163 471 HA CYS 59 HA CYS 59 7.299 9.559 14.387 472 HB2 CYS 59 HB2 CYS 59 9.241 10.911 15.309 473 HB3 CYS 59 HB1 CYS 59 10.311 9.797 14.460 474 H ARG 60 HN ARG 60 7.015 8.620 12.401 475 HA ARG 60 HA ARG 60 8.915 6.464 11.635 476 HB2 ARG 60 HB2 ARG 60 5.895 6.435 11.438 477 HB3 ARG 60 HB1 ARG 60 6.954 5.249 10.674 478 HG2 ARG 60 HG2 ARG 60 7.882 4.652 12.884 479 HG3 ARG 60 HG1 ARG 60 6.813 5.830 13.648 480 HD2 ARG 60 HD2 ARG 60 4.849 4.613 12.858 481 HD3 ARG 60 HD1 ARG 60 5.873 3.477 11.984 482 HE ARG 60 HE ARG 60 6.575 3.533 14.745 483 HH11 ARG 60 HH21 ARG 60 4.170 2.449 12.506 484 HH12 ARG 60 HH22 ARG 60 3.682 1.096 13.472 485 HH21 ARG 60 HH11 ARG 60 5.939 1.760 16.018 486 HH22 ARG 60 HH12 ARG 60 4.683 0.706 15.459 487 H LYS 61 HN LYS 61 9.975 7.217 9.926 488 HA LYS 61 HA LYS 61 8.420 8.296 7.660 489 HB2 LYS 61 HB2 LYS 61 10.116 9.999 7.256 490 HB3 LYS 61 HB1 LYS 61 9.459 10.192 8.882 491 HG2 LYS 61 HG2 LYS 61 11.410 8.767 9.701 492 HG3 LYS 61 HG1 LYS 61 12.106 8.961 8.091 493 HD2 LYS 61 HD2 LYS 61 11.918 11.450 8.379 494 HD3 LYS 61 HD1 LYS 61 11.417 11.170 10.047 495 HE2 LYS 61 HE2 LYS 61 13.791 11.580 10.080 496 HE3 LYS 61 HE1 LYS 61 13.556 9.857 10.370 497 HZ1 LYS 61 HZ1 LYS 61 15.264 10.675 8.607 498 HZ2 LYS 61 HZ2 LYS 61 14.305 9.308 8.295 499 HZ3 LYS 61 HZ3 LYS 61 13.892 10.805 7.613 500 H TRP 62 HN TRP 62 8.965 7.399 5.739 501 HA TRP 62 HA TRP 62 11.619 6.335 5.290 502 HB2 TRP 62 HB2 TRP 62 11.233 4.126 5.567 503 HB3 TRP 62 HB1 TRP 62 9.789 4.608 6.448 504 HD1 TRP 62 HD1 TRP 62 7.661 5.220 4.510 505 HE1 TRP 62 HE1 TRP 62 6.850 3.582 2.690 506 HE3 TRP 62 HE3 TRP 62 11.741 2.169 4.186 507 HZ2 TRP 62 HZ2 TRP 62 7.811 1.280 1.281 508 HZ3 TRP 62 HZ3 TRP 62 11.768 0.265 2.601 509 HH2 TRP 62 HH2 TRP 62 9.810 -0.182 1.149 510 H GLU 63 HN GLU 63 11.635 5.179 3.060 511 HA GLU 63 HA GLU 63 9.940 6.752 1.199 512 HB2 GLU 63 HB2 GLU 63 12.372 7.418 1.313 513 HB3 GLU 63 HB1 GLU 63 12.768 5.820 0.680 514 HG2 GLU 63 HG2 GLU 63 11.608 6.238 -1.365 515 HG3 GLU 63 HG1 GLU 63 10.835 7.682 -0.715 516 H THR 64 HN THR 64 9.688 5.762 -0.957 517 HA THR 64 HA THR 64 10.008 2.861 -1.111 518 HB THR 64 HB THR 64 7.274 4.077 -1.473 519 HG1 THR 64 HG1 THR 64 8.298 4.157 0.734 520 HG21 THR 64 HG21 THR 64 7.603 1.942 -2.579 521 HG22 THR 64 HG22 THR 64 8.322 1.256 -1.122 522 HG23 THR 64 HG23 THR 64 6.610 1.678 -1.145 523 H THR 65 HN THR 65 10.045 2.093 -3.217 524 HA THR 65 HA THR 65 10.030 4.163 -5.326 525 HB THR 65 HB THR 65 11.326 1.432 -5.298 526 HG1 THR 65 HG1 THR 65 12.413 4.044 -5.103 527 HG21 THR 65 HG21 THR 65 10.816 2.006 -7.559 528 HG22 THR 65 HG22 THR 65 11.274 3.690 -7.307 529 HG23 THR 65 HG23 THR 65 12.511 2.433 -7.323 530 H PHE 66 HN PHE 66 8.516 4.134 -6.883 531 HA PHE 66 HA PHE 66 6.913 1.665 -7.262 532 HB2 PHE 66 HB2 PHE 66 6.135 4.571 -7.140 533 HB3 PHE 66 HB1 PHE 66 5.163 3.444 -8.082 534 HD1 PHE 66 HD1 PHE 66 6.658 3.926 -4.690 535 HD2 PHE 66 HD2 PHE 66 3.557 2.093 -7.027 536 HE1 PHE 66 HE1 PHE 66 5.551 3.144 -2.618 537 HE2 PHE 66 HE2 PHE 66 2.452 1.316 -4.949 538 HZ PHE 66 HZ PHE 66 3.451 1.841 -2.745 539 H LYS 67 HN LYS 67 6.725 0.918 -9.322 540 HA LYS 67 HA LYS 67 7.914 2.562 -11.489 541 HB2 LYS 67 HB2 LYS 67 7.887 -0.437 -11.101 542 HB3 LYS 67 HB1 LYS 67 8.379 0.353 -12.598 543 HG2 LYS 67 HG2 LYS 67 9.996 1.718 -11.049 544 HG3 LYS 67 HG1 LYS 67 9.723 0.405 -9.904 545 HD2 LYS 67 HD2 LYS 67 10.319 -1.194 -11.795 546 HD3 LYS 67 HD1 LYS 67 10.871 0.219 -12.693 547 HE2 LYS 67 HE2 LYS 67 12.310 0.773 -10.644 548 HE3 LYS 67 HE1 LYS 67 11.947 -0.859 -10.081 549 HZ1 LYS 67 HZ1 LYS 67 12.716 -0.930 -12.794 550 HZ2 LYS 67 HZ2 LYS 67 13.894 -0.094 -11.900 551 HZ3 LYS 67 HZ3 LYS 67 13.457 -1.672 -11.458 552 H LYS 68 HN LYS 68 6.870 2.657 -13.461 553 HA LYS 68 HA LYS 68 4.031 2.338 -13.377 554 HB2 LYS 68 HB2 LYS 68 5.452 4.058 -14.713 555 HB3 LYS 68 HB1 LYS 68 5.565 2.779 -15.922 556 HG2 LYS 68 HG2 LYS 68 3.097 2.617 -15.977 557 HG3 LYS 68 HG1 LYS 68 2.992 3.923 -14.796 558 HD2 LYS 68 HD2 LYS 68 4.162 5.433 -16.364 559 HD3 LYS 68 HD1 LYS 68 4.247 4.130 -17.550 560 HE2 LYS 68 HE2 LYS 68 1.886 4.088 -17.830 561 HE3 LYS 68 HE1 LYS 68 1.619 5.054 -16.379 562 HZ1 LYS 68 HZ1 LYS 68 3.247 6.189 -18.533 563 HZ2 LYS 68 HZ2 LYS 68 1.563 6.133 -18.745 564 HZ3 LYS 68 HZ3 LYS 68 2.223 6.969 -17.425 565 H THR 69 HN THR 69 2.775 0.724 -14.024 566 HA THR 69 HA THR 69 3.929 -1.430 -15.698 567 HB THR 69 HB THR 69 3.833 -2.255 -13.412 568 HG1 THR 69 HG1 THR 69 1.714 -3.149 -15.064 569 HG21 THR 69 HG21 THR 69 2.197 -0.638 -12.538 570 HG22 THR 69 HG22 THR 69 0.928 -1.395 -13.499 571 HG23 THR 69 HG23 THR 69 1.689 -2.288 -12.183 572 H SER 70 HN SER 70 2.065 -2.862 -16.547 573 HA SER 70 HA SER 70 0.021 -1.060 -17.659 574 HB2 SER 70 HB2 SER 70 1.329 -2.313 -19.294 575 HB3 SER 70 HB1 SER 70 0.912 -3.828 -18.498 576 HG SER 70 HG SER 70 -0.956 -3.786 -19.459 577 H ASP 71 HN ASP 71 0.327 -2.933 -15.074 578 HA ASP 71 HA ASP 71 -1.332 -4.826 -14.557 579 HB2 ASP 71 HB2 ASP 71 -0.366 -3.222 -12.855 580 HB3 ASP 71 HB1 ASP 71 -1.825 -2.256 -13.064 581 H ASP 72 HN ASP 72 -2.754 -1.574 -15.201 582 HA ASP 72 HA ASP 72 -5.007 -2.764 -16.511 583 HB2 ASP 72 HB2 ASP 72 -5.286 -1.704 -13.705 584 HB3 ASP 72 HB1 ASP 72 -6.642 -1.674 -14.829 585 H GLY 73 HN GLY 73 -3.635 -1.167 -17.861 586 HA2 GLY 73 HA2 GLY 73 -4.095 0.720 -19.200 587 HA3 GLY 73 HA1 GLY 73 -5.095 1.374 -17.908 588 H GLU 74 HN GLU 74 -4.180 2.678 -16.347 589 HA GLU 74 HA GLU 74 -1.289 3.284 -16.628 590 HB2 GLU 74 HB2 GLU 74 -3.560 5.208 -16.063 591 HB3 GLU 74 HB1 GLU 74 -1.846 5.623 -16.039 592 HG2 GLU 74 HG2 GLU 74 -1.657 4.920 -18.410 593 HG3 GLU 74 HG1 GLU 74 -3.384 4.567 -18.429 594 H VAL 75 HN VAL 75 -0.724 1.915 -14.890 595 HA VAL 75 HA VAL 75 -1.516 2.953 -12.248 596 HB VAL 75 HB VAL 75 -1.342 0.018 -12.936 597 HG11 VAL 75 HG11 VAL 75 -2.501 0.016 -10.566 598 HG12 VAL 75 HG12 VAL 75 -0.751 0.178 -10.680 599 HG13 VAL 75 HG13 VAL 75 -1.748 1.603 -10.402 600 HG21 VAL 75 HG21 VAL 75 -3.872 0.269 -12.243 601 HG22 VAL 75 HG22 VAL 75 -3.636 1.957 -12.696 602 HG23 VAL 75 HG23 VAL 75 -3.379 0.681 -13.885 603 H TYR 76 HN TYR 76 -0.016 2.665 -10.581 604 HA TYR 76 HA TYR 76 2.728 2.019 -11.496 605 HB2 TYR 76 HB2 TYR 76 1.990 3.857 -9.218 606 HB3 TYR 76 HB1 TYR 76 3.546 3.714 -10.047 607 HD1 TYR 76 HD1 TYR 76 3.822 4.529 -12.368 608 HD2 TYR 76 HD2 TYR 76 0.150 5.087 -10.211 609 HE1 TYR 76 HE1 TYR 76 3.083 6.190 -14.055 610 HE2 TYR 76 HE2 TYR 76 -0.585 6.752 -11.896 611 HH TYR 76 HH TYR 76 0.687 8.348 -13.580 612 H TYR 77 HN TYR 77 4.098 0.933 -9.958 613 HA TYR 77 HA TYR 77 2.881 -0.144 -7.549 614 HB2 TYR 77 HB2 TYR 77 2.629 -2.360 -8.149 615 HB3 TYR 77 HB1 TYR 77 2.214 -1.569 -9.666 616 HD1 TYR 77 HD2 TYR 77 4.138 -1.177 -11.363 617 HD2 TYR 77 HD1 TYR 77 4.374 -3.938 -8.085 618 HE1 TYR 77 HE2 TYR 77 5.988 -2.369 -12.504 619 HE2 TYR 77 HE1 TYR 77 6.223 -5.133 -9.226 620 HH TYR 77 HH TYR 77 7.354 -4.117 -12.451 621 H SER 78 HN SER 78 4.312 -0.855 -6.022 622 HA SER 78 HA SER 78 7.176 -0.601 -6.697 623 HB2 SER 78 HB2 SER 78 7.496 -0.344 -4.267 624 HB3 SER 78 HB1 SER 78 6.359 0.851 -4.884 625 HG SER 78 HG SER 78 4.877 -1.171 -4.309 626 H GLU 79 HN GLU 79 7.835 -2.545 -7.367 627 HA GLU 79 HA GLU 79 6.854 -5.051 -6.651 628 HB2 GLU 79 HB2 GLU 79 8.384 -4.524 -8.568 629 HB3 GLU 79 HB1 GLU 79 9.711 -4.430 -7.413 630 HG2 GLU 79 HG2 GLU 79 9.696 -6.661 -8.352 631 HG3 GLU 79 HG1 GLU 79 9.156 -6.770 -6.679 632 H GLU 80 HN GLU 80 9.471 -3.171 -5.176 633 HA GLU 80 HA GLU 80 10.421 -5.160 -3.435 634 HB2 GLU 80 HB2 GLU 80 11.396 -3.270 -2.159 635 HB3 GLU 80 HB1 GLU 80 11.703 -3.157 -3.893 636 HG2 GLU 80 HG2 GLU 80 9.776 -1.614 -4.119 637 HG3 GLU 80 HG1 GLU 80 9.519 -1.699 -2.377 638 H ALA 81 HN ALA 81 7.738 -2.877 -3.053 639 HA ALA 81 HA ALA 81 7.320 -3.862 -0.298 640 HB1 ALA 81 HB1 ALA 81 6.004 -1.912 0.078 641 HB2 ALA 81 HB2 ALA 81 5.939 -1.544 -1.645 642 HB3 ALA 81 HB3 ALA 81 7.461 -1.388 -0.767 643 H LYS 82 HN LYS 82 6.055 -4.239 -3.461 644 HA LYS 82 HA LYS 82 4.199 -5.357 -4.255 645 HB2 LYS 82 HB2 LYS 82 3.766 -6.343 -1.430 646 HB3 LYS 82 HB1 LYS 82 3.278 -7.116 -2.937 647 HG2 LYS 82 HG2 LYS 82 5.661 -7.406 -3.550 648 HG3 LYS 82 HG1 LYS 82 6.133 -6.677 -2.014 649 HD2 LYS 82 HD2 LYS 82 4.839 -8.474 -0.833 650 HD3 LYS 82 HD1 LYS 82 4.565 -9.242 -2.397 651 HE2 LYS 82 HE2 LYS 82 7.095 -9.237 -2.702 652 HE3 LYS 82 HE1 LYS 82 7.210 -8.783 -1.002 653 HZ1 LYS 82 HZ1 LYS 82 5.455 -11.012 -1.539 654 HZ2 LYS 82 HZ2 LYS 82 7.089 -11.309 -1.897 655 HZ3 LYS 82 HZ3 LYS 82 6.639 -10.825 -0.335 656 H LYS 83 HN LYS 83 3.710 -2.905 -4.081 657 HA LYS 83 HA LYS 83 0.997 -2.651 -2.973 658 HB2 LYS 83 HB2 LYS 83 2.400 -1.618 -1.276 659 HB3 LYS 83 HB1 LYS 83 3.227 -0.656 -2.502 660 HG2 LYS 83 HG2 LYS 83 1.240 0.592 -2.992 661 HG3 LYS 83 HG1 LYS 83 0.238 -0.511 -2.047 662 HD2 LYS 83 HD2 LYS 83 1.142 0.249 0.009 663 HD3 LYS 83 HD1 LYS 83 2.503 1.038 -0.784 664 HE2 LYS 83 HE2 LYS 83 1.097 2.750 -1.696 665 HE3 LYS 83 HE1 LYS 83 -0.367 1.877 -1.246 666 HZ1 LYS 83 HZ1 LYS 83 1.482 2.481 0.913 667 HZ2 LYS 83 HZ2 LYS 83 0.683 3.814 0.227 668 HZ3 LYS 83 HZ3 LYS 83 -0.216 2.537 0.886 669 H LYS 84 HN LYS 84 -0.351 -1.777 -4.396 670 HA LYS 84 HA LYS 84 0.771 -0.323 -6.728 671 HB2 LYS 84 HB2 LYS 84 -0.077 -2.690 -7.118 672 HB3 LYS 84 HB1 LYS 84 -1.681 -2.076 -6.731 673 HG2 LYS 84 HG2 LYS 84 -1.471 -0.410 -8.540 674 HG3 LYS 84 HG1 LYS 84 0.112 -1.066 -8.939 675 HD2 LYS 84 HD2 LYS 84 -1.487 -2.070 -10.448 676 HD3 LYS 84 HD1 LYS 84 -0.963 -3.303 -9.306 677 HE2 LYS 84 HE2 LYS 84 -3.354 -1.730 -8.483 678 HE3 LYS 84 HE1 LYS 84 -3.577 -2.817 -9.852 679 HZ1 LYS 84 HZ1 LYS 84 -4.021 -3.918 -7.747 680 HZ2 LYS 84 HZ2 LYS 84 -2.694 -4.626 -8.537 681 HZ3 LYS 84 HZ3 LYS 84 -2.441 -3.588 -7.220 682 H VAL 85 HN VAL 85 -0.079 1.591 -7.259 683 HA VAL 85 HA VAL 85 -2.706 2.294 -6.123 684 HB VAL 85 HB VAL 85 -2.003 4.199 -5.106 685 HG11 VAL 85 HG11 VAL 85 -0.770 2.206 -4.186 686 HG12 VAL 85 HG12 VAL 85 0.640 2.758 -5.089 687 HG13 VAL 85 HG13 VAL 85 -0.042 3.767 -3.816 688 HG21 VAL 85 HG21 VAL 85 0.293 5.322 -5.685 689 HG22 VAL 85 HG22 VAL 85 0.195 4.395 -7.177 690 HG23 VAL 85 HG23 VAL 85 -1.057 5.577 -6.788 691 H GLU 86 HN GLU 86 -4.065 2.976 -7.560 692 HA GLU 86 HA GLU 86 -3.066 3.992 -10.167 693 HB2 GLU 86 HB2 GLU 86 -5.078 2.932 -11.160 694 HB3 GLU 86 HB1 GLU 86 -4.006 1.756 -10.406 695 HG2 GLU 86 HG2 GLU 86 -5.432 1.966 -8.314 696 HG3 GLU 86 HG1 GLU 86 -6.583 2.874 -9.294 697 H VAL 87 HN VAL 87 -3.902 5.822 -10.936 698 HA VAL 87 HA VAL 87 -5.370 7.567 -9.299 699 HB VAL 87 HB VAL 87 -4.123 8.597 -10.990 700 HG11 VAL 87 HG11 VAL 87 -3.664 6.803 -12.463 701 HG12 VAL 87 HG12 VAL 87 -5.373 6.537 -12.809 702 HG13 VAL 87 HG13 VAL 87 -4.554 7.962 -13.449 703 HG21 VAL 87 HG21 VAL 87 -6.753 8.677 -12.446 704 HG22 VAL 87 HG22 VAL 87 -6.687 9.289 -10.795 705 HG23 VAL 87 HG23 VAL 87 -5.660 9.999 -12.040 706 H LEU 88 HN LEU 88 -7.240 6.705 -8.509 707 HA LEU 88 HA LEU 88 -9.291 5.676 -10.321 708 HB2 LEU 88 HB2 LEU 88 -8.633 4.970 -7.786 709 HB3 LEU 88 HB1 LEU 88 -9.876 6.162 -7.429 710 HG LEU 88 HG LEU 88 -10.903 3.965 -7.581 711 HD11 LEU 88 HD11 LEU 88 -12.654 4.478 -9.088 712 HD12 LEU 88 HD12 LEU 88 -12.015 6.043 -8.590 713 HD13 LEU 88 HD13 LEU 88 -11.581 5.372 -10.163 714 HD21 LEU 88 HD21 LEU 88 -8.969 3.295 -9.361 715 HD22 LEU 88 HD22 LEU 88 -10.486 2.411 -9.217 716 HD23 LEU 88 HD23 LEU 88 -10.291 3.622 -10.482 717 H ASP 89 HN ASP 89 -8.272 8.521 -8.830 718 HA ASP 89 HA ASP 89 -9.980 10.257 -10.167 719 HB2 ASP 89 HB2 ASP 89 -11.359 9.111 -8.052 720 HB3 ASP 89 HB1 ASP 89 -10.698 10.565 -7.317 721 H THR 90 HN THR 90 -8.615 11.977 -10.337 722 HA THR 90 HA THR 90 -7.120 12.816 -7.971 723 HB THR 90 HB THR 90 -5.903 11.051 -9.538 724 HG1 THR 90 HG1 THR 90 -4.058 11.743 -8.644 725 HG21 THR 90 HG21 THR 90 -5.107 13.684 -10.808 726 HG22 THR 90 HG22 THR 90 -4.514 12.079 -11.225 727 HG23 THR 90 HG23 THR 90 -6.188 12.510 -11.561 728 H ASP 91 HN ASP 91 -7.307 14.893 -7.754 729 HA ASP 91 HA ASP 91 -8.167 16.578 -9.968 730 HB2 ASP 91 HB2 ASP 91 -9.005 16.794 -7.573 731 HB3 ASP 91 HB1 ASP 91 -7.410 17.431 -7.176 732 H TYR 92 HN TYR 92 -5.334 15.801 -8.141 733 HA TYR 92 HA TYR 92 -3.133 16.342 -8.359 734 HB2 TYR 92 HB2 TYR 92 -4.255 16.368 -11.025 735 HB3 TYR 92 HB1 TYR 92 -2.985 17.581 -10.912 736 HD1 TYR 92 HD2 TYR 92 -3.426 14.215 -9.305 737 HD2 TYR 92 HD1 TYR 92 -1.019 16.713 -11.839 738 HE1 TYR 92 HE2 TYR 92 -1.724 12.423 -9.456 739 HE2 TYR 92 HE1 TYR 92 0.685 14.918 -11.985 740 HH TYR 92 HH TYR 92 0.984 12.505 -9.957 741 H LYS 93 HN LYS 93 -5.294 18.530 -7.593 742 HA LYS 93 HA LYS 93 -3.313 20.647 -7.426 743 HB2 LYS 93 HB2 LYS 93 -4.629 20.865 -9.633 744 HB3 LYS 93 HB1 LYS 93 -6.009 21.281 -8.617 745 HG2 LYS 93 HG2 LYS 93 -4.622 23.080 -7.559 746 HG3 LYS 93 HG1 LYS 93 -3.339 22.717 -8.714 747 HD2 LYS 93 HD2 LYS 93 -5.082 23.099 -10.549 748 HD3 LYS 93 HD1 LYS 93 -6.107 23.788 -9.290 749 HE2 LYS 93 HE2 LYS 93 -4.937 25.637 -10.242 750 HE3 LYS 93 HE1 LYS 93 -4.130 25.304 -8.710 751 HZ1 LYS 93 HZ1 LYS 93 -3.231 24.680 -11.449 752 HZ2 LYS 93 HZ2 LYS 93 -2.394 25.483 -10.207 753 HZ3 LYS 93 HZ3 LYS 93 -2.629 23.805 -10.122 754 H SER 94 HN SER 94 -6.346 19.169 -6.542 755 HA SER 94 HA SER 94 -6.470 20.910 -4.141 756 HB2 SER 94 HB2 SER 94 -8.890 19.702 -5.468 757 HB3 SER 94 HB1 SER 94 -8.832 20.970 -4.247 758 HG SER 94 HG SER 94 -8.062 21.076 -6.970 759 H TYR 95 HN TYR 95 -7.763 17.807 -5.407 760 HA TYR 95 HA TYR 95 -6.742 16.393 -3.088 761 HB2 TYR 95 HB2 TYR 95 -9.029 15.511 -2.502 762 HB3 TYR 95 HB1 TYR 95 -8.776 17.211 -2.103 763 HD1 TYR 95 HD2 TYR 95 -10.306 14.891 -4.568 764 HD2 TYR 95 HD1 TYR 95 -10.021 18.949 -3.188 765 HE1 TYR 95 HE2 TYR 95 -12.223 15.517 -6.012 766 HE2 TYR 95 HE1 TYR 95 -11.938 19.574 -4.632 767 HH TYR 95 HH TYR 95 -14.039 18.056 -5.656 768 H ALA 96 HN ALA 96 -7.183 14.019 -3.269 769 HA ALA 96 HA ALA 96 -8.062 13.117 -5.906 770 HB1 ALA 96 HB1 ALA 96 -5.258 12.647 -4.871 771 HB2 ALA 96 HB2 ALA 96 -5.707 13.582 -6.294 772 HB3 ALA 96 HB3 ALA 96 -5.961 11.837 -6.266 773 H VAL 97 HN VAL 97 -8.721 11.038 -5.994 774 HA VAL 97 HA VAL 97 -8.638 9.460 -3.474 775 HB VAL 97 HB VAL 97 -10.781 9.121 -5.566 776 HG11 VAL 97 HG11 VAL 97 -11.971 8.071 -3.814 777 HG12 VAL 97 HG12 VAL 97 -10.311 7.522 -3.595 778 HG13 VAL 97 HG13 VAL 97 -10.958 8.803 -2.572 779 HG21 VAL 97 HG21 VAL 97 -12.156 10.653 -3.996 780 HG22 VAL 97 HG22 VAL 97 -10.598 11.234 -3.415 781 HG23 VAL 97 HG23 VAL 97 -11.037 11.433 -5.111 782 H ILE 98 HN ILE 98 -7.238 7.806 -3.743 783 HA ILE 98 HA ILE 98 -7.039 6.581 -6.427 784 HB ILE 98 HB ILE 98 -4.852 6.719 -4.360 785 HG12 ILE 98 HG12 ILE 98 -5.417 8.671 -6.620 786 HG13 ILE 98 HG11 ILE 98 -5.597 9.026 -4.903 787 HG21 ILE 98 HG21 ILE 98 -4.858 5.113 -6.400 788 HG22 ILE 98 HG22 ILE 98 -4.598 6.569 -7.360 789 HG23 ILE 98 HG23 ILE 98 -3.425 6.103 -6.131 790 HD11 ILE 98 HD11 ILE 98 -3.115 8.689 -6.515 791 HD12 ILE 98 HD12 ILE 98 -3.464 9.836 -5.223 792 HD13 ILE 98 HD13 ILE 98 -3.084 8.160 -4.829 793 H TYR 99 HN TYR 99 -6.778 4.382 -6.544 794 HA TYR 99 HA TYR 99 -7.751 2.889 -4.209 795 HB2 TYR 99 HB2 TYR 99 -8.616 2.752 -6.705 796 HB3 TYR 99 HB1 TYR 99 -7.261 1.643 -6.898 797 HD1 TYR 99 HD1 TYR 99 -10.297 2.310 -4.835 798 HD2 TYR 99 HD2 TYR 99 -7.401 -0.592 -6.116 799 HE1 TYR 99 HE1 TYR 99 -11.641 0.509 -3.787 800 HE2 TYR 99 HE2 TYR 99 -8.745 -2.394 -5.067 801 HH TYR 99 HH TYR 99 -11.502 -2.521 -4.475 802 H ALA 100 HN ALA 100 -6.172 2.336 -2.878 803 HA ALA 100 HA ALA 100 -3.593 1.366 -3.944 804 HB1 ALA 100 HB1 ALA 100 -3.643 3.168 -2.156 805 HB2 ALA 100 HB2 ALA 100 -2.667 1.751 -1.772 806 HB3 ALA 100 HB3 ALA 100 -4.265 1.941 -1.052 807 H THR 101 HN THR 101 -2.877 -0.673 -3.619 808 HA THR 101 HA THR 101 -4.403 -2.474 -1.878 809 HB THR 101 HB THR 101 -5.485 -2.769 -4.026 810 HG1 THR 101 HG1 THR 101 -4.456 -4.622 -2.663 811 HG21 THR 101 HG21 THR 101 -2.761 -3.417 -5.167 812 HG22 THR 101 HG22 THR 101 -4.284 -3.269 -6.043 813 HG23 THR 101 HG23 THR 101 -3.530 -1.838 -5.339 814 H ARG 102 HN ARG 102 -3.130 -3.778 -0.784 815 HA ARG 102 HA ARG 102 -0.366 -4.261 -1.741 816 HB2 ARG 102 HB2 ARG 102 -0.527 -2.666 0.225 817 HB3 ARG 102 HB1 ARG 102 -1.199 -4.004 1.157 818 HG2 ARG 102 HG2 ARG 102 0.899 -5.324 0.387 819 HG3 ARG 102 HG1 ARG 102 1.560 -3.745 -0.036 820 HD2 ARG 102 HD2 ARG 102 2.287 -4.190 2.196 821 HD3 ARG 102 HD1 ARG 102 0.992 -3.003 2.327 822 HE ARG 102 HE ARG 102 -0.354 -5.325 2.604 823 HH11 ARG 102 HH21 ARG 102 2.566 -4.108 4.005 824 HH12 ARG 102 HH22 ARG 102 2.371 -4.966 5.497 825 HH21 ARG 102 HH11 ARG 102 -0.616 -6.455 4.557 826 HH22 ARG 102 HH12 ARG 102 0.569 -6.295 5.810 827 H VAL 103 HN VAL 103 0.220 -6.408 -1.816 828 HA VAL 103 HA VAL 103 -1.663 -8.312 -0.541 829 HB VAL 103 HB VAL 103 -1.880 -8.369 -2.960 830 HG11 VAL 103 HG11 VAL 103 0.993 -9.228 -3.232 831 HG12 VAL 103 HG12 VAL 103 -0.092 -8.568 -4.453 832 HG13 VAL 103 HG13 VAL 103 0.595 -7.510 -3.222 833 HG21 VAL 103 HG21 VAL 103 -0.217 -10.745 -2.086 834 HG22 VAL 103 HG22 VAL 103 -1.883 -10.495 -1.564 835 HG23 VAL 103 HG23 VAL 103 -1.520 -10.723 -3.275 836 H LYS 104 HN LYS 104 -0.729 -9.156 1.190 837 HA LYS 104 HA LYS 104 2.162 -9.590 1.254 838 HB2 LYS 104 HB2 LYS 104 0.525 -8.687 3.183 839 HB3 LYS 104 HB1 LYS 104 0.371 -10.410 3.508 840 HG2 LYS 104 HG2 LYS 104 2.216 -9.888 4.829 841 HG3 LYS 104 HG1 LYS 104 3.015 -10.371 3.334 842 HD2 LYS 104 HD2 LYS 104 3.061 -7.964 2.638 843 HD3 LYS 104 HD1 LYS 104 2.394 -7.536 4.214 844 HE2 LYS 104 HE2 LYS 104 4.329 -8.398 5.355 845 HE3 LYS 104 HE1 LYS 104 4.953 -9.117 3.870 846 HZ1 LYS 104 HZ1 LYS 104 4.424 -6.314 3.612 847 HZ2 LYS 104 HZ2 LYS 104 5.568 -6.646 4.823 848 HZ3 LYS 104 HZ3 LYS 104 5.832 -7.190 3.238 849 H ASP 105 HN ASP 105 2.863 -11.762 2.202 850 HA ASP 105 HA ASP 105 2.093 -13.820 0.464 851 HB2 ASP 105 HB2 ASP 105 3.476 -13.942 3.150 852 HB3 ASP 105 HB1 ASP 105 3.321 -15.315 2.056 853 H GLY 106 HN GLY 106 0.055 -14.538 0.366 854 HA2 GLY 106 HA2 GLY 106 -1.624 -16.021 1.061 855 HA3 GLY 106 HA1 GLY 106 -1.060 -15.862 2.717 856 H ARG 107 HN ARG 107 -1.186 -12.749 1.923 857 HA ARG 107 HA ARG 107 -4.093 -12.492 2.490 858 HB2 ARG 107 HB2 ARG 107 -1.941 -10.669 3.564 859 HB3 ARG 107 HB1 ARG 107 -3.645 -10.708 4.012 860 HG2 ARG 107 HG2 ARG 107 -3.364 -12.975 4.931 861 HG3 ARG 107 HG1 ARG 107 -1.661 -12.957 4.470 862 HD2 ARG 107 HD2 ARG 107 -1.454 -10.837 5.889 863 HD3 ARG 107 HD1 ARG 107 -3.048 -11.230 6.527 864 HE ARG 107 HE ARG 107 -0.560 -12.620 7.096 865 HH11 ARG 107 HH21 ARG 107 -4.020 -12.689 7.070 866 HH12 ARG 107 HH22 ARG 107 -4.142 -13.924 8.279 867 HH21 ARG 107 HH11 ARG 107 -0.713 -14.239 8.682 868 HH22 ARG 107 HH12 ARG 107 -2.270 -14.801 9.191 869 H THR 108 HN THR 108 -5.226 -11.053 1.357 870 HA THR 108 HA THR 108 -3.805 -9.125 -0.383 871 HB THR 108 HB THR 108 -6.240 -10.740 -1.177 872 HG1 THR 108 HG1 THR 108 -3.584 -11.274 -1.257 873 HG21 THR 108 HG21 THR 108 -4.444 -8.845 -2.717 874 HG22 THR 108 HG22 THR 108 -5.773 -9.777 -3.407 875 HG23 THR 108 HG23 THR 108 -6.103 -8.518 -2.217 876 H LEU 109 HN LEU 109 -4.708 -7.100 -0.469 877 HA LEU 109 HA LEU 109 -7.434 -6.686 0.489 878 HB2 LEU 109 HB2 LEU 109 -6.917 -5.224 2.308 879 HB3 LEU 109 HB1 LEU 109 -6.081 -6.737 2.546 880 HG LEU 109 HG LEU 109 -4.173 -5.394 1.152 881 HD11 LEU 109 HD11 LEU 109 -5.050 -3.233 3.014 882 HD12 LEU 109 HD12 LEU 109 -4.162 -3.126 1.495 883 HD13 LEU 109 HD13 LEU 109 -5.906 -3.355 1.481 884 HD21 LEU 109 HD21 LEU 109 -3.103 -4.966 3.352 885 HD22 LEU 109 HD22 LEU 109 -4.645 -5.287 4.147 886 HD23 LEU 109 HD23 LEU 109 -3.819 -6.576 3.270 887 H HIS 110 HN HIS 110 -8.224 -4.599 0.317 888 HA HIS 110 HA HIS 110 -6.661 -2.795 -1.393 889 HB2 HIS 110 HB2 HIS 110 -8.880 -2.194 -2.504 890 HB3 HIS 110 HB1 HIS 110 -8.216 -3.775 -2.914 891 HD1 HIS 110 HD1 HIS 110 -11.313 -2.321 -2.012 892 HD2 HIS 110 HD2 HIS 110 -9.342 -5.801 -0.834 893 HE1 HIS 110 HE1 HIS 110 -13.077 -3.842 -1.018 894 H MET 111 HN MET 111 -7.292 -0.474 -1.204 895 HA MET 111 HA MET 111 -9.100 0.258 0.910 896 HB2 MET 111 HB2 MET 111 -7.228 1.542 2.129 897 HB3 MET 111 HB1 MET 111 -7.350 -0.190 2.410 898 HG2 MET 111 HG2 MET 111 -5.654 -0.051 0.213 899 HG3 MET 111 HG1 MET 111 -5.186 1.360 1.150 900 HE1 MET 111 HE1 MET 111 -4.946 0.971 4.078 901 HE2 MET 111 HE2 MET 111 -3.378 0.173 4.088 902 HE3 MET 111 HE3 MET 111 -3.729 1.414 2.882 903 H MET 112 HN MET 112 -9.484 2.536 1.003 904 HA MET 112 HA MET 112 -8.684 3.937 -1.482 905 HB2 MET 112 HB2 MET 112 -10.664 5.241 0.305 906 HB3 MET 112 HB1 MET 112 -10.664 5.085 -1.441 907 HG2 MET 112 HG2 MET 112 -11.200 2.675 0.284 908 HG3 MET 112 HG1 MET 112 -12.479 3.835 -0.043 909 HE1 MET 112 HE1 MET 112 -11.838 4.657 -3.421 910 HE2 MET 112 HE2 MET 112 -13.370 3.794 -3.496 911 HE3 MET 112 HE3 MET 112 -12.981 4.791 -2.088 912 H ARG 113 HN ARG 113 -7.590 5.877 -1.411 913 HA ARG 113 HA ARG 113 -6.834 6.893 1.274 914 HB2 ARG 113 HB2 ARG 113 -4.938 5.697 0.431 915 HB3 ARG 113 HB1 ARG 113 -5.100 6.437 -1.157 916 HG2 ARG 113 HG2 ARG 113 -4.826 8.373 1.081 917 HG3 ARG 113 HG1 ARG 113 -3.415 7.352 0.826 918 HD2 ARG 113 HD2 ARG 113 -3.676 8.007 -1.688 919 HD3 ARG 113 HD1 ARG 113 -4.684 9.316 -1.075 920 HE ARG 113 HE ARG 113 -2.319 9.331 0.409 921 HH11 ARG 113 HH21 ARG 113 -3.376 9.721 -2.862 922 HH12 ARG 113 HH22 ARG 113 -2.090 10.799 -3.295 923 HH21 ARG 113 HH11 ARG 113 -0.630 10.744 -0.150 924 HH22 ARG 113 HH12 ARG 113 -0.536 11.378 -1.759 925 H LEU 114 HN LEU 114 -7.197 9.006 1.567 926 HA LEU 114 HA LEU 114 -7.777 10.684 -0.797 927 HB2 LEU 114 HB2 LEU 114 -9.688 10.342 0.725 928 HB3 LEU 114 HB1 LEU 114 -8.716 10.935 2.060 929 HG LEU 114 HG LEU 114 -8.492 13.126 0.954 930 HD11 LEU 114 HD11 LEU 114 -8.601 12.778 -1.350 931 HD12 LEU 114 HD12 LEU 114 -9.978 11.685 -1.224 932 HD13 LEU 114 HD13 LEU 114 -10.210 13.422 -1.028 933 HD21 LEU 114 HD21 LEU 114 -11.334 12.094 1.222 934 HD22 LEU 114 HD22 LEU 114 -10.355 12.826 2.494 935 HD23 LEU 114 HD23 LEU 114 -10.901 13.802 1.129 936 H TYR 115 HN TYR 115 -6.408 12.251 -1.201 937 HA TYR 115 HA TYR 115 -4.667 13.236 0.966 938 HB2 TYR 115 HB2 TYR 115 -2.858 12.791 -0.329 939 HB3 TYR 115 HB1 TYR 115 -3.942 11.943 -1.419 940 HD1 TYR 115 HD1 TYR 115 -5.432 13.739 -2.894 941 HD2 TYR 115 HD2 TYR 115 -1.461 14.346 -1.378 942 HE1 TYR 115 HE1 TYR 115 -5.017 15.427 -4.663 943 HE2 TYR 115 HE2 TYR 115 -1.048 16.039 -3.143 944 HH TYR 115 HH TYR 115 -3.587 17.291 -5.115 945 H SER 116 HN SER 116 -3.921 15.441 0.747 946 HA SER 116 HA SER 116 -5.793 17.191 -0.747 947 HB2 SER 116 HB2 SER 116 -6.178 17.142 1.761 948 HB3 SER 116 HB1 SER 116 -4.565 17.827 1.946 949 HG SER 116 HG SER 116 -6.900 19.007 1.183 950 H ARG 117 HN ARG 117 -4.858 19.068 -1.674 951 HA ARG 117 HA ARG 117 -2.087 18.832 -2.335 952 HB2 ARG 117 HB2 ARG 117 -3.702 19.715 -3.926 953 HB3 ARG 117 HB1 ARG 117 -4.108 21.029 -2.837 954 HG2 ARG 117 HG2 ARG 117 -2.533 21.761 -4.611 955 HG3 ARG 117 HG1 ARG 117 -1.822 21.915 -3.008 956 HD2 ARG 117 HD2 ARG 117 -0.422 20.047 -3.316 957 HD3 ARG 117 HD1 ARG 117 -1.405 19.410 -4.634 958 HE ARG 117 HE ARG 117 -0.142 20.705 -6.074 959 HH11 ARG 117 HH21 ARG 117 -0.014 21.985 -2.862 960 HH12 ARG 117 HH22 ARG 117 1.130 23.226 -3.252 961 HH21 ARG 117 HH11 ARG 117 1.361 22.332 -6.594 962 HH22 ARG 117 HH12 ARG 117 1.907 23.422 -5.365 963 H SER 118 HN SER 118 -3.939 20.523 0.027 964 HA SER 118 HA SER 118 -1.486 21.841 1.047 965 HB2 SER 118 HB2 SER 118 -3.892 23.071 0.147 966 HB3 SER 118 HB1 SER 118 -3.752 23.342 1.873 967 HG SER 118 HG SER 118 -1.805 23.861 -0.133 968 HA PRO 119 HA PRO 119 -2.279 20.037 4.926 969 HB2 PRO 119 HB2 PRO 119 -1.760 22.133 6.657 970 HB3 PRO 119 HB1 PRO 119 -0.510 21.188 5.827 971 HG2 PRO 119 HG2 PRO 119 -1.607 23.864 5.149 972 HG3 PRO 119 HG1 PRO 119 0.049 23.262 5.013 973 HD2 PRO 119 HD2 PRO 119 -1.655 23.522 2.902 974 HD3 PRO 119 HD1 PRO 119 -0.362 22.321 2.938 975 H GLU 120 HN GLU 120 -4.529 21.654 3.534 976 HA GLU 120 HA GLU 120 -6.261 21.995 5.918 977 HB2 GLU 120 HB2 GLU 120 -6.746 23.255 3.220 978 HB3 GLU 120 HB1 GLU 120 -7.468 23.678 4.771 979 HG2 GLU 120 HG2 GLU 120 -5.217 24.372 5.590 980 HG3 GLU 120 HG1 GLU 120 -4.564 24.047 3.986 981 H VAL 121 HN VAL 121 -8.518 21.389 5.600 982 HA VAL 121 HA VAL 121 -8.824 19.190 3.628 983 HB VAL 121 HB VAL 121 -10.020 19.475 6.394 984 HG11 VAL 121 HG11 VAL 121 -11.641 18.396 4.989 985 HG12 VAL 121 HG12 VAL 121 -10.399 17.425 4.199 986 HG13 VAL 121 HG13 VAL 121 -10.821 17.117 5.883 987 HG21 VAL 121 HG21 VAL 121 -8.638 17.526 6.918 988 HG22 VAL 121 HG22 VAL 121 -8.048 17.467 5.256 989 HG23 VAL 121 HG23 VAL 121 -7.611 18.820 6.299 990 H SER 122 HN SER 122 -10.141 19.777 2.029 991 HA SER 122 HA SER 122 -12.190 21.803 2.458 992 HB2 SER 122 HB2 SER 122 -12.523 21.608 0.007 993 HB3 SER 122 HB1 SER 122 -10.847 21.945 0.428 994 HG SER 122 HG SER 122 -11.652 20.024 -1.063 995 HA PRO 123 HA PRO 123 -15.392 18.811 3.126 996 HB2 PRO 123 HB2 PRO 123 -17.576 20.224 2.192 997 HB3 PRO 123 HB1 PRO 123 -16.817 20.498 3.772 998 HG2 PRO 123 HG2 PRO 123 -16.490 22.018 1.229 999 HG3 PRO 123 HG1 PRO 123 -16.596 22.613 2.895 1000 HD2 PRO 123 HD2 PRO 123 -14.225 22.412 1.571 1001 HD3 PRO 123 HD1 PRO 123 -14.351 22.195 3.332 1002 H ALA 124 HN ALA 124 -14.936 20.253 -0.033 1003 HA ALA 124 HA ALA 124 -16.672 18.534 -1.494 1004 HB1 ALA 124 HB1 ALA 124 -15.296 19.284 -3.463 1005 HB2 ALA 124 HB2 ALA 124 -14.265 20.161 -2.332 1006 HB3 ALA 124 HB3 ALA 124 -15.964 20.602 -2.500 1007 H ALA 125 HN ALA 125 -13.227 18.408 -0.680 1008 HA ALA 125 HA ALA 125 -12.595 16.106 -2.208 1009 HB1 ALA 125 HB1 ALA 125 -11.291 17.100 0.336 1010 HB2 ALA 125 HB2 ALA 125 -10.907 17.673 -1.286 1011 HB3 ALA 125 HB3 ALA 125 -10.578 15.999 -0.841 1012 H THR 126 HN THR 126 -13.721 16.569 1.095 1013 HA THR 126 HA THR 126 -13.527 13.790 1.800 1014 HB THR 126 HB THR 126 -15.368 15.618 3.282 1015 HG1 THR 126 HG1 THR 126 -13.166 16.229 4.290 1016 HG21 THR 126 HG21 THR 126 -14.280 14.526 5.215 1017 HG22 THR 126 HG22 THR 126 -14.908 13.324 4.087 1018 HG23 THR 126 HG23 THR 126 -13.182 13.686 4.121 1019 H ALA 127 HN ALA 127 -16.014 15.875 0.404 1020 HA ALA 127 HA ALA 127 -18.162 14.037 0.803 1021 HB1 ALA 127 HB1 ALA 127 -17.884 16.357 -1.100 1022 HB2 ALA 127 HB2 ALA 127 -18.487 16.451 0.555 1023 HB3 ALA 127 HB3 ALA 127 -19.388 15.546 -0.663 1024 H ILE 128 HN ILE 128 -16.165 14.900 -2.063 1025 HA ILE 128 HA ILE 128 -17.475 13.194 -3.876 1026 HB ILE 128 HB ILE 128 -15.595 15.027 -4.187 1027 HG12 ILE 128 HG12 ILE 128 -16.721 13.991 -6.050 1028 HG13 ILE 128 HG11 ILE 128 -14.991 13.982 -6.359 1029 HG21 ILE 128 HG21 ILE 128 -13.890 12.524 -4.177 1030 HG22 ILE 128 HG22 ILE 128 -13.364 14.181 -4.470 1031 HG23 ILE 128 HG23 ILE 128 -13.905 13.700 -2.864 1032 HD11 ILE 128 HD11 ILE 128 -16.774 11.683 -5.593 1033 HD12 ILE 128 HD12 ILE 128 -15.639 11.795 -6.937 1034 HD13 ILE 128 HD13 ILE 128 -15.038 11.604 -5.290 1035 H PHE 129 HN PHE 129 -14.941 12.811 -1.590 1036 HA PHE 129 HA PHE 129 -14.031 10.225 -2.026 1037 HB2 PHE 129 HB2 PHE 129 -13.114 11.775 -0.321 1038 HB3 PHE 129 HB1 PHE 129 -14.550 11.491 0.660 1039 HD1 PHE 129 HD1 PHE 129 -14.988 9.326 1.698 1040 HD2 PHE 129 HD2 PHE 129 -11.464 9.997 -0.653 1041 HE1 PHE 129 HE1 PHE 129 -14.008 7.224 2.572 1042 HE2 PHE 129 HE2 PHE 129 -10.473 7.899 0.229 1043 HZ PHE 129 HZ PHE 129 -11.751 6.514 1.843 1044 H ARG 130 HN ARG 130 -16.863 11.336 -0.217 1045 HA ARG 130 HA ARG 130 -17.685 8.766 0.691 1046 HB2 ARG 130 HB2 ARG 130 -18.407 10.740 1.867 1047 HB3 ARG 130 HB1 ARG 130 -19.181 11.378 0.418 1048 HG2 ARG 130 HG2 ARG 130 -20.858 9.683 0.444 1049 HG3 ARG 130 HG1 ARG 130 -19.973 8.723 1.629 1050 HD2 ARG 130 HD2 ARG 130 -21.915 10.017 2.588 1051 HD3 ARG 130 HD1 ARG 130 -20.367 10.355 3.357 1052 HE ARG 130 HE ARG 130 -20.538 12.531 2.584 1053 HH11 ARG 130 HH21 ARG 130 -22.615 10.425 0.790 1054 HH12 ARG 130 HH22 ARG 130 -23.361 11.702 -0.112 1055 HH21 ARG 130 HH11 ARG 130 -21.510 14.212 1.405 1056 HH22 ARG 130 HH12 ARG 130 -22.735 13.847 0.236 1057 H LYS 131 HN LYS 131 -18.619 10.738 -2.130 1058 HA LYS 131 HA LYS 131 -20.836 9.358 -2.996 1059 HB2 LYS 131 HB2 LYS 131 -18.609 10.562 -4.650 1060 HB3 LYS 131 HB1 LYS 131 -20.167 10.051 -5.300 1061 HG2 LYS 131 HG2 LYS 131 -21.275 11.585 -3.632 1062 HG3 LYS 131 HG1 LYS 131 -19.673 12.195 -3.218 1063 HD2 LYS 131 HD2 LYS 131 -19.327 12.810 -5.610 1064 HD3 LYS 131 HD1 LYS 131 -20.978 12.293 -5.953 1065 HE2 LYS 131 HE2 LYS 131 -21.101 14.654 -5.622 1066 HE3 LYS 131 HE1 LYS 131 -21.720 13.932 -4.136 1067 HZ1 LYS 131 HZ1 LYS 131 -18.865 14.329 -4.159 1068 HZ2 LYS 131 HZ2 LYS 131 -19.758 15.771 -4.253 1069 HZ3 LYS 131 HZ3 LYS 131 -20.006 14.705 -2.957 1070 H LEU 132 HN LEU 132 -17.509 8.685 -4.152 1071 HA LEU 132 HA LEU 132 -18.228 6.293 -5.480 1072 HB2 LEU 132 HB2 LEU 132 -15.749 5.797 -5.371 1073 HB3 LEU 132 HB1 LEU 132 -16.186 7.329 -6.117 1074 HG LEU 132 HG LEU 132 -15.919 7.992 -3.405 1075 HD11 LEU 132 HD11 LEU 132 -13.538 6.290 -4.148 1076 HD12 LEU 132 HD12 LEU 132 -13.910 7.024 -2.588 1077 HD13 LEU 132 HD13 LEU 132 -14.871 5.667 -3.176 1078 HD21 LEU 132 HD21 LEU 132 -15.130 9.256 -5.435 1079 HD22 LEU 132 HD22 LEU 132 -13.959 9.217 -4.121 1080 HD23 LEU 132 HD23 LEU 132 -13.749 8.161 -5.516 1081 H ALA 133 HN ALA 133 -16.846 6.881 -2.259 1082 HA ALA 133 HA ALA 133 -16.513 4.237 -1.454 1083 HB1 ALA 133 HB1 ALA 133 -15.849 6.372 -0.215 1084 HB2 ALA 133 HB2 ALA 133 -16.453 5.037 0.762 1085 HB3 ALA 133 HB3 ALA 133 -17.504 6.401 0.389 1086 H GLY 134 HN GLY 134 -19.432 6.263 -1.491 1087 HA2 GLY 134 HA2 GLY 134 -21.106 4.478 -0.061 1088 HA3 GLY 134 HA1 GLY 134 -21.643 5.731 -1.180 1089 H GLU 135 HN GLU 135 -20.215 4.842 -3.447 1090 HA GLU 135 HA GLU 135 -22.028 2.969 -4.538 1091 HB2 GLU 135 HB2 GLU 135 -20.601 4.661 -5.805 1092 HB3 GLU 135 HB1 GLU 135 -19.254 3.542 -5.593 1093 HG2 GLU 135 HG2 GLU 135 -20.537 1.768 -6.718 1094 HG3 GLU 135 HG1 GLU 135 -21.898 2.870 -6.917 1095 H ARG 136 HN ARG 136 -19.297 2.625 -2.520 1096 HA ARG 136 HA ARG 136 -18.924 -0.208 -3.258 1097 HB2 ARG 136 HB2 ARG 136 -17.270 1.588 -1.463 1098 HB3 ARG 136 HB1 ARG 136 -16.887 -0.080 -1.892 1099 HG2 ARG 136 HG2 ARG 136 -16.985 0.686 -4.336 1100 HG3 ARG 136 HG1 ARG 136 -16.971 2.334 -3.709 1101 HD2 ARG 136 HD2 ARG 136 -14.688 1.761 -4.160 1102 HD3 ARG 136 HD1 ARG 136 -14.884 1.707 -2.410 1103 HE ARG 136 HE ARG 136 -14.398 -0.552 -2.508 1104 HH11 ARG 136 HH21 ARG 136 -15.494 0.591 -5.585 1105 HH12 ARG 136 HH22 ARG 136 -15.215 -0.913 -6.398 1106 HH21 ARG 136 HH11 ARG 136 -14.030 -2.527 -3.567 1107 HH22 ARG 136 HH12 ARG 136 -14.386 -2.679 -5.255 1108 H ASN 137 HN ASN 137 -21.001 1.388 -1.497 1109 HA ASN 137 HA ASN 137 -22.273 0.973 0.388 1110 HB2 ASN 137 HB2 ASN 137 -21.088 -1.756 0.073 1111 HB3 ASN 137 HB1 ASN 137 -22.583 -1.369 0.920 1112 HD21 ASN 137 HD21 ASN 137 -23.522 0.585 -1.075 1113 HD22 ASN 137 HD22 ASN 137 -23.958 -0.299 -2.457 1114 H TYR 138 HN TYR 138 -19.648 1.974 0.899 1115 HA TYR 138 HA TYR 138 -18.575 0.489 3.163 1116 HB2 TYR 138 HB2 TYR 138 -16.746 1.900 3.044 1117 HB3 TYR 138 HB1 TYR 138 -17.318 2.008 1.380 1118 HD1 TYR 138 HD1 TYR 138 -19.682 3.717 1.592 1119 HD2 TYR 138 HD2 TYR 138 -15.899 4.025 3.596 1120 HE1 TYR 138 HE1 TYR 138 -20.038 6.152 1.883 1121 HE2 TYR 138 HE2 TYR 138 -16.256 6.455 3.879 1122 HH TYR 138 HH TYR 138 -19.302 7.970 3.196 1123 H THR 139 HN THR 139 -18.157 1.726 5.243 1124 HA THR 139 HA THR 139 -20.477 3.448 5.935 1125 HB THR 139 HB THR 139 -20.948 2.200 7.783 1126 HG1 THR 139 HG1 THR 139 -19.461 2.116 9.230 1127 HG21 THR 139 HG21 THR 139 -20.536 0.538 5.810 1128 HG22 THR 139 HG22 THR 139 -19.105 0.069 6.725 1129 HG23 THR 139 HG23 THR 139 -20.703 -0.107 7.441 1130 H ASP 140 HN ASP 140 -20.076 5.094 7.528 1131 HA ASP 140 HA ASP 140 -17.863 6.626 7.186 1132 HB2 ASP 140 HB2 ASP 140 -19.484 6.315 9.719 1133 HB3 ASP 140 HB1 ASP 140 -18.340 7.624 9.428 1134 H GLU 141 HN GLU 141 -18.192 4.238 9.875 1135 HA GLU 141 HA GLU 141 -15.714 4.665 11.026 1136 HB2 GLU 141 HB2 GLU 141 -17.278 2.091 10.750 1137 HB3 GLU 141 HB1 GLU 141 -15.893 2.303 11.821 1138 HG2 GLU 141 HG2 GLU 141 -17.074 4.164 12.956 1139 HG3 GLU 141 HG1 GLU 141 -18.469 3.900 11.911 1140 H MET 142 HN MET 142 -16.431 3.245 7.972 1141 HA MET 142 HA MET 142 -14.021 1.691 7.753 1142 HB2 MET 142 HB2 MET 142 -15.770 2.674 5.501 1143 HB3 MET 142 HB1 MET 142 -14.687 1.289 5.498 1144 HG2 MET 142 HG2 MET 142 -16.196 0.561 7.587 1145 HG3 MET 142 HG1 MET 142 -17.373 1.583 6.773 1146 HE1 MET 142 HE1 MET 142 -15.360 -2.227 5.648 1147 HE2 MET 142 HE2 MET 142 -14.611 -0.919 4.737 1148 HE3 MET 142 HE3 MET 142 -14.712 -0.829 6.500 1149 H VAL 143 HN VAL 143 -14.769 4.982 7.426 1150 HA VAL 143 HA VAL 143 -12.157 5.476 6.102 1151 HB VAL 143 HB VAL 143 -14.108 6.057 4.631 1152 HG11 VAL 143 HG11 VAL 143 -15.429 8.042 5.179 1153 HG12 VAL 143 HG12 VAL 143 -15.628 6.830 6.441 1154 HG13 VAL 143 HG13 VAL 143 -14.582 8.223 6.702 1155 HG21 VAL 143 HG21 VAL 143 -12.144 7.187 4.041 1156 HG22 VAL 143 HG22 VAL 143 -13.244 8.530 4.337 1157 HG23 VAL 143 HG23 VAL 143 -12.065 8.067 5.561 1158 H ALA 144 HN ALA 144 -10.737 6.552 7.298 1159 HA ALA 144 HA ALA 144 -11.784 8.092 9.621 1160 HB1 ALA 144 HB1 ALA 144 -10.521 6.221 10.387 1161 HB2 ALA 144 HB2 ALA 144 -9.503 7.645 10.598 1162 HB3 ALA 144 HB3 ALA 144 -9.218 6.551 9.245 1163 H MET 145 HN MET 145 -11.691 10.237 9.337 1164 HA MET 145 HA MET 145 -9.813 11.498 7.577 1165 HB2 MET 145 HB2 MET 145 -11.941 12.435 7.453 1166 HB3 MET 145 HB1 MET 145 -12.267 12.163 9.155 1167 HG2 MET 145 HG2 MET 145 -11.652 14.259 9.647 1168 HG3 MET 145 HG1 MET 145 -10.088 14.001 8.916 1169 HE1 MET 145 HE1 MET 145 -9.863 13.588 6.533 1170 HE2 MET 145 HE2 MET 145 -11.298 13.525 5.513 1171 HE3 MET 145 HE3 MET 145 -10.203 14.910 5.422 1172 H LEU 146 HN LEU 146 -8.163 12.947 8.293 1173 HA LEU 146 HA LEU 146 -7.467 12.662 11.146 1174 HB2 LEU 146 HB2 LEU 146 -5.870 12.238 8.710 1175 HB3 LEU 146 HB1 LEU 146 -5.047 13.153 9.974 1176 HG LEU 146 HG LEU 146 -5.526 11.400 11.601 1177 HD11 LEU 146 HD11 LEU 146 -7.512 10.413 11.154 1178 HD12 LEU 146 HD12 LEU 146 -7.245 10.404 9.410 1179 HD13 LEU 146 HD13 LEU 146 -6.455 9.207 10.434 1180 HD21 LEU 146 HD21 LEU 146 -3.796 11.101 9.403 1181 HD22 LEU 146 HD22 LEU 146 -3.720 10.257 10.944 1182 HD23 LEU 146 HD23 LEU 146 -4.578 9.539 9.595 1183 HA PRO 147 HA PRO 147 -7.400 17.086 11.500 1184 HB2 PRO 147 HB2 PRO 147 -6.064 17.309 13.827 1185 HB3 PRO 147 HB1 PRO 147 -7.655 16.518 13.763 1186 HG2 PRO 147 HG2 PRO 147 -4.934 15.241 13.695 1187 HG3 PRO 147 HG1 PRO 147 -6.307 14.867 14.758 1188 HD2 PRO 147 HD2 PRO 147 -5.825 13.426 12.551 1189 HD3 PRO 147 HD1 PRO 147 -7.488 13.781 13.078 1190 H ARG 148 HN ARG 148 -5.976 18.924 11.368 1191 HA ARG 148 HA ARG 148 -3.678 18.664 9.805 1192 HB2 ARG 148 HB2 ARG 148 -4.471 20.920 11.655 1193 HB3 ARG 148 HB1 ARG 148 -3.259 21.024 10.378 1194 HG2 ARG 148 HG2 ARG 148 -4.963 20.473 8.693 1195 HG3 ARG 148 HG1 ARG 148 -6.182 20.331 9.961 1196 HD2 ARG 148 HD2 ARG 148 -4.626 22.835 9.256 1197 HD3 ARG 148 HD1 ARG 148 -6.326 22.537 8.904 1198 HE ARG 148 HE ARG 148 -5.881 22.239 11.684 1199 HH11 ARG 148 HH21 ARG 148 -5.962 24.615 9.170 1200 HH12 ARG 148 HH22 ARG 148 -6.450 25.906 10.216 1201 HH21 ARG 148 HH11 ARG 148 -6.521 23.927 13.063 1202 HH22 ARG 148 HH12 ARG 148 -6.767 25.517 12.420 1203 H GLN 149 HN GLN 149 -4.048 18.159 13.180 1204 HA GLN 149 HA GLN 149 -1.705 18.945 14.341 1205 HB2 GLN 149 HB2 GLN 149 -3.056 16.255 14.673 1206 HB3 GLN 149 HB1 GLN 149 -1.862 16.936 15.779 1207 HG2 GLN 149 HG2 GLN 149 -4.400 18.404 15.049 1208 HG3 GLN 149 HG1 GLN 149 -4.316 17.291 16.414 1209 HE21 GLN 149 HE21 GLN 149 -2.639 17.829 18.124 1210 HE22 GLN 149 HE22 GLN 149 -2.224 19.457 18.364 1211 H GLU 150 HN GLU 150 0.402 18.579 14.054 1212 HA GLU 150 HA GLU 150 1.256 16.215 12.478 1213 HB2 GLU 150 HB2 GLU 150 2.906 17.583 11.346 1214 HB3 GLU 150 HB1 GLU 150 1.307 18.289 11.105 1215 HG2 GLU 150 HG2 GLU 150 1.784 19.784 13.099 1216 HG3 GLU 150 HG1 GLU 150 3.447 19.201 13.042 1217 H GLU 151 HN GLU 151 3.087 15.195 13.153 1218 HA GLU 151 HA GLU 151 4.461 16.288 15.546 1219 HB2 GLU 151 HB2 GLU 151 4.018 13.362 14.901 1220 HB3 GLU 151 HB1 GLU 151 4.735 14.031 16.366 1221 HG2 GLU 151 HG2 GLU 151 1.892 14.542 15.444 1222 HG3 GLU 151 HG1 GLU 151 2.353 13.387 16.694 1223 H CYS 152 HN CYS 152 4.612 14.631 12.491 1224 HA CYS 152 HA CYS 152 7.507 15.166 12.332 1225 HB2 CYS 152 HB2 CYS 152 6.105 12.546 11.808 1226 HB3 CYS 152 HB1 CYS 152 7.668 12.930 11.092 1227 H THR 153 HN THR 153 8.283 15.180 10.088 1228 HA THR 153 HA THR 153 6.290 15.346 7.972 1229 HB THR 153 HB THR 153 6.996 17.661 7.337 1230 HG1 THR 153 HG1 THR 153 8.076 17.726 9.952 1231 HG21 THR 153 HG21 THR 153 5.515 18.748 8.857 1232 HG22 THR 153 HG22 THR 153 4.937 17.087 8.751 1233 HG23 THR 153 HG23 THR 153 5.880 17.605 10.148 1234 H VAL 154 HN VAL 154 7.330 15.652 5.825 1235 HA VAL 154 HA VAL 154 9.669 14.078 5.585 1236 HB VAL 154 HB VAL 154 9.424 14.410 3.243 1237 HG11 VAL 154 HG11 VAL 154 6.894 14.125 2.927 1238 HG12 VAL 154 HG12 VAL 154 7.708 12.961 3.970 1239 HG13 VAL 154 HG13 VAL 154 6.779 14.281 4.678 1240 HG21 VAL 154 HG21 VAL 154 7.695 16.159 2.441 1241 HG22 VAL 154 HG22 VAL 154 7.863 16.855 4.053 1242 HG23 VAL 154 HG23 VAL 154 9.264 16.751 2.986 1243 H ASP 155 HN ASP 155 11.590 14.798 4.472 1244 HA ASP 155 HA ASP 155 12.552 17.315 5.558 1245 HB2 ASP 155 HB2 ASP 155 14.077 15.471 5.674 1246 HB3 ASP 155 HB1 ASP 155 13.942 15.179 3.947 1247 H GLU 156 HN GLU 156 13.828 18.700 4.197 1248 HA GLU 156 HA GLU 156 12.285 19.841 2.129 1249 HB2 GLU 156 HB2 GLU 156 14.192 21.319 1.753 1250 HB3 GLU 156 HB1 GLU 156 13.928 21.109 3.485 1251 HG2 GLU 156 HG2 GLU 156 15.664 19.282 3.449 1252 HG3 GLU 156 HG1 GLU 156 16.010 19.720 1.777 1253 H VAL 157 HN VAL 157 14.539 17.256 2.125 1254 HA VAL 157 HA VAL 157 14.106 16.786 -0.689 1255 HB VAL 157 HB VAL 157 15.972 18.452 -0.691 1256 HG11 VAL 157 HG11 VAL 157 17.603 16.245 0.582 1257 HG12 VAL 157 HG12 VAL 157 18.092 17.910 0.263 1258 HG13 VAL 157 HG13 VAL 157 16.905 17.564 1.522 1259 HG21 VAL 157 HG21 VAL 157 16.851 15.673 -1.529 1260 HG22 VAL 157 HG22 VAL 157 15.687 16.642 -2.433 1261 HG23 VAL 157 HG23 VAL 157 17.347 17.207 -2.244 1262 HN1 EB4 200 H17 EB4 200 0.363 -0.965 5.779 1263 H8 EB4 200 H8 EB4 200 4.918 0.793 0.956 1264 HN2 EB4 200 H25 EB4 200 3.494 -0.142 6.340 1265 H9 EB4 200 H9 EB4 200 0.764 5.902 3.019 1266 H10 EB4 200 H10 EB4 200 -2.641 -1.106 0.670 1267 HN3 EB4 200 H32 EB4 200 0.908 1.890 7.214 1268 H7 EB4 200 H7 EB4 200 -1.114 0.836 0.474 1269 H11 EB4 200 H11 EB4 200 6.801 -0.679 1.617 1270 H12 EB4 200 H12 EB4 200 -0.172 7.230 4.894 1271 H15 EB4 200 H15 EB4 200 -0.295 6.251 7.168 1272 H14 EB4 200 H14 EB4 200 7.001 -1.459 3.962 1273 H13 EB4 200 H13 EB4 200 -2.637 -2.481 2.735 1274 H22 EB4 200 H22 EB4 200 -0.888 -3.254 7.161 1275 H30 EB4 200 H30 EB4 200 -0.388 0.088 10.167 1276 H30A EB4 200 H9N EB4 200 -1.380 1.117 9.022 1277 H24 EB4 200 H24 EB4 200 0.379 2.449 10.078 1278 H28 EB4 200 H28 EB4 200 1.276 -3.660 8.233 1279 H28A EB4 200 H9L EB4 200 1.317 -3.879 6.475 1280 H23 EB4 200 H23 EB4 200 5.142 -1.543 8.392 1281 H29 EB4 200 H29 EB4 200 4.005 -0.123 10.055 1282 H29A EB4 200 H9M EB4 200 4.905 0.885 8.819 1283 H21 ACD 300 HA3 ACD 300 0.127 9.134 -11.967 1284 H22 ACD 300 HA4 ACD 300 0.403 10.506 -10.873 1285 H31 ACD 300 HA1 ACD 300 0.328 7.563 -10.071 1286 H32 ACD 300 HA2 ACD 300 1.785 8.574 -10.200 1287 H41 ACD 300 HA0 ACD 300 -0.560 9.035 -8.300 1288 H42 ACD 300 HAZ ACD 300 0.861 10.093 -8.456 1289 H5 ACD 300 HAY ACD 300 2.259 7.795 -7.843 1290 H6 ACD 300 HAX ACD 300 1.238 7.196 -5.509 1291 H71 ACD 300 HAV ACD 300 -0.954 9.210 -6.443 1292 H72 ACD 300 HAW ACD 300 -1.438 7.574 -5.945 1293 H8 ACD 300 HAU ACD 300 -0.618 9.866 -4.099 1294 H9 ACD 300 HAT ACD 300 -0.805 8.109 -2.179 1295 H101 ACD 300 HAR ACD 300 -1.475 6.158 -4.471 1296 H102 ACD 300 HAS ACD 300 0.068 5.855 -3.639 1297 H11 ACD 300 HAQ ACD 300 -2.721 5.304 -2.525 1298 H12 ACD 300 HAP ACD 300 -1.482 4.804 -0.264 1299 H131 ACD 300 HAN ACD 300 0.778 6.603 -1.467 1300 H132 ACD 300 HAO ACD 300 1.147 4.841 -1.121 1301 H14 ACD 300 HAM ACD 300 0.843 5.228 1.282 1302 H15 ACD 300 HAL ACD 300 0.944 7.705 2.095 1303 H161 ACD 300 HAJ ACD 300 -0.326 8.546 -0.471 1304 H162 ACD 300 HAK ACD 300 0.649 9.590 0.586 1305 H171 ACD 300 HAH ACD 300 2.708 8.844 -0.474 1306 H172 ACD 300 HAI ACD 300 1.833 7.641 -1.443 1307 H181 ACD 300 HAF ACD 300 0.469 9.607 -2.391 1308 H182 ACD 300 HAG ACD 300 1.687 10.670 -1.648 1309 H191 ACD 300 HAD ACD 300 3.473 9.627 -2.917 1310 H192 ACD 300 HAE ACD 300 2.371 8.380 -3.542 1311 H201 ACD 300 HAA ACD 300 2.738 10.103 -5.243 1312 H202 ACD 300 HAB ACD 300 2.223 11.377 -4.118 1313 H203 ACD 300 HAC ACD 300 1.049 10.174 -4.700 Start of MODEL 3 1 H1 MET 1 HT1 MET 1 3.846 17.690 -22.910 2 H2 MET 1 HT2 MET 1 3.442 17.135 -21.356 3 H3 MET 1 HT3 MET 1 5.070 17.223 -21.832 4 HA MET 1 HA MET 1 4.508 19.048 -20.356 5 HB2 MET 1 HB2 MET 1 6.190 19.327 -22.189 6 HB3 MET 1 HB1 MET 1 4.907 19.952 -23.224 7 HG2 MET 1 HG2 MET 1 5.432 21.180 -20.519 8 HG3 MET 1 HG1 MET 1 6.379 21.660 -21.926 9 HE1 MET 1 HE1 MET 1 5.457 22.064 -24.085 10 HE2 MET 1 HE2 MET 1 4.045 23.065 -24.416 11 HE3 MET 1 HE3 MET 1 5.425 23.739 -23.539 12 H THR 2 HN THR 2 2.482 18.742 -23.220 13 HA THR 2 HA THR 2 0.867 21.027 -22.810 14 HB THR 2 HB THR 2 -0.662 20.020 -24.377 15 HG1 THR 2 HG1 THR 2 -0.440 17.907 -23.231 16 HG21 THR 2 HG21 THR 2 0.809 19.655 -26.210 17 HG22 THR 2 HG22 THR 2 1.679 20.740 -25.127 18 HG23 THR 2 HG23 THR 2 2.079 19.023 -25.162 19 H VAL 3 HN VAL 3 0.635 17.695 -21.652 20 HA VAL 3 HA VAL 3 -1.925 17.936 -20.456 21 HB VAL 3 HB VAL 3 -1.055 15.932 -19.072 22 HG11 VAL 3 HG11 VAL 3 -2.438 15.571 -21.015 23 HG12 VAL 3 HG12 VAL 3 -1.099 15.942 -22.102 24 HG13 VAL 3 HG13 VAL 3 -1.067 14.467 -21.135 25 HG21 VAL 3 HG21 VAL 3 1.027 14.967 -19.727 26 HG22 VAL 3 HG22 VAL 3 1.184 16.060 -21.103 27 HG23 VAL 3 HG23 VAL 3 1.368 16.677 -19.461 28 HA PRO 4 HA PRO 4 -1.522 20.332 -16.770 29 HB2 PRO 4 HB2 PRO 4 -2.086 17.746 -15.338 30 HB3 PRO 4 HB1 PRO 4 -2.774 19.358 -15.054 31 HG2 PRO 4 HG2 PRO 4 -4.102 17.469 -16.419 32 HG3 PRO 4 HG1 PRO 4 -4.242 19.192 -16.810 33 HD2 PRO 4 HD2 PRO 4 -2.938 17.047 -18.364 34 HD3 PRO 4 HD1 PRO 4 -3.450 18.663 -18.893 35 H ASP 5 HN ASP 5 0.173 20.907 -15.473 36 HA ASP 5 HA ASP 5 2.617 19.446 -15.643 37 HB2 ASP 5 HB2 ASP 5 1.846 21.786 -13.886 38 HB3 ASP 5 HB1 ASP 5 3.487 21.187 -14.116 39 H ARG 6 HN ARG 6 3.309 17.827 -14.419 40 HA ARG 6 HA ARG 6 1.789 16.978 -12.100 41 HB2 ARG 6 HB2 ARG 6 3.693 15.201 -12.059 42 HB3 ARG 6 HB1 ARG 6 2.525 15.156 -13.377 43 HG2 ARG 6 HG2 ARG 6 4.979 16.837 -13.757 44 HG3 ARG 6 HG1 ARG 6 5.165 15.088 -13.843 45 HD2 ARG 6 HD2 ARG 6 2.926 16.364 -15.381 46 HD3 ARG 6 HD1 ARG 6 4.565 16.481 -16.016 47 HE ARG 6 HE ARG 6 2.943 14.076 -15.826 48 HH11 ARG 6 HH21 ARG 6 6.091 15.477 -16.153 49 HH12 ARG 6 HH22 ARG 6 6.788 14.077 -16.898 50 HH21 ARG 6 HH11 ARG 6 3.850 12.237 -16.805 51 HH22 ARG 6 HH12 ARG 6 5.519 12.243 -17.267 52 H SER 7 HN SER 7 4.666 18.767 -12.780 53 HA SER 7 HA SER 7 6.155 18.432 -10.454 54 HB2 SER 7 HB2 SER 7 7.200 20.524 -10.983 55 HB3 SER 7 HB1 SER 7 6.819 19.733 -12.511 56 HG SER 7 HG SER 7 6.080 21.797 -12.692 57 H GLU 8 HN GLU 8 3.229 20.290 -11.013 58 HA GLU 8 HA GLU 8 3.299 21.981 -8.790 59 HB2 GLU 8 HB2 GLU 8 1.665 22.081 -10.693 60 HB3 GLU 8 HB1 GLU 8 0.826 20.708 -9.971 61 HG2 GLU 8 HG2 GLU 8 0.525 22.010 -7.882 62 HG3 GLU 8 HG1 GLU 8 1.316 23.389 -8.643 63 H ILE 9 HN ILE 9 1.728 18.759 -9.061 64 HA ILE 9 HA ILE 9 1.230 18.745 -6.199 65 HB ILE 9 HB ILE 9 -0.515 17.629 -7.212 66 HG12 ILE 9 HG12 ILE 9 1.411 15.306 -7.070 67 HG13 ILE 9 HG11 ILE 9 0.788 16.077 -5.616 68 HG21 ILE 9 HG21 ILE 9 -0.060 16.009 -9.162 69 HG22 ILE 9 HG22 ILE 9 0.143 17.730 -9.487 70 HG23 ILE 9 HG23 ILE 9 1.555 16.712 -9.209 71 HD11 ILE 9 HD11 ILE 9 -0.742 14.341 -5.900 72 HD12 ILE 9 HD12 ILE 9 -1.555 15.649 -6.749 73 HD13 ILE 9 HD13 ILE 9 -0.669 14.429 -7.661 74 H ALA 10 HN ALA 10 3.613 17.450 -8.414 75 HA ALA 10 HA ALA 10 4.642 15.538 -6.539 76 HB1 ALA 10 HB1 ALA 10 6.204 16.716 -8.838 77 HB2 ALA 10 HB2 ALA 10 5.055 15.391 -9.027 78 HB3 ALA 10 HB3 ALA 10 6.484 15.181 -8.016 79 H GLY 11 HN GLY 11 6.163 15.744 -5.002 80 HA2 GLY 11 HA2 GLY 11 8.183 17.022 -4.261 81 HA3 GLY 11 HA1 GLY 11 7.217 18.470 -4.523 82 H LYS 12 HN LYS 12 4.740 17.232 -3.557 83 HA LYS 12 HA LYS 12 5.153 16.362 -0.855 84 HB2 LYS 12 HB2 LYS 12 5.703 18.791 -0.682 85 HB3 LYS 12 HB1 LYS 12 4.064 19.159 -1.222 86 HG2 LYS 12 HG2 LYS 12 3.150 17.903 0.700 87 HG3 LYS 12 HG1 LYS 12 4.790 17.550 1.244 88 HD2 LYS 12 HD2 LYS 12 5.222 20.004 1.408 89 HD3 LYS 12 HD1 LYS 12 3.536 20.298 0.981 90 HE2 LYS 12 HE2 LYS 12 3.969 20.331 3.458 91 HE3 LYS 12 HE1 LYS 12 2.769 19.136 2.965 92 HZ1 LYS 12 HZ1 LYS 12 4.467 18.294 4.546 93 HZ2 LYS 12 HZ2 LYS 12 4.387 17.418 3.093 94 HZ3 LYS 12 HZ3 LYS 12 5.647 18.524 3.346 95 H TRP 13 HN TRP 13 3.531 14.849 -0.778 96 HA TRP 13 HA TRP 13 0.833 15.631 -1.749 97 HB2 TRP 13 HB2 TRP 13 2.221 12.947 -1.476 98 HB3 TRP 13 HB1 TRP 13 0.507 13.063 -1.782 99 HD1 TRP 13 HD1 TRP 13 3.467 14.908 -3.429 100 HE1 TRP 13 HE1 TRP 13 3.278 14.448 -5.952 101 HE3 TRP 13 HE3 TRP 13 -0.722 12.004 -3.508 102 HZ2 TRP 13 HZ2 TRP 13 1.647 13.011 -7.741 103 HZ3 TRP 13 HZ3 TRP 13 -1.591 11.114 -5.651 104 HH2 TRP 13 HH2 TRP 13 -0.427 11.630 -7.779 105 H TYR 14 HN TYR 14 -0.645 15.913 -0.060 106 HA TYR 14 HA TYR 14 0.156 14.967 2.602 107 HB2 TYR 14 HB2 TYR 14 -1.031 17.343 1.577 108 HB3 TYR 14 HB1 TYR 14 -2.236 16.580 2.602 109 HD1 TYR 14 HD1 TYR 14 1.519 16.805 2.804 110 HD2 TYR 14 HD2 TYR 14 -2.258 17.625 4.688 111 HE1 TYR 14 HE1 TYR 14 2.695 17.659 4.807 112 HE2 TYR 14 HE2 TYR 14 -1.069 18.483 6.686 113 HH TYR 14 HH TYR 14 0.991 19.258 7.408 114 H VAL 15 HN VAL 15 -0.742 13.283 3.507 115 HA VAL 15 HA VAL 15 -3.208 12.112 2.378 116 HB VAL 15 HB VAL 15 -1.170 10.981 4.310 117 HG11 VAL 15 HG11 VAL 15 -3.305 9.984 4.783 118 HG12 VAL 15 HG12 VAL 15 -3.671 9.816 3.066 119 HG13 VAL 15 HG13 VAL 15 -2.409 8.827 3.800 120 HG21 VAL 15 HG21 VAL 15 -0.874 9.404 2.242 121 HG22 VAL 15 HG22 VAL 15 -1.634 10.717 1.343 122 HG23 VAL 15 HG23 VAL 15 -0.121 10.999 2.203 123 H VAL 16 HN VAL 16 -5.103 12.592 3.405 124 HA VAL 16 HA VAL 16 -4.986 13.099 6.327 125 HB VAL 16 HB VAL 16 -6.524 14.890 6.120 126 HG11 VAL 16 HG11 VAL 16 -4.522 15.312 3.898 127 HG12 VAL 16 HG12 VAL 16 -5.097 16.487 5.074 128 HG13 VAL 16 HG13 VAL 16 -4.027 15.190 5.569 129 HG21 VAL 16 HG21 VAL 16 -6.636 14.050 3.217 130 HG22 VAL 16 HG22 VAL 16 -7.974 14.222 4.353 131 HG23 VAL 16 HG23 VAL 16 -7.150 15.655 3.737 132 H ALA 17 HN ALA 17 -6.114 10.864 4.328 133 HA ALA 17 HA ALA 17 -8.063 9.968 6.149 134 HB1 ALA 17 HB1 ALA 17 -9.894 10.390 4.071 135 HB2 ALA 17 HB2 ALA 17 -9.014 11.911 4.182 136 HB3 ALA 17 HB3 ALA 17 -9.843 11.274 5.588 137 H LEU 18 HN LEU 18 -8.403 7.804 5.783 138 HA LEU 18 HA LEU 18 -8.252 6.828 3.034 139 HB2 LEU 18 HB2 LEU 18 -6.012 6.442 3.380 140 HB3 LEU 18 HB1 LEU 18 -6.169 6.458 5.125 141 HG LEU 18 HG LEU 18 -7.369 4.152 3.624 142 HD11 LEU 18 HD11 LEU 18 -5.116 4.413 2.650 143 HD12 LEU 18 HD12 LEU 18 -4.422 4.415 4.271 144 HD13 LEU 18 HD13 LEU 18 -5.221 2.968 3.655 145 HD21 LEU 18 HD21 LEU 18 -5.751 3.916 6.128 146 HD22 LEU 18 HD22 LEU 18 -7.309 4.720 6.250 147 HD23 LEU 18 HD23 LEU 18 -7.219 3.064 5.658 148 H ALA 19 HN ALA 19 -9.281 4.884 2.741 149 HA ALA 19 HA ALA 19 -10.774 3.852 5.073 150 HB1 ALA 19 HB1 ALA 19 -12.265 4.929 3.432 151 HB2 ALA 19 HB2 ALA 19 -12.546 3.193 3.499 152 HB3 ALA 19 HB3 ALA 19 -11.624 3.885 2.168 153 H SER 20 HN SER 20 -11.343 1.571 4.920 154 HA SER 20 HA SER 20 -9.828 -0.094 3.104 155 HB2 SER 20 HB2 SER 20 -9.119 -0.310 6.024 156 HB3 SER 20 HB1 SER 20 -8.350 -1.112 4.658 157 HG SER 20 HG SER 20 -8.093 1.482 5.605 158 H ASN 21 HN ASN 21 -9.941 -2.458 3.895 159 HA ASN 21 HA ASN 21 -12.652 -2.964 4.979 160 HB2 ASN 21 HB2 ASN 21 -11.085 -4.395 2.824 161 HB3 ASN 21 HB1 ASN 21 -12.484 -5.112 3.620 162 HD21 ASN 21 HD21 ASN 21 -12.970 -1.785 3.541 163 HD22 ASN 21 HD22 ASN 21 -13.893 -1.693 2.119 164 H THR 22 HN THR 22 -9.287 -3.400 5.247 165 HA THR 22 HA THR 22 -9.465 -5.779 6.927 166 HB THR 22 HB THR 22 -7.533 -5.342 5.343 167 HG1 THR 22 HG1 THR 22 -6.365 -6.496 6.660 168 HG21 THR 22 HG21 THR 22 -6.421 -3.534 7.453 169 HG22 THR 22 HG22 THR 22 -5.972 -3.670 5.756 170 HG23 THR 22 HG23 THR 22 -7.463 -2.843 6.209 171 H GLU 23 HN GLU 23 -10.326 -5.438 8.862 172 HA GLU 23 HA GLU 23 -10.751 -3.128 10.201 173 HB2 GLU 23 HB2 GLU 23 -11.569 -5.374 10.898 174 HB3 GLU 23 HB1 GLU 23 -9.969 -5.708 11.562 175 HG2 GLU 23 HG2 GLU 23 -10.175 -3.784 13.073 176 HG3 GLU 23 HG1 GLU 23 -11.754 -3.399 12.391 177 H PHE 24 HN PHE 24 -7.713 -4.860 10.077 178 HA PHE 24 HA PHE 24 -6.405 -3.675 12.224 179 HB2 PHE 24 HB2 PHE 24 -4.956 -4.191 9.647 180 HB3 PHE 24 HB1 PHE 24 -4.424 -4.483 11.303 181 HD1 PHE 24 HD1 PHE 24 -6.626 -5.945 12.521 182 HD2 PHE 24 HD2 PHE 24 -5.025 -6.258 8.545 183 HE1 PHE 24 HE1 PHE 24 -7.449 -8.278 12.371 184 HE2 PHE 24 HE2 PHE 24 -5.849 -8.592 8.398 185 HZ PHE 24 HZ PHE 24 -7.061 -9.602 10.311 186 H PHE 25 HN PHE 25 -6.483 -2.486 8.823 187 HA PHE 25 HA PHE 25 -4.907 -0.208 9.451 188 HB2 PHE 25 HB2 PHE 25 -5.454 -1.481 7.152 189 HB3 PHE 25 HB1 PHE 25 -6.591 -0.144 7.005 190 HD1 PHE 25 HD1 PHE 25 -5.574 2.223 7.738 191 HD2 PHE 25 HD2 PHE 25 -3.276 -1.141 6.383 192 HE1 PHE 25 HE1 PHE 25 -3.698 3.741 7.152 193 HE2 PHE 25 HE2 PHE 25 -1.406 0.377 5.795 194 HZ PHE 25 HZ PHE 25 -1.616 2.816 6.176 195 H LEU 26 HN LEU 26 -8.435 -0.519 8.882 196 HA LEU 26 HA LEU 26 -8.874 2.296 9.132 197 HB2 LEU 26 HB2 LEU 26 -11.282 1.663 9.446 198 HB3 LEU 26 HB1 LEU 26 -10.540 1.032 7.981 199 HG LEU 26 HG LEU 26 -10.024 -1.001 9.784 200 HD11 LEU 26 HD11 LEU 26 -12.172 -1.437 10.942 201 HD12 LEU 26 HD12 LEU 26 -11.426 0.056 11.510 202 HD13 LEU 26 HD13 LEU 26 -12.781 0.119 10.383 203 HD21 LEU 26 HD21 LEU 26 -10.822 -1.529 7.617 204 HD22 LEU 26 HD22 LEU 26 -12.123 -2.065 8.680 205 HD23 LEU 26 HD23 LEU 26 -12.266 -0.537 7.811 206 H ARG 27 HN ARG 27 -8.995 -0.401 11.319 207 HA ARG 27 HA ARG 27 -10.019 0.893 13.606 208 HB2 ARG 27 HB2 ARG 27 -9.704 -1.541 13.551 209 HB3 ARG 27 HB1 ARG 27 -7.953 -1.324 13.506 210 HG2 ARG 27 HG2 ARG 27 -7.960 -0.302 15.696 211 HG3 ARG 27 HG1 ARG 27 -9.723 -0.273 15.727 212 HD2 ARG 27 HD2 ARG 27 -9.686 -2.787 15.548 213 HD3 ARG 27 HD1 ARG 27 -7.937 -2.718 15.750 214 HE ARG 27 HE ARG 27 -8.276 -2.323 18.010 215 HH11 ARG 27 HH21 ARG 27 -11.160 -1.697 16.201 216 HH12 ARG 27 HH22 ARG 27 -12.147 -1.443 17.601 217 HH21 ARG 27 HH11 ARG 27 -9.567 -1.990 19.850 218 HH22 ARG 27 HH12 ARG 27 -11.246 -1.608 19.666 219 H GLU 28 HN GLU 28 -6.677 0.507 12.473 220 HA GLU 28 HA GLU 28 -5.586 2.127 14.584 221 HB2 GLU 28 HB2 GLU 28 -4.459 0.218 13.216 222 HB3 GLU 28 HB1 GLU 28 -4.133 1.482 12.032 223 HG2 GLU 28 HG2 GLU 28 -2.217 1.437 13.447 224 HG3 GLU 28 HG1 GLU 28 -3.150 2.839 13.969 225 H LYS 29 HN LYS 29 -6.347 2.712 11.110 226 HA LYS 29 HA LYS 29 -5.104 5.107 10.717 227 HB2 LYS 29 HB2 LYS 29 -6.391 4.022 8.971 228 HB3 LYS 29 HB1 LYS 29 -7.882 4.262 9.870 229 HG2 LYS 29 HG2 LYS 29 -7.824 5.949 8.177 230 HG3 LYS 29 HG1 LYS 29 -7.459 6.770 9.688 231 HD2 LYS 29 HD2 LYS 29 -5.101 6.810 9.179 232 HD3 LYS 29 HD1 LYS 29 -5.332 5.753 7.787 233 HE2 LYS 29 HE2 LYS 29 -6.929 7.617 6.915 234 HE3 LYS 29 HE1 LYS 29 -6.144 8.638 8.111 235 HZ1 LYS 29 HZ1 LYS 29 -5.221 8.024 5.591 236 HZ2 LYS 29 HZ2 LYS 29 -4.372 8.831 6.822 237 HZ3 LYS 29 HZ3 LYS 29 -4.225 7.150 6.653 238 H ASP 30 HN ASP 30 -7.858 4.408 12.704 239 HA ASP 30 HA ASP 30 -8.799 7.044 13.072 240 HB2 ASP 30 HB2 ASP 30 -10.085 4.977 13.594 241 HB3 ASP 30 HB1 ASP 30 -9.032 4.715 14.984 242 H LYS 31 HN LYS 31 -6.144 5.280 14.607 243 HA LYS 31 HA LYS 31 -6.001 7.298 16.696 244 HB2 LYS 31 HB2 LYS 31 -4.463 5.945 17.851 245 HB3 LYS 31 HB1 LYS 31 -5.686 4.862 17.204 246 HG2 LYS 31 HG2 LYS 31 -3.730 3.731 16.662 247 HG3 LYS 31 HG1 LYS 31 -4.050 4.620 15.191 248 HD2 LYS 31 HD2 LYS 31 -2.498 6.371 16.816 249 HD3 LYS 31 HD1 LYS 31 -1.750 4.789 16.957 250 HE2 LYS 31 HE2 LYS 31 -2.520 5.681 14.208 251 HE3 LYS 31 HE1 LYS 31 -1.130 6.456 14.953 252 HZ1 LYS 31 HZ1 LYS 31 -1.532 3.596 14.352 253 HZ2 LYS 31 HZ2 LYS 31 -0.245 4.608 13.898 254 HZ3 LYS 31 HZ3 LYS 31 -0.392 4.098 15.509 255 H MET 32 HN MET 32 -4.416 6.788 13.616 256 HA MET 32 HA MET 32 -2.099 8.336 14.437 257 HB2 MET 32 HB2 MET 32 -1.654 8.392 11.894 258 HB3 MET 32 HB1 MET 32 -1.524 6.847 12.707 259 HG2 MET 32 HG2 MET 32 -4.104 6.670 12.030 260 HG3 MET 32 HG1 MET 32 -3.609 7.812 10.797 261 HE1 MET 32 HE1 MET 32 -3.380 4.592 12.447 262 HE2 MET 32 HE2 MET 32 -2.574 3.467 11.374 263 HE3 MET 32 HE3 MET 32 -1.626 4.545 12.400 264 H LYS 33 HN LYS 33 -1.462 10.109 12.837 265 HA LYS 33 HA LYS 33 -3.677 12.058 12.605 266 HB2 LYS 33 HB2 LYS 33 -0.821 12.447 13.495 267 HB3 LYS 33 HB1 LYS 33 -1.866 13.783 13.009 268 HG2 LYS 33 HG2 LYS 33 -3.481 13.191 14.748 269 HG3 LYS 33 HG1 LYS 33 -2.511 11.790 15.201 270 HD2 LYS 33 HD2 LYS 33 -0.626 13.306 15.768 271 HD3 LYS 33 HD1 LYS 33 -1.648 14.689 15.387 272 HE2 LYS 33 HE2 LYS 33 -3.273 13.922 17.118 273 HE3 LYS 33 HE1 LYS 33 -2.158 12.625 17.547 274 HZ1 LYS 33 HZ1 LYS 33 -1.413 15.495 17.576 275 HZ2 LYS 33 HZ2 LYS 33 -1.987 14.666 18.944 276 HZ3 LYS 33 HZ3 LYS 33 -0.531 14.191 18.214 277 H MET 34 HN MET 34 -3.037 13.850 10.999 278 HA MET 34 HA MET 34 -2.875 12.983 8.466 279 HB2 MET 34 HB2 MET 34 -3.328 15.279 9.354 280 HB3 MET 34 HB1 MET 34 -1.599 15.511 9.518 281 HG2 MET 34 HG2 MET 34 -1.239 15.510 7.218 282 HG3 MET 34 HG1 MET 34 -2.733 14.648 6.890 283 HE1 MET 34 HE1 MET 34 -4.911 15.443 7.666 284 HE2 MET 34 HE2 MET 34 -4.933 16.771 8.816 285 HE3 MET 34 HE3 MET 34 -5.528 17.018 7.175 286 H ALA 35 HN ALA 35 -1.398 12.456 7.008 287 HA ALA 35 HA ALA 35 1.455 12.349 7.780 288 HB1 ALA 35 HB1 ALA 35 1.454 10.351 6.129 289 HB2 ALA 35 HB2 ALA 35 -0.294 10.361 6.353 290 HB3 ALA 35 HB3 ALA 35 0.767 10.104 7.733 291 H MET 36 HN MET 36 2.911 12.188 5.831 292 HA MET 36 HA MET 36 1.878 13.780 3.563 293 HB2 MET 36 HB2 MET 36 4.617 14.457 3.907 294 HB3 MET 36 HB1 MET 36 3.219 15.504 4.117 295 HG2 MET 36 HG2 MET 36 4.215 13.658 6.296 296 HG3 MET 36 HG1 MET 36 4.767 15.322 6.125 297 HE1 MET 36 HE1 MET 36 2.326 14.240 8.978 298 HE2 MET 36 HE2 MET 36 4.001 14.429 8.472 299 HE3 MET 36 HE3 MET 36 3.080 15.831 9.034 300 H ALA 37 HN ALA 37 3.378 13.695 1.673 301 HA ALA 37 HA ALA 37 5.101 11.360 1.497 302 HB1 ALA 37 HB1 ALA 37 3.187 10.123 1.037 303 HB2 ALA 37 HB2 ALA 37 3.690 10.609 -0.583 304 HB3 ALA 37 HB3 ALA 37 2.385 11.469 0.235 305 H ARG 38 HN ARG 38 6.230 11.208 -0.548 306 HA ARG 38 HA ARG 38 6.231 13.722 -2.137 307 HB2 ARG 38 HB2 ARG 38 8.098 14.009 -0.711 308 HB3 ARG 38 HB1 ARG 38 8.527 12.306 -0.780 309 HG2 ARG 38 HG2 ARG 38 10.092 13.666 -2.108 310 HG3 ARG 38 HG1 ARG 38 9.196 12.568 -3.153 311 HD2 ARG 38 HD2 ARG 38 7.697 14.351 -3.826 312 HD3 ARG 38 HD1 ARG 38 8.409 15.438 -2.643 313 HE ARG 38 HE ARG 38 9.492 14.770 -5.237 314 HH11 ARG 38 HH21 ARG 38 10.148 15.837 -2.012 315 HH12 ARG 38 HH22 ARG 38 11.617 16.652 -2.432 316 HH21 ARG 38 HH11 ARG 38 11.417 15.835 -5.796 317 HH22 ARG 38 HH12 ARG 38 12.337 16.651 -4.576 318 H ILE 39 HN ILE 39 6.077 13.297 -4.374 319 HA ILE 39 HA ILE 39 6.733 10.601 -5.285 320 HB ILE 39 HB ILE 39 4.368 11.269 -5.201 321 HG12 ILE 39 HG12 ILE 39 5.091 11.126 -8.112 322 HG13 ILE 39 HG11 ILE 39 5.481 9.761 -7.071 323 HG21 ILE 39 HG21 ILE 39 3.633 12.916 -6.803 324 HG22 ILE 39 HG22 ILE 39 4.726 13.606 -5.606 325 HG23 ILE 39 HG23 ILE 39 5.275 13.268 -7.242 326 HD11 ILE 39 HD11 ILE 39 3.086 9.919 -8.208 327 HD12 ILE 39 HD12 ILE 39 3.255 9.324 -6.562 328 HD13 ILE 39 HD13 ILE 39 2.746 10.985 -6.858 329 H SER 40 HN SER 40 7.975 10.498 -7.204 330 HA SER 40 HA SER 40 8.468 12.943 -8.683 331 HB2 SER 40 HB2 SER 40 10.788 11.570 -7.372 332 HB3 SER 40 HB1 SER 40 10.825 13.030 -8.340 333 HG SER 40 HG SER 40 9.235 13.782 -6.652 334 H PHE 41 HN PHE 41 9.813 12.556 -10.616 335 HA PHE 41 HA PHE 41 9.182 9.895 -11.671 336 HB2 PHE 41 HB2 PHE 41 9.995 12.446 -13.062 337 HB3 PHE 41 HB1 PHE 41 9.592 10.935 -13.875 338 HD1 PHE 41 HD2 PHE 41 8.262 13.655 -11.732 339 HD2 PHE 41 HD1 PHE 41 7.317 10.195 -14.096 340 HE1 PHE 41 HE2 PHE 41 5.852 14.228 -11.609 341 HE2 PHE 41 HE1 PHE 41 4.908 10.769 -13.974 342 HZ PHE 41 HZ PHE 41 4.175 12.786 -12.730 343 H LEU 42 HN LEU 42 10.904 8.691 -10.755 344 HA LEU 42 HA LEU 42 13.661 9.270 -11.083 345 HB2 LEU 42 HB2 LEU 42 12.193 6.620 -10.964 346 HB3 LEU 42 HB1 LEU 42 13.943 6.744 -11.018 347 HG LEU 42 HG LEU 42 12.377 8.248 -8.927 348 HD11 LEU 42 HD11 LEU 42 12.996 5.304 -9.039 349 HD12 LEU 42 HD12 LEU 42 13.034 6.131 -7.483 350 HD13 LEU 42 HD13 LEU 42 11.551 6.117 -8.438 351 HD21 LEU 42 HD21 LEU 42 14.525 7.829 -7.655 352 HD22 LEU 42 HD22 LEU 42 15.190 7.115 -9.122 353 HD23 LEU 42 HD23 LEU 42 14.729 8.817 -9.099 354 H GLY 43 HN GLY 43 11.239 7.747 -13.033 355 HA2 GLY 43 HA2 GLY 43 12.438 8.418 -15.530 356 HA3 GLY 43 HA1 GLY 43 12.594 6.694 -15.181 357 H GLU 44 HN GLU 44 11.009 7.678 -17.333 358 HA GLU 44 HA GLU 44 8.313 8.084 -16.824 359 HB2 GLU 44 HB2 GLU 44 9.552 6.461 -19.066 360 HB3 GLU 44 HB1 GLU 44 7.898 7.072 -19.048 361 HG2 GLU 44 HG2 GLU 44 8.746 9.381 -18.884 362 HG3 GLU 44 HG1 GLU 44 10.401 8.776 -18.892 363 H ASP 45 HN ASP 45 10.179 5.124 -16.649 364 HA ASP 45 HA ASP 45 7.732 3.639 -15.891 365 HB2 ASP 45 HB2 ASP 45 9.470 1.651 -16.222 366 HB3 ASP 45 HB1 ASP 45 8.605 2.350 -17.587 367 H GLU 46 HN GLU 46 9.650 5.467 -14.324 368 HA GLU 46 HA GLU 46 9.822 3.696 -11.996 369 HB2 GLU 46 HB2 GLU 46 12.187 5.338 -12.917 370 HB3 GLU 46 HB1 GLU 46 12.121 4.255 -11.528 371 HG2 GLU 46 HG2 GLU 46 11.594 2.378 -13.138 372 HG3 GLU 46 HG1 GLU 46 11.941 3.498 -14.453 373 H LEU 47 HN LEU 47 8.794 4.720 -10.428 374 HA LEU 47 HA LEU 47 9.162 7.644 -10.118 375 HB2 LEU 47 HB2 LEU 47 6.608 6.226 -9.371 376 HB3 LEU 47 HB1 LEU 47 6.887 7.952 -9.569 377 HG LEU 47 HG LEU 47 7.065 5.958 -11.847 378 HD11 LEU 47 HD11 LEU 47 4.798 6.041 -10.846 379 HD12 LEU 47 HD12 LEU 47 4.787 7.792 -11.059 380 HD13 LEU 47 HD13 LEU 47 4.833 6.733 -12.468 381 HD21 LEU 47 HD21 LEU 47 6.643 8.157 -13.132 382 HD22 LEU 47 HD22 LEU 47 7.056 8.978 -11.628 383 HD23 LEU 47 HD23 LEU 47 8.240 7.947 -12.425 384 H LYS 48 HN LYS 48 9.451 8.352 -8.025 385 HA LYS 48 HA LYS 48 9.757 6.237 -5.982 386 HB2 LYS 48 HB2 LYS 48 11.688 7.844 -6.746 387 HB3 LYS 48 HB1 LYS 48 10.873 9.016 -5.721 388 HG2 LYS 48 HG2 LYS 48 11.121 7.613 -3.781 389 HG3 LYS 48 HG1 LYS 48 11.682 6.257 -4.760 390 HD2 LYS 48 HD2 LYS 48 13.588 7.371 -3.681 391 HD3 LYS 48 HD1 LYS 48 13.671 7.566 -5.429 392 HE2 LYS 48 HE2 LYS 48 13.037 9.822 -5.340 393 HE3 LYS 48 HE1 LYS 48 12.306 9.656 -3.744 394 HZ1 LYS 48 HZ1 LYS 48 14.216 10.444 -2.968 395 HZ2 LYS 48 HZ2 LYS 48 14.905 8.941 -3.362 396 HZ3 LYS 48 HZ3 LYS 48 15.016 10.236 -4.452 397 H VAL 49 HN VAL 49 8.160 6.136 -4.492 398 HA VAL 49 HA VAL 49 6.847 8.670 -3.736 399 HB VAL 49 HB VAL 49 5.625 6.088 -4.527 400 HG11 VAL 49 HG11 VAL 49 5.030 5.977 -2.170 401 HG12 VAL 49 HG12 VAL 49 4.582 7.684 -2.168 402 HG13 VAL 49 HG13 VAL 49 3.622 6.521 -3.082 403 HG21 VAL 49 HG21 VAL 49 3.740 7.708 -4.991 404 HG22 VAL 49 HG22 VAL 49 4.797 8.997 -4.420 405 HG23 VAL 49 HG23 VAL 49 5.244 8.048 -5.834 406 H SER 50 HN SER 50 6.603 9.130 -1.714 407 HA SER 50 HA SER 50 7.848 7.316 0.282 408 HB2 SER 50 HB2 SER 50 9.145 9.320 -0.493 409 HB3 SER 50 HB1 SER 50 7.882 10.318 0.202 410 HG SER 50 HG SER 50 9.556 9.992 1.705 411 H TYR 51 HN TYR 51 7.074 7.377 2.410 412 HA TYR 51 HA TYR 51 4.490 8.777 2.825 413 HB2 TYR 51 HB2 TYR 51 5.153 6.182 4.204 414 HB3 TYR 51 HB1 TYR 51 3.581 6.934 3.952 415 HD1 TYR 51 HD1 TYR 51 3.428 7.518 1.151 416 HD2 TYR 51 HD2 TYR 51 5.234 4.144 3.095 417 HE1 TYR 51 HE1 TYR 51 3.072 6.144 -0.876 418 HE2 TYR 51 HE2 TYR 51 4.892 2.783 1.054 419 HH TYR 51 HH TYR 51 2.949 3.119 -1.062 420 H ALA 52 HN ALA 52 4.383 9.992 4.631 421 HA ALA 52 HA ALA 52 6.453 9.616 6.717 422 HB1 ALA 52 HB1 ALA 52 5.571 12.075 5.278 423 HB2 ALA 52 HB2 ALA 52 7.164 11.649 5.897 424 HB3 ALA 52 HB3 ALA 52 5.918 12.228 7.001 425 H VAL 53 HN VAL 53 5.379 8.729 8.419 426 HA VAL 53 HA VAL 53 2.667 9.729 9.007 427 HB VAL 53 HB VAL 53 3.826 7.164 10.056 428 HG11 VAL 53 HG11 VAL 53 1.701 8.053 10.995 429 HG12 VAL 53 HG12 VAL 53 1.005 8.051 9.375 430 HG13 VAL 53 HG13 VAL 53 1.461 6.529 10.141 431 HG21 VAL 53 HG21 VAL 53 2.569 7.696 7.350 432 HG22 VAL 53 HG22 VAL 53 4.147 6.981 7.676 433 HG23 VAL 53 HG23 VAL 53 2.677 6.087 8.064 434 HA PRO 54 HA PRO 54 4.813 11.218 12.712 435 HB2 PRO 54 HB2 PRO 54 2.966 12.997 13.530 436 HB3 PRO 54 HB1 PRO 54 3.963 13.301 12.094 437 HG2 PRO 54 HG2 PRO 54 1.144 12.353 12.272 438 HG3 PRO 54 HG1 PRO 54 1.870 13.523 11.157 439 HD2 PRO 54 HD2 PRO 54 1.388 10.855 10.533 440 HD3 PRO 54 HD1 PRO 54 2.581 11.883 9.709 441 H LYS 55 HN LYS 55 4.864 9.864 14.413 442 HA LYS 55 HA LYS 55 2.343 8.790 15.493 443 HB2 LYS 55 HB2 LYS 55 4.228 7.251 14.787 444 HB3 LYS 55 HB1 LYS 55 5.145 7.892 16.150 445 HG2 LYS 55 HG2 LYS 55 3.246 7.241 17.657 446 HG3 LYS 55 HG1 LYS 55 2.477 6.461 16.276 447 HD2 LYS 55 HD2 LYS 55 4.649 5.140 15.993 448 HD3 LYS 55 HD1 LYS 55 5.103 5.740 17.589 449 HE2 LYS 55 HE2 LYS 55 3.042 4.767 18.541 450 HE3 LYS 55 HE1 LYS 55 2.594 4.162 16.947 451 HZ1 LYS 55 HZ1 LYS 55 3.685 2.344 17.634 452 HZ2 LYS 55 HZ2 LYS 55 5.074 3.212 17.182 453 HZ3 LYS 55 HZ3 LYS 55 4.587 3.181 18.806 454 HA PRO 56 HA PRO 56 2.893 12.152 18.587 455 HB2 PRO 56 HB2 PRO 56 0.894 10.285 19.840 456 HB3 PRO 56 HB1 PRO 56 0.913 12.062 19.825 457 HG2 PRO 56 HG2 PRO 56 -0.652 10.684 18.165 458 HG3 PRO 56 HG1 PRO 56 0.142 12.185 17.658 459 HD2 PRO 56 HD2 PRO 56 0.728 9.398 16.839 460 HD3 PRO 56 HD1 PRO 56 1.106 10.918 15.996 461 H ASN 57 HN ASN 57 3.328 8.716 18.850 462 HA ASN 57 HA ASN 57 4.624 8.936 21.486 463 HB2 ASN 57 HB2 ASN 57 3.955 6.519 19.792 464 HB3 ASN 57 HB1 ASN 57 4.685 6.467 21.395 465 HD21 ASN 57 HD21 ASN 57 3.215 8.351 22.816 466 HD22 ASN 57 HD22 ASN 57 1.577 7.909 22.850 467 H GLY 58 HN GLY 58 5.337 8.519 18.103 468 HA2 GLY 58 HA2 GLY 58 8.187 8.783 18.645 469 HA3 GLY 58 HA1 GLY 58 7.703 7.282 17.862 470 H CYS 59 HN CYS 59 8.969 7.910 16.016 471 HA CYS 59 HA CYS 59 7.474 9.660 14.183 472 HB2 CYS 59 HB2 CYS 59 9.369 10.944 15.323 473 HB3 CYS 59 HB1 CYS 59 10.473 9.884 14.445 474 H ARG 60 HN ARG 60 7.006 8.371 12.492 475 HA ARG 60 HA ARG 60 9.070 6.421 11.611 476 HB2 ARG 60 HB2 ARG 60 6.074 6.290 11.206 477 HB3 ARG 60 HB1 ARG 60 7.250 5.062 10.740 478 HG2 ARG 60 HG2 ARG 60 6.808 6.003 13.589 479 HG3 ARG 60 HG1 ARG 60 6.079 4.552 12.902 480 HD2 ARG 60 HD2 ARG 60 7.982 3.656 13.897 481 HD3 ARG 60 HD1 ARG 60 8.580 3.962 12.271 482 HE ARG 60 HE ARG 60 8.965 6.185 14.077 483 HH11 ARG 60 HH21 ARG 60 10.183 3.166 12.903 484 HH12 ARG 60 HH22 ARG 60 11.832 3.517 13.305 485 HH21 ARG 60 HH11 ARG 60 11.124 6.651 14.608 486 HH22 ARG 60 HH12 ARG 60 12.364 5.491 14.270 487 H LYS 61 HN LYS 61 10.109 7.175 9.897 488 HA LYS 61 HA LYS 61 8.538 8.283 7.654 489 HB2 LYS 61 HB2 LYS 61 10.478 9.861 7.246 490 HB3 LYS 61 HB1 LYS 61 9.496 10.231 8.663 491 HG2 LYS 61 HG2 LYS 61 11.144 9.005 10.082 492 HG3 LYS 61 HG1 LYS 61 12.149 8.762 8.653 493 HD2 LYS 61 HD2 LYS 61 12.340 11.196 8.357 494 HD3 LYS 61 HD1 LYS 61 11.312 11.455 9.767 495 HE2 LYS 61 HE2 LYS 61 12.938 10.538 11.248 496 HE3 LYS 61 HE1 LYS 61 13.874 9.859 9.917 497 HZ1 LYS 61 HZ1 LYS 61 14.573 12.093 11.038 498 HZ2 LYS 61 HZ2 LYS 61 14.732 11.883 9.359 499 HZ3 LYS 61 HZ3 LYS 61 13.417 12.754 9.983 500 H TRP 62 HN TRP 62 9.047 7.379 5.726 501 HA TRP 62 HA TRP 62 11.690 6.314 5.236 502 HB2 TRP 62 HB2 TRP 62 11.315 4.102 5.505 503 HB3 TRP 62 HB1 TRP 62 9.910 4.587 6.443 504 HD1 TRP 62 HD1 TRP 62 7.730 5.237 4.536 505 HE1 TRP 62 HE1 TRP 62 6.835 3.570 2.781 506 HE3 TRP 62 HE3 TRP 62 11.731 2.084 4.188 507 HZ2 TRP 62 HZ2 TRP 62 7.706 1.213 1.408 508 HZ3 TRP 62 HZ3 TRP 62 11.673 0.141 2.652 509 HH2 TRP 62 HH2 TRP 62 9.668 -0.298 1.262 510 H GLU 63 HN GLU 63 11.680 5.150 3.016 511 HA GLU 63 HA GLU 63 9.958 6.706 1.166 512 HB2 GLU 63 HB2 GLU 63 12.403 7.368 1.268 513 HB3 GLU 63 HB1 GLU 63 12.778 5.779 0.604 514 HG2 GLU 63 HG2 GLU 63 11.591 6.235 -1.416 515 HG3 GLU 63 HG1 GLU 63 10.832 7.672 -0.731 516 H THR 64 HN THR 64 9.716 5.707 -0.994 517 HA THR 64 HA THR 64 10.047 2.809 -1.137 518 HB THR 64 HB THR 64 7.305 4.026 -1.460 519 HG1 THR 64 HG1 THR 64 6.888 3.438 0.586 520 HG21 THR 64 HG21 THR 64 7.591 1.943 -2.650 521 HG22 THR 64 HG22 THR 64 8.369 1.198 -1.254 522 HG23 THR 64 HG23 THR 64 6.654 1.605 -1.195 523 H THR 65 HN THR 65 10.087 2.038 -3.237 524 HA THR 65 HA THR 65 10.072 4.100 -5.350 525 HB THR 65 HB THR 65 11.303 1.341 -5.387 526 HG1 THR 65 HG1 THR 65 12.654 2.345 -4.117 527 HG21 THR 65 HG21 THR 65 10.783 2.176 -7.615 528 HG22 THR 65 HG22 THR 65 11.524 3.731 -7.237 529 HG23 THR 65 HG23 THR 65 12.524 2.282 -7.350 530 H PHE 66 HN PHE 66 8.521 4.102 -6.871 531 HA PHE 66 HA PHE 66 6.895 1.650 -7.251 532 HB2 PHE 66 HB2 PHE 66 6.153 4.562 -7.105 533 HB3 PHE 66 HB1 PHE 66 5.162 3.457 -8.052 534 HD1 PHE 66 HD1 PHE 66 6.667 3.903 -4.657 535 HD2 PHE 66 HD2 PHE 66 3.548 2.110 -7.003 536 HE1 PHE 66 HE1 PHE 66 5.548 3.127 -2.587 537 HE2 PHE 66 HE2 PHE 66 2.433 1.339 -4.927 538 HZ PHE 66 HZ PHE 66 3.434 1.848 -2.721 539 H LYS 67 HN LYS 67 6.686 0.913 -9.318 540 HA LYS 67 HA LYS 67 7.882 2.557 -11.483 541 HB2 LYS 67 HB2 LYS 67 7.775 -0.451 -11.165 542 HB3 LYS 67 HB1 LYS 67 8.345 0.383 -12.610 543 HG2 LYS 67 HG2 LYS 67 9.927 1.643 -10.916 544 HG3 LYS 67 HG1 LYS 67 9.599 0.255 -9.879 545 HD2 LYS 67 HD2 LYS 67 10.244 -1.220 -11.842 546 HD3 LYS 67 HD1 LYS 67 10.817 0.241 -12.646 547 HE2 LYS 67 HE2 LYS 67 11.854 -1.027 -10.109 548 HE3 LYS 67 HE1 LYS 67 12.746 -0.626 -11.576 549 HZ1 LYS 67 HZ1 LYS 67 13.303 1.209 -10.456 550 HZ2 LYS 67 HZ2 LYS 67 11.743 1.759 -10.847 551 HZ3 LYS 67 HZ3 LYS 67 12.036 1.047 -9.336 552 H LYS 68 HN LYS 68 6.828 2.687 -13.447 553 HA LYS 68 HA LYS 68 3.985 2.409 -13.361 554 HB2 LYS 68 HB2 LYS 68 5.385 4.143 -14.659 555 HB3 LYS 68 HB1 LYS 68 5.570 2.880 -15.874 556 HG2 LYS 68 HG2 LYS 68 3.103 2.661 -16.005 557 HG3 LYS 68 HG1 LYS 68 2.940 3.972 -14.837 558 HD2 LYS 68 HD2 LYS 68 4.170 5.477 -16.385 559 HD3 LYS 68 HD1 LYS 68 4.251 4.168 -17.565 560 HE2 LYS 68 HE2 LYS 68 1.733 5.463 -16.478 561 HE3 LYS 68 HE1 LYS 68 2.367 5.610 -18.118 562 HZ1 LYS 68 HZ1 LYS 68 2.204 2.908 -17.620 563 HZ2 LYS 68 HZ2 LYS 68 0.762 3.556 -16.996 564 HZ3 LYS 68 HZ3 LYS 68 1.180 3.824 -18.618 565 H THR 69 HN THR 69 2.709 0.818 -14.017 566 HA THR 69 HA THR 69 3.816 -1.317 -15.744 567 HB THR 69 HB THR 69 3.774 -2.178 -13.466 568 HG1 THR 69 HG1 THR 69 2.997 -3.477 -15.255 569 HG21 THR 69 HG21 THR 69 2.132 -0.581 -12.548 570 HG22 THR 69 HG22 THR 69 0.855 -1.358 -13.482 571 HG23 THR 69 HG23 THR 69 1.666 -2.244 -12.191 572 H SER 70 HN SER 70 1.909 -2.739 -16.531 573 HA SER 70 HA SER 70 -0.153 -0.909 -17.572 574 HB2 SER 70 HB2 SER 70 1.184 -2.166 -19.228 575 HB3 SER 70 HB1 SER 70 0.638 -3.678 -18.505 576 HG SER 70 HG SER 70 -0.801 -1.744 -19.957 577 H ASP 71 HN ASP 71 0.207 -2.841 -15.038 578 HA ASP 71 HA ASP 71 -1.434 -4.751 -14.533 579 HB2 ASP 71 HB2 ASP 71 -0.454 -3.177 -12.812 580 HB3 ASP 71 HB1 ASP 71 -1.920 -2.213 -12.985 581 H ASP 72 HN ASP 72 -2.872 -1.503 -15.124 582 HA ASP 72 HA ASP 72 -5.149 -2.691 -16.395 583 HB2 ASP 72 HB2 ASP 72 -5.383 -1.607 -13.592 584 HB3 ASP 72 HB1 ASP 72 -6.756 -1.597 -14.696 585 H GLY 73 HN GLY 73 -3.785 -1.102 -17.770 586 HA2 GLY 73 HA2 GLY 73 -4.255 0.783 -19.109 587 HA3 GLY 73 HA1 GLY 73 -5.239 1.444 -17.808 588 H GLU 74 HN GLU 74 -4.300 2.743 -16.252 589 HA GLU 74 HA GLU 74 -1.412 3.343 -16.571 590 HB2 GLU 74 HB2 GLU 74 -3.685 5.260 -15.988 591 HB3 GLU 74 HB1 GLU 74 -1.973 5.682 -15.948 592 HG2 GLU 74 HG2 GLU 74 -1.759 5.015 -18.322 593 HG3 GLU 74 HG1 GLU 74 -3.479 4.628 -18.359 594 H VAL 75 HN VAL 75 -0.832 1.960 -14.844 595 HA VAL 75 HA VAL 75 -1.589 2.990 -12.187 596 HB VAL 75 HB VAL 75 -1.423 0.058 -12.890 597 HG11 VAL 75 HG11 VAL 75 -2.555 0.038 -10.511 598 HG12 VAL 75 HG12 VAL 75 -0.807 0.217 -10.642 599 HG13 VAL 75 HG13 VAL 75 -1.813 1.630 -10.347 600 HG21 VAL 75 HG21 VAL 75 -3.949 0.312 -12.167 601 HG22 VAL 75 HG22 VAL 75 -3.714 1.996 -12.634 602 HG23 VAL 75 HG23 VAL 75 -3.472 0.712 -13.815 603 H TYR 76 HN TYR 76 -0.066 2.693 -10.541 604 HA TYR 76 HA TYR 76 2.663 2.036 -11.494 605 HB2 TYR 76 HB2 TYR 76 1.950 3.877 -9.209 606 HB3 TYR 76 HB1 TYR 76 3.511 3.707 -10.022 607 HD1 TYR 76 HD1 TYR 76 3.823 4.520 -12.340 608 HD2 TYR 76 HD2 TYR 76 0.142 5.142 -10.216 609 HE1 TYR 76 HE1 TYR 76 3.133 6.199 -14.029 610 HE2 TYR 76 HE2 TYR 76 -0.544 6.826 -11.903 611 HH TYR 76 HH TYR 76 0.842 7.125 -14.870 612 H TYR 77 HN TYR 77 4.048 0.939 -9.971 613 HA TYR 77 HA TYR 77 2.846 -0.144 -7.557 614 HB2 TYR 77 HB2 TYR 77 2.588 -2.357 -8.166 615 HB3 TYR 77 HB1 TYR 77 2.165 -1.559 -9.678 616 HD1 TYR 77 HD2 TYR 77 4.075 -1.161 -11.386 617 HD2 TYR 77 HD1 TYR 77 4.344 -3.926 -8.113 618 HE1 TYR 77 HE2 TYR 77 5.925 -2.344 -12.539 619 HE2 TYR 77 HE1 TYR 77 6.195 -5.110 -9.263 620 HH TYR 77 HH TYR 77 7.726 -4.922 -10.951 621 H SER 78 HN SER 78 4.285 -0.841 -6.039 622 HA SER 78 HA SER 78 7.144 -0.594 -6.726 623 HB2 SER 78 HB2 SER 78 7.445 -0.410 -4.265 624 HB3 SER 78 HB1 SER 78 6.382 0.840 -4.902 625 HG SER 78 HG SER 78 5.706 -1.537 -3.522 626 H GLU 79 HN GLU 79 7.789 -2.552 -7.429 627 HA GLU 79 HA GLU 79 6.784 -5.049 -6.730 628 HB2 GLU 79 HB2 GLU 79 8.381 -4.469 -8.626 629 HB3 GLU 79 HB1 GLU 79 9.677 -4.546 -7.433 630 HG2 GLU 79 HG2 GLU 79 7.720 -6.818 -7.859 631 HG3 GLU 79 HG1 GLU 79 9.243 -6.696 -8.736 632 H GLU 80 HN GLU 80 9.384 -3.193 -5.202 633 HA GLU 80 HA GLU 80 10.237 -5.246 -3.443 634 HB2 GLU 80 HB2 GLU 80 11.445 -3.487 -2.281 635 HB3 GLU 80 HB1 GLU 80 11.589 -3.253 -4.024 636 HG2 GLU 80 HG2 GLU 80 9.635 -1.659 -3.883 637 HG3 GLU 80 HG1 GLU 80 9.745 -1.778 -2.128 638 H ALA 81 HN ALA 81 7.799 -2.689 -3.095 639 HA ALA 81 HA ALA 81 7.240 -3.620 -0.349 640 HB1 ALA 81 HB1 ALA 81 6.559 -1.095 -1.842 641 HB2 ALA 81 HB2 ALA 81 7.532 -1.278 -0.385 642 HB3 ALA 81 HB3 ALA 81 5.786 -1.516 -0.315 643 H LYS 82 HN LYS 82 6.275 -4.620 -3.231 644 HA LYS 82 HA LYS 82 4.256 -5.320 -4.189 645 HB2 LYS 82 HB2 LYS 82 4.174 -6.321 -1.335 646 HB3 LYS 82 HB1 LYS 82 3.025 -6.835 -2.567 647 HG2 LYS 82 HG2 LYS 82 4.679 -8.502 -2.674 648 HG3 LYS 82 HG1 LYS 82 5.136 -7.416 -3.983 649 HD2 LYS 82 HD2 LYS 82 6.857 -6.398 -2.649 650 HD3 LYS 82 HD1 LYS 82 6.284 -7.200 -1.187 651 HE2 LYS 82 HE2 LYS 82 7.394 -8.619 -3.625 652 HE3 LYS 82 HE1 LYS 82 8.286 -8.321 -2.133 653 HZ1 LYS 82 HZ1 LYS 82 6.493 -10.403 -2.712 654 HZ2 LYS 82 HZ2 LYS 82 7.396 -10.148 -1.295 655 HZ3 LYS 82 HZ3 LYS 82 5.846 -9.475 -1.444 656 H LYS 83 HN LYS 83 3.756 -2.866 -4.092 657 HA LYS 83 HA LYS 83 1.058 -2.590 -2.954 658 HB2 LYS 83 HB2 LYS 83 2.492 -1.543 -1.288 659 HB3 LYS 83 HB1 LYS 83 3.283 -0.581 -2.538 660 HG2 LYS 83 HG2 LYS 83 1.297 0.661 -2.982 661 HG3 LYS 83 HG1 LYS 83 0.300 -0.467 -2.061 662 HD2 LYS 83 HD2 LYS 83 1.144 0.286 0.010 663 HD3 LYS 83 HD1 LYS 83 2.548 1.048 -0.733 664 HE2 LYS 83 HE2 LYS 83 1.186 2.783 -1.705 665 HE3 LYS 83 HE1 LYS 83 -0.298 1.961 -1.226 666 HZ1 LYS 83 HZ1 LYS 83 1.575 2.521 0.916 667 HZ2 LYS 83 HZ2 LYS 83 0.855 3.886 0.207 668 HZ3 LYS 83 HZ3 LYS 83 -0.117 2.672 0.882 669 H LYS 84 HN LYS 84 -0.313 -1.720 -4.355 670 HA LYS 84 HA LYS 84 0.766 -0.276 -6.713 671 HB2 LYS 84 HB2 LYS 84 -0.063 -2.638 -7.107 672 HB3 LYS 84 HB1 LYS 84 -1.665 -2.059 -6.666 673 HG2 LYS 84 HG2 LYS 84 -1.474 -0.327 -8.465 674 HG3 LYS 84 HG1 LYS 84 0.049 -1.069 -8.946 675 HD2 LYS 84 HD2 LYS 84 -1.557 -2.060 -10.383 676 HD3 LYS 84 HD1 LYS 84 -1.256 -3.272 -9.141 677 HE2 LYS 84 HE2 LYS 84 -3.310 -2.863 -8.065 678 HE3 LYS 84 HE1 LYS 84 -3.498 -1.279 -8.814 679 HZ1 LYS 84 HZ1 LYS 84 -4.856 -2.427 -10.167 680 HZ2 LYS 84 HZ2 LYS 84 -3.409 -2.819 -10.967 681 HZ3 LYS 84 HZ3 LYS 84 -4.096 -3.917 -9.872 682 H VAL 85 HN VAL 85 -0.107 1.626 -7.245 683 HA VAL 85 HA VAL 85 -2.718 2.326 -6.074 684 HB VAL 85 HB VAL 85 -2.006 4.235 -5.064 685 HG11 VAL 85 HG11 VAL 85 -0.761 2.251 -4.152 686 HG12 VAL 85 HG12 VAL 85 0.634 2.786 -5.088 687 HG13 VAL 85 HG13 VAL 85 -0.014 3.810 -3.809 688 HG21 VAL 85 HG21 VAL 85 0.282 5.358 -5.679 689 HG22 VAL 85 HG22 VAL 85 0.161 4.430 -7.168 690 HG23 VAL 85 HG23 VAL 85 -1.085 5.612 -6.760 691 H GLU 86 HN GLU 86 -4.095 3.013 -7.501 692 HA GLU 86 HA GLU 86 -3.117 4.016 -10.120 693 HB2 GLU 86 HB2 GLU 86 -5.146 2.961 -11.088 694 HB3 GLU 86 HB1 GLU 86 -4.069 1.783 -10.343 695 HG2 GLU 86 HG2 GLU 86 -5.470 1.998 -8.238 696 HG3 GLU 86 HG1 GLU 86 -6.626 2.919 -9.200 697 H VAL 87 HN VAL 87 -3.957 5.844 -10.894 698 HA VAL 87 HA VAL 87 -5.400 7.602 -9.246 699 HB VAL 87 HB VAL 87 -4.152 8.621 -10.943 700 HG11 VAL 87 HG11 VAL 87 -3.731 6.809 -12.414 701 HG12 VAL 87 HG12 VAL 87 -5.444 6.589 -12.767 702 HG13 VAL 87 HG13 VAL 87 -4.589 7.998 -13.395 703 HG21 VAL 87 HG21 VAL 87 -6.795 8.726 -12.375 704 HG22 VAL 87 HG22 VAL 87 -6.703 9.341 -10.727 705 HG23 VAL 87 HG23 VAL 87 -5.683 10.037 -11.984 706 H LEU 88 HN LEU 88 -7.263 6.746 -8.444 707 HA LEU 88 HA LEU 88 -9.340 5.736 -10.236 708 HB2 LEU 88 HB2 LEU 88 -8.656 5.016 -7.715 709 HB3 LEU 88 HB1 LEU 88 -9.885 6.216 -7.335 710 HG LEU 88 HG LEU 88 -10.930 4.027 -7.480 711 HD11 LEU 88 HD11 LEU 88 -12.701 4.560 -8.956 712 HD12 LEU 88 HD12 LEU 88 -12.042 6.118 -8.464 713 HD13 LEU 88 HD13 LEU 88 -11.638 5.449 -10.046 714 HD21 LEU 88 HD21 LEU 88 -9.029 3.349 -9.289 715 HD22 LEU 88 HD22 LEU 88 -10.551 2.477 -9.129 716 HD23 LEU 88 HD23 LEU 88 -10.362 3.692 -10.391 717 H ASP 89 HN ASP 89 -8.293 8.574 -8.743 718 HA ASP 89 HA ASP 89 -10.010 10.319 -10.056 719 HB2 ASP 89 HB2 ASP 89 -11.391 9.164 -7.956 720 HB3 ASP 89 HB1 ASP 89 -10.708 10.593 -7.192 721 H THR 90 HN THR 90 -8.657 12.044 -10.223 722 HA THR 90 HA THR 90 -7.139 12.874 -7.870 723 HB THR 90 HB THR 90 -5.938 11.117 -9.462 724 HG1 THR 90 HG1 THR 90 -4.890 13.364 -8.154 725 HG21 THR 90 HG21 THR 90 -5.159 13.758 -10.724 726 HG22 THR 90 HG22 THR 90 -4.567 12.157 -11.157 727 HG23 THR 90 HG23 THR 90 -6.247 12.587 -11.472 728 H ASP 91 HN ASP 91 -7.341 14.953 -7.644 729 HA ASP 91 HA ASP 91 -8.244 16.636 -9.840 730 HB2 ASP 91 HB2 ASP 91 -9.030 16.867 -7.431 731 HB3 ASP 91 HB1 ASP 91 -7.425 17.499 -7.068 732 H TYR 92 HN TYR 92 -5.370 15.892 -8.058 733 HA TYR 92 HA TYR 92 -3.172 16.427 -8.344 734 HB2 TYR 92 HB2 TYR 92 -4.371 16.458 -10.983 735 HB3 TYR 92 HB1 TYR 92 -3.100 17.672 -10.899 736 HD1 TYR 92 HD2 TYR 92 -3.451 14.312 -9.254 737 HD2 TYR 92 HD1 TYR 92 -1.198 16.795 -11.942 738 HE1 TYR 92 HE2 TYR 92 -1.745 12.533 -9.469 739 HE2 TYR 92 HE1 TYR 92 0.509 15.010 -12.155 740 HH TYR 92 HH TYR 92 1.153 12.862 -10.326 741 H LYS 93 HN LYS 93 -5.332 18.616 -7.531 742 HA LYS 93 HA LYS 93 -3.350 20.731 -7.395 743 HB2 LYS 93 HB2 LYS 93 -5.977 21.013 -8.863 744 HB3 LYS 93 HB1 LYS 93 -5.035 22.389 -8.289 745 HG2 LYS 93 HG2 LYS 93 -3.061 21.383 -9.590 746 HG3 LYS 93 HG1 LYS 93 -4.248 20.327 -10.356 747 HD2 LYS 93 HD2 LYS 93 -4.376 23.357 -10.346 748 HD3 LYS 93 HD1 LYS 93 -3.817 22.374 -11.698 749 HE2 LYS 93 HE2 LYS 93 -6.071 22.763 -12.237 750 HE3 LYS 93 HE1 LYS 93 -6.123 21.172 -11.477 751 HZ1 LYS 93 HZ1 LYS 93 -7.338 21.956 -9.810 752 HZ2 LYS 93 HZ2 LYS 93 -6.313 23.289 -9.569 753 HZ3 LYS 93 HZ3 LYS 93 -7.553 23.374 -10.722 754 H SER 94 HN SER 94 -6.318 19.209 -6.415 755 HA SER 94 HA SER 94 -6.404 20.971 -4.031 756 HB2 SER 94 HB2 SER 94 -8.870 19.824 -5.327 757 HB3 SER 94 HB1 SER 94 -8.765 21.083 -4.100 758 HG SER 94 HG SER 94 -8.488 21.228 -6.828 759 H TYR 95 HN TYR 95 -7.776 17.898 -5.287 760 HA TYR 95 HA TYR 95 -6.767 16.468 -2.967 761 HB2 TYR 95 HB2 TYR 95 -9.096 15.592 -2.442 762 HB3 TYR 95 HB1 TYR 95 -8.781 17.259 -1.959 763 HD1 TYR 95 HD2 TYR 95 -10.491 15.092 -4.413 764 HD2 TYR 95 HD1 TYR 95 -9.844 19.126 -3.089 765 HE1 TYR 95 HE2 TYR 95 -12.377 15.859 -5.830 766 HE2 TYR 95 HE1 TYR 95 -11.730 19.893 -4.505 767 HH TYR 95 HH TYR 95 -13.198 19.311 -6.082 768 H ALA 96 HN ALA 96 -7.185 14.101 -3.168 769 HA ALA 96 HA ALA 96 -8.074 13.208 -5.806 770 HB1 ALA 96 HB1 ALA 96 -5.260 12.775 -4.782 771 HB2 ALA 96 HB2 ALA 96 -5.730 13.683 -6.215 772 HB3 ALA 96 HB3 ALA 96 -5.958 11.934 -6.161 773 H VAL 97 HN VAL 97 -8.731 11.128 -5.894 774 HA VAL 97 HA VAL 97 -8.603 9.542 -3.382 775 HB VAL 97 HB VAL 97 -10.787 9.167 -5.420 776 HG11 VAL 97 HG11 VAL 97 -12.022 8.491 -3.350 777 HG12 VAL 97 HG12 VAL 97 -10.587 7.513 -3.654 778 HG13 VAL 97 HG13 VAL 97 -10.551 8.775 -2.423 779 HG21 VAL 97 HG21 VAL 97 -10.571 11.357 -3.353 780 HG22 VAL 97 HG22 VAL 97 -11.045 11.491 -5.044 781 HG23 VAL 97 HG23 VAL 97 -12.140 10.750 -3.879 782 H ILE 98 HN ILE 98 -7.254 7.853 -3.663 783 HA ILE 98 HA ILE 98 -7.071 6.654 -6.361 784 HB ILE 98 HB ILE 98 -4.873 6.783 -4.303 785 HG12 ILE 98 HG12 ILE 98 -5.424 8.729 -6.572 786 HG13 ILE 98 HG11 ILE 98 -5.623 9.090 -4.858 787 HG21 ILE 98 HG21 ILE 98 -4.887 5.172 -6.337 788 HG22 ILE 98 HG22 ILE 98 -4.629 6.624 -7.303 789 HG23 ILE 98 HG23 ILE 98 -3.452 6.161 -6.077 790 HD11 ILE 98 HD11 ILE 98 -3.137 8.807 -6.454 791 HD12 ILE 98 HD12 ILE 98 -3.486 9.880 -5.101 792 HD13 ILE 98 HD13 ILE 98 -3.096 8.189 -4.800 793 H TYR 99 HN TYR 99 -6.825 4.446 -6.486 794 HA TYR 99 HA TYR 99 -7.760 2.956 -4.133 795 HB2 TYR 99 HB2 TYR 99 -8.670 2.801 -6.612 796 HB3 TYR 99 HB1 TYR 99 -7.311 1.700 -6.825 797 HD1 TYR 99 HD1 TYR 99 -10.344 2.347 -4.757 798 HD2 TYR 99 HD2 TYR 99 -7.389 -0.522 -5.978 799 HE1 TYR 99 HE1 TYR 99 -11.649 0.541 -3.671 800 HE2 TYR 99 HE2 TYR 99 -8.695 -2.328 -4.891 801 HH TYR 99 HH TYR 99 -10.539 -2.849 -3.782 802 H ALA 100 HN ALA 100 -6.149 2.440 -2.829 803 HA ALA 100 HA ALA 100 -3.591 1.461 -3.938 804 HB1 ALA 100 HB1 ALA 100 -2.812 1.705 -1.541 805 HB2 ALA 100 HB2 ALA 100 -4.368 2.459 -1.194 806 HB3 ALA 100 HB3 ALA 100 -3.260 3.211 -2.342 807 H THR 101 HN THR 101 -2.847 -0.561 -3.571 808 HA THR 101 HA THR 101 -4.325 -2.330 -1.752 809 HB THR 101 HB THR 101 -5.431 -2.683 -3.882 810 HG1 THR 101 HG1 THR 101 -4.377 -4.494 -2.475 811 HG21 THR 101 HG21 THR 101 -2.713 -3.356 -5.027 812 HG22 THR 101 HG22 THR 101 -4.245 -3.241 -5.894 813 HG23 THR 101 HG23 THR 101 -3.492 -1.787 -5.239 814 H ARG 102 HN ARG 102 -3.048 -3.624 -0.658 815 HA ARG 102 HA ARG 102 -0.285 -4.114 -1.614 816 HB2 ARG 102 HB2 ARG 102 -0.379 -2.491 0.293 817 HB3 ARG 102 HB1 ARG 102 -1.170 -3.733 1.261 818 HG2 ARG 102 HG2 ARG 102 0.826 -5.227 0.793 819 HG3 ARG 102 HG1 ARG 102 1.618 -3.819 0.085 820 HD2 ARG 102 HD2 ARG 102 2.252 -4.103 2.455 821 HD3 ARG 102 HD1 ARG 102 1.378 -2.596 2.200 822 HE ARG 102 HE ARG 102 -0.396 -3.455 3.456 823 HH11 ARG 102 HH21 ARG 102 1.942 -5.888 2.691 824 HH12 ARG 102 HH22 ARG 102 1.267 -7.068 3.763 825 HH21 ARG 102 HH11 ARG 102 -1.285 -4.998 4.865 826 HH22 ARG 102 HH12 ARG 102 -0.559 -6.566 4.995 827 H VAL 103 HN VAL 103 0.285 -6.271 -1.669 828 HA VAL 103 HA VAL 103 -1.571 -8.148 -0.319 829 HB VAL 103 HB VAL 103 -1.894 -8.196 -2.736 830 HG11 VAL 103 HG11 VAL 103 0.964 -9.105 -3.061 831 HG12 VAL 103 HG12 VAL 103 -0.156 -8.514 -4.288 832 HG13 VAL 103 HG13 VAL 103 0.553 -7.391 -3.129 833 HG21 VAL 103 HG21 VAL 103 -0.272 -10.614 -1.894 834 HG22 VAL 103 HG22 VAL 103 -1.921 -10.316 -1.343 835 HG23 VAL 103 HG23 VAL 103 -1.596 -10.564 -3.058 836 H LYS 104 HN LYS 104 -0.655 -9.250 1.238 837 HA LYS 104 HA LYS 104 2.260 -9.669 1.225 838 HB2 LYS 104 HB2 LYS 104 0.775 -8.707 3.226 839 HB3 LYS 104 HB1 LYS 104 0.511 -10.418 3.544 840 HG2 LYS 104 HG2 LYS 104 2.434 -10.041 4.802 841 HG3 LYS 104 HG1 LYS 104 3.147 -10.559 3.276 842 HD2 LYS 104 HD2 LYS 104 3.205 -8.079 2.629 843 HD3 LYS 104 HD1 LYS 104 2.843 -7.738 4.322 844 HE2 LYS 104 HE2 LYS 104 4.844 -9.062 4.987 845 HE3 LYS 104 HE1 LYS 104 5.226 -9.298 3.281 846 HZ1 LYS 104 HZ1 LYS 104 4.740 -6.554 3.963 847 HZ2 LYS 104 HZ2 LYS 104 6.054 -7.219 4.810 848 HZ3 LYS 104 HZ3 LYS 104 6.040 -7.247 3.115 849 H ASP 105 HN ASP 105 2.945 -11.864 2.109 850 HA ASP 105 HA ASP 105 2.009 -13.896 0.420 851 HB2 ASP 105 HB2 ASP 105 3.529 -14.112 3.028 852 HB3 ASP 105 HB1 ASP 105 3.325 -15.423 1.867 853 H GLY 106 HN GLY 106 -0.021 -14.629 0.455 854 HA2 GLY 106 HA2 GLY 106 -1.664 -16.086 1.286 855 HA3 GLY 106 HA1 GLY 106 -1.023 -15.862 2.908 856 H ARG 107 HN ARG 107 -1.145 -12.790 2.084 857 HA ARG 107 HA ARG 107 -4.044 -12.475 2.654 858 HB2 ARG 107 HB2 ARG 107 -1.755 -10.893 3.840 859 HB3 ARG 107 HB1 ARG 107 -3.469 -10.577 4.111 860 HG2 ARG 107 HG2 ARG 107 -3.694 -12.912 5.005 861 HG3 ARG 107 HG1 ARG 107 -1.944 -13.083 4.874 862 HD2 ARG 107 HD2 ARG 107 -3.467 -11.112 6.591 863 HD3 ARG 107 HD1 ARG 107 -2.434 -12.429 7.140 864 HE ARG 107 HE ARG 107 -1.014 -10.577 5.470 865 HH11 ARG 107 HH21 ARG 107 -2.264 -11.154 8.644 866 HH12 ARG 107 HH22 ARG 107 -1.102 -10.143 9.436 867 HH21 ARG 107 HH11 ARG 107 0.513 -9.247 6.501 868 HH22 ARG 107 HH12 ARG 107 0.470 -9.062 8.223 869 H THR 108 HN THR 108 -5.129 -11.008 1.512 870 HA THR 108 HA THR 108 -3.643 -9.073 -0.165 871 HB THR 108 HB THR 108 -6.066 -10.664 -1.042 872 HG1 THR 108 HG1 THR 108 -3.699 -11.534 -0.869 873 HG21 THR 108 HG21 THR 108 -5.975 -8.453 -2.053 874 HG22 THR 108 HG22 THR 108 -4.273 -8.675 -2.459 875 HG23 THR 108 HG23 THR 108 -5.504 -9.655 -3.256 876 H LEU 109 HN LEU 109 -4.573 -7.049 -0.327 877 HA LEU 109 HA LEU 109 -7.294 -6.636 0.633 878 HB2 LEU 109 HB2 LEU 109 -6.845 -5.253 2.481 879 HB3 LEU 109 HB1 LEU 109 -5.827 -6.656 2.667 880 HG LEU 109 HG LEU 109 -4.093 -5.131 1.297 881 HD11 LEU 109 HD11 LEU 109 -5.095 -2.943 3.017 882 HD12 LEU 109 HD12 LEU 109 -4.429 -2.886 1.387 883 HD13 LEU 109 HD13 LEU 109 -6.124 -3.290 1.632 884 HD21 LEU 109 HD21 LEU 109 -3.100 -4.519 3.469 885 HD22 LEU 109 HD22 LEU 109 -4.623 -4.889 4.275 886 HD23 LEU 109 HD23 LEU 109 -3.700 -6.175 3.501 887 H HIS 110 HN HIS 110 -8.109 -4.574 0.406 888 HA HIS 110 HA HIS 110 -6.554 -2.785 -1.322 889 HB2 HIS 110 HB2 HIS 110 -8.790 -2.214 -2.433 890 HB3 HIS 110 HB1 HIS 110 -8.098 -3.784 -2.840 891 HD1 HIS 110 HD1 HIS 110 -9.103 -5.881 -1.490 892 HD2 HIS 110 HD2 HIS 110 -11.290 -2.344 -1.203 893 HE1 HIS 110 HE1 HIS 110 -11.390 -6.522 -0.611 894 H MET 111 HN MET 111 -7.199 -0.463 -1.142 895 HA MET 111 HA MET 111 -9.008 0.246 0.985 896 HB2 MET 111 HB2 MET 111 -7.002 1.602 2.065 897 HB3 MET 111 HB1 MET 111 -7.305 -0.073 2.523 898 HG2 MET 111 HG2 MET 111 -5.576 -0.879 1.101 899 HG3 MET 111 HG1 MET 111 -5.441 0.666 0.263 900 HE1 MET 111 HE1 MET 111 -4.691 2.719 1.108 901 HE2 MET 111 HE2 MET 111 -3.354 2.890 2.243 902 HE3 MET 111 HE3 MET 111 -3.148 1.941 0.765 903 H MET 112 HN MET 112 -9.413 2.524 1.082 904 HA MET 112 HA MET 112 -8.688 3.921 -1.423 905 HB2 MET 112 HB2 MET 112 -10.650 5.125 0.477 906 HB3 MET 112 HB1 MET 112 -10.651 5.125 -1.276 907 HG2 MET 112 HG2 MET 112 -11.158 2.577 0.250 908 HG3 MET 112 HG1 MET 112 -12.452 3.737 -0.017 909 HE1 MET 112 HE1 MET 112 -12.994 4.787 -1.996 910 HE2 MET 112 HE2 MET 112 -11.799 4.819 -3.289 911 HE3 MET 112 HE3 MET 112 -13.296 3.898 -3.485 912 H ARG 113 HN ARG 113 -7.606 5.872 -1.383 913 HA ARG 113 HA ARG 113 -6.795 6.898 1.278 914 HB2 ARG 113 HB2 ARG 113 -4.913 5.708 0.389 915 HB3 ARG 113 HB1 ARG 113 -5.108 6.465 -1.187 916 HG2 ARG 113 HG2 ARG 113 -4.796 8.359 1.089 917 HG3 ARG 113 HG1 ARG 113 -3.380 7.370 0.747 918 HD2 ARG 113 HD2 ARG 113 -3.724 8.090 -1.724 919 HD3 ARG 113 HD1 ARG 113 -4.772 9.343 -1.063 920 HE ARG 113 HE ARG 113 -2.443 9.512 0.396 921 HH11 ARG 113 HH21 ARG 113 -3.346 9.617 -2.942 922 HH12 ARG 113 HH22 ARG 113 -2.046 10.664 -3.403 923 HH21 ARG 113 HH11 ARG 113 -0.734 10.882 -0.200 924 HH22 ARG 113 HH12 ARG 113 -0.566 11.380 -1.850 925 H LEU 114 HN LEU 114 -7.176 9.000 1.590 926 HA LEU 114 HA LEU 114 -7.792 10.688 -0.753 927 HB2 LEU 114 HB2 LEU 114 -9.703 10.334 0.744 928 HB3 LEU 114 HB1 LEU 114 -8.744 10.861 2.118 929 HG LEU 114 HG LEU 114 -8.498 13.099 1.111 930 HD11 LEU 114 HD11 LEU 114 -8.552 12.820 -1.213 931 HD12 LEU 114 HD12 LEU 114 -9.964 11.765 -1.154 932 HD13 LEU 114 HD13 LEU 114 -10.146 13.499 -0.896 933 HD21 LEU 114 HD21 LEU 114 -11.006 13.689 1.125 934 HD22 LEU 114 HD22 LEU 114 -11.288 11.972 1.410 935 HD23 LEU 114 HD23 LEU 114 -10.361 12.920 2.574 936 H TYR 115 HN TYR 115 -6.421 12.279 -1.141 937 HA TYR 115 HA TYR 115 -4.671 13.218 1.045 938 HB2 TYR 115 HB2 TYR 115 -2.875 12.807 -0.279 939 HB3 TYR 115 HB1 TYR 115 -3.968 12.005 -1.393 940 HD1 TYR 115 HD1 TYR 115 -5.452 13.850 -2.801 941 HD2 TYR 115 HD2 TYR 115 -1.481 14.403 -1.269 942 HE1 TYR 115 HE1 TYR 115 -5.037 15.593 -4.516 943 HE2 TYR 115 HE2 TYR 115 -1.068 16.152 -2.979 944 HH TYR 115 HH TYR 115 -3.488 16.899 -5.469 945 H SER 116 HN SER 116 -3.971 15.441 0.923 946 HA SER 116 HA SER 116 -5.877 17.216 -0.501 947 HB2 SER 116 HB2 SER 116 -6.356 17.251 1.903 948 HB3 SER 116 HB1 SER 116 -4.658 17.571 2.257 949 HG SER 116 HG SER 116 -6.603 19.221 1.068 950 H ARG 117 HN ARG 117 -4.966 19.130 -1.403 951 HA ARG 117 HA ARG 117 -2.143 18.931 -1.977 952 HB2 ARG 117 HB2 ARG 117 -3.910 19.616 -3.647 953 HB3 ARG 117 HB1 ARG 117 -4.096 21.114 -2.745 954 HG2 ARG 117 HG2 ARG 117 -2.541 21.766 -4.353 955 HG3 ARG 117 HG1 ARG 117 -1.470 21.274 -3.048 956 HD2 ARG 117 HD2 ARG 117 -1.607 18.910 -4.202 957 HD3 ARG 117 HD1 ARG 117 -2.112 19.843 -5.608 958 HE ARG 117 HE ARG 117 0.076 20.562 -5.825 959 HH11 ARG 117 HH21 ARG 117 -0.519 19.408 -2.617 960 HH12 ARG 117 HH22 ARG 117 1.130 19.559 -2.108 961 HH21 ARG 117 HH11 ARG 117 2.240 20.766 -5.163 962 HH22 ARG 117 HH12 ARG 117 2.691 20.328 -3.549 963 H SER 118 HN SER 118 -4.202 20.635 0.214 964 HA SER 118 HA SER 118 -1.874 22.175 1.198 965 HB2 SER 118 HB2 SER 118 -3.422 23.683 0.028 966 HB3 SER 118 HB1 SER 118 -4.748 23.115 1.038 967 HG SER 118 HG SER 118 -3.537 25.119 1.666 968 HA PRO 119 HA PRO 119 -2.357 20.256 5.164 969 HB2 PRO 119 HB2 PRO 119 -2.567 23.099 6.121 970 HB3 PRO 119 HB1 PRO 119 -1.606 21.761 6.781 971 HG2 PRO 119 HG2 PRO 119 -0.523 23.671 5.233 972 HG3 PRO 119 HG1 PRO 119 0.048 21.994 5.211 973 HD2 PRO 119 HD2 PRO 119 -1.426 23.473 3.125 974 HD3 PRO 119 HD1 PRO 119 -0.500 21.963 2.991 975 H GLU 120 HN GLU 120 -4.598 22.637 3.960 976 HA GLU 120 HA GLU 120 -6.605 22.164 5.980 977 HB2 GLU 120 HB2 GLU 120 -6.916 23.575 3.328 978 HB3 GLU 120 HB1 GLU 120 -7.938 23.736 4.757 979 HG2 GLU 120 HG2 GLU 120 -5.942 24.610 6.007 980 HG3 GLU 120 HG1 GLU 120 -5.046 24.599 4.489 981 H VAL 121 HN VAL 121 -8.735 21.430 5.412 982 HA VAL 121 HA VAL 121 -8.725 19.319 3.328 983 HB VAL 121 HB VAL 121 -10.370 19.311 5.862 984 HG11 VAL 121 HG11 VAL 121 -10.995 17.922 3.786 985 HG12 VAL 121 HG12 VAL 121 -9.528 16.997 4.108 986 HG13 VAL 121 HG13 VAL 121 -10.821 17.046 5.306 987 HG21 VAL 121 HG21 VAL 121 -8.646 17.566 6.585 988 HG22 VAL 121 HG22 VAL 121 -7.621 18.182 5.289 989 HG23 VAL 121 HG23 VAL 121 -8.099 19.243 6.614 990 H SER 122 HN SER 122 -9.963 19.912 1.658 991 HA SER 122 HA SER 122 -12.012 21.902 1.899 992 HB2 SER 122 HB2 SER 122 -10.531 21.410 -0.146 993 HB3 SER 122 HB1 SER 122 -11.621 20.063 -0.458 994 HG SER 122 HG SER 122 -12.836 21.516 -1.359 995 HA PRO 123 HA PRO 123 -15.322 19.150 2.990 996 HB2 PRO 123 HB2 PRO 123 -17.471 20.569 2.003 997 HB3 PRO 123 HB1 PRO 123 -16.629 20.972 3.512 998 HG2 PRO 123 HG2 PRO 123 -16.347 22.190 0.805 999 HG3 PRO 123 HG1 PRO 123 -16.359 22.969 2.398 1000 HD2 PRO 123 HD2 PRO 123 -14.054 22.509 1.022 1001 HD3 PRO 123 HD1 PRO 123 -14.118 22.493 2.798 1002 H ALA 124 HN ALA 124 -14.896 20.249 -0.302 1003 HA ALA 124 HA ALA 124 -16.746 18.402 -1.493 1004 HB1 ALA 124 HB1 ALA 124 -16.193 20.413 -2.702 1005 HB2 ALA 124 HB2 ALA 124 -15.565 19.041 -3.615 1006 HB3 ALA 124 HB3 ALA 124 -14.472 20.030 -2.646 1007 H ALA 125 HN ALA 125 -13.336 18.386 -0.671 1008 HA ALA 125 HA ALA 125 -12.596 16.085 -2.163 1009 HB1 ALA 125 HB1 ALA 125 -11.384 17.174 0.389 1010 HB2 ALA 125 HB2 ALA 125 -10.962 17.699 -1.241 1011 HB3 ALA 125 HB3 ALA 125 -10.615 16.047 -0.729 1012 H THR 126 HN THR 126 -13.738 16.560 1.146 1013 HA THR 126 HA THR 126 -13.537 13.779 1.841 1014 HB THR 126 HB THR 126 -15.375 15.600 3.342 1015 HG1 THR 126 HG1 THR 126 -13.479 16.813 2.669 1016 HG21 THR 126 HG21 THR 126 -14.231 14.515 5.267 1017 HG22 THR 126 HG22 THR 126 -14.933 13.327 4.169 1018 HG23 THR 126 HG23 THR 126 -13.198 13.638 4.140 1019 H ALA 127 HN ALA 127 -16.034 15.871 0.477 1020 HA ALA 127 HA ALA 127 -18.177 14.021 0.866 1021 HB1 ALA 127 HB1 ALA 127 -17.955 16.333 -1.051 1022 HB2 ALA 127 HB2 ALA 127 -18.442 16.472 0.638 1023 HB3 ALA 127 HB3 ALA 127 -19.437 15.556 -0.495 1024 H ILE 128 HN ILE 128 -16.208 14.947 -2.000 1025 HA ILE 128 HA ILE 128 -17.515 13.259 -3.832 1026 HB ILE 128 HB ILE 128 -15.658 15.112 -4.132 1027 HG12 ILE 128 HG12 ILE 128 -16.779 14.073 -6.000 1028 HG13 ILE 128 HG11 ILE 128 -15.050 14.106 -6.317 1029 HG21 ILE 128 HG21 ILE 128 -13.922 12.630 -4.145 1030 HG22 ILE 128 HG22 ILE 128 -13.416 14.293 -4.436 1031 HG23 ILE 128 HG23 ILE 128 -13.945 13.802 -2.829 1032 HD11 ILE 128 HD11 ILE 128 -16.781 11.760 -5.578 1033 HD12 ILE 128 HD12 ILE 128 -15.646 11.912 -6.918 1034 HD13 ILE 128 HD13 ILE 128 -15.045 11.714 -5.273 1035 H PHE 129 HN PHE 129 -14.934 12.870 -1.599 1036 HA PHE 129 HA PHE 129 -14.009 10.302 -2.068 1037 HB2 PHE 129 HB2 PHE 129 -13.076 11.812 -0.357 1038 HB3 PHE 129 HB1 PHE 129 -14.513 11.554 0.628 1039 HD1 PHE 129 HD1 PHE 129 -14.987 9.392 1.661 1040 HD2 PHE 129 HD2 PHE 129 -11.451 10.018 -0.684 1041 HE1 PHE 129 HE1 PHE 129 -14.042 7.270 2.528 1042 HE2 PHE 129 HE2 PHE 129 -10.493 7.901 0.192 1043 HZ PHE 129 HZ PHE 129 -11.795 6.532 1.797 1044 H ARG 130 HN ARG 130 -16.842 11.349 -0.218 1045 HA ARG 130 HA ARG 130 -17.613 8.746 0.650 1046 HB2 ARG 130 HB2 ARG 130 -18.352 10.664 1.890 1047 HB3 ARG 130 HB1 ARG 130 -19.134 11.349 0.468 1048 HG2 ARG 130 HG2 ARG 130 -20.810 9.659 0.443 1049 HG3 ARG 130 HG1 ARG 130 -19.913 8.646 1.574 1050 HD2 ARG 130 HD2 ARG 130 -21.906 10.001 2.504 1051 HD3 ARG 130 HD1 ARG 130 -20.396 10.053 3.404 1052 HE ARG 130 HE ARG 130 -21.513 12.219 1.747 1053 HH11 ARG 130 HH21 ARG 130 -19.041 11.012 3.868 1054 HH12 ARG 130 HH22 ARG 130 -18.390 12.580 4.209 1055 HH21 ARG 130 HH11 ARG 130 -20.652 14.262 2.198 1056 HH22 ARG 130 HH12 ARG 130 -19.297 14.413 3.266 1057 H LYS 131 HN LYS 131 -18.587 10.758 -2.125 1058 HA LYS 131 HA LYS 131 -20.802 9.381 -2.996 1059 HB2 LYS 131 HB2 LYS 131 -18.596 10.587 -4.678 1060 HB3 LYS 131 HB1 LYS 131 -20.194 10.139 -5.277 1061 HG2 LYS 131 HG2 LYS 131 -21.209 11.676 -3.584 1062 HG3 LYS 131 HG1 LYS 131 -19.583 12.195 -3.133 1063 HD2 LYS 131 HD2 LYS 131 -19.197 12.869 -5.516 1064 HD3 LYS 131 HD1 LYS 131 -20.885 12.486 -5.855 1065 HE2 LYS 131 HE2 LYS 131 -20.851 14.828 -5.422 1066 HE3 LYS 131 HE1 LYS 131 -21.476 14.092 -3.946 1067 HZ1 LYS 131 HZ1 LYS 131 -19.672 15.809 -3.668 1068 HZ2 LYS 131 HZ2 LYS 131 -19.412 14.323 -2.886 1069 HZ3 LYS 131 HZ3 LYS 131 -18.599 14.672 -4.333 1070 H LEU 132 HN LEU 132 -17.477 8.742 -4.186 1071 HA LEU 132 HA LEU 132 -18.194 6.373 -5.551 1072 HB2 LEU 132 HB2 LEU 132 -15.704 5.871 -5.423 1073 HB3 LEU 132 HB1 LEU 132 -16.154 7.391 -6.187 1074 HG LEU 132 HG LEU 132 -15.890 8.047 -3.454 1075 HD11 LEU 132 HD11 LEU 132 -13.454 6.466 -4.278 1076 HD12 LEU 132 HD12 LEU 132 -13.829 7.150 -2.697 1077 HD13 LEU 132 HD13 LEU 132 -14.737 5.763 -3.295 1078 HD21 LEU 132 HD21 LEU 132 -15.209 9.378 -5.476 1079 HD22 LEU 132 HD22 LEU 132 -13.994 9.363 -4.201 1080 HD23 LEU 132 HD23 LEU 132 -13.789 8.342 -5.623 1081 H ALA 133 HN ALA 133 -16.799 6.897 -2.325 1082 HA ALA 133 HA ALA 133 -16.475 4.241 -1.564 1083 HB1 ALA 133 HB1 ALA 133 -15.809 6.344 -0.281 1084 HB2 ALA 133 HB2 ALA 133 -16.433 5.001 0.670 1085 HB3 ALA 133 HB3 ALA 133 -17.470 6.379 0.308 1086 H GLY 134 HN GLY 134 -19.394 6.262 -1.598 1087 HA2 GLY 134 HA2 GLY 134 -21.071 4.459 -0.192 1088 HA3 GLY 134 HA1 GLY 134 -21.606 5.725 -1.299 1089 H GLU 135 HN GLU 135 -20.163 4.862 -3.572 1090 HA GLU 135 HA GLU 135 -21.969 3.010 -4.702 1091 HB2 GLU 135 HB2 GLU 135 -20.491 4.698 -5.928 1092 HB3 GLU 135 HB1 GLU 135 -19.172 3.546 -5.712 1093 HG2 GLU 135 HG2 GLU 135 -20.519 1.808 -6.854 1094 HG3 GLU 135 HG1 GLU 135 -21.806 2.986 -7.105 1095 H ARG 136 HN ARG 136 -19.258 2.634 -2.662 1096 HA ARG 136 HA ARG 136 -18.901 -0.201 -3.402 1097 HB2 ARG 136 HB2 ARG 136 -17.266 1.522 -1.520 1098 HB3 ARG 136 HB1 ARG 136 -16.872 -0.108 -2.066 1099 HG2 ARG 136 HG2 ARG 136 -16.940 0.812 -4.446 1100 HG3 ARG 136 HG1 ARG 136 -16.985 2.419 -3.723 1101 HD2 ARG 136 HD2 ARG 136 -14.685 2.017 -4.116 1102 HD3 ARG 136 HD1 ARG 136 -14.901 1.696 -2.397 1103 HE ARG 136 HE ARG 136 -14.378 -0.526 -2.812 1104 HH11 ARG 136 HH21 ARG 136 -15.262 1.103 -5.734 1105 HH12 ARG 136 HH22 ARG 136 -14.851 -0.228 -6.764 1106 HH21 ARG 136 HH11 ARG 136 -13.837 -2.276 -4.157 1107 HH22 ARG 136 HH12 ARG 136 -14.045 -2.141 -5.871 1108 H ASN 137 HN ASN 137 -20.976 1.429 -1.637 1109 HA ASN 137 HA ASN 137 -22.272 1.011 0.231 1110 HB2 ASN 137 HB2 ASN 137 -21.144 -1.737 -0.121 1111 HB3 ASN 137 HB1 ASN 137 -22.629 -1.334 0.733 1112 HD21 ASN 137 HD21 ASN 137 -23.978 0.347 -0.942 1113 HD22 ASN 137 HD22 ASN 137 -24.245 -0.370 -2.458 1114 H TYR 138 HN TYR 138 -19.649 1.960 0.768 1115 HA TYR 138 HA TYR 138 -18.595 0.426 3.007 1116 HB2 TYR 138 HB2 TYR 138 -16.752 1.821 2.915 1117 HB3 TYR 138 HB1 TYR 138 -17.319 1.953 1.251 1118 HD1 TYR 138 HD1 TYR 138 -19.673 3.687 1.494 1119 HD2 TYR 138 HD2 TYR 138 -15.874 3.928 3.476 1120 HE1 TYR 138 HE1 TYR 138 -19.997 6.123 1.813 1121 HE2 TYR 138 HE2 TYR 138 -16.199 6.356 3.787 1122 HH TYR 138 HH TYR 138 -17.591 8.072 3.579 1123 H THR 139 HN THR 139 -18.159 1.635 5.105 1124 HA THR 139 HA THR 139 -20.474 3.352 5.827 1125 HB THR 139 HB THR 139 -20.938 2.079 7.659 1126 HG1 THR 139 HG1 THR 139 -19.402 2.184 9.058 1127 HG21 THR 139 HG21 THR 139 -20.526 0.442 5.664 1128 HG22 THR 139 HG22 THR 139 -19.097 -0.040 6.574 1129 HG23 THR 139 HG23 THR 139 -20.696 -0.223 7.286 1130 H ASP 140 HN ASP 140 -20.067 4.975 7.445 1131 HA ASP 140 HA ASP 140 -17.854 6.512 7.108 1132 HB2 ASP 140 HB2 ASP 140 -19.483 6.172 9.631 1133 HB3 ASP 140 HB1 ASP 140 -18.317 7.470 9.381 1134 H GLU 141 HN GLU 141 -18.167 4.106 9.787 1135 HA GLU 141 HA GLU 141 -15.680 4.524 10.915 1136 HB2 GLU 141 HB2 GLU 141 -17.252 1.955 10.641 1137 HB3 GLU 141 HB1 GLU 141 -15.850 2.153 11.693 1138 HG2 GLU 141 HG2 GLU 141 -17.022 4.055 12.818 1139 HG3 GLU 141 HG1 GLU 141 -18.447 3.709 11.839 1140 H MET 142 HN MET 142 -16.422 3.125 7.858 1141 HA MET 142 HA MET 142 -14.016 1.573 7.609 1142 HB2 MET 142 HB2 MET 142 -15.774 2.587 5.377 1143 HB3 MET 142 HB1 MET 142 -14.689 1.205 5.349 1144 HG2 MET 142 HG2 MET 142 -16.193 0.452 7.439 1145 HG3 MET 142 HG1 MET 142 -17.374 1.473 6.631 1146 HE1 MET 142 HE1 MET 142 -14.704 -0.925 6.351 1147 HE2 MET 142 HE2 MET 142 -15.348 -2.322 5.495 1148 HE3 MET 142 HE3 MET 142 -14.591 -1.003 4.595 1149 H VAL 143 HN VAL 143 -14.758 4.865 7.355 1150 HA VAL 143 HA VAL 143 -12.131 5.388 6.077 1151 HB VAL 143 HB VAL 143 -14.045 5.960 4.546 1152 HG11 VAL 143 HG11 VAL 143 -15.399 7.935 5.070 1153 HG12 VAL 143 HG12 VAL 143 -15.628 6.711 6.315 1154 HG13 VAL 143 HG13 VAL 143 -14.600 8.109 6.619 1155 HG21 VAL 143 HG21 VAL 143 -12.096 7.125 4.000 1156 HG22 VAL 143 HG22 VAL 143 -13.196 8.460 4.323 1157 HG23 VAL 143 HG23 VAL 143 -12.031 7.960 5.544 1158 H ALA 144 HN ALA 144 -10.768 6.544 7.285 1159 HA ALA 144 HA ALA 144 -11.948 8.131 9.521 1160 HB1 ALA 144 HB1 ALA 144 -10.868 6.519 10.730 1161 HB2 ALA 144 HB2 ALA 144 -9.495 7.596 10.478 1162 HB3 ALA 144 HB3 ALA 144 -9.709 6.180 9.449 1163 H MET 145 HN MET 145 -11.650 10.237 9.394 1164 HA MET 145 HA MET 145 -9.723 11.423 7.647 1165 HB2 MET 145 HB2 MET 145 -11.832 12.412 7.516 1166 HB3 MET 145 HB1 MET 145 -12.145 12.195 9.229 1167 HG2 MET 145 HG2 MET 145 -11.395 14.255 9.688 1168 HG3 MET 145 HG1 MET 145 -9.888 13.931 8.868 1169 HE1 MET 145 HE1 MET 145 -9.847 13.455 6.481 1170 HE2 MET 145 HE2 MET 145 -11.318 13.513 5.516 1171 HE3 MET 145 HE3 MET 145 -10.131 14.817 5.404 1172 H LEU 146 HN LEU 146 -8.061 12.845 8.365 1173 HA LEU 146 HA LEU 146 -7.336 12.514 11.206 1174 HB2 LEU 146 HB2 LEU 146 -5.773 12.154 8.735 1175 HB3 LEU 146 HB1 LEU 146 -4.934 13.027 10.017 1176 HG LEU 146 HG LEU 146 -5.371 11.220 11.588 1177 HD11 LEU 146 HD11 LEU 146 -7.388 10.275 11.156 1178 HD12 LEU 146 HD12 LEU 146 -7.150 10.295 9.408 1179 HD13 LEU 146 HD13 LEU 146 -6.353 9.073 10.397 1180 HD21 LEU 146 HD21 LEU 146 -3.683 11.019 9.368 1181 HD22 LEU 146 HD22 LEU 146 -3.607 10.052 10.836 1182 HD23 LEU 146 HD23 LEU 146 -4.490 9.463 9.440 1183 HA PRO 147 HA PRO 147 -7.264 16.930 11.646 1184 HB2 PRO 147 HB2 PRO 147 -5.761 17.120 13.888 1185 HB3 PRO 147 HB1 PRO 147 -7.376 16.377 13.919 1186 HG2 PRO 147 HG2 PRO 147 -4.699 15.029 13.698 1187 HG3 PRO 147 HG1 PRO 147 -6.032 14.676 14.817 1188 HD2 PRO 147 HD2 PRO 147 -5.687 13.242 12.585 1189 HD3 PRO 147 HD1 PRO 147 -7.317 13.640 13.177 1190 H ARG 148 HN ARG 148 -5.906 18.744 11.284 1191 HA ARG 148 HA ARG 148 -3.647 18.423 9.664 1192 HB2 ARG 148 HB2 ARG 148 -4.394 20.813 11.361 1193 HB3 ARG 148 HB1 ARG 148 -3.300 20.821 9.977 1194 HG2 ARG 148 HG2 ARG 148 -5.163 20.016 8.535 1195 HG3 ARG 148 HG1 ARG 148 -6.248 20.115 9.922 1196 HD2 ARG 148 HD2 ARG 148 -4.733 22.409 8.650 1197 HD3 ARG 148 HD1 ARG 148 -6.473 22.143 8.594 1198 HE ARG 148 HE ARG 148 -5.006 23.336 10.747 1199 HH11 ARG 148 HH21 ARG 148 -7.709 21.330 9.941 1200 HH12 ARG 148 HH22 ARG 148 -8.615 21.745 11.357 1201 HH21 ARG 148 HH11 ARG 148 -6.189 23.884 12.607 1202 HH22 ARG 148 HH12 ARG 148 -7.754 23.190 12.867 1203 H GLN 149 HN GLN 149 -3.918 18.084 13.043 1204 HA GLN 149 HA GLN 149 -1.573 19.041 14.102 1205 HB2 GLN 149 HB2 GLN 149 -3.003 16.437 14.647 1206 HB3 GLN 149 HB1 GLN 149 -1.644 17.010 15.617 1207 HG2 GLN 149 HG2 GLN 149 -2.860 19.064 16.157 1208 HG3 GLN 149 HG1 GLN 149 -4.203 18.562 15.133 1209 HE21 GLN 149 HE21 GLN 149 -4.489 19.073 17.973 1210 HE22 GLN 149 HE22 GLN 149 -4.895 17.603 18.718 1211 H GLU 150 HN GLU 150 0.555 18.581 13.971 1212 HA GLU 150 HA GLU 150 1.416 16.158 12.501 1213 HB2 GLU 150 HB2 GLU 150 3.158 17.565 11.394 1214 HB3 GLU 150 HB1 GLU 150 1.512 17.957 10.897 1215 HG2 GLU 150 HG2 GLU 150 1.481 19.805 12.568 1216 HG3 GLU 150 HG1 GLU 150 3.163 19.447 12.957 1217 H GLU 151 HN GLU 151 3.338 15.263 13.157 1218 HA GLU 151 HA GLU 151 4.716 16.526 15.461 1219 HB2 GLU 151 HB2 GLU 151 4.514 13.535 15.126 1220 HB3 GLU 151 HB1 GLU 151 4.919 14.462 16.569 1221 HG2 GLU 151 HG2 GLU 151 2.202 14.408 15.222 1222 HG3 GLU 151 HG1 GLU 151 2.625 13.571 16.715 1223 H CYS 152 HN CYS 152 4.818 14.760 12.489 1224 HA CYS 152 HA CYS 152 7.718 15.244 12.268 1225 HB2 CYS 152 HB2 CYS 152 6.279 12.651 11.667 1226 HB3 CYS 152 HB1 CYS 152 7.902 13.023 11.091 1227 H THR 153 HN THR 153 8.442 15.265 10.017 1228 HA THR 153 HA THR 153 6.424 15.407 7.932 1229 HB THR 153 HB THR 153 7.090 17.743 7.288 1230 HG1 THR 153 HG1 THR 153 9.020 17.588 8.696 1231 HG21 THR 153 HG21 THR 153 5.545 18.779 8.777 1232 HG22 THR 153 HG22 THR 153 5.020 17.100 8.671 1233 HG23 THR 153 HG23 THR 153 5.926 17.657 10.080 1234 H VAL 154 HN VAL 154 7.440 15.773 5.766 1235 HA VAL 154 HA VAL 154 9.849 14.266 5.540 1236 HB VAL 154 HB VAL 154 9.507 14.444 3.197 1237 HG11 VAL 154 HG11 VAL 154 7.034 13.940 2.959 1238 HG12 VAL 154 HG12 VAL 154 7.898 12.961 4.142 1239 HG13 VAL 154 HG13 VAL 154 6.883 14.298 4.678 1240 HG21 VAL 154 HG21 VAL 154 7.656 16.040 2.354 1241 HG22 VAL 154 HG22 VAL 154 7.829 16.838 3.917 1242 HG23 VAL 154 HG23 VAL 154 9.201 16.754 2.813 1243 H ASP 155 HN ASP 155 11.690 15.045 4.328 1244 HA ASP 155 HA ASP 155 12.478 17.711 5.205 1245 HB2 ASP 155 HB2 ASP 155 14.125 16.003 5.524 1246 HB3 ASP 155 HB1 ASP 155 14.033 15.520 3.838 1247 H GLU 156 HN GLU 156 13.679 19.034 3.716 1248 HA GLU 156 HA GLU 156 12.100 19.875 1.547 1249 HB2 GLU 156 HB2 GLU 156 13.921 21.394 1.012 1250 HB3 GLU 156 HB1 GLU 156 13.714 21.327 2.762 1251 HG2 GLU 156 HG2 GLU 156 15.524 19.553 2.806 1252 HG3 GLU 156 HG1 GLU 156 15.820 19.917 1.107 1253 H VAL 157 HN VAL 157 14.488 17.415 1.783 1254 HA VAL 157 HA VAL 157 14.050 16.640 -0.969 1255 HB VAL 157 HB VAL 157 15.854 18.358 -1.152 1256 HG11 VAL 157 HG11 VAL 157 17.558 16.367 0.359 1257 HG12 VAL 157 HG12 VAL 157 17.990 18.001 -0.144 1258 HG13 VAL 157 HG13 VAL 157 16.810 17.758 1.143 1259 HG21 VAL 157 HG21 VAL 157 16.864 15.549 -1.680 1260 HG22 VAL 157 HG22 VAL 157 15.644 16.343 -2.678 1261 HG23 VAL 157 HG23 VAL 157 17.271 17.016 -2.571 1262 HN1 EB4 200 H17 EB4 200 0.231 -1.005 5.689 1263 H8 EB4 200 H8 EB4 200 4.866 0.663 0.907 1264 HN2 EB4 200 H25 EB4 200 3.385 -0.287 6.272 1265 H9 EB4 200 H9 EB4 200 0.878 5.877 2.987 1266 H10 EB4 200 H10 EB4 200 -2.747 -1.009 0.566 1267 HN3 EB4 200 H32 EB4 200 0.870 1.828 7.149 1268 H7 EB4 200 H7 EB4 200 -1.136 0.866 0.383 1269 H11 EB4 200 H11 EB4 200 6.691 -0.885 1.557 1270 H12 EB4 200 H12 EB4 200 -0.012 7.223 4.872 1271 H15 EB4 200 H15 EB4 200 -0.175 6.230 7.137 1272 H14 EB4 200 H14 EB4 200 6.853 -1.701 3.893 1273 H13 EB4 200 H13 EB4 200 -2.812 -2.389 2.626 1274 H22 EB4 200 H22 EB4 200 -1.109 -3.251 7.056 1275 H30 EB4 200 H30 EB4 200 -0.502 0.051 10.084 1276 H30A EB4 200 H9N EB4 200 -1.451 1.123 8.942 1277 H24 EB4 200 H24 EB4 200 0.350 2.383 10.016 1278 H28 EB4 200 H28 EB4 200 1.035 -3.741 8.134 1279 H28A EB4 200 H9L EB4 200 1.074 -3.952 6.375 1280 H23 EB4 200 H23 EB4 200 4.973 -1.765 8.317 1281 H29 EB4 200 H29 EB4 200 3.881 -0.319 9.988 1282 H29A EB4 200 H9M EB4 200 4.823 0.665 8.764 1283 H21 ACD 300 HA3 ACD 300 0.161 9.256 -11.959 1284 H22 ACD 300 HA4 ACD 300 0.452 10.605 -10.841 1285 H31 ACD 300 HA1 ACD 300 0.305 7.654 -10.083 1286 H32 ACD 300 HA2 ACD 300 1.784 8.634 -10.184 1287 H41 ACD 300 HA0 ACD 300 -0.568 9.111 -8.296 1288 H42 ACD 300 HAZ ACD 300 0.869 10.153 -8.432 1289 H5 ACD 300 HAY ACD 300 2.232 7.827 -7.840 1290 H6 ACD 300 HAX ACD 300 1.198 7.228 -5.511 1291 H71 ACD 300 HAV ACD 300 -0.963 9.278 -6.436 1292 H72 ACD 300 HAW ACD 300 -1.471 7.646 -5.949 1293 H8 ACD 300 HAU ACD 300 -0.627 9.917 -4.089 1294 H9 ACD 300 HAT ACD 300 -0.826 8.152 -2.179 1295 H101 ACD 300 HAR ACD 300 -1.513 6.217 -4.479 1296 H102 ACD 300 HAS ACD 300 0.027 5.899 -3.648 1297 H11 ACD 300 HAQ ACD 300 -2.769 5.377 -2.530 1298 H12 ACD 300 HAP ACD 300 -1.522 4.824 -0.287 1299 H131 ACD 300 HAN ACD 300 0.764 6.591 -1.491 1300 H132 ACD 300 HAO ACD 300 1.100 4.820 -1.157 1301 H14 ACD 300 HAM ACD 300 0.823 5.197 1.249 1302 H15 ACD 300 HAL ACD 300 0.971 7.667 2.076 1303 H161 ACD 300 HAJ ACD 300 -0.306 8.550 -0.468 1304 H162 ACD 300 HAK ACD 300 0.705 9.566 0.582 1305 H171 ACD 300 HAH ACD 300 2.734 8.780 -0.510 1306 H172 ACD 300 HAI ACD 300 1.817 7.611 -1.481 1307 H181 ACD 300 HAF ACD 300 0.487 9.618 -2.386 1308 H182 ACD 300 HAG ACD 300 1.733 10.645 -1.642 1309 H191 ACD 300 HAD ACD 300 3.483 9.589 -2.949 1310 H192 ACD 300 HAE ACD 300 2.348 8.376 -3.582 1311 H201 ACD 300 HAA ACD 300 2.725 10.125 -5.259 1312 H202 ACD 300 HAB ACD 300 2.253 11.386 -4.101 1313 H203 ACD 300 HAC ACD 300 1.046 10.217 -4.689 Start of MODEL 4 1 H1 MET 1 HT1 MET 1 -0.519 22.497 -20.340 2 H2 MET 1 HT2 MET 1 -1.167 21.354 -21.416 3 H3 MET 1 HT3 MET 1 -1.525 21.261 -19.758 4 HA MET 1 HA MET 1 -2.526 23.581 -20.041 5 HB2 MET 1 HB2 MET 1 -2.476 22.556 -22.897 6 HB3 MET 1 HB1 MET 1 -3.378 23.966 -22.340 7 HG2 MET 1 HG2 MET 1 -1.248 25.000 -21.580 8 HG3 MET 1 HG1 MET 1 -0.368 23.613 -22.224 9 HE1 MET 1 HE1 MET 1 0.709 26.016 -24.902 10 HE2 MET 1 HE2 MET 1 0.509 26.418 -23.199 11 HE3 MET 1 HE3 MET 1 1.121 24.826 -23.669 12 H THR 2 HN THR 2 -3.352 20.830 -22.169 13 HA THR 2 HA THR 2 -6.069 20.740 -21.374 14 HB THR 2 HB THR 2 -6.140 18.603 -22.562 15 HG1 THR 2 HG1 THR 2 -4.420 17.432 -22.543 16 HG21 THR 2 HG21 THR 2 -5.443 19.397 -24.725 17 HG22 THR 2 HG22 THR 2 -6.000 20.796 -23.808 18 HG23 THR 2 HG23 THR 2 -4.272 20.501 -24.001 19 H VAL 3 HN VAL 3 -3.288 19.882 -19.713 20 HA VAL 3 HA VAL 3 -4.855 18.461 -17.696 21 HB VAL 3 HB VAL 3 -2.943 16.734 -17.555 22 HG11 VAL 3 HG11 VAL 3 -5.249 16.250 -18.370 23 HG12 VAL 3 HG12 VAL 3 -4.744 16.708 -19.996 24 HG13 VAL 3 HG13 VAL 3 -4.027 15.299 -19.214 25 HG21 VAL 3 HG21 VAL 3 -1.668 16.366 -19.572 26 HG22 VAL 3 HG22 VAL 3 -2.576 17.608 -20.434 27 HG23 VAL 3 HG23 VAL 3 -1.477 18.063 -19.133 28 HA PRO 4 HA PRO 4 -2.254 20.884 -15.063 29 HB2 PRO 4 HB2 PRO 4 -2.298 19.397 -12.759 30 HB3 PRO 4 HB1 PRO 4 -3.680 20.358 -13.321 31 HG2 PRO 4 HG2 PRO 4 -3.183 17.428 -13.593 32 HG3 PRO 4 HG1 PRO 4 -4.683 18.284 -13.190 33 HD2 PRO 4 HD2 PRO 4 -4.184 17.321 -15.691 34 HD3 PRO 4 HD1 PRO 4 -5.154 18.784 -15.409 35 H ASP 5 HN ASP 5 -0.107 21.064 -14.475 36 HA ASP 5 HA ASP 5 1.707 19.069 -15.443 37 HB2 ASP 5 HB2 ASP 5 2.153 21.605 -13.854 38 HB3 ASP 5 HB1 ASP 5 3.451 20.595 -14.489 39 H ARG 6 HN ARG 6 2.233 17.273 -14.394 40 HA ARG 6 HA ARG 6 1.526 16.593 -11.808 41 HB2 ARG 6 HB2 ARG 6 3.047 14.737 -11.992 42 HB3 ARG 6 HB1 ARG 6 2.336 15.012 -13.580 43 HG2 ARG 6 HG2 ARG 6 5.065 16.019 -12.698 44 HG3 ARG 6 HG1 ARG 6 4.780 14.615 -13.719 45 HD2 ARG 6 HD2 ARG 6 3.440 16.283 -15.221 46 HD3 ARG 6 HD1 ARG 6 4.352 17.520 -14.357 47 HE ARG 6 HE ARG 6 6.289 15.794 -15.152 48 HH11 ARG 6 HH21 ARG 6 3.638 17.344 -16.746 49 HH12 ARG 6 HH22 ARG 6 4.431 17.429 -18.283 50 HH21 ARG 6 HH11 ARG 6 7.337 15.900 -17.165 51 HH22 ARG 6 HH12 ARG 6 6.525 16.611 -18.520 52 H SER 7 HN SER 7 4.169 18.550 -12.894 53 HA SER 7 HA SER 7 5.911 18.329 -10.705 54 HB2 SER 7 HB2 SER 7 6.454 19.500 -12.832 55 HB3 SER 7 HB1 SER 7 5.350 20.794 -12.372 56 HG SER 7 HG SER 7 7.051 21.561 -11.396 57 H GLU 8 HN GLU 8 2.939 20.150 -11.146 58 HA GLU 8 HA GLU 8 3.160 21.909 -8.971 59 HB2 GLU 8 HB2 GLU 8 1.442 21.998 -10.811 60 HB3 GLU 8 HB1 GLU 8 0.606 20.667 -10.010 61 HG2 GLU 8 HG2 GLU 8 -0.417 22.722 -9.265 62 HG3 GLU 8 HG1 GLU 8 0.527 22.081 -7.923 63 H ILE 9 HN ILE 9 1.590 18.695 -9.144 64 HA ILE 9 HA ILE 9 1.160 18.706 -6.268 65 HB ILE 9 HB ILE 9 -0.621 17.591 -7.205 66 HG12 ILE 9 HG12 ILE 9 1.302 15.257 -7.199 67 HG13 ILE 9 HG11 ILE 9 0.730 15.991 -5.704 68 HG21 ILE 9 HG21 ILE 9 -0.305 16.050 -9.221 69 HG22 ILE 9 HG22 ILE 9 -0.018 17.767 -9.506 70 HG23 ILE 9 HG23 ILE 9 1.345 16.665 -9.308 71 HD11 ILE 9 HD11 ILE 9 -0.825 14.284 -5.967 72 HD12 ILE 9 HD12 ILE 9 -1.650 15.594 -6.795 73 HD13 ILE 9 HD13 ILE 9 -0.785 14.376 -7.727 74 H ALA 10 HN ALA 10 3.483 17.381 -8.535 75 HA ALA 10 HA ALA 10 4.501 15.440 -6.707 76 HB1 ALA 10 HB1 ALA 10 5.927 16.638 -9.083 77 HB2 ALA 10 HB2 ALA 10 4.935 15.180 -9.108 78 HB3 ALA 10 HB3 ALA 10 6.436 15.208 -8.184 79 H GLY 11 HN GLY 11 6.191 15.507 -5.285 80 HA2 GLY 11 HA2 GLY 11 8.184 16.673 -4.472 81 HA3 GLY 11 HA1 GLY 11 7.319 18.187 -4.730 82 H LYS 12 HN LYS 12 4.759 17.104 -3.751 83 HA LYS 12 HA LYS 12 5.166 16.224 -1.044 84 HB2 LYS 12 HB2 LYS 12 5.796 18.657 -0.950 85 HB3 LYS 12 HB1 LYS 12 4.134 19.039 -1.401 86 HG2 LYS 12 HG2 LYS 12 3.319 17.794 0.577 87 HG3 LYS 12 HG1 LYS 12 4.986 17.449 1.037 88 HD2 LYS 12 HD2 LYS 12 5.379 19.963 1.045 89 HD3 LYS 12 HD1 LYS 12 3.631 20.152 0.901 90 HE2 LYS 12 HE2 LYS 12 4.127 20.258 3.243 91 HE3 LYS 12 HE1 LYS 12 3.421 18.667 2.957 92 HZ1 LYS 12 HZ1 LYS 12 5.282 18.178 4.197 93 HZ2 LYS 12 HZ2 LYS 12 5.863 17.965 2.614 94 HZ3 LYS 12 HZ3 LYS 12 6.230 19.384 3.467 95 H TRP 13 HN TRP 13 3.523 14.773 -0.952 96 HA TRP 13 HA TRP 13 0.821 15.595 -1.868 97 HB2 TRP 13 HB2 TRP 13 2.156 12.882 -1.588 98 HB3 TRP 13 HB1 TRP 13 0.443 13.040 -1.882 99 HD1 TRP 13 HD1 TRP 13 3.412 14.832 -3.573 100 HE1 TRP 13 HE1 TRP 13 3.185 14.375 -6.089 101 HE3 TRP 13 HE3 TRP 13 -0.798 11.960 -3.592 102 HZ2 TRP 13 HZ2 TRP 13 1.529 12.939 -7.856 103 HZ3 TRP 13 HZ3 TRP 13 -1.696 11.068 -5.723 104 HH2 TRP 13 HH2 TRP 13 -0.550 11.567 -7.866 105 H TYR 14 HN TYR 14 -0.621 15.917 -0.149 106 HA TYR 14 HA TYR 14 0.243 15.017 2.503 107 HB2 TYR 14 HB2 TYR 14 -0.857 17.395 1.494 108 HB3 TYR 14 HB1 TYR 14 -2.153 16.674 2.433 109 HD1 TYR 14 HD1 TYR 14 1.591 16.817 2.848 110 HD2 TYR 14 HD2 TYR 14 -2.270 17.643 4.550 111 HE1 TYR 14 HE1 TYR 14 2.670 17.609 4.927 112 HE2 TYR 14 HE2 TYR 14 -1.177 18.444 6.625 113 HH TYR 14 HH TYR 14 2.361 18.325 7.004 114 H VAL 15 HN VAL 15 -0.586 13.325 3.413 115 HA VAL 15 HA VAL 15 -3.091 12.120 2.431 116 HB VAL 15 HB VAL 15 -1.011 11.130 4.399 117 HG11 VAL 15 HG11 VAL 15 -3.102 10.168 5.044 118 HG12 VAL 15 HG12 VAL 15 -3.578 9.908 3.366 119 HG13 VAL 15 HG13 VAL 15 -2.286 8.940 4.077 120 HG21 VAL 15 HG21 VAL 15 -0.780 9.383 2.474 121 HG22 VAL 15 HG22 VAL 15 -1.582 10.605 1.486 122 HG23 VAL 15 HG23 VAL 15 -0.042 10.970 2.260 123 H VAL 16 HN VAL 16 -5.005 12.408 3.557 124 HA VAL 16 HA VAL 16 -4.793 13.212 6.397 125 HB VAL 16 HB VAL 16 -6.436 14.960 6.065 126 HG11 VAL 16 HG11 VAL 16 -4.334 15.484 3.982 127 HG12 VAL 16 HG12 VAL 16 -4.883 16.528 5.286 128 HG13 VAL 16 HG13 VAL 16 -3.827 15.169 5.623 129 HG21 VAL 16 HG21 VAL 16 -7.705 14.210 4.197 130 HG22 VAL 16 HG22 VAL 16 -6.851 15.638 3.615 131 HG23 VAL 16 HG23 VAL 16 -6.267 14.029 3.193 132 H ALA 17 HN ALA 17 -6.049 10.907 4.503 133 HA ALA 17 HA ALA 17 -7.802 9.991 6.461 134 HB1 ALA 17 HB1 ALA 17 -10.001 10.438 5.714 135 HB2 ALA 17 HB2 ALA 17 -9.448 11.064 4.174 136 HB3 ALA 17 HB3 ALA 17 -9.196 11.999 5.632 137 H LEU 18 HN LEU 18 -8.305 7.863 6.081 138 HA LEU 18 HA LEU 18 -8.246 6.901 3.311 139 HB2 LEU 18 HB2 LEU 18 -6.012 6.494 3.646 140 HB3 LEU 18 HB1 LEU 18 -6.167 6.463 5.392 141 HG LEU 18 HG LEU 18 -7.427 4.195 3.895 142 HD11 LEU 18 HD11 LEU 18 -5.259 4.480 2.755 143 HD12 LEU 18 HD12 LEU 18 -4.440 4.435 4.316 144 HD13 LEU 18 HD13 LEU 18 -5.292 3.008 3.726 145 HD21 LEU 18 HD21 LEU 18 -5.652 4.183 6.342 146 HD22 LEU 18 HD22 LEU 18 -7.373 4.539 6.442 147 HD23 LEU 18 HD23 LEU 18 -6.832 2.967 5.854 148 H ALA 19 HN ALA 19 -9.318 4.978 3.006 149 HA ALA 19 HA ALA 19 -10.807 3.925 5.335 150 HB1 ALA 19 HB1 ALA 19 -12.279 5.070 3.696 151 HB2 ALA 19 HB2 ALA 19 -12.621 3.348 3.799 152 HB3 ALA 19 HB3 ALA 19 -11.698 3.981 2.442 153 H SER 20 HN SER 20 -11.426 1.632 5.105 154 HA SER 20 HA SER 20 -10.018 -0.030 3.241 155 HB2 SER 20 HB2 SER 20 -8.438 -1.055 4.724 156 HB3 SER 20 HB1 SER 20 -8.181 0.686 4.803 157 HG SER 20 HG SER 20 -8.946 -1.052 6.739 158 H ASN 21 HN ASN 21 -9.996 -2.373 4.181 159 HA ASN 21 HA ASN 21 -12.632 -2.875 5.438 160 HB2 ASN 21 HB2 ASN 21 -11.158 -4.480 3.325 161 HB3 ASN 21 HB1 ASN 21 -12.603 -5.036 4.169 162 HD21 ASN 21 HD21 ASN 21 -12.734 -4.751 1.382 163 HD22 ASN 21 HD22 ASN 21 -13.703 -3.413 0.991 164 H THR 22 HN THR 22 -9.250 -3.256 5.428 165 HA THR 22 HA THR 22 -9.193 -5.532 7.229 166 HB THR 22 HB THR 22 -7.394 -5.047 5.509 167 HG1 THR 22 HG1 THR 22 -7.213 -5.825 8.064 168 HG21 THR 22 HG21 THR 22 -6.235 -3.113 7.477 169 HG22 THR 22 HG22 THR 22 -5.910 -3.279 5.753 170 HG23 THR 22 HG23 THR 22 -7.406 -2.517 6.298 171 H GLU 23 HN GLU 23 -10.050 -5.112 9.150 172 HA GLU 23 HA GLU 23 -10.477 -2.807 10.457 173 HB2 GLU 23 HB2 GLU 23 -11.196 -5.009 11.290 174 HB3 GLU 23 HB1 GLU 23 -9.543 -5.347 11.801 175 HG2 GLU 23 HG2 GLU 23 -9.586 -3.491 13.362 176 HG3 GLU 23 HG1 GLU 23 -11.168 -2.982 12.773 177 H PHE 24 HN PHE 24 -7.360 -4.362 10.176 178 HA PHE 24 HA PHE 24 -5.993 -3.089 12.240 179 HB2 PHE 24 HB2 PHE 24 -4.681 -3.540 9.578 180 HB3 PHE 24 HB1 PHE 24 -4.026 -3.776 11.198 181 HD1 PHE 24 HD1 PHE 24 -6.118 -5.348 12.541 182 HD2 PHE 24 HD2 PHE 24 -4.612 -5.637 8.526 183 HE1 PHE 24 HE1 PHE 24 -6.793 -7.729 12.458 184 HE2 PHE 24 HE2 PHE 24 -5.289 -8.020 8.446 185 HZ PHE 24 HZ PHE 24 -6.378 -9.067 10.413 186 H PHE 25 HN PHE 25 -6.346 -1.921 8.836 187 HA PHE 25 HA PHE 25 -4.863 0.442 9.321 188 HB2 PHE 25 HB2 PHE 25 -5.717 -0.901 7.103 189 HB3 PHE 25 HB1 PHE 25 -6.788 0.493 7.077 190 HD1 PHE 25 HD1 PHE 25 -4.971 2.555 8.319 191 HD2 PHE 25 HD2 PHE 25 -4.213 -0.440 5.338 192 HE1 PHE 25 HE1 PHE 25 -3.132 3.936 7.405 193 HE2 PHE 25 HE2 PHE 25 -2.372 0.945 4.423 194 HZ PHE 25 HZ PHE 25 -1.830 3.131 5.455 195 H LEU 26 HN LEU 26 -8.413 -0.033 9.034 196 HA LEU 26 HA LEU 26 -8.964 2.747 9.392 197 HB2 LEU 26 HB2 LEU 26 -11.314 1.988 9.836 198 HB3 LEU 26 HB1 LEU 26 -10.635 1.431 8.312 199 HG LEU 26 HG LEU 26 -9.911 -0.619 10.022 200 HD11 LEU 26 HD11 LEU 26 -11.345 0.497 11.793 201 HD12 LEU 26 HD12 LEU 26 -12.739 0.168 10.766 202 HD13 LEU 26 HD13 LEU 26 -11.791 -1.166 11.421 203 HD21 LEU 26 HD21 LEU 26 -10.831 -1.097 7.880 204 HD22 LEU 26 HD22 LEU 26 -11.994 -1.771 9.020 205 HD23 LEU 26 HD23 LEU 26 -12.321 -0.226 8.236 206 H ARG 27 HN ARG 27 -8.900 -0.006 11.554 207 HA ARG 27 HA ARG 27 -9.828 1.260 13.889 208 HB2 ARG 27 HB2 ARG 27 -9.476 -1.188 13.726 209 HB3 ARG 27 HB1 ARG 27 -7.733 -0.922 13.715 210 HG2 ARG 27 HG2 ARG 27 -8.468 -1.499 15.976 211 HG3 ARG 27 HG1 ARG 27 -7.906 0.169 15.943 212 HD2 ARG 27 HD2 ARG 27 -10.051 1.039 16.181 213 HD3 ARG 27 HD1 ARG 27 -10.818 -0.373 15.458 214 HE ARG 27 HE ARG 27 -10.874 -1.354 17.563 215 HH11 ARG 27 HH21 ARG 27 -8.717 1.351 17.500 216 HH12 ARG 27 HH22 ARG 27 -8.455 1.358 19.213 217 HH21 ARG 27 HH11 ARG 27 -10.536 -1.352 19.808 218 HH22 ARG 27 HH12 ARG 27 -9.485 -0.172 20.519 219 H GLU 28 HN GLU 28 -6.506 0.885 12.663 220 HA GLU 28 HA GLU 28 -5.396 2.513 14.763 221 HB2 GLU 28 HB2 GLU 28 -4.272 0.589 13.433 222 HB3 GLU 28 HB1 GLU 28 -3.963 1.821 12.210 223 HG2 GLU 28 HG2 GLU 28 -2.033 1.827 13.603 224 HG3 GLU 28 HG1 GLU 28 -2.969 3.233 14.102 225 H LYS 29 HN LYS 29 -6.151 3.076 11.281 226 HA LYS 29 HA LYS 29 -4.886 5.465 10.893 227 HB2 LYS 29 HB2 LYS 29 -6.124 4.445 9.103 228 HB3 LYS 29 HB1 LYS 29 -7.634 4.572 10.000 229 HG2 LYS 29 HG2 LYS 29 -7.473 6.317 8.260 230 HG3 LYS 29 HG1 LYS 29 -7.523 7.035 9.865 231 HD2 LYS 29 HD2 LYS 29 -5.186 7.488 9.847 232 HD3 LYS 29 HD1 LYS 29 -4.916 6.441 8.454 233 HE2 LYS 29 HE2 LYS 29 -6.376 8.002 7.109 234 HE3 LYS 29 HE1 LYS 29 -6.393 9.088 8.497 235 HZ1 LYS 29 HZ1 LYS 29 -4.626 9.887 7.307 236 HZ2 LYS 29 HZ2 LYS 29 -3.832 8.796 8.339 237 HZ3 LYS 29 HZ3 LYS 29 -4.160 8.356 6.735 238 H ASP 30 HN ASP 30 -7.660 4.775 12.856 239 HA ASP 30 HA ASP 30 -8.605 7.411 13.205 240 HB2 ASP 30 HB2 ASP 30 -9.875 5.326 13.734 241 HB3 ASP 30 HB1 ASP 30 -8.842 5.111 15.147 242 H LYS 31 HN LYS 31 -5.929 5.688 14.738 243 HA LYS 31 HA LYS 31 -5.810 7.725 16.821 244 HB2 LYS 31 HB2 LYS 31 -4.292 6.371 18.009 245 HB3 LYS 31 HB1 LYS 31 -5.531 5.298 17.376 246 HG2 LYS 31 HG2 LYS 31 -3.592 4.123 16.864 247 HG3 LYS 31 HG1 LYS 31 -3.888 4.990 15.375 248 HD2 LYS 31 HD2 LYS 31 -2.313 6.743 16.979 249 HD3 LYS 31 HD1 LYS 31 -1.594 5.150 17.148 250 HE2 LYS 31 HE2 LYS 31 -2.334 6.025 14.383 251 HE3 LYS 31 HE1 LYS 31 -0.924 6.766 15.127 252 HZ1 LYS 31 HZ1 LYS 31 -0.111 4.506 15.635 253 HZ2 LYS 31 HZ2 LYS 31 -1.408 3.867 14.743 254 HZ3 LYS 31 HZ3 LYS 31 -0.237 4.817 13.969 255 H MET 32 HN MET 32 -4.172 7.156 13.769 256 HA MET 32 HA MET 32 -1.846 8.668 14.619 257 HB2 MET 32 HB2 MET 32 -1.355 8.729 12.091 258 HB3 MET 32 HB1 MET 32 -1.289 7.171 12.886 259 HG2 MET 32 HG2 MET 32 -3.865 7.097 12.151 260 HG3 MET 32 HG1 MET 32 -3.288 8.219 10.934 261 HE1 MET 32 HE1 MET 32 -3.202 4.991 12.594 262 HE2 MET 32 HE2 MET 32 -2.425 3.836 11.530 263 HE3 MET 32 HE3 MET 32 -1.451 4.880 12.569 264 H LYS 33 HN LYS 33 -1.175 10.437 12.967 265 HA LYS 33 HA LYS 33 -3.338 12.453 12.869 266 HB2 LYS 33 HB2 LYS 33 -0.408 12.718 13.532 267 HB3 LYS 33 HB1 LYS 33 -1.392 14.097 13.054 268 HG2 LYS 33 HG2 LYS 33 -2.913 13.727 14.910 269 HG3 LYS 33 HG1 LYS 33 -2.075 12.237 15.344 270 HD2 LYS 33 HD2 LYS 33 -0.055 13.474 15.892 271 HD3 LYS 33 HD1 LYS 33 -0.781 14.978 15.325 272 HE2 LYS 33 HE2 LYS 33 -2.566 14.703 17.068 273 HE3 LYS 33 HE1 LYS 33 -1.681 13.310 17.690 274 HZ1 LYS 33 HZ1 LYS 33 -0.246 15.840 17.319 275 HZ2 LYS 33 HZ2 LYS 33 -1.279 15.684 18.658 276 HZ3 LYS 33 HZ3 LYS 33 0.014 14.607 18.458 277 H MET 34 HN MET 34 -2.589 14.287 11.172 278 HA MET 34 HA MET 34 -2.785 13.329 8.650 279 HB2 MET 34 HB2 MET 34 -2.919 15.703 9.553 280 HB3 MET 34 HB1 MET 34 -1.170 15.760 9.471 281 HG2 MET 34 HG2 MET 34 -1.151 15.965 7.205 282 HG3 MET 34 HG1 MET 34 -2.483 14.843 6.997 283 HE1 MET 34 HE1 MET 34 -4.738 15.223 7.677 284 HE2 MET 34 HE2 MET 34 -4.922 16.429 8.936 285 HE3 MET 34 HE3 MET 34 -5.634 16.704 7.352 286 H ALA 35 HN ALA 35 -1.418 12.522 7.124 287 HA ALA 35 HA ALA 35 1.460 12.274 7.786 288 HB1 ALA 35 HB1 ALA 35 1.211 10.292 6.077 289 HB2 ALA 35 HB2 ALA 35 -0.500 10.403 6.494 290 HB3 ALA 35 HB3 ALA 35 0.689 10.075 7.747 291 H MET 36 HN MET 36 2.876 12.127 5.829 292 HA MET 36 HA MET 36 1.820 13.712 3.566 293 HB2 MET 36 HB2 MET 36 4.602 14.340 3.964 294 HB3 MET 36 HB1 MET 36 3.217 15.428 3.985 295 HG2 MET 36 HG2 MET 36 4.025 13.746 6.370 296 HG3 MET 36 HG1 MET 36 4.597 15.391 6.105 297 HE1 MET 36 HE1 MET 36 3.716 17.008 7.529 298 HE2 MET 36 HE2 MET 36 2.241 16.842 8.478 299 HE3 MET 36 HE3 MET 36 3.521 15.634 8.612 300 H ALA 37 HN ALA 37 3.269 13.642 1.677 301 HA ALA 37 HA ALA 37 5.039 11.354 1.443 302 HB1 ALA 37 HB1 ALA 37 3.118 10.081 1.036 303 HB2 ALA 37 HB2 ALA 37 3.615 10.555 -0.590 304 HB3 ALA 37 HB3 ALA 37 2.298 11.408 0.215 305 H ARG 38 HN ARG 38 6.084 11.247 -0.667 306 HA ARG 38 HA ARG 38 5.812 13.705 -2.295 307 HB2 ARG 38 HB2 ARG 38 7.961 14.436 -1.988 308 HB3 ARG 38 HB1 ARG 38 7.791 13.590 -0.457 309 HG2 ARG 38 HG2 ARG 38 9.846 12.809 -1.309 310 HG3 ARG 38 HG1 ARG 38 8.716 11.522 -1.699 311 HD2 ARG 38 HD2 ARG 38 9.262 11.729 -3.886 312 HD3 ARG 38 HD1 ARG 38 8.671 13.386 -3.880 313 HE ARG 38 HE ARG 38 11.445 12.523 -3.654 314 HH11 ARG 38 HH21 ARG 38 9.096 15.036 -3.260 315 HH12 ARG 38 HH22 ARG 38 10.257 16.320 -3.330 316 HH21 ARG 38 HH11 ARG 38 12.970 14.202 -3.746 317 HH22 ARG 38 HH12 ARG 38 12.450 15.847 -3.605 318 H ILE 39 HN ILE 39 5.904 13.324 -4.501 319 HA ILE 39 HA ILE 39 6.648 10.633 -5.376 320 HB ILE 39 HB ILE 39 4.263 11.279 -5.324 321 HG12 ILE 39 HG12 ILE 39 5.004 11.013 -8.219 322 HG13 ILE 39 HG11 ILE 39 5.405 9.700 -7.116 323 HG21 ILE 39 HG21 ILE 39 3.521 12.848 -6.977 324 HG22 ILE 39 HG22 ILE 39 4.630 13.590 -5.827 325 HG23 ILE 39 HG23 ILE 39 5.159 13.179 -7.451 326 HD11 ILE 39 HD11 ILE 39 3.006 9.786 -8.269 327 HD12 ILE 39 HD12 ILE 39 3.180 9.251 -6.604 328 HD13 ILE 39 HD13 ILE 39 2.652 10.896 -6.956 329 H SER 40 HN SER 40 7.912 10.538 -7.279 330 HA SER 40 HA SER 40 8.410 12.987 -8.752 331 HB2 SER 40 HB2 SER 40 10.721 11.614 -7.423 332 HB3 SER 40 HB1 SER 40 10.762 13.082 -8.382 333 HG SER 40 HG SER 40 9.331 12.727 -5.957 334 H PHE 41 HN PHE 41 9.778 12.598 -10.675 335 HA PHE 41 HA PHE 41 9.188 9.913 -11.703 336 HB2 PHE 41 HB2 PHE 41 9.855 12.505 -13.083 337 HB3 PHE 41 HB1 PHE 41 9.622 10.974 -13.926 338 HD1 PHE 41 HD2 PHE 41 7.955 13.312 -11.528 339 HD2 PHE 41 HD1 PHE 41 7.453 10.235 -14.484 340 HE1 PHE 41 HE2 PHE 41 5.500 13.648 -11.460 341 HE2 PHE 41 HE1 PHE 41 4.996 10.571 -14.416 342 HZ PHE 41 HZ PHE 41 4.020 12.278 -12.903 343 H LEU 42 HN LEU 42 10.932 8.779 -10.784 344 HA LEU 42 HA LEU 42 13.674 9.396 -11.104 345 HB2 LEU 42 HB2 LEU 42 12.240 6.727 -11.006 346 HB3 LEU 42 HB1 LEU 42 13.989 6.869 -11.057 347 HG LEU 42 HG LEU 42 12.408 8.349 -8.960 348 HD11 LEU 42 HD11 LEU 42 13.047 5.408 -9.086 349 HD12 LEU 42 HD12 LEU 42 13.077 6.227 -7.526 350 HD13 LEU 42 HD13 LEU 42 11.596 6.210 -8.483 351 HD21 LEU 42 HD21 LEU 42 14.764 8.927 -9.139 352 HD22 LEU 42 HD22 LEU 42 14.554 7.953 -7.686 353 HD23 LEU 42 HD23 LEU 42 15.227 7.225 -9.144 354 H GLY 43 HN GLY 43 11.286 7.857 -13.080 355 HA2 GLY 43 HA2 GLY 43 12.495 8.552 -15.566 356 HA3 GLY 43 HA1 GLY 43 12.656 6.827 -15.225 357 H GLU 44 HN GLU 44 11.072 7.824 -17.379 358 HA GLU 44 HA GLU 44 8.374 8.215 -16.869 359 HB2 GLU 44 HB2 GLU 44 9.621 6.614 -19.122 360 HB3 GLU 44 HB1 GLU 44 7.962 7.215 -19.100 361 HG2 GLU 44 HG2 GLU 44 10.413 8.981 -18.852 362 HG3 GLU 44 HG1 GLU 44 9.542 8.702 -20.359 363 H ASP 45 HN ASP 45 10.244 5.251 -16.734 364 HA ASP 45 HA ASP 45 7.801 3.760 -15.978 365 HB2 ASP 45 HB2 ASP 45 9.545 1.778 -16.327 366 HB3 ASP 45 HB1 ASP 45 8.673 2.484 -17.684 367 H GLU 46 HN GLU 46 9.714 5.576 -14.398 368 HA GLU 46 HA GLU 46 9.898 3.786 -12.085 369 HB2 GLU 46 HB2 GLU 46 12.247 5.472 -12.969 370 HB3 GLU 46 HB1 GLU 46 12.193 4.338 -11.619 371 HG2 GLU 46 HG2 GLU 46 11.689 2.512 -13.291 372 HG3 GLU 46 HG1 GLU 46 12.012 3.681 -14.569 373 H LEU 47 HN LEU 47 8.847 4.790 -10.513 374 HA LEU 47 HA LEU 47 9.182 7.717 -10.187 375 HB2 LEU 47 HB2 LEU 47 6.639 6.276 -9.451 376 HB3 LEU 47 HB1 LEU 47 6.902 8.003 -9.662 377 HG LEU 47 HG LEU 47 7.105 5.993 -11.924 378 HD11 LEU 47 HD11 LEU 47 4.834 6.064 -10.935 379 HD12 LEU 47 HD12 LEU 47 4.811 7.814 -11.155 380 HD13 LEU 47 HD13 LEU 47 4.872 6.751 -12.560 381 HD21 LEU 47 HD21 LEU 47 6.670 8.176 -13.228 382 HD22 LEU 47 HD22 LEU 47 7.066 9.014 -11.729 383 HD23 LEU 47 HD23 LEU 47 8.266 7.989 -12.512 384 H LYS 48 HN LYS 48 9.449 8.427 -8.095 385 HA LYS 48 HA LYS 48 9.769 6.316 -6.048 386 HB2 LYS 48 HB2 LYS 48 11.701 7.907 -6.770 387 HB3 LYS 48 HB1 LYS 48 10.844 9.120 -5.828 388 HG2 LYS 48 HG2 LYS 48 11.017 7.793 -3.822 389 HG3 LYS 48 HG1 LYS 48 11.638 6.410 -4.723 390 HD2 LYS 48 HD2 LYS 48 13.503 7.540 -3.641 391 HD3 LYS 48 HD1 LYS 48 13.620 7.782 -5.384 392 HE2 LYS 48 HE2 LYS 48 12.915 10.023 -5.248 393 HE3 LYS 48 HE1 LYS 48 12.195 9.799 -3.653 394 HZ1 LYS 48 HZ1 LYS 48 14.252 9.791 -2.631 395 HZ2 LYS 48 HZ2 LYS 48 15.091 9.423 -4.062 396 HZ3 LYS 48 HZ3 LYS 48 14.451 10.977 -3.832 397 H VAL 49 HN VAL 49 8.151 6.191 -4.583 398 HA VAL 49 HA VAL 49 6.791 8.705 -3.840 399 HB VAL 49 HB VAL 49 5.639 6.085 -4.606 400 HG11 VAL 49 HG11 VAL 49 5.060 5.965 -2.247 401 HG12 VAL 49 HG12 VAL 49 4.552 7.655 -2.252 402 HG13 VAL 49 HG13 VAL 49 3.632 6.455 -3.158 403 HG21 VAL 49 HG21 VAL 49 3.685 7.664 -5.024 404 HG22 VAL 49 HG22 VAL 49 4.756 8.974 -4.533 405 HG23 VAL 49 HG23 VAL 49 5.154 7.984 -5.933 406 H SER 50 HN SER 50 6.567 9.189 -1.819 407 HA SER 50 HA SER 50 7.887 7.435 0.178 408 HB2 SER 50 HB2 SER 50 9.061 9.513 -0.604 409 HB3 SER 50 HB1 SER 50 7.748 10.435 0.101 410 HG SER 50 HG SER 50 9.701 8.829 1.348 411 H TYR 51 HN TYR 51 7.077 7.383 2.283 412 HA TYR 51 HA TYR 51 4.470 8.719 2.724 413 HB2 TYR 51 HB2 TYR 51 5.201 6.106 4.039 414 HB3 TYR 51 HB1 TYR 51 3.611 6.830 3.826 415 HD1 TYR 51 HD1 TYR 51 3.408 7.474 1.050 416 HD2 TYR 51 HD2 TYR 51 5.316 4.097 2.881 417 HE1 TYR 51 HE1 TYR 51 3.036 6.139 -0.997 418 HE2 TYR 51 HE2 TYR 51 4.963 2.776 0.817 419 HH TYR 51 HH TYR 51 3.864 2.707 -1.152 420 H ALA 52 HN ALA 52 4.338 9.883 4.555 421 HA ALA 52 HA ALA 52 6.410 9.502 6.644 422 HB1 ALA 52 HB1 ALA 52 5.309 12.020 5.412 423 HB2 ALA 52 HB2 ALA 52 6.987 11.589 5.743 424 HB3 ALA 52 HB3 ALA 52 5.913 12.031 7.070 425 H VAL 53 HN VAL 53 5.338 8.510 8.319 426 HA VAL 53 HA VAL 53 2.579 9.379 8.850 427 HB VAL 53 HB VAL 53 3.835 6.843 9.864 428 HG11 VAL 53 HG11 VAL 53 1.681 7.572 10.830 429 HG12 VAL 53 HG12 VAL 53 0.987 7.665 9.211 430 HG13 VAL 53 HG13 VAL 53 1.480 6.105 9.872 431 HG21 VAL 53 HG21 VAL 53 2.550 7.379 7.170 432 HG22 VAL 53 HG22 VAL 53 4.173 6.759 7.472 433 HG23 VAL 53 HG23 VAL 53 2.766 5.762 7.841 434 HA PRO 54 HA PRO 54 4.317 10.961 12.681 435 HB2 PRO 54 HB2 PRO 54 2.068 11.994 13.750 436 HB3 PRO 54 HB1 PRO 54 2.832 12.727 12.323 437 HG2 PRO 54 HG2 PRO 54 0.483 10.884 12.469 438 HG3 PRO 54 HG1 PRO 54 0.694 12.360 11.508 439 HD2 PRO 54 HD2 PRO 54 1.049 9.833 10.486 440 HD3 PRO 54 HD1 PRO 54 1.887 11.272 9.857 441 H LYS 55 HN LYS 55 4.017 10.620 15.019 442 HA LYS 55 HA LYS 55 2.215 8.566 15.931 443 HB2 LYS 55 HB2 LYS 55 3.877 7.133 14.907 444 HB3 LYS 55 HB1 LYS 55 5.175 7.989 15.737 445 HG2 LYS 55 HG2 LYS 55 4.582 7.131 17.840 446 HG3 LYS 55 HG1 LYS 55 2.946 6.723 17.324 447 HD2 LYS 55 HD2 LYS 55 5.265 5.372 15.967 448 HD3 LYS 55 HD1 LYS 55 4.786 4.827 17.574 449 HE2 LYS 55 HE2 LYS 55 2.751 5.155 15.368 450 HE3 LYS 55 HE1 LYS 55 3.679 3.666 15.546 451 HZ1 LYS 55 HZ1 LYS 55 1.432 3.881 16.742 452 HZ2 LYS 55 HZ2 LYS 55 2.748 3.228 17.595 453 HZ3 LYS 55 HZ3 LYS 55 2.282 4.837 17.859 454 HA PRO 56 HA PRO 56 3.165 11.927 19.017 455 HB2 PRO 56 HB2 PRO 56 1.074 10.164 20.274 456 HB3 PRO 56 HB1 PRO 56 1.243 11.931 20.348 457 HG2 PRO 56 HG2 PRO 56 -0.498 10.778 18.689 458 HG3 PRO 56 HG1 PRO 56 0.394 12.237 18.227 459 HD2 PRO 56 HD2 PRO 56 0.706 9.469 17.226 460 HD3 PRO 56 HD1 PRO 56 1.198 10.998 16.464 461 H ASN 57 HN ASN 57 3.312 8.455 19.141 462 HA ASN 57 HA ASN 57 4.874 8.509 21.652 463 HB2 ASN 57 HB2 ASN 57 3.631 6.188 20.155 464 HB3 ASN 57 HB1 ASN 57 4.531 6.064 21.666 465 HD21 ASN 57 HD21 ASN 57 3.495 8.394 22.991 466 HD22 ASN 57 HD22 ASN 57 1.846 8.133 23.301 467 H GLY 58 HN GLY 58 5.777 9.292 18.875 468 HA2 GLY 58 HA2 GLY 58 8.383 8.738 18.812 469 HA3 GLY 58 HA1 GLY 58 7.725 7.232 18.178 470 H CYS 59 HN CYS 59 8.922 7.785 16.203 471 HA CYS 59 HA CYS 59 7.263 9.413 14.400 472 HB2 CYS 59 HB2 CYS 59 9.206 10.792 15.332 473 HB3 CYS 59 HB1 CYS 59 10.266 9.715 14.422 474 H ARG 60 HN ARG 60 6.998 8.448 12.430 475 HA ARG 60 HA ARG 60 8.937 6.322 11.683 476 HB2 ARG 60 HB2 ARG 60 5.917 6.229 11.524 477 HB3 ARG 60 HB1 ARG 60 6.983 5.072 10.725 478 HG2 ARG 60 HG2 ARG 60 8.016 4.587 12.972 479 HG3 ARG 60 HG1 ARG 60 6.763 5.594 13.702 480 HD2 ARG 60 HD2 ARG 60 5.044 4.126 12.595 481 HD3 ARG 60 HD1 ARG 60 6.354 3.064 12.086 482 HE ARG 60 HE ARG 60 5.213 3.221 14.714 483 HH11 ARG 60 HH21 ARG 60 8.116 2.665 12.913 484 HH12 ARG 60 HH22 ARG 60 8.840 1.663 14.126 485 HH21 ARG 60 HH11 ARG 60 6.155 1.908 16.309 486 HH22 ARG 60 HH12 ARG 60 7.729 1.234 16.048 487 H LYS 61 HN LYS 61 9.968 7.039 9.948 488 HA LYS 61 HA LYS 61 8.386 8.104 7.694 489 HB2 LYS 61 HB2 LYS 61 10.235 9.720 7.238 490 HB3 LYS 61 HB1 LYS 61 9.378 10.051 8.743 491 HG2 LYS 61 HG2 LYS 61 11.165 8.736 9.950 492 HG3 LYS 61 HG1 LYS 61 12.060 8.678 8.432 493 HD2 LYS 61 HD2 LYS 61 12.030 11.163 8.347 494 HD3 LYS 61 HD1 LYS 61 11.216 11.186 9.911 495 HE2 LYS 61 HE2 LYS 61 13.101 10.178 11.004 496 HE3 LYS 61 HE1 LYS 61 13.880 9.822 9.462 497 HZ1 LYS 61 HZ1 LYS 61 14.668 11.887 9.301 498 HZ2 LYS 61 HZ2 LYS 61 13.214 12.599 9.816 499 HZ3 LYS 61 HZ3 LYS 61 14.325 12.025 10.960 500 H TRP 62 HN TRP 62 8.879 7.175 5.783 501 HA TRP 62 HA TRP 62 11.519 6.071 5.303 502 HB2 TRP 62 HB2 TRP 62 11.074 3.885 5.640 503 HB3 TRP 62 HB1 TRP 62 9.585 4.391 6.426 504 HD1 TRP 62 HD1 TRP 62 7.551 4.957 4.406 505 HE1 TRP 62 HE1 TRP 62 6.848 3.319 2.542 506 HE3 TRP 62 HE3 TRP 62 11.692 1.973 4.239 507 HZ2 TRP 62 HZ2 TRP 62 7.903 1.045 1.160 508 HZ3 TRP 62 HZ3 TRP 62 11.818 0.082 2.642 509 HH2 TRP 62 HH2 TRP 62 9.931 -0.384 1.103 510 H GLU 63 HN GLU 63 11.533 4.987 3.047 511 HA GLU 63 HA GLU 63 9.801 6.570 1.228 512 HB2 GLU 63 HB2 GLU 63 12.156 7.366 1.301 513 HB3 GLU 63 HB1 GLU 63 12.683 5.769 0.767 514 HG2 GLU 63 HG2 GLU 63 11.639 6.003 -1.343 515 HG3 GLU 63 HG1 GLU 63 10.640 7.349 -0.797 516 H THR 64 HN THR 64 9.617 5.633 -0.970 517 HA THR 64 HA THR 64 10.013 2.749 -1.193 518 HB THR 64 HB THR 64 7.244 3.886 -1.546 519 HG1 THR 64 HG1 THR 64 7.802 4.121 0.612 520 HG21 THR 64 HG21 THR 64 7.635 1.794 -2.700 521 HG22 THR 64 HG22 THR 64 8.385 1.094 -1.266 522 HG23 THR 64 HG23 THR 64 6.659 1.455 -1.270 523 H THR 65 HN THR 65 10.095 2.043 -3.315 524 HA THR 65 HA THR 65 10.043 4.168 -5.366 525 HB THR 65 HB THR 65 11.353 1.443 -5.462 526 HG1 THR 65 HG1 THR 65 12.977 3.592 -5.470 527 HG21 THR 65 HG21 THR 65 12.590 2.583 -7.377 528 HG22 THR 65 HG22 THR 65 10.898 2.193 -7.685 529 HG23 THR 65 HG23 THR 65 11.364 3.848 -7.293 530 H PHE 66 HN PHE 66 8.528 4.158 -6.924 531 HA PHE 66 HA PHE 66 6.944 1.684 -7.351 532 HB2 PHE 66 HB2 PHE 66 6.160 4.582 -7.164 533 HB3 PHE 66 HB1 PHE 66 5.202 3.493 -8.163 534 HD1 PHE 66 HD1 PHE 66 6.689 3.756 -4.731 535 HD2 PHE 66 HD2 PHE 66 3.513 2.209 -7.176 536 HE1 PHE 66 HE1 PHE 66 5.534 2.911 -2.708 537 HE2 PHE 66 HE2 PHE 66 2.363 1.370 -5.149 538 HZ PHE 66 HZ PHE 66 3.373 1.720 -2.914 539 H LYS 67 HN LYS 67 6.759 0.969 -9.426 540 HA LYS 67 HA LYS 67 7.958 2.647 -11.562 541 HB2 LYS 67 HB2 LYS 67 7.874 -0.365 -11.279 542 HB3 LYS 67 HB1 LYS 67 8.452 0.491 -12.708 543 HG2 LYS 67 HG2 LYS 67 10.006 1.743 -10.982 544 HG3 LYS 67 HG1 LYS 67 9.679 0.340 -9.965 545 HD2 LYS 67 HD2 LYS 67 10.346 -1.097 -11.962 546 HD3 LYS 67 HD1 LYS 67 10.949 0.384 -12.706 547 HE2 LYS 67 HE2 LYS 67 12.767 -0.786 -11.527 548 HE3 LYS 67 HE1 LYS 67 12.422 0.760 -10.753 549 HZ1 LYS 67 HZ1 LYS 67 12.634 -1.377 -9.329 550 HZ2 LYS 67 HZ2 LYS 67 11.414 -0.250 -8.973 551 HZ3 LYS 67 HZ3 LYS 67 11.036 -1.662 -9.831 552 H LYS 68 HN LYS 68 6.915 2.782 -13.534 553 HA LYS 68 HA LYS 68 4.075 2.499 -13.470 554 HB2 LYS 68 HB2 LYS 68 5.508 4.207 -14.785 555 HB3 LYS 68 HB1 LYS 68 5.668 2.927 -15.988 556 HG2 LYS 68 HG2 LYS 68 3.188 2.746 -16.090 557 HG3 LYS 68 HG1 LYS 68 3.067 4.096 -14.959 558 HD2 LYS 68 HD2 LYS 68 4.327 5.521 -16.560 559 HD3 LYS 68 HD1 LYS 68 4.358 4.177 -17.701 560 HE2 LYS 68 HE2 LYS 68 1.812 4.146 -17.532 561 HE3 LYS 68 HE1 LYS 68 1.943 5.687 -16.685 562 HZ1 LYS 68 HZ1 LYS 68 3.057 6.635 -18.569 563 HZ2 LYS 68 HZ2 LYS 68 3.064 5.141 -19.379 564 HZ3 LYS 68 HZ3 LYS 68 1.597 5.942 -19.089 565 H THR 69 HN THR 69 2.824 0.865 -14.062 566 HA THR 69 HA THR 69 3.960 -1.293 -15.748 567 HB THR 69 HB THR 69 3.865 -2.108 -13.459 568 HG1 THR 69 HG1 THR 69 2.035 -3.669 -13.842 569 HG21 THR 69 HG21 THR 69 2.238 -0.485 -12.583 570 HG22 THR 69 HG22 THR 69 0.964 -1.233 -13.544 571 HG23 THR 69 HG23 THR 69 1.719 -2.133 -12.229 572 H SER 70 HN SER 70 2.125 -2.700 -16.634 573 HA SER 70 HA SER 70 0.076 -0.902 -17.736 574 HB2 SER 70 HB2 SER 70 -0.148 -2.452 -19.519 575 HB3 SER 70 HB1 SER 70 1.583 -2.349 -19.209 576 HG SER 70 HG SER 70 1.420 -4.252 -17.999 577 H ASP 71 HN ASP 71 0.356 -2.763 -15.143 578 HA ASP 71 HA ASP 71 -1.313 -4.665 -14.659 579 HB2 ASP 71 HB2 ASP 71 -0.350 -3.068 -12.938 580 HB3 ASP 71 HB1 ASP 71 -1.818 -2.114 -13.142 581 H ASP 72 HN ASP 72 -2.671 -1.412 -15.391 582 HA ASP 72 HA ASP 72 -4.870 -2.475 -16.790 583 HB2 ASP 72 HB2 ASP 72 -5.704 -3.237 -14.669 584 HB3 ASP 72 HB1 ASP 72 -5.394 -1.671 -13.925 585 H GLY 73 HN GLY 73 -4.137 -0.846 -18.170 586 HA2 GLY 73 HA2 GLY 73 -4.533 1.205 -19.184 587 HA3 GLY 73 HA1 GLY 73 -5.402 1.714 -17.741 588 H GLU 74 HN GLU 74 -4.396 2.993 -16.277 589 HA GLU 74 HA GLU 74 -1.497 3.516 -16.634 590 HB2 GLU 74 HB2 GLU 74 -3.730 5.473 -16.045 591 HB3 GLU 74 HB1 GLU 74 -2.016 5.860 -15.892 592 HG2 GLU 74 HG2 GLU 74 -1.684 5.258 -18.276 593 HG3 GLU 74 HG1 GLU 74 -3.411 4.937 -18.421 594 H VAL 75 HN VAL 75 -0.908 2.101 -14.930 595 HA VAL 75 HA VAL 75 -1.624 3.100 -12.249 596 HB VAL 75 HB VAL 75 -1.478 0.180 -13.005 597 HG11 VAL 75 HG11 VAL 75 -2.588 0.104 -10.628 598 HG12 VAL 75 HG12 VAL 75 -0.845 0.317 -10.752 599 HG13 VAL 75 HG13 VAL 75 -1.879 1.707 -10.432 600 HG21 VAL 75 HG21 VAL 75 -3.995 0.411 -12.291 601 HG22 VAL 75 HG22 VAL 75 -3.765 2.116 -12.679 602 HG23 VAL 75 HG23 VAL 75 -3.519 0.889 -13.919 603 H TYR 76 HN TYR 76 -0.084 2.787 -10.633 604 HA TYR 76 HA TYR 76 2.628 2.097 -11.612 605 HB2 TYR 76 HB2 TYR 76 1.960 3.947 -9.319 606 HB3 TYR 76 HB1 TYR 76 3.511 3.756 -10.147 607 HD1 TYR 76 HD1 TYR 76 3.829 4.594 -12.448 608 HD2 TYR 76 HD2 TYR 76 0.147 5.214 -10.327 609 HE1 TYR 76 HE1 TYR 76 3.148 6.287 -14.126 610 HE2 TYR 76 HE2 TYR 76 -0.532 6.911 -12.005 611 HH TYR 76 HH TYR 76 1.101 8.518 -13.758 612 H TYR 77 HN TYR 77 4.007 0.984 -10.067 613 HA TYR 77 HA TYR 77 2.777 -0.065 -7.658 614 HB2 TYR 77 HB2 TYR 77 2.433 -2.261 -8.257 615 HB3 TYR 77 HB1 TYR 77 2.075 -1.474 -9.791 616 HD1 TYR 77 HD2 TYR 77 4.152 -1.086 -11.380 617 HD2 TYR 77 HD1 TYR 77 4.012 -3.992 -8.222 618 HE1 TYR 77 HE2 TYR 77 5.977 -2.360 -12.472 619 HE2 TYR 77 HE1 TYR 77 5.838 -5.266 -9.313 620 HH TYR 77 HH TYR 77 7.746 -4.722 -10.928 621 H SER 78 HN SER 78 4.202 -0.826 -6.142 622 HA SER 78 HA SER 78 7.062 -0.595 -6.816 623 HB2 SER 78 HB2 SER 78 7.284 -0.638 -4.283 624 HB3 SER 78 HB1 SER 78 6.462 0.768 -4.948 625 HG SER 78 HG SER 78 4.792 0.197 -3.827 626 H GLU 79 HN GLU 79 7.700 -2.539 -7.590 627 HA GLU 79 HA GLU 79 6.655 -5.046 -6.983 628 HB2 GLU 79 HB2 GLU 79 8.306 -4.357 -8.838 629 HB3 GLU 79 HB1 GLU 79 9.567 -4.630 -7.637 630 HG2 GLU 79 HG2 GLU 79 7.472 -6.690 -8.389 631 HG3 GLU 79 HG1 GLU 79 9.093 -6.634 -9.078 632 H GLU 80 HN GLU 80 9.260 -3.269 -5.364 633 HA GLU 80 HA GLU 80 10.020 -5.435 -3.669 634 HB2 GLU 80 HB2 GLU 80 11.349 -3.772 -2.481 635 HB3 GLU 80 HB1 GLU 80 11.532 -3.568 -4.223 636 HG2 GLU 80 HG2 GLU 80 9.755 -1.800 -4.144 637 HG3 GLU 80 HG1 GLU 80 9.755 -1.938 -2.387 638 H ALA 81 HN ALA 81 7.711 -2.781 -3.321 639 HA ALA 81 HA ALA 81 7.173 -3.609 -0.541 640 HB1 ALA 81 HB1 ALA 81 6.509 -1.133 -2.123 641 HB2 ALA 81 HB2 ALA 81 7.498 -1.276 -0.671 642 HB3 ALA 81 HB3 ALA 81 5.750 -1.482 -0.570 643 H LYS 82 HN LYS 82 6.140 -4.688 -3.381 644 HA LYS 82 HA LYS 82 4.091 -5.371 -4.280 645 HB2 LYS 82 HB2 LYS 82 3.956 -6.320 -1.407 646 HB3 LYS 82 HB1 LYS 82 2.950 -6.934 -2.720 647 HG2 LYS 82 HG2 LYS 82 5.037 -7.562 -3.955 648 HG3 LYS 82 HG1 LYS 82 5.973 -7.078 -2.540 649 HD2 LYS 82 HD2 LYS 82 4.674 -8.717 -1.173 650 HD3 LYS 82 HD1 LYS 82 3.868 -9.257 -2.646 651 HE2 LYS 82 HE2 LYS 82 5.669 -10.780 -2.332 652 HE3 LYS 82 HE1 LYS 82 6.216 -9.674 -3.592 653 HZ1 LYS 82 HZ1 LYS 82 8.000 -9.594 -2.216 654 HZ2 LYS 82 HZ2 LYS 82 7.078 -8.359 -1.498 655 HZ3 LYS 82 HZ3 LYS 82 7.093 -9.911 -0.814 656 H LYS 83 HN LYS 83 3.634 -2.902 -4.164 657 HA LYS 83 HA LYS 83 0.940 -2.607 -3.028 658 HB2 LYS 83 HB2 LYS 83 2.403 -1.597 -1.345 659 HB3 LYS 83 HB1 LYS 83 3.167 -0.602 -2.586 660 HG2 LYS 83 HG2 LYS 83 1.128 0.596 -3.001 661 HG3 LYS 83 HG1 LYS 83 0.195 -0.532 -2.016 662 HD2 LYS 83 HD2 LYS 83 1.177 0.245 0.003 663 HD3 LYS 83 HD1 LYS 83 2.472 1.079 -0.855 664 HE2 LYS 83 HE2 LYS 83 0.956 2.738 -1.705 665 HE3 LYS 83 HE1 LYS 83 -0.447 1.825 -1.150 666 HZ1 LYS 83 HZ1 LYS 83 -0.185 2.523 0.954 667 HZ2 LYS 83 HZ2 LYS 83 1.512 2.490 0.883 668 HZ3 LYS 83 HZ3 LYS 83 0.663 3.806 0.234 669 H LYS 84 HN LYS 84 -0.407 -1.728 -4.444 670 HA LYS 84 HA LYS 84 0.706 -0.245 -6.762 671 HB2 LYS 84 HB2 LYS 84 -0.107 -2.594 -7.224 672 HB3 LYS 84 HB1 LYS 84 -1.716 -2.046 -6.767 673 HG2 LYS 84 HG2 LYS 84 -1.573 -0.284 -8.530 674 HG3 LYS 84 HG1 LYS 84 -0.020 -0.952 -9.016 675 HD2 LYS 84 HD2 LYS 84 -1.554 -1.978 -10.493 676 HD3 LYS 84 HD1 LYS 84 -1.251 -3.202 -9.263 677 HE2 LYS 84 HE2 LYS 84 -3.335 -2.833 -8.210 678 HE3 LYS 84 HE1 LYS 84 -3.558 -1.270 -8.995 679 HZ1 LYS 84 HZ1 LYS 84 -4.909 -3.073 -9.966 680 HZ2 LYS 84 HZ2 LYS 84 -3.861 -2.345 -11.088 681 HZ3 LYS 84 HZ3 LYS 84 -3.478 -3.862 -10.435 682 H VAL 85 HN VAL 85 -0.184 1.645 -7.305 683 HA VAL 85 HA VAL 85 -2.793 2.332 -6.122 684 HB VAL 85 HB VAL 85 -2.085 4.271 -5.145 685 HG11 VAL 85 HG11 VAL 85 -0.905 2.256 -4.188 686 HG12 VAL 85 HG12 VAL 85 0.528 2.779 -5.072 687 HG13 VAL 85 HG13 VAL 85 -0.160 3.810 -3.818 688 HG21 VAL 85 HG21 VAL 85 0.269 5.304 -5.726 689 HG22 VAL 85 HG22 VAL 85 0.113 4.382 -7.216 690 HG23 VAL 85 HG23 VAL 85 -1.085 5.613 -6.811 691 H GLU 86 HN GLU 86 -4.174 3.008 -7.546 692 HA GLU 86 HA GLU 86 -3.204 4.015 -10.167 693 HB2 GLU 86 HB2 GLU 86 -5.250 2.962 -11.118 694 HB3 GLU 86 HB1 GLU 86 -4.147 1.788 -10.404 695 HG2 GLU 86 HG2 GLU 86 -5.511 1.941 -8.279 696 HG3 GLU 86 HG1 GLU 86 -6.685 2.894 -9.187 697 H VAL 87 HN VAL 87 -4.061 5.834 -10.948 698 HA VAL 87 HA VAL 87 -5.502 7.583 -9.284 699 HB VAL 87 HB VAL 87 -4.258 8.613 -10.978 700 HG11 VAL 87 HG11 VAL 87 -3.830 6.812 -12.458 701 HG12 VAL 87 HG12 VAL 87 -5.543 6.583 -12.807 702 HG13 VAL 87 HG13 VAL 87 -4.696 7.998 -13.433 703 HG21 VAL 87 HG21 VAL 87 -6.898 8.719 -12.413 704 HG22 VAL 87 HG22 VAL 87 -6.816 9.320 -10.759 705 HG23 VAL 87 HG23 VAL 87 -5.794 10.031 -12.007 706 H LEU 88 HN LEU 88 -7.355 6.704 -8.486 707 HA LEU 88 HA LEU 88 -9.434 5.703 -10.282 708 HB2 LEU 88 HB2 LEU 88 -8.733 4.948 -7.776 709 HB3 LEU 88 HB1 LEU 88 -9.960 6.141 -7.370 710 HG LEU 88 HG LEU 88 -11.005 3.954 -7.538 711 HD11 LEU 88 HD11 LEU 88 -12.786 4.505 -8.998 712 HD12 LEU 88 HD12 LEU 88 -12.127 6.057 -8.483 713 HD13 LEU 88 HD13 LEU 88 -11.731 5.414 -10.079 714 HD21 LEU 88 HD21 LEU 88 -9.117 3.299 -9.367 715 HD22 LEU 88 HD22 LEU 88 -10.641 2.430 -9.216 716 HD23 LEU 88 HD23 LEU 88 -10.453 3.664 -10.459 717 H ASP 89 HN ASP 89 -8.375 8.520 -8.782 718 HA ASP 89 HA ASP 89 -10.101 10.284 -10.051 719 HB2 ASP 89 HB2 ASP 89 -11.555 9.137 -8.070 720 HB3 ASP 89 HB1 ASP 89 -10.761 10.401 -7.138 721 H THR 90 HN THR 90 -8.730 11.992 -10.216 722 HA THR 90 HA THR 90 -7.205 12.811 -7.865 723 HB THR 90 HB THR 90 -6.019 11.029 -9.428 724 HG1 THR 90 HG1 THR 90 -4.070 11.847 -8.718 725 HG21 THR 90 HG21 THR 90 -5.230 13.635 -10.755 726 HG22 THR 90 HG22 THR 90 -4.664 12.016 -11.164 727 HG23 THR 90 HG23 THR 90 -6.342 12.464 -11.464 728 H ASP 91 HN ASP 91 -7.302 14.907 -7.663 729 HA ASP 91 HA ASP 91 -8.217 16.581 -9.870 730 HB2 ASP 91 HB2 ASP 91 -9.013 16.857 -7.483 731 HB3 ASP 91 HB1 ASP 91 -7.393 17.434 -7.094 732 H TYR 92 HN TYR 92 -5.329 15.791 -8.132 733 HA TYR 92 HA TYR 92 -3.130 16.316 -8.442 734 HB2 TYR 92 HB2 TYR 92 -4.374 16.419 -11.072 735 HB3 TYR 92 HB1 TYR 92 -3.038 17.557 -10.978 736 HD1 TYR 92 HD2 TYR 92 -3.511 14.222 -9.316 737 HD2 TYR 92 HD1 TYR 92 -1.250 16.566 -12.120 738 HE1 TYR 92 HE2 TYR 92 -1.905 12.356 -9.585 739 HE2 TYR 92 HE1 TYR 92 0.351 14.694 -12.388 740 HH TYR 92 HH TYR 92 1.057 12.643 -10.761 741 H LYS 93 HN LYS 93 -5.255 18.513 -7.587 742 HA LYS 93 HA LYS 93 -3.256 20.608 -7.447 743 HB2 LYS 93 HB2 LYS 93 -5.868 20.927 -8.934 744 HB3 LYS 93 HB1 LYS 93 -4.926 22.292 -8.336 745 HG2 LYS 93 HG2 LYS 93 -2.942 21.288 -9.626 746 HG3 LYS 93 HG1 LYS 93 -4.127 20.251 -10.418 747 HD2 LYS 93 HD2 LYS 93 -4.236 23.281 -10.369 748 HD3 LYS 93 HD1 LYS 93 -3.665 22.315 -11.728 749 HE2 LYS 93 HE2 LYS 93 -5.910 22.725 -12.287 750 HE3 LYS 93 HE1 LYS 93 -5.979 21.122 -11.555 751 HZ1 LYS 93 HZ1 LYS 93 -7.410 23.317 -10.784 752 HZ2 LYS 93 HZ2 LYS 93 -7.211 21.886 -9.890 753 HZ3 LYS 93 HZ3 LYS 93 -6.184 23.206 -9.613 754 H SER 94 HN SER 94 -6.405 19.285 -6.625 755 HA SER 94 HA SER 94 -6.464 21.010 -4.208 756 HB2 SER 94 HB2 SER 94 -8.894 19.745 -5.456 757 HB3 SER 94 HB1 SER 94 -8.815 21.075 -4.305 758 HG SER 94 HG SER 94 -9.013 21.334 -6.834 759 H TYR 95 HN TYR 95 -7.829 17.895 -5.360 760 HA TYR 95 HA TYR 95 -6.742 16.518 -3.039 761 HB2 TYR 95 HB2 TYR 95 -9.035 15.658 -2.402 762 HB3 TYR 95 HB1 TYR 95 -8.742 17.354 -2.015 763 HD1 TYR 95 HD2 TYR 95 -10.342 15.063 -4.468 764 HD2 TYR 95 HD1 TYR 95 -10.004 19.102 -3.048 765 HE1 TYR 95 HE2 TYR 95 -12.281 15.718 -5.868 766 HE2 TYR 95 HE1 TYR 95 -11.943 19.757 -4.448 767 HH TYR 95 HH TYR 95 -13.446 19.091 -5.932 768 H ALA 96 HN ALA 96 -7.103 14.151 -3.186 769 HA ALA 96 HA ALA 96 -8.087 13.197 -5.774 770 HB1 ALA 96 HB1 ALA 96 -5.243 12.795 -4.828 771 HB2 ALA 96 HB2 ALA 96 -5.761 13.670 -6.265 772 HB3 ALA 96 HB3 ALA 96 -5.978 11.922 -6.166 773 H VAL 97 HN VAL 97 -8.745 11.121 -5.809 774 HA VAL 97 HA VAL 97 -8.528 9.562 -3.286 775 HB VAL 97 HB VAL 97 -10.775 9.133 -5.241 776 HG11 VAL 97 HG11 VAL 97 -11.938 8.524 -3.102 777 HG12 VAL 97 HG12 VAL 97 -10.521 7.533 -3.439 778 HG13 VAL 97 HG13 VAL 97 -10.431 8.826 -2.245 779 HG21 VAL 97 HG21 VAL 97 -10.511 11.390 -3.252 780 HG22 VAL 97 HG22 VAL 97 -11.044 11.464 -4.930 781 HG23 VAL 97 HG23 VAL 97 -12.090 10.752 -3.703 782 H ILE 98 HN ILE 98 -7.312 7.769 -3.556 783 HA ILE 98 HA ILE 98 -7.148 6.609 -6.272 784 HB ILE 98 HB ILE 98 -4.889 6.700 -4.284 785 HG12 ILE 98 HG12 ILE 98 -5.504 8.714 -6.475 786 HG13 ILE 98 HG11 ILE 98 -5.666 9.025 -4.749 787 HG21 ILE 98 HG21 ILE 98 -4.973 5.152 -6.360 788 HG22 ILE 98 HG22 ILE 98 -4.761 6.632 -7.297 789 HG23 ILE 98 HG23 ILE 98 -3.532 6.142 -6.133 790 HD11 ILE 98 HD11 ILE 98 -3.207 8.757 -6.399 791 HD12 ILE 98 HD12 ILE 98 -3.542 9.841 -5.048 792 HD13 ILE 98 HD13 ILE 98 -3.147 8.151 -4.740 793 H TYR 99 HN TYR 99 -6.871 4.408 -6.416 794 HA TYR 99 HA TYR 99 -7.796 2.890 -4.077 795 HB2 TYR 99 HB2 TYR 99 -8.758 2.739 -6.497 796 HB3 TYR 99 HB1 TYR 99 -7.339 1.747 -6.828 797 HD1 TYR 99 HD1 TYR 99 -10.489 1.992 -4.935 798 HD2 TYR 99 HD2 TYR 99 -7.056 -0.444 -5.789 799 HE1 TYR 99 HE1 TYR 99 -11.623 0.038 -3.913 800 HE2 TYR 99 HE2 TYR 99 -8.190 -2.399 -4.767 801 HH TYR 99 HH TYR 99 -10.624 -2.264 -2.754 802 H ALA 100 HN ALA 100 -6.183 2.350 -2.777 803 HA ALA 100 HA ALA 100 -3.621 1.400 -3.901 804 HB1 ALA 100 HB1 ALA 100 -2.762 1.646 -1.590 805 HB2 ALA 100 HB2 ALA 100 -4.355 2.202 -1.075 806 HB3 ALA 100 HB3 ALA 100 -3.414 3.158 -2.222 807 H THR 101 HN THR 101 -2.906 -0.639 -3.628 808 HA THR 101 HA THR 101 -4.384 -2.449 -1.845 809 HB THR 101 HB THR 101 -5.468 -2.760 -3.988 810 HG1 THR 101 HG1 THR 101 -4.007 -4.626 -2.746 811 HG21 THR 101 HG21 THR 101 -2.748 -3.386 -5.150 812 HG22 THR 101 HG22 THR 101 -4.277 -3.227 -6.012 813 HG23 THR 101 HG23 THR 101 -3.515 -1.805 -5.301 814 H ARG 102 HN ARG 102 -3.091 -3.693 -0.727 815 HA ARG 102 HA ARG 102 -0.335 -4.201 -1.694 816 HB2 ARG 102 HB2 ARG 102 -0.431 -2.567 0.212 817 HB3 ARG 102 HB1 ARG 102 -1.192 -3.821 1.189 818 HG2 ARG 102 HG2 ARG 102 0.841 -5.283 0.597 819 HG3 ARG 102 HG1 ARG 102 1.595 -3.798 0.021 820 HD2 ARG 102 HD2 ARG 102 1.272 -2.764 2.230 821 HD3 ARG 102 HD1 ARG 102 0.495 -4.235 2.811 822 HE ARG 102 HE ARG 102 2.597 -5.225 2.986 823 HH11 ARG 102 HH21 ARG 102 2.726 -2.284 1.167 824 HH12 ARG 102 HH22 ARG 102 4.456 -2.224 1.124 825 HH21 ARG 102 HH11 ARG 102 4.866 -5.153 2.934 826 HH22 ARG 102 HH12 ARG 102 5.668 -3.849 2.125 827 H VAL 103 HN VAL 103 0.192 -6.346 -1.793 828 HA VAL 103 HA VAL 103 -1.643 -8.228 -0.420 829 HB VAL 103 HB VAL 103 -1.947 -8.273 -2.844 830 HG11 VAL 103 HG11 VAL 103 0.893 -9.227 -3.168 831 HG12 VAL 103 HG12 VAL 103 -0.205 -8.571 -4.381 832 HG13 VAL 103 HG13 VAL 103 0.535 -7.501 -3.192 833 HG21 VAL 103 HG21 VAL 103 -0.359 -10.696 -1.945 834 HG22 VAL 103 HG22 VAL 103 -2.027 -10.385 -1.465 835 HG23 VAL 103 HG23 VAL 103 -1.633 -10.649 -3.163 836 H LYS 104 HN LYS 104 -0.689 -9.212 1.205 837 HA LYS 104 HA LYS 104 2.217 -9.609 1.192 838 HB2 LYS 104 HB2 LYS 104 0.600 -8.752 3.186 839 HB3 LYS 104 HB1 LYS 104 0.539 -10.482 3.502 840 HG2 LYS 104 HG2 LYS 104 2.409 -9.862 4.754 841 HG3 LYS 104 HG1 LYS 104 3.162 -10.338 3.232 842 HD2 LYS 104 HD2 LYS 104 3.252 -8.003 2.507 843 HD3 LYS 104 HD1 LYS 104 2.396 -7.492 3.962 844 HE2 LYS 104 HE2 LYS 104 4.965 -7.265 3.969 845 HE3 LYS 104 HE1 LYS 104 4.221 -8.042 5.366 846 HZ1 LYS 104 HZ1 LYS 104 4.822 -10.150 4.602 847 HZ2 LYS 104 HZ2 LYS 104 5.173 -9.593 3.036 848 HZ3 LYS 104 HZ3 LYS 104 6.201 -9.198 4.325 849 H ASP 105 HN ASP 105 2.947 -11.791 2.084 850 HA ASP 105 HA ASP 105 2.113 -13.830 0.350 851 HB2 ASP 105 HB2 ASP 105 3.606 -13.971 2.976 852 HB3 ASP 105 HB1 ASP 105 3.399 -15.342 1.887 853 H GLY 106 HN GLY 106 0.089 -14.586 0.322 854 HA2 GLY 106 HA2 GLY 106 -1.561 -16.071 1.072 855 HA3 GLY 106 HA1 GLY 106 -0.934 -15.921 2.706 856 H ARG 107 HN ARG 107 -1.087 -12.809 1.963 857 HA ARG 107 HA ARG 107 -3.975 -12.549 2.611 858 HB2 ARG 107 HB2 ARG 107 -1.753 -10.804 3.681 859 HB3 ARG 107 HB1 ARG 107 -3.459 -10.750 4.125 860 HG2 ARG 107 HG2 ARG 107 -3.276 -13.091 4.969 861 HG3 ARG 107 HG1 ARG 107 -1.548 -13.054 4.616 862 HD2 ARG 107 HD2 ARG 107 -3.041 -11.271 6.559 863 HD3 ARG 107 HD1 ARG 107 -1.866 -12.518 6.963 864 HE ARG 107 HE ARG 107 -0.459 -10.851 5.335 865 HH11 ARG 107 HH21 ARG 107 -2.447 -10.412 8.133 866 HH12 ARG 107 HH22 ARG 107 -1.578 -9.026 8.703 867 HH21 ARG 107 HH11 ARG 107 0.686 -9.035 6.075 868 HH22 ARG 107 HH12 ARG 107 0.197 -8.246 7.537 869 H THR 108 HN THR 108 -5.125 -11.074 1.540 870 HA THR 108 HA THR 108 -3.731 -9.136 -0.212 871 HB THR 108 HB THR 108 -6.213 -10.700 -0.957 872 HG1 THR 108 HG1 THR 108 -3.775 -11.539 -0.911 873 HG21 THR 108 HG21 THR 108 -4.415 -8.841 -2.538 874 HG22 THR 108 HG22 THR 108 -5.802 -9.720 -3.182 875 HG23 THR 108 HG23 THR 108 -6.041 -8.460 -1.971 876 H LEU 109 HN LEU 109 -4.614 -7.104 -0.255 877 HA LEU 109 HA LEU 109 -7.299 -6.669 0.797 878 HB2 LEU 109 HB2 LEU 109 -6.783 -5.385 2.679 879 HB3 LEU 109 HB1 LEU 109 -5.706 -6.754 2.763 880 HG LEU 109 HG LEU 109 -4.108 -5.096 1.360 881 HD11 LEU 109 HD11 LEU 109 -6.154 -3.357 1.851 882 HD12 LEU 109 HD12 LEU 109 -5.169 -3.083 3.284 883 HD13 LEU 109 HD13 LEU 109 -4.476 -2.857 1.680 884 HD21 LEU 109 HD21 LEU 109 -3.007 -4.565 3.506 885 HD22 LEU 109 HD22 LEU 109 -4.463 -5.047 4.376 886 HD23 LEU 109 HD23 LEU 109 -3.538 -6.246 3.473 887 H HIS 110 HN HIS 110 -8.088 -4.594 0.627 888 HA HIS 110 HA HIS 110 -6.559 -2.815 -1.137 889 HB2 HIS 110 HB2 HIS 110 -8.857 -2.174 -2.113 890 HB3 HIS 110 HB1 HIS 110 -8.175 -3.723 -2.613 891 HD1 HIS 110 HD1 HIS 110 -9.171 -5.886 -1.455 892 HD2 HIS 110 HD2 HIS 110 -11.230 -2.359 -0.615 893 HE1 HIS 110 HE1 HIS 110 -11.392 -6.574 -0.452 894 H MET 111 HN MET 111 -7.189 -0.485 -0.949 895 HA MET 111 HA MET 111 -8.841 0.251 1.298 896 HB2 MET 111 HB2 MET 111 -7.118 1.297 2.615 897 HB3 MET 111 HB1 MET 111 -6.636 -0.374 2.334 898 HG2 MET 111 HG2 MET 111 -5.283 0.448 0.359 899 HG3 MET 111 HG1 MET 111 -5.621 2.093 0.899 900 HE1 MET 111 HE1 MET 111 -3.660 3.197 1.736 901 HE2 MET 111 HE2 MET 111 -2.223 2.364 2.317 902 HE3 MET 111 HE3 MET 111 -2.861 2.019 0.706 903 H MET 112 HN MET 112 -9.274 2.523 1.379 904 HA MET 112 HA MET 112 -8.651 3.910 -1.162 905 HB2 MET 112 HB2 MET 112 -10.563 5.085 0.811 906 HB3 MET 112 HB1 MET 112 -10.598 5.138 -0.941 907 HG2 MET 112 HG2 MET 112 -11.109 2.582 0.584 908 HG3 MET 112 HG1 MET 112 -12.394 3.734 0.235 909 HE1 MET 112 HE1 MET 112 -12.839 4.746 -1.793 910 HE2 MET 112 HE2 MET 112 -11.583 4.739 -3.029 911 HE3 MET 112 HE3 MET 112 -13.077 3.825 -3.275 912 H ARG 113 HN ARG 113 -7.558 5.847 -1.157 913 HA ARG 113 HA ARG 113 -6.708 6.903 1.480 914 HB2 ARG 113 HB2 ARG 113 -4.829 5.711 0.602 915 HB3 ARG 113 HB1 ARG 113 -5.054 6.408 -0.997 916 HG2 ARG 113 HG2 ARG 113 -4.708 8.382 1.207 917 HG3 ARG 113 HG1 ARG 113 -3.294 7.389 0.866 918 HD2 ARG 113 HD2 ARG 113 -3.711 8.025 -1.625 919 HD3 ARG 113 HD1 ARG 113 -4.728 9.306 -0.967 920 HE ARG 113 HE ARG 113 -2.346 9.488 0.410 921 HH11 ARG 113 HH21 ARG 113 -3.380 9.542 -2.891 922 HH12 ARG 113 HH22 ARG 113 -2.093 10.572 -3.421 923 HH21 ARG 113 HH11 ARG 113 -0.657 10.838 -0.274 924 HH22 ARG 113 HH12 ARG 113 -0.550 11.307 -1.939 925 H LEU 114 HN LEU 114 -7.059 9.006 1.756 926 HA LEU 114 HA LEU 114 -7.698 10.658 -0.613 927 HB2 LEU 114 HB2 LEU 114 -9.618 10.308 0.869 928 HB3 LEU 114 HB1 LEU 114 -8.672 10.863 2.234 929 HG LEU 114 HG LEU 114 -8.450 13.089 1.228 930 HD11 LEU 114 HD11 LEU 114 -8.435 12.794 -1.094 931 HD12 LEU 114 HD12 LEU 114 -9.834 11.722 -1.067 932 HD13 LEU 114 HD13 LEU 114 -10.046 13.456 -0.828 933 HD21 LEU 114 HD21 LEU 114 -10.408 12.645 2.652 934 HD22 LEU 114 HD22 LEU 114 -10.836 13.759 1.353 935 HD23 LEU 114 HD23 LEU 114 -11.309 12.063 1.251 936 H TYR 115 HN TYR 115 -6.377 12.269 -1.009 937 HA TYR 115 HA TYR 115 -4.622 13.257 1.149 938 HB2 TYR 115 HB2 TYR 115 -2.814 12.840 -0.163 939 HB3 TYR 115 HB1 TYR 115 -3.897 11.949 -1.219 940 HD1 TYR 115 HD1 TYR 115 -5.437 13.686 -2.719 941 HD2 TYR 115 HD2 TYR 115 -1.458 14.392 -1.268 942 HE1 TYR 115 HE1 TYR 115 -5.068 15.338 -4.532 943 HE2 TYR 115 HE2 TYR 115 -1.094 16.049 -3.079 944 HH TYR 115 HH TYR 115 -3.635 17.275 -4.987 945 H SER 116 HN SER 116 -3.901 15.462 0.927 946 HA SER 116 HA SER 116 -5.769 17.202 -0.586 947 HB2 SER 116 HB2 SER 116 -6.361 17.347 1.769 948 HB3 SER 116 HB1 SER 116 -4.676 17.610 2.212 949 HG SER 116 HG SER 116 -6.268 19.282 0.552 950 H ARG 117 HN ARG 117 -4.853 19.092 -1.487 951 HA ARG 117 HA ARG 117 -2.037 18.898 -2.057 952 HB2 ARG 117 HB2 ARG 117 -3.625 19.634 -3.766 953 HB3 ARG 117 HB1 ARG 117 -4.095 21.000 -2.772 954 HG2 ARG 117 HG2 ARG 117 -2.456 21.640 -4.537 955 HG3 ARG 117 HG1 ARG 117 -1.841 21.936 -2.914 956 HD2 ARG 117 HD2 ARG 117 -0.360 20.118 -3.007 957 HD3 ARG 117 HD1 ARG 117 -1.263 19.321 -4.294 958 HE ARG 117 HE ARG 117 -0.003 20.533 -5.809 959 HH11 ARG 117 HH21 ARG 117 0.012 22.068 -2.708 960 HH12 ARG 117 HH22 ARG 117 1.154 23.289 -3.163 961 HH21 ARG 117 HH11 ARG 117 1.500 22.129 -6.411 962 HH22 ARG 117 HH12 ARG 117 1.997 23.322 -5.259 963 H SER 118 HN SER 118 -4.073 20.572 0.136 964 HA SER 118 HA SER 118 -1.759 22.100 1.173 965 HB2 SER 118 HB2 SER 118 -3.299 23.621 0.018 966 HB3 SER 118 HB1 SER 118 -4.640 23.016 0.986 967 HG SER 118 HG SER 118 -3.196 23.667 2.829 968 HA PRO 119 HA PRO 119 -2.238 20.127 5.108 969 HB2 PRO 119 HB2 PRO 119 -2.592 22.948 6.090 970 HB3 PRO 119 HB1 PRO 119 -1.594 21.643 6.763 971 HG2 PRO 119 HG2 PRO 119 -0.554 23.611 5.252 972 HG3 PRO 119 HG1 PRO 119 0.090 21.960 5.241 973 HD2 PRO 119 HD2 PRO 119 -1.371 23.385 3.115 974 HD3 PRO 119 HD1 PRO 119 -0.405 21.899 3.009 975 H GLU 120 HN GLU 120 -4.548 22.463 3.922 976 HA GLU 120 HA GLU 120 -6.607 21.650 5.830 977 HB2 GLU 120 HB2 GLU 120 -6.877 23.587 3.533 978 HB3 GLU 120 HB1 GLU 120 -7.893 23.460 4.969 979 HG2 GLU 120 HG2 GLU 120 -5.944 24.097 6.376 980 HG3 GLU 120 HG1 GLU 120 -4.980 24.300 4.914 981 H VAL 121 HN VAL 121 -8.695 21.001 5.042 982 HA VAL 121 HA VAL 121 -8.562 19.437 2.525 983 HB VAL 121 HB VAL 121 -10.223 18.808 4.974 984 HG11 VAL 121 HG11 VAL 121 -9.597 17.344 2.396 985 HG12 VAL 121 HG12 VAL 121 -10.334 16.566 3.797 986 HG13 VAL 121 HG13 VAL 121 -11.179 17.875 2.969 987 HG21 VAL 121 HG21 VAL 121 -8.515 16.898 5.162 988 HG22 VAL 121 HG22 VAL 121 -7.501 17.842 4.070 989 HG23 VAL 121 HG23 VAL 121 -7.954 18.499 5.644 990 H SER 122 HN SER 122 -10.092 19.802 1.031 991 HA SER 122 HA SER 122 -11.996 21.936 1.486 992 HB2 SER 122 HB2 SER 122 -12.321 21.937 -0.842 993 HB3 SER 122 HB1 SER 122 -10.622 21.515 -0.649 994 HG SER 122 HG SER 122 -12.347 20.168 -1.976 995 HA PRO 123 HA PRO 123 -15.293 19.223 2.937 996 HB2 PRO 123 HB2 PRO 123 -16.921 21.209 1.376 997 HB3 PRO 123 HB1 PRO 123 -17.205 20.552 3.001 998 HG2 PRO 123 HG2 PRO 123 -16.188 22.992 2.646 999 HG3 PRO 123 HG1 PRO 123 -15.667 21.952 3.983 1000 HD2 PRO 123 HD2 PRO 123 -14.182 22.719 1.524 1001 HD3 PRO 123 HD1 PRO 123 -13.559 22.189 3.103 1002 H ALA 124 HN ALA 124 -14.838 20.229 -0.389 1003 HA ALA 124 HA ALA 124 -16.692 18.360 -1.538 1004 HB1 ALA 124 HB1 ALA 124 -14.368 19.816 -2.822 1005 HB2 ALA 124 HB2 ALA 124 -16.014 20.436 -2.697 1006 HB3 ALA 124 HB3 ALA 124 -15.684 19.004 -3.671 1007 H ALA 125 HN ALA 125 -13.292 18.332 -0.691 1008 HA ALA 125 HA ALA 125 -12.536 16.031 -2.165 1009 HB1 ALA 125 HB1 ALA 125 -11.375 17.098 0.420 1010 HB2 ALA 125 HB2 ALA 125 -10.917 17.633 -1.196 1011 HB3 ALA 125 HB3 ALA 125 -10.587 15.976 -0.690 1012 H THR 126 HN THR 126 -13.749 16.492 1.122 1013 HA THR 126 HA THR 126 -13.568 13.705 1.799 1014 HB THR 126 HB THR 126 -15.352 15.638 3.250 1015 HG1 THR 126 HG1 THR 126 -13.068 16.382 2.635 1016 HG21 THR 126 HG21 THR 126 -15.339 13.387 4.122 1017 HG22 THR 126 HG22 THR 126 -13.580 13.308 4.043 1018 HG23 THR 126 HG23 THR 126 -14.362 14.370 5.212 1019 H ALA 127 HN ALA 127 -16.057 15.806 0.416 1020 HA ALA 127 HA ALA 127 -18.199 13.959 0.804 1021 HB1 ALA 127 HB1 ALA 127 -19.473 15.488 -0.501 1022 HB2 ALA 127 HB2 ALA 127 -18.015 16.203 -1.191 1023 HB3 ALA 127 HB3 ALA 127 -18.394 16.445 0.514 1024 H ILE 128 HN ILE 128 -16.205 14.850 -2.052 1025 HA ILE 128 HA ILE 128 -17.495 13.127 -3.871 1026 HB ILE 128 HB ILE 128 -15.680 15.005 -4.198 1027 HG12 ILE 128 HG12 ILE 128 -16.755 13.885 -6.054 1028 HG13 ILE 128 HG11 ILE 128 -15.026 13.986 -6.356 1029 HG21 ILE 128 HG21 ILE 128 -13.879 12.573 -4.137 1030 HG22 ILE 128 HG22 ILE 128 -13.415 14.246 -4.443 1031 HG23 ILE 128 HG23 ILE 128 -13.960 13.763 -2.839 1032 HD11 ILE 128 HD11 ILE 128 -16.671 11.583 -5.619 1033 HD12 ILE 128 HD12 ILE 128 -15.504 11.762 -6.924 1034 HD13 ILE 128 HD13 ILE 128 -14.946 11.607 -5.260 1035 H PHE 129 HN PHE 129 -14.923 12.797 -1.606 1036 HA PHE 129 HA PHE 129 -13.937 10.252 -2.049 1037 HB2 PHE 129 HB2 PHE 129 -13.064 11.774 -0.329 1038 HB3 PHE 129 HB1 PHE 129 -14.522 11.519 0.623 1039 HD1 PHE 129 HD1 PHE 129 -15.035 9.323 1.610 1040 HD2 PHE 129 HD2 PHE 129 -11.381 10.047 -0.515 1041 HE1 PHE 129 HE1 PHE 129 -14.081 7.237 2.549 1042 HE2 PHE 129 HE2 PHE 129 -10.415 7.964 0.433 1043 HZ PHE 129 HZ PHE 129 -11.771 6.566 1.968 1044 H ARG 130 HN ARG 130 -16.825 11.237 -0.247 1045 HA ARG 130 HA ARG 130 -17.565 8.621 0.600 1046 HB2 ARG 130 HB2 ARG 130 -18.388 10.489 1.839 1047 HB3 ARG 130 HB1 ARG 130 -19.097 11.214 0.398 1048 HG2 ARG 130 HG2 ARG 130 -20.791 9.557 0.259 1049 HG3 ARG 130 HG1 ARG 130 -19.950 8.488 1.380 1050 HD2 ARG 130 HD2 ARG 130 -20.293 10.153 3.191 1051 HD3 ARG 130 HD1 ARG 130 -21.187 11.170 2.065 1052 HE ARG 130 HE ARG 130 -22.257 8.504 2.220 1053 HH11 ARG 130 HH21 ARG 130 -22.126 11.621 3.719 1054 HH12 ARG 130 HH22 ARG 130 -23.668 11.466 4.493 1055 HH21 ARG 130 HH11 ARG 130 -24.280 8.293 3.231 1056 HH22 ARG 130 HH12 ARG 130 -24.888 9.582 4.216 1057 H LYS 131 HN LYS 131 -18.487 10.601 -2.211 1058 HA LYS 131 HA LYS 131 -20.664 9.197 -3.137 1059 HB2 LYS 131 HB2 LYS 131 -19.672 11.272 -4.150 1060 HB3 LYS 131 HB1 LYS 131 -18.455 10.249 -4.909 1061 HG2 LYS 131 HG2 LYS 131 -20.258 8.946 -6.011 1062 HG3 LYS 131 HG1 LYS 131 -21.455 10.026 -5.291 1063 HD2 LYS 131 HD2 LYS 131 -20.363 11.950 -6.441 1064 HD3 LYS 131 HD1 LYS 131 -19.257 10.819 -7.224 1065 HE2 LYS 131 HE2 LYS 131 -21.121 11.340 -8.729 1066 HE3 LYS 131 HE1 LYS 131 -21.201 9.649 -8.234 1067 HZ1 LYS 131 HZ1 LYS 131 -23.225 11.423 -8.037 1068 HZ2 LYS 131 HZ2 LYS 131 -23.105 9.982 -7.145 1069 HZ3 LYS 131 HZ3 LYS 131 -22.585 11.446 -6.463 1070 H LEU 132 HN LEU 132 -17.296 8.579 -4.206 1071 HA LEU 132 HA LEU 132 -17.948 6.183 -5.565 1072 HB2 LEU 132 HB2 LEU 132 -15.453 5.717 -5.360 1073 HB3 LEU 132 HB1 LEU 132 -15.908 7.210 -6.170 1074 HG LEU 132 HG LEU 132 -15.727 7.942 -3.455 1075 HD11 LEU 132 HD11 LEU 132 -13.243 6.372 -4.143 1076 HD12 LEU 132 HD12 LEU 132 -13.700 7.080 -2.593 1077 HD13 LEU 132 HD13 LEU 132 -14.559 5.667 -3.204 1078 HD21 LEU 132 HD21 LEU 132 -14.985 9.207 -5.510 1079 HD22 LEU 132 HD22 LEU 132 -13.841 9.270 -4.173 1080 HD23 LEU 132 HD23 LEU 132 -13.539 8.197 -5.538 1081 H ALA 133 HN ALA 133 -16.828 6.821 -2.271 1082 HA ALA 133 HA ALA 133 -16.417 4.165 -1.471 1083 HB1 ALA 133 HB1 ALA 133 -16.448 4.957 0.743 1084 HB2 ALA 133 HB2 ALA 133 -17.530 6.291 0.344 1085 HB3 ALA 133 HB3 ALA 133 -15.856 6.318 -0.204 1086 H GLY 134 HN GLY 134 -19.375 6.137 -1.600 1087 HA2 GLY 134 HA2 GLY 134 -21.061 4.306 -0.250 1088 HA3 GLY 134 HA1 GLY 134 -21.584 5.557 -1.377 1089 H GLU 135 HN GLU 135 -20.053 4.707 -3.599 1090 HA GLU 135 HA GLU 135 -21.794 2.789 -4.746 1091 HB2 GLU 135 HB2 GLU 135 -20.530 4.492 -6.055 1092 HB3 GLU 135 HB1 GLU 135 -19.037 3.631 -5.689 1093 HG2 GLU 135 HG2 GLU 135 -21.349 2.161 -6.943 1094 HG3 GLU 135 HG1 GLU 135 -20.279 3.136 -7.946 1095 H ARG 136 HN ARG 136 -19.079 2.535 -2.686 1096 HA ARG 136 HA ARG 136 -18.562 -0.264 -3.448 1097 HB2 ARG 136 HB2 ARG 136 -16.707 1.524 -3.056 1098 HB3 ARG 136 HB1 ARG 136 -17.056 1.282 -1.346 1099 HG2 ARG 136 HG2 ARG 136 -16.600 -1.120 -1.567 1100 HG3 ARG 136 HG1 ARG 136 -16.320 -0.922 -3.297 1101 HD2 ARG 136 HD2 ARG 136 -14.438 0.605 -2.812 1102 HD3 ARG 136 HD1 ARG 136 -14.710 0.386 -1.085 1103 HE ARG 136 HE ARG 136 -13.581 -1.627 -1.243 1104 HH11 ARG 136 HH21 ARG 136 -14.759 -0.644 -4.346 1105 HH12 ARG 136 HH22 ARG 136 -13.996 -1.943 -5.200 1106 HH21 ARG 136 HH11 ARG 136 -12.577 -3.332 -2.356 1107 HH22 ARG 136 HH12 ARG 136 -12.760 -3.465 -4.074 1108 H ASN 137 HN ASN 137 -20.773 1.227 -1.725 1109 HA ASN 137 HA ASN 137 -22.112 0.705 0.084 1110 HB2 ASN 137 HB2 ASN 137 -20.810 -1.966 -0.265 1111 HB3 ASN 137 HB1 ASN 137 -22.330 -1.666 0.568 1112 HD21 ASN 137 HD21 ASN 137 -20.974 -2.435 -2.474 1113 HD22 ASN 137 HD22 ASN 137 -22.348 -2.127 -3.417 1114 H TYR 138 HN TYR 138 -19.560 1.797 0.724 1115 HA TYR 138 HA TYR 138 -18.527 0.310 3.008 1116 HB2 TYR 138 HB2 TYR 138 -16.736 1.772 2.969 1117 HB3 TYR 138 HB1 TYR 138 -17.250 1.883 1.286 1118 HD1 TYR 138 HD1 TYR 138 -19.672 3.524 1.436 1119 HD2 TYR 138 HD2 TYR 138 -15.966 3.913 3.567 1120 HE1 TYR 138 HE1 TYR 138 -20.107 5.945 1.747 1121 HE2 TYR 138 HE2 TYR 138 -16.403 6.326 3.871 1122 HH TYR 138 HH TYR 138 -18.625 7.802 3.950 1123 H THR 139 HN THR 139 -18.205 1.563 5.102 1124 HA THR 139 HA THR 139 -20.599 3.202 5.736 1125 HB THR 139 HB THR 139 -21.074 1.949 7.579 1126 HG1 THR 139 HG1 THR 139 -19.600 1.525 9.060 1127 HG21 THR 139 HG21 THR 139 -20.545 0.292 5.612 1128 HG22 THR 139 HG22 THR 139 -19.152 -0.146 6.597 1129 HG23 THR 139 HG23 THR 139 -20.779 -0.346 7.238 1130 H ASP 140 HN ASP 140 -20.277 4.857 7.359 1131 HA ASP 140 HA ASP 140 -18.099 6.452 7.033 1132 HB2 ASP 140 HB2 ASP 140 -20.195 7.038 8.280 1133 HB3 ASP 140 HB1 ASP 140 -19.543 6.176 9.673 1134 H GLU 141 HN GLU 141 -18.401 4.104 9.768 1135 HA GLU 141 HA GLU 141 -15.948 4.615 10.923 1136 HB2 GLU 141 HB2 GLU 141 -17.792 3.082 11.761 1137 HB3 GLU 141 HB1 GLU 141 -17.138 1.852 10.680 1138 HG2 GLU 141 HG2 GLU 141 -14.949 2.022 11.788 1139 HG3 GLU 141 HG1 GLU 141 -15.578 3.275 12.856 1140 H MET 142 HN MET 142 -16.591 3.145 7.882 1141 HA MET 142 HA MET 142 -14.132 1.659 7.717 1142 HB2 MET 142 HB2 MET 142 -15.881 2.537 5.423 1143 HB3 MET 142 HB1 MET 142 -14.761 1.182 5.471 1144 HG2 MET 142 HG2 MET 142 -16.305 0.511 7.582 1145 HG3 MET 142 HG1 MET 142 -17.486 1.420 6.652 1146 HE1 MET 142 HE1 MET 142 -15.278 -2.363 5.884 1147 HE2 MET 142 HE2 MET 142 -14.522 -1.081 4.944 1148 HE3 MET 142 HE3 MET 142 -14.737 -0.895 6.689 1149 H VAL 143 HN VAL 143 -14.952 4.916 7.412 1150 HA VAL 143 HA VAL 143 -12.337 5.482 6.119 1151 HB VAL 143 HB VAL 143 -14.225 6.035 4.575 1152 HG11 VAL 143 HG11 VAL 143 -15.637 7.991 5.113 1153 HG12 VAL 143 HG12 VAL 143 -15.903 6.683 6.264 1154 HG13 VAL 143 HG13 VAL 143 -14.925 8.079 6.711 1155 HG21 VAL 143 HG21 VAL 143 -12.285 7.281 4.128 1156 HG22 VAL 143 HG22 VAL 143 -13.484 8.548 4.365 1157 HG23 VAL 143 HG23 VAL 143 -12.358 8.143 5.657 1158 H ALA 144 HN ALA 144 -10.991 6.651 7.332 1159 HA ALA 144 HA ALA 144 -12.162 8.165 9.608 1160 HB1 ALA 144 HB1 ALA 144 -9.823 7.697 10.631 1161 HB2 ALA 144 HB2 ALA 144 -9.715 6.436 9.402 1162 HB3 ALA 144 HB3 ALA 144 -11.009 6.390 10.598 1163 H MET 145 HN MET 145 -11.934 10.294 9.454 1164 HA MET 145 HA MET 145 -10.064 11.527 7.698 1165 HB2 MET 145 HB2 MET 145 -12.206 12.491 7.717 1166 HB3 MET 145 HB1 MET 145 -12.384 12.288 9.453 1167 HG2 MET 145 HG2 MET 145 -11.398 14.265 9.900 1168 HG3 MET 145 HG1 MET 145 -10.135 13.970 8.728 1169 HE1 MET 145 HE1 MET 145 -10.462 13.798 6.410 1170 HE2 MET 145 HE2 MET 145 -12.099 13.725 5.768 1171 HE3 MET 145 HE3 MET 145 -11.104 15.159 5.497 1172 H LEU 146 HN LEU 146 -8.309 12.862 8.459 1173 HA LEU 146 HA LEU 146 -7.605 12.455 11.264 1174 HB2 LEU 146 HB2 LEU 146 -6.382 11.432 9.029 1175 HB3 LEU 146 HB1 LEU 146 -5.456 12.904 9.283 1176 HG LEU 146 HG LEU 146 -4.915 12.240 11.495 1177 HD11 LEU 146 HD11 LEU 146 -6.508 11.030 12.601 1178 HD12 LEU 146 HD12 LEU 146 -7.063 10.250 11.119 1179 HD13 LEU 146 HD13 LEU 146 -5.634 9.651 11.957 1180 HD21 LEU 146 HD21 LEU 146 -3.653 11.277 9.534 1181 HD22 LEU 146 HD22 LEU 146 -3.503 10.378 11.043 1182 HD23 LEU 146 HD23 LEU 146 -4.579 9.799 9.782 1183 HA PRO 147 HA PRO 147 -7.536 16.918 11.520 1184 HB2 PRO 147 HB2 PRO 147 -6.087 17.211 13.817 1185 HB3 PRO 147 HB1 PRO 147 -7.766 16.629 13.809 1186 HG2 PRO 147 HG2 PRO 147 -5.225 15.046 13.928 1187 HG3 PRO 147 HG1 PRO 147 -6.693 14.883 14.912 1188 HD2 PRO 147 HD2 PRO 147 -6.224 13.260 12.837 1189 HD3 PRO 147 HD1 PRO 147 -7.870 13.793 13.218 1190 H ARG 148 HN ARG 148 -6.110 18.719 11.302 1191 HA ARG 148 HA ARG 148 -3.893 18.351 9.637 1192 HB2 ARG 148 HB2 ARG 148 -4.648 20.718 11.359 1193 HB3 ARG 148 HB1 ARG 148 -3.425 20.751 10.088 1194 HG2 ARG 148 HG2 ARG 148 -5.193 19.947 8.477 1195 HG3 ARG 148 HG1 ARG 148 -6.381 20.176 9.761 1196 HD2 ARG 148 HD2 ARG 148 -4.591 22.312 8.572 1197 HD3 ARG 148 HD1 ARG 148 -6.329 22.159 8.337 1198 HE ARG 148 HE ARG 148 -5.548 22.382 11.113 1199 HH11 ARG 148 HH21 ARG 148 -6.332 24.036 8.177 1200 HH12 ARG 148 HH22 ARG 148 -6.834 25.492 8.969 1201 HH21 ARG 148 HH11 ARG 148 -6.206 24.288 12.159 1202 HH22 ARG 148 HH12 ARG 148 -6.764 25.635 11.224 1203 H GLN 149 HN GLN 149 -4.090 18.178 13.085 1204 HA GLN 149 HA GLN 149 -1.696 18.991 14.065 1205 HB2 GLN 149 HB2 GLN 149 -3.028 16.332 14.633 1206 HB3 GLN 149 HB1 GLN 149 -1.781 17.075 15.635 1207 HG2 GLN 149 HG2 GLN 149 -4.407 18.420 14.949 1208 HG3 GLN 149 HG1 GLN 149 -4.133 17.509 16.433 1209 HE21 GLN 149 HE21 GLN 149 -1.815 18.279 17.474 1210 HE22 GLN 149 HE22 GLN 149 -1.678 19.964 17.621 1211 H GLU 150 HN GLU 150 0.424 18.494 13.880 1212 HA GLU 150 HA GLU 150 1.190 16.085 12.328 1213 HB2 GLU 150 HB2 GLU 150 2.873 17.380 11.154 1214 HB3 GLU 150 HB1 GLU 150 1.293 18.125 10.909 1215 HG2 GLU 150 HG2 GLU 150 1.826 19.648 12.868 1216 HG3 GLU 150 HG1 GLU 150 3.473 19.020 12.808 1217 H GLU 151 HN GLU 151 3.038 15.044 12.974 1218 HA GLU 151 HA GLU 151 4.477 16.153 15.320 1219 HB2 GLU 151 HB2 GLU 151 3.718 13.261 14.813 1220 HB3 GLU 151 HB1 GLU 151 4.710 13.839 16.151 1221 HG2 GLU 151 HG2 GLU 151 1.877 14.773 15.618 1222 HG3 GLU 151 HG1 GLU 151 2.297 13.502 16.765 1223 H CYS 152 HN CYS 152 4.499 14.263 12.380 1224 HA CYS 152 HA CYS 152 7.446 14.537 12.231 1225 HB2 CYS 152 HB2 CYS 152 5.735 12.194 11.368 1226 HB3 CYS 152 HB1 CYS 152 7.437 12.385 10.969 1227 H THR 153 HN THR 153 8.269 15.017 10.182 1228 HA THR 153 HA THR 153 6.397 15.321 7.946 1229 HB THR 153 HB THR 153 6.878 17.639 7.584 1230 HG1 THR 153 HG1 THR 153 8.736 17.262 9.683 1231 HG21 THR 153 HG21 THR 153 5.911 18.659 9.553 1232 HG22 THR 153 HG22 THR 153 5.179 17.069 9.357 1233 HG23 THR 153 HG23 THR 153 6.437 17.315 10.566 1234 H VAL 154 HN VAL 154 7.495 15.656 5.892 1235 HA VAL 154 HA VAL 154 9.882 14.151 5.668 1236 HB VAL 154 HB VAL 154 9.654 14.485 3.337 1237 HG11 VAL 154 HG11 VAL 154 7.228 14.090 2.918 1238 HG12 VAL 154 HG12 VAL 154 7.869 13.100 4.228 1239 HG13 VAL 154 HG13 VAL 154 6.900 14.529 4.593 1240 HG21 VAL 154 HG21 VAL 154 7.971 16.265 2.508 1241 HG22 VAL 154 HG22 VAL 154 8.108 16.950 4.126 1242 HG23 VAL 154 HG23 VAL 154 9.532 16.836 3.094 1243 H ASP 155 HN ASP 155 11.815 14.953 4.634 1244 HA ASP 155 HA ASP 155 12.736 17.383 5.876 1245 HB2 ASP 155 HB2 ASP 155 14.303 15.580 5.727 1246 HB3 ASP 155 HB1 ASP 155 14.110 15.479 3.984 1247 H GLU 156 HN GLU 156 13.946 18.945 4.633 1248 HA GLU 156 HA GLU 156 12.277 20.234 2.731 1249 HB2 GLU 156 HB2 GLU 156 14.079 21.879 2.547 1250 HB3 GLU 156 HB1 GLU 156 13.801 21.461 4.238 1251 HG2 GLU 156 HG2 GLU 156 15.667 19.783 4.055 1252 HG3 GLU 156 HG1 GLU 156 16.006 20.413 2.444 1253 H VAL 157 HN VAL 157 14.782 17.882 2.429 1254 HA VAL 157 HA VAL 157 15.919 18.313 -0.022 1255 HB VAL 157 HB VAL 157 16.359 16.355 1.470 1256 HG11 VAL 157 HG11 VAL 157 13.975 15.084 0.113 1257 HG12 VAL 157 HG12 VAL 157 14.909 14.469 1.477 1258 HG13 VAL 157 HG13 VAL 157 13.844 15.858 1.691 1259 HG21 VAL 157 HG21 VAL 157 16.891 14.837 -0.345 1260 HG22 VAL 157 HG22 VAL 157 15.672 15.580 -1.381 1261 HG23 VAL 157 HG23 VAL 157 17.116 16.486 -0.930 1262 HN1 EB4 200 H17 EB4 200 0.394 -1.137 5.742 1263 H8 EB4 200 H8 EB4 200 4.799 0.690 0.806 1264 HN2 EB4 200 H25 EB4 200 3.540 -0.324 6.216 1265 H9 EB4 200 H9 EB4 200 0.732 5.774 3.060 1266 H10 EB4 200 H10 EB4 200 -2.759 -1.210 0.726 1267 HN3 EB4 200 H32 EB4 200 0.994 1.708 7.197 1268 H7 EB4 200 H7 EB4 200 -1.213 0.714 0.497 1269 H11 EB4 200 H11 EB4 200 6.694 -0.801 1.384 1270 H12 EB4 200 H12 EB4 200 -0.133 7.084 4.982 1271 H15 EB4 200 H15 EB4 200 -0.185 6.076 7.246 1272 H14 EB4 200 H14 EB4 200 6.964 -1.619 3.710 1273 H13 EB4 200 H13 EB4 200 -2.711 -2.600 2.781 1274 H22 EB4 200 H22 EB4 200 -0.830 -3.430 7.144 1275 H30 EB4 200 H30 EB4 200 -0.216 -0.125 10.166 1276 H30A EB4 200 H9N EB4 200 -1.239 0.923 9.066 1277 H24 EB4 200 H24 EB4 200 0.559 2.233 10.082 1278 H28 EB4 200 H28 EB4 200 1.366 -3.857 8.142 1279 H28A EB4 200 H9L EB4 200 1.350 -4.060 6.382 1280 H23 EB4 200 H23 EB4 200 5.246 -1.760 8.196 1281 H29 EB4 200 H29 EB4 200 4.170 -0.356 9.913 1282 H29A EB4 200 H9M EB4 200 5.036 0.663 8.662 1283 H21 ACD 300 HA3 ACD 300 -0.007 8.973 -11.959 1284 H22 ACD 300 HA4 ACD 300 0.285 10.369 -10.900 1285 H31 ACD 300 HA1 ACD 300 0.183 7.450 -10.021 1286 H32 ACD 300 HA2 ACD 300 1.651 8.438 -10.189 1287 H41 ACD 300 HA0 ACD 300 -0.674 8.972 -8.281 1288 H42 ACD 300 HAZ ACD 300 0.750 10.020 -8.483 1289 H5 ACD 300 HAY ACD 300 2.145 7.733 -7.821 1290 H6 ACD 300 HAX ACD 300 1.150 7.208 -5.457 1291 H71 ACD 300 HAV ACD 300 -1.033 9.218 -6.414 1292 H72 ACD 300 HAW ACD 300 -1.533 7.594 -5.892 1293 H8 ACD 300 HAU ACD 300 -0.675 9.901 -4.081 1294 H9 ACD 300 HAT ACD 300 -0.864 8.172 -2.136 1295 H101 ACD 300 HAR ACD 300 -1.572 6.196 -4.394 1296 H102 ACD 300 HAS ACD 300 -0.024 5.891 -3.574 1297 H11 ACD 300 HAQ ACD 300 -2.815 5.417 -2.409 1298 H12 ACD 300 HAP ACD 300 -1.535 4.861 -0.185 1299 H131 ACD 300 HAN ACD 300 0.767 6.559 -1.469 1300 H132 ACD 300 HAO ACD 300 1.070 4.792 -1.083 1301 H14 ACD 300 HAM ACD 300 0.850 5.250 1.309 1302 H15 ACD 300 HAL ACD 300 1.016 7.738 2.069 1303 H161 ACD 300 HAJ ACD 300 -0.305 8.570 -0.467 1304 H162 ACD 300 HAK ACD 300 0.737 9.602 0.536 1305 H171 ACD 300 HAH ACD 300 2.738 8.745 -0.580 1306 H172 ACD 300 HAI ACD 300 1.767 7.600 -1.528 1307 H181 ACD 300 HAF ACD 300 0.472 9.635 -2.412 1308 H182 ACD 300 HAG ACD 300 1.755 10.636 -1.694 1309 H191 ACD 300 HAD ACD 300 3.455 9.547 -3.035 1310 H192 ACD 300 HAE ACD 300 2.288 8.350 -3.639 1311 H201 ACD 300 HAA ACD 300 2.666 10.092 -5.328 1312 H202 ACD 300 HAB ACD 300 2.222 11.358 -4.167 1313 H203 ACD 300 HAC ACD 300 0.997 10.200 -4.734 Start of MODEL 5 1 H1 MET 1 HT1 MET 1 0.413 22.072 -21.494 2 H2 MET 1 HT2 MET 1 0.730 22.682 -23.047 3 H3 MET 1 HT3 MET 1 1.733 21.483 -22.381 4 HA MET 1 HA MET 1 -0.221 20.958 -24.099 5 HB2 MET 1 HB2 MET 1 0.803 19.301 -21.778 6 HB3 MET 1 HB1 MET 1 -0.173 18.634 -23.087 7 HG2 MET 1 HG2 MET 1 1.518 19.459 -24.723 8 HG3 MET 1 HG1 MET 1 2.514 20.011 -23.375 9 HE1 MET 1 HE1 MET 1 4.478 18.691 -24.267 10 HE2 MET 1 HE2 MET 1 4.511 16.959 -24.588 11 HE3 MET 1 HE3 MET 1 3.554 18.035 -25.615 12 H THR 2 HN THR 2 -2.284 19.783 -23.890 13 HA THR 2 HA THR 2 -4.181 21.210 -22.389 14 HB THR 2 HB THR 2 -4.462 18.417 -23.523 15 HG1 THR 2 HG1 THR 2 -4.373 20.954 -24.641 16 HG21 THR 2 HG21 THR 2 -6.862 19.100 -23.687 17 HG22 THR 2 HG22 THR 2 -6.283 19.004 -22.023 18 HG23 THR 2 HG23 THR 2 -6.465 20.575 -22.805 19 H VAL 3 HN VAL 3 -2.490 18.179 -21.733 20 HA VAL 3 HA VAL 3 -4.002 17.441 -19.452 21 HB VAL 3 HB VAL 3 -1.894 16.070 -18.926 22 HG11 VAL 3 HG11 VAL 3 -2.334 14.530 -20.797 23 HG12 VAL 3 HG12 VAL 3 -3.846 15.184 -20.165 24 HG13 VAL 3 HG13 VAL 3 -3.170 15.816 -21.668 25 HG21 VAL 3 HG21 VAL 3 -0.159 16.013 -20.565 26 HG22 VAL 3 HG22 VAL 3 -1.097 16.988 -21.696 27 HG23 VAL 3 HG23 VAL 3 -0.436 17.722 -20.235 28 HA PRO 4 HA PRO 4 -2.375 20.258 -16.444 29 HB2 PRO 4 HB2 PRO 4 -2.676 18.813 -14.144 30 HB3 PRO 4 HB1 PRO 4 -4.048 19.510 -15.029 31 HG2 PRO 4 HG2 PRO 4 -3.010 16.710 -15.055 32 HG3 PRO 4 HG1 PRO 4 -4.685 17.289 -14.998 33 HD2 PRO 4 HD2 PRO 4 -3.520 16.414 -17.307 34 HD3 PRO 4 HD1 PRO 4 -4.775 17.672 -17.285 35 H ASP 5 HN ASP 5 -0.556 20.653 -15.069 36 HA ASP 5 HA ASP 5 1.770 19.085 -15.742 37 HB2 ASP 5 HB2 ASP 5 1.403 21.472 -13.919 38 HB3 ASP 5 HB1 ASP 5 2.961 20.750 -14.317 39 H ARG 6 HN ARG 6 2.819 17.617 -14.518 40 HA ARG 6 HA ARG 6 1.505 16.651 -12.115 41 HB2 ARG 6 HB2 ARG 6 3.485 14.980 -12.216 42 HB3 ARG 6 HB1 ARG 6 2.260 14.894 -13.480 43 HG2 ARG 6 HG2 ARG 6 4.585 16.719 -13.964 44 HG3 ARG 6 HG1 ARG 6 4.890 14.986 -14.049 45 HD2 ARG 6 HD2 ARG 6 2.532 16.155 -15.506 46 HD3 ARG 6 HD1 ARG 6 4.141 16.255 -16.214 47 HE ARG 6 HE ARG 6 3.908 13.622 -15.530 48 HH11 ARG 6 HH21 ARG 6 1.980 15.877 -17.311 49 HH12 ARG 6 HH22 ARG 6 1.314 14.682 -18.372 50 HH21 ARG 6 HH11 ARG 6 3.039 12.048 -16.918 51 HH22 ARG 6 HH12 ARG 6 1.913 12.514 -18.150 52 H SER 7 HN SER 7 4.229 18.601 -12.976 53 HA SER 7 HA SER 7 5.849 18.327 -10.710 54 HB2 SER 7 HB2 SER 7 5.376 20.833 -12.337 55 HB3 SER 7 HB1 SER 7 6.764 20.505 -11.304 56 HG SER 7 HG SER 7 7.571 19.263 -12.805 57 H GLU 8 HN GLU 8 2.885 20.151 -11.215 58 HA GLU 8 HA GLU 8 3.023 21.883 -9.026 59 HB2 GLU 8 HB2 GLU 8 1.336 21.934 -10.894 60 HB3 GLU 8 HB1 GLU 8 0.511 20.592 -10.102 61 HG2 GLU 8 HG2 GLU 8 -0.559 22.631 -9.381 62 HG3 GLU 8 HG1 GLU 8 0.372 22.011 -8.022 63 H ILE 9 HN ILE 9 1.470 18.653 -9.208 64 HA ILE 9 HA ILE 9 1.035 18.672 -6.333 65 HB ILE 9 HB ILE 9 -0.731 17.541 -7.296 66 HG12 ILE 9 HG12 ILE 9 1.203 15.219 -7.179 67 HG13 ILE 9 HG11 ILE 9 0.608 16.001 -5.719 68 HG21 ILE 9 HG21 ILE 9 -0.320 15.913 -9.250 69 HG22 ILE 9 HG22 ILE 9 -0.121 17.633 -9.587 70 HG23 ILE 9 HG23 ILE 9 1.296 16.613 -9.334 71 HD11 ILE 9 HD11 ILE 9 -0.925 14.264 -5.954 72 HD12 ILE 9 HD12 ILE 9 -1.755 15.556 -6.808 73 HD13 ILE 9 HD13 ILE 9 -0.882 14.327 -7.717 74 H ALA 10 HN ALA 10 3.378 17.369 -8.587 75 HA ALA 10 HA ALA 10 4.411 15.442 -6.752 76 HB1 ALA 10 HB1 ALA 10 5.955 16.625 -9.053 77 HB2 ALA 10 HB2 ALA 10 4.797 15.305 -9.230 78 HB3 ALA 10 HB3 ALA 10 6.241 15.085 -8.243 79 H GLY 11 HN GLY 11 6.061 15.532 -5.313 80 HA2 GLY 11 HA2 GLY 11 8.079 16.718 -4.539 81 HA3 GLY 11 HA1 GLY 11 7.177 18.216 -4.758 82 H LYS 12 HN LYS 12 4.655 17.105 -3.750 83 HA LYS 12 HA LYS 12 5.105 16.136 -1.091 84 HB2 LYS 12 HB2 LYS 12 5.690 18.686 -1.141 85 HB3 LYS 12 HB1 LYS 12 3.943 18.901 -1.114 86 HG2 LYS 12 HG2 LYS 12 3.818 17.488 0.920 87 HG3 LYS 12 HG1 LYS 12 5.572 17.307 0.891 88 HD2 LYS 12 HD2 LYS 12 5.522 19.965 0.842 89 HD3 LYS 12 HD1 LYS 12 3.925 19.732 1.552 90 HE2 LYS 12 HE2 LYS 12 5.206 19.783 3.483 91 HE3 LYS 12 HE1 LYS 12 5.274 18.055 3.139 92 HZ1 LYS 12 HZ1 LYS 12 7.275 19.412 1.680 93 HZ2 LYS 12 HZ2 LYS 12 7.397 19.820 3.325 94 HZ3 LYS 12 HZ3 LYS 12 7.450 18.193 2.851 95 H TRP 13 HN TRP 13 3.449 14.753 -0.929 96 HA TRP 13 HA TRP 13 0.742 15.584 -1.825 97 HB2 TRP 13 HB2 TRP 13 2.071 12.865 -1.557 98 HB3 TRP 13 HB1 TRP 13 0.358 13.029 -1.842 99 HD1 TRP 13 HD1 TRP 13 3.315 14.826 -3.553 100 HE1 TRP 13 HE1 TRP 13 3.077 14.362 -6.066 101 HE3 TRP 13 HE3 TRP 13 -0.881 11.930 -3.545 102 HZ2 TRP 13 HZ2 TRP 13 1.422 12.915 -7.822 103 HZ3 TRP 13 HZ3 TRP 13 -1.782 11.030 -5.670 104 HH2 TRP 13 HH2 TRP 13 -0.650 11.530 -7.818 105 H TYR 14 HN TYR 14 -0.697 15.896 -0.098 106 HA TYR 14 HA TYR 14 0.178 14.989 2.554 107 HB2 TYR 14 HB2 TYR 14 -1.252 17.278 1.481 108 HB3 TYR 14 HB1 TYR 14 -2.156 16.549 2.799 109 HD1 TYR 14 HD1 TYR 14 1.537 16.861 2.209 110 HD2 TYR 14 HD2 TYR 14 -1.818 17.890 4.684 111 HE1 TYR 14 HE1 TYR 14 3.061 17.951 3.828 112 HE2 TYR 14 HE2 TYR 14 -0.291 18.977 6.303 113 HH TYR 14 HH TYR 14 1.958 19.043 6.950 114 H VAL 15 HN VAL 15 -0.653 13.278 3.464 115 HA VAL 15 HA VAL 15 -3.139 12.066 2.448 116 HB VAL 15 HB VAL 15 -1.100 11.082 4.465 117 HG11 VAL 15 HG11 VAL 15 -3.217 10.108 5.028 118 HG12 VAL 15 HG12 VAL 15 -3.611 9.831 3.331 119 HG13 VAL 15 HG13 VAL 15 -2.338 8.888 4.104 120 HG21 VAL 15 HG21 VAL 15 -0.795 9.356 2.530 121 HG22 VAL 15 HG22 VAL 15 -1.577 10.580 1.529 122 HG23 VAL 15 HG23 VAL 15 -0.064 10.950 2.354 123 H VAL 16 HN VAL 16 -5.069 12.280 3.558 124 HA VAL 16 HA VAL 16 -4.929 13.167 6.377 125 HB VAL 16 HB VAL 16 -6.550 14.907 5.972 126 HG11 VAL 16 HG11 VAL 16 -4.415 15.242 3.872 127 HG12 VAL 16 HG12 VAL 16 -5.038 16.432 5.008 128 HG13 VAL 16 HG13 VAL 16 -3.986 15.141 5.566 129 HG21 VAL 16 HG21 VAL 16 -7.820 14.019 4.137 130 HG22 VAL 16 HG22 VAL 16 -7.042 15.483 3.536 131 HG23 VAL 16 HG23 VAL 16 -6.384 13.900 3.119 132 H ALA 17 HN ALA 17 -6.127 10.841 4.454 133 HA ALA 17 HA ALA 17 -7.884 9.883 6.377 134 HB1 ALA 17 HB1 ALA 17 -10.079 10.330 5.641 135 HB2 ALA 17 HB2 ALA 17 -9.537 10.945 4.092 136 HB3 ALA 17 HB3 ALA 17 -9.288 11.898 5.539 137 H LEU 18 HN LEU 18 -8.374 7.760 5.956 138 HA LEU 18 HA LEU 18 -8.262 6.853 3.169 139 HB2 LEU 18 HB2 LEU 18 -6.039 6.412 3.517 140 HB3 LEU 18 HB1 LEU 18 -6.210 6.372 5.264 141 HG LEU 18 HG LEU 18 -7.417 4.144 3.641 142 HD11 LEU 18 HD11 LEU 18 -5.121 4.395 2.779 143 HD12 LEU 18 HD12 LEU 18 -4.499 4.324 4.427 144 HD13 LEU 18 HD13 LEU 18 -5.294 2.916 3.723 145 HD21 LEU 18 HD21 LEU 18 -5.925 3.674 6.168 146 HD22 LEU 18 HD22 LEU 18 -7.376 4.657 6.326 147 HD23 LEU 18 HD23 LEU 18 -7.481 3.036 5.645 148 H ALA 19 HN ALA 19 -9.300 4.929 2.797 149 HA ALA 19 HA ALA 19 -10.861 3.841 5.060 150 HB1 ALA 19 HB1 ALA 19 -12.390 4.916 3.553 151 HB2 ALA 19 HB2 ALA 19 -12.538 3.182 3.291 152 HB3 ALA 19 HB3 ALA 19 -11.624 4.170 2.154 153 H SER 20 HN SER 20 -11.454 1.566 4.816 154 HA SER 20 HA SER 20 -10.037 -0.102 2.963 155 HB2 SER 20 HB2 SER 20 -8.518 -1.169 4.526 156 HB3 SER 20 HB1 SER 20 -8.179 0.558 4.470 157 HG SER 20 HG SER 20 -10.054 0.147 6.296 158 H ASN 21 HN ASN 21 -10.047 -2.449 3.900 159 HA ASN 21 HA ASN 21 -12.713 -2.918 5.111 160 HB2 ASN 21 HB2 ASN 21 -11.187 -4.539 3.052 161 HB3 ASN 21 HB1 ASN 21 -12.634 -5.112 3.880 162 HD21 ASN 21 HD21 ASN 21 -12.899 -4.948 1.165 163 HD22 ASN 21 HD22 ASN 21 -13.813 -3.589 0.719 164 H THR 22 HN THR 22 -9.347 -3.258 5.301 165 HA THR 22 HA THR 22 -9.392 -5.545 7.103 166 HB THR 22 HB THR 22 -7.521 -5.087 5.440 167 HG1 THR 22 HG1 THR 22 -6.014 -5.854 6.891 168 HG21 THR 22 HG21 THR 22 -6.403 -3.212 7.492 169 HG22 THR 22 HG22 THR 22 -5.981 -3.379 5.791 170 HG23 THR 22 HG23 THR 22 -7.481 -2.573 6.248 171 H GLU 23 HN GLU 23 -10.297 -5.111 8.994 172 HA GLU 23 HA GLU 23 -10.728 -2.783 10.280 173 HB2 GLU 23 HB2 GLU 23 -11.510 -5.006 11.060 174 HB3 GLU 23 HB1 GLU 23 -9.893 -5.322 11.690 175 HG2 GLU 23 HG2 GLU 23 -10.061 -3.392 13.182 176 HG3 GLU 23 HG1 GLU 23 -11.641 -2.986 12.514 177 H PHE 24 HN PHE 24 -7.651 -4.429 10.110 178 HA PHE 24 HA PHE 24 -6.321 -3.199 12.225 179 HB2 PHE 24 HB2 PHE 24 -4.920 -3.701 9.621 180 HB3 PHE 24 HB1 PHE 24 -4.346 -3.970 11.266 181 HD1 PHE 24 HD1 PHE 24 -6.566 -5.455 12.504 182 HD2 PHE 24 HD2 PHE 24 -4.883 -5.799 8.565 183 HE1 PHE 24 HE1 PHE 24 -7.332 -7.807 12.381 184 HE2 PHE 24 HE2 PHE 24 -5.651 -8.152 8.444 185 HZ PHE 24 HZ PHE 24 -6.876 -9.157 10.353 186 H PHE 25 HN PHE 25 -6.520 -2.031 8.811 187 HA PHE 25 HA PHE 25 -4.961 0.271 9.324 188 HB2 PHE 25 HB2 PHE 25 -5.776 -1.036 7.091 189 HB3 PHE 25 HB1 PHE 25 -6.861 0.345 7.045 190 HD1 PHE 25 HD1 PHE 25 -4.950 2.365 8.393 191 HD2 PHE 25 HD2 PHE 25 -4.380 -0.495 5.242 192 HE1 PHE 25 HE1 PHE 25 -3.119 3.747 7.476 193 HE2 PHE 25 HE2 PHE 25 -2.548 0.895 4.326 194 HZ PHE 25 HZ PHE 25 -1.914 3.013 5.440 195 H LEU 26 HN LEU 26 -8.525 -0.073 8.972 196 HA LEU 26 HA LEU 26 -8.969 2.732 9.318 197 HB2 LEU 26 HB2 LEU 26 -11.358 2.041 9.789 198 HB3 LEU 26 HB1 LEU 26 -10.708 1.560 8.229 199 HG LEU 26 HG LEU 26 -10.057 -0.591 9.929 200 HD11 LEU 26 HD11 LEU 26 -11.573 0.231 11.653 201 HD12 LEU 26 HD12 LEU 26 -12.869 0.411 10.470 202 HD13 LEU 26 HD13 LEU 26 -12.281 -1.195 10.895 203 HD21 LEU 26 HD21 LEU 26 -10.735 -0.960 7.665 204 HD22 LEU 26 HD22 LEU 26 -11.986 -1.711 8.653 205 HD23 LEU 26 HD23 LEU 26 -12.273 -0.137 7.914 206 H ARG 27 HN ARG 27 -8.903 -0.010 11.460 207 HA ARG 27 HA ARG 27 -9.850 1.224 13.810 208 HB2 ARG 27 HB2 ARG 27 -9.516 -1.187 13.720 209 HB3 ARG 27 HB1 ARG 27 -7.775 -0.963 13.527 210 HG2 ARG 27 HG2 ARG 27 -7.545 -0.069 15.724 211 HG3 ARG 27 HG1 ARG 27 -9.288 0.136 15.902 212 HD2 ARG 27 HD2 ARG 27 -8.307 -1.875 17.106 213 HD3 ARG 27 HD1 ARG 27 -9.646 -2.227 16.017 214 HE ARG 27 HE ARG 27 -7.345 -2.521 14.499 215 HH11 ARG 27 HH21 ARG 27 -8.704 -3.844 17.394 216 HH12 ARG 27 HH22 ARG 27 -7.961 -5.396 17.198 217 HH21 ARG 27 HH11 ARG 27 -6.367 -4.555 14.235 218 HH22 ARG 27 HH12 ARG 27 -6.638 -5.799 15.409 219 H GLU 28 HN GLU 28 -6.523 0.903 12.573 220 HA GLU 28 HA GLU 28 -5.451 2.551 14.684 221 HB2 GLU 28 HB2 GLU 28 -4.307 0.604 13.399 222 HB3 GLU 28 HB1 GLU 28 -3.958 1.825 12.178 223 HG2 GLU 28 HG2 GLU 28 -2.067 1.825 13.626 224 HG3 GLU 28 HG1 GLU 28 -3.003 3.246 14.083 225 H LYS 29 HN LYS 29 -6.103 3.085 11.160 226 HA LYS 29 HA LYS 29 -4.813 5.477 10.845 227 HB2 LYS 29 HB2 LYS 29 -6.155 4.240 9.097 228 HB3 LYS 29 HB1 LYS 29 -7.603 4.945 9.813 229 HG2 LYS 29 HG2 LYS 29 -7.134 6.507 8.148 230 HG3 LYS 29 HG1 LYS 29 -6.278 7.221 9.513 231 HD2 LYS 29 HD2 LYS 29 -4.178 6.153 8.752 232 HD3 LYS 29 HD1 LYS 29 -5.038 5.441 7.390 233 HE2 LYS 29 HE2 LYS 29 -5.736 7.949 6.912 234 HE3 LYS 29 HE1 LYS 29 -4.303 8.309 7.875 235 HZ1 LYS 29 HZ1 LYS 29 -4.327 6.482 5.538 236 HZ2 LYS 29 HZ2 LYS 29 -3.858 8.114 5.470 237 HZ3 LYS 29 HZ3 LYS 29 -2.966 7.015 6.404 238 H ASP 30 HN ASP 30 -7.675 4.772 12.658 239 HA ASP 30 HA ASP 30 -8.653 7.399 12.968 240 HB2 ASP 30 HB2 ASP 30 -9.929 5.304 13.439 241 HB3 ASP 30 HB1 ASP 30 -8.960 5.097 14.897 242 H LYS 31 HN LYS 31 -6.017 5.710 14.590 243 HA LYS 31 HA LYS 31 -6.008 7.730 16.691 244 HB2 LYS 31 HB2 LYS 31 -4.519 6.398 17.929 245 HB3 LYS 31 HB1 LYS 31 -5.702 5.301 17.236 246 HG2 LYS 31 HG2 LYS 31 -3.713 4.179 16.804 247 HG3 LYS 31 HG1 LYS 31 -3.972 5.043 15.307 248 HD2 LYS 31 HD2 LYS 31 -2.510 6.827 16.987 249 HD3 LYS 31 HD1 LYS 31 -1.752 5.253 17.163 250 HE2 LYS 31 HE2 LYS 31 -2.419 6.118 14.381 251 HE3 LYS 31 HE1 LYS 31 -1.078 6.925 15.178 252 HZ1 LYS 31 HZ1 LYS 31 -0.231 5.027 14.062 253 HZ2 LYS 31 HZ2 LYS 31 -0.193 4.691 15.727 254 HZ3 LYS 31 HZ3 LYS 31 -1.404 4.011 14.754 255 H MET 32 HN MET 32 -4.299 7.219 13.687 256 HA MET 32 HA MET 32 -2.025 8.793 14.595 257 HB2 MET 32 HB2 MET 32 -1.476 8.836 12.069 258 HB3 MET 32 HB1 MET 32 -1.357 7.302 12.906 259 HG2 MET 32 HG2 MET 32 -3.900 7.079 12.122 260 HG3 MET 32 HG1 MET 32 -3.371 8.209 10.894 261 HE1 MET 32 HE1 MET 32 -3.186 5.007 12.578 262 HE2 MET 32 HE2 MET 32 -2.303 3.887 11.560 263 HE3 MET 32 HE3 MET 32 -1.432 4.990 12.627 264 H LYS 33 HN LYS 33 -1.363 10.563 12.915 265 HA LYS 33 HA LYS 33 -3.588 12.512 12.771 266 HB2 LYS 33 HB2 LYS 33 -0.659 13.152 13.108 267 HB3 LYS 33 HB1 LYS 33 -2.027 14.252 13.237 268 HG2 LYS 33 HG2 LYS 33 -2.820 13.164 15.233 269 HG3 LYS 33 HG1 LYS 33 -1.640 11.864 15.056 270 HD2 LYS 33 HD2 LYS 33 0.164 13.233 15.661 271 HD3 LYS 33 HD1 LYS 33 -0.702 14.718 15.268 272 HE2 LYS 33 HE2 LYS 33 -2.107 14.506 17.208 273 HE3 LYS 33 HE1 LYS 33 -1.519 12.876 17.529 274 HZ1 LYS 33 HZ1 LYS 33 0.759 14.299 17.467 275 HZ2 LYS 33 HZ2 LYS 33 -0.317 15.424 18.150 276 HZ3 LYS 33 HZ3 LYS 33 -0.095 13.911 18.884 277 H MET 34 HN MET 34 -2.846 14.383 11.086 278 HA MET 34 HA MET 34 -2.948 13.368 8.552 279 HB2 MET 34 HB2 MET 34 -3.467 15.642 9.012 280 HB3 MET 34 HB1 MET 34 -1.891 15.949 9.718 281 HG2 MET 34 HG2 MET 34 -0.816 15.779 7.571 282 HG3 MET 34 HG1 MET 34 -2.304 15.238 6.811 283 HE1 MET 34 HE1 MET 34 -4.452 16.400 7.235 284 HE2 MET 34 HE2 MET 34 -4.554 17.809 8.262 285 HE3 MET 34 HE3 MET 34 -4.597 17.995 6.514 286 H ALA 35 HN ALA 35 -1.476 12.759 7.039 287 HA ALA 35 HA ALA 35 1.370 12.580 7.846 288 HB1 ALA 35 HB1 ALA 35 1.154 10.606 6.021 289 HB2 ALA 35 HB2 ALA 35 -0.500 10.615 6.631 290 HB3 ALA 35 HB3 ALA 35 0.843 10.352 7.738 291 H MET 36 HN MET 36 2.873 12.387 5.952 292 HA MET 36 HA MET 36 1.963 14.027 3.663 293 HB2 MET 36 HB2 MET 36 4.712 14.584 4.053 294 HB3 MET 36 HB1 MET 36 3.358 15.679 4.315 295 HG2 MET 36 HG2 MET 36 4.285 13.700 6.407 296 HG3 MET 36 HG1 MET 36 4.900 15.349 6.309 297 HE1 MET 36 HE1 MET 36 4.084 14.359 8.620 298 HE2 MET 36 HE2 MET 36 3.248 15.778 9.243 299 HE3 MET 36 HE3 MET 36 2.400 14.233 9.119 300 H ALA 37 HN ALA 37 3.326 13.827 1.771 301 HA ALA 37 HA ALA 37 5.067 11.511 1.543 302 HB1 ALA 37 HB1 ALA 37 3.118 10.256 1.220 303 HB2 ALA 37 HB2 ALA 37 3.579 10.684 -0.429 304 HB3 ALA 37 HB3 ALA 37 2.294 11.574 0.387 305 H ARG 38 HN ARG 38 6.029 11.338 -0.632 306 HA ARG 38 HA ARG 38 5.695 13.752 -2.303 307 HB2 ARG 38 HB2 ARG 38 7.900 14.455 -2.218 308 HB3 ARG 38 HB1 ARG 38 7.641 13.934 -0.562 309 HG2 ARG 38 HG2 ARG 38 9.602 12.796 -0.922 310 HG3 ARG 38 HG1 ARG 38 8.523 11.593 -1.606 311 HD2 ARG 38 HD2 ARG 38 8.975 12.325 -3.842 312 HD3 ARG 38 HD1 ARG 38 9.760 13.795 -3.275 313 HE ARG 38 HE ARG 38 10.934 11.142 -3.401 314 HH11 ARG 38 HH21 ARG 38 11.023 14.336 -2.073 315 HH12 ARG 38 HH22 ARG 38 12.709 14.276 -1.680 316 HH21 ARG 38 HH11 ARG 38 13.147 11.055 -2.885 317 HH22 ARG 38 HH12 ARG 38 13.910 12.420 -2.139 318 H ILE 39 HN ILE 39 5.833 13.371 -4.495 319 HA ILE 39 HA ILE 39 6.568 10.667 -5.350 320 HB ILE 39 HB ILE 39 4.181 11.300 -5.297 321 HG12 ILE 39 HG12 ILE 39 4.919 11.018 -8.193 322 HG13 ILE 39 HG11 ILE 39 5.325 9.715 -7.082 323 HG21 ILE 39 HG21 ILE 39 3.425 12.854 -6.962 324 HG22 ILE 39 HG22 ILE 39 4.531 13.610 -5.817 325 HG23 ILE 39 HG23 ILE 39 5.062 13.192 -7.439 326 HD11 ILE 39 HD11 ILE 39 2.922 9.797 -8.239 327 HD12 ILE 39 HD12 ILE 39 3.104 9.254 -6.577 328 HD13 ILE 39 HD13 ILE 39 2.569 10.898 -6.919 329 H SER 40 HN SER 40 7.802 10.557 -7.275 330 HA SER 40 HA SER 40 8.300 12.998 -8.758 331 HB2 SER 40 HB2 SER 40 10.618 11.619 -7.451 332 HB3 SER 40 HB1 SER 40 10.653 13.085 -8.412 333 HG SER 40 HG SER 40 10.231 14.119 -6.646 334 H PHE 41 HN PHE 41 9.652 12.594 -10.689 335 HA PHE 41 HA PHE 41 9.038 9.910 -11.707 336 HB2 PHE 41 HB2 PHE 41 9.774 12.462 -13.138 337 HB3 PHE 41 HB1 PHE 41 9.410 10.930 -13.931 338 HD1 PHE 41 HD2 PHE 41 8.013 13.605 -11.763 339 HD2 PHE 41 HD1 PHE 41 7.159 10.152 -14.172 340 HE1 PHE 41 HE2 PHE 41 5.588 14.108 -11.626 341 HE2 PHE 41 HE1 PHE 41 4.734 10.656 -14.035 342 HZ PHE 41 HZ PHE 41 3.949 12.634 -12.762 343 H LEU 42 HN LEU 42 10.792 8.766 -10.779 344 HA LEU 42 HA LEU 42 13.531 9.389 -11.124 345 HB2 LEU 42 HB2 LEU 42 12.109 6.716 -10.986 346 HB3 LEU 42 HB1 LEU 42 13.855 6.864 -11.054 347 HG LEU 42 HG LEU 42 12.287 8.359 -8.957 348 HD11 LEU 42 HD11 LEU 42 12.938 5.420 -9.058 349 HD12 LEU 42 HD12 LEU 42 12.974 6.256 -7.508 350 HD13 LEU 42 HD13 LEU 42 11.486 6.221 -8.456 351 HD21 LEU 42 HD21 LEU 42 14.639 8.943 -9.161 352 HD22 LEU 42 HD22 LEU 42 14.445 7.980 -7.699 353 HD23 LEU 42 HD23 LEU 42 15.107 7.245 -9.157 354 H GLY 43 HN GLY 43 11.132 7.825 -13.064 355 HA2 GLY 43 HA2 GLY 43 12.316 8.503 -15.567 356 HA3 GLY 43 HA1 GLY 43 12.486 6.780 -15.213 357 H GLU 44 HN GLU 44 10.879 7.752 -17.361 358 HA GLU 44 HA GLU 44 8.185 8.139 -16.831 359 HB2 GLU 44 HB2 GLU 44 9.392 6.501 -19.080 360 HB3 GLU 44 HB1 GLU 44 7.751 7.150 -19.049 361 HG2 GLU 44 HG2 GLU 44 10.262 8.837 -18.855 362 HG3 GLU 44 HG1 GLU 44 9.344 8.586 -20.338 363 H ASP 45 HN ASP 45 10.071 5.192 -16.663 364 HA ASP 45 HA ASP 45 7.639 3.691 -15.889 365 HB2 ASP 45 HB2 ASP 45 9.367 1.712 -16.224 366 HB3 ASP 45 HB1 ASP 45 8.535 2.427 -17.602 367 H GLU 46 HN GLU 46 9.569 5.536 -14.336 368 HA GLU 46 HA GLU 46 9.753 3.772 -12.003 369 HB2 GLU 46 HB2 GLU 46 12.100 5.434 -12.937 370 HB3 GLU 46 HB1 GLU 46 12.050 4.355 -11.542 371 HG2 GLU 46 HG2 GLU 46 11.540 2.466 -13.137 372 HG3 GLU 46 HG1 GLU 46 11.856 3.582 -14.463 373 H LEU 47 HN LEU 47 8.707 4.790 -10.440 374 HA LEU 47 HA LEU 47 9.053 7.717 -10.132 375 HB2 LEU 47 HB2 LEU 47 6.509 6.293 -9.369 376 HB3 LEU 47 HB1 LEU 47 6.777 8.015 -9.612 377 HG LEU 47 HG LEU 47 6.971 5.969 -11.841 378 HD11 LEU 47 HD11 LEU 47 4.707 6.007 -10.878 379 HD12 LEU 47 HD12 LEU 47 4.666 7.763 -11.039 380 HD13 LEU 47 HD13 LEU 47 4.725 6.747 -12.479 381 HD21 LEU 47 HD21 LEU 47 6.509 8.130 -13.175 382 HD22 LEU 47 HD22 LEU 47 6.917 8.991 -11.693 383 HD23 LEU 47 HD23 LEU 47 8.113 7.961 -12.472 384 H LYS 48 HN LYS 48 9.337 8.431 -8.039 385 HA LYS 48 HA LYS 48 9.655 6.320 -5.994 386 HB2 LYS 48 HB2 LYS 48 11.583 7.924 -6.750 387 HB3 LYS 48 HB1 LYS 48 10.754 9.108 -5.749 388 HG2 LYS 48 HG2 LYS 48 10.989 7.737 -3.787 389 HG3 LYS 48 HG1 LYS 48 11.554 6.365 -4.738 390 HD2 LYS 48 HD2 LYS 48 13.463 7.463 -3.675 391 HD3 LYS 48 HD1 LYS 48 13.546 7.686 -5.422 392 HE2 LYS 48 HE2 LYS 48 12.886 9.941 -5.294 393 HE3 LYS 48 HE1 LYS 48 12.200 9.746 -3.680 394 HZ1 LYS 48 HZ1 LYS 48 15.090 9.512 -4.321 395 HZ2 LYS 48 HZ2 LYS 48 14.354 10.908 -3.690 396 HZ3 LYS 48 HZ3 LYS 48 14.386 9.480 -2.775 397 H VAL 49 HN VAL 49 8.054 6.205 -4.514 398 HA VAL 49 HA VAL 49 6.711 8.726 -3.760 399 HB VAL 49 HB VAL 49 5.538 6.112 -4.521 400 HG11 VAL 49 HG11 VAL 49 4.956 6.004 -2.165 401 HG12 VAL 49 HG12 VAL 49 4.483 7.703 -2.167 402 HG13 VAL 49 HG13 VAL 49 3.533 6.522 -3.069 403 HG21 VAL 49 HG21 VAL 49 3.610 7.702 -4.963 404 HG22 VAL 49 HG22 VAL 49 4.677 9.009 -4.455 405 HG23 VAL 49 HG23 VAL 49 5.089 8.023 -5.853 406 H SER 50 HN SER 50 6.477 9.201 -1.738 407 HA SER 50 HA SER 50 7.748 7.412 0.261 408 HB2 SER 50 HB2 SER 50 9.029 9.415 -0.549 409 HB3 SER 50 HB1 SER 50 7.766 10.410 0.157 410 HG SER 50 HG SER 50 9.847 9.504 1.390 411 H TYR 51 HN TYR 51 6.987 7.465 2.373 412 HA TYR 51 HA TYR 51 4.439 8.910 2.833 413 HB2 TYR 51 HB2 TYR 51 5.041 6.312 4.229 414 HB3 TYR 51 HB1 TYR 51 3.489 7.087 3.943 415 HD1 TYR 51 HD1 TYR 51 3.365 7.611 1.134 416 HD2 TYR 51 HD2 TYR 51 5.114 4.257 3.160 417 HE1 TYR 51 HE1 TYR 51 3.002 6.199 -0.864 418 HE2 TYR 51 HE2 TYR 51 4.765 2.856 1.148 419 HH TYR 51 HH TYR 51 3.962 2.769 -0.911 420 H ALA 52 HN ALA 52 4.373 10.090 4.664 421 HA ALA 52 HA ALA 52 6.471 9.649 6.712 422 HB1 ALA 52 HB1 ALA 52 5.633 12.155 5.318 423 HB2 ALA 52 HB2 ALA 52 7.224 11.676 5.904 424 HB3 ALA 52 HB3 ALA 52 6.012 12.270 7.037 425 H VAL 53 HN VAL 53 5.384 8.758 8.386 426 HA VAL 53 HA VAL 53 2.717 9.840 9.030 427 HB VAL 53 HB VAL 53 3.757 7.171 9.940 428 HG11 VAL 53 HG11 VAL 53 1.711 8.061 10.990 429 HG12 VAL 53 HG12 VAL 53 0.986 8.284 9.397 430 HG13 VAL 53 HG13 VAL 53 1.338 6.660 9.987 431 HG21 VAL 53 HG21 VAL 53 2.489 7.907 7.289 432 HG22 VAL 53 HG22 VAL 53 4.023 7.078 7.553 433 HG23 VAL 53 HG23 VAL 53 2.503 6.261 7.921 434 HA PRO 54 HA PRO 54 4.754 11.120 12.827 435 HB2 PRO 54 HB2 PRO 54 2.643 12.297 14.045 436 HB3 PRO 54 HB1 PRO 54 3.442 13.037 12.642 437 HG2 PRO 54 HG2 PRO 54 0.906 11.470 12.764 438 HG3 PRO 54 HG1 PRO 54 1.280 12.940 11.843 439 HD2 PRO 54 HD2 PRO 54 1.304 10.405 10.749 440 HD3 PRO 54 HD1 PRO 54 2.259 11.767 10.117 441 H LYS 55 HN LYS 55 4.325 10.816 15.237 442 HA LYS 55 HA LYS 55 2.473 8.752 16.013 443 HB2 LYS 55 HB2 LYS 55 4.163 7.340 15.000 444 HB3 LYS 55 HB1 LYS 55 5.431 8.145 15.922 445 HG2 LYS 55 HG2 LYS 55 4.632 7.266 17.986 446 HG3 LYS 55 HG1 LYS 55 3.105 6.760 17.264 447 HD2 LYS 55 HD2 LYS 55 4.199 5.045 15.969 448 HD3 LYS 55 HD1 LYS 55 5.794 5.640 16.435 449 HE2 LYS 55 HE2 LYS 55 5.446 4.995 18.732 450 HE3 LYS 55 HE1 LYS 55 3.750 4.618 18.424 451 HZ1 LYS 55 HZ1 LYS 55 5.501 2.732 18.456 452 HZ2 LYS 55 HZ2 LYS 55 4.285 2.722 17.271 453 HZ3 LYS 55 HZ3 LYS 55 5.846 3.254 16.877 454 HA PRO 56 HA PRO 56 3.269 11.934 19.296 455 HB2 PRO 56 HB2 PRO 56 1.254 10.026 20.461 456 HB3 PRO 56 HB1 PRO 56 1.341 11.794 20.609 457 HG2 PRO 56 HG2 PRO 56 -0.342 10.632 18.895 458 HG3 PRO 56 HG1 PRO 56 0.482 12.150 18.501 459 HD2 PRO 56 HD2 PRO 56 0.929 9.445 17.385 460 HD3 PRO 56 HD1 PRO 56 1.342 11.027 16.687 461 H ASN 57 HN ASN 57 3.509 8.455 19.283 462 HA ASN 57 HA ASN 57 5.100 8.469 21.777 463 HB2 ASN 57 HB2 ASN 57 3.156 6.882 21.562 464 HB3 ASN 57 HB1 ASN 57 4.036 6.080 20.262 465 HD21 ASN 57 HD21 ASN 57 4.409 7.026 23.717 466 HD22 ASN 57 HD22 ASN 57 5.430 5.729 24.111 467 H GLY 58 HN GLY 58 5.976 9.326 19.007 468 HA2 GLY 58 HA2 GLY 58 8.587 8.797 18.922 469 HA3 GLY 58 HA1 GLY 58 7.942 7.295 18.267 470 H CYS 59 HN CYS 59 9.079 7.831 16.284 471 HA CYS 59 HA CYS 59 7.444 9.527 14.519 472 HB2 CYS 59 HB2 CYS 59 9.392 10.877 15.400 473 HB3 CYS 59 HB1 CYS 59 10.461 9.736 14.584 474 H ARG 60 HN ARG 60 7.157 8.617 12.515 475 HA ARG 60 HA ARG 60 9.019 6.443 11.727 476 HB2 ARG 60 HB2 ARG 60 5.995 6.391 11.636 477 HB3 ARG 60 HB1 ARG 60 7.031 5.216 10.826 478 HG2 ARG 60 HG2 ARG 60 8.075 4.670 13.022 479 HG3 ARG 60 HG1 ARG 60 6.942 5.773 13.804 480 HD2 ARG 60 HD2 ARG 60 5.058 4.431 12.844 481 HD3 ARG 60 HD1 ARG 60 6.242 3.283 12.227 482 HE ARG 60 HE ARG 60 5.333 3.500 14.943 483 HH11 ARG 60 HH21 ARG 60 8.005 2.713 12.890 484 HH12 ARG 60 HH22 ARG 60 8.739 1.633 14.028 485 HH21 ARG 60 HH11 ARG 60 6.289 2.085 16.441 486 HH22 ARG 60 HH12 ARG 60 7.767 1.277 16.038 487 H LYS 61 HN LYS 61 10.014 7.161 9.973 488 HA LYS 61 HA LYS 61 8.392 8.232 7.752 489 HB2 LYS 61 HB2 LYS 61 10.127 9.901 7.268 490 HB3 LYS 61 HB1 LYS 61 9.452 10.150 8.879 491 HG2 LYS 61 HG2 LYS 61 11.379 8.758 9.779 492 HG3 LYS 61 HG1 LYS 61 12.094 8.857 8.169 493 HD2 LYS 61 HD2 LYS 61 11.928 11.365 8.330 494 HD3 LYS 61 HD1 LYS 61 11.428 11.168 10.010 495 HE2 LYS 61 HE2 LYS 61 13.559 9.822 10.363 496 HE3 LYS 61 HE1 LYS 61 14.068 10.370 8.765 497 HZ1 LYS 61 HZ1 LYS 61 13.969 11.808 11.251 498 HZ2 LYS 61 HZ2 LYS 61 14.863 12.134 9.843 499 HZ3 LYS 61 HZ3 LYS 61 13.253 12.652 9.961 500 H TRP 62 HN TRP 62 8.878 7.321 5.815 501 HA TRP 62 HA TRP 62 11.513 6.210 5.331 502 HB2 TRP 62 HB2 TRP 62 11.069 4.012 5.600 503 HB3 TRP 62 HB1 TRP 62 9.638 4.525 6.484 504 HD1 TRP 62 HD1 TRP 62 7.490 5.145 4.605 505 HE1 TRP 62 HE1 TRP 62 6.653 3.546 2.762 506 HE3 TRP 62 HE3 TRP 62 11.575 2.118 4.133 507 HZ2 TRP 62 HZ2 TRP 62 7.593 1.284 1.281 508 HZ3 TRP 62 HZ3 TRP 62 11.578 0.253 2.502 509 HH2 TRP 62 HH2 TRP 62 9.594 -0.167 1.076 510 H GLU 63 HN GLU 63 11.537 5.125 3.086 511 HA GLU 63 HA GLU 63 9.839 6.723 1.248 512 HB2 GLU 63 HB2 GLU 63 12.236 7.421 1.321 513 HB3 GLU 63 HB1 GLU 63 12.684 5.803 0.780 514 HG2 GLU 63 HG2 GLU 63 11.595 6.086 -1.314 515 HG3 GLU 63 HG1 GLU 63 10.722 7.512 -0.756 516 H THR 64 HN THR 64 9.559 5.764 -0.908 517 HA THR 64 HA THR 64 9.865 2.858 -1.090 518 HB THR 64 HB THR 64 7.153 4.117 -1.486 519 HG1 THR 64 HG1 THR 64 6.682 3.243 0.574 520 HG21 THR 64 HG21 THR 64 7.457 1.996 -2.614 521 HG22 THR 64 HG22 THR 64 8.163 1.278 -1.166 522 HG23 THR 64 HG23 THR 64 6.456 1.718 -1.189 523 H THR 65 HN THR 65 9.935 2.108 -3.195 524 HA THR 65 HA THR 65 9.974 4.189 -5.294 525 HB THR 65 HB THR 65 11.190 1.424 -5.375 526 HG1 THR 65 HG1 THR 65 12.332 2.483 -3.866 527 HG21 THR 65 HG21 THR 65 10.731 2.448 -7.569 528 HG22 THR 65 HG22 THR 65 11.595 3.902 -7.073 529 HG23 THR 65 HG23 THR 65 12.466 2.380 -7.259 530 H PHE 66 HN PHE 66 8.449 4.187 -6.848 531 HA PHE 66 HA PHE 66 6.826 1.734 -7.235 532 HB2 PHE 66 HB2 PHE 66 6.094 4.647 -7.112 533 HB3 PHE 66 HB1 PHE 66 5.115 3.549 -8.082 534 HD1 PHE 66 HD1 PHE 66 6.542 4.000 -4.657 535 HD2 PHE 66 HD2 PHE 66 3.490 2.184 -7.070 536 HE1 PHE 66 HE1 PHE 66 5.379 3.224 -2.612 537 HE2 PHE 66 HE2 PHE 66 2.332 1.410 -5.022 538 HZ PHE 66 HZ PHE 66 3.278 1.930 -2.793 539 H LYS 67 HN LYS 67 6.681 0.957 -9.276 540 HA LYS 67 HA LYS 67 7.854 2.587 -11.461 541 HB2 LYS 67 HB2 LYS 67 7.835 -0.416 -11.078 542 HB3 LYS 67 HB1 LYS 67 8.384 0.402 -12.541 543 HG2 LYS 67 HG2 LYS 67 9.920 1.748 -10.869 544 HG3 LYS 67 HG1 LYS 67 9.636 0.369 -9.807 545 HD2 LYS 67 HD2 LYS 67 10.351 -1.129 -11.708 546 HD3 LYS 67 HD1 LYS 67 10.831 0.323 -12.587 547 HE2 LYS 67 HE2 LYS 67 12.244 0.917 -10.531 548 HE3 LYS 67 HE1 LYS 67 11.964 -0.739 -9.992 549 HZ1 LYS 67 HZ1 LYS 67 13.022 -0.109 -12.682 550 HZ2 LYS 67 HZ2 LYS 67 14.038 -0.331 -11.339 551 HZ3 LYS 67 HZ3 LYS 67 13.045 -1.599 -11.867 552 H LYS 68 HN LYS 68 6.806 2.639 -13.436 553 HA LYS 68 HA LYS 68 3.970 2.275 -13.344 554 HB2 LYS 68 HB2 LYS 68 5.317 4.027 -14.678 555 HB3 LYS 68 HB1 LYS 68 5.542 2.743 -15.867 556 HG2 LYS 68 HG2 LYS 68 3.073 2.443 -15.969 557 HG3 LYS 68 HG1 LYS 68 2.886 3.800 -14.858 558 HD2 LYS 68 HD2 LYS 68 4.077 5.260 -16.478 559 HD3 LYS 68 HD1 LYS 68 4.176 3.904 -17.600 560 HE2 LYS 68 HE2 LYS 68 2.249 5.434 -18.075 561 HE3 LYS 68 HE1 LYS 68 1.754 3.775 -17.740 562 HZ1 LYS 68 HZ1 LYS 68 1.945 5.647 -15.497 563 HZ2 LYS 68 HZ2 LYS 68 0.618 5.793 -16.548 564 HZ3 LYS 68 HZ3 LYS 68 0.891 4.335 -15.725 565 H THR 69 HN THR 69 2.769 0.601 -13.933 566 HA THR 69 HA THR 69 3.984 -1.544 -15.579 567 HB THR 69 HB THR 69 3.877 -2.330 -13.283 568 HG1 THR 69 HG1 THR 69 3.214 -3.746 -14.982 569 HG21 THR 69 HG21 THR 69 2.198 -0.735 -12.455 570 HG22 THR 69 HG22 THR 69 0.957 -1.531 -13.417 571 HG23 THR 69 HG23 THR 69 1.717 -2.390 -12.078 572 H SER 70 HN SER 70 2.212 -3.003 -16.494 573 HA SER 70 HA SER 70 0.158 -1.277 -17.675 574 HB2 SER 70 HB2 SER 70 1.277 -2.487 -19.351 575 HB3 SER 70 HB1 SER 70 1.310 -3.961 -18.389 576 HG SER 70 HG SER 70 -0.785 -2.794 -19.843 577 H ASP 71 HN ASP 71 0.413 -3.058 -15.014 578 HA ASP 71 HA ASP 71 -1.280 -4.916 -14.463 579 HB2 ASP 71 HB2 ASP 71 -0.329 -3.364 -12.759 580 HB3 ASP 71 HB1 ASP 71 -1.668 -2.265 -13.077 581 H ASP 72 HN ASP 72 -2.641 -1.666 -15.233 582 HA ASP 72 HA ASP 72 -4.816 -2.749 -16.661 583 HB2 ASP 72 HB2 ASP 72 -5.656 -3.513 -14.542 584 HB3 ASP 72 HB1 ASP 72 -5.379 -1.937 -13.806 585 H GLY 73 HN GLY 73 -4.106 -1.122 -18.048 586 HA2 GLY 73 HA2 GLY 73 -4.516 0.918 -19.076 587 HA3 GLY 73 HA1 GLY 73 -5.409 1.420 -17.644 588 H GLU 74 HN GLU 74 -4.447 2.733 -16.186 589 HA GLU 74 HA GLU 74 -1.559 3.325 -16.525 590 HB2 GLU 74 HB2 GLU 74 -3.822 5.242 -15.913 591 HB3 GLU 74 HB1 GLU 74 -2.110 5.660 -15.854 592 HG2 GLU 74 HG2 GLU 74 -1.884 5.018 -18.238 593 HG3 GLU 74 HG1 GLU 74 -3.610 4.657 -18.291 594 H VAL 75 HN VAL 75 -0.938 1.945 -14.808 595 HA VAL 75 HA VAL 75 -1.691 2.949 -12.139 596 HB VAL 75 HB VAL 75 -1.465 0.026 -12.860 597 HG11 VAL 75 HG11 VAL 75 -2.634 -0.014 -10.489 598 HG12 VAL 75 HG12 VAL 75 -0.886 0.157 -10.607 599 HG13 VAL 75 HG13 VAL 75 -1.888 1.574 -10.310 600 HG21 VAL 75 HG21 VAL 75 -4.006 0.230 -12.150 601 HG22 VAL 75 HG22 VAL 75 -3.798 1.913 -12.630 602 HG23 VAL 75 HG23 VAL 75 -3.519 0.625 -13.798 603 H TYR 76 HN TYR 76 -0.147 2.694 -10.513 604 HA TYR 76 HA TYR 76 2.583 2.052 -11.477 605 HB2 TYR 76 HB2 TYR 76 1.858 3.934 -9.227 606 HB3 TYR 76 HB1 TYR 76 3.428 3.741 -10.013 607 HD1 TYR 76 HD1 TYR 76 3.730 4.429 -12.400 608 HD2 TYR 76 HD2 TYR 76 0.119 5.261 -10.228 609 HE1 TYR 76 HE1 TYR 76 3.069 6.079 -14.130 610 HE2 TYR 76 HE2 TYR 76 -0.538 6.914 -11.957 611 HH TYR 76 HH TYR 76 -0.085 7.686 -14.027 612 H TYR 77 HN TYR 77 3.985 0.995 -9.921 613 HA TYR 77 HA TYR 77 2.788 -0.042 -7.490 614 HB2 TYR 77 HB2 TYR 77 2.461 -2.245 -8.054 615 HB3 TYR 77 HB1 TYR 77 2.124 -1.501 -9.614 616 HD1 TYR 77 HD2 TYR 77 4.133 -1.217 -11.244 617 HD2 TYR 77 HD1 TYR 77 4.144 -3.876 -7.874 618 HE1 TYR 77 HE2 TYR 77 5.987 -2.505 -12.269 619 HE2 TYR 77 HE1 TYR 77 5.998 -5.166 -8.897 620 HH TYR 77 HH TYR 77 7.599 -5.108 -10.518 621 H SER 78 HN SER 78 4.232 -0.756 -5.970 622 HA SER 78 HA SER 78 7.086 -0.497 -6.671 623 HB2 SER 78 HB2 SER 78 7.420 -0.281 -4.233 624 HB3 SER 78 HB1 SER 78 6.294 0.932 -4.834 625 HG SER 78 HG SER 78 5.359 0.020 -3.053 626 H GLU 79 HN GLU 79 7.724 -2.449 -7.385 627 HA GLU 79 HA GLU 79 6.731 -4.950 -6.619 628 HB2 GLU 79 HB2 GLU 79 8.200 -4.400 -8.619 629 HB3 GLU 79 HB1 GLU 79 9.571 -4.441 -7.511 630 HG2 GLU 79 HG2 GLU 79 7.617 -6.739 -7.759 631 HG3 GLU 79 HG1 GLU 79 9.070 -6.619 -8.746 632 H GLU 80 HN GLU 80 9.451 -3.092 -5.309 633 HA GLU 80 HA GLU 80 10.478 -5.064 -3.599 634 HB2 GLU 80 HB2 GLU 80 11.591 -3.238 -2.444 635 HB3 GLU 80 HB1 GLU 80 11.645 -2.961 -4.185 636 HG2 GLU 80 HG2 GLU 80 9.577 -1.530 -3.930 637 HG3 GLU 80 HG1 GLU 80 9.773 -1.671 -2.184 638 H ALA 81 HN ALA 81 7.822 -2.771 -3.108 639 HA ALA 81 HA ALA 81 7.489 -3.774 -0.348 640 HB1 ALA 81 HB1 ALA 81 6.457 -1.318 -1.762 641 HB2 ALA 81 HB2 ALA 81 7.583 -1.399 -0.408 642 HB3 ALA 81 HB3 ALA 81 5.887 -1.820 -0.170 643 H LYS 82 HN LYS 82 6.139 -4.106 -3.474 644 HA LYS 82 HA LYS 82 4.272 -5.218 -4.238 645 HB2 LYS 82 HB2 LYS 82 3.888 -6.213 -1.409 646 HB3 LYS 82 HB1 LYS 82 3.356 -6.972 -2.907 647 HG2 LYS 82 HG2 LYS 82 5.762 -7.207 -3.578 648 HG3 LYS 82 HG1 LYS 82 6.218 -6.606 -1.983 649 HD2 LYS 82 HD2 LYS 82 4.943 -8.470 -0.941 650 HD3 LYS 82 HD1 LYS 82 4.581 -9.093 -2.552 651 HE2 LYS 82 HE2 LYS 82 6.497 -10.303 -1.715 652 HE3 LYS 82 HE1 LYS 82 7.063 -9.210 -2.978 653 HZ1 LYS 82 HZ1 LYS 82 8.510 -9.067 -1.088 654 HZ2 LYS 82 HZ2 LYS 82 7.646 -7.610 -1.224 655 HZ3 LYS 82 HZ3 LYS 82 7.204 -8.750 -0.048 656 H LYS 83 HN LYS 83 3.750 -2.776 -4.090 657 HA LYS 83 HA LYS 83 1.071 -2.539 -2.896 658 HB2 LYS 83 HB2 LYS 83 2.523 -1.459 -1.268 659 HB3 LYS 83 HB1 LYS 83 3.285 -0.504 -2.540 660 HG2 LYS 83 HG2 LYS 83 1.281 0.722 -2.959 661 HG3 LYS 83 HG1 LYS 83 0.311 -0.403 -2.008 662 HD2 LYS 83 HD2 LYS 83 1.189 0.375 0.039 663 HD3 LYS 83 HD1 LYS 83 2.575 1.137 -0.739 664 HE2 LYS 83 HE2 LYS 83 1.236 2.894 -1.634 665 HE3 LYS 83 HE1 LYS 83 -0.261 2.039 -1.269 666 HZ1 LYS 83 HZ1 LYS 83 0.791 3.923 0.293 667 HZ2 LYS 83 HZ2 LYS 83 -0.207 2.675 0.869 668 HZ3 LYS 83 HZ3 LYS 83 1.478 2.538 0.995 669 H LYS 84 HN LYS 84 -0.340 -1.709 -4.293 670 HA LYS 84 HA LYS 84 0.687 -0.261 -6.671 671 HB2 LYS 84 HB2 LYS 84 -0.103 -2.658 -7.018 672 HB3 LYS 84 HB1 LYS 84 -1.717 -2.080 -6.615 673 HG2 LYS 84 HG2 LYS 84 -1.597 -0.446 -8.453 674 HG3 LYS 84 HG1 LYS 84 0.020 -1.018 -8.848 675 HD2 LYS 84 HD2 LYS 84 -1.592 -2.088 -10.338 676 HD3 LYS 84 HD1 LYS 84 -0.898 -3.292 -9.254 677 HE2 LYS 84 HE2 LYS 84 -3.407 -1.916 -8.368 678 HE3 LYS 84 HE1 LYS 84 -3.538 -3.131 -9.639 679 HZ1 LYS 84 HZ1 LYS 84 -1.943 -4.386 -7.926 680 HZ2 LYS 84 HZ2 LYS 84 -2.850 -3.449 -6.838 681 HZ3 LYS 84 HZ3 LYS 84 -3.637 -4.518 -7.893 682 H VAL 85 HN VAL 85 -0.219 1.610 -7.207 683 HA VAL 85 HA VAL 85 -2.846 2.267 -6.053 684 HB VAL 85 HB VAL 85 -2.177 4.216 -5.067 685 HG11 VAL 85 HG11 VAL 85 -0.998 2.225 -4.079 686 HG12 VAL 85 HG12 VAL 85 0.443 2.739 -4.953 687 HG13 VAL 85 HG13 VAL 85 -0.256 3.781 -3.717 688 HG21 VAL 85 HG21 VAL 85 0.165 5.284 -5.609 689 HG22 VAL 85 HG22 VAL 85 0.061 4.349 -7.096 690 HG23 VAL 85 HG23 VAL 85 -1.166 5.563 -6.728 691 H GLU 86 HN GLU 86 -4.217 2.945 -7.496 692 HA GLU 86 HA GLU 86 -3.218 3.965 -10.102 693 HB2 GLU 86 HB2 GLU 86 -5.224 2.895 -11.095 694 HB3 GLU 86 HB1 GLU 86 -4.150 1.724 -10.337 695 HG2 GLU 86 HG2 GLU 86 -5.577 1.922 -8.250 696 HG3 GLU 86 HG1 GLU 86 -6.725 2.843 -9.220 697 H VAL 87 HN VAL 87 -4.091 5.774 -10.901 698 HA VAL 87 HA VAL 87 -5.554 7.516 -9.250 699 HB VAL 87 HB VAL 87 -4.309 8.550 -10.941 700 HG11 VAL 87 HG11 VAL 87 -3.866 6.753 -12.422 701 HG12 VAL 87 HG12 VAL 87 -5.577 6.510 -12.771 702 HG13 VAL 87 HG13 VAL 87 -4.742 7.931 -13.397 703 HG21 VAL 87 HG21 VAL 87 -6.947 8.642 -12.380 704 HG22 VAL 87 HG22 VAL 87 -6.868 9.245 -10.727 705 HG23 VAL 87 HG23 VAL 87 -5.848 9.959 -11.974 706 H LEU 88 HN LEU 88 -7.403 6.618 -8.458 707 HA LEU 88 HA LEU 88 -9.467 5.604 -10.261 708 HB2 LEU 88 HB2 LEU 88 -8.781 4.870 -7.744 709 HB3 LEU 88 HB1 LEU 88 -10.019 6.058 -7.357 710 HG LEU 88 HG LEU 88 -11.049 3.864 -7.518 711 HD11 LEU 88 HD11 LEU 88 -12.820 4.390 -8.997 712 HD12 LEU 88 HD12 LEU 88 -12.176 5.951 -8.490 713 HD13 LEU 88 HD13 LEU 88 -11.762 5.297 -10.076 714 HD21 LEU 88 HD21 LEU 88 -9.139 3.209 -9.328 715 HD22 LEU 88 HD22 LEU 88 -10.655 2.327 -9.179 716 HD23 LEU 88 HD23 LEU 88 -10.470 3.553 -10.432 717 H ASP 89 HN ASP 89 -8.438 8.433 -8.755 718 HA ASP 89 HA ASP 89 -10.161 10.183 -10.053 719 HB2 ASP 89 HB2 ASP 89 -11.560 9.011 -7.990 720 HB3 ASP 89 HB1 ASP 89 -10.864 10.408 -7.178 721 H THR 90 HN THR 90 -8.820 11.917 -10.204 722 HA THR 90 HA THR 90 -7.307 12.742 -7.847 723 HB THR 90 HB THR 90 -6.096 10.981 -9.412 724 HG1 THR 90 HG1 THR 90 -5.006 13.284 -8.217 725 HG21 THR 90 HG21 THR 90 -5.339 13.599 -10.734 726 HG22 THR 90 HG22 THR 90 -4.754 11.989 -11.146 727 HG23 THR 90 HG23 THR 90 -6.437 12.416 -11.446 728 H ASP 91 HN ASP 91 -7.453 14.830 -7.632 729 HA ASP 91 HA ASP 91 -8.386 16.510 -9.818 730 HB2 ASP 91 HB2 ASP 91 -9.135 16.758 -7.405 731 HB3 ASP 91 HB1 ASP 91 -7.519 17.377 -7.063 732 H TYR 92 HN TYR 92 -5.474 15.769 -8.084 733 HA TYR 92 HA TYR 92 -3.281 16.309 -8.420 734 HB2 TYR 92 HB2 TYR 92 -4.541 16.351 -11.041 735 HB3 TYR 92 HB1 TYR 92 -3.227 17.520 -10.976 736 HD1 TYR 92 HD2 TYR 92 -3.639 14.195 -9.278 737 HD2 TYR 92 HD1 TYR 92 -1.406 16.557 -12.088 738 HE1 TYR 92 HE2 TYR 92 -1.998 12.358 -9.520 739 HE2 TYR 92 HE1 TYR 92 0.232 14.714 -12.329 740 HH TYR 92 HH TYR 92 1.017 12.782 -11.036 741 H LYS 93 HN LYS 93 -5.424 18.499 -7.581 742 HA LYS 93 HA LYS 93 -3.443 20.618 -7.506 743 HB2 LYS 93 HB2 LYS 93 -4.830 20.811 -9.673 744 HB3 LYS 93 HB1 LYS 93 -6.175 21.244 -8.617 745 HG2 LYS 93 HG2 LYS 93 -4.577 22.988 -7.589 746 HG3 LYS 93 HG1 LYS 93 -3.555 22.702 -8.998 747 HD2 LYS 93 HD2 LYS 93 -6.472 23.524 -9.116 748 HD3 LYS 93 HD1 LYS 93 -5.106 24.617 -9.340 749 HE2 LYS 93 HE2 LYS 93 -4.337 23.019 -11.197 750 HE3 LYS 93 HE1 LYS 93 -5.945 22.303 -11.092 751 HZ1 LYS 93 HZ1 LYS 93 -5.128 24.860 -12.164 752 HZ2 LYS 93 HZ2 LYS 93 -6.475 23.898 -12.549 753 HZ3 LYS 93 HZ3 LYS 93 -6.519 24.915 -11.192 754 H SER 94 HN SER 94 -6.420 19.128 -6.491 755 HA SER 94 HA SER 94 -6.467 20.895 -4.109 756 HB2 SER 94 HB2 SER 94 -8.934 19.719 -5.381 757 HB3 SER 94 HB1 SER 94 -8.838 20.961 -4.136 758 HG SER 94 HG SER 94 -7.398 21.649 -6.314 759 H TYR 95 HN TYR 95 -7.837 17.803 -5.322 760 HA TYR 95 HA TYR 95 -6.774 16.395 -3.011 761 HB2 TYR 95 HB2 TYR 95 -9.110 15.526 -2.443 762 HB3 TYR 95 HB1 TYR 95 -8.745 17.180 -1.944 763 HD1 TYR 95 HD2 TYR 95 -10.589 15.085 -4.362 764 HD2 TYR 95 HD1 TYR 95 -9.767 19.092 -3.047 765 HE1 TYR 95 HE2 TYR 95 -12.488 15.922 -5.719 766 HE2 TYR 95 HE1 TYR 95 -11.666 19.927 -4.404 767 HH TYR 95 HH TYR 95 -13.788 17.688 -6.168 768 H ALA 96 HN ALA 96 -7.182 14.031 -3.168 769 HA ALA 96 HA ALA 96 -8.163 13.106 -5.765 770 HB1 ALA 96 HB1 ALA 96 -5.328 12.644 -4.818 771 HB2 ALA 96 HB2 ALA 96 -5.825 13.548 -6.244 772 HB3 ALA 96 HB3 ALA 96 -6.079 11.804 -6.169 773 H VAL 97 HN VAL 97 -8.852 11.041 -5.813 774 HA VAL 97 HA VAL 97 -8.679 9.475 -3.291 775 HB VAL 97 HB VAL 97 -10.917 9.140 -5.285 776 HG11 VAL 97 HG11 VAL 97 -10.732 7.428 -3.598 777 HG12 VAL 97 HG12 VAL 97 -10.562 8.629 -2.320 778 HG13 VAL 97 HG13 VAL 97 -12.098 8.452 -3.163 779 HG21 VAL 97 HG21 VAL 97 -10.644 11.254 -3.142 780 HG22 VAL 97 HG22 VAL 97 -11.120 11.463 -4.826 781 HG23 VAL 97 HG23 VAL 97 -12.222 10.688 -3.687 782 H ILE 98 HN ILE 98 -7.316 7.815 -3.604 783 HA ILE 98 HA ILE 98 -7.201 6.591 -6.294 784 HB ILE 98 HB ILE 98 -4.963 6.720 -4.281 785 HG12 ILE 98 HG12 ILE 98 -5.521 8.663 -6.550 786 HG13 ILE 98 HG11 ILE 98 -5.765 9.029 -4.845 787 HG21 ILE 98 HG21 ILE 98 -5.017 5.115 -6.320 788 HG22 ILE 98 HG22 ILE 98 -4.780 6.571 -7.286 789 HG23 ILE 98 HG23 ILE 98 -3.577 6.104 -6.086 790 HD11 ILE 98 HD11 ILE 98 -3.240 8.779 -6.381 791 HD12 ILE 98 HD12 ILE 98 -3.638 9.842 -5.032 792 HD13 ILE 98 HD13 ILE 98 -3.225 8.157 -4.727 793 H TYR 99 HN TYR 99 -6.935 4.391 -6.426 794 HA TYR 99 HA TYR 99 -7.851 2.884 -4.077 795 HB2 TYR 99 HB2 TYR 99 -8.749 2.734 -6.561 796 HB3 TYR 99 HB1 TYR 99 -7.377 1.652 -6.777 797 HD1 TYR 99 HD1 TYR 99 -10.384 2.259 -4.648 798 HD2 TYR 99 HD2 TYR 99 -7.479 -0.591 -6.023 799 HE1 TYR 99 HE1 TYR 99 -11.679 0.428 -3.590 800 HE2 TYR 99 HE2 TYR 99 -8.773 -2.421 -4.964 801 HH TYR 99 HH TYR 99 -11.959 -1.999 -3.829 802 H ALA 100 HN ALA 100 -6.220 2.400 -2.774 803 HA ALA 100 HA ALA 100 -3.655 1.452 -3.890 804 HB1 ALA 100 HB1 ALA 100 -2.855 1.735 -1.511 805 HB2 ALA 100 HB2 ALA 100 -4.427 2.446 -1.142 806 HB3 ALA 100 HB3 ALA 100 -3.357 3.226 -2.307 807 H THR 101 HN THR 101 -2.880 -0.556 -3.514 808 HA THR 101 HA THR 101 -4.306 -2.325 -1.660 809 HB THR 101 HB THR 101 -5.451 -2.706 -3.765 810 HG1 THR 101 HG1 THR 101 -4.480 -4.945 -4.119 811 HG21 THR 101 HG21 THR 101 -4.301 -3.279 -5.791 812 HG22 THR 101 HG22 THR 101 -3.537 -1.817 -5.167 813 HG23 THR 101 HG23 THR 101 -2.753 -3.383 -4.953 814 H ARG 102 HN ARG 102 -3.014 -3.650 -0.608 815 HA ARG 102 HA ARG 102 -0.248 -4.065 -1.588 816 HB2 ARG 102 HB2 ARG 102 -0.398 -2.529 0.402 817 HB3 ARG 102 HB1 ARG 102 -1.122 -3.859 1.306 818 HG2 ARG 102 HG2 ARG 102 0.924 -5.237 0.717 819 HG3 ARG 102 HG1 ARG 102 1.647 -3.757 0.086 820 HD2 ARG 102 HD2 ARG 102 1.250 -2.688 2.324 821 HD3 ARG 102 HD1 ARG 102 0.721 -4.257 2.926 822 HE ARG 102 HE ARG 102 2.947 -4.917 2.997 823 HH11 ARG 102 HH21 ARG 102 2.546 -2.089 1.043 824 HH12 ARG 102 HH22 ARG 102 4.246 -1.821 0.837 825 HH21 ARG 102 HH11 ARG 102 5.177 -4.572 2.732 826 HH22 ARG 102 HH12 ARG 102 5.735 -3.228 1.794 827 H VAL 103 HN VAL 103 0.303 -6.219 -1.815 828 HA VAL 103 HA VAL 103 -1.535 -8.174 -0.564 829 HB VAL 103 HB VAL 103 -1.708 -8.084 -3.016 830 HG11 VAL 103 HG11 VAL 103 1.135 -9.058 -3.212 831 HG12 VAL 103 HG12 VAL 103 0.116 -8.342 -4.460 832 HG13 VAL 103 HG13 VAL 103 0.791 -7.329 -3.184 833 HG21 VAL 103 HG21 VAL 103 -0.265 -10.558 -2.003 834 HG22 VAL 103 HG22 VAL 103 -1.997 -10.255 -1.881 835 HG23 VAL 103 HG23 VAL 103 -1.250 -10.472 -3.461 836 H LYS 104 HN LYS 104 -0.628 -9.264 1.043 837 HA LYS 104 HA LYS 104 2.287 -9.563 1.148 838 HB2 LYS 104 HB2 LYS 104 0.786 -8.765 3.116 839 HB3 LYS 104 HB1 LYS 104 0.328 -10.460 3.261 840 HG2 LYS 104 HG2 LYS 104 2.666 -11.104 3.559 841 HG3 LYS 104 HG1 LYS 104 3.184 -9.438 3.303 842 HD2 LYS 104 HD2 LYS 104 1.678 -8.826 5.285 843 HD3 LYS 104 HD1 LYS 104 1.590 -10.556 5.615 844 HE2 LYS 104 HE2 LYS 104 3.398 -9.788 6.946 845 HE3 LYS 104 HE1 LYS 104 4.165 -10.526 5.540 846 HZ1 LYS 104 HZ1 LYS 104 3.719 -7.960 4.762 847 HZ2 LYS 104 HZ2 LYS 104 4.165 -7.790 6.393 848 HZ3 LYS 104 HZ3 LYS 104 5.201 -8.585 5.311 849 H ASP 105 HN ASP 105 3.040 -11.771 1.945 850 HA ASP 105 HA ASP 105 2.344 -13.731 0.072 851 HB2 ASP 105 HB2 ASP 105 3.686 -14.016 2.768 852 HB3 ASP 105 HB1 ASP 105 3.610 -15.290 1.552 853 H GLY 106 HN GLY 106 0.368 -14.562 -0.103 854 HA2 GLY 106 HA2 GLY 106 -1.272 -16.127 0.478 855 HA3 GLY 106 HA1 GLY 106 -0.746 -16.037 2.151 856 H ARG 107 HN ARG 107 -1.032 -12.877 1.384 857 HA ARG 107 HA ARG 107 -3.955 -12.790 1.881 858 HB2 ARG 107 HB2 ARG 107 -1.925 -11.063 3.305 859 HB3 ARG 107 HB1 ARG 107 -3.665 -11.118 3.588 860 HG2 ARG 107 HG2 ARG 107 -3.356 -13.600 4.124 861 HG3 ARG 107 HG1 ARG 107 -1.624 -13.272 4.165 862 HD2 ARG 107 HD2 ARG 107 -2.347 -13.038 6.417 863 HD3 ARG 107 HD1 ARG 107 -2.174 -11.391 5.816 864 HE ARG 107 HE ARG 107 -4.839 -12.454 5.482 865 HH11 ARG 107 HH21 ARG 107 -2.595 -10.902 7.611 866 HH12 ARG 107 HH22 ARG 107 -3.820 -10.158 8.583 867 HH21 ARG 107 HH11 ARG 107 -6.451 -11.482 6.752 868 HH22 ARG 107 HH12 ARG 107 -6.003 -10.487 8.098 869 H THR 108 HN THR 108 -5.070 -11.109 1.024 870 HA THR 108 HA THR 108 -3.589 -9.127 -0.608 871 HB THR 108 HB THR 108 -6.197 -10.467 -1.363 872 HG1 THR 108 HG1 THR 108 -4.509 -11.104 -3.118 873 HG21 THR 108 HG21 THR 108 -5.718 -9.356 -3.557 874 HG22 THR 108 HG22 THR 108 -6.015 -8.214 -2.248 875 HG23 THR 108 HG23 THR 108 -4.366 -8.521 -2.792 876 H LEU 109 HN LEU 109 -4.434 -7.035 -0.607 877 HA LEU 109 HA LEU 109 -6.957 -6.547 0.786 878 HB2 LEU 109 HB2 LEU 109 -5.972 -6.221 2.779 879 HB3 LEU 109 HB1 LEU 109 -4.366 -6.306 2.077 880 HG LEU 109 HG LEU 109 -4.715 -3.859 1.359 881 HD11 LEU 109 HD11 LEU 109 -6.559 -2.686 2.049 882 HD12 LEU 109 HD12 LEU 109 -7.321 -4.273 2.089 883 HD13 LEU 109 HD13 LEU 109 -6.683 -3.564 3.570 884 HD21 LEU 109 HD21 LEU 109 -3.225 -4.309 3.151 885 HD22 LEU 109 HD22 LEU 109 -4.324 -3.074 3.768 886 HD23 LEU 109 HD23 LEU 109 -4.541 -4.761 4.236 887 H HIS 110 HN HIS 110 -7.909 -4.627 0.370 888 HA HIS 110 HA HIS 110 -6.557 -2.770 -1.493 889 HB2 HIS 110 HB2 HIS 110 -8.841 -2.417 -2.514 890 HB3 HIS 110 HB1 HIS 110 -8.140 -4.003 -2.827 891 HD1 HIS 110 HD1 HIS 110 -8.968 -5.956 -1.108 892 HD2 HIS 110 HD2 HIS 110 -11.321 -2.519 -1.274 893 HE1 HIS 110 HE1 HIS 110 -11.201 -6.567 -0.082 894 H MET 111 HN MET 111 -7.136 -0.499 -1.184 895 HA MET 111 HA MET 111 -9.016 0.168 0.901 896 HB2 MET 111 HB2 MET 111 -7.082 1.489 2.088 897 HB3 MET 111 HB1 MET 111 -7.310 -0.225 2.441 898 HG2 MET 111 HG2 MET 111 -5.524 -0.864 1.004 899 HG3 MET 111 HG1 MET 111 -5.459 0.729 0.251 900 HE1 MET 111 HE1 MET 111 -4.724 2.754 1.165 901 HE2 MET 111 HE2 MET 111 -3.388 2.888 2.305 902 HE3 MET 111 HE3 MET 111 -3.184 1.983 0.799 903 H MET 112 HN MET 112 -9.435 2.446 1.014 904 HA MET 112 HA MET 112 -8.617 3.882 -1.441 905 HB2 MET 112 HB2 MET 112 -10.624 5.158 0.331 906 HB3 MET 112 HB1 MET 112 -10.608 5.006 -1.415 907 HG2 MET 112 HG2 MET 112 -11.133 2.577 0.285 908 HG3 MET 112 HG1 MET 112 -12.421 3.736 -0.014 909 HE1 MET 112 HE1 MET 112 -12.941 4.722 -2.043 910 HE2 MET 112 HE2 MET 112 -11.807 4.614 -3.387 911 HE3 MET 112 HE3 MET 112 -13.345 3.745 -3.450 912 H ARG 113 HN ARG 113 -7.573 5.847 -1.339 913 HA ARG 113 HA ARG 113 -6.836 6.837 1.358 914 HB2 ARG 113 HB2 ARG 113 -4.917 5.675 0.534 915 HB3 ARG 113 HB1 ARG 113 -5.074 6.408 -1.056 916 HG2 ARG 113 HG2 ARG 113 -4.827 8.319 1.220 917 HG3 ARG 113 HG1 ARG 113 -3.395 7.351 0.888 918 HD2 ARG 113 HD2 ARG 113 -3.784 8.076 -1.602 919 HD3 ARG 113 HD1 ARG 113 -4.773 9.349 -0.892 920 HE ARG 113 HE ARG 113 -2.415 9.442 0.511 921 HH11 ARG 113 HH21 ARG 113 -3.359 9.554 -2.814 922 HH12 ARG 113 HH22 ARG 113 -2.027 10.548 -3.303 923 HH21 ARG 113 HH11 ARG 113 -0.666 10.747 -0.120 924 HH22 ARG 113 HH12 ARG 113 -0.502 11.223 -1.778 925 H LEU 114 HN LEU 114 -7.189 8.944 1.666 926 HA LEU 114 HA LEU 114 -7.767 10.640 -0.689 927 HB2 LEU 114 HB2 LEU 114 -9.730 10.338 0.690 928 HB3 LEU 114 HB1 LEU 114 -8.819 10.723 2.135 929 HG LEU 114 HG LEU 114 -8.498 13.018 1.405 930 HD11 LEU 114 HD11 LEU 114 -8.233 12.907 -0.933 931 HD12 LEU 114 HD12 LEU 114 -9.709 11.968 -1.148 932 HD13 LEU 114 HD13 LEU 114 -9.804 13.684 -0.750 933 HD21 LEU 114 HD21 LEU 114 -10.599 12.566 2.565 934 HD22 LEU 114 HD22 LEU 114 -10.892 13.749 1.291 935 HD23 LEU 114 HD23 LEU 114 -11.360 12.066 1.055 936 H TYR 115 HN TYR 115 -6.423 12.240 -1.049 937 HA TYR 115 HA TYR 115 -4.694 13.202 1.145 938 HB2 TYR 115 HB2 TYR 115 -2.861 12.796 -0.139 939 HB3 TYR 115 HB1 TYR 115 -3.928 11.870 -1.181 940 HD1 TYR 115 HD1 TYR 115 -5.473 13.561 -2.729 941 HD2 TYR 115 HD2 TYR 115 -1.505 14.324 -1.277 942 HE1 TYR 115 HE1 TYR 115 -5.104 15.169 -4.581 943 HE2 TYR 115 HE2 TYR 115 -1.140 15.936 -3.128 944 HH TYR 115 HH TYR 115 -3.427 17.332 -4.825 945 H SER 116 HN SER 116 -3.923 15.402 0.918 946 HA SER 116 HA SER 116 -5.811 17.174 -0.533 947 HB2 SER 116 HB2 SER 116 -6.075 17.340 1.917 948 HB3 SER 116 HB1 SER 116 -4.352 17.680 2.081 949 HG SER 116 HG SER 116 -4.708 19.526 0.746 950 H ARG 117 HN ARG 117 -4.876 19.040 -1.566 951 HA ARG 117 HA ARG 117 -2.118 18.654 -2.353 952 HB2 ARG 117 HB2 ARG 117 -3.725 19.346 -4.030 953 HB3 ARG 117 HB1 ARG 117 -4.192 20.739 -3.070 954 HG2 ARG 117 HG2 ARG 117 -2.623 21.331 -4.919 955 HG3 ARG 117 HG1 ARG 117 -1.975 21.726 -3.332 956 HD2 ARG 117 HD2 ARG 117 -0.504 19.856 -3.353 957 HD3 ARG 117 HD1 ARG 117 -1.358 19.102 -4.697 958 HE ARG 117 HE ARG 117 -0.088 20.405 -6.135 959 HH11 ARG 117 HH21 ARG 117 -0.069 21.714 -2.932 960 HH12 ARG 117 HH22 ARG 117 1.108 22.935 -3.288 961 HH21 ARG 117 HH11 ARG 117 1.463 22.002 -6.607 962 HH22 ARG 117 HH12 ARG 117 1.974 23.098 -5.367 963 H SER 118 HN SER 118 -3.980 20.651 -0.228 964 HA SER 118 HA SER 118 -1.548 22.163 0.538 965 HB2 SER 118 HB2 SER 118 -3.248 23.582 -0.539 966 HB3 SER 118 HB1 SER 118 -4.439 23.055 0.646 967 HG SER 118 HG SER 118 -3.352 25.081 1.128 968 HA PRO 119 HA PRO 119 -1.588 20.418 4.607 969 HB2 PRO 119 HB2 PRO 119 -1.827 23.293 5.460 970 HB3 PRO 119 HB1 PRO 119 -0.759 22.020 6.089 971 HG2 PRO 119 HG2 PRO 119 0.108 23.891 4.365 972 HG3 PRO 119 HG1 PRO 119 0.739 22.238 4.365 973 HD2 PRO 119 HD2 PRO 119 -0.966 23.566 2.359 974 HD3 PRO 119 HD1 PRO 119 -0.007 22.080 2.208 975 H GLU 120 HN GLU 120 -4.014 22.687 3.540 976 HA GLU 120 HA GLU 120 -5.838 22.081 5.725 977 HB2 GLU 120 HB2 GLU 120 -6.367 23.706 3.234 978 HB3 GLU 120 HB1 GLU 120 -7.274 23.731 4.746 979 HG2 GLU 120 HG2 GLU 120 -5.228 24.555 5.915 980 HG3 GLU 120 HG1 GLU 120 -4.403 24.627 4.360 981 H VAL 121 HN VAL 121 -8.010 21.353 5.239 982 HA VAL 121 HA VAL 121 -8.089 19.421 2.989 983 HB VAL 121 HB VAL 121 -9.478 19.197 5.669 984 HG11 VAL 121 HG11 VAL 121 -9.264 17.420 3.232 985 HG12 VAL 121 HG12 VAL 121 -9.701 16.786 4.818 986 HG13 VAL 121 HG13 VAL 121 -10.725 17.992 4.039 987 HG21 VAL 121 HG21 VAL 121 -7.803 17.325 5.995 988 HG22 VAL 121 HG22 VAL 121 -6.947 17.932 4.579 989 HG23 VAL 121 HG23 VAL 121 -7.101 18.943 6.016 990 H SER 122 HN SER 122 -9.601 19.782 1.510 991 HA SER 122 HA SER 122 -11.576 21.850 1.907 992 HB2 SER 122 HB2 SER 122 -10.555 21.724 -0.262 993 HB3 SER 122 HB1 SER 122 -10.958 20.017 -0.414 994 HG SER 122 HG SER 122 -12.672 22.267 -0.430 995 HA PRO 123 HA PRO 123 -14.782 19.105 3.297 996 HB2 PRO 123 HB2 PRO 123 -17.001 20.571 2.610 997 HB3 PRO 123 HB1 PRO 123 -15.960 20.965 3.993 998 HG2 PRO 123 HG2 PRO 123 -16.008 22.165 1.261 999 HG3 PRO 123 HG1 PRO 123 -15.824 22.956 2.838 1000 HD2 PRO 123 HD2 PRO 123 -13.701 22.456 1.199 1001 HD3 PRO 123 HD1 PRO 123 -13.557 22.468 2.972 1002 H ALA 124 HN ALA 124 -14.705 20.272 -0.001 1003 HA ALA 124 HA ALA 124 -16.726 18.515 -1.026 1004 HB1 ALA 124 HB1 ALA 124 -14.474 19.779 -2.591 1005 HB2 ALA 124 HB2 ALA 124 -15.917 20.668 -2.107 1006 HB3 ALA 124 HB3 ALA 124 -16.057 19.279 -3.185 1007 H ALA 125 HN ALA 125 -13.254 18.346 -0.562 1008 HA ALA 125 HA ALA 125 -12.702 16.085 -2.156 1009 HB1 ALA 125 HB1 ALA 125 -11.351 17.004 0.393 1010 HB2 ALA 125 HB2 ALA 125 -10.949 17.549 -1.234 1011 HB3 ALA 125 HB3 ALA 125 -10.680 15.868 -0.774 1012 H THR 126 HN THR 126 -13.851 16.449 1.135 1013 HA THR 126 HA THR 126 -13.652 13.653 1.779 1014 HB THR 126 HB THR 126 -15.453 15.555 3.245 1015 HG1 THR 126 HG1 THR 126 -12.636 15.512 3.157 1016 HG21 THR 126 HG21 THR 126 -15.397 13.265 4.054 1017 HG22 THR 126 HG22 THR 126 -13.635 13.261 4.043 1018 HG23 THR 126 HG23 THR 126 -14.508 14.273 5.194 1019 H ALA 127 HN ALA 127 -16.139 15.761 0.407 1020 HA ALA 127 HA ALA 127 -18.279 13.907 0.759 1021 HB1 ALA 127 HB1 ALA 127 -19.455 15.438 -0.796 1022 HB2 ALA 127 HB2 ALA 127 -17.942 16.320 -1.013 1023 HB3 ALA 127 HB3 ALA 127 -18.712 16.267 0.573 1024 H ILE 128 HN ILE 128 -16.277 14.836 -2.084 1025 HA ILE 128 HA ILE 128 -17.562 13.146 -3.930 1026 HB ILE 128 HB ILE 128 -15.711 15.001 -4.215 1027 HG12 ILE 128 HG12 ILE 128 -16.793 13.935 -6.095 1028 HG13 ILE 128 HG11 ILE 128 -15.059 13.989 -6.382 1029 HG21 ILE 128 HG21 ILE 128 -13.959 12.530 -4.173 1030 HG22 ILE 128 HG22 ILE 128 -13.459 14.194 -4.471 1031 HG23 ILE 128 HG23 ILE 128 -14.015 13.715 -2.869 1032 HD11 ILE 128 HD11 ILE 128 -16.774 11.624 -5.667 1033 HD12 ILE 128 HD12 ILE 128 -15.611 11.784 -6.982 1034 HD13 ILE 128 HD13 ILE 128 -15.045 11.600 -5.323 1035 H PHE 129 HN PHE 129 -14.994 12.761 -1.673 1036 HA PHE 129 HA PHE 129 -14.055 10.201 -2.131 1037 HB2 PHE 129 HB2 PHE 129 -13.168 11.727 -0.403 1038 HB3 PHE 129 HB1 PHE 129 -14.612 11.434 0.562 1039 HD1 PHE 129 HD1 PHE 129 -15.072 9.235 1.541 1040 HD2 PHE 129 HD2 PHE 129 -11.484 9.995 -0.684 1041 HE1 PHE 129 HE1 PHE 129 -14.087 7.138 2.419 1042 HE2 PHE 129 HE2 PHE 129 -10.487 7.901 0.205 1043 HZ PHE 129 HZ PHE 129 -11.796 6.476 1.760 1044 H ARG 130 HN ARG 130 -16.923 11.229 -0.323 1045 HA ARG 130 HA ARG 130 -17.698 8.623 0.524 1046 HB2 ARG 130 HB2 ARG 130 -18.484 10.524 1.758 1047 HB3 ARG 130 HB1 ARG 130 -19.226 11.221 0.320 1048 HG2 ARG 130 HG2 ARG 130 -20.906 9.546 0.236 1049 HG3 ARG 130 HG1 ARG 130 -20.036 8.504 1.362 1050 HD2 ARG 130 HD2 ARG 130 -20.360 10.211 3.144 1051 HD3 ARG 130 HD1 ARG 130 -21.301 11.181 2.013 1052 HE ARG 130 HE ARG 130 -22.339 8.523 2.207 1053 HH11 ARG 130 HH21 ARG 130 -22.131 11.582 3.813 1054 HH12 ARG 130 HH22 ARG 130 -23.623 11.388 4.670 1055 HH21 ARG 130 HH11 ARG 130 -24.296 8.263 3.328 1056 HH22 ARG 130 HH12 ARG 130 -24.850 9.509 4.396 1057 H LYS 131 HN LYS 131 -18.617 10.628 -2.277 1058 HA LYS 131 HA LYS 131 -20.809 9.247 -3.198 1059 HB2 LYS 131 HB2 LYS 131 -19.834 11.312 -4.216 1060 HB3 LYS 131 HB1 LYS 131 -18.585 10.308 -4.951 1061 HG2 LYS 131 HG2 LYS 131 -20.332 8.990 -6.108 1062 HG3 LYS 131 HG1 LYS 131 -21.572 10.019 -5.390 1063 HD2 LYS 131 HD2 LYS 131 -20.608 11.986 -6.512 1064 HD3 LYS 131 HD1 LYS 131 -19.347 10.973 -7.217 1065 HE2 LYS 131 HE2 LYS 131 -22.328 10.666 -7.693 1066 HE3 LYS 131 HE1 LYS 131 -21.170 11.351 -8.835 1067 HZ1 LYS 131 HZ1 LYS 131 -21.318 9.165 -9.506 1068 HZ2 LYS 131 HZ2 LYS 131 -19.951 9.125 -8.499 1069 HZ3 LYS 131 HZ3 LYS 131 -21.443 8.564 -7.921 1070 H LEU 132 HN LEU 132 -17.456 8.603 -4.290 1071 HA LEU 132 HA LEU 132 -18.132 6.213 -5.646 1072 HB2 LEU 132 HB2 LEU 132 -15.641 5.734 -5.461 1073 HB3 LEU 132 HB1 LEU 132 -16.089 7.236 -6.258 1074 HG LEU 132 HG LEU 132 -15.889 7.973 -3.557 1075 HD11 LEU 132 HD11 LEU 132 -13.442 6.331 -4.201 1076 HD12 LEU 132 HD12 LEU 132 -13.903 7.056 -2.662 1077 HD13 LEU 132 HD13 LEU 132 -14.790 5.664 -3.281 1078 HD21 LEU 132 HD21 LEU 132 -15.087 9.194 -5.619 1079 HD22 LEU 132 HD22 LEU 132 -13.962 9.241 -4.268 1080 HD23 LEU 132 HD23 LEU 132 -13.670 8.144 -5.615 1081 H ALA 133 HN ALA 133 -16.939 6.834 -2.370 1082 HA ALA 133 HA ALA 133 -16.573 4.169 -1.580 1083 HB1 ALA 133 HB1 ALA 133 -16.512 4.962 0.627 1084 HB2 ALA 133 HB2 ALA 133 -17.603 6.300 0.274 1085 HB3 ALA 133 HB3 ALA 133 -15.948 6.328 -0.330 1086 H GLY 134 HN GLY 134 -19.492 6.189 -1.710 1087 HA2 GLY 134 HA2 GLY 134 -21.190 4.404 -0.300 1088 HA3 GLY 134 HA1 GLY 134 -21.707 5.664 -1.420 1089 H GLU 135 HN GLU 135 -20.267 4.788 -3.683 1090 HA GLU 135 HA GLU 135 -22.067 2.896 -4.774 1091 HB2 GLU 135 HB2 GLU 135 -19.358 3.849 -5.736 1092 HB3 GLU 135 HB1 GLU 135 -20.436 2.821 -6.679 1093 HG2 GLU 135 HG2 GLU 135 -22.202 4.552 -6.521 1094 HG3 GLU 135 HG1 GLU 135 -21.089 5.589 -5.631 1095 H ARG 136 HN ARG 136 -19.327 2.592 -2.764 1096 HA ARG 136 HA ARG 136 -18.877 -0.218 -3.529 1097 HB2 ARG 136 HB2 ARG 136 -16.982 1.540 -3.177 1098 HB3 ARG 136 HB1 ARG 136 -17.300 1.304 -1.460 1099 HG2 ARG 136 HG2 ARG 136 -16.915 -1.118 -1.712 1100 HG3 ARG 136 HG1 ARG 136 -16.617 -0.896 -3.436 1101 HD2 ARG 136 HD2 ARG 136 -14.471 -0.983 -2.345 1102 HD3 ARG 136 HD1 ARG 136 -14.752 0.689 -2.822 1103 HE ARG 136 HE ARG 136 -15.712 0.596 -0.272 1104 HH11 ARG 136 HH21 ARG 136 -12.761 -0.359 -1.808 1105 HH12 ARG 136 HH22 ARG 136 -11.779 -0.071 -0.411 1106 HH21 ARG 136 HH11 ARG 136 -14.430 0.977 1.564 1107 HH22 ARG 136 HH12 ARG 136 -12.724 0.685 1.499 1108 H ASN 137 HN ASN 137 -21.012 1.343 -1.762 1109 HA ASN 137 HA ASN 137 -22.324 0.866 0.079 1110 HB2 ASN 137 HB2 ASN 137 -21.113 -1.844 -0.294 1111 HB3 ASN 137 HB1 ASN 137 -22.601 -1.497 0.578 1112 HD21 ASN 137 HD21 ASN 137 -21.348 -2.311 -2.496 1113 HD22 ASN 137 HD22 ASN 137 -22.737 -1.964 -3.405 1114 H TYR 138 HN TYR 138 -19.735 1.886 0.653 1115 HA TYR 138 HA TYR 138 -18.671 0.378 2.906 1116 HB2 TYR 138 HB2 TYR 138 -16.856 1.808 2.823 1117 HB3 TYR 138 HB1 TYR 138 -17.417 1.944 1.157 1118 HD1 TYR 138 HD1 TYR 138 -19.798 3.623 1.378 1119 HD2 TYR 138 HD2 TYR 138 -16.041 3.929 3.432 1120 HE1 TYR 138 HE1 TYR 138 -20.185 6.048 1.722 1121 HE2 TYR 138 HE2 TYR 138 -16.430 6.346 3.769 1122 HH TYR 138 HH TYR 138 -19.227 7.803 3.632 1123 H THR 139 HN THR 139 -18.282 1.601 5.002 1124 HA THR 139 HA THR 139 -20.626 3.284 5.701 1125 HB THR 139 HB THR 139 -21.090 2.018 7.538 1126 HG1 THR 139 HG1 THR 139 -18.671 0.936 8.125 1127 HG21 THR 139 HG21 THR 139 -20.648 0.377 5.546 1128 HG22 THR 139 HG22 THR 139 -19.228 -0.094 6.477 1129 HG23 THR 139 HG23 THR 139 -20.834 -0.282 7.170 1130 H ASP 140 HN ASP 140 -20.245 4.918 7.322 1131 HA ASP 140 HA ASP 140 -18.045 6.474 6.986 1132 HB2 ASP 140 HB2 ASP 140 -20.093 7.102 8.268 1133 HB3 ASP 140 HB1 ASP 140 -19.470 6.179 9.634 1134 H GLU 141 HN GLU 141 -18.347 4.082 9.677 1135 HA GLU 141 HA GLU 141 -15.870 4.530 10.815 1136 HB2 GLU 141 HB2 GLU 141 -17.726 3.018 11.655 1137 HB3 GLU 141 HB1 GLU 141 -17.121 1.796 10.537 1138 HG2 GLU 141 HG2 GLU 141 -14.910 1.886 11.607 1139 HG3 GLU 141 HG1 GLU 141 -15.482 3.140 12.706 1140 H MET 142 HN MET 142 -16.582 3.112 7.760 1141 HA MET 142 HA MET 142 -14.153 1.585 7.533 1142 HB2 MET 142 HB2 MET 142 -15.916 2.546 5.284 1143 HB3 MET 142 HB1 MET 142 -14.823 1.170 5.286 1144 HG2 MET 142 HG2 MET 142 -16.338 0.466 7.396 1145 HG3 MET 142 HG1 MET 142 -17.517 1.440 6.533 1146 HE1 MET 142 HE1 MET 142 -15.432 -2.369 5.561 1147 HE2 MET 142 HE2 MET 142 -14.665 -1.068 4.655 1148 HE3 MET 142 HE3 MET 142 -14.833 -0.949 6.410 1149 H VAL 143 HN VAL 143 -14.930 4.863 7.263 1150 HA VAL 143 HA VAL 143 -12.319 5.404 5.957 1151 HB VAL 143 HB VAL 143 -14.245 5.989 4.455 1152 HG11 VAL 143 HG11 VAL 143 -15.598 7.965 5.017 1153 HG12 VAL 143 HG12 VAL 143 -15.841 6.693 6.211 1154 HG13 VAL 143 HG13 VAL 143 -14.817 8.079 6.583 1155 HG21 VAL 143 HG21 VAL 143 -12.277 7.165 3.954 1156 HG22 VAL 143 HG22 VAL 143 -13.430 8.472 4.213 1157 HG23 VAL 143 HG23 VAL 143 -12.286 8.038 5.481 1158 H ALA 144 HN ALA 144 -10.940 6.520 7.183 1159 HA ALA 144 HA ALA 144 -12.061 7.972 9.524 1160 HB1 ALA 144 HB1 ALA 144 -10.035 7.453 10.700 1161 HB2 ALA 144 HB2 ALA 144 -9.292 6.802 9.239 1162 HB3 ALA 144 HB3 ALA 144 -10.645 5.958 9.992 1163 H MET 145 HN MET 145 -11.991 10.126 9.347 1164 HA MET 145 HA MET 145 -10.210 11.480 7.581 1165 HB2 MET 145 HB2 MET 145 -12.368 12.378 7.649 1166 HB3 MET 145 HB1 MET 145 -12.542 12.075 9.369 1167 HG2 MET 145 HG2 MET 145 -11.788 14.123 9.882 1168 HG3 MET 145 HG1 MET 145 -10.373 13.901 8.880 1169 HE1 MET 145 HE1 MET 145 -10.483 13.666 6.502 1170 HE2 MET 145 HE2 MET 145 -12.054 13.586 5.710 1171 HE3 MET 145 HE3 MET 145 -11.040 15.021 5.524 1172 H LEU 146 HN LEU 146 -8.448 12.797 8.290 1173 HA LEU 146 HA LEU 146 -7.694 12.437 11.090 1174 HB2 LEU 146 HB2 LEU 146 -6.535 11.305 8.901 1175 HB3 LEU 146 HB1 LEU 146 -5.580 12.775 9.048 1176 HG LEU 146 HG LEU 146 -5.032 12.238 11.299 1177 HD11 LEU 146 HD11 LEU 146 -6.605 11.036 12.470 1178 HD12 LEU 146 HD12 LEU 146 -7.176 10.219 11.016 1179 HD13 LEU 146 HD13 LEU 146 -5.738 9.642 11.851 1180 HD21 LEU 146 HD21 LEU 146 -3.760 11.211 9.390 1181 HD22 LEU 146 HD22 LEU 146 -3.609 10.361 10.928 1182 HD23 LEU 146 HD23 LEU 146 -4.677 9.734 9.682 1183 HA PRO 147 HA PRO 147 -7.377 16.912 11.225 1184 HB2 PRO 147 HB2 PRO 147 -6.209 17.194 13.641 1185 HB3 PRO 147 HB1 PRO 147 -7.871 16.584 13.482 1186 HG2 PRO 147 HG2 PRO 147 -5.327 15.032 13.812 1187 HG3 PRO 147 HG1 PRO 147 -6.849 14.877 14.710 1188 HD2 PRO 147 HD2 PRO 147 -6.243 13.238 12.671 1189 HD3 PRO 147 HD1 PRO 147 -7.913 13.742 12.982 1190 H ARG 148 HN ARG 148 -5.745 18.644 11.468 1191 HA ARG 148 HA ARG 148 -3.396 18.143 9.963 1192 HB2 ARG 148 HB2 ARG 148 -4.330 20.553 11.508 1193 HB3 ARG 148 HB1 ARG 148 -2.882 20.539 10.500 1194 HG2 ARG 148 HG2 ARG 148 -4.144 20.103 8.521 1195 HG3 ARG 148 HG1 ARG 148 -5.595 19.718 9.447 1196 HD2 ARG 148 HD2 ARG 148 -5.404 22.075 8.346 1197 HD3 ARG 148 HD1 ARG 148 -5.996 21.959 10.000 1198 HE ARG 148 HE ARG 148 -4.054 23.022 10.719 1199 HH11 ARG 148 HH21 ARG 148 -3.751 21.916 7.454 1200 HH12 ARG 148 HH22 ARG 148 -2.249 22.731 7.172 1201 HH21 ARG 148 HH11 ARG 148 -2.085 24.094 10.356 1202 HH22 ARG 148 HH12 ARG 148 -1.306 23.965 8.815 1203 H GLN 149 HN GLN 149 -3.903 17.760 13.324 1204 HA GLN 149 HA GLN 149 -1.658 18.629 14.586 1205 HB2 GLN 149 HB2 GLN 149 -2.734 15.806 14.817 1206 HB3 GLN 149 HB1 GLN 149 -1.747 16.646 16.014 1207 HG2 GLN 149 HG2 GLN 149 -4.408 17.710 15.049 1208 HG3 GLN 149 HG1 GLN 149 -4.252 16.667 16.461 1209 HE21 GLN 149 HE21 GLN 149 -3.242 17.560 18.379 1210 HE22 GLN 149 HE22 GLN 149 -2.917 19.219 18.527 1211 H GLU 150 HN GLU 150 0.504 18.431 14.328 1212 HA GLU 150 HA GLU 150 1.525 16.187 12.671 1213 HB2 GLU 150 HB2 GLU 150 3.106 17.707 11.641 1214 HB3 GLU 150 HB1 GLU 150 1.470 18.323 11.409 1215 HG2 GLU 150 HG2 GLU 150 1.824 19.743 13.481 1216 HG3 GLU 150 HG1 GLU 150 3.521 19.267 13.426 1217 H GLU 151 HN GLU 151 3.303 15.163 13.361 1218 HA GLU 151 HA GLU 151 4.699 16.222 15.753 1219 HB2 GLU 151 HB2 GLU 151 3.201 14.109 16.018 1220 HB3 GLU 151 HB1 GLU 151 4.468 13.283 15.113 1221 HG2 GLU 151 HG2 GLU 151 4.955 14.895 17.635 1222 HG3 GLU 151 HG1 GLU 151 4.769 13.143 17.599 1223 H CYS 152 HN CYS 152 4.838 14.624 12.657 1224 HA CYS 152 HA CYS 152 7.722 15.204 12.477 1225 HB2 CYS 152 HB2 CYS 152 6.373 12.551 12.032 1226 HB3 CYS 152 HB1 CYS 152 7.864 12.958 11.192 1227 H THR 153 HN THR 153 8.483 15.188 10.217 1228 HA THR 153 HA THR 153 6.471 15.344 8.118 1229 HB THR 153 HB THR 153 7.176 17.651 7.460 1230 HG1 THR 153 HG1 THR 153 8.905 17.198 9.465 1231 HG21 THR 153 HG21 THR 153 5.718 18.754 8.987 1232 HG22 THR 153 HG22 THR 153 5.134 17.094 8.904 1233 HG23 THR 153 HG23 THR 153 6.096 17.623 10.284 1234 H VAL 154 HN VAL 154 7.493 15.632 5.958 1235 HA VAL 154 HA VAL 154 9.826 14.052 5.708 1236 HB VAL 154 HB VAL 154 9.570 14.383 3.364 1237 HG11 VAL 154 HG11 VAL 154 7.022 14.110 3.077 1238 HG12 VAL 154 HG12 VAL 154 7.866 12.926 4.072 1239 HG13 VAL 154 HG13 VAL 154 6.948 14.223 4.834 1240 HG21 VAL 154 HG21 VAL 154 7.829 16.128 2.573 1241 HG22 VAL 154 HG22 VAL 154 8.009 16.825 4.184 1242 HG23 VAL 154 HG23 VAL 154 9.402 16.722 3.106 1243 H ASP 155 HN ASP 155 11.741 14.766 4.573 1244 HA ASP 155 HA ASP 155 12.771 17.214 5.697 1245 HB2 ASP 155 HB2 ASP 155 14.291 15.370 5.558 1246 HB3 ASP 155 HB1 ASP 155 14.019 15.203 3.831 1247 H GLU 156 HN GLU 156 13.952 18.699 4.354 1248 HA GLU 156 HA GLU 156 12.260 19.667 2.180 1249 HB2 GLU 156 HB2 GLU 156 13.986 21.615 2.299 1250 HB3 GLU 156 HB1 GLU 156 12.840 21.415 3.625 1251 HG2 GLU 156 HG2 GLU 156 14.485 20.301 4.983 1252 HG3 GLU 156 HG1 GLU 156 15.613 20.201 3.633 1253 H VAL 157 HN VAL 157 15.601 18.599 2.698 1254 HA VAL 157 HA VAL 157 15.821 17.806 -0.072 1255 HB VAL 157 HB VAL 157 16.344 20.265 -0.114 1256 HG11 VAL 157 HG11 VAL 157 18.298 21.101 0.965 1257 HG12 VAL 157 HG12 VAL 157 17.458 20.156 2.196 1258 HG13 VAL 157 HG13 VAL 157 18.860 19.478 1.368 1259 HG21 VAL 157 HG21 VAL 157 18.472 19.963 -1.386 1260 HG22 VAL 157 HG22 VAL 157 18.585 18.320 -0.755 1261 HG23 VAL 157 HG23 VAL 157 17.253 18.765 -1.820 1262 HN1 EB4 200 H17 EB4 200 0.184 -1.070 5.638 1263 H8 EB4 200 H8 EB4 200 4.907 0.758 0.992 1264 HN2 EB4 200 H25 EB4 200 3.331 -0.378 6.294 1265 H9 EB4 200 H9 EB4 200 0.891 5.898 3.188 1266 H10 EB4 200 H10 EB4 200 -2.716 -0.875 0.474 1267 HN3 EB4 200 H32 EB4 200 0.805 1.707 7.207 1268 H7 EB4 200 H7 EB4 200 -1.097 1.000 0.387 1269 H11 EB4 200 H11 EB4 200 6.718 -0.817 1.619 1270 H12 EB4 200 H12 EB4 200 -0.029 7.180 5.103 1271 H15 EB4 200 H15 EB4 200 -0.232 6.109 7.330 1272 H14 EB4 200 H14 EB4 200 6.838 -1.716 3.926 1273 H13 EB4 200 H13 EB4 200 -2.817 -2.331 2.481 1274 H22 EB4 200 H22 EB4 200 -1.182 -3.360 6.904 1275 H30 EB4 200 H30 EB4 200 -0.615 -0.168 10.054 1276 H30A EB4 200 H9N EB4 200 -1.546 0.946 8.937 1277 H24 EB4 200 H24 EB4 200 0.241 2.164 10.082 1278 H28 EB4 200 H28 EB4 200 0.945 -3.893 7.995 1279 H28A EB4 200 H9L EB4 200 1.011 -4.040 6.230 1280 H23 EB4 200 H23 EB4 200 4.883 -1.932 8.311 1281 H29 EB4 200 H29 EB4 200 3.766 -0.545 10.014 1282 H29A EB4 200 H9M EB4 200 4.730 0.480 8.842 1283 H21 ACD 300 HA3 ACD 300 -0.113 9.000 -11.916 1284 H22 ACD 300 HA4 ACD 300 0.197 10.386 -10.849 1285 H31 ACD 300 HA1 ACD 300 0.092 7.459 -9.995 1286 H32 ACD 300 HA2 ACD 300 1.561 8.447 -10.163 1287 H41 ACD 300 HA0 ACD 300 -0.748 8.966 -8.234 1288 H42 ACD 300 HAZ ACD 300 0.675 10.013 -8.436 1289 H5 ACD 300 HAY ACD 300 2.072 7.719 -7.805 1290 H6 ACD 300 HAX ACD 300 1.090 7.170 -5.442 1291 H71 ACD 300 HAV ACD 300 -1.103 9.181 -6.370 1292 H72 ACD 300 HAW ACD 300 -1.593 7.556 -5.844 1293 H8 ACD 300 HAU ACD 300 -0.722 9.863 -4.041 1294 H9 ACD 300 HAT ACD 300 -0.894 8.134 -2.095 1295 H101 ACD 300 HAR ACD 300 -1.628 6.159 -4.344 1296 H102 ACD 300 HAS ACD 300 -0.069 5.853 -3.544 1297 H11 ACD 300 HAQ ACD 300 -2.830 5.326 -2.365 1298 H12 ACD 300 HAP ACD 300 -1.557 4.889 -0.109 1299 H131 ACD 300 HAN ACD 300 0.671 6.675 -1.387 1300 H132 ACD 300 HAO ACD 300 1.060 4.923 -1.005 1301 H14 ACD 300 HAM ACD 300 0.770 5.365 1.395 1302 H15 ACD 300 HAL ACD 300 0.909 7.861 2.141 1303 H161 ACD 300 HAJ ACD 300 -0.382 8.657 -0.424 1304 H162 ACD 300 HAK ACD 300 0.633 9.710 0.586 1305 H171 ACD 300 HAH ACD 300 2.657 8.895 -0.494 1306 H172 ACD 300 HAI ACD 300 1.739 7.687 -1.417 1307 H181 ACD 300 HAF ACD 300 0.391 9.656 -2.380 1308 H182 ACD 300 HAG ACD 300 1.641 10.714 -1.685 1309 H191 ACD 300 HAD ACD 300 3.382 9.614 -2.969 1310 H192 ACD 300 HAE ACD 300 2.243 8.381 -3.552 1311 H201 ACD 300 HAA ACD 300 2.604 10.071 -5.289 1312 H202 ACD 300 HAB ACD 300 2.145 11.371 -4.171 1313 H203 ACD 300 HAC ACD 300 0.931 10.186 -4.706 Start of MODEL 6 1 H1 MET 1 HT1 MET 1 -1.667 15.447 -19.465 2 H2 MET 1 HT2 MET 1 -0.074 14.858 -19.393 3 H3 MET 1 HT3 MET 1 -1.055 14.499 -20.732 4 HA MET 1 HA MET 1 0.614 16.749 -20.281 5 HB2 MET 1 HB2 MET 1 0.595 15.381 -22.324 6 HB3 MET 1 HB1 MET 1 -1.083 15.836 -22.625 7 HG2 MET 1 HG2 MET 1 -0.468 18.162 -22.904 8 HG3 MET 1 HG1 MET 1 1.191 17.827 -22.408 9 HE1 MET 1 HE1 MET 1 2.502 15.705 -23.660 10 HE2 MET 1 HE2 MET 1 2.946 16.292 -25.260 11 HE3 MET 1 HE3 MET 1 3.003 17.381 -23.868 12 H THR 2 HN THR 2 -2.651 16.642 -21.723 13 HA THR 2 HA THR 2 -3.203 19.357 -21.525 14 HB THR 2 HB THR 2 -5.237 17.133 -21.258 15 HG1 THR 2 HG1 THR 2 -5.014 18.076 -23.719 16 HG21 THR 2 HG21 THR 2 -6.719 18.770 -22.353 17 HG22 THR 2 HG22 THR 2 -6.085 19.408 -20.835 18 HG23 THR 2 HG23 THR 2 -5.404 19.947 -22.370 19 H VAL 3 HN VAL 3 -3.707 16.780 -19.156 20 HA VAL 3 HA VAL 3 -5.132 18.335 -17.266 21 HB VAL 3 HB VAL 3 -4.239 16.517 -15.654 22 HG11 VAL 3 HG11 VAL 3 -5.824 15.871 -18.153 23 HG12 VAL 3 HG12 VAL 3 -5.693 14.778 -16.775 24 HG13 VAL 3 HG13 VAL 3 -6.460 16.355 -16.581 25 HG21 VAL 3 HG21 VAL 3 -3.421 15.223 -18.263 26 HG22 VAL 3 HG22 VAL 3 -2.263 16.064 -17.232 27 HG23 VAL 3 HG23 VAL 3 -3.121 14.648 -16.622 28 HA PRO 4 HA PRO 4 -2.298 21.098 -15.315 29 HB2 PRO 4 HB2 PRO 4 -2.745 19.422 -12.858 30 HB3 PRO 4 HB1 PRO 4 -2.739 21.190 -13.024 31 HG2 PRO 4 HG2 PRO 4 -5.021 19.784 -12.894 32 HG3 PRO 4 HG1 PRO 4 -4.871 21.256 -13.868 33 HD2 PRO 4 HD2 PRO 4 -5.144 18.458 -14.776 34 HD3 PRO 4 HD1 PRO 4 -5.408 19.964 -15.681 35 H ASP 5 HN ASP 5 -0.099 21.190 -14.918 36 HA ASP 5 HA ASP 5 1.560 19.094 -15.668 37 HB2 ASP 5 HB2 ASP 5 2.158 21.451 -13.866 38 HB3 ASP 5 HB1 ASP 5 3.384 20.395 -14.565 39 H ARG 6 HN ARG 6 2.894 17.660 -14.511 40 HA ARG 6 HA ARG 6 1.684 16.600 -12.115 41 HB2 ARG 6 HB2 ARG 6 3.751 15.028 -12.287 42 HB3 ARG 6 HB1 ARG 6 2.502 14.917 -13.524 43 HG2 ARG 6 HG2 ARG 6 4.739 16.858 -13.990 44 HG3 ARG 6 HG1 ARG 6 5.098 15.142 -14.165 45 HD2 ARG 6 HD2 ARG 6 2.629 16.206 -15.493 46 HD3 ARG 6 HD1 ARG 6 4.191 16.561 -16.224 47 HE ARG 6 HE ARG 6 2.889 13.976 -16.098 48 HH11 ARG 6 HH21 ARG 6 5.855 15.732 -16.410 49 HH12 ARG 6 HH22 ARG 6 6.685 14.455 -17.235 50 HH21 ARG 6 HH11 ARG 6 3.971 12.297 -17.181 51 HH22 ARG 6 HH12 ARG 6 5.618 12.511 -17.672 52 H SER 7 HN SER 7 4.368 18.651 -12.913 53 HA SER 7 HA SER 7 5.960 18.373 -10.629 54 HB2 SER 7 HB2 SER 7 5.436 20.922 -12.171 55 HB3 SER 7 HB1 SER 7 6.836 20.571 -11.162 56 HG SER 7 HG SER 7 6.041 19.130 -13.481 57 H GLU 8 HN GLU 8 2.946 20.079 -11.146 58 HA GLU 8 HA GLU 8 2.961 21.777 -8.922 59 HB2 GLU 8 HB2 GLU 8 1.309 21.742 -10.852 60 HB3 GLU 8 HB1 GLU 8 0.505 20.410 -10.020 61 HG2 GLU 8 HG2 GLU 8 -0.618 22.404 -9.321 62 HG3 GLU 8 HG1 GLU 8 0.400 21.913 -7.970 63 H ILE 9 HN ILE 9 1.545 18.487 -9.198 64 HA ILE 9 HA ILE 9 1.032 18.434 -6.340 65 HB ILE 9 HB ILE 9 -0.493 17.334 -8.010 66 HG12 ILE 9 HG12 ILE 9 0.785 15.696 -5.794 67 HG13 ILE 9 HG11 ILE 9 -0.628 16.726 -5.668 68 HG21 ILE 9 HG21 ILE 9 0.175 15.277 -9.055 69 HG22 ILE 9 HG22 ILE 9 1.457 16.440 -9.383 70 HG23 ILE 9 HG23 ILE 9 1.674 15.219 -8.130 71 HD11 ILE 9 HD11 ILE 9 -0.912 14.121 -5.880 72 HD12 ILE 9 HD12 ILE 9 -2.007 15.187 -6.740 73 HD13 ILE 9 HD13 ILE 9 -0.680 14.415 -7.597 74 H ALA 10 HN ALA 10 3.461 17.217 -8.553 75 HA ALA 10 HA ALA 10 4.560 15.372 -6.665 76 HB1 ALA 10 HB1 ALA 10 5.976 16.520 -9.065 77 HB2 ALA 10 HB2 ALA 10 4.926 15.104 -9.109 78 HB3 ALA 10 HB3 ALA 10 6.416 15.067 -8.168 79 H GLY 11 HN GLY 11 6.184 15.564 -5.233 80 HA2 GLY 11 HA2 GLY 11 8.172 16.807 -4.485 81 HA3 GLY 11 HA1 GLY 11 7.263 18.285 -4.799 82 H LYS 12 HN LYS 12 4.739 17.173 -3.784 83 HA LYS 12 HA LYS 12 5.153 16.397 -1.049 84 HB2 LYS 12 HB2 LYS 12 5.724 18.840 -1.013 85 HB3 LYS 12 HB1 LYS 12 4.066 19.177 -1.511 86 HG2 LYS 12 HG2 LYS 12 3.205 18.055 0.486 87 HG3 LYS 12 HG1 LYS 12 4.844 17.620 0.972 88 HD2 LYS 12 HD2 LYS 12 5.415 20.053 1.064 89 HD3 LYS 12 HD1 LYS 12 3.727 20.427 0.714 90 HE2 LYS 12 HE2 LYS 12 2.981 19.481 2.764 91 HE3 LYS 12 HE1 LYS 12 4.522 18.669 3.040 92 HZ1 LYS 12 HZ1 LYS 12 4.161 21.615 2.962 93 HZ2 LYS 12 HZ2 LYS 12 4.236 20.692 4.386 94 HZ3 LYS 12 HZ3 LYS 12 5.584 20.776 3.359 95 H TRP 13 HN TRP 13 3.552 14.896 -0.950 96 HA TRP 13 HA TRP 13 0.833 15.629 -1.890 97 HB2 TRP 13 HB2 TRP 13 2.260 12.967 -1.582 98 HB3 TRP 13 HB1 TRP 13 0.537 13.055 -1.851 99 HD1 TRP 13 HD1 TRP 13 3.400 14.954 -3.620 100 HE1 TRP 13 HE1 TRP 13 3.157 14.436 -6.130 101 HE3 TRP 13 HE3 TRP 13 -0.667 11.879 -3.520 102 HZ2 TRP 13 HZ2 TRP 13 1.526 12.912 -7.843 103 HZ3 TRP 13 HZ3 TRP 13 -1.559 10.918 -5.623 104 HH2 TRP 13 HH2 TRP 13 -0.484 11.444 -7.793 105 H TYR 14 HN TYR 14 -0.635 15.928 -0.189 106 HA TYR 14 HA TYR 14 0.216 15.066 2.482 107 HB2 TYR 14 HB2 TYR 14 -0.933 17.419 1.438 108 HB3 TYR 14 HB1 TYR 14 -2.213 16.673 2.384 109 HD1 TYR 14 HD1 TYR 14 1.529 16.886 2.817 110 HD2 TYR 14 HD2 TYR 14 -2.353 17.689 4.481 111 HE1 TYR 14 HE1 TYR 14 2.584 17.722 4.893 112 HE2 TYR 14 HE2 TYR 14 -1.283 18.533 6.552 113 HH TYR 14 HH TYR 14 0.868 18.241 7.758 114 H VAL 15 HN VAL 15 -0.629 13.395 3.439 115 HA VAL 15 HA VAL 15 -3.085 12.128 2.403 116 HB VAL 15 HB VAL 15 -1.036 11.173 4.421 117 HG11 VAL 15 HG11 VAL 15 -3.127 10.168 4.995 118 HG12 VAL 15 HG12 VAL 15 -3.549 9.915 3.301 119 HG13 VAL 15 HG13 VAL 15 -2.261 8.963 4.041 120 HG21 VAL 15 HG21 VAL 15 -0.675 9.456 2.517 121 HG22 VAL 15 HG22 VAL 15 -1.536 10.608 1.495 122 HG23 VAL 15 HG23 VAL 15 -0.028 11.079 2.278 123 H VAL 16 HN VAL 16 -5.025 12.373 3.504 124 HA VAL 16 HA VAL 16 -4.867 13.209 6.337 125 HB VAL 16 HB VAL 16 -6.535 14.934 5.963 126 HG11 VAL 16 HG11 VAL 16 -4.371 15.440 3.935 127 HG12 VAL 16 HG12 VAL 16 -4.990 16.519 5.179 128 HG13 VAL 16 HG13 VAL 16 -3.934 15.185 5.606 129 HG21 VAL 16 HG21 VAL 16 -7.718 14.076 4.048 130 HG22 VAL 16 HG22 VAL 16 -6.974 15.595 3.549 131 HG23 VAL 16 HG23 VAL 16 -6.246 14.059 3.076 132 H ALA 17 HN ALA 17 -6.060 10.865 4.451 133 HA ALA 17 HA ALA 17 -7.823 9.942 6.401 134 HB1 ALA 17 HB1 ALA 17 -10.019 10.337 5.604 135 HB2 ALA 17 HB2 ALA 17 -9.444 10.965 4.072 136 HB3 ALA 17 HB3 ALA 17 -9.238 11.911 5.530 137 H LEU 18 HN LEU 18 -8.270 7.794 6.047 138 HA LEU 18 HA LEU 18 -8.164 6.802 3.288 139 HB2 LEU 18 HB2 LEU 18 -5.936 6.407 3.652 140 HB3 LEU 18 HB1 LEU 18 -6.108 6.424 5.397 141 HG LEU 18 HG LEU 18 -7.332 4.101 3.956 142 HD11 LEU 18 HD11 LEU 18 -5.147 4.381 2.826 143 HD12 LEU 18 HD12 LEU 18 -4.349 4.372 4.398 144 HD13 LEU 18 HD13 LEU 18 -5.187 2.929 3.827 145 HD21 LEU 18 HD21 LEU 18 -5.668 4.371 6.480 146 HD22 LEU 18 HD22 LEU 18 -7.427 4.330 6.429 147 HD23 LEU 18 HD23 LEU 18 -6.500 2.911 5.947 148 H ALA 19 HN ALA 19 -9.208 4.872 2.973 149 HA ALA 19 HA ALA 19 -10.750 3.827 5.268 150 HB1 ALA 19 HB1 ALA 19 -11.775 3.327 2.527 151 HB2 ALA 19 HB2 ALA 19 -11.826 4.999 3.063 152 HB3 ALA 19 HB3 ALA 19 -12.653 3.760 3.992 153 H SER 20 HN SER 20 -11.332 1.530 5.084 154 HA SER 20 HA SER 20 -9.895 -0.158 3.269 155 HB2 SER 20 HB2 SER 20 -8.346 -1.163 4.801 156 HB3 SER 20 HB1 SER 20 -8.085 0.578 4.842 157 HG SER 20 HG SER 20 -8.594 -0.974 6.865 158 H ASN 21 HN ASN 21 -9.909 -2.494 4.206 159 HA ASN 21 HA ASN 21 -12.581 -2.973 5.396 160 HB2 ASN 21 HB2 ASN 21 -10.998 -4.665 3.436 161 HB3 ASN 21 HB1 ASN 21 -12.516 -5.149 4.189 162 HD21 ASN 21 HD21 ASN 21 -12.734 -1.846 3.755 163 HD22 ASN 21 HD22 ASN 21 -13.506 -1.824 2.243 164 H THR 22 HN THR 22 -9.226 -3.237 5.650 165 HA THR 22 HA THR 22 -9.245 -5.491 7.499 166 HB THR 22 HB THR 22 -7.372 -5.104 5.854 167 HG1 THR 22 HG1 THR 22 -6.968 -6.392 7.592 168 HG21 THR 22 HG21 THR 22 -6.287 -3.051 7.738 169 HG22 THR 22 HG22 THR 22 -5.921 -3.305 6.033 170 HG23 THR 22 HG23 THR 22 -7.433 -2.525 6.502 171 H GLU 23 HN GLU 23 -10.137 -5.019 9.387 172 HA GLU 23 HA GLU 23 -10.610 -2.672 10.608 173 HB2 GLU 23 HB2 GLU 23 -11.343 -4.851 11.493 174 HB3 GLU 23 HB1 GLU 23 -9.699 -5.167 12.049 175 HG2 GLU 23 HG2 GLU 23 -9.783 -3.264 13.552 176 HG3 GLU 23 HG1 GLU 23 -11.354 -2.781 12.915 177 H PHE 24 HN PHE 24 -7.482 -4.208 10.423 178 HA PHE 24 HA PHE 24 -6.168 -2.866 12.487 179 HB2 PHE 24 HB2 PHE 24 -4.801 -3.411 9.870 180 HB3 PHE 24 HB1 PHE 24 -4.169 -3.565 11.508 181 HD1 PHE 24 HD1 PHE 24 -6.297 -5.097 12.874 182 HD2 PHE 24 HD2 PHE 24 -4.655 -5.558 8.929 183 HE1 PHE 24 HE1 PHE 24 -6.937 -7.490 12.886 184 HE2 PHE 24 HE2 PHE 24 -5.297 -7.952 8.944 185 HZ PHE 24 HZ PHE 24 -6.437 -8.919 10.923 186 H PHE 25 HN PHE 25 -6.457 -1.811 9.036 187 HA PHE 25 HA PHE 25 -4.992 0.570 9.473 188 HB2 PHE 25 HB2 PHE 25 -5.792 -0.846 7.285 189 HB3 PHE 25 HB1 PHE 25 -6.886 0.527 7.198 190 HD1 PHE 25 HD1 PHE 25 -5.089 2.645 8.420 191 HD2 PHE 25 HD2 PHE 25 -4.302 -0.403 5.500 192 HE1 PHE 25 HE1 PHE 25 -3.260 4.021 7.482 193 HE2 PHE 25 HE2 PHE 25 -2.473 0.978 4.562 194 HZ PHE 25 HZ PHE 25 -1.949 3.188 5.550 195 H LEU 26 HN LEU 26 -8.536 0.074 9.122 196 HA LEU 26 HA LEU 26 -9.105 2.861 9.386 197 HB2 LEU 26 HB2 LEU 26 -11.461 2.096 9.816 198 HB3 LEU 26 HB1 LEU 26 -10.751 1.522 8.312 199 HG LEU 26 HG LEU 26 -10.057 -0.466 10.171 200 HD11 LEU 26 HD11 LEU 26 -11.741 0.666 11.707 201 HD12 LEU 26 HD12 LEU 26 -12.984 0.209 10.543 202 HD13 LEU 26 HD13 LEU 26 -12.053 -1.036 11.373 203 HD21 LEU 26 HD21 LEU 26 -10.698 -1.044 7.949 204 HD22 LEU 26 HD22 LEU 26 -11.952 -1.739 8.975 205 HD23 LEU 26 HD23 LEU 26 -12.258 -0.236 8.106 206 H ARG 27 HN ARG 27 -9.204 0.168 11.628 207 HA ARG 27 HA ARG 27 -10.140 1.538 13.896 208 HB2 ARG 27 HB2 ARG 27 -9.828 -0.941 13.773 209 HB3 ARG 27 HB1 ARG 27 -8.088 -0.689 13.926 210 HG2 ARG 27 HG2 ARG 27 -8.315 0.246 16.109 211 HG3 ARG 27 HG1 ARG 27 -10.061 0.413 15.934 212 HD2 ARG 27 HD2 ARG 27 -9.625 -1.519 17.326 213 HD3 ARG 27 HD1 ARG 27 -10.225 -2.084 15.770 214 HE ARG 27 HE ARG 27 -8.121 -3.005 15.336 215 HH11 ARG 27 HH21 ARG 27 -8.075 -0.936 18.109 216 HH12 ARG 27 HH22 ARG 27 -6.492 -1.421 18.617 217 HH21 ARG 27 HH11 ARG 27 -6.044 -3.647 15.996 218 HH22 ARG 27 HH12 ARG 27 -5.342 -2.956 17.420 219 H GLU 28 HN GLU 28 -6.806 1.054 12.751 220 HA GLU 28 HA GLU 28 -5.693 2.693 14.844 221 HB2 GLU 28 HB2 GLU 28 -4.586 0.716 13.593 222 HB3 GLU 28 HB1 GLU 28 -4.240 1.898 12.332 223 HG2 GLU 28 HG2 GLU 28 -3.225 3.358 14.165 224 HG3 GLU 28 HG1 GLU 28 -3.327 1.946 15.214 225 H LYS 29 HN LYS 29 -6.390 3.194 11.346 226 HA LYS 29 HA LYS 29 -5.061 5.545 10.918 227 HB2 LYS 29 HB2 LYS 29 -6.297 4.511 9.132 228 HB3 LYS 29 HB1 LYS 29 -7.816 4.701 9.999 229 HG2 LYS 29 HG2 LYS 29 -7.577 6.398 8.220 230 HG3 LYS 29 HG1 LYS 29 -7.629 7.157 9.806 231 HD2 LYS 29 HD2 LYS 29 -5.279 7.536 9.815 232 HD3 LYS 29 HD1 LYS 29 -5.021 6.452 8.450 233 HE2 LYS 29 HE2 LYS 29 -6.414 8.027 7.051 234 HE3 LYS 29 HE1 LYS 29 -6.412 9.142 8.415 235 HZ1 LYS 29 HZ1 LYS 29 -4.446 9.865 7.755 236 HZ2 LYS 29 HZ2 LYS 29 -3.786 8.318 7.996 237 HZ3 LYS 29 HZ3 LYS 29 -4.416 8.742 6.481 238 H ASP 30 HN ASP 30 -7.835 4.957 12.904 239 HA ASP 30 HA ASP 30 -8.733 7.632 13.152 240 HB2 ASP 30 HB2 ASP 30 -10.052 5.576 13.721 241 HB3 ASP 30 HB1 ASP 30 -9.057 5.408 15.167 242 H LYS 31 HN LYS 31 -6.115 5.879 14.742 243 HA LYS 31 HA LYS 31 -5.962 7.944 16.792 244 HB2 LYS 31 HB2 LYS 31 -4.461 6.584 17.997 245 HB3 LYS 31 HB1 LYS 31 -5.720 5.523 17.384 246 HG2 LYS 31 HG2 LYS 31 -3.809 4.305 16.877 247 HG3 LYS 31 HG1 LYS 31 -4.086 5.165 15.381 248 HD2 LYS 31 HD2 LYS 31 -2.478 6.909 16.944 249 HD3 LYS 31 HD1 LYS 31 -1.798 5.306 17.175 250 HE2 LYS 31 HE2 LYS 31 -2.491 6.139 14.380 251 HE3 LYS 31 HE1 LYS 31 -1.048 6.818 15.116 252 HZ1 LYS 31 HZ1 LYS 31 -0.084 4.938 14.451 253 HZ2 LYS 31 HZ2 LYS 31 -0.866 4.213 15.774 254 HZ3 LYS 31 HZ3 LYS 31 -1.562 4.129 14.230 255 H MET 32 HN MET 32 -4.294 7.268 13.762 256 HA MET 32 HA MET 32 -1.956 8.751 14.595 257 HB2 MET 32 HB2 MET 32 -1.481 8.799 12.055 258 HB3 MET 32 HB1 MET 32 -1.420 7.249 12.869 259 HG2 MET 32 HG2 MET 32 -4.009 7.197 12.151 260 HG3 MET 32 HG1 MET 32 -3.418 8.285 10.914 261 HE1 MET 32 HE1 MET 32 -3.406 5.083 12.616 262 HE2 MET 32 HE2 MET 32 -2.643 3.899 11.572 263 HE3 MET 32 HE3 MET 32 -1.656 4.938 12.603 264 H LYS 33 HN LYS 33 -1.258 10.501 12.906 265 HA LYS 33 HA LYS 33 -3.371 12.577 12.845 266 HB2 LYS 33 HB2 LYS 33 -0.428 12.736 13.476 267 HB3 LYS 33 HB1 LYS 33 -1.355 14.155 12.996 268 HG2 LYS 33 HG2 LYS 33 -2.870 13.864 14.871 269 HG3 LYS 33 HG1 LYS 33 -2.097 12.339 15.306 270 HD2 LYS 33 HD2 LYS 33 -0.006 13.494 15.799 271 HD3 LYS 33 HD1 LYS 33 -0.693 15.026 15.264 272 HE2 LYS 33 HE2 LYS 33 -2.500 14.660 17.052 273 HE3 LYS 33 HE1 LYS 33 -1.453 13.392 17.690 274 HZ1 LYS 33 HZ1 LYS 33 -0.829 15.284 18.853 275 HZ2 LYS 33 HZ2 LYS 33 0.348 15.177 17.634 276 HZ3 LYS 33 HZ3 LYS 33 -0.923 16.289 17.487 277 H MET 34 HN MET 34 -2.658 14.381 11.125 278 HA MET 34 HA MET 34 -2.831 13.398 8.609 279 HB2 MET 34 HB2 MET 34 -3.026 15.774 9.483 280 HB3 MET 34 HB1 MET 34 -1.279 15.869 9.439 281 HG2 MET 34 HG2 MET 34 -1.212 16.063 7.174 282 HG3 MET 34 HG1 MET 34 -2.509 14.908 6.940 283 HE1 MET 34 HE1 MET 34 -4.770 15.256 7.715 284 HE2 MET 34 HE2 MET 34 -5.025 16.562 8.860 285 HE3 MET 34 HE3 MET 34 -5.710 16.669 7.243 286 H ALA 35 HN ALA 35 -1.438 12.591 7.119 287 HA ALA 35 HA ALA 35 1.438 12.416 7.802 288 HB1 ALA 35 HB1 ALA 35 1.220 10.423 6.073 289 HB2 ALA 35 HB2 ALA 35 -0.477 10.484 6.549 290 HB3 ALA 35 HB3 ALA 35 0.768 10.195 7.762 291 H MET 36 HN MET 36 2.879 12.286 5.875 292 HA MET 36 HA MET 36 1.826 13.838 3.587 293 HB2 MET 36 HB2 MET 36 4.558 14.549 3.914 294 HB3 MET 36 HB1 MET 36 3.149 15.584 4.126 295 HG2 MET 36 HG2 MET 36 4.181 13.762 6.310 296 HG3 MET 36 HG1 MET 36 4.703 15.435 6.126 297 HE1 MET 36 HE1 MET 36 4.147 15.614 8.419 298 HE2 MET 36 HE2 MET 36 3.511 17.153 7.840 299 HE3 MET 36 HE3 MET 36 2.595 16.199 9.016 300 H ALA 37 HN ALA 37 3.241 13.726 1.694 301 HA ALA 37 HA ALA 37 5.030 11.441 1.491 302 HB1 ALA 37 HB1 ALA 37 3.086 10.179 1.136 303 HB2 ALA 37 HB2 ALA 37 3.590 10.602 -0.503 304 HB3 ALA 37 HB3 ALA 37 2.281 11.491 0.275 305 H ARG 38 HN ARG 38 6.067 11.304 -0.611 306 HA ARG 38 HA ARG 38 5.709 13.696 -2.328 307 HB2 ARG 38 HB2 ARG 38 8.197 13.957 -2.512 308 HB3 ARG 38 HB1 ARG 38 7.534 14.398 -0.941 309 HG2 ARG 38 HG2 ARG 38 8.367 12.466 0.097 310 HG3 ARG 38 HG1 ARG 38 8.572 11.614 -1.437 311 HD2 ARG 38 HD2 ARG 38 10.369 13.206 -2.055 312 HD3 ARG 38 HD1 ARG 38 10.182 14.004 -0.497 313 HE ARG 38 HE ARG 38 10.687 11.169 -0.274 314 HH11 ARG 38 HH21 ARG 38 12.057 14.322 -0.662 315 HH12 ARG 38 HH22 ARG 38 13.591 13.892 0.018 316 HH21 ARG 38 HH11 ARG 38 12.695 10.596 0.619 317 HH22 ARG 38 HH12 ARG 38 13.952 11.782 0.743 318 H ILE 39 HN ILE 39 5.850 13.280 -4.505 319 HA ILE 39 HA ILE 39 6.620 10.578 -5.321 320 HB ILE 39 HB ILE 39 4.246 11.226 -5.289 321 HG12 ILE 39 HG12 ILE 39 4.978 10.916 -8.179 322 HG13 ILE 39 HG11 ILE 39 5.387 9.623 -7.060 323 HG21 ILE 39 HG21 ILE 39 3.508 12.769 -6.972 324 HG22 ILE 39 HG22 ILE 39 4.597 13.524 -5.817 325 HG23 ILE 39 HG23 ILE 39 5.147 13.102 -7.432 326 HD11 ILE 39 HD11 ILE 39 2.982 9.694 -8.213 327 HD12 ILE 39 HD12 ILE 39 3.167 9.159 -6.549 328 HD13 ILE 39 HD13 ILE 39 2.628 10.801 -6.899 329 H SER 40 HN SER 40 7.890 10.429 -7.212 330 HA SER 40 HA SER 40 8.381 12.834 -8.762 331 HB2 SER 40 HB2 SER 40 10.693 11.477 -7.416 332 HB3 SER 40 HB1 SER 40 10.734 12.920 -8.413 333 HG SER 40 HG SER 40 10.081 12.603 -5.774 334 H PHE 41 HN PHE 41 9.679 12.383 -10.706 335 HA PHE 41 HA PHE 41 9.108 9.646 -11.626 336 HB2 PHE 41 HB2 PHE 41 9.761 12.159 -13.173 337 HB3 PHE 41 HB1 PHE 41 9.371 10.593 -13.886 338 HD1 PHE 41 HD2 PHE 41 8.050 13.342 -11.760 339 HD2 PHE 41 HD1 PHE 41 7.115 9.813 -14.024 340 HE1 PHE 41 HE2 PHE 41 5.632 13.846 -11.547 341 HE2 PHE 41 HE1 PHE 41 4.696 10.317 -13.810 342 HZ PHE 41 HZ PHE 41 3.954 12.333 -12.571 343 H LEU 42 HN LEU 42 10.912 8.593 -10.700 344 HA LEU 42 HA LEU 42 13.620 9.279 -11.061 345 HB2 LEU 42 HB2 LEU 42 12.264 6.579 -10.910 346 HB3 LEU 42 HB1 LEU 42 14.009 6.760 -10.977 347 HG LEU 42 HG LEU 42 12.442 8.280 -8.907 348 HD11 LEU 42 HD11 LEU 42 13.029 5.322 -8.953 349 HD12 LEU 42 HD12 LEU 42 13.034 6.188 -7.418 350 HD13 LEU 42 HD13 LEU 42 11.575 6.158 -8.409 351 HD21 LEU 42 HD21 LEU 42 14.562 7.931 -7.633 352 HD22 LEU 42 HD22 LEU 42 15.218 7.042 -9.006 353 HD23 LEU 42 HD23 LEU 42 14.838 8.757 -9.164 354 H GLY 43 HN GLY 43 11.292 7.605 -13.032 355 HA2 GLY 43 HA2 GLY 43 12.562 8.303 -15.506 356 HA3 GLY 43 HA1 GLY 43 12.698 6.581 -15.138 357 H GLU 44 HN GLU 44 11.205 7.565 -17.351 358 HA GLU 44 HA GLU 44 8.496 7.986 -16.955 359 HB2 GLU 44 HB2 GLU 44 9.870 6.395 -19.136 360 HB3 GLU 44 HB1 GLU 44 8.179 6.893 -19.187 361 HG2 GLU 44 HG2 GLU 44 10.489 8.822 -18.841 362 HG3 GLU 44 HG1 GLU 44 9.746 8.453 -20.397 363 H ASP 45 HN ASP 45 10.345 5.118 -16.404 364 HA ASP 45 HA ASP 45 7.849 3.629 -15.818 365 HB2 ASP 45 HB2 ASP 45 10.404 2.175 -16.354 366 HB3 ASP 45 HB1 ASP 45 8.743 1.677 -16.666 367 H GLU 46 HN GLU 46 9.965 5.379 -14.286 368 HA GLU 46 HA GLU 46 10.075 3.575 -11.951 369 HB2 GLU 46 HB2 GLU 46 12.344 5.359 -12.867 370 HB3 GLU 46 HB1 GLU 46 12.338 4.323 -11.438 371 HG2 GLU 46 HG2 GLU 46 12.018 2.346 -12.913 372 HG3 GLU 46 HG1 GLU 46 12.124 3.404 -14.318 373 H LEU 47 HN LEU 47 8.959 4.490 -10.373 374 HA LEU 47 HA LEU 47 9.015 7.442 -10.062 375 HB2 LEU 47 HB2 LEU 47 6.822 5.615 -10.518 376 HB3 LEU 47 HB1 LEU 47 6.622 6.358 -8.938 377 HG LEU 47 HG LEU 47 7.310 8.114 -11.286 378 HD11 LEU 47 HD11 LEU 47 4.580 6.991 -10.630 379 HD12 LEU 47 HD12 LEU 47 4.877 8.328 -11.741 380 HD13 LEU 47 HD13 LEU 47 5.500 6.720 -12.110 381 HD21 LEU 47 HD21 LEU 47 6.905 8.651 -8.639 382 HD22 LEU 47 HD22 LEU 47 6.543 9.804 -9.923 383 HD23 LEU 47 HD23 LEU 47 5.256 8.812 -9.237 384 H LYS 48 HN LYS 48 9.387 8.223 -8.048 385 HA LYS 48 HA LYS 48 9.806 6.249 -5.890 386 HB2 LYS 48 HB2 LYS 48 11.641 7.912 -6.773 387 HB3 LYS 48 HB1 LYS 48 10.782 9.087 -5.787 388 HG2 LYS 48 HG2 LYS 48 11.123 7.769 -3.794 389 HG3 LYS 48 HG1 LYS 48 11.772 6.423 -4.732 390 HD2 LYS 48 HD2 LYS 48 13.616 7.681 -3.733 391 HD3 LYS 48 HD1 LYS 48 13.644 7.876 -5.483 392 HE2 LYS 48 HE2 LYS 48 12.865 10.082 -5.384 393 HE3 LYS 48 HE1 LYS 48 12.160 9.868 -3.782 394 HZ1 LYS 48 HZ1 LYS 48 15.041 10.032 -4.467 395 HZ2 LYS 48 HZ2 LYS 48 14.136 11.139 -3.549 396 HZ3 LYS 48 HZ3 LYS 48 14.461 9.593 -2.931 397 H VAL 49 HN VAL 49 8.181 6.136 -4.435 398 HA VAL 49 HA VAL 49 6.798 8.652 -3.732 399 HB VAL 49 HB VAL 49 5.651 6.051 -4.545 400 HG11 VAL 49 HG11 VAL 49 5.071 5.863 -2.187 401 HG12 VAL 49 HG12 VAL 49 4.534 7.544 -2.156 402 HG13 VAL 49 HG13 VAL 49 3.639 6.349 -3.095 403 HG21 VAL 49 HG21 VAL 49 3.687 7.633 -4.916 404 HG22 VAL 49 HG22 VAL 49 4.757 8.933 -4.396 405 HG23 VAL 49 HG23 VAL 49 5.153 7.977 -5.819 406 H SER 50 HN SER 50 6.503 9.128 -1.710 407 HA SER 50 HA SER 50 7.732 7.352 0.328 408 HB2 SER 50 HB2 SER 50 9.029 9.378 -0.439 409 HB3 SER 50 HB1 SER 50 7.745 10.344 0.257 410 HG SER 50 HG SER 50 9.565 8.601 1.528 411 H TYR 51 HN TYR 51 6.949 7.462 2.423 412 HA TYR 51 HA TYR 51 4.366 8.869 2.813 413 HB2 TYR 51 HB2 TYR 51 4.983 6.297 4.258 414 HB3 TYR 51 HB1 TYR 51 3.423 7.053 3.956 415 HD1 TYR 51 HD1 TYR 51 3.411 7.574 1.108 416 HD2 TYR 51 HD2 TYR 51 4.978 4.203 3.247 417 HE1 TYR 51 HE1 TYR 51 3.078 6.143 -0.882 418 HE2 TYR 51 HE2 TYR 51 4.663 2.780 1.245 419 HH TYR 51 HH TYR 51 3.411 4.149 -1.797 420 H ALA 52 HN ALA 52 4.229 10.058 4.660 421 HA ALA 52 HA ALA 52 6.336 9.696 6.714 422 HB1 ALA 52 HB1 ALA 52 5.499 12.159 5.244 423 HB2 ALA 52 HB2 ALA 52 7.094 11.677 5.815 424 HB3 ALA 52 HB3 ALA 52 5.914 12.322 6.952 425 H VAL 53 HN VAL 53 5.310 8.925 8.454 426 HA VAL 53 HA VAL 53 2.650 10.025 9.137 427 HB VAL 53 HB VAL 53 3.787 7.464 10.233 428 HG11 VAL 53 HG11 VAL 53 1.706 8.579 11.171 429 HG12 VAL 53 HG12 VAL 53 0.939 8.282 9.612 430 HG13 VAL 53 HG13 VAL 53 1.475 6.926 10.602 431 HG21 VAL 53 HG21 VAL 53 2.372 7.903 7.587 432 HG22 VAL 53 HG22 VAL 53 3.967 7.193 7.837 433 HG23 VAL 53 HG23 VAL 53 2.523 6.327 8.362 434 HA PRO 54 HA PRO 54 5.126 11.560 12.618 435 HB2 PRO 54 HB2 PRO 54 3.515 13.562 13.392 436 HB3 PRO 54 HB1 PRO 54 4.421 13.659 11.870 437 HG2 PRO 54 HG2 PRO 54 1.549 12.997 12.317 438 HG3 PRO 54 HG1 PRO 54 2.290 14.001 11.058 439 HD2 PRO 54 HD2 PRO 54 1.538 11.331 10.716 440 HD3 PRO 54 HD1 PRO 54 2.718 12.193 9.706 441 H LYS 55 HN LYS 55 3.803 9.177 13.067 442 HA LYS 55 HA LYS 55 1.720 9.069 14.864 443 HB2 LYS 55 HB2 LYS 55 2.890 7.128 13.779 444 HB3 LYS 55 HB1 LYS 55 4.171 7.310 14.976 445 HG2 LYS 55 HG2 LYS 55 2.447 7.062 16.779 446 HG3 LYS 55 HG1 LYS 55 1.251 6.717 15.528 447 HD2 LYS 55 HD2 LYS 55 2.692 4.823 14.746 448 HD3 LYS 55 HD1 LYS 55 3.763 5.122 16.113 449 HE2 LYS 55 HE2 LYS 55 1.570 4.918 17.541 450 HE3 LYS 55 HE1 LYS 55 0.939 4.089 16.118 451 HZ1 LYS 55 HZ1 LYS 55 3.505 3.355 17.401 452 HZ2 LYS 55 HZ2 LYS 55 2.025 2.639 17.828 453 HZ3 LYS 55 HZ3 LYS 55 2.625 2.469 16.250 454 HA PRO 56 HA PRO 56 3.519 11.615 18.197 455 HB2 PRO 56 HB2 PRO 56 1.303 10.164 19.614 456 HB3 PRO 56 HB1 PRO 56 1.769 11.874 19.713 457 HG2 PRO 56 HG2 PRO 56 -0.324 11.106 18.263 458 HG3 PRO 56 HG1 PRO 56 0.749 12.406 17.716 459 HD2 PRO 56 HD2 PRO 56 0.495 9.629 16.680 460 HD3 PRO 56 HD1 PRO 56 1.035 11.098 15.841 461 H ASN 57 HN ASN 57 2.994 8.170 18.116 462 HA ASN 57 HA ASN 57 4.433 7.631 20.571 463 HB2 ASN 57 HB2 ASN 57 3.595 5.744 18.360 464 HB3 ASN 57 HB1 ASN 57 4.155 5.283 19.966 465 HD21 ASN 57 HD21 ASN 57 1.742 4.272 19.591 466 HD22 ASN 57 HD22 ASN 57 0.504 5.210 20.278 467 H GLY 58 HN GLY 58 5.187 7.948 17.182 468 HA2 GLY 58 HA2 GLY 58 7.971 8.088 17.630 469 HA3 GLY 58 HA1 GLY 58 7.572 6.477 17.044 470 H CYS 59 HN CYS 59 8.542 9.467 16.081 471 HA CYS 59 HA CYS 59 7.035 9.974 13.751 472 HB2 CYS 59 HB2 CYS 59 8.456 11.706 14.584 473 HB3 CYS 59 HB1 CYS 59 9.876 10.664 14.514 474 H ARG 60 HN ARG 60 6.683 8.080 12.590 475 HA ARG 60 HA ARG 60 8.992 6.556 11.624 476 HB2 ARG 60 HB2 ARG 60 6.005 6.159 11.410 477 HB3 ARG 60 HB1 ARG 60 7.168 5.142 10.560 478 HG2 ARG 60 HG2 ARG 60 8.246 4.588 12.722 479 HG3 ARG 60 HG1 ARG 60 7.045 5.571 13.560 480 HD2 ARG 60 HD2 ARG 60 5.255 4.121 12.575 481 HD3 ARG 60 HD1 ARG 60 6.515 3.089 11.904 482 HE ARG 60 HE ARG 60 7.003 3.355 14.654 483 HH11 ARG 60 HH21 ARG 60 4.633 2.076 12.482 484 HH12 ARG 60 HH22 ARG 60 4.124 0.819 13.558 485 HH21 ARG 60 HH11 ARG 60 6.341 1.708 16.072 486 HH22 ARG 60 HH12 ARG 60 5.091 0.611 15.591 487 H LYS 61 HN LYS 61 10.002 7.249 9.874 488 HA LYS 61 HA LYS 61 8.408 8.259 7.598 489 HB2 LYS 61 HB2 LYS 61 9.991 10.028 7.181 490 HB3 LYS 61 HB1 LYS 61 9.450 10.165 8.853 491 HG2 LYS 61 HG2 LYS 61 11.499 8.787 9.494 492 HG3 LYS 61 HG1 LYS 61 12.069 9.037 7.843 493 HD2 LYS 61 HD2 LYS 61 11.717 11.538 8.253 494 HD3 LYS 61 HD1 LYS 61 11.545 11.128 9.960 495 HE2 LYS 61 HE2 LYS 61 13.776 9.960 9.820 496 HE3 LYS 61 HE1 LYS 61 13.953 10.621 8.194 497 HZ1 LYS 61 HZ1 LYS 61 13.331 12.823 9.495 498 HZ2 LYS 61 HZ2 LYS 61 14.057 11.974 10.774 499 HZ3 LYS 61 HZ3 LYS 61 14.934 12.277 9.355 500 H TRP 62 HN TRP 62 8.939 7.358 5.695 501 HA TRP 62 HA TRP 62 11.606 6.362 5.195 502 HB2 TRP 62 HB2 TRP 62 11.277 4.121 5.376 503 HB3 TRP 62 HB1 TRP 62 9.958 4.583 6.445 504 HD1 TRP 62 HD1 TRP 62 7.609 5.247 4.778 505 HE1 TRP 62 HE1 TRP 62 6.569 3.630 3.060 506 HE3 TRP 62 HE3 TRP 62 11.587 2.155 3.947 507 HZ2 TRP 62 HZ2 TRP 62 7.322 1.334 1.531 508 HZ3 TRP 62 HZ3 TRP 62 11.398 0.263 2.357 509 HH2 TRP 62 HH2 TRP 62 9.273 -0.151 1.149 510 H GLU 63 HN GLU 63 11.593 5.185 2.977 511 HA GLU 63 HA GLU 63 9.832 6.721 1.147 512 HB2 GLU 63 HB2 GLU 63 12.282 7.380 1.219 513 HB3 GLU 63 HB1 GLU 63 12.639 5.797 0.533 514 HG2 GLU 63 HG2 GLU 63 11.382 6.274 -1.449 515 HG3 GLU 63 HG1 GLU 63 10.685 7.729 -0.737 516 H THR 64 HN THR 64 9.488 5.730 -0.964 517 HA THR 64 HA THR 64 9.823 2.824 -1.120 518 HB THR 64 HB THR 64 7.098 4.064 -1.488 519 HG1 THR 64 HG1 THR 64 7.289 4.280 0.619 520 HG21 THR 64 HG21 THR 64 7.390 1.941 -2.609 521 HG22 THR 64 HG22 THR 64 8.132 1.234 -1.174 522 HG23 THR 64 HG23 THR 64 6.422 1.661 -1.162 523 H THR 65 HN THR 65 9.855 2.051 -3.228 524 HA THR 65 HA THR 65 9.852 4.125 -5.331 525 HB THR 65 HB THR 65 11.126 1.392 -5.424 526 HG1 THR 65 HG1 THR 65 12.929 2.327 -4.700 527 HG21 THR 65 HG21 THR 65 11.432 3.893 -7.108 528 HG22 THR 65 HG22 THR 65 12.409 2.434 -7.281 529 HG23 THR 65 HG23 THR 65 10.677 2.381 -7.614 530 H PHE 66 HN PHE 66 8.307 4.107 -6.868 531 HA PHE 66 HA PHE 66 6.764 1.613 -7.286 532 HB2 PHE 66 HB2 PHE 66 5.964 4.517 -7.179 533 HB3 PHE 66 HB1 PHE 66 5.010 3.371 -8.111 534 HD1 PHE 66 HD1 PHE 66 6.493 3.876 -4.714 535 HD2 PHE 66 HD2 PHE 66 3.387 2.057 -7.054 536 HE1 PHE 66 HE1 PHE 66 5.361 3.126 -2.640 537 HE2 PHE 66 HE2 PHE 66 2.266 1.304 -4.978 538 HZ PHE 66 HZ PHE 66 3.253 1.842 -2.773 539 H LYS 67 HN LYS 67 6.675 0.879 -9.369 540 HA LYS 67 HA LYS 67 7.933 2.576 -11.459 541 HB2 LYS 67 HB2 LYS 67 7.809 -0.440 -11.226 542 HB3 LYS 67 HB1 LYS 67 8.500 0.447 -12.584 543 HG2 LYS 67 HG2 LYS 67 9.925 1.632 -10.700 544 HG3 LYS 67 HG1 LYS 67 9.523 0.190 -9.769 545 HD2 LYS 67 HD2 LYS 67 10.332 -1.172 -11.757 546 HD3 LYS 67 HD1 LYS 67 10.972 0.333 -12.417 547 HE2 LYS 67 HE2 LYS 67 12.388 0.646 -10.461 548 HE3 LYS 67 HE1 LYS 67 11.675 -0.765 -9.679 549 HZ1 LYS 67 HZ1 LYS 67 13.541 -0.634 -11.939 550 HZ2 LYS 67 HZ2 LYS 67 13.551 -1.665 -10.589 551 HZ3 LYS 67 HZ3 LYS 67 12.454 -1.936 -11.853 552 H LYS 68 HN LYS 68 6.973 2.713 -13.467 553 HA LYS 68 HA LYS 68 4.136 2.457 -13.528 554 HB2 LYS 68 HB2 LYS 68 5.736 4.072 -14.850 555 HB3 LYS 68 HB1 LYS 68 5.752 2.768 -16.039 556 HG2 LYS 68 HG2 LYS 68 3.267 2.806 -16.082 557 HG3 LYS 68 HG1 LYS 68 3.286 4.165 -14.958 558 HD2 LYS 68 HD2 LYS 68 4.703 5.420 -16.627 559 HD3 LYS 68 HD1 LYS 68 4.421 4.103 -17.766 560 HE2 LYS 68 HE2 LYS 68 2.799 5.900 -18.153 561 HE3 LYS 68 HE1 LYS 68 1.974 4.464 -17.548 562 HZ1 LYS 68 HZ1 LYS 68 2.151 7.051 -16.392 563 HZ2 LYS 68 HZ2 LYS 68 1.166 5.741 -15.945 564 HZ3 LYS 68 HZ3 LYS 68 2.735 5.875 -15.314 565 H THR 69 HN THR 69 2.912 0.783 -14.042 566 HA THR 69 HA THR 69 4.045 -1.393 -15.703 567 HB THR 69 HB THR 69 4.001 -2.163 -13.394 568 HG1 THR 69 HG1 THR 69 2.751 -3.946 -13.745 569 HG21 THR 69 HG21 THR 69 2.352 -0.545 -12.538 570 HG22 THR 69 HG22 THR 69 1.080 -1.357 -13.451 571 HG23 THR 69 HG23 THR 69 1.885 -2.195 -12.126 572 H SER 70 HN SER 70 2.198 -2.847 -16.508 573 HA SER 70 HA SER 70 0.112 -1.091 -17.611 574 HB2 SER 70 HB2 SER 70 1.234 -2.259 -19.338 575 HB3 SER 70 HB1 SER 70 1.222 -3.771 -18.433 576 HG SER 70 HG SER 70 -0.516 -3.012 -20.198 577 H ASP 71 HN ASP 71 0.459 -2.886 -14.981 578 HA ASP 71 HA ASP 71 -1.185 -4.799 -14.433 579 HB2 ASP 71 HB2 ASP 71 -0.199 -3.181 -12.755 580 HB3 ASP 71 HB1 ASP 71 -1.658 -2.216 -12.958 581 H ASP 72 HN ASP 72 -2.581 -1.564 -15.192 582 HA ASP 72 HA ASP 72 -4.797 -2.666 -16.529 583 HB2 ASP 72 HB2 ASP 72 -5.587 -3.394 -14.383 584 HB3 ASP 72 HB1 ASP 72 -5.269 -1.816 -13.669 585 H GLY 73 HN GLY 73 -4.035 -1.055 -17.932 586 HA2 GLY 73 HA2 GLY 73 -4.457 0.973 -18.991 587 HA3 GLY 73 HA1 GLY 73 -5.329 1.504 -17.557 588 H GLU 74 HN GLU 74 -4.333 2.815 -16.116 589 HA GLU 74 HA GLU 74 -1.439 3.359 -16.483 590 HB2 GLU 74 HB2 GLU 74 -3.678 5.310 -15.896 591 HB3 GLU 74 HB1 GLU 74 -1.962 5.708 -15.799 592 HG2 GLU 74 HG2 GLU 74 -1.699 5.051 -18.181 593 HG3 GLU 74 HG1 GLU 74 -3.431 4.734 -18.267 594 H VAL 75 HN VAL 75 -0.834 1.977 -14.759 595 HA VAL 75 HA VAL 75 -1.576 2.995 -12.091 596 HB VAL 75 HB VAL 75 -1.376 0.073 -12.826 597 HG11 VAL 75 HG11 VAL 75 -2.534 0.008 -10.461 598 HG12 VAL 75 HG12 VAL 75 -0.786 0.203 -10.567 599 HG13 VAL 75 HG13 VAL 75 -1.811 1.606 -10.267 600 HG21 VAL 75 HG21 VAL 75 -3.908 0.274 -12.135 601 HG22 VAL 75 HG22 VAL 75 -3.696 1.975 -12.554 602 HG23 VAL 75 HG23 VAL 75 -3.419 0.728 -13.767 603 H TYR 76 HN TYR 76 -0.037 2.715 -10.462 604 HA TYR 76 HA TYR 76 2.693 2.075 -11.424 605 HB2 TYR 76 HB2 TYR 76 1.927 3.900 -9.135 606 HB3 TYR 76 HB1 TYR 76 3.529 3.682 -9.841 607 HD1 TYR 76 HD2 TYR 76 0.102 4.951 -10.503 608 HD2 TYR 76 HD1 TYR 76 4.175 4.800 -11.858 609 HE1 TYR 76 HE2 TYR 76 -0.396 6.694 -12.195 610 HE2 TYR 76 HE1 TYR 76 3.674 6.541 -13.553 611 HH TYR 76 HH TYR 76 0.895 8.431 -13.479 612 H TYR 77 HN TYR 77 4.068 0.944 -9.902 613 HA TYR 77 HA TYR 77 2.840 -0.159 -7.508 614 HB2 TYR 77 HB2 TYR 77 2.532 -2.346 -8.149 615 HB3 TYR 77 HB1 TYR 77 2.192 -1.544 -9.680 616 HD1 TYR 77 HD2 TYR 77 4.219 -1.174 -11.284 617 HD2 TYR 77 HD1 TYR 77 4.208 -3.989 -8.041 618 HE1 TYR 77 HE2 TYR 77 6.084 -2.412 -12.352 619 HE2 TYR 77 HE1 TYR 77 6.072 -5.227 -9.109 620 HH TYR 77 HH TYR 77 6.991 -4.765 -12.305 621 H SER 78 HN SER 78 4.281 -0.850 -5.983 622 HA SER 78 HA SER 78 7.138 -0.601 -6.666 623 HB2 SER 78 HB2 SER 78 6.295 0.776 -4.788 624 HB3 SER 78 HB1 SER 78 5.748 -0.686 -3.973 625 HG SER 78 HG SER 78 7.941 -1.393 -4.007 626 H GLU 79 HN GLU 79 7.782 -2.543 -7.419 627 HA GLU 79 HA GLU 79 6.769 -5.052 -6.788 628 HB2 GLU 79 HB2 GLU 79 8.338 -4.443 -8.679 629 HB3 GLU 79 HB1 GLU 79 9.652 -4.515 -7.507 630 HG2 GLU 79 HG2 GLU 79 7.724 -6.813 -7.912 631 HG3 GLU 79 HG1 GLU 79 9.208 -6.653 -8.847 632 H GLU 80 HN GLU 80 9.357 -3.241 -5.188 633 HA GLU 80 HA GLU 80 10.169 -5.388 -3.495 634 HB2 GLU 80 HB2 GLU 80 11.470 -3.710 -2.318 635 HB3 GLU 80 HB1 GLU 80 11.617 -3.461 -4.057 636 HG2 GLU 80 HG2 GLU 80 9.748 -1.770 -3.884 637 HG3 GLU 80 HG1 GLU 80 9.862 -1.918 -2.132 638 H ALA 81 HN ALA 81 7.772 -2.819 -3.164 639 HA ALA 81 HA ALA 81 7.241 -3.676 -0.386 640 HB1 ALA 81 HB1 ALA 81 6.025 -1.278 -1.735 641 HB2 ALA 81 HB2 ALA 81 7.643 -1.220 -1.038 642 HB3 ALA 81 HB3 ALA 81 6.255 -1.580 -0.014 643 H LYS 82 HN LYS 82 6.238 -4.716 -3.249 644 HA LYS 82 HA LYS 82 4.196 -5.390 -4.180 645 HB2 LYS 82 HB2 LYS 82 4.048 -6.384 -1.323 646 HB3 LYS 82 HB1 LYS 82 3.044 -6.978 -2.646 647 HG2 LYS 82 HG2 LYS 82 5.236 -7.468 -3.884 648 HG3 LYS 82 HG1 LYS 82 6.042 -7.211 -2.338 649 HD2 LYS 82 HD2 LYS 82 3.819 -9.216 -2.838 650 HD3 LYS 82 HD1 LYS 82 5.534 -9.610 -2.718 651 HE2 LYS 82 HE2 LYS 82 3.712 -8.550 -0.552 652 HE3 LYS 82 HE1 LYS 82 4.644 -10.045 -0.555 653 HZ1 LYS 82 HZ1 LYS 82 5.657 -7.271 -0.342 654 HZ2 LYS 82 HZ2 LYS 82 5.825 -8.535 0.780 655 HZ3 LYS 82 HZ3 LYS 82 6.669 -8.590 -0.690 656 H LYS 83 HN LYS 83 3.745 -2.922 -4.022 657 HA LYS 83 HA LYS 83 1.059 -2.623 -2.853 658 HB2 LYS 83 HB2 LYS 83 2.564 -1.613 -1.216 659 HB3 LYS 83 HB1 LYS 83 3.321 -0.644 -2.480 660 HG2 LYS 83 HG2 LYS 83 1.291 0.584 -2.868 661 HG3 LYS 83 HG1 LYS 83 0.365 -0.510 -1.840 662 HD2 LYS 83 HD2 LYS 83 1.329 0.317 0.135 663 HD3 LYS 83 HD1 LYS 83 2.719 0.992 -0.706 664 HE2 LYS 83 HE2 LYS 83 1.487 2.823 -1.534 665 HE3 LYS 83 HE1 LYS 83 -0.061 2.026 -1.254 666 HZ1 LYS 83 HZ1 LYS 83 1.540 2.347 1.119 667 HZ2 LYS 83 HZ2 LYS 83 1.081 3.819 0.405 668 HZ3 LYS 83 HZ3 LYS 83 -0.103 2.694 0.861 669 H LYS 84 HN LYS 84 -0.315 -1.778 -4.261 670 HA LYS 84 HA LYS 84 0.742 -0.287 -6.599 671 HB2 LYS 84 HB2 LYS 84 -0.053 -2.682 -6.995 672 HB3 LYS 84 HB1 LYS 84 -1.670 -2.095 -6.615 673 HG2 LYS 84 HG2 LYS 84 -1.482 -0.423 -8.425 674 HG3 LYS 84 HG1 LYS 84 0.119 -1.044 -8.813 675 HD2 LYS 84 HD2 LYS 84 -1.494 -2.058 -10.328 676 HD3 LYS 84 HD1 LYS 84 -0.880 -3.289 -9.229 677 HE2 LYS 84 HE2 LYS 84 -3.343 -1.813 -8.386 678 HE3 LYS 84 HE1 LYS 84 -3.504 -3.002 -9.677 679 HZ1 LYS 84 HZ1 LYS 84 -2.008 -4.358 -7.957 680 HZ2 LYS 84 HZ2 LYS 84 -2.883 -3.391 -6.869 681 HZ3 LYS 84 HZ3 LYS 84 -3.706 -4.404 -7.951 682 H VAL 85 HN VAL 85 -0.175 1.579 -7.133 683 HA VAL 85 HA VAL 85 -2.802 2.224 -5.971 684 HB VAL 85 HB VAL 85 -2.136 4.190 -5.002 685 HG11 VAL 85 HG11 VAL 85 -0.992 2.167 -4.002 686 HG12 VAL 85 HG12 VAL 85 0.471 2.704 -4.823 687 HG13 VAL 85 HG13 VAL 85 -0.275 3.723 -3.598 688 HG21 VAL 85 HG21 VAL 85 0.249 5.200 -5.518 689 HG22 VAL 85 HG22 VAL 85 0.121 4.272 -7.008 690 HG23 VAL 85 HG23 VAL 85 -1.073 5.519 -6.638 691 H GLU 86 HN GLU 86 -4.175 2.899 -7.418 692 HA GLU 86 HA GLU 86 -3.169 3.922 -10.019 693 HB2 GLU 86 HB2 GLU 86 -5.186 2.855 -11.011 694 HB3 GLU 86 HB1 GLU 86 -4.091 1.689 -10.275 695 HG2 GLU 86 HG2 GLU 86 -5.497 1.826 -8.179 696 HG3 GLU 86 HG1 GLU 86 -6.658 2.777 -9.103 697 H VAL 87 HN VAL 87 -4.026 5.728 -10.819 698 HA VAL 87 HA VAL 87 -5.454 7.512 -9.210 699 HB VAL 87 HB VAL 87 -4.269 8.478 -10.982 700 HG11 VAL 87 HG11 VAL 87 -3.876 6.616 -12.398 701 HG12 VAL 87 HG12 VAL 87 -5.598 6.372 -12.690 702 HG13 VAL 87 HG13 VAL 87 -4.773 7.761 -13.395 703 HG21 VAL 87 HG21 VAL 87 -6.952 8.511 -12.341 704 HG22 VAL 87 HG22 VAL 87 -6.825 9.180 -10.716 705 HG23 VAL 87 HG23 VAL 87 -5.844 9.845 -12.022 706 H LEU 88 HN LEU 88 -7.283 6.685 -8.321 707 HA LEU 88 HA LEU 88 -9.408 5.585 -9.999 708 HB2 LEU 88 HB2 LEU 88 -8.645 4.981 -7.471 709 HB3 LEU 88 HB1 LEU 88 -9.857 6.202 -7.106 710 HG LEU 88 HG LEU 88 -10.914 4.015 -7.113 711 HD11 LEU 88 HD11 LEU 88 -12.729 4.482 -8.557 712 HD12 LEU 88 HD12 LEU 88 -12.053 6.060 -8.157 713 HD13 LEU 88 HD13 LEU 88 -11.701 5.317 -9.719 714 HD21 LEU 88 HD21 LEU 88 -9.076 3.238 -8.945 715 HD22 LEU 88 HD22 LEU 88 -10.599 2.388 -8.704 716 HD23 LEU 88 HD23 LEU 88 -10.437 3.544 -10.024 717 H ASP 89 HN ASP 89 -8.300 8.480 -8.706 718 HA ASP 89 HA ASP 89 -10.025 10.184 -10.037 719 HB2 ASP 89 HB2 ASP 89 -11.429 9.141 -7.919 720 HB3 ASP 89 HB1 ASP 89 -10.677 10.537 -7.158 721 H THR 90 HN THR 90 -8.654 11.888 -10.288 722 HA THR 90 HA THR 90 -7.095 12.786 -7.988 723 HB THR 90 HB THR 90 -5.943 10.949 -9.536 724 HG1 THR 90 HG1 THR 90 -4.936 13.140 -8.162 725 HG21 THR 90 HG21 THR 90 -5.107 13.543 -10.859 726 HG22 THR 90 HG22 THR 90 -4.552 11.918 -11.257 727 HG23 THR 90 HG23 THR 90 -6.221 12.381 -11.580 728 H ASP 91 HN ASP 91 -7.161 14.882 -7.849 729 HA ASP 91 HA ASP 91 -8.058 16.492 -10.122 730 HB2 ASP 91 HB2 ASP 91 -8.950 16.785 -7.765 731 HB3 ASP 91 HB1 ASP 91 -7.362 17.419 -7.337 732 H TYR 92 HN TYR 92 -5.221 15.730 -8.304 733 HA TYR 92 HA TYR 92 -3.027 16.323 -8.504 734 HB2 TYR 92 HB2 TYR 92 -4.162 16.339 -11.190 735 HB3 TYR 92 HB1 TYR 92 -2.818 17.467 -11.065 736 HD1 TYR 92 HD2 TYR 92 -3.445 14.184 -9.360 737 HD2 TYR 92 HD1 TYR 92 -0.951 16.435 -12.038 738 HE1 TYR 92 HE2 TYR 92 -1.851 12.291 -9.470 739 HE2 TYR 92 HE1 TYR 92 0.642 14.538 -12.143 740 HH TYR 92 HH TYR 92 0.142 11.687 -11.610 741 H LYS 93 HN LYS 93 -5.207 18.490 -7.778 742 HA LYS 93 HA LYS 93 -3.266 20.648 -7.686 743 HB2 LYS 93 HB2 LYS 93 -4.558 20.833 -9.881 744 HB3 LYS 93 HB1 LYS 93 -5.982 21.160 -8.895 745 HG2 LYS 93 HG2 LYS 93 -4.708 23.025 -7.791 746 HG3 LYS 93 HG1 LYS 93 -3.408 22.760 -8.953 747 HD2 LYS 93 HD2 LYS 93 -4.932 23.229 -10.811 748 HD3 LYS 93 HD1 LYS 93 -6.276 23.418 -9.685 749 HE2 LYS 93 HE2 LYS 93 -4.870 25.249 -8.561 750 HE3 LYS 93 HE1 LYS 93 -3.844 25.185 -9.994 751 HZ1 LYS 93 HZ1 LYS 93 -6.581 26.149 -9.704 752 HZ2 LYS 93 HZ2 LYS 93 -5.325 26.723 -10.693 753 HZ3 LYS 93 HZ3 LYS 93 -6.202 25.346 -11.152 754 H SER 94 HN SER 94 -6.428 19.313 -6.880 755 HA SER 94 HA SER 94 -6.518 21.060 -4.479 756 HB2 SER 94 HB2 SER 94 -8.908 19.731 -5.742 757 HB3 SER 94 HB1 SER 94 -8.876 21.060 -4.587 758 HG SER 94 HG SER 94 -7.431 21.564 -6.848 759 H TYR 95 HN TYR 95 -7.812 17.901 -5.595 760 HA TYR 95 HA TYR 95 -6.719 16.581 -3.246 761 HB2 TYR 95 HB2 TYR 95 -9.035 15.684 -2.659 762 HB3 TYR 95 HB1 TYR 95 -8.717 17.364 -2.221 763 HD1 TYR 95 HD2 TYR 95 -10.478 15.132 -4.576 764 HD2 TYR 95 HD1 TYR 95 -9.785 19.205 -3.401 765 HE1 TYR 95 HE2 TYR 95 -12.382 15.863 -5.987 766 HE2 TYR 95 HE1 TYR 95 -11.691 19.935 -4.811 767 HH TYR 95 HH TYR 95 -13.819 17.609 -6.371 768 H ALA 96 HN ALA 96 -7.026 14.214 -3.356 769 HA ALA 96 HA ALA 96 -7.982 13.196 -5.933 770 HB1 ALA 96 HB1 ALA 96 -5.151 12.817 -4.938 771 HB2 ALA 96 HB2 ALA 96 -5.647 13.668 -6.397 772 HB3 ALA 96 HB3 ALA 96 -5.866 11.921 -6.273 773 H VAL 97 HN VAL 97 -8.663 11.132 -5.918 774 HA VAL 97 HA VAL 97 -8.471 9.637 -3.357 775 HB VAL 97 HB VAL 97 -10.723 9.203 -5.311 776 HG11 VAL 97 HG11 VAL 97 -10.272 8.822 -2.350 777 HG12 VAL 97 HG12 VAL 97 -11.891 8.811 -3.039 778 HG13 VAL 97 HG13 VAL 97 -10.705 7.619 -3.561 779 HG21 VAL 97 HG21 VAL 97 -10.441 11.478 -3.342 780 HG22 VAL 97 HG22 VAL 97 -10.902 11.557 -5.041 781 HG23 VAL 97 HG23 VAL 97 -12.020 10.884 -3.856 782 H ILE 98 HN ILE 98 -7.267 7.826 -3.579 783 HA ILE 98 HA ILE 98 -7.121 6.576 -6.258 784 HB ILE 98 HB ILE 98 -4.867 6.733 -4.267 785 HG12 ILE 98 HG12 ILE 98 -5.421 8.613 -6.588 786 HG13 ILE 98 HG11 ILE 98 -5.643 9.034 -4.893 787 HG21 ILE 98 HG21 ILE 98 -4.966 5.074 -6.269 788 HG22 ILE 98 HG22 ILE 98 -4.693 6.502 -7.266 789 HG23 ILE 98 HG23 ILE 98 -3.505 6.034 -6.052 790 HD11 ILE 98 HD11 ILE 98 -3.125 8.644 -6.430 791 HD12 ILE 98 HD12 ILE 98 -3.509 9.828 -5.181 792 HD13 ILE 98 HD13 ILE 98 -3.130 8.168 -4.728 793 H TYR 99 HN TYR 99 -6.889 4.374 -6.341 794 HA TYR 99 HA TYR 99 -7.788 2.924 -3.949 795 HB2 TYR 99 HB2 TYR 99 -8.751 2.737 -6.398 796 HB3 TYR 99 HB1 TYR 99 -7.392 1.642 -6.639 797 HD1 TYR 99 HD1 TYR 99 -10.561 2.193 -4.854 798 HD2 TYR 99 HD2 TYR 99 -7.250 -0.483 -5.426 799 HE1 TYR 99 HE1 TYR 99 -11.829 0.384 -3.729 800 HE2 TYR 99 HE2 TYR 99 -8.519 -2.293 -4.300 801 HH TYR 99 HH TYR 99 -10.953 -2.848 -3.890 802 H ALA 100 HN ALA 100 -6.170 2.385 -2.666 803 HA ALA 100 HA ALA 100 -3.625 1.399 -3.799 804 HB1 ALA 100 HB1 ALA 100 -2.828 1.624 -1.407 805 HB2 ALA 100 HB2 ALA 100 -4.382 2.370 -1.039 806 HB3 ALA 100 HB3 ALA 100 -3.286 3.136 -2.189 807 H THR 101 HN THR 101 -2.879 -0.626 -3.448 808 HA THR 101 HA THR 101 -4.352 -2.418 -1.646 809 HB THR 101 HB THR 101 -5.481 -2.754 -3.754 810 HG1 THR 101 HG1 THR 101 -3.547 -4.738 -3.170 811 HG21 THR 101 HG21 THR 101 -3.595 -1.787 -5.135 812 HG22 THR 101 HG22 THR 101 -2.775 -3.340 -4.972 813 HG23 THR 101 HG23 THR 101 -4.326 -3.246 -5.806 814 H ARG 102 HN ARG 102 -3.084 -3.797 -0.607 815 HA ARG 102 HA ARG 102 -0.299 -4.181 -1.545 816 HB2 ARG 102 HB2 ARG 102 -0.592 -2.801 0.576 817 HB3 ARG 102 HB1 ARG 102 -1.228 -4.263 1.328 818 HG2 ARG 102 HG2 ARG 102 0.891 -5.445 0.657 819 HG3 ARG 102 HG1 ARG 102 1.524 -3.889 0.121 820 HD2 ARG 102 HD2 ARG 102 1.011 -3.017 2.458 821 HD3 ARG 102 HD1 ARG 102 0.730 -4.692 2.925 822 HE ARG 102 HE ARG 102 3.028 -5.052 2.838 823 HH11 ARG 102 HH21 ARG 102 2.156 -2.077 1.301 824 HH12 ARG 102 HH22 ARG 102 3.790 -1.536 1.112 825 HH21 ARG 102 HH11 ARG 102 5.174 -4.348 2.593 826 HH22 ARG 102 HH12 ARG 102 5.499 -2.821 1.844 827 H VAL 103 HN VAL 103 0.208 -6.345 -1.982 828 HA VAL 103 HA VAL 103 -1.659 -8.346 -0.850 829 HB VAL 103 HB VAL 103 -1.909 -8.072 -3.274 830 HG11 VAL 103 HG11 VAL 103 0.932 -9.026 -3.612 831 HG12 VAL 103 HG12 VAL 103 -0.127 -8.262 -4.797 832 HG13 VAL 103 HG13 VAL 103 0.568 -7.304 -3.490 833 HG21 VAL 103 HG21 VAL 103 -0.422 -10.628 -2.584 834 HG22 VAL 103 HG22 VAL 103 -2.126 -10.335 -2.243 835 HG23 VAL 103 HG23 VAL 103 -1.562 -10.406 -3.910 836 H LYS 104 HN LYS 104 -0.773 -9.680 0.559 837 HA LYS 104 HA LYS 104 2.143 -10.075 0.554 838 HB2 LYS 104 HB2 LYS 104 0.731 -9.315 2.632 839 HB3 LYS 104 HB1 LYS 104 0.280 -11.016 2.725 840 HG2 LYS 104 HG2 LYS 104 2.645 -11.660 2.837 841 HG3 LYS 104 HG1 LYS 104 3.129 -9.973 2.675 842 HD2 LYS 104 HD2 LYS 104 1.804 -9.484 4.770 843 HD3 LYS 104 HD1 LYS 104 1.593 -11.224 4.965 844 HE2 LYS 104 HE2 LYS 104 4.278 -9.832 4.760 845 HE3 LYS 104 HE1 LYS 104 3.528 -10.345 6.272 846 HZ1 LYS 104 HZ1 LYS 104 4.964 -11.887 4.359 847 HZ2 LYS 104 HZ2 LYS 104 4.478 -12.304 5.933 848 HZ3 LYS 104 HZ3 LYS 104 3.418 -12.540 4.630 849 H ASP 105 HN ASP 105 2.780 -12.377 1.230 850 HA ASP 105 HA ASP 105 1.927 -14.172 -0.732 851 HB2 ASP 105 HB2 ASP 105 3.151 -15.878 0.523 852 HB3 ASP 105 HB1 ASP 105 4.072 -14.376 0.465 853 H GLY 106 HN GLY 106 -0.047 -14.940 -0.952 854 HA2 GLY 106 HA2 GLY 106 -1.829 -16.353 -0.481 855 HA3 GLY 106 HA1 GLY 106 -1.257 -16.484 1.175 856 H ARG 107 HN ARG 107 -1.321 -13.249 0.738 857 HA ARG 107 HA ARG 107 -4.206 -13.008 1.390 858 HB2 ARG 107 HB2 ARG 107 -1.991 -11.519 2.805 859 HB3 ARG 107 HB1 ARG 107 -3.710 -11.507 3.198 860 HG2 ARG 107 HG2 ARG 107 -3.608 -13.933 3.685 861 HG3 ARG 107 HG1 ARG 107 -1.881 -13.922 3.330 862 HD2 ARG 107 HD2 ARG 107 -1.673 -12.106 5.121 863 HD3 ARG 107 HD1 ARG 107 -3.320 -12.519 5.586 864 HE ARG 107 HE ARG 107 -0.972 -14.015 6.208 865 HH11 ARG 107 HH21 ARG 107 -4.304 -14.285 5.318 866 HH12 ARG 107 HH22 ARG 107 -4.531 -15.816 6.095 867 HH21 ARG 107 HH11 ARG 107 -1.261 -16.024 7.229 868 HH22 ARG 107 HH12 ARG 107 -2.808 -16.801 7.177 869 H THR 108 HN THR 108 -5.262 -11.270 0.627 870 HA THR 108 HA THR 108 -3.737 -9.263 -0.939 871 HB THR 108 HB THR 108 -6.486 -10.383 -1.547 872 HG1 THR 108 HG1 THR 108 -3.915 -11.031 -2.336 873 HG21 THR 108 HG21 THR 108 -6.128 -9.103 -3.690 874 HG22 THR 108 HG22 THR 108 -6.320 -8.085 -2.262 875 HG23 THR 108 HG23 THR 108 -4.715 -8.361 -2.939 876 H LEU 109 HN LEU 109 -4.535 -7.111 -0.863 877 HA LEU 109 HA LEU 109 -6.755 -6.564 0.980 878 HB2 LEU 109 HB2 LEU 109 -4.891 -6.599 2.458 879 HB3 LEU 109 HB1 LEU 109 -3.916 -5.629 1.385 880 HG LEU 109 HG LEU 109 -5.573 -3.748 1.725 881 HD11 LEU 109 HD11 LEU 109 -7.544 -4.926 2.427 882 HD12 LEU 109 HD12 LEU 109 -6.668 -5.750 3.715 883 HD13 LEU 109 HD13 LEU 109 -6.988 -4.020 3.830 884 HD21 LEU 109 HD21 LEU 109 -3.405 -4.152 3.057 885 HD22 LEU 109 HD22 LEU 109 -4.595 -3.066 3.771 886 HD23 LEU 109 HD23 LEU 109 -4.454 -4.725 4.352 887 H HIS 110 HN HIS 110 -7.701 -4.626 0.743 888 HA HIS 110 HA HIS 110 -6.613 -2.789 -1.258 889 HB2 HIS 110 HB2 HIS 110 -9.050 -2.440 -2.020 890 HB3 HIS 110 HB1 HIS 110 -8.244 -3.913 -2.559 891 HD1 HIS 110 HD1 HIS 110 -9.531 -6.001 -2.139 892 HD2 HIS 110 HD2 HIS 110 -10.580 -2.998 0.555 893 HE1 HIS 110 HE1 HIS 110 -11.383 -6.950 -0.695 894 H MET 111 HN MET 111 -7.157 -0.561 -0.902 895 HA MET 111 HA MET 111 -8.889 0.124 1.296 896 HB2 MET 111 HB2 MET 111 -6.907 1.458 2.364 897 HB3 MET 111 HB1 MET 111 -7.094 -0.256 2.733 898 HG2 MET 111 HG2 MET 111 -5.375 -0.883 1.224 899 HG3 MET 111 HG1 MET 111 -5.380 0.694 0.436 900 HE1 MET 111 HE1 MET 111 -4.652 2.741 1.256 901 HE2 MET 111 HE2 MET 111 -3.309 2.965 2.373 902 HE3 MET 111 HE3 MET 111 -3.079 2.040 0.884 903 H MET 112 HN MET 112 -9.296 2.401 1.448 904 HA MET 112 HA MET 112 -8.739 3.815 -1.082 905 HB2 MET 112 HB2 MET 112 -10.627 4.735 1.078 906 HB3 MET 112 HB1 MET 112 -10.638 5.152 -0.629 907 HG2 MET 112 HG2 MET 112 -11.120 2.332 0.338 908 HG3 MET 112 HG1 MET 112 -12.423 3.503 0.185 909 HE1 MET 112 HE1 MET 112 -13.046 4.176 -3.312 910 HE2 MET 112 HE2 MET 112 -13.065 4.718 -1.638 911 HE3 MET 112 HE3 MET 112 -11.724 5.166 -2.701 912 H ARG 113 HN ARG 113 -7.585 5.704 -1.111 913 HA ARG 113 HA ARG 113 -6.709 6.819 1.495 914 HB2 ARG 113 HB2 ARG 113 -4.853 5.579 0.605 915 HB3 ARG 113 HB1 ARG 113 -5.072 6.289 -0.989 916 HG2 ARG 113 HG2 ARG 113 -4.712 8.263 1.204 917 HG3 ARG 113 HG1 ARG 113 -3.311 7.241 0.904 918 HD2 ARG 113 HD2 ARG 113 -3.573 7.846 -1.571 919 HD3 ARG 113 HD1 ARG 113 -4.714 9.082 -1.044 920 HE ARG 113 HE ARG 113 -2.455 9.470 0.495 921 HH11 ARG 113 HH21 ARG 113 -3.259 9.343 -2.867 922 HH12 ARG 113 HH22 ARG 113 -1.999 10.428 -3.352 923 HH21 ARG 113 HH11 ARG 113 -0.800 10.894 -0.132 924 HH22 ARG 113 HH12 ARG 113 -0.606 11.306 -1.804 925 H LEU 114 HN LEU 114 -7.029 8.943 1.724 926 HA LEU 114 HA LEU 114 -7.641 10.549 -0.686 927 HB2 LEU 114 HB2 LEU 114 -9.612 10.283 0.681 928 HB3 LEU 114 HB1 LEU 114 -8.720 10.717 2.122 929 HG LEU 114 HG LEU 114 -8.393 12.991 1.301 930 HD11 LEU 114 HD11 LEU 114 -8.145 12.793 -1.032 931 HD12 LEU 114 HD12 LEU 114 -9.618 11.839 -1.200 932 HD13 LEU 114 HD13 LEU 114 -9.719 13.567 -0.868 933 HD21 LEU 114 HD21 LEU 114 -10.853 13.658 1.059 934 HD22 LEU 114 HD22 LEU 114 -11.227 11.936 1.132 935 HD23 LEU 114 HD23 LEU 114 -10.446 12.729 2.501 936 H TYR 115 HN TYR 115 -6.336 12.163 -1.077 937 HA TYR 115 HA TYR 115 -4.606 13.181 1.087 938 HB2 TYR 115 HB2 TYR 115 -2.803 12.783 -0.237 939 HB3 TYR 115 HB1 TYR 115 -3.883 11.918 -1.317 940 HD1 TYR 115 HD1 TYR 115 -5.403 13.636 -2.814 941 HD2 TYR 115 HD2 TYR 115 -1.482 14.422 -1.253 942 HE1 TYR 115 HE1 TYR 115 -5.039 15.337 -4.581 943 HE2 TYR 115 HE2 TYR 115 -1.124 16.129 -3.017 944 HH TYR 115 HH TYR 115 -3.323 16.504 -5.683 945 H SER 116 HN SER 116 -4.041 15.411 1.011 946 HA SER 116 HA SER 116 -5.943 17.109 -0.512 947 HB2 SER 116 HB2 SER 116 -6.516 17.260 1.825 948 HB3 SER 116 HB1 SER 116 -4.826 17.456 2.283 949 HG SER 116 HG SER 116 -6.105 19.232 0.496 950 H ARG 117 HN ARG 117 -5.080 19.013 -1.453 951 HA ARG 117 HA ARG 117 -2.255 18.879 -2.015 952 HB2 ARG 117 HB2 ARG 117 -4.049 19.511 -3.685 953 HB3 ARG 117 HB1 ARG 117 -4.229 21.028 -2.812 954 HG2 ARG 117 HG2 ARG 117 -2.684 21.651 -4.439 955 HG3 ARG 117 HG1 ARG 117 -1.603 21.176 -3.135 956 HD2 ARG 117 HD2 ARG 117 -1.756 18.795 -4.252 957 HD3 ARG 117 HD1 ARG 117 -2.275 19.706 -5.667 958 HE ARG 117 HE ARG 117 -0.079 20.371 -5.934 959 HH11 ARG 117 HH21 ARG 117 -0.669 19.430 -2.656 960 HH12 ARG 117 HH22 ARG 117 0.977 19.627 -2.157 961 HH21 ARG 117 HH11 ARG 117 2.084 20.634 -5.283 962 HH22 ARG 117 HH12 ARG 117 2.535 20.309 -3.644 963 H SER 118 HN SER 118 -4.336 20.599 0.157 964 HA SER 118 HA SER 118 -2.046 22.266 1.023 965 HB2 SER 118 HB2 SER 118 -3.835 23.611 -0.018 966 HB3 SER 118 HB1 SER 118 -4.987 22.963 1.146 967 HG SER 118 HG SER 118 -3.698 23.876 2.797 968 HA PRO 119 HA PRO 119 -2.077 20.270 4.984 969 HB2 PRO 119 HB2 PRO 119 -2.324 23.083 6.016 970 HB3 PRO 119 HB1 PRO 119 -1.233 21.785 6.541 971 HG2 PRO 119 HG2 PRO 119 -0.411 23.781 4.946 972 HG3 PRO 119 HG1 PRO 119 0.238 22.138 4.819 973 HD2 PRO 119 HD2 PRO 119 -1.534 23.584 2.946 974 HD3 PRO 119 HD1 PRO 119 -0.522 22.150 2.662 975 H GLU 120 HN GLU 120 -4.520 22.525 3.983 976 HA GLU 120 HA GLU 120 -6.322 21.924 6.179 977 HB2 GLU 120 HB2 GLU 120 -6.804 23.500 3.641 978 HB3 GLU 120 HB1 GLU 120 -7.837 23.471 5.071 979 HG2 GLU 120 HG2 GLU 120 -5.927 24.364 6.415 980 HG3 GLU 120 HG1 GLU 120 -4.990 24.504 4.928 981 H VAL 121 HN VAL 121 -8.551 21.272 5.646 982 HA VAL 121 HA VAL 121 -8.602 19.172 3.550 983 HB VAL 121 HB VAL 121 -10.098 19.204 6.183 984 HG11 VAL 121 HG11 VAL 121 -11.245 17.964 4.407 985 HG12 VAL 121 HG12 VAL 121 -9.758 17.093 4.032 986 HG13 VAL 121 HG13 VAL 121 -10.562 16.839 5.580 987 HG21 VAL 121 HG21 VAL 121 -8.513 17.350 6.768 988 HG22 VAL 121 HG22 VAL 121 -7.607 17.714 5.300 989 HG23 VAL 121 HG23 VAL 121 -7.714 18.912 6.590 990 H SER 122 HN SER 122 -9.868 19.772 1.911 991 HA SER 122 HA SER 122 -11.920 21.769 2.235 992 HB2 SER 122 HB2 SER 122 -12.260 21.488 -0.177 993 HB3 SER 122 HB1 SER 122 -10.546 21.660 0.191 994 HG SER 122 HG SER 122 -10.325 19.437 0.007 995 HA PRO 123 HA PRO 123 -15.208 18.917 3.108 996 HB2 PRO 123 HB2 PRO 123 -17.363 20.385 2.235 997 HB3 PRO 123 HB1 PRO 123 -16.507 20.711 3.755 998 HG2 PRO 123 HG2 PRO 123 -16.251 22.072 1.113 999 HG3 PRO 123 HG1 PRO 123 -16.268 22.768 2.744 1000 HD2 PRO 123 HD2 PRO 123 -13.961 22.395 1.339 1001 HD3 PRO 123 HD1 PRO 123 -14.022 22.297 3.114 1002 H ALA 124 HN ALA 124 -14.917 20.332 -0.101 1003 HA ALA 124 HA ALA 124 -16.718 18.572 -1.435 1004 HB1 ALA 124 HB1 ALA 124 -16.080 20.662 -2.479 1005 HB2 ALA 124 HB2 ALA 124 -15.516 19.333 -3.494 1006 HB3 ALA 124 HB3 ALA 124 -14.378 20.198 -2.460 1007 H ALA 125 HN ALA 125 -13.238 18.517 -0.810 1008 HA ALA 125 HA ALA 125 -12.622 16.223 -2.350 1009 HB1 ALA 125 HB1 ALA 125 -11.268 17.308 0.131 1010 HB2 ALA 125 HB2 ALA 125 -10.900 17.768 -1.530 1011 HB3 ALA 125 HB3 ALA 125 -10.575 16.126 -0.977 1012 H THR 126 HN THR 126 -13.668 16.676 0.972 1013 HA THR 126 HA THR 126 -13.407 13.898 1.675 1014 HB THR 126 HB THR 126 -15.183 15.777 3.191 1015 HG1 THR 126 HG1 THR 126 -12.694 15.970 4.061 1016 HG21 THR 126 HG21 THR 126 -13.185 13.629 3.965 1017 HG22 THR 126 HG22 THR 126 -14.112 14.594 5.114 1018 HG23 THR 126 HG23 THR 126 -14.941 13.488 4.018 1019 H ALA 127 HN ALA 127 -15.970 15.962 0.364 1020 HA ALA 127 HA ALA 127 -18.072 14.085 0.826 1021 HB1 ALA 127 HB1 ALA 127 -19.331 15.594 -0.685 1022 HB2 ALA 127 HB2 ALA 127 -17.841 16.494 -0.968 1023 HB3 ALA 127 HB3 ALA 127 -18.545 16.439 0.649 1024 H ILE 128 HN ILE 128 -16.223 15.039 -2.118 1025 HA ILE 128 HA ILE 128 -17.554 13.343 -3.913 1026 HB ILE 128 HB ILE 128 -15.689 15.174 -4.260 1027 HG12 ILE 128 HG12 ILE 128 -16.830 14.109 -6.102 1028 HG13 ILE 128 HG11 ILE 128 -15.105 14.138 -6.435 1029 HG21 ILE 128 HG21 ILE 128 -13.966 12.678 -4.217 1030 HG22 ILE 128 HG22 ILE 128 -13.451 14.318 -4.600 1031 HG23 ILE 128 HG23 ILE 128 -13.953 13.915 -2.961 1032 HD11 ILE 128 HD11 ILE 128 -16.824 11.800 -5.638 1033 HD12 ILE 128 HD12 ILE 128 -15.717 11.936 -7.002 1034 HD13 ILE 128 HD13 ILE 128 -15.081 11.760 -5.369 1035 H PHE 129 HN PHE 129 -14.882 12.953 -1.794 1036 HA PHE 129 HA PHE 129 -14.033 10.355 -2.239 1037 HB2 PHE 129 HB2 PHE 129 -13.007 11.912 -0.609 1038 HB3 PHE 129 HB1 PHE 129 -14.396 11.675 0.449 1039 HD1 PHE 129 HD1 PHE 129 -14.893 9.444 1.411 1040 HD2 PHE 129 HD2 PHE 129 -11.337 10.211 -0.858 1041 HE1 PHE 129 HE1 PHE 129 -13.898 7.339 2.261 1042 HE2 PHE 129 HE2 PHE 129 -10.334 8.111 -0.002 1043 HZ PHE 129 HZ PHE 129 -11.618 6.685 1.559 1044 H ARG 130 HN ARG 130 -16.756 11.552 -0.360 1045 HA ARG 130 HA ARG 130 -17.599 9.072 0.718 1046 HB2 ARG 130 HB2 ARG 130 -18.198 11.498 1.415 1047 HB3 ARG 130 HB1 ARG 130 -19.447 11.386 0.176 1048 HG2 ARG 130 HG2 ARG 130 -20.120 9.171 1.322 1049 HG3 ARG 130 HG1 ARG 130 -19.128 9.725 2.673 1050 HD2 ARG 130 HD2 ARG 130 -21.424 11.281 1.452 1051 HD3 ARG 130 HD1 ARG 130 -21.512 10.361 2.952 1052 HE ARG 130 HE ARG 130 -20.305 12.956 2.597 1053 HH11 ARG 130 HH21 ARG 130 -20.280 9.994 4.386 1054 HH12 ARG 130 HH22 ARG 130 -19.589 10.699 5.810 1055 HH21 ARG 130 HH11 ARG 130 -19.400 13.887 4.461 1056 HH22 ARG 130 HH12 ARG 130 -19.091 12.904 5.852 1057 H LYS 131 HN LYS 131 -18.568 10.859 -2.206 1058 HA LYS 131 HA LYS 131 -20.786 9.415 -2.972 1059 HB2 LYS 131 HB2 LYS 131 -19.881 11.429 -4.131 1060 HB3 LYS 131 HB1 LYS 131 -18.628 10.411 -4.842 1061 HG2 LYS 131 HG2 LYS 131 -20.352 9.011 -5.906 1062 HG3 LYS 131 HG1 LYS 131 -21.615 10.007 -5.182 1063 HD2 LYS 131 HD2 LYS 131 -20.798 11.972 -6.405 1064 HD3 LYS 131 HD1 LYS 131 -19.487 11.014 -7.094 1065 HE2 LYS 131 HE2 LYS 131 -22.388 10.251 -7.458 1066 HE3 LYS 131 HE1 LYS 131 -21.560 11.339 -8.571 1067 HZ1 LYS 131 HZ1 LYS 131 -19.795 9.355 -8.399 1068 HZ2 LYS 131 HZ2 LYS 131 -21.239 8.482 -8.190 1069 HZ3 LYS 131 HZ3 LYS 131 -21.014 9.425 -9.582 1070 H LEU 132 HN LEU 132 -17.463 8.738 -4.132 1071 HA LEU 132 HA LEU 132 -18.147 6.304 -5.377 1072 HB2 LEU 132 HB2 LEU 132 -15.645 5.816 -5.171 1073 HB3 LEU 132 HB1 LEU 132 -16.113 7.258 -6.062 1074 HG LEU 132 HG LEU 132 -15.878 8.271 -3.502 1075 HD11 LEU 132 HD11 LEU 132 -13.529 6.404 -3.804 1076 HD12 LEU 132 HD12 LEU 132 -14.010 7.345 -2.393 1077 HD13 LEU 132 HD13 LEU 132 -14.959 5.942 -2.882 1078 HD21 LEU 132 HD21 LEU 132 -14.919 9.184 -5.625 1079 HD22 LEU 132 HD22 LEU 132 -13.786 9.252 -4.279 1080 HD23 LEU 132 HD23 LEU 132 -13.616 8.001 -5.507 1081 H ALA 133 HN ALA 133 -17.167 7.049 -2.080 1082 HA ALA 133 HA ALA 133 -16.632 4.452 -1.183 1083 HB1 ALA 133 HB1 ALA 133 -16.652 5.339 0.942 1084 HB2 ALA 133 HB2 ALA 133 -18.070 6.343 0.632 1085 HB3 ALA 133 HB3 ALA 133 -16.492 6.824 0.009 1086 H GLY 134 HN GLY 134 -19.717 6.220 -1.427 1087 HA2 GLY 134 HA2 GLY 134 -21.368 4.295 -0.209 1088 HA3 GLY 134 HA1 GLY 134 -21.889 5.478 -1.404 1089 H GLU 135 HN GLU 135 -20.120 4.637 -3.473 1090 HA GLU 135 HA GLU 135 -21.688 2.575 -4.653 1091 HB2 GLU 135 HB2 GLU 135 -20.444 4.415 -5.879 1092 HB3 GLU 135 HB1 GLU 135 -18.963 3.511 -5.564 1093 HG2 GLU 135 HG2 GLU 135 -19.858 1.565 -6.743 1094 HG3 GLU 135 HG1 GLU 135 -21.392 2.396 -6.996 1095 H ARG 136 HN ARG 136 -19.022 2.553 -2.498 1096 HA ARG 136 HA ARG 136 -18.283 -0.203 -3.245 1097 HB2 ARG 136 HB2 ARG 136 -16.575 1.741 -2.887 1098 HB3 ARG 136 HB1 ARG 136 -16.865 1.456 -1.172 1099 HG2 ARG 136 HG2 ARG 136 -16.214 -0.896 -1.426 1100 HG3 ARG 136 HG1 ARG 136 -15.998 -0.668 -3.161 1101 HD2 ARG 136 HD2 ARG 136 -14.252 1.041 -2.688 1102 HD3 ARG 136 HD1 ARG 136 -14.432 0.716 -0.966 1103 HE ARG 136 HE ARG 136 -13.055 -0.936 -2.897 1104 HH11 ARG 136 HH21 ARG 136 -14.746 -0.803 0.119 1105 HH12 ARG 136 HH22 ARG 136 -13.991 -2.223 0.763 1106 HH21 ARG 136 HH11 ARG 136 -12.061 -2.799 -2.059 1107 HH22 ARG 136 HH12 ARG 136 -12.471 -3.353 -0.470 1108 H ASN 137 HN ASN 137 -20.663 0.977 -1.560 1109 HA ASN 137 HA ASN 137 -21.890 0.331 0.290 1110 HB2 ASN 137 HB2 ASN 137 -20.229 -2.151 -0.043 1111 HB3 ASN 137 HB1 ASN 137 -21.730 -2.042 0.871 1112 HD21 ASN 137 HD21 ASN 137 -20.470 -2.776 -2.199 1113 HD22 ASN 137 HD22 ASN 137 -21.913 -2.657 -3.083 1114 H TYR 138 HN TYR 138 -19.422 1.742 0.777 1115 HA TYR 138 HA TYR 138 -18.082 0.572 3.044 1116 HB2 TYR 138 HB2 TYR 138 -16.687 2.430 2.955 1117 HB3 TYR 138 HB1 TYR 138 -17.274 2.397 1.290 1118 HD1 TYR 138 HD1 TYR 138 -19.905 3.435 1.315 1119 HD2 TYR 138 HD2 TYR 138 -16.588 4.648 3.755 1120 HE1 TYR 138 HE1 TYR 138 -20.968 5.645 1.651 1121 HE2 TYR 138 HE2 TYR 138 -17.656 6.864 4.084 1122 HH TYR 138 HH TYR 138 -19.442 8.116 3.710 1123 H THR 139 HN THR 139 -18.016 1.555 5.168 1124 HA THR 139 HA THR 139 -20.483 3.010 5.934 1125 HB THR 139 HB THR 139 -20.908 1.615 7.692 1126 HG1 THR 139 HG1 THR 139 -18.808 0.451 8.528 1127 HG21 THR 139 HG21 THR 139 -20.361 0.146 5.563 1128 HG22 THR 139 HG22 THR 139 -19.005 -0.397 6.547 1129 HG23 THR 139 HG23 THR 139 -20.652 -0.621 7.122 1130 H ASP 140 HN ASP 140 -20.175 4.563 7.651 1131 HA ASP 140 HA ASP 140 -18.048 6.221 7.410 1132 HB2 ASP 140 HB2 ASP 140 -18.588 7.158 9.589 1133 HB3 ASP 140 HB1 ASP 140 -20.073 6.725 8.742 1134 H GLU 141 HN GLU 141 -18.206 3.691 9.977 1135 HA GLU 141 HA GLU 141 -15.719 4.168 11.083 1136 HB2 GLU 141 HB2 GLU 141 -17.515 2.572 11.897 1137 HB3 GLU 141 HB1 GLU 141 -16.896 1.412 10.721 1138 HG2 GLU 141 HG2 GLU 141 -14.667 1.532 11.756 1139 HG3 GLU 141 HG1 GLU 141 -15.262 2.715 12.918 1140 H MET 142 HN MET 142 -16.439 2.848 7.983 1141 HA MET 142 HA MET 142 -13.969 1.402 7.669 1142 HB2 MET 142 HB2 MET 142 -15.800 2.373 5.479 1143 HB3 MET 142 HB1 MET 142 -14.659 1.035 5.419 1144 HG2 MET 142 HG2 MET 142 -16.127 0.229 7.538 1145 HG3 MET 142 HG1 MET 142 -17.348 1.167 6.690 1146 HE1 MET 142 HE1 MET 142 -15.121 -2.550 5.652 1147 HE2 MET 142 HE2 MET 142 -14.395 -1.202 4.783 1148 HE3 MET 142 HE3 MET 142 -14.579 -1.131 6.541 1149 H VAL 143 HN VAL 143 -14.887 4.677 7.401 1150 HA VAL 143 HA VAL 143 -12.282 5.311 6.118 1151 HB VAL 143 HB VAL 143 -14.253 5.754 4.598 1152 HG11 VAL 143 HG11 VAL 143 -15.758 7.540 5.106 1153 HG12 VAL 143 HG12 VAL 143 -15.734 6.505 6.531 1154 HG13 VAL 143 HG13 VAL 143 -14.829 8.019 6.520 1155 HG21 VAL 143 HG21 VAL 143 -12.296 7.853 5.514 1156 HG22 VAL 143 HG22 VAL 143 -12.364 6.990 3.983 1157 HG23 VAL 143 HG23 VAL 143 -13.509 8.287 4.312 1158 H ALA 144 HN ALA 144 -10.982 6.548 7.323 1159 HA ALA 144 HA ALA 144 -12.235 8.121 9.518 1160 HB1 ALA 144 HB1 ALA 144 -9.928 7.700 10.640 1161 HB2 ALA 144 HB2 ALA 144 -9.789 6.381 9.478 1162 HB3 ALA 144 HB3 ALA 144 -11.120 6.401 10.632 1163 H MET 145 HN MET 145 -11.961 10.250 9.353 1164 HA MET 145 HA MET 145 -10.078 11.423 7.586 1165 HB2 MET 145 HB2 MET 145 -12.291 12.288 7.615 1166 HB3 MET 145 HB1 MET 145 -12.351 12.277 9.371 1167 HG2 MET 145 HG2 MET 145 -11.391 14.283 9.520 1168 HG3 MET 145 HG1 MET 145 -10.151 13.849 8.364 1169 HE1 MET 145 HE1 MET 145 -10.176 13.985 6.020 1170 HE2 MET 145 HE2 MET 145 -11.668 13.130 5.645 1171 HE3 MET 145 HE3 MET 145 -11.371 14.734 4.967 1172 H LEU 146 HN LEU 146 -8.346 12.818 8.345 1173 HA LEU 146 HA LEU 146 -7.661 12.446 11.161 1174 HB2 LEU 146 HB2 LEU 146 -6.404 11.424 8.953 1175 HB3 LEU 146 HB1 LEU 146 -5.512 12.921 9.185 1176 HG LEU 146 HG LEU 146 -4.954 12.303 11.407 1177 HD11 LEU 146 HD11 LEU 146 -6.540 11.075 12.524 1178 HD12 LEU 146 HD12 LEU 146 -7.051 10.245 11.056 1179 HD13 LEU 146 HD13 LEU 146 -5.612 9.714 11.920 1180 HD21 LEU 146 HD21 LEU 146 -3.665 11.354 9.478 1181 HD22 LEU 146 HD22 LEU 146 -3.524 10.438 10.978 1182 HD23 LEU 146 HD23 LEU 146 -4.583 9.866 9.696 1183 HA PRO 147 HA PRO 147 -7.623 16.915 11.375 1184 HB2 PRO 147 HB2 PRO 147 -6.298 17.236 13.727 1185 HB3 PRO 147 HB1 PRO 147 -7.953 16.594 13.654 1186 HG2 PRO 147 HG2 PRO 147 -5.364 15.100 13.859 1187 HG3 PRO 147 HG1 PRO 147 -6.851 14.892 14.804 1188 HD2 PRO 147 HD2 PRO 147 -6.270 13.288 12.738 1189 HD3 PRO 147 HD1 PRO 147 -7.944 13.754 13.089 1190 H ARG 148 HN ARG 148 -6.160 18.734 11.304 1191 HA ARG 148 HA ARG 148 -3.860 18.342 9.724 1192 HB2 ARG 148 HB2 ARG 148 -4.633 20.764 11.360 1193 HB3 ARG 148 HB1 ARG 148 -3.482 20.737 10.024 1194 HG2 ARG 148 HG2 ARG 148 -5.324 19.898 8.536 1195 HG3 ARG 148 HG1 ARG 148 -6.448 20.135 9.875 1196 HD2 ARG 148 HD2 ARG 148 -4.826 22.236 8.428 1197 HD3 ARG 148 HD1 ARG 148 -6.579 22.114 8.537 1198 HE ARG 148 HE ARG 148 -4.829 23.301 10.481 1199 HH11 ARG 148 HH21 ARG 148 -7.779 21.556 10.000 1200 HH12 ARG 148 HH22 ARG 148 -8.530 22.156 11.440 1201 HH21 ARG 148 HH11 ARG 148 -5.807 24.090 12.371 1202 HH22 ARG 148 HH12 ARG 148 -7.413 23.590 12.784 1203 H GLN 149 HN GLN 149 -4.234 18.013 13.094 1204 HA GLN 149 HA GLN 149 -2.022 18.979 14.316 1205 HB2 GLN 149 HB2 GLN 149 -3.137 16.179 14.579 1206 HB3 GLN 149 HB1 GLN 149 -1.990 16.904 15.707 1207 HG2 GLN 149 HG2 GLN 149 -4.617 18.226 15.011 1208 HG3 GLN 149 HG1 GLN 149 -4.461 17.085 16.346 1209 HE21 GLN 149 HE21 GLN 149 -4.338 20.363 15.648 1210 HE22 GLN 149 HE22 GLN 149 -3.387 20.874 16.958 1211 H GLU 150 HN GLU 150 0.122 18.855 14.117 1212 HA GLU 150 HA GLU 150 1.319 16.611 12.582 1213 HB2 GLU 150 HB2 GLU 150 2.897 18.233 11.603 1214 HB3 GLU 150 HB1 GLU 150 1.230 18.585 11.147 1215 HG2 GLU 150 HG2 GLU 150 1.143 20.216 13.078 1216 HG3 GLU 150 HG1 GLU 150 2.878 19.972 13.275 1217 H GLU 151 HN GLU 151 3.137 15.740 13.425 1218 HA GLU 151 HA GLU 151 4.410 17.109 15.727 1219 HB2 GLU 151 HB2 GLU 151 2.939 15.084 16.336 1220 HB3 GLU 151 HB1 GLU 151 4.170 14.106 15.538 1221 HG2 GLU 151 HG2 GLU 151 5.891 14.956 17.031 1222 HG3 GLU 151 HG1 GLU 151 4.746 16.074 17.771 1223 H CYS 152 HN CYS 152 4.672 15.121 12.880 1224 HA CYS 152 HA CYS 152 7.561 15.689 12.777 1225 HB2 CYS 152 HB2 CYS 152 6.836 13.227 13.499 1226 HB3 CYS 152 HB1 CYS 152 6.656 13.031 11.761 1227 H THR 153 HN THR 153 8.420 15.564 10.619 1228 HA THR 153 HA THR 153 6.539 15.507 8.386 1229 HB THR 153 HB THR 153 7.006 17.754 7.623 1230 HG1 THR 153 HG1 THR 153 8.271 18.696 9.802 1231 HG21 THR 153 HG21 THR 153 5.877 19.050 9.311 1232 HG22 THR 153 HG22 THR 153 5.212 17.425 9.381 1233 HG23 THR 153 HG23 THR 153 6.387 17.948 10.585 1234 H VAL 154 HN VAL 154 7.687 15.677 6.270 1235 HA VAL 154 HA VAL 154 10.067 14.150 6.247 1236 HB VAL 154 HB VAL 154 9.995 14.436 3.866 1237 HG11 VAL 154 HG11 VAL 154 8.371 12.855 4.327 1238 HG12 VAL 154 HG12 VAL 154 7.371 13.989 5.233 1239 HG13 VAL 154 HG13 VAL 154 7.412 14.058 3.471 1240 HG21 VAL 154 HG21 VAL 154 8.190 16.035 2.924 1241 HG22 VAL 154 HG22 VAL 154 8.216 16.771 4.526 1242 HG23 VAL 154 HG23 VAL 154 9.680 16.745 3.543 1243 H ASP 155 HN ASP 155 12.032 14.866 5.187 1244 HA ASP 155 HA ASP 155 12.961 17.355 6.278 1245 HB2 ASP 155 HB2 ASP 155 14.542 15.561 6.159 1246 HB3 ASP 155 HB1 ASP 155 14.295 15.382 4.428 1247 H GLU 156 HN GLU 156 14.112 18.875 4.933 1248 HA GLU 156 HA GLU 156 12.424 20.153 3.104 1249 HB2 GLU 156 HB2 GLU 156 15.363 20.443 3.721 1250 HB3 GLU 156 HB1 GLU 156 14.527 21.484 2.577 1251 HG2 GLU 156 HG2 GLU 156 12.901 22.103 4.344 1252 HG3 GLU 156 HG1 GLU 156 13.793 21.102 5.488 1253 H VAL 157 HN VAL 157 14.995 17.810 2.662 1254 HA VAL 157 HA VAL 157 14.140 17.297 -0.045 1255 HB VAL 157 HB VAL 157 15.630 19.263 -0.348 1256 HG11 VAL 157 HG11 VAL 157 17.958 19.143 0.216 1257 HG12 VAL 157 HG12 VAL 157 17.071 18.657 1.662 1258 HG13 VAL 157 HG13 VAL 157 17.833 17.436 0.641 1259 HG21 VAL 157 HG21 VAL 157 16.963 18.275 -2.116 1260 HG22 VAL 157 HG22 VAL 157 16.876 16.687 -1.354 1261 HG23 VAL 157 HG23 VAL 157 15.426 17.412 -2.048 1262 HN1 EB4 200 H17 EB4 200 0.011 -1.044 5.733 1263 H8 EB4 200 H8 EB4 200 5.041 0.724 1.392 1264 HN2 EB4 200 H25 EB4 200 3.122 -0.395 6.583 1265 H9 EB4 200 H9 EB4 200 0.957 5.912 3.339 1266 H10 EB4 200 H10 EB4 200 -2.557 -0.808 0.399 1267 HN3 EB4 200 H32 EB4 200 0.571 1.722 7.341 1268 H7 EB4 200 H7 EB4 200 -0.912 1.046 0.416 1269 H11 EB4 200 H11 EB4 200 6.788 -0.876 2.128 1270 H12 EB4 200 H12 EB4 200 -0.061 7.206 5.196 1271 H15 EB4 200 H15 EB4 200 -0.413 6.137 7.404 1272 H14 EB4 200 H14 EB4 200 6.751 -1.778 4.437 1273 H13 EB4 200 H13 EB4 200 -2.802 -2.265 2.392 1274 H22 EB4 200 H22 EB4 200 -1.460 -3.317 6.908 1275 H30 EB4 200 H30 EB4 200 -1.047 -0.134 10.093 1276 H30A EB4 200 H9N EB4 200 -1.892 0.992 8.921 1277 H24 EB4 200 H24 EB4 200 -0.164 2.185 10.176 1278 H28 EB4 200 H28 EB4 200 0.589 -3.878 8.127 1279 H28A EB4 200 H9L EB4 200 0.761 -4.026 6.371 1280 H23 EB4 200 H23 EB4 200 4.525 -1.971 8.691 1281 H29 EB4 200 H29 EB4 200 3.323 -0.571 10.323 1282 H29A EB4 200 H9M EB4 200 4.371 0.442 9.215 1283 H21 ACD 300 HA3 ACD 300 -0.025 8.790 -11.929 1284 H22 ACD 300 HA4 ACD 300 0.244 10.193 -10.873 1285 H31 ACD 300 HA1 ACD 300 0.207 7.270 -9.998 1286 H32 ACD 300 HA2 ACD 300 1.652 8.293 -10.162 1287 H41 ACD 300 HA0 ACD 300 -0.682 8.766 -8.250 1288 H42 ACD 300 HAZ ACD 300 0.713 9.852 -8.454 1289 H5 ACD 300 HAY ACD 300 2.159 7.581 -7.805 1290 H6 ACD 300 HAX ACD 300 1.206 7.077 -5.419 1291 H71 ACD 300 HAV ACD 300 -1.020 9.039 -6.377 1292 H72 ACD 300 HAW ACD 300 -1.485 7.426 -5.794 1293 H8 ACD 300 HAU ACD 300 -0.607 9.799 -4.077 1294 H9 ACD 300 HAT ACD 300 -0.767 8.137 -2.074 1295 H101 ACD 300 HAR ACD 300 -1.489 6.086 -4.266 1296 H102 ACD 300 HAS ACD 300 0.045 5.799 -3.414 1297 H11 ACD 300 HAQ ACD 300 -2.763 5.380 -2.278 1298 H12 ACD 300 HAP ACD 300 -1.532 4.922 -0.006 1299 H131 ACD 300 HAN ACD 300 0.795 6.572 -1.300 1300 H132 ACD 300 HAO ACD 300 1.092 4.821 -0.850 1301 H14 ACD 300 HAM ACD 300 0.835 5.358 1.519 1302 H15 ACD 300 HAL ACD 300 0.956 7.871 2.202 1303 H161 ACD 300 HAJ ACD 300 -0.334 8.603 -0.381 1304 H162 ACD 300 HAK ACD 300 0.678 9.681 0.605 1305 H171 ACD 300 HAH ACD 300 2.709 8.817 -0.450 1306 H172 ACD 300 HAI ACD 300 1.770 7.627 -1.374 1307 H181 ACD 300 HAF ACD 300 0.464 9.612 -2.351 1308 H182 ACD 300 HAG ACD 300 1.715 10.657 -1.640 1309 H191 ACD 300 HAD ACD 300 3.462 9.551 -2.907 1310 H192 ACD 300 HAE ACD 300 2.326 8.318 -3.499 1311 H201 ACD 300 HAA ACD 300 2.726 10.019 -5.227 1312 H202 ACD 300 HAB ACD 300 2.216 11.309 -4.119 1313 H203 ACD 300 HAC ACD 300 1.038 10.104 -4.689 Start of MODEL 7 1 H1 MET 1 HT1 MET 1 3.471 18.150 -23.995 2 H2 MET 1 HT2 MET 1 1.827 18.141 -24.427 3 H3 MET 1 HT3 MET 1 2.373 17.185 -23.134 4 HA MET 1 HA MET 1 2.352 18.864 -21.676 5 HB2 MET 1 HB2 MET 1 4.256 19.922 -22.940 6 HB3 MET 1 HB1 MET 1 3.062 20.775 -23.920 7 HG2 MET 1 HG2 MET 1 2.103 21.742 -21.817 8 HG3 MET 1 HG1 MET 1 3.418 20.988 -20.917 9 HE1 MET 1 HE1 MET 1 5.705 21.145 -21.411 10 HE2 MET 1 HE2 MET 1 6.010 21.474 -23.115 11 HE3 MET 1 HE3 MET 1 6.560 22.614 -21.879 12 H THR 2 HN THR 2 0.202 18.787 -21.250 13 HA THR 2 HA THR 2 -1.487 20.831 -22.408 14 HB THR 2 HB THR 2 -2.398 17.964 -22.681 15 HG1 THR 2 HG1 THR 2 -0.837 19.566 -24.319 16 HG21 THR 2 HG21 THR 2 -4.187 18.894 -23.950 17 HG22 THR 2 HG22 THR 2 -4.039 19.919 -22.522 18 HG23 THR 2 HG23 THR 2 -3.384 20.460 -24.067 19 H VAL 3 HN VAL 3 -1.913 17.709 -20.722 20 HA VAL 3 HA VAL 3 -3.890 18.647 -18.946 21 HB VAL 3 HB VAL 3 -3.129 16.582 -17.580 22 HG11 VAL 3 HG11 VAL 3 -3.890 16.235 -20.497 23 HG12 VAL 3 HG12 VAL 3 -4.161 15.064 -19.206 24 HG13 VAL 3 HG13 VAL 3 -5.021 16.603 -19.194 25 HG21 VAL 3 HG21 VAL 3 -1.565 16.036 -20.111 26 HG22 VAL 3 HG22 VAL 3 -0.806 16.688 -18.660 27 HG23 VAL 3 HG23 VAL 3 -1.571 15.100 -18.616 28 HA PRO 4 HA PRO 4 -2.015 21.097 -15.789 29 HB2 PRO 4 HB2 PRO 4 -2.710 18.806 -13.966 30 HB3 PRO 4 HB1 PRO 4 -2.935 20.550 -13.713 31 HG2 PRO 4 HG2 PRO 4 -4.953 18.955 -14.474 32 HG3 PRO 4 HG1 PRO 4 -4.820 20.636 -15.017 33 HD2 PRO 4 HD2 PRO 4 -4.475 18.157 -16.583 34 HD3 PRO 4 HD1 PRO 4 -4.747 19.816 -17.155 35 H ASP 5 HN ASP 5 0.056 21.337 -15.068 36 HA ASP 5 HA ASP 5 2.045 19.457 -15.708 37 HB2 ASP 5 HB2 ASP 5 2.107 21.814 -13.812 38 HB3 ASP 5 HB1 ASP 5 3.533 20.909 -14.317 39 H ARG 6 HN ARG 6 3.008 17.843 -14.596 40 HA ARG 6 HA ARG 6 1.714 16.825 -12.245 41 HB2 ARG 6 HB2 ARG 6 3.846 15.251 -12.373 42 HB3 ARG 6 HB1 ARG 6 2.534 15.084 -13.538 43 HG2 ARG 6 HG2 ARG 6 4.726 17.029 -14.181 44 HG3 ARG 6 HG1 ARG 6 5.079 15.310 -14.334 45 HD2 ARG 6 HD2 ARG 6 2.556 16.402 -15.550 46 HD3 ARG 6 HD1 ARG 6 4.089 16.621 -16.389 47 HE ARG 6 HE ARG 6 2.646 14.134 -16.048 48 HH11 ARG 6 HH21 ARG 6 5.694 15.676 -16.604 49 HH12 ARG 6 HH22 ARG 6 6.400 14.306 -17.394 50 HH21 ARG 6 HH11 ARG 6 3.567 12.332 -17.082 51 HH22 ARG 6 HH12 ARG 6 5.196 12.413 -17.664 52 H SER 7 HN SER 7 4.427 18.860 -12.900 53 HA SER 7 HA SER 7 5.966 18.526 -10.587 54 HB2 SER 7 HB2 SER 7 5.469 21.103 -12.092 55 HB3 SER 7 HB1 SER 7 6.836 20.752 -11.040 56 HG SER 7 HG SER 7 6.229 19.805 -13.602 57 H GLU 8 HN GLU 8 2.952 20.229 -11.120 58 HA GLU 8 HA GLU 8 2.914 21.890 -8.874 59 HB2 GLU 8 HB2 GLU 8 1.284 21.959 -10.762 60 HB3 GLU 8 HB1 GLU 8 0.550 20.483 -10.137 61 HG2 GLU 8 HG2 GLU 8 -0.721 22.396 -9.336 62 HG3 GLU 8 HG1 GLU 8 0.121 21.663 -7.974 63 H ILE 9 HN ILE 9 1.539 18.584 -9.198 64 HA ILE 9 HA ILE 9 1.031 18.494 -6.340 65 HB ILE 9 HB ILE 9 -0.490 17.406 -8.029 66 HG12 ILE 9 HG12 ILE 9 0.784 15.757 -5.818 67 HG13 ILE 9 HG11 ILE 9 -0.623 16.795 -5.684 68 HG21 ILE 9 HG21 ILE 9 0.185 15.375 -9.095 69 HG22 ILE 9 HG22 ILE 9 1.497 16.519 -9.376 70 HG23 ILE 9 HG23 ILE 9 1.659 15.277 -8.135 71 HD11 ILE 9 HD11 ILE 9 -0.931 14.195 -5.909 72 HD12 ILE 9 HD12 ILE 9 -2.012 15.273 -6.773 73 HD13 ILE 9 HD13 ILE 9 -0.686 14.492 -7.624 74 H ALA 10 HN ALA 10 3.448 17.286 -8.580 75 HA ALA 10 HA ALA 10 4.557 15.440 -6.705 76 HB1 ALA 10 HB1 ALA 10 5.727 16.562 -9.243 77 HB2 ALA 10 HB2 ALA 10 4.998 14.973 -9.006 78 HB3 ALA 10 HB3 ALA 10 6.536 15.360 -8.237 79 H GLY 11 HN GLY 11 6.189 15.613 -5.296 80 HA2 GLY 11 HA2 GLY 11 8.195 16.834 -4.555 81 HA3 GLY 11 HA1 GLY 11 7.294 18.323 -4.846 82 H LYS 12 HN LYS 12 4.772 17.226 -3.828 83 HA LYS 12 HA LYS 12 5.190 16.399 -1.112 84 HB2 LYS 12 HB2 LYS 12 5.784 18.864 -1.093 85 HB3 LYS 12 HB1 LYS 12 4.090 19.185 -1.463 86 HG2 LYS 12 HG2 LYS 12 3.426 17.903 0.557 87 HG3 LYS 12 HG1 LYS 12 5.130 17.656 0.940 88 HD2 LYS 12 HD2 LYS 12 5.351 20.216 0.861 89 HD3 LYS 12 HD1 LYS 12 3.588 20.253 0.899 90 HE2 LYS 12 HE2 LYS 12 4.210 20.402 3.177 91 HE3 LYS 12 HE1 LYS 12 3.794 18.702 2.960 92 HZ1 LYS 12 HZ1 LYS 12 6.447 18.908 2.269 93 HZ2 LYS 12 HZ2 LYS 12 6.287 19.861 3.667 94 HZ3 LYS 12 HZ3 LYS 12 5.815 18.232 3.694 95 H TRP 13 HN TRP 13 3.572 14.938 -1.001 96 HA TRP 13 HA TRP 13 0.855 15.703 -1.928 97 HB2 TRP 13 HB2 TRP 13 2.263 13.029 -1.631 98 HB3 TRP 13 HB1 TRP 13 0.539 13.126 -1.885 99 HD1 TRP 13 HD1 TRP 13 3.392 15.014 -3.680 100 HE1 TRP 13 HE1 TRP 13 3.127 14.488 -6.187 101 HE3 TRP 13 HE3 TRP 13 -0.681 11.950 -3.535 102 HZ2 TRP 13 HZ2 TRP 13 1.475 12.961 -7.879 103 HZ3 TRP 13 HZ3 TRP 13 -1.594 10.982 -5.624 104 HH2 TRP 13 HH2 TRP 13 -0.535 11.496 -7.805 105 H TYR 14 HN TYR 14 -0.601 16.015 -0.205 106 HA TYR 14 HA TYR 14 0.287 15.155 2.456 107 HB2 TYR 14 HB2 TYR 14 -1.075 17.447 1.380 108 HB3 TYR 14 HB1 TYR 14 -2.098 16.706 2.602 109 HD1 TYR 14 HD2 TYR 14 -0.854 15.996 4.829 110 HD2 TYR 14 HD1 TYR 14 0.601 18.930 2.048 111 HE1 TYR 14 HE2 TYR 14 0.555 16.991 6.609 112 HE2 TYR 14 HE1 TYR 14 2.006 19.920 3.829 113 HH TYR 14 HH TYR 14 3.037 18.695 6.254 114 H VAL 15 HN VAL 15 -0.539 13.467 3.423 115 HA VAL 15 HA VAL 15 -3.011 12.210 2.422 116 HB VAL 15 HB VAL 15 -0.884 11.268 4.361 117 HG11 VAL 15 HG11 VAL 15 -2.925 10.292 5.116 118 HG12 VAL 15 HG12 VAL 15 -3.489 10.020 3.468 119 HG13 VAL 15 HG13 VAL 15 -2.158 9.059 4.115 120 HG21 VAL 15 HG21 VAL 15 -0.667 9.496 2.495 121 HG22 VAL 15 HG22 VAL 15 -1.595 10.617 1.498 122 HG23 VAL 15 HG23 VAL 15 -0.033 11.105 2.154 123 H VAL 16 HN VAL 16 -4.930 12.425 3.544 124 HA VAL 16 HA VAL 16 -4.769 13.226 6.384 125 HB VAL 16 HB VAL 16 -6.492 14.927 6.031 126 HG11 VAL 16 HG11 VAL 16 -4.322 15.647 4.086 127 HG12 VAL 16 HG12 VAL 16 -4.949 16.567 5.454 128 HG13 VAL 16 HG13 VAL 16 -3.846 15.220 5.726 129 HG21 VAL 16 HG21 VAL 16 -6.081 14.163 3.129 130 HG22 VAL 16 HG22 VAL 16 -7.586 14.133 4.048 131 HG23 VAL 16 HG23 VAL 16 -6.844 15.674 3.622 132 H ALA 17 HN ALA 17 -5.956 10.914 4.449 133 HA ALA 17 HA ALA 17 -7.767 9.994 6.367 134 HB1 ALA 17 HB1 ALA 17 -9.948 10.360 5.353 135 HB2 ALA 17 HB2 ALA 17 -9.214 11.241 4.022 136 HB3 ALA 17 HB3 ALA 17 -9.181 11.918 5.632 137 H LEU 18 HN LEU 18 -8.233 7.844 5.991 138 HA LEU 18 HA LEU 18 -8.120 6.861 3.235 139 HB2 LEU 18 HB2 LEU 18 -5.891 6.456 3.583 140 HB3 LEU 18 HB1 LEU 18 -6.051 6.498 5.329 141 HG LEU 18 HG LEU 18 -7.250 4.155 3.884 142 HD11 LEU 18 HD11 LEU 18 -5.022 4.422 2.851 143 HD12 LEU 18 HD12 LEU 18 -4.292 4.446 4.456 144 HD13 LEU 18 HD13 LEU 18 -5.096 2.989 3.875 145 HD21 LEU 18 HD21 LEU 18 -5.575 4.128 6.388 146 HD22 LEU 18 HD22 LEU 18 -7.239 4.695 6.457 147 HD23 LEU 18 HD23 LEU 18 -6.893 3.051 5.926 148 H ALA 19 HN ALA 19 -9.155 4.913 2.929 149 HA ALA 19 HA ALA 19 -10.697 3.871 5.232 150 HB1 ALA 19 HB1 ALA 19 -11.727 3.341 2.501 151 HB2 ALA 19 HB2 ALA 19 -11.761 5.027 3.000 152 HB3 ALA 19 HB3 ALA 19 -12.598 3.815 3.959 153 H SER 20 HN SER 20 -11.270 1.564 5.048 154 HA SER 20 HA SER 20 -9.820 -0.119 3.242 155 HB2 SER 20 HB2 SER 20 -8.347 -1.170 4.899 156 HB3 SER 20 HB1 SER 20 -7.963 0.538 4.701 157 HG SER 20 HG SER 20 -9.870 0.240 6.560 158 H ASN 21 HN ASN 21 -9.820 -2.452 4.190 159 HA ASN 21 HA ASN 21 -12.507 -2.942 5.343 160 HB2 ASN 21 HB2 ASN 21 -10.868 -4.511 3.342 161 HB3 ASN 21 HB1 ASN 21 -12.232 -5.214 4.209 162 HD21 ASN 21 HD21 ASN 21 -13.019 -5.342 1.796 163 HD22 ASN 21 HD22 ASN 21 -13.885 -3.998 1.223 164 H THR 22 HN THR 22 -9.159 -3.151 5.705 165 HA THR 22 HA THR 22 -9.208 -5.390 7.570 166 HB THR 22 HB THR 22 -7.301 -4.978 5.957 167 HG1 THR 22 HG1 THR 22 -6.878 -6.309 7.620 168 HG21 THR 22 HG21 THR 22 -6.264 -2.965 7.912 169 HG22 THR 22 HG22 THR 22 -5.837 -3.198 6.219 170 HG23 THR 22 HG23 THR 22 -7.360 -2.415 6.642 171 H GLU 23 HN GLU 23 -10.180 -4.903 9.415 172 HA GLU 23 HA GLU 23 -10.678 -2.550 10.626 173 HB2 GLU 23 HB2 GLU 23 -11.473 -4.716 11.474 174 HB3 GLU 23 HB1 GLU 23 -9.852 -5.072 12.074 175 HG2 GLU 23 HG2 GLU 23 -9.943 -3.172 13.590 176 HG3 GLU 23 HG1 GLU 23 -11.497 -2.672 12.924 177 H PHE 24 HN PHE 24 -7.566 -4.128 10.547 178 HA PHE 24 HA PHE 24 -6.307 -2.820 12.665 179 HB2 PHE 24 HB2 PHE 24 -4.850 -3.381 10.101 180 HB3 PHE 24 HB1 PHE 24 -4.290 -3.564 11.763 181 HD1 PHE 24 HD1 PHE 24 -6.517 -5.049 13.023 182 HD2 PHE 24 HD2 PHE 24 -4.713 -5.528 9.152 183 HE1 PHE 24 HE1 PHE 24 -7.218 -7.424 12.989 184 HE2 PHE 24 HE2 PHE 24 -5.418 -7.904 9.121 185 HZ PHE 24 HZ PHE 24 -6.670 -8.852 11.040 186 H PHE 25 HN PHE 25 -6.464 -1.742 9.216 187 HA PHE 25 HA PHE 25 -4.955 0.602 9.703 188 HB2 PHE 25 HB2 PHE 25 -5.744 -0.775 7.484 189 HB3 PHE 25 HB1 PHE 25 -6.798 0.627 7.387 190 HD1 PHE 25 HD1 PHE 25 -4.973 2.685 8.668 191 HD2 PHE 25 HD2 PHE 25 -4.206 -0.357 5.737 192 HE1 PHE 25 HE1 PHE 25 -3.089 4.020 7.780 193 HE2 PHE 25 HE2 PHE 25 -2.321 0.983 4.849 194 HZ PHE 25 HZ PHE 25 -1.760 3.169 5.869 195 H LEU 26 HN LEU 26 -8.503 0.181 9.291 196 HA LEU 26 HA LEU 26 -9.014 2.982 9.573 197 HB2 LEU 26 HB2 LEU 26 -11.399 2.243 9.988 198 HB3 LEU 26 HB1 LEU 26 -10.691 1.747 8.457 199 HG LEU 26 HG LEU 26 -10.053 -0.333 10.287 200 HD11 LEU 26 HD11 LEU 26 -11.755 0.476 11.830 201 HD12 LEU 26 HD12 LEU 26 -12.938 0.571 10.526 202 HD13 LEU 26 HD13 LEU 26 -12.337 -0.999 11.058 203 HD21 LEU 26 HD21 LEU 26 -10.491 -0.811 7.986 204 HD22 LEU 26 HD22 LEU 26 -11.803 -1.579 8.877 205 HD23 LEU 26 HD23 LEU 26 -12.080 -0.047 8.052 206 H ARG 27 HN ARG 27 -9.127 0.262 11.774 207 HA ARG 27 HA ARG 27 -10.119 1.578 14.051 208 HB2 ARG 27 HB2 ARG 27 -9.804 -0.871 13.952 209 HB3 ARG 27 HB1 ARG 27 -8.054 -0.638 13.998 210 HG2 ARG 27 HG2 ARG 27 -8.181 0.373 16.189 211 HG3 ARG 27 HG1 ARG 27 -9.944 0.384 16.133 212 HD2 ARG 27 HD2 ARG 27 -9.231 -1.501 17.485 213 HD3 ARG 27 HD1 ARG 27 -9.904 -2.114 15.976 214 HE ARG 27 HE ARG 27 -7.795 -2.919 15.426 215 HH11 ARG 27 HH21 ARG 27 -7.619 -0.609 17.996 216 HH12 ARG 27 HH22 ARG 27 -5.941 -0.891 18.322 217 HH21 ARG 27 HH11 ARG 27 -5.595 -3.295 15.846 218 HH22 ARG 27 HH12 ARG 27 -4.796 -2.412 17.103 219 H GLU 28 HN GLU 28 -6.753 1.148 12.968 220 HA GLU 28 HA GLU 28 -5.720 2.799 15.097 221 HB2 GLU 28 HB2 GLU 28 -4.550 0.829 13.916 222 HB3 GLU 28 HB1 GLU 28 -4.191 1.986 12.634 223 HG2 GLU 28 HG2 GLU 28 -3.176 3.494 14.370 224 HG3 GLU 28 HG1 GLU 28 -3.399 2.205 15.550 225 H LYS 29 HN LYS 29 -6.303 3.287 11.571 226 HA LYS 29 HA LYS 29 -4.964 5.639 11.192 227 HB2 LYS 29 HB2 LYS 29 -6.150 4.566 9.378 228 HB3 LYS 29 HB1 LYS 29 -7.698 4.830 10.174 229 HG2 LYS 29 HG2 LYS 29 -7.289 6.477 8.362 230 HG3 LYS 29 HG1 LYS 29 -7.432 7.261 9.932 231 HD2 LYS 29 HD2 LYS 29 -5.093 7.613 10.093 232 HD3 LYS 29 HD1 LYS 29 -4.746 6.455 8.810 233 HE2 LYS 29 HE2 LYS 29 -5.666 7.922 7.137 234 HE3 LYS 29 HE1 LYS 29 -6.305 9.012 8.365 235 HZ1 LYS 29 HZ1 LYS 29 -4.392 10.090 8.350 236 HZ2 LYS 29 HZ2 LYS 29 -3.571 8.683 8.831 237 HZ3 LYS 29 HZ3 LYS 29 -3.768 9.026 7.181 238 H ASP 30 HN ASP 30 -7.830 5.065 13.063 239 HA ASP 30 HA ASP 30 -8.709 7.753 13.270 240 HB2 ASP 30 HB2 ASP 30 -10.076 5.708 13.776 241 HB3 ASP 30 HB1 ASP 30 -9.155 5.535 15.268 242 H LYS 31 HN LYS 31 -6.169 5.983 14.948 243 HA LYS 31 HA LYS 31 -6.095 8.023 17.032 244 HB2 LYS 31 HB2 LYS 31 -4.641 6.648 18.273 245 HB3 LYS 31 HB1 LYS 31 -5.863 5.588 17.590 246 HG2 LYS 31 HG2 LYS 31 -3.916 4.394 17.157 247 HG3 LYS 31 HG1 LYS 31 -4.147 5.263 15.658 248 HD2 LYS 31 HD2 LYS 31 -2.620 7.004 17.317 249 HD3 LYS 31 HD1 LYS 31 -1.921 5.405 17.517 250 HE2 LYS 31 HE2 LYS 31 -2.549 6.277 14.723 251 HE3 LYS 31 HE1 LYS 31 -1.165 7.014 15.517 252 HZ1 LYS 31 HZ1 LYS 31 -0.451 5.059 14.383 253 HZ2 LYS 31 HZ2 LYS 31 -0.380 4.751 16.053 254 HZ3 LYS 31 HZ3 LYS 31 -1.652 4.115 15.128 255 H MET 32 HN MET 32 -4.332 7.380 14.049 256 HA MET 32 HA MET 32 -2.037 8.920 14.964 257 HB2 MET 32 HB2 MET 32 -1.397 8.907 12.495 258 HB3 MET 32 HB1 MET 32 -1.456 7.342 13.268 259 HG2 MET 32 HG2 MET 32 -3.988 7.412 12.379 260 HG3 MET 32 HG1 MET 32 -3.271 8.512 11.212 261 HE1 MET 32 HE1 MET 32 -3.411 5.276 12.885 262 HE2 MET 32 HE2 MET 32 -2.655 4.082 11.846 263 HE3 MET 32 HE3 MET 32 -1.666 5.077 12.921 264 H LYS 33 HN LYS 33 -1.333 10.629 13.187 265 HA LYS 33 HA LYS 33 -3.518 12.619 13.049 266 HB2 LYS 33 HB2 LYS 33 -0.636 13.429 12.932 267 HB3 LYS 33 HB1 LYS 33 -2.021 14.299 13.585 268 HG2 LYS 33 HG2 LYS 33 -2.118 12.455 15.380 269 HG3 LYS 33 HG1 LYS 33 -0.503 12.006 14.830 270 HD2 LYS 33 HD2 LYS 33 0.083 14.509 15.149 271 HD3 LYS 33 HD1 LYS 33 -1.405 14.590 16.095 272 HE2 LYS 33 HE2 LYS 33 -0.536 12.646 17.458 273 HE3 LYS 33 HE1 LYS 33 1.002 12.833 16.617 274 HZ1 LYS 33 HZ1 LYS 33 0.112 14.228 18.841 275 HZ2 LYS 33 HZ2 LYS 33 1.531 14.503 17.948 276 HZ3 LYS 33 HZ3 LYS 33 0.109 15.340 17.555 277 H MET 34 HN MET 34 -2.739 14.338 11.222 278 HA MET 34 HA MET 34 -3.131 13.018 8.796 279 HB2 MET 34 HB2 MET 34 -3.291 15.113 7.991 280 HB3 MET 34 HB1 MET 34 -3.200 15.582 9.672 281 HG2 MET 34 HG2 MET 34 -0.653 15.673 9.358 282 HG3 MET 34 HG1 MET 34 -0.986 15.606 7.626 283 HE1 MET 34 HE1 MET 34 -4.046 17.142 8.119 284 HE2 MET 34 HE2 MET 34 -3.514 18.588 7.271 285 HE3 MET 34 HE3 MET 34 -3.024 16.999 6.693 286 H ALA 35 HN ALA 35 -1.758 12.417 7.108 287 HA ALA 35 HA ALA 35 1.117 12.208 7.798 288 HB1 ALA 35 HB1 ALA 35 0.406 10.003 7.696 289 HB2 ALA 35 HB2 ALA 35 0.907 10.264 6.025 290 HB3 ALA 35 HB3 ALA 35 -0.802 10.338 6.459 291 H MET 36 HN MET 36 2.593 12.116 5.919 292 HA MET 36 HA MET 36 1.636 13.717 3.626 293 HB2 MET 36 HB2 MET 36 4.337 14.417 4.000 294 HB3 MET 36 HB1 MET 36 2.934 15.432 4.319 295 HG2 MET 36 HG2 MET 36 4.000 13.464 6.341 296 HG3 MET 36 HG1 MET 36 4.554 15.132 6.258 297 HE1 MET 36 HE1 MET 36 2.300 13.763 9.055 298 HE2 MET 36 HE2 MET 36 3.929 14.201 8.556 299 HE3 MET 36 HE3 MET 36 2.864 15.413 9.280 300 H ALA 37 HN ALA 37 3.044 13.606 1.763 301 HA ALA 37 HA ALA 37 4.903 11.386 1.541 302 HB1 ALA 37 HB1 ALA 37 3.039 10.027 1.159 303 HB2 ALA 37 HB2 ALA 37 3.490 10.519 -0.476 304 HB3 ALA 37 HB3 ALA 37 2.148 11.313 0.347 305 H ARG 38 HN ARG 38 5.917 11.297 -0.604 306 HA ARG 38 HA ARG 38 5.473 13.696 -2.280 307 HB2 ARG 38 HB2 ARG 38 7.955 14.057 -2.444 308 HB3 ARG 38 HB1 ARG 38 7.261 14.457 -0.875 309 HG2 ARG 38 HG2 ARG 38 8.128 12.512 0.137 310 HG3 ARG 38 HG1 ARG 38 8.432 11.732 -1.418 311 HD2 ARG 38 HD2 ARG 38 10.179 13.389 -1.916 312 HD3 ARG 38 HD1 ARG 38 9.865 14.193 -0.381 313 HE ARG 38 HE ARG 38 10.545 11.378 -0.156 314 HH11 ARG 38 HH21 ARG 38 11.642 14.658 -0.271 315 HH12 ARG 38 HH22 ARG 38 13.127 14.335 0.560 316 HH21 ARG 38 HH11 ARG 38 12.490 10.948 0.935 317 HH22 ARG 38 HH12 ARG 38 13.607 12.235 1.243 318 H ILE 39 HN ILE 39 5.730 13.344 -4.471 319 HA ILE 39 HA ILE 39 6.560 10.667 -5.311 320 HB ILE 39 HB ILE 39 4.171 11.312 -5.331 321 HG12 ILE 39 HG12 ILE 39 4.978 10.982 -8.198 322 HG13 ILE 39 HG11 ILE 39 5.366 9.697 -7.061 323 HG21 ILE 39 HG21 ILE 39 3.472 12.840 -7.032 324 HG22 ILE 39 HG22 ILE 39 4.555 13.607 -5.877 325 HG23 ILE 39 HG23 ILE 39 5.120 13.158 -7.478 326 HD11 ILE 39 HD11 ILE 39 2.981 9.764 -8.268 327 HD12 ILE 39 HD12 ILE 39 3.140 9.227 -6.604 328 HD13 ILE 39 HD13 ILE 39 2.601 10.867 -6.958 329 H SER 40 HN SER 40 7.888 10.579 -7.176 330 HA SER 40 HA SER 40 8.402 13.054 -8.621 331 HB2 SER 40 HB2 SER 40 10.683 11.596 -7.334 332 HB3 SER 40 HB1 SER 40 10.753 13.087 -8.252 333 HG SER 40 HG SER 40 10.337 12.765 -5.657 334 H PHE 41 HN PHE 41 9.671 12.693 -10.588 335 HA PHE 41 HA PHE 41 9.057 10.037 -11.657 336 HB2 PHE 41 HB2 PHE 41 9.814 12.609 -13.040 337 HB3 PHE 41 HB1 PHE 41 9.391 11.103 -13.855 338 HD1 PHE 41 HD2 PHE 41 8.113 13.720 -11.536 339 HD2 PHE 41 HD1 PHE 41 7.119 10.432 -14.117 340 HE1 PHE 41 HE2 PHE 41 5.706 14.279 -11.323 341 HE2 PHE 41 HE1 PHE 41 4.713 10.991 -13.902 342 HZ PHE 41 HZ PHE 41 4.006 12.915 -12.506 343 H LEU 42 HN LEU 42 10.791 8.838 -10.806 344 HA LEU 42 HA LEU 42 13.541 9.426 -11.164 345 HB2 LEU 42 HB2 LEU 42 12.060 6.784 -11.059 346 HB3 LEU 42 HB1 LEU 42 13.809 6.890 -11.163 347 HG LEU 42 HG LEU 42 12.333 8.390 -9.007 348 HD11 LEU 42 HD11 LEU 42 12.908 5.435 -9.155 349 HD12 LEU 42 HD12 LEU 42 12.955 6.258 -7.597 350 HD13 LEU 42 HD13 LEU 42 11.470 6.258 -8.549 351 HD21 LEU 42 HD21 LEU 42 14.702 8.893 -9.259 352 HD22 LEU 42 HD22 LEU 42 14.498 7.927 -7.800 353 HD23 LEU 42 HD23 LEU 42 15.108 7.178 -9.274 354 H GLY 43 HN GLY 43 11.087 7.958 -13.118 355 HA2 GLY 43 HA2 GLY 43 12.279 8.665 -15.613 356 HA3 GLY 43 HA1 GLY 43 12.396 6.931 -15.301 357 H GLU 44 HN GLU 44 10.811 8.061 -17.410 358 HA GLU 44 HA GLU 44 8.132 8.485 -16.847 359 HB2 GLU 44 HB2 GLU 44 9.218 8.627 -19.113 360 HB3 GLU 44 HB1 GLU 44 9.160 6.867 -19.192 361 HG2 GLU 44 HG2 GLU 44 6.681 8.506 -18.642 362 HG3 GLU 44 HG1 GLU 44 7.215 8.166 -20.286 363 H ASP 45 HN ASP 45 9.957 5.520 -16.713 364 HA ASP 45 HA ASP 45 7.479 4.020 -16.094 365 HB2 ASP 45 HB2 ASP 45 10.118 2.717 -16.695 366 HB3 ASP 45 HB1 ASP 45 8.493 2.063 -16.872 367 H GLU 46 HN GLU 46 9.694 5.716 -14.531 368 HA GLU 46 HA GLU 46 9.702 3.898 -12.204 369 HB2 GLU 46 HB2 GLU 46 12.065 5.575 -13.071 370 HB3 GLU 46 HB1 GLU 46 11.997 4.474 -11.694 371 HG2 GLU 46 HG2 GLU 46 11.539 2.596 -13.284 372 HG3 GLU 46 HG1 GLU 46 11.774 3.721 -14.621 373 H LEU 47 HN LEU 47 8.697 4.861 -10.577 374 HA LEU 47 HA LEU 47 9.013 7.785 -10.205 375 HB2 LEU 47 HB2 LEU 47 6.497 6.287 -9.479 376 HB3 LEU 47 HB1 LEU 47 6.737 8.026 -9.601 377 HG LEU 47 HG LEU 47 6.940 6.138 -11.963 378 HD11 LEU 47 HD11 LEU 47 4.637 7.894 -11.080 379 HD12 LEU 47 HD12 LEU 47 4.693 6.908 -12.539 380 HD13 LEU 47 HD13 LEU 47 4.679 6.136 -10.955 381 HD21 LEU 47 HD21 LEU 47 6.919 9.141 -11.606 382 HD22 LEU 47 HD22 LEU 47 8.073 8.150 -12.496 383 HD23 LEU 47 HD23 LEU 47 6.454 8.402 -13.136 384 H LYS 48 HN LYS 48 9.319 8.465 -8.117 385 HA LYS 48 HA LYS 48 9.686 6.342 -6.093 386 HB2 LYS 48 HB2 LYS 48 11.590 7.959 -6.847 387 HB3 LYS 48 HB1 LYS 48 10.750 9.149 -5.863 388 HG2 LYS 48 HG2 LYS 48 11.029 7.849 -3.878 389 HG3 LYS 48 HG1 LYS 48 11.536 6.428 -4.792 390 HD2 LYS 48 HD2 LYS 48 13.496 7.512 -3.807 391 HD3 LYS 48 HD1 LYS 48 13.547 7.667 -5.562 392 HE2 LYS 48 HE2 LYS 48 12.924 9.942 -5.502 393 HE3 LYS 48 HE1 LYS 48 12.309 9.823 -3.853 394 HZ1 LYS 48 HZ1 LYS 48 14.956 9.044 -3.750 395 HZ2 LYS 48 HZ2 LYS 48 14.929 10.426 -4.738 396 HZ3 LYS 48 HZ3 LYS 48 14.290 10.494 -3.168 397 H VAL 49 HN VAL 49 8.130 6.206 -4.563 398 HA VAL 49 HA VAL 49 6.751 8.702 -3.791 399 HB VAL 49 HB VAL 49 5.599 6.103 -4.625 400 HG11 VAL 49 HG11 VAL 49 5.021 5.911 -2.271 401 HG12 VAL 49 HG12 VAL 49 4.505 7.598 -2.227 402 HG13 VAL 49 HG13 VAL 49 3.591 6.422 -3.171 403 HG21 VAL 49 HG21 VAL 49 3.637 7.706 -4.971 404 HG22 VAL 49 HG22 VAL 49 4.739 8.994 -4.491 405 HG23 VAL 49 HG23 VAL 49 5.091 8.009 -5.908 406 H SER 50 HN SER 50 6.487 9.132 -1.774 407 HA SER 50 HA SER 50 7.743 7.328 0.222 408 HB2 SER 50 HB2 SER 50 8.993 9.393 -0.513 409 HB3 SER 50 HB1 SER 50 7.698 10.321 0.211 410 HG SER 50 HG SER 50 9.653 8.717 1.408 411 H TYR 51 HN TYR 51 6.928 7.329 2.316 412 HA TYR 51 HA TYR 51 4.317 8.685 2.716 413 HB2 TYR 51 HB2 TYR 51 5.009 6.063 4.039 414 HB3 TYR 51 HB1 TYR 51 3.430 6.810 3.830 415 HD1 TYR 51 HD1 TYR 51 3.289 7.488 1.025 416 HD2 TYR 51 HD2 TYR 51 5.032 4.039 2.891 417 HE1 TYR 51 HE1 TYR 51 2.916 6.173 -1.031 418 HE2 TYR 51 HE2 TYR 51 4.670 2.734 0.818 419 HH TYR 51 HH TYR 51 3.165 4.228 -2.048 420 H ALA 52 HN ALA 52 4.139 9.840 4.549 421 HA ALA 52 HA ALA 52 6.166 9.454 6.669 422 HB1 ALA 52 HB1 ALA 52 5.327 11.946 5.259 423 HB2 ALA 52 HB2 ALA 52 6.912 11.480 5.872 424 HB3 ALA 52 HB3 ALA 52 5.675 12.051 6.987 425 H VAL 53 HN VAL 53 5.062 8.551 8.305 426 HA VAL 53 HA VAL 53 2.352 9.565 8.891 427 HB VAL 53 HB VAL 53 3.458 6.928 9.824 428 HG11 VAL 53 HG11 VAL 53 1.344 7.924 10.795 429 HG12 VAL 53 HG12 VAL 53 0.631 7.810 9.186 430 HG13 VAL 53 HG13 VAL 53 1.129 6.348 10.036 431 HG21 VAL 53 HG21 VAL 53 2.087 7.566 7.193 432 HG22 VAL 53 HG22 VAL 53 3.719 6.931 7.400 433 HG23 VAL 53 HG23 VAL 53 2.326 5.936 7.823 434 HA PRO 54 HA PRO 54 4.408 10.898 12.682 435 HB2 PRO 54 HB2 PRO 54 2.380 12.313 13.763 436 HB3 PRO 54 HB1 PRO 54 3.266 12.903 12.340 437 HG2 PRO 54 HG2 PRO 54 0.610 11.547 12.486 438 HG3 PRO 54 HG1 PRO 54 1.115 12.933 11.500 439 HD2 PRO 54 HD2 PRO 54 0.967 10.341 10.548 440 HD3 PRO 54 HD1 PRO 54 2.023 11.594 9.857 441 H LYS 55 HN LYS 55 4.731 9.443 14.267 442 HA LYS 55 HA LYS 55 2.381 8.203 15.573 443 HB2 LYS 55 HB2 LYS 55 3.673 6.645 14.075 444 HB3 LYS 55 HB1 LYS 55 5.051 6.869 15.151 445 HG2 LYS 55 HG2 LYS 55 3.585 6.136 17.065 446 HG3 LYS 55 HG1 LYS 55 2.339 5.734 15.881 447 HD2 LYS 55 HD2 LYS 55 4.130 4.298 14.724 448 HD3 LYS 55 HD1 LYS 55 5.075 4.492 16.202 449 HE2 LYS 55 HE2 LYS 55 3.845 2.455 16.463 450 HE3 LYS 55 HE1 LYS 55 3.031 3.651 17.470 451 HZ1 LYS 55 HZ1 LYS 55 1.858 3.937 15.032 452 HZ2 LYS 55 HZ2 LYS 55 2.068 2.256 15.165 453 HZ3 LYS 55 HZ3 LYS 55 1.204 3.097 16.357 454 HA PRO 56 HA PRO 56 4.476 10.860 18.775 455 HB2 PRO 56 HB2 PRO 56 2.285 9.346 20.176 456 HB3 PRO 56 HB1 PRO 56 2.819 11.023 20.418 457 HG2 PRO 56 HG2 PRO 56 0.654 10.435 18.956 458 HG3 PRO 56 HG1 PRO 56 1.726 11.785 18.546 459 HD2 PRO 56 HD2 PRO 56 1.334 9.238 17.118 460 HD3 PRO 56 HD1 PRO 56 2.071 10.744 16.528 461 H ASN 57 HN ASN 57 3.825 7.416 18.655 462 HA ASN 57 HA ASN 57 5.562 6.821 20.921 463 HB2 ASN 57 HB2 ASN 57 3.440 5.525 20.287 464 HB3 ASN 57 HB1 ASN 57 4.395 4.828 18.981 465 HD21 ASN 57 HD21 ASN 57 3.919 2.757 20.324 466 HD22 ASN 57 HD22 ASN 57 5.010 2.388 21.572 467 H GLY 58 HN GLY 58 6.415 8.043 18.206 468 HA2 GLY 58 HA2 GLY 58 8.911 7.767 17.811 469 HA3 GLY 58 HA1 GLY 58 8.521 6.075 17.511 470 H CYS 59 HN CYS 59 8.473 9.297 16.237 471 HA CYS 59 HA CYS 59 6.761 9.148 14.086 472 HB2 CYS 59 HB2 CYS 59 7.878 11.211 14.526 473 HB3 CYS 59 HB1 CYS 59 9.465 10.471 14.324 474 H ARG 60 HN ARG 60 6.620 7.932 12.324 475 HA ARG 60 HA ARG 60 8.962 6.300 11.527 476 HB2 ARG 60 HB2 ARG 60 5.994 5.833 11.156 477 HB3 ARG 60 HB1 ARG 60 7.252 4.830 10.435 478 HG2 ARG 60 HG2 ARG 60 8.172 4.475 12.768 479 HG3 ARG 60 HG1 ARG 60 6.722 5.269 13.384 480 HD2 ARG 60 HD2 ARG 60 5.328 3.585 12.208 481 HD3 ARG 60 HD1 ARG 60 6.794 2.772 11.668 482 HE ARG 60 HE ARG 60 7.088 2.876 14.380 483 HH11 ARG 60 HH21 ARG 60 4.596 1.822 12.222 484 HH12 ARG 60 HH22 ARG 60 4.006 0.588 13.284 485 HH21 ARG 60 HH11 ARG 60 6.320 1.259 15.778 486 HH22 ARG 60 HH12 ARG 60 4.982 0.269 15.298 487 H LYS 61 HN LYS 61 9.971 7.033 9.791 488 HA LYS 61 HA LYS 61 8.382 8.119 7.546 489 HB2 LYS 61 HB2 LYS 61 10.382 9.708 7.189 490 HB3 LYS 61 HB1 LYS 61 9.247 10.102 8.481 491 HG2 LYS 61 HG2 LYS 61 10.715 9.303 10.167 492 HG3 LYS 61 HG1 LYS 61 11.727 8.455 8.997 493 HD2 LYS 61 HD2 LYS 61 12.848 10.510 9.705 494 HD3 LYS 61 HD1 LYS 61 12.374 10.649 8.011 495 HE2 LYS 61 HE2 LYS 61 10.533 12.058 8.531 496 HE3 LYS 61 HE1 LYS 61 10.607 11.655 10.246 497 HZ1 LYS 61 HZ1 LYS 61 11.595 13.749 10.060 498 HZ2 LYS 61 HZ2 LYS 61 12.906 12.676 10.184 499 HZ3 LYS 61 HZ3 LYS 61 12.479 13.320 8.675 500 H TRP 62 HN TRP 62 8.917 7.275 5.609 501 HA TRP 62 HA TRP 62 11.582 6.284 5.099 502 HB2 TRP 62 HB2 TRP 62 11.262 4.049 5.274 503 HB3 TRP 62 HB1 TRP 62 9.889 4.481 6.285 504 HD1 TRP 62 HD1 TRP 62 7.616 5.142 4.504 505 HE1 TRP 62 HE1 TRP 62 6.680 3.525 2.726 506 HE3 TRP 62 HE3 TRP 62 11.663 2.098 3.856 507 HZ2 TRP 62 HZ2 TRP 62 7.534 1.244 1.225 508 HZ3 TRP 62 HZ3 TRP 62 11.576 0.214 2.249 509 HH2 TRP 62 HH2 TRP 62 9.519 -0.217 0.933 510 H GLU 63 HN GLU 63 11.586 5.149 2.864 511 HA GLU 63 HA GLU 63 9.838 6.709 1.042 512 HB2 GLU 63 HB2 GLU 63 12.272 7.405 1.149 513 HB3 GLU 63 HB1 GLU 63 12.667 5.835 0.452 514 HG2 GLU 63 HG2 GLU 63 11.444 6.314 -1.548 515 HG3 GLU 63 HG1 GLU 63 10.697 7.742 -0.830 516 H THR 64 HN THR 64 9.572 5.745 -1.116 517 HA THR 64 HA THR 64 9.940 2.846 -1.298 518 HB THR 64 HB THR 64 7.198 4.049 -1.670 519 HG1 THR 64 HG1 THR 64 7.277 4.191 0.431 520 HG21 THR 64 HG21 THR 64 7.561 1.949 -2.831 521 HG22 THR 64 HG22 THR 64 8.261 1.226 -1.383 522 HG23 THR 64 HG23 THR 64 6.547 1.640 -1.422 523 H THR 65 HN THR 65 10.029 2.108 -3.400 524 HA THR 65 HA THR 65 10.020 4.192 -5.492 525 HB THR 65 HB THR 65 11.278 1.443 -5.540 526 HG1 THR 65 HG1 THR 65 13.163 2.522 -5.088 527 HG21 THR 65 HG21 THR 65 11.523 3.854 -7.362 528 HG22 THR 65 HG22 THR 65 12.503 2.393 -7.486 529 HG23 THR 65 HG23 THR 65 10.763 2.315 -7.765 530 H PHE 66 HN PHE 66 8.462 4.191 -7.019 531 HA PHE 66 HA PHE 66 6.866 1.723 -7.406 532 HB2 PHE 66 HB2 PHE 66 6.124 4.634 -7.250 533 HB3 PHE 66 HB1 PHE 66 5.147 3.551 -8.236 534 HD1 PHE 66 HD1 PHE 66 6.558 3.970 -4.802 535 HD2 PHE 66 HD2 PHE 66 3.532 2.156 -7.249 536 HE1 PHE 66 HE1 PHE 66 5.389 3.166 -2.769 537 HE2 PHE 66 HE2 PHE 66 2.367 1.356 -5.215 538 HZ PHE 66 HZ PHE 66 3.296 1.861 -2.976 539 H LYS 67 HN LYS 67 6.721 0.962 -9.458 540 HA LYS 67 HA LYS 67 7.873 2.624 -11.630 541 HB2 LYS 67 HB2 LYS 67 7.917 -0.376 -11.244 542 HB3 LYS 67 HB1 LYS 67 8.411 0.436 -12.729 543 HG2 LYS 67 HG2 LYS 67 9.971 1.831 -11.146 544 HG3 LYS 67 HG1 LYS 67 9.717 0.499 -10.017 545 HD2 LYS 67 HD2 LYS 67 10.372 -1.056 -11.944 546 HD3 LYS 67 HD1 LYS 67 10.936 0.392 -12.778 547 HE2 LYS 67 HE2 LYS 67 12.405 0.908 -10.839 548 HE3 LYS 67 HE1 LYS 67 11.883 -0.591 -10.069 549 HZ1 LYS 67 HZ1 LYS 67 12.645 -1.692 -12.218 550 HZ2 LYS 67 HZ2 LYS 67 13.473 -0.242 -12.534 551 HZ3 LYS 67 HZ3 LYS 67 13.850 -1.147 -11.151 552 H LYS 68 HN LYS 68 6.834 2.676 -13.602 553 HA LYS 68 HA LYS 68 4.005 2.327 -13.536 554 HB2 LYS 68 HB2 LYS 68 5.405 4.015 -14.913 555 HB3 LYS 68 HB1 LYS 68 5.595 2.693 -16.066 556 HG2 LYS 68 HG2 LYS 68 3.121 2.457 -16.168 557 HG3 LYS 68 HG1 LYS 68 2.966 3.840 -15.083 558 HD2 LYS 68 HD2 LYS 68 4.158 5.257 -16.719 559 HD3 LYS 68 HD1 LYS 68 4.295 3.877 -17.809 560 HE2 LYS 68 HE2 LYS 68 2.360 5.439 -18.310 561 HE3 LYS 68 HE1 LYS 68 1.909 3.750 -18.079 562 HZ1 LYS 68 HZ1 LYS 68 1.099 4.179 -15.953 563 HZ2 LYS 68 HZ2 LYS 68 1.893 5.676 -15.840 564 HZ3 LYS 68 HZ3 LYS 68 0.553 5.505 -16.865 565 H THR 69 HN THR 69 2.799 0.636 -14.041 566 HA THR 69 HA THR 69 3.973 -1.555 -15.657 567 HB THR 69 HB THR 69 3.906 -2.284 -13.339 568 HG1 THR 69 HG1 THR 69 1.657 -3.589 -14.049 569 HG21 THR 69 HG21 THR 69 2.251 -0.663 -12.517 570 HG22 THR 69 HG22 THR 69 0.986 -1.478 -13.438 571 HG23 THR 69 HG23 THR 69 1.771 -2.308 -12.093 572 H SER 70 HN SER 70 2.171 -3.027 -16.497 573 HA SER 70 HA SER 70 0.082 -1.313 -17.647 574 HB2 SER 70 HB2 SER 70 -0.132 -2.934 -19.364 575 HB3 SER 70 HB1 SER 70 1.600 -2.807 -19.065 576 HG SER 70 HG SER 70 -0.029 -4.679 -17.709 577 H ASP 71 HN ASP 71 0.418 -3.091 -14.993 578 HA ASP 71 HA ASP 71 -1.241 -4.977 -14.420 579 HB2 ASP 71 HB2 ASP 71 -0.247 -3.342 -12.763 580 HB3 ASP 71 HB1 ASP 71 -1.703 -2.372 -12.979 581 H ASP 72 HN ASP 72 -2.631 -1.741 -15.186 582 HA ASP 72 HA ASP 72 -4.847 -2.848 -16.531 583 HB2 ASP 72 HB2 ASP 72 -5.632 -3.565 -14.377 584 HB3 ASP 72 HB1 ASP 72 -5.323 -1.979 -13.676 585 H GLY 73 HN GLY 73 -4.128 -1.247 -17.955 586 HA2 GLY 73 HA2 GLY 73 -4.541 0.779 -19.012 587 HA3 GLY 73 HA1 GLY 73 -5.414 1.311 -17.579 588 H GLU 74 HN GLU 74 -4.424 2.636 -16.150 589 HA GLU 74 HA GLU 74 -1.531 3.186 -16.524 590 HB2 GLU 74 HB2 GLU 74 -3.768 5.135 -15.923 591 HB3 GLU 74 HB1 GLU 74 -2.051 5.536 -15.872 592 HG2 GLU 74 HG2 GLU 74 -1.847 4.838 -18.253 593 HG3 GLU 74 HG1 GLU 74 -3.583 4.539 -18.291 594 H VAL 75 HN VAL 75 -0.910 1.820 -14.791 595 HA VAL 75 HA VAL 75 -1.630 2.869 -12.131 596 HB VAL 75 HB VAL 75 -1.447 -0.067 -12.818 597 HG11 VAL 75 HG11 VAL 75 -2.562 -0.084 -10.433 598 HG12 VAL 75 HG12 VAL 75 -0.817 0.114 -10.575 599 HG13 VAL 75 HG13 VAL 75 -1.839 1.518 -10.282 600 HG21 VAL 75 HG21 VAL 75 -3.968 0.167 -12.085 601 HG22 VAL 75 HG22 VAL 75 -3.752 1.853 -12.554 602 HG23 VAL 75 HG23 VAL 75 -3.503 0.572 -13.737 603 H TYR 76 HN TYR 76 -0.079 2.615 -10.514 604 HA TYR 76 HA TYR 76 2.641 1.962 -11.491 605 HB2 TYR 76 HB2 TYR 76 1.921 3.849 -9.243 606 HB3 TYR 76 HB1 TYR 76 3.491 3.654 -10.028 607 HD1 TYR 76 HD1 TYR 76 3.808 4.352 -12.401 608 HD2 TYR 76 HD2 TYR 76 0.167 5.153 -10.269 609 HE1 TYR 76 HE1 TYR 76 3.149 5.989 -14.141 610 HE2 TYR 76 HE2 TYR 76 -0.487 6.796 -12.008 611 HH TYR 76 HH TYR 76 1.431 8.214 -14.013 612 H TYR 77 HN TYR 77 4.061 0.931 -9.935 613 HA TYR 77 HA TYR 77 2.881 -0.127 -7.502 614 HB2 TYR 77 HB2 TYR 77 2.650 -2.352 -8.063 615 HB3 TYR 77 HB1 TYR 77 2.220 -1.598 -9.595 616 HD1 TYR 77 HD2 TYR 77 4.170 -1.187 -11.285 617 HD2 TYR 77 HD1 TYR 77 4.384 -3.935 -7.991 618 HE1 TYR 77 HE2 TYR 77 6.040 -2.376 -12.399 619 HE2 TYR 77 HE1 TYR 77 6.252 -5.125 -9.106 620 HH TYR 77 HH TYR 77 8.040 -3.878 -11.528 621 H SER 78 HN SER 78 4.342 -0.774 -5.977 622 HA SER 78 HA SER 78 7.191 -0.474 -6.679 623 HB2 SER 78 HB2 SER 78 6.446 0.943 -4.847 624 HB3 SER 78 HB1 SER 78 5.737 -0.439 -4.021 625 HG SER 78 HG SER 78 7.985 -1.315 -4.164 626 H GLU 79 HN GLU 79 7.881 -2.420 -7.382 627 HA GLU 79 HA GLU 79 6.920 -4.935 -6.691 628 HB2 GLU 79 HB2 GLU 79 8.488 -4.341 -8.586 629 HB3 GLU 79 HB1 GLU 79 9.795 -4.361 -7.401 630 HG2 GLU 79 HG2 GLU 79 9.146 -6.691 -6.784 631 HG3 GLU 79 HG1 GLU 79 7.942 -6.664 -8.071 632 H GLU 80 HN GLU 80 9.499 -3.050 -5.148 633 HA GLU 80 HA GLU 80 10.329 -5.131 -3.393 634 HB2 GLU 80 HB2 GLU 80 11.607 -3.412 -2.257 635 HB3 GLU 80 HB1 GLU 80 11.741 -3.185 -4.001 636 HG2 GLU 80 HG2 GLU 80 9.848 -1.522 -3.844 637 HG3 GLU 80 HG1 GLU 80 9.965 -1.646 -2.090 638 H ALA 81 HN ALA 81 7.878 -2.609 -3.133 639 HA ALA 81 HA ALA 81 7.356 -3.408 -0.336 640 HB1 ALA 81 HB1 ALA 81 6.623 -0.965 -1.938 641 HB2 ALA 81 HB2 ALA 81 7.619 -1.064 -0.488 642 HB3 ALA 81 HB3 ALA 81 5.879 -1.327 -0.381 643 H LYS 82 HN LYS 82 6.387 -4.539 -3.178 644 HA LYS 82 HA LYS 82 4.364 -5.287 -4.094 645 HB2 LYS 82 HB2 LYS 82 4.159 -6.205 -1.213 646 HB3 LYS 82 HB1 LYS 82 3.292 -6.905 -2.581 647 HG2 LYS 82 HG2 LYS 82 5.535 -7.353 -3.657 648 HG3 LYS 82 HG1 LYS 82 6.289 -6.872 -2.139 649 HD2 LYS 82 HD2 LYS 82 4.290 -9.128 -2.488 650 HD3 LYS 82 HD1 LYS 82 6.024 -9.319 -2.237 651 HE2 LYS 82 HE2 LYS 82 3.940 -8.339 -0.298 652 HE3 LYS 82 HE1 LYS 82 5.152 -9.597 -0.074 653 HZ1 LYS 82 HZ1 LYS 82 5.776 -6.715 -0.410 654 HZ2 LYS 82 HZ2 LYS 82 5.676 -7.505 1.092 655 HZ3 LYS 82 HZ3 LYS 82 6.870 -7.957 -0.026 656 H LYS 83 HN LYS 83 3.835 -2.834 -4.015 657 HA LYS 83 HA LYS 83 1.141 -2.580 -2.859 658 HB2 LYS 83 HB2 LYS 83 2.584 -1.496 -1.225 659 HB3 LYS 83 HB1 LYS 83 3.355 -0.546 -2.496 660 HG2 LYS 83 HG2 LYS 83 1.304 0.634 -2.962 661 HG3 LYS 83 HG1 LYS 83 0.386 -0.440 -1.906 662 HD2 LYS 83 HD2 LYS 83 1.374 0.446 0.051 663 HD3 LYS 83 HD1 LYS 83 2.696 1.189 -0.846 664 HE2 LYS 83 HE2 LYS 83 1.343 2.926 -1.656 665 HE3 LYS 83 HE1 LYS 83 -0.149 2.031 -1.375 666 HZ1 LYS 83 HZ1 LYS 83 0.517 3.898 0.247 667 HZ2 LYS 83 HZ2 LYS 83 -0.074 2.437 0.879 668 HZ3 LYS 83 HZ3 LYS 83 1.593 2.751 0.888 669 H LYS 84 HN LYS 84 -0.252 -1.747 -4.258 670 HA LYS 84 HA LYS 84 0.778 -0.300 -6.635 671 HB2 LYS 84 HB2 LYS 84 -0.007 -2.688 -7.002 672 HB3 LYS 84 HB1 LYS 84 -1.620 -2.127 -6.569 673 HG2 LYS 84 HG2 LYS 84 -1.453 -0.413 -8.388 674 HG3 LYS 84 HG1 LYS 84 0.085 -1.132 -8.857 675 HD2 LYS 84 HD2 LYS 84 -1.509 -2.158 -10.287 676 HD3 LYS 84 HD1 LYS 84 -1.172 -3.358 -9.042 677 HE2 LYS 84 HE2 LYS 84 -3.230 -2.996 -7.959 678 HE3 LYS 84 HE1 LYS 84 -3.460 -1.417 -8.711 679 HZ1 LYS 84 HZ1 LYS 84 -3.656 -4.080 -9.994 680 HZ2 LYS 84 HZ2 LYS 84 -4.886 -2.924 -9.806 681 HZ3 LYS 84 HZ3 LYS 84 -3.602 -2.629 -10.874 682 H VAL 85 HN VAL 85 -0.128 1.571 -7.172 683 HA VAL 85 HA VAL 85 -2.750 2.232 -6.005 684 HB VAL 85 HB VAL 85 -2.074 4.202 -5.058 685 HG11 VAL 85 HG11 VAL 85 -0.913 2.192 -4.055 686 HG12 VAL 85 HG12 VAL 85 0.541 2.727 -4.895 687 HG13 VAL 85 HG13 VAL 85 -0.198 3.755 -3.671 688 HG21 VAL 85 HG21 VAL 85 0.308 5.210 -5.612 689 HG22 VAL 85 HG22 VAL 85 0.148 4.284 -7.099 690 HG23 VAL 85 HG23 VAL 85 -1.037 5.531 -6.703 691 H GLU 86 HN GLU 86 -4.135 2.893 -7.437 692 HA GLU 86 HA GLU 86 -3.168 3.882 -10.066 693 HB2 GLU 86 HB2 GLU 86 -5.193 2.806 -11.016 694 HB3 GLU 86 HB1 GLU 86 -4.108 1.643 -10.261 695 HG2 GLU 86 HG2 GLU 86 -5.506 1.872 -8.155 696 HG3 GLU 86 HG1 GLU 86 -6.667 2.777 -9.123 697 H VAL 87 HN VAL 87 -4.015 5.697 -10.859 698 HA VAL 87 HA VAL 87 -5.451 7.477 -9.238 699 HB VAL 87 HB VAL 87 -4.226 8.464 -10.971 700 HG11 VAL 87 HG11 VAL 87 -3.817 6.621 -12.408 701 HG12 VAL 87 HG12 VAL 87 -5.534 6.392 -12.737 702 HG13 VAL 87 HG13 VAL 87 -4.686 7.788 -13.404 703 HG21 VAL 87 HG21 VAL 87 -6.884 8.532 -12.375 704 HG22 VAL 87 HG22 VAL 87 -6.778 9.178 -10.740 705 HG23 VAL 87 HG23 VAL 87 -5.774 9.853 -12.020 706 H LEU 88 HN LEU 88 -7.298 6.641 -8.397 707 HA LEU 88 HA LEU 88 -9.397 5.586 -10.138 708 HB2 LEU 88 HB2 LEU 88 -8.678 4.915 -7.613 709 HB3 LEU 88 HB1 LEU 88 -9.895 6.127 -7.238 710 HG LEU 88 HG LEU 88 -10.951 3.941 -7.321 711 HD11 LEU 88 HD11 LEU 88 -12.741 4.447 -8.785 712 HD12 LEU 88 HD12 LEU 88 -12.073 6.013 -8.330 713 HD13 LEU 88 HD13 LEU 88 -11.692 5.314 -9.905 714 HD21 LEU 88 HD21 LEU 88 -9.081 3.212 -9.139 715 HD22 LEU 88 HD22 LEU 88 -10.610 2.357 -8.949 716 HD23 LEU 88 HD23 LEU 88 -10.422 3.546 -10.234 717 H ASP 89 HN ASP 89 -8.311 8.450 -8.752 718 HA ASP 89 HA ASP 89 -10.042 10.173 -10.066 719 HB2 ASP 89 HB2 ASP 89 -11.437 9.084 -7.968 720 HB3 ASP 89 HB1 ASP 89 -10.694 10.470 -7.178 721 H THR 90 HN THR 90 -8.677 11.879 -10.298 722 HA THR 90 HA THR 90 -7.128 12.769 -7.988 723 HB THR 90 HB THR 90 -5.948 10.952 -9.517 724 HG1 THR 90 HG1 THR 90 -3.953 11.952 -8.947 725 HG21 THR 90 HG21 THR 90 -5.172 13.530 -10.903 726 HG22 THR 90 HG22 THR 90 -4.613 11.905 -11.284 727 HG23 THR 90 HG23 THR 90 -6.292 12.348 -11.583 728 H ASP 91 HN ASP 91 -7.214 14.868 -7.842 729 HA ASP 91 HA ASP 91 -8.143 16.479 -10.092 730 HB2 ASP 91 HB2 ASP 91 -8.963 16.777 -7.710 731 HB3 ASP 91 HB1 ASP 91 -7.360 17.408 -7.332 732 H TYR 92 HN TYR 92 -5.262 15.752 -8.311 733 HA TYR 92 HA TYR 92 -3.072 16.332 -8.574 734 HB2 TYR 92 HB2 TYR 92 -4.254 16.245 -11.221 735 HB3 TYR 92 HB1 TYR 92 -2.971 17.450 -11.176 736 HD1 TYR 92 HD2 TYR 92 -3.448 14.138 -9.474 737 HD2 TYR 92 HD1 TYR 92 -0.998 16.552 -12.047 738 HE1 TYR 92 HE2 TYR 92 -1.763 12.327 -9.569 739 HE2 TYR 92 HE1 TYR 92 0.690 14.737 -12.137 740 HH TYR 92 HH TYR 92 1.157 12.640 -11.581 741 H LYS 93 HN LYS 93 -5.252 18.518 -7.869 742 HA LYS 93 HA LYS 93 -3.309 20.681 -7.854 743 HB2 LYS 93 HB2 LYS 93 -4.670 20.786 -10.027 744 HB3 LYS 93 HB1 LYS 93 -6.052 21.179 -9.005 745 HG2 LYS 93 HG2 LYS 93 -4.769 23.083 -8.044 746 HG3 LYS 93 HG1 LYS 93 -3.442 22.719 -9.149 747 HD2 LYS 93 HD2 LYS 93 -5.056 22.995 -11.062 748 HD3 LYS 93 HD1 LYS 93 -6.257 23.554 -9.898 749 HE2 LYS 93 HE2 LYS 93 -4.767 25.387 -9.217 750 HE3 LYS 93 HE1 LYS 93 -3.540 24.822 -10.351 751 HZ1 LYS 93 HZ1 LYS 93 -4.545 26.280 -11.711 752 HZ2 LYS 93 HZ2 LYS 93 -5.651 25.014 -11.956 753 HZ3 LYS 93 HZ3 LYS 93 -6.013 26.253 -10.857 754 H SER 94 HN SER 94 -6.307 19.210 -6.832 755 HA SER 94 HA SER 94 -6.375 21.036 -4.494 756 HB2 SER 94 HB2 SER 94 -8.820 19.792 -5.745 757 HB3 SER 94 HB1 SER 94 -8.746 21.075 -4.542 758 HG SER 94 HG SER 94 -8.392 21.159 -7.285 759 H TYR 95 HN TYR 95 -7.743 17.902 -5.603 760 HA TYR 95 HA TYR 95 -6.659 16.572 -3.253 761 HB2 TYR 95 HB2 TYR 95 -8.992 15.706 -2.662 762 HB3 TYR 95 HB1 TYR 95 -8.634 17.374 -2.209 763 HD1 TYR 95 HD2 TYR 95 -10.477 15.201 -4.553 764 HD2 TYR 95 HD1 TYR 95 -9.653 19.251 -3.383 765 HE1 TYR 95 HE2 TYR 95 -12.378 15.990 -5.939 766 HE2 TYR 95 HE1 TYR 95 -11.553 20.039 -4.768 767 HH TYR 95 HH TYR 95 -12.837 19.236 -6.752 768 H ALA 96 HN ALA 96 -6.988 14.212 -3.350 769 HA ALA 96 HA ALA 96 -7.983 13.195 -5.915 770 HB1 ALA 96 HB1 ALA 96 -5.142 12.798 -4.960 771 HB2 ALA 96 HB2 ALA 96 -5.655 13.645 -6.415 772 HB3 ALA 96 HB3 ALA 96 -5.883 11.901 -6.278 773 H VAL 97 HN VAL 97 -8.666 11.133 -5.898 774 HA VAL 97 HA VAL 97 -8.463 9.634 -3.343 775 HB VAL 97 HB VAL 97 -10.732 9.211 -5.277 776 HG11 VAL 97 HG11 VAL 97 -10.260 8.830 -2.319 777 HG12 VAL 97 HG12 VAL 97 -11.882 8.819 -2.998 778 HG13 VAL 97 HG13 VAL 97 -10.700 7.626 -3.526 779 HG21 VAL 97 HG21 VAL 97 -10.416 11.491 -3.320 780 HG22 VAL 97 HG22 VAL 97 -10.913 11.561 -5.009 781 HG23 VAL 97 HG23 VAL 97 -12.006 10.897 -3.796 782 H ILE 98 HN ILE 98 -7.252 7.836 -3.580 783 HA ILE 98 HA ILE 98 -7.136 6.580 -6.259 784 HB ILE 98 HB ILE 98 -4.861 6.784 -4.294 785 HG12 ILE 98 HG12 ILE 98 -5.448 8.607 -6.654 786 HG13 ILE 98 HG11 ILE 98 -5.690 9.060 -4.969 787 HG21 ILE 98 HG21 ILE 98 -4.969 5.089 -6.278 788 HG22 ILE 98 HG22 ILE 98 -4.690 6.507 -7.287 789 HG23 ILE 98 HG23 ILE 98 -3.508 6.048 -6.065 790 HD11 ILE 98 HD11 ILE 98 -3.160 8.710 -6.489 791 HD12 ILE 98 HD12 ILE 98 -3.570 9.886 -5.241 792 HD13 ILE 98 HD13 ILE 98 -3.155 8.235 -4.787 793 H TYR 99 HN TYR 99 -6.881 4.373 -6.339 794 HA TYR 99 HA TYR 99 -7.748 2.928 -3.932 795 HB2 TYR 99 HB2 TYR 99 -8.742 2.730 -6.364 796 HB3 TYR 99 HB1 TYR 99 -7.377 1.650 -6.628 797 HD1 TYR 99 HD1 TYR 99 -10.517 2.168 -4.781 798 HD2 TYR 99 HD2 TYR 99 -7.203 -0.484 -5.439 799 HE1 TYR 99 HE1 TYR 99 -11.755 0.343 -3.648 800 HE2 TYR 99 HE2 TYR 99 -8.440 -2.310 -4.304 801 HH TYR 99 HH TYR 99 -11.756 -1.803 -3.091 802 H ALA 100 HN ALA 100 -6.106 2.414 -2.667 803 HA ALA 100 HA ALA 100 -3.576 1.414 -3.826 804 HB1 ALA 100 HB1 ALA 100 -3.198 3.167 -2.251 805 HB2 ALA 100 HB2 ALA 100 -2.750 1.666 -1.441 806 HB3 ALA 100 HB3 ALA 100 -4.294 2.438 -1.076 807 H THR 101 HN THR 101 -2.783 -0.593 -3.404 808 HA THR 101 HA THR 101 -4.261 -2.370 -1.591 809 HB THR 101 HB THR 101 -5.340 -2.744 -3.731 810 HG1 THR 101 HG1 THR 101 -4.524 -4.964 -4.069 811 HG21 THR 101 HG21 THR 101 -3.405 -1.821 -5.075 812 HG22 THR 101 HG22 THR 101 -2.598 -3.373 -4.846 813 HG23 THR 101 HG23 THR 101 -4.122 -3.293 -5.730 814 H ARG 102 HN ARG 102 -2.980 -3.712 -0.501 815 HA ARG 102 HA ARG 102 -0.187 -4.077 -1.409 816 HB2 ARG 102 HB2 ARG 102 -0.376 -2.630 0.616 817 HB3 ARG 102 HB1 ARG 102 -1.183 -3.962 1.445 818 HG2 ARG 102 HG2 ARG 102 0.800 -5.388 1.092 819 HG3 ARG 102 HG1 ARG 102 1.609 -4.059 0.262 820 HD2 ARG 102 HD2 ARG 102 1.346 -2.683 2.344 821 HD3 ARG 102 HD1 ARG 102 0.715 -4.113 3.156 822 HE ARG 102 HE ARG 102 2.884 -4.948 3.262 823 HH11 ARG 102 HH21 ARG 102 2.660 -2.311 1.033 824 HH12 ARG 102 HH22 ARG 102 4.371 -2.189 0.793 825 HH21 ARG 102 HH11 ARG 102 5.129 -4.794 2.952 826 HH22 ARG 102 HH12 ARG 102 5.769 -3.593 1.879 827 H VAL 103 HN VAL 103 0.368 -6.238 -1.765 828 HA VAL 103 HA VAL 103 -1.469 -8.237 -0.587 829 HB VAL 103 HB VAL 103 -1.658 -8.066 -3.027 830 HG11 VAL 103 HG11 VAL 103 1.205 -8.976 -3.267 831 HG12 VAL 103 HG12 VAL 103 0.165 -8.251 -4.492 832 HG13 VAL 103 HG13 VAL 103 0.819 -7.257 -3.192 833 HG21 VAL 103 HG21 VAL 103 -0.146 -10.556 -2.160 834 HG22 VAL 103 HG22 VAL 103 -1.875 -10.289 -1.942 835 HG23 VAL 103 HG23 VAL 103 -1.202 -10.421 -3.565 836 H LYS 104 HN LYS 104 -0.572 -9.438 0.941 837 HA LYS 104 HA LYS 104 2.349 -9.748 1.021 838 HB2 LYS 104 HB2 LYS 104 1.127 -8.929 3.052 839 HB3 LYS 104 HB1 LYS 104 0.269 -10.468 3.106 840 HG2 LYS 104 HG2 LYS 104 2.249 -11.689 3.560 841 HG3 LYS 104 HG1 LYS 104 3.288 -10.353 3.063 842 HD2 LYS 104 HD2 LYS 104 2.428 -9.021 4.994 843 HD3 LYS 104 HD1 LYS 104 1.507 -10.433 5.516 844 HE2 LYS 104 HE2 LYS 104 3.487 -11.697 5.928 845 HE3 LYS 104 HE1 LYS 104 4.495 -10.533 5.068 846 HZ1 LYS 104 HZ1 LYS 104 4.538 -10.412 7.568 847 HZ2 LYS 104 HZ2 LYS 104 4.212 -8.951 6.762 848 HZ3 LYS 104 HZ3 LYS 104 2.948 -9.817 7.489 849 H ASP 105 HN ASP 105 3.072 -11.975 1.779 850 HA ASP 105 HA ASP 105 2.333 -13.895 -0.119 851 HB2 ASP 105 HB2 ASP 105 4.480 -13.912 1.109 852 HB3 ASP 105 HB1 ASP 105 3.620 -14.362 2.581 853 H GLY 106 HN GLY 106 0.369 -14.733 -0.298 854 HA2 GLY 106 HA2 GLY 106 -1.290 -16.276 0.269 855 HA3 GLY 106 HA1 GLY 106 -0.760 -16.209 1.942 856 H ARG 107 HN ARG 107 -1.035 -13.035 1.202 857 HA ARG 107 HA ARG 107 -3.959 -12.942 1.668 858 HB2 ARG 107 HB2 ARG 107 -2.621 -12.763 3.818 859 HB3 ARG 107 HB1 ARG 107 -2.011 -11.226 3.203 860 HG2 ARG 107 HG2 ARG 107 -4.327 -10.401 2.967 861 HG3 ARG 107 HG1 ARG 107 -4.934 -11.933 3.597 862 HD2 ARG 107 HD2 ARG 107 -3.491 -11.490 5.661 863 HD3 ARG 107 HD1 ARG 107 -3.289 -9.851 5.045 864 HE ARG 107 HE ARG 107 -5.606 -10.880 6.351 865 HH11 ARG 107 HH21 ARG 107 -4.525 -8.813 3.795 866 HH12 ARG 107 HH22 ARG 107 -5.930 -7.801 3.832 867 HH21 ARG 107 HH11 ARG 107 -7.452 -9.559 6.404 868 HH22 ARG 107 HH12 ARG 107 -7.588 -8.224 5.308 869 H THR 108 HN THR 108 -5.038 -11.190 0.902 870 HA THR 108 HA THR 108 -3.510 -9.204 -0.688 871 HB THR 108 HB THR 108 -6.255 -10.290 -1.352 872 HG1 THR 108 HG1 THR 108 -4.841 -11.934 -1.699 873 HG21 THR 108 HG21 THR 108 -5.880 -9.161 -3.486 874 HG22 THR 108 HG22 THR 108 -5.699 -8.005 -2.166 875 HG23 THR 108 HG23 THR 108 -4.271 -8.662 -2.965 876 H LEU 109 HN LEU 109 -4.345 -7.063 -0.684 877 HA LEU 109 HA LEU 109 -6.626 -6.519 1.088 878 HB2 LEU 109 HB2 LEU 109 -4.801 -6.494 2.609 879 HB3 LEU 109 HB1 LEU 109 -3.814 -5.532 1.541 880 HG LEU 109 HG LEU 109 -5.517 -3.672 1.803 881 HD11 LEU 109 HD11 LEU 109 -6.594 -5.647 3.829 882 HD12 LEU 109 HD12 LEU 109 -6.948 -3.921 3.899 883 HD13 LEU 109 HD13 LEU 109 -7.470 -4.873 2.511 884 HD21 LEU 109 HD21 LEU 109 -3.355 -3.993 3.158 885 HD22 LEU 109 HD22 LEU 109 -4.576 -2.924 3.845 886 HD23 LEU 109 HD23 LEU 109 -4.397 -4.568 4.457 887 H HIS 110 HN HIS 110 -7.599 -4.606 0.791 888 HA HIS 110 HA HIS 110 -6.503 -2.792 -1.229 889 HB2 HIS 110 HB2 HIS 110 -8.932 -2.467 -2.013 890 HB3 HIS 110 HB1 HIS 110 -8.126 -3.955 -2.511 891 HD1 HIS 110 HD1 HIS 110 -9.108 -6.144 -1.703 892 HD2 HIS 110 HD2 HIS 110 -10.786 -2.850 0.222 893 HE1 HIS 110 HE1 HIS 110 -11.050 -7.025 -0.337 894 H MET 111 HN MET 111 -7.067 -0.550 -0.915 895 HA MET 111 HA MET 111 -8.804 0.150 1.275 896 HB2 MET 111 HB2 MET 111 -6.849 1.500 2.348 897 HB3 MET 111 HB1 MET 111 -6.998 -0.220 2.706 898 HG2 MET 111 HG2 MET 111 -5.265 -0.799 1.192 899 HG3 MET 111 HG1 MET 111 -5.303 0.785 0.417 900 HE1 MET 111 HE1 MET 111 -4.555 2.831 1.221 901 HE2 MET 111 HE2 MET 111 -3.200 3.045 2.325 902 HE3 MET 111 HE3 MET 111 -2.998 2.101 0.844 903 H MET 112 HN MET 112 -9.221 2.428 1.410 904 HA MET 112 HA MET 112 -8.675 3.829 -1.132 905 HB2 MET 112 HB2 MET 112 -10.561 4.730 1.043 906 HB3 MET 112 HB1 MET 112 -10.566 5.186 -0.654 907 HG2 MET 112 HG2 MET 112 -11.063 2.351 0.261 908 HG3 MET 112 HG1 MET 112 -12.359 3.530 0.104 909 HE1 MET 112 HE1 MET 112 -12.938 4.193 -3.438 910 HE2 MET 112 HE2 MET 112 -13.144 4.615 -1.742 911 HE3 MET 112 HE3 MET 112 -11.761 5.239 -2.650 912 H ARG 113 HN ARG 113 -7.527 5.732 -1.166 913 HA ARG 113 HA ARG 113 -6.649 6.845 1.439 914 HB2 ARG 113 HB2 ARG 113 -4.795 5.607 0.545 915 HB3 ARG 113 HB1 ARG 113 -5.013 6.325 -1.047 916 HG2 ARG 113 HG2 ARG 113 -4.650 8.284 1.162 917 HG3 ARG 113 HG1 ARG 113 -3.249 7.266 0.846 918 HD2 ARG 113 HD2 ARG 113 -3.551 7.894 -1.632 919 HD3 ARG 113 HD1 ARG 113 -4.651 9.147 -1.060 920 HE ARG 113 HE ARG 113 -2.334 9.428 0.433 921 HH11 ARG 113 HH21 ARG 113 -3.271 9.463 -2.896 922 HH12 ARG 113 HH22 ARG 113 -2.018 10.559 -3.380 923 HH21 ARG 113 HH11 ARG 113 -0.690 10.863 -0.191 924 HH22 ARG 113 HH12 ARG 113 -0.558 11.353 -1.846 925 H LEU 114 HN LEU 114 -6.975 8.966 1.680 926 HA LEU 114 HA LEU 114 -7.579 10.587 -0.721 927 HB2 LEU 114 HB2 LEU 114 -9.564 10.316 0.596 928 HB3 LEU 114 HB1 LEU 114 -8.702 10.675 2.073 929 HG LEU 114 HG LEU 114 -8.336 12.987 1.342 930 HD11 LEU 114 HD11 LEU 114 -8.095 12.841 -1.006 931 HD12 LEU 114 HD12 LEU 114 -9.608 11.956 -1.193 932 HD13 LEU 114 HD13 LEU 114 -9.633 13.673 -0.795 933 HD21 LEU 114 HD21 LEU 114 -10.758 13.708 1.190 934 HD22 LEU 114 HD22 LEU 114 -11.193 12.002 1.077 935 HD23 LEU 114 HD23 LEU 114 -10.408 12.618 2.530 936 H TYR 115 HN TYR 115 -6.282 12.215 -1.088 937 HA TYR 115 HA TYR 115 -4.572 13.233 1.096 938 HB2 TYR 115 HB2 TYR 115 -2.741 12.843 -0.195 939 HB3 TYR 115 HB1 TYR 115 -3.801 11.920 -1.246 940 HD1 TYR 115 HD1 TYR 115 -5.349 13.564 -2.800 941 HD2 TYR 115 HD2 TYR 115 -1.429 14.447 -1.285 942 HE1 TYR 115 HE1 TYR 115 -5.010 15.202 -4.630 943 HE2 TYR 115 HE2 TYR 115 -1.097 16.090 -3.115 944 HH TYR 115 HH TYR 115 -3.564 17.305 -4.963 945 H SER 116 HN SER 116 -3.874 15.446 0.878 946 HA SER 116 HA SER 116 -5.788 17.171 -0.594 947 HB2 SER 116 HB2 SER 116 -6.025 17.258 1.901 948 HB3 SER 116 HB1 SER 116 -4.347 17.792 2.005 949 HG SER 116 HG SER 116 -5.300 19.681 1.816 950 H ARG 117 HN ARG 117 -4.881 19.049 -1.622 951 HA ARG 117 HA ARG 117 -2.122 18.724 -2.396 952 HB2 ARG 117 HB2 ARG 117 -3.754 19.453 -4.040 953 HB3 ARG 117 HB1 ARG 117 -4.194 20.832 -3.047 954 HG2 ARG 117 HG2 ARG 117 -2.640 21.439 -4.907 955 HG3 ARG 117 HG1 ARG 117 -1.974 21.802 -3.318 956 HD2 ARG 117 HD2 ARG 117 -0.497 19.953 -3.392 957 HD3 ARG 117 HD1 ARG 117 -1.394 19.179 -4.696 958 HE ARG 117 HE ARG 117 -0.163 20.450 -6.192 959 HH11 ARG 117 HH21 ARG 117 -0.070 21.842 -3.026 960 HH12 ARG 117 HH22 ARG 117 1.088 23.061 -3.443 961 HH21 ARG 117 HH11 ARG 117 1.360 22.047 -6.747 962 HH22 ARG 117 HH12 ARG 117 1.895 23.178 -5.550 963 H SER 118 HN SER 118 -3.974 20.633 -0.191 964 HA SER 118 HA SER 118 -1.527 22.078 0.648 965 HB2 SER 118 HB2 SER 118 -3.089 23.602 -0.482 966 HB3 SER 118 HB1 SER 118 -4.375 23.108 0.614 967 HG SER 118 HG SER 118 -3.297 25.052 1.259 968 HA PRO 119 HA PRO 119 -1.837 20.306 4.695 969 HB2 PRO 119 HB2 PRO 119 -1.963 23.182 5.566 970 HB3 PRO 119 HB1 PRO 119 -0.991 21.850 6.225 971 HG2 PRO 119 HG2 PRO 119 0.042 23.690 4.558 972 HG3 PRO 119 HG1 PRO 119 0.591 22.007 4.573 973 HD2 PRO 119 HD2 PRO 119 -0.952 23.429 2.502 974 HD3 PRO 119 HD1 PRO 119 -0.066 21.894 2.386 975 H GLU 120 HN GLU 120 -4.104 22.687 3.535 976 HA GLU 120 HA GLU 120 -6.019 22.281 5.660 977 HB2 GLU 120 HB2 GLU 120 -6.463 23.653 3.006 978 HB3 GLU 120 HB1 GLU 120 -7.366 23.877 4.505 979 HG2 GLU 120 HG2 GLU 120 -5.293 24.749 5.582 980 HG3 GLU 120 HG1 GLU 120 -4.467 24.620 4.030 981 H VAL 121 HN VAL 121 -8.176 21.551 5.213 982 HA VAL 121 HA VAL 121 -8.289 19.420 3.153 983 HB VAL 121 HB VAL 121 -9.693 19.493 5.835 984 HG11 VAL 121 HG11 VAL 121 -10.981 18.208 4.282 985 HG12 VAL 121 HG12 VAL 121 -9.536 17.474 3.586 986 HG13 VAL 121 HG13 VAL 121 -10.047 17.039 5.217 987 HG21 VAL 121 HG21 VAL 121 -8.092 17.792 6.519 988 HG22 VAL 121 HG22 VAL 121 -7.352 17.794 4.919 989 HG23 VAL 121 HG23 VAL 121 -7.200 19.207 5.962 990 H SER 122 HN SER 122 -9.627 19.944 1.552 991 HA SER 122 HA SER 122 -11.638 21.973 1.854 992 HB2 SER 122 HB2 SER 122 -10.654 20.251 -0.393 993 HB3 SER 122 HB1 SER 122 -12.171 21.125 -0.567 994 HG SER 122 HG SER 122 -10.950 22.770 -1.015 995 HA PRO 123 HA PRO 123 -14.915 19.220 3.049 996 HB2 PRO 123 HB2 PRO 123 -17.093 20.682 2.226 997 HB3 PRO 123 HB1 PRO 123 -16.144 21.072 3.674 998 HG2 PRO 123 HG2 PRO 123 -16.024 22.287 0.953 999 HG3 PRO 123 HG1 PRO 123 -15.936 23.068 2.541 1000 HD2 PRO 123 HD2 PRO 123 -13.718 22.580 1.030 1001 HD3 PRO 123 HD1 PRO 123 -13.680 22.582 2.808 1002 H ALA 124 HN ALA 124 -14.709 20.437 -0.237 1003 HA ALA 124 HA ALA 124 -16.624 18.639 -1.377 1004 HB1 ALA 124 HB1 ALA 124 -16.102 20.662 -2.571 1005 HB2 ALA 124 HB2 ALA 124 -15.522 19.306 -3.540 1006 HB3 ALA 124 HB3 ALA 124 -14.383 20.266 -2.594 1007 H ALA 125 HN ALA 125 -13.155 18.577 -0.811 1008 HA ALA 125 HA ALA 125 -12.531 16.291 -2.361 1009 HB1 ALA 125 HB1 ALA 125 -11.199 17.354 0.143 1010 HB2 ALA 125 HB2 ALA 125 -10.816 17.830 -1.508 1011 HB3 ALA 125 HB3 ALA 125 -10.498 16.182 -0.969 1012 H THR 126 HN THR 126 -13.590 16.727 0.960 1013 HA THR 126 HA THR 126 -13.356 13.941 1.645 1014 HB THR 126 HB THR 126 -15.093 15.866 3.156 1015 HG1 THR 126 HG1 THR 126 -12.776 16.081 4.194 1016 HG21 THR 126 HG21 THR 126 -13.229 13.605 3.939 1017 HG22 THR 126 HG22 THR 126 -14.125 14.603 5.083 1018 HG23 THR 126 HG23 THR 126 -14.991 13.559 3.957 1019 H ALA 127 HN ALA 127 -15.898 16.037 0.347 1020 HA ALA 127 HA ALA 127 -18.019 14.182 0.805 1021 HB1 ALA 127 HB1 ALA 127 -17.770 16.580 -1.002 1022 HB2 ALA 127 HB2 ALA 127 -18.453 16.548 0.623 1023 HB3 ALA 127 HB3 ALA 127 -19.269 15.703 -0.693 1024 H ILE 128 HN ILE 128 -16.149 15.107 -2.133 1025 HA ILE 128 HA ILE 128 -17.497 13.422 -3.927 1026 HB ILE 128 HB ILE 128 -15.603 15.235 -4.265 1027 HG12 ILE 128 HG12 ILE 128 -16.775 14.218 -6.110 1028 HG13 ILE 128 HG11 ILE 128 -15.051 14.196 -6.452 1029 HG21 ILE 128 HG21 ILE 128 -13.931 12.704 -4.262 1030 HG22 ILE 128 HG22 ILE 128 -13.386 14.340 -4.626 1031 HG23 ILE 128 HG23 ILE 128 -13.885 13.924 -2.989 1032 HD11 ILE 128 HD11 ILE 128 -16.832 11.906 -5.645 1033 HD12 ILE 128 HD12 ILE 128 -15.744 12.017 -7.028 1034 HD13 ILE 128 HD13 ILE 128 -15.087 11.816 -5.403 1035 H PHE 129 HN PHE 129 -14.843 13.009 -1.785 1036 HA PHE 129 HA PHE 129 -14.003 10.410 -2.232 1037 HB2 PHE 129 HB2 PHE 129 -13.003 11.966 -0.574 1038 HB3 PHE 129 HB1 PHE 129 -14.393 11.681 0.473 1039 HD1 PHE 129 HD1 PHE 129 -14.863 9.427 1.380 1040 HD2 PHE 129 HD2 PHE 129 -11.319 10.283 -0.876 1041 HE1 PHE 129 HE1 PHE 129 -13.853 7.305 2.167 1042 HE2 PHE 129 HE2 PHE 129 -10.297 8.167 -0.077 1043 HZ PHE 129 HZ PHE 129 -11.569 6.687 1.445 1044 H ARG 130 HN ARG 130 -16.740 11.609 -0.370 1045 HA ARG 130 HA ARG 130 -17.594 9.120 0.677 1046 HB2 ARG 130 HB2 ARG 130 -18.185 11.593 1.340 1047 HB3 ARG 130 HB1 ARG 130 -19.493 11.390 0.175 1048 HG2 ARG 130 HG2 ARG 130 -20.178 9.308 1.388 1049 HG3 ARG 130 HG1 ARG 130 -18.944 9.660 2.599 1050 HD2 ARG 130 HD2 ARG 130 -21.285 11.443 1.878 1051 HD3 ARG 130 HD1 ARG 130 -21.125 10.492 3.352 1052 HE ARG 130 HE ARG 130 -19.938 13.041 2.855 1053 HH11 ARG 130 HH21 ARG 130 -19.432 9.958 4.346 1054 HH12 ARG 130 HH22 ARG 130 -18.334 10.564 5.542 1055 HH21 ARG 130 HH11 ARG 130 -18.500 13.841 4.420 1056 HH22 ARG 130 HH12 ARG 130 -17.807 12.760 5.583 1057 H LYS 131 HN LYS 131 -18.531 10.932 -2.242 1058 HA LYS 131 HA LYS 131 -20.757 9.511 -3.029 1059 HB2 LYS 131 HB2 LYS 131 -19.777 11.517 -4.179 1060 HB3 LYS 131 HB1 LYS 131 -18.581 10.445 -4.909 1061 HG2 LYS 131 HG2 LYS 131 -20.453 9.085 -5.865 1062 HG3 LYS 131 HG1 LYS 131 -21.592 10.274 -5.232 1063 HD2 LYS 131 HD2 LYS 131 -20.533 12.036 -6.575 1064 HD3 LYS 131 HD1 LYS 131 -19.348 10.878 -7.181 1065 HE2 LYS 131 HE2 LYS 131 -21.425 9.509 -7.963 1066 HE3 LYS 131 HE1 LYS 131 -22.302 11.027 -7.759 1067 HZ1 LYS 131 HZ1 LYS 131 -21.041 12.070 -9.376 1068 HZ2 LYS 131 HZ2 LYS 131 -19.785 10.929 -9.293 1069 HZ3 LYS 131 HZ3 LYS 131 -21.258 10.515 -10.024 1070 H LEU 132 HN LEU 132 -17.425 8.801 -4.142 1071 HA LEU 132 HA LEU 132 -18.119 6.364 -5.381 1072 HB2 LEU 132 HB2 LEU 132 -15.622 5.856 -5.145 1073 HB3 LEU 132 HB1 LEU 132 -16.069 7.291 -6.056 1074 HG LEU 132 HG LEU 132 -15.851 8.332 -3.507 1075 HD11 LEU 132 HD11 LEU 132 -13.522 6.433 -3.756 1076 HD12 LEU 132 HD12 LEU 132 -14.004 7.403 -2.365 1077 HD13 LEU 132 HD13 LEU 132 -14.967 6.005 -2.841 1078 HD21 LEU 132 HD21 LEU 132 -14.857 9.205 -5.633 1079 HD22 LEU 132 HD22 LEU 132 -13.746 9.287 -4.270 1080 HD23 LEU 132 HD23 LEU 132 -13.565 8.014 -5.475 1081 H ALA 133 HN ALA 133 -17.212 7.138 -2.077 1082 HA ALA 133 HA ALA 133 -16.688 4.546 -1.147 1083 HB1 ALA 133 HB1 ALA 133 -16.719 5.462 0.962 1084 HB2 ALA 133 HB2 ALA 133 -18.151 6.441 0.640 1085 HB3 ALA 133 HB3 ALA 133 -16.580 6.944 0.020 1086 H GLY 134 HN GLY 134 -19.763 6.336 -1.419 1087 HA2 GLY 134 HA2 GLY 134 -21.439 4.412 -0.233 1088 HA3 GLY 134 HA1 GLY 134 -21.939 5.607 -1.426 1089 H GLU 135 HN GLU 135 -20.151 4.770 -3.480 1090 HA GLU 135 HA GLU 135 -21.717 2.738 -4.706 1091 HB2 GLU 135 HB2 GLU 135 -20.402 4.579 -5.874 1092 HB3 GLU 135 HB1 GLU 135 -18.956 3.620 -5.557 1093 HG2 GLU 135 HG2 GLU 135 -19.958 1.712 -6.762 1094 HG3 GLU 135 HG1 GLU 135 -21.398 2.674 -7.086 1095 H ARG 136 HN ARG 136 -19.086 2.663 -2.506 1096 HA ARG 136 HA ARG 136 -18.388 -0.105 -3.249 1097 HB2 ARG 136 HB2 ARG 136 -16.648 1.803 -2.886 1098 HB3 ARG 136 HB1 ARG 136 -16.957 1.536 -1.172 1099 HG2 ARG 136 HG2 ARG 136 -16.342 -0.823 -1.394 1100 HG3 ARG 136 HG1 ARG 136 -16.121 -0.624 -3.132 1101 HD2 ARG 136 HD2 ARG 136 -14.233 0.787 -2.839 1102 HD3 ARG 136 HD1 ARG 136 -14.587 1.037 -1.131 1103 HE ARG 136 HE ARG 136 -13.115 -1.147 -2.253 1104 HH11 ARG 136 HH21 ARG 136 -15.338 -0.221 0.231 1105 HH12 ARG 136 HH22 ARG 136 -14.846 -1.466 1.328 1106 HH21 ARG 136 HH11 ARG 136 -12.462 -2.783 -0.819 1107 HH22 ARG 136 HH12 ARG 136 -13.216 -2.915 0.736 1108 H ASN 137 HN ASN 137 -20.757 1.122 -1.572 1109 HA ASN 137 HA ASN 137 -21.998 0.501 0.279 1110 HB2 ASN 137 HB2 ASN 137 -20.392 -2.019 -0.054 1111 HB3 ASN 137 HB1 ASN 137 -21.900 -1.877 0.846 1112 HD21 ASN 137 HD21 ASN 137 -23.771 -0.859 -0.602 1113 HD22 ASN 137 HD22 ASN 137 -23.871 -1.463 -2.185 1114 H TYR 138 HN TYR 138 -19.507 1.857 0.763 1115 HA TYR 138 HA TYR 138 -18.156 0.662 3.005 1116 HB2 TYR 138 HB2 TYR 138 -16.766 2.526 2.931 1117 HB3 TYR 138 HB1 TYR 138 -17.361 2.503 1.269 1118 HD1 TYR 138 HD1 TYR 138 -19.981 3.545 1.292 1119 HD2 TYR 138 HD2 TYR 138 -16.679 4.731 3.766 1120 HE1 TYR 138 HE1 TYR 138 -21.046 5.752 1.646 1121 HE2 TYR 138 HE2 TYR 138 -17.749 6.944 4.115 1122 HH TYR 138 HH TYR 138 -20.866 7.573 3.609 1123 H THR 139 HN THR 139 -18.070 1.601 5.144 1124 HA THR 139 HA THR 139 -20.517 3.066 5.955 1125 HB THR 139 HB THR 139 -20.939 1.648 7.695 1126 HG1 THR 139 HG1 THR 139 -19.381 0.913 9.029 1127 HG21 THR 139 HG21 THR 139 -20.714 -0.580 7.084 1128 HG22 THR 139 HG22 THR 139 -20.425 0.209 5.536 1129 HG23 THR 139 HG23 THR 139 -19.069 -0.366 6.503 1130 H ASP 140 HN ASP 140 -20.182 4.595 7.680 1131 HA ASP 140 HA ASP 140 -18.046 6.236 7.454 1132 HB2 ASP 140 HB2 ASP 140 -18.536 7.100 9.701 1133 HB3 ASP 140 HB1 ASP 140 -20.019 6.788 8.799 1134 H GLU 141 HN GLU 141 -18.199 3.665 9.979 1135 HA GLU 141 HA GLU 141 -15.699 4.107 11.072 1136 HB2 GLU 141 HB2 GLU 141 -17.529 2.506 11.849 1137 HB3 GLU 141 HB1 GLU 141 -16.863 1.353 10.693 1138 HG2 GLU 141 HG2 GLU 141 -14.651 1.547 11.785 1139 HG3 GLU 141 HG1 GLU 141 -15.334 2.676 12.952 1140 H MET 142 HN MET 142 -16.448 2.836 7.959 1141 HA MET 142 HA MET 142 -13.990 1.370 7.612 1142 HB2 MET 142 HB2 MET 142 -15.835 2.368 5.445 1143 HB3 MET 142 HB1 MET 142 -14.711 1.014 5.372 1144 HG2 MET 142 HG2 MET 142 -16.180 0.231 7.506 1145 HG3 MET 142 HG1 MET 142 -17.391 1.176 6.653 1146 HE1 MET 142 HE1 MET 142 -14.447 -1.231 4.803 1147 HE2 MET 142 HE2 MET 142 -14.670 -1.188 6.548 1148 HE3 MET 142 HE3 MET 142 -15.221 -2.586 5.617 1149 H VAL 143 HN VAL 143 -14.917 4.649 7.344 1150 HA VAL 143 HA VAL 143 -12.327 5.283 6.030 1151 HB VAL 143 HB VAL 143 -14.338 5.755 4.570 1152 HG11 VAL 143 HG11 VAL 143 -15.818 7.534 5.134 1153 HG12 VAL 143 HG12 VAL 143 -15.738 6.521 6.572 1154 HG13 VAL 143 HG13 VAL 143 -14.829 8.029 6.501 1155 HG21 VAL 143 HG21 VAL 143 -12.368 7.859 5.462 1156 HG22 VAL 143 HG22 VAL 143 -12.411 6.954 3.955 1157 HG23 VAL 143 HG23 VAL 143 -13.571 8.248 4.236 1158 H ALA 144 HN ALA 144 -10.990 6.419 7.260 1159 HA ALA 144 HA ALA 144 -12.139 7.929 9.544 1160 HB1 ALA 144 HB1 ALA 144 -9.834 7.597 10.545 1161 HB2 ALA 144 HB2 ALA 144 -9.520 6.466 9.229 1162 HB3 ALA 144 HB3 ALA 144 -10.813 6.139 10.382 1163 H MET 145 HN MET 145 -12.120 10.070 9.210 1164 HA MET 145 HA MET 145 -10.301 11.322 7.415 1165 HB2 MET 145 HB2 MET 145 -12.500 12.133 7.327 1166 HB3 MET 145 HB1 MET 145 -12.713 12.005 9.064 1167 HG2 MET 145 HG2 MET 145 -12.043 14.116 9.367 1168 HG3 MET 145 HG1 MET 145 -10.579 13.828 8.458 1169 HE1 MET 145 HE1 MET 145 -10.221 13.940 6.140 1170 HE2 MET 145 HE2 MET 145 -11.586 13.048 5.476 1171 HE3 MET 145 HE3 MET 145 -11.234 14.683 4.906 1172 H LEU 146 HN LEU 146 -8.650 12.842 8.151 1173 HA LEU 146 HA LEU 146 -8.094 12.734 10.991 1174 HB2 LEU 146 HB2 LEU 146 -6.704 11.399 9.066 1175 HB3 LEU 146 HB1 LEU 146 -5.820 12.920 9.109 1176 HG LEU 146 HG LEU 146 -5.330 12.679 11.381 1177 HD11 LEU 146 HD11 LEU 146 -7.078 11.744 12.655 1178 HD12 LEU 146 HD12 LEU 146 -7.526 10.632 11.364 1179 HD13 LEU 146 HD13 LEU 146 -6.159 10.273 12.412 1180 HD21 LEU 146 HD21 LEU 146 -4.045 11.254 9.779 1181 HD22 LEU 146 HD22 LEU 146 -4.049 10.636 11.428 1182 HD23 LEU 146 HD23 LEU 146 -5.089 9.914 10.215 1183 HA PRO 147 HA PRO 147 -8.126 17.168 10.623 1184 HB2 PRO 147 HB2 PRO 147 -7.103 17.833 13.028 1185 HB3 PRO 147 HB1 PRO 147 -8.682 17.028 12.885 1186 HG2 PRO 147 HG2 PRO 147 -6.000 15.798 13.438 1187 HG3 PRO 147 HG1 PRO 147 -7.521 15.591 14.329 1188 HD2 PRO 147 HD2 PRO 147 -6.714 13.812 12.508 1189 HD3 PRO 147 HD1 PRO 147 -8.434 14.193 12.711 1190 H ARG 148 HN ARG 148 -6.709 19.084 10.852 1191 HA ARG 148 HA ARG 148 -4.360 18.936 9.373 1192 HB2 ARG 148 HB2 ARG 148 -5.316 21.069 11.273 1193 HB3 ARG 148 HB1 ARG 148 -3.991 21.270 10.124 1194 HG2 ARG 148 HG2 ARG 148 -5.527 20.757 8.260 1195 HG3 ARG 148 HG1 ARG 148 -6.853 20.565 9.408 1196 HD2 ARG 148 HD2 ARG 148 -7.012 22.794 8.532 1197 HD3 ARG 148 HD1 ARG 148 -6.401 22.933 10.178 1198 HE ARG 148 HE ARG 148 -4.333 22.792 8.150 1199 HH11 ARG 148 HH21 ARG 148 -6.493 24.779 9.985 1200 HH12 ARG 148 HH22 ARG 148 -5.536 26.214 9.815 1201 HH21 ARG 148 HH11 ARG 148 -3.075 24.670 7.925 1202 HH22 ARG 148 HH12 ARG 148 -3.602 26.152 8.649 1203 H GLN 149 HN GLN 149 -4.796 17.956 12.523 1204 HA GLN 149 HA GLN 149 -2.565 18.877 13.898 1205 HB2 GLN 149 HB2 GLN 149 -4.601 17.269 14.562 1206 HB3 GLN 149 HB1 GLN 149 -3.363 16.037 14.344 1207 HG2 GLN 149 HG2 GLN 149 -3.377 18.366 16.269 1208 HG3 GLN 149 HG1 GLN 149 -3.202 16.650 16.631 1209 HE21 GLN 149 HE21 GLN 149 -1.399 19.328 16.772 1210 HE22 GLN 149 HE22 GLN 149 0.116 18.725 16.302 1211 H GLU 150 HN GLU 150 -0.463 18.587 13.752 1212 HA GLU 150 HA GLU 150 0.626 16.225 12.332 1213 HB2 GLU 150 HB2 GLU 150 2.299 17.660 11.272 1214 HB3 GLU 150 HB1 GLU 150 0.674 18.175 10.818 1215 HG2 GLU 150 HG2 GLU 150 0.773 19.871 12.679 1216 HG3 GLU 150 HG1 GLU 150 2.467 19.438 12.907 1217 H GLU 151 HN GLU 151 2.484 15.371 13.213 1218 HA GLU 151 HA GLU 151 3.643 16.754 15.567 1219 HB2 GLU 151 HB2 GLU 151 2.147 14.811 16.187 1220 HB3 GLU 151 HB1 GLU 151 3.288 13.761 15.347 1221 HG2 GLU 151 HG2 GLU 151 5.107 14.789 16.815 1222 HG3 GLU 151 HG1 GLU 151 3.805 15.498 17.768 1223 H CYS 152 HN CYS 152 4.045 14.711 12.775 1224 HA CYS 152 HA CYS 152 6.955 15.203 12.857 1225 HB2 CYS 152 HB2 CYS 152 6.289 12.828 13.593 1226 HB3 CYS 152 HB1 CYS 152 5.819 12.574 11.914 1227 H THR 153 HN THR 153 7.950 15.128 10.749 1228 HA THR 153 HA THR 153 6.224 15.063 8.406 1229 HB THR 153 HB THR 153 6.913 17.371 7.703 1230 HG1 THR 153 HG1 THR 153 7.499 17.830 10.410 1231 HG21 THR 153 HG21 THR 153 5.179 18.460 8.925 1232 HG22 THR 153 HG22 THR 153 4.702 16.766 8.856 1233 HG23 THR 153 HG23 THR 153 5.413 17.424 10.329 1234 H VAL 154 HN VAL 154 7.494 15.333 6.377 1235 HA VAL 154 HA VAL 154 9.879 13.828 6.458 1236 HB VAL 154 HB VAL 154 9.935 14.140 4.094 1237 HG11 VAL 154 HG11 VAL 154 7.208 13.797 5.286 1238 HG12 VAL 154 HG12 VAL 154 7.355 13.911 3.534 1239 HG13 VAL 154 HG13 VAL 154 8.203 12.638 4.406 1240 HG21 VAL 154 HG21 VAL 154 9.750 16.467 3.789 1241 HG22 VAL 154 HG22 VAL 154 8.268 15.840 3.070 1242 HG23 VAL 154 HG23 VAL 154 8.233 16.552 4.682 1243 H ASP 155 HN ASP 155 11.913 14.568 5.583 1244 HA ASP 155 HA ASP 155 12.724 17.071 6.779 1245 HB2 ASP 155 HB2 ASP 155 14.274 15.252 6.942 1246 HB3 ASP 155 HB1 ASP 155 14.278 15.027 5.199 1247 H GLU 156 HN GLU 156 14.077 18.534 5.577 1248 HA GLU 156 HA GLU 156 12.686 19.728 3.442 1249 HB2 GLU 156 HB2 GLU 156 15.449 20.129 4.583 1250 HB3 GLU 156 HB1 GLU 156 14.821 21.106 3.264 1251 HG2 GLU 156 HG2 GLU 156 12.852 21.693 4.691 1252 HG3 GLU 156 HG1 GLU 156 13.609 20.819 6.023 1253 H VAL 157 HN VAL 157 15.413 17.511 3.562 1254 HA VAL 157 HA VAL 157 15.058 16.837 0.780 1255 HB VAL 157 HB VAL 157 16.443 18.878 0.596 1256 HG11 VAL 157 HG11 VAL 157 18.597 19.033 1.604 1257 HG12 VAL 157 HG12 VAL 157 17.523 18.477 2.888 1258 HG13 VAL 157 HG13 VAL 157 18.585 17.332 2.067 1259 HG21 VAL 157 HG21 VAL 157 18.164 17.907 -0.814 1260 HG22 VAL 157 HG22 VAL 157 18.039 16.362 0.028 1261 HG23 VAL 157 HG23 VAL 157 16.705 16.929 -0.976 1262 HN1 EB4 200 H17 EB4 200 0.063 -0.835 5.758 1263 H8 EB4 200 H8 EB4 200 5.130 0.787 1.398 1264 HN2 EB4 200 H25 EB4 200 3.172 -0.173 6.608 1265 H9 EB4 200 H9 EB4 200 1.039 6.048 3.170 1266 H10 EB4 200 H10 EB4 200 -2.476 -0.745 0.405 1267 HN3 EB4 200 H32 EB4 200 0.622 1.975 7.287 1268 H7 EB4 200 H7 EB4 200 -0.825 1.104 0.378 1269 H11 EB4 200 H11 EB4 200 6.866 -0.796 2.191 1270 H12 EB4 200 H12 EB4 200 0.015 7.396 4.982 1271 H15 EB4 200 H15 EB4 200 -0.351 6.392 7.219 1272 H14 EB4 200 H14 EB4 200 6.809 -1.631 4.525 1273 H13 EB4 200 H13 EB4 200 -2.736 -2.142 2.439 1274 H22 EB4 200 H22 EB4 200 -1.422 -3.069 6.990 1275 H30 EB4 200 H30 EB4 200 -1.017 0.203 10.083 1276 H30A EB4 200 H9N EB4 200 -1.851 1.297 8.875 1277 H24 EB4 200 H24 EB4 200 -0.126 2.522 10.104 1278 H28 EB4 200 H28 EB4 200 0.618 -3.601 8.237 1279 H28A EB4 200 H9L EB4 200 0.800 -3.800 6.486 1280 H23 EB4 200 H23 EB4 200 4.556 -1.692 8.768 1281 H29 EB4 200 H29 EB4 200 3.350 -0.239 10.352 1282 H29A EB4 200 H9M EB4 200 4.408 0.738 9.220 1283 H21 ACD 300 HA3 ACD 300 0.130 9.012 -11.971 1284 H22 ACD 300 HA4 ACD 300 0.391 10.376 -10.863 1285 H31 ACD 300 HA1 ACD 300 0.268 7.431 -10.080 1286 H32 ACD 300 HA2 ACD 300 1.736 8.430 -10.164 1287 H41 ACD 300 HA0 ACD 300 -0.653 8.878 -8.315 1288 H42 ACD 300 HAZ ACD 300 0.758 9.954 -8.440 1289 H5 ACD 300 HAY ACD 300 2.151 7.629 -7.831 1290 H6 ACD 300 HAX ACD 300 1.148 7.105 -5.470 1291 H71 ACD 300 HAV ACD 300 -1.017 9.136 -6.428 1292 H72 ACD 300 HAW ACD 300 -1.527 7.526 -5.874 1293 H8 ACD 300 HAU ACD 300 -0.610 9.850 -4.109 1294 H9 ACD 300 HAT ACD 300 -0.840 8.160 -2.137 1295 H101 ACD 300 HAR ACD 300 -1.607 6.168 -4.364 1296 H102 ACD 300 HAS ACD 300 -0.080 5.826 -3.519 1297 H11 ACD 300 HAQ ACD 300 -2.890 5.436 -2.392 1298 H12 ACD 300 HAP ACD 300 -1.678 4.966 -0.111 1299 H131 ACD 300 HAN ACD 300 0.662 6.612 -1.387 1300 H132 ACD 300 HAO ACD 300 0.951 4.858 -0.944 1301 H14 ACD 300 HAM ACD 300 0.674 5.382 1.430 1302 H15 ACD 300 HAL ACD 300 0.845 7.889 2.122 1303 H161 ACD 300 HAJ ACD 300 -0.419 8.673 -0.450 1304 H162 ACD 300 HAK ACD 300 0.640 9.710 0.528 1305 H171 ACD 300 HAH ACD 300 2.629 8.759 -0.549 1306 H172 ACD 300 HAI ACD 300 1.623 7.633 -1.483 1307 H181 ACD 300 HAF ACD 300 0.407 9.684 -2.420 1308 H182 ACD 300 HAG ACD 300 1.704 10.665 -1.699 1309 H191 ACD 300 HAD ACD 300 3.396 9.507 -2.993 1310 H192 ACD 300 HAE ACD 300 2.207 8.332 -3.596 1311 H201 ACD 300 HAA ACD 300 2.679 10.043 -5.300 1312 H202 ACD 300 HAB ACD 300 2.211 11.334 -4.173 1313 H203 ACD 300 HAC ACD 300 0.993 10.178 -4.763 Start of MODEL 8 1 H1 MET 1 HT1 MET 1 1.511 15.354 -27.600 2 H2 MET 1 HT2 MET 1 1.442 14.156 -26.397 3 H3 MET 1 HT3 MET 1 2.577 14.035 -27.656 4 HA MET 1 HA MET 1 3.831 14.786 -25.864 5 HB2 MET 1 HB2 MET 1 4.092 16.116 -27.974 6 HB3 MET 1 HB1 MET 1 2.935 17.283 -27.333 7 HG2 MET 1 HG2 MET 1 4.412 17.644 -25.372 8 HG3 MET 1 HG1 MET 1 5.581 16.518 -26.063 9 HE1 MET 1 HE1 MET 1 5.790 19.734 -25.206 10 HE2 MET 1 HE2 MET 1 7.136 18.645 -25.528 11 HE3 MET 1 HE3 MET 1 7.027 20.194 -26.374 12 H THR 2 HN THR 2 0.591 15.995 -25.965 13 HA THR 2 HA THR 2 0.632 17.834 -23.842 14 HB THR 2 HB THR 2 -1.631 15.966 -24.583 15 HG1 THR 2 HG1 THR 2 -0.483 18.140 -25.830 16 HG21 THR 2 HG21 THR 2 -1.546 18.686 -23.247 17 HG22 THR 2 HG22 THR 2 -3.019 17.842 -23.724 18 HG23 THR 2 HG23 THR 2 -1.977 17.160 -22.475 19 H VAL 3 HN VAL 3 0.646 17.629 -21.672 20 HA VAL 3 HA VAL 3 0.094 15.052 -20.416 21 HB VAL 3 HB VAL 3 2.293 15.291 -19.103 22 HG11 VAL 3 HG11 VAL 3 2.486 14.670 -22.065 23 HG12 VAL 3 HG12 VAL 3 3.530 14.046 -20.790 24 HG13 VAL 3 HG13 VAL 3 1.836 13.562 -20.857 25 HG21 VAL 3 HG21 VAL 3 3.107 16.869 -21.552 26 HG22 VAL 3 HG22 VAL 3 2.652 17.648 -20.038 27 HG23 VAL 3 HG23 VAL 3 4.049 16.574 -20.091 28 HA PRO 4 HA PRO 4 -1.519 17.795 -17.337 29 HB2 PRO 4 HB2 PRO 4 -1.462 16.194 -15.117 30 HB3 PRO 4 HB1 PRO 4 -2.618 15.966 -16.445 31 HG2 PRO 4 HG2 PRO 4 -0.069 14.515 -15.891 32 HG3 PRO 4 HG1 PRO 4 -1.636 13.876 -16.421 33 HD2 PRO 4 HD2 PRO 4 0.435 14.282 -18.152 34 HD3 PRO 4 HD1 PRO 4 -1.266 14.434 -18.645 35 H ASP 5 HN ASP 5 -0.933 19.056 -15.474 36 HA ASP 5 HA ASP 5 1.868 19.602 -15.281 37 HB2 ASP 5 HB2 ASP 5 -0.065 21.255 -14.999 38 HB3 ASP 5 HB1 ASP 5 -0.251 20.591 -13.377 39 H ARG 6 HN ARG 6 2.373 17.295 -14.673 40 HA ARG 6 HA ARG 6 1.714 16.216 -12.155 41 HB2 ARG 6 HB2 ARG 6 3.788 14.827 -12.504 42 HB3 ARG 6 HB1 ARG 6 2.647 14.789 -13.849 43 HG2 ARG 6 HG2 ARG 6 3.970 16.545 -15.002 44 HG3 ARG 6 HG1 ARG 6 5.129 16.524 -13.673 45 HD2 ARG 6 HD2 ARG 6 5.852 15.129 -15.615 46 HD3 ARG 6 HD1 ARG 6 5.685 14.203 -14.127 47 HE ARG 6 HE ARG 6 3.245 13.929 -15.318 48 HH11 ARG 6 HH21 ARG 6 6.526 13.502 -16.328 49 HH12 ARG 6 HH22 ARG 6 6.160 12.238 -17.455 50 HH21 ARG 6 HH11 ARG 6 2.757 12.272 -16.794 51 HH22 ARG 6 HH12 ARG 6 4.026 11.542 -17.719 52 H SER 7 HN SER 7 4.251 18.429 -13.179 53 HA SER 7 HA SER 7 5.908 18.336 -10.934 54 HB2 SER 7 HB2 SER 7 5.240 20.732 -12.656 55 HB3 SER 7 HB1 SER 7 6.633 20.588 -11.589 56 HG SER 7 HG SER 7 6.443 18.438 -13.196 57 H GLU 8 HN GLU 8 2.833 19.985 -11.431 58 HA GLU 8 HA GLU 8 2.912 21.751 -9.264 59 HB2 GLU 8 HB2 GLU 8 1.216 21.728 -11.113 60 HB3 GLU 8 HB1 GLU 8 0.464 20.336 -10.335 61 HG2 GLU 8 HG2 GLU 8 -0.712 22.318 -9.607 62 HG3 GLU 8 HG1 GLU 8 0.230 21.718 -8.245 63 H ILE 9 HN ILE 9 1.495 18.457 -9.402 64 HA ILE 9 HA ILE 9 1.048 18.488 -6.533 65 HB ILE 9 HB ILE 9 -0.515 17.359 -8.149 66 HG12 ILE 9 HG12 ILE 9 0.784 15.758 -5.917 67 HG13 ILE 9 HG11 ILE 9 -0.613 16.810 -5.789 68 HG21 ILE 9 HG21 ILE 9 0.119 15.278 -9.158 69 HG22 ILE 9 HG22 ILE 9 1.412 16.420 -9.526 70 HG23 ILE 9 HG23 ILE 9 1.628 15.222 -8.250 71 HD11 ILE 9 HD11 ILE 9 -0.927 14.199 -5.949 72 HD12 ILE 9 HD12 ILE 9 -2.033 15.265 -6.792 73 HD13 ILE 9 HD13 ILE 9 -0.738 14.468 -7.673 74 H ALA 10 HN ALA 10 3.453 17.243 -8.755 75 HA ALA 10 HA ALA 10 4.562 15.415 -6.851 76 HB1 ALA 10 HB1 ALA 10 6.055 16.500 -9.224 77 HB2 ALA 10 HB2 ALA 10 4.871 15.198 -9.353 78 HB3 ALA 10 HB3 ALA 10 6.320 14.977 -8.374 79 H GLY 11 HN GLY 11 6.196 15.611 -5.452 80 HA2 GLY 11 HA2 GLY 11 8.214 16.843 -4.750 81 HA3 GLY 11 HA1 GLY 11 7.312 18.326 -5.061 82 H LYS 12 HN LYS 12 4.797 17.245 -4.000 83 HA LYS 12 HA LYS 12 5.242 16.485 -1.266 84 HB2 LYS 12 HB2 LYS 12 5.829 18.940 -1.300 85 HB3 LYS 12 HB1 LYS 12 4.142 19.262 -1.703 86 HG2 LYS 12 HG2 LYS 12 3.534 17.877 0.361 87 HG3 LYS 12 HG1 LYS 12 5.238 17.971 0.803 88 HD2 LYS 12 HD2 LYS 12 3.379 20.324 0.346 89 HD3 LYS 12 HD1 LYS 12 3.998 19.774 1.903 90 HE2 LYS 12 HE2 LYS 12 5.509 21.061 -0.367 91 HE3 LYS 12 HE1 LYS 12 5.440 21.551 1.326 92 HZ1 LYS 12 HZ1 LYS 12 6.629 19.523 1.914 93 HZ2 LYS 12 HZ2 LYS 12 6.722 19.086 0.276 94 HZ3 LYS 12 HZ3 LYS 12 7.531 20.470 0.829 95 H TRP 13 HN TRP 13 3.631 15.007 -1.124 96 HA TRP 13 HA TRP 13 0.905 15.751 -2.039 97 HB2 TRP 13 HB2 TRP 13 2.318 13.084 -1.713 98 HB3 TRP 13 HB1 TRP 13 0.590 13.176 -1.945 99 HD1 TRP 13 HD1 TRP 13 3.421 15.031 -3.803 100 HE1 TRP 13 HE1 TRP 13 3.123 14.479 -6.298 101 HE3 TRP 13 HE3 TRP 13 -0.661 11.983 -3.573 102 HZ2 TRP 13 HZ2 TRP 13 1.454 12.932 -7.951 103 HZ3 TRP 13 HZ3 TRP 13 -1.604 10.995 -5.642 104 HH2 TRP 13 HH2 TRP 13 -0.568 11.483 -7.843 105 H TYR 14 HN TYR 14 -0.531 16.097 -0.308 106 HA TYR 14 HA TYR 14 0.381 15.284 2.354 107 HB2 TYR 14 HB2 TYR 14 -0.811 17.601 1.282 108 HB3 TYR 14 HB1 TYR 14 -2.046 16.883 2.305 109 HD1 TYR 14 HD1 TYR 14 1.703 17.193 2.499 110 HD2 TYR 14 HD2 TYR 14 -2.084 17.862 4.418 111 HE1 TYR 14 HE1 TYR 14 2.869 18.095 4.490 112 HE2 TYR 14 HE2 TYR 14 -0.914 18.764 6.404 113 HH TYR 14 HH TYR 14 1.662 19.947 6.645 114 H VAL 15 HN VAL 15 -0.427 13.603 3.339 115 HA VAL 15 HA VAL 15 -2.928 12.358 2.400 116 HB VAL 15 HB VAL 15 -0.797 11.388 4.317 117 HG11 VAL 15 HG11 VAL 15 -3.400 10.166 3.384 118 HG12 VAL 15 HG12 VAL 15 -2.086 9.197 4.050 119 HG13 VAL 15 HG13 VAL 15 -2.861 10.432 5.043 120 HG21 VAL 15 HG21 VAL 15 -0.602 9.630 2.425 121 HG22 VAL 15 HG22 VAL 15 -1.481 10.800 1.440 122 HG23 VAL 15 HG23 VAL 15 0.082 11.229 2.132 123 H VAL 16 HN VAL 16 -4.809 12.607 3.545 124 HA VAL 16 HA VAL 16 -4.596 13.391 6.386 125 HB VAL 16 HB VAL 16 -6.313 15.094 6.072 126 HG11 VAL 16 HG11 VAL 16 -4.231 15.852 4.051 127 HG12 VAL 16 HG12 VAL 16 -4.767 16.724 5.486 128 HG13 VAL 16 HG13 VAL 16 -3.655 15.367 5.641 129 HG21 VAL 16 HG21 VAL 16 -7.489 14.345 4.142 130 HG22 VAL 16 HG22 VAL 16 -6.690 15.835 3.639 131 HG23 VAL 16 HG23 VAL 16 -6.015 14.273 3.176 132 H ALA 17 HN ALA 17 -5.783 11.067 4.493 133 HA ALA 17 HA ALA 17 -7.628 10.192 6.412 134 HB1 ALA 17 HB1 ALA 17 -9.746 10.509 4.956 135 HB2 ALA 17 HB2 ALA 17 -8.824 11.780 4.155 136 HB3 ALA 17 HB3 ALA 17 -9.160 11.894 5.866 137 H LEU 18 HN LEU 18 -8.085 8.022 6.064 138 HA LEU 18 HA LEU 18 -8.005 7.014 3.318 139 HB2 LEU 18 HB2 LEU 18 -5.752 6.670 3.645 140 HB3 LEU 18 HB1 LEU 18 -5.903 6.628 5.394 141 HG LEU 18 HG LEU 18 -7.093 4.352 3.836 142 HD11 LEU 18 HD11 LEU 18 -4.914 4.591 2.782 143 HD12 LEU 18 HD12 LEU 18 -4.134 4.715 4.359 144 HD13 LEU 18 HD13 LEU 18 -4.888 3.200 3.865 145 HD21 LEU 18 HD21 LEU 18 -5.408 4.135 6.314 146 HD22 LEU 18 HD22 LEU 18 -7.031 4.800 6.458 147 HD23 LEU 18 HD23 LEU 18 -6.800 3.172 5.824 148 H ALA 19 HN ALA 19 -9.031 5.051 3.055 149 HA ALA 19 HA ALA 19 -10.494 4.017 5.412 150 HB1 ALA 19 HB1 ALA 19 -11.391 4.094 2.520 151 HB2 ALA 19 HB2 ALA 19 -12.027 5.088 3.826 152 HB3 ALA 19 HB3 ALA 19 -12.283 3.347 3.843 153 H SER 20 HN SER 20 -11.108 1.718 5.212 154 HA SER 20 HA SER 20 -9.692 0.026 3.383 155 HB2 SER 20 HB2 SER 20 -8.222 -1.050 5.032 156 HB3 SER 20 HB1 SER 20 -7.811 0.650 4.825 157 HG SER 20 HG SER 20 -8.474 -0.610 7.046 158 H ASN 21 HN ASN 21 -9.718 -2.312 4.338 159 HA ASN 21 HA ASN 21 -12.400 -2.755 5.521 160 HB2 ASN 21 HB2 ASN 21 -12.016 -3.534 3.120 161 HB3 ASN 21 HB1 ASN 21 -10.866 -4.695 3.780 162 HD21 ASN 21 HD21 ASN 21 -11.769 -6.684 4.318 163 HD22 ASN 21 HD22 ASN 21 -13.406 -6.941 4.689 164 H THR 22 HN THR 22 -9.062 -3.018 5.873 165 HA THR 22 HA THR 22 -9.153 -5.278 7.724 166 HB THR 22 HB THR 22 -7.252 -4.939 6.093 167 HG1 THR 22 HG1 THR 22 -6.340 -4.825 8.749 168 HG21 THR 22 HG21 THR 22 -6.139 -2.924 8.006 169 HG22 THR 22 HG22 THR 22 -5.743 -3.188 6.309 170 HG23 THR 22 HG23 THR 22 -7.240 -2.364 6.746 171 H GLU 23 HN GLU 23 -10.035 -4.790 9.609 172 HA GLU 23 HA GLU 23 -10.468 -2.425 10.826 173 HB2 GLU 23 HB2 GLU 23 -9.696 -5.020 12.163 174 HB3 GLU 23 HB1 GLU 23 -10.389 -3.637 13.011 175 HG2 GLU 23 HG2 GLU 23 -12.366 -3.729 11.521 176 HG3 GLU 23 HG1 GLU 23 -11.682 -5.142 10.719 177 H PHE 24 HN PHE 24 -7.379 -4.051 10.668 178 HA PHE 24 HA PHE 24 -6.039 -2.756 12.742 179 HB2 PHE 24 HB2 PHE 24 -4.675 -3.326 10.128 180 HB3 PHE 24 HB1 PHE 24 -4.053 -3.502 11.768 181 HD1 PHE 24 HD1 PHE 24 -6.230 -4.982 13.119 182 HD2 PHE 24 HD2 PHE 24 -4.579 -5.475 9.183 183 HE1 PHE 24 HE1 PHE 24 -6.932 -7.356 13.122 184 HE2 PHE 24 HE2 PHE 24 -5.283 -7.852 9.188 185 HZ PHE 24 HZ PHE 24 -6.459 -8.793 11.157 186 H PHE 25 HN PHE 25 -6.283 -1.677 9.300 187 HA PHE 25 HA PHE 25 -4.745 0.651 9.727 188 HB2 PHE 25 HB2 PHE 25 -5.642 -0.721 7.548 189 HB3 PHE 25 HB1 PHE 25 -6.693 0.685 7.498 190 HD1 PHE 25 HD1 PHE 25 -4.781 2.730 8.700 191 HD2 PHE 25 HD2 PHE 25 -4.212 -0.301 5.711 192 HE1 PHE 25 HE1 PHE 25 -2.939 4.054 7.710 193 HE2 PHE 25 HE2 PHE 25 -2.371 1.027 4.722 194 HZ PHE 25 HZ PHE 25 -1.733 3.203 5.719 195 H LEU 26 HN LEU 26 -8.314 0.271 9.462 196 HA LEU 26 HA LEU 26 -8.768 3.080 9.772 197 HB2 LEU 26 HB2 LEU 26 -11.148 2.367 10.312 198 HB3 LEU 26 HB1 LEU 26 -10.529 1.918 8.729 199 HG LEU 26 HG LEU 26 -9.840 -0.222 10.496 200 HD11 LEU 26 HD11 LEU 26 -12.709 0.713 10.787 201 HD12 LEU 26 HD12 LEU 26 -12.151 -0.899 11.228 202 HD13 LEU 26 HD13 LEU 26 -11.522 0.512 12.077 203 HD21 LEU 26 HD21 LEU 26 -11.896 0.115 8.293 204 HD22 LEU 26 HD22 LEU 26 -10.296 -0.615 8.174 205 HD23 LEU 26 HD23 LEU 26 -11.577 -1.437 9.063 206 H ARG 27 HN ARG 27 -8.659 0.365 11.957 207 HA ARG 27 HA ARG 27 -9.595 1.629 14.292 208 HB2 ARG 27 HB2 ARG 27 -9.240 -0.784 14.228 209 HB3 ARG 27 HB1 ARG 27 -7.502 -0.544 14.026 210 HG2 ARG 27 HG2 ARG 27 -7.302 0.432 16.214 211 HG3 ARG 27 HG1 ARG 27 -9.054 0.512 16.401 212 HD2 ARG 27 HD2 ARG 27 -8.242 -1.398 17.651 213 HD3 ARG 27 HD1 ARG 27 -9.130 -1.986 16.248 214 HE ARG 27 HE ARG 27 -7.150 -2.895 15.455 215 HH11 ARG 27 HH21 ARG 27 -6.528 -0.501 17.873 216 HH12 ARG 27 HH22 ARG 27 -4.827 -0.819 17.948 217 HH21 ARG 27 HH11 ARG 27 -4.919 -3.319 15.547 218 HH22 ARG 27 HH12 ARG 27 -3.917 -2.415 16.633 219 H GLU 28 HN GLU 28 -6.271 1.309 13.043 220 HA GLU 28 HA GLU 28 -5.200 2.991 15.125 221 HB2 GLU 28 HB2 GLU 28 -4.034 1.049 13.894 222 HB3 GLU 28 HB1 GLU 28 -3.746 2.220 12.607 223 HG2 GLU 28 HG2 GLU 28 -2.725 3.744 14.349 224 HG3 GLU 28 HG1 GLU 28 -2.834 2.405 15.489 225 H LYS 29 HN LYS 29 -5.858 3.483 11.600 226 HA LYS 29 HA LYS 29 -4.596 5.898 11.266 227 HB2 LYS 29 HB2 LYS 29 -5.901 4.618 9.521 228 HB3 LYS 29 HB1 LYS 29 -7.369 5.300 10.217 229 HG2 LYS 29 HG2 LYS 29 -6.916 6.850 8.535 230 HG3 LYS 29 HG1 LYS 29 -6.094 7.600 9.898 231 HD2 LYS 29 HD2 LYS 29 -3.961 6.603 9.178 232 HD3 LYS 29 HD1 LYS 29 -4.778 5.807 7.834 233 HE2 LYS 29 HE2 LYS 29 -5.543 8.160 7.128 234 HE3 LYS 29 HE1 LYS 29 -4.336 8.764 8.263 235 HZ1 LYS 29 HZ1 LYS 29 -3.470 6.696 6.405 236 HZ2 LYS 29 HZ2 LYS 29 -3.780 8.228 5.740 237 HZ3 LYS 29 HZ3 LYS 29 -2.636 8.059 6.980 238 H ASP 30 HN ASP 30 -7.465 5.173 13.077 239 HA ASP 30 HA ASP 30 -8.473 7.797 13.341 240 HB2 ASP 30 HB2 ASP 30 -9.734 5.704 13.838 241 HB3 ASP 30 HB1 ASP 30 -8.760 5.514 15.297 242 H LYS 31 HN LYS 31 -5.819 6.162 15.002 243 HA LYS 31 HA LYS 31 -5.840 8.237 17.060 244 HB2 LYS 31 HB2 LYS 31 -4.380 6.925 18.358 245 HB3 LYS 31 HB1 LYS 31 -5.572 5.824 17.683 246 HG2 LYS 31 HG2 LYS 31 -3.591 4.661 17.319 247 HG3 LYS 31 HG1 LYS 31 -3.824 5.472 15.789 248 HD2 LYS 31 HD2 LYS 31 -2.350 7.289 17.436 249 HD3 LYS 31 HD1 LYS 31 -1.611 5.710 17.641 250 HE2 LYS 31 HE2 LYS 31 -2.266 6.548 14.845 251 HE3 LYS 31 HE1 LYS 31 -0.905 7.333 15.632 252 HZ1 LYS 31 HZ1 LYS 31 0.214 5.541 14.954 253 HZ2 LYS 31 HZ2 LYS 31 -0.513 4.756 16.274 254 HZ3 LYS 31 HZ3 LYS 31 -1.188 4.610 14.725 255 H MET 32 HN MET 32 -4.038 7.615 14.109 256 HA MET 32 HA MET 32 -1.781 9.210 15.048 257 HB2 MET 32 HB2 MET 32 -1.068 9.165 12.617 258 HB3 MET 32 HB1 MET 32 -1.168 7.593 13.374 259 HG2 MET 32 HG2 MET 32 -3.666 7.689 12.412 260 HG3 MET 32 HG1 MET 32 -2.913 8.802 11.278 261 HE1 MET 32 HE1 MET 32 -3.034 5.586 12.963 262 HE2 MET 32 HE2 MET 32 -2.345 4.376 11.899 263 HE3 MET 32 HE3 MET 32 -1.297 5.332 12.952 264 H LYS 33 HN LYS 33 -1.094 10.910 13.247 265 HA LYS 33 HA LYS 33 -3.333 12.834 13.076 266 HB2 LYS 33 HB2 LYS 33 -0.430 13.614 12.924 267 HB3 LYS 33 HB1 LYS 33 -1.820 14.585 13.399 268 HG2 LYS 33 HG2 LYS 33 -2.053 12.912 15.371 269 HG3 LYS 33 HG1 LYS 33 -0.395 12.451 14.979 270 HD2 LYS 33 HD2 LYS 33 0.137 14.972 15.074 271 HD3 LYS 33 HD1 LYS 33 -1.427 15.144 15.872 272 HE2 LYS 33 HE2 LYS 33 -0.741 13.584 17.626 273 HE3 LYS 33 HE1 LYS 33 0.796 13.310 16.807 274 HZ1 LYS 33 HZ1 LYS 33 -0.165 15.756 18.153 275 HZ2 LYS 33 HZ2 LYS 33 1.281 14.900 18.409 276 HZ3 LYS 33 HZ3 LYS 33 1.081 15.822 16.999 277 H MET 34 HN MET 34 -2.603 14.514 11.200 278 HA MET 34 HA MET 34 -3.054 13.141 8.809 279 HB2 MET 34 HB2 MET 34 -3.129 15.219 7.898 280 HB3 MET 34 HB1 MET 34 -3.214 15.676 9.581 281 HG2 MET 34 HG2 MET 34 -0.637 15.811 9.496 282 HG3 MET 34 HG1 MET 34 -0.836 15.819 7.741 283 HE1 MET 34 HE1 MET 34 -3.972 17.263 8.048 284 HE2 MET 34 HE2 MET 34 -3.376 18.716 7.252 285 HE3 MET 34 HE3 MET 34 -2.821 17.131 6.721 286 H ALA 35 HN ALA 35 -1.699 12.533 7.078 287 HA ALA 35 HA ALA 35 1.185 12.338 7.744 288 HB1 ALA 35 HB1 ALA 35 0.408 10.138 7.702 289 HB2 ALA 35 HB2 ALA 35 1.001 10.354 6.057 290 HB3 ALA 35 HB3 ALA 35 -0.726 10.454 6.395 291 H MET 36 HN MET 36 2.637 12.210 5.836 292 HA MET 36 HA MET 36 1.623 13.757 3.529 293 HB2 MET 36 HB2 MET 36 4.390 14.411 3.967 294 HB3 MET 36 HB1 MET 36 2.998 15.489 3.969 295 HG2 MET 36 HG2 MET 36 3.810 13.826 6.364 296 HG3 MET 36 HG1 MET 36 4.343 15.486 6.103 297 HE1 MET 36 HE1 MET 36 1.579 15.285 8.939 298 HE2 MET 36 HE2 MET 36 2.933 14.256 8.480 299 HE3 MET 36 HE3 MET 36 3.143 16.007 8.589 300 H ALA 37 HN ALA 37 3.054 13.651 1.668 301 HA ALA 37 HA ALA 37 4.900 11.424 1.469 302 HB1 ALA 37 HB1 ALA 37 3.022 10.072 1.098 303 HB2 ALA 37 HB2 ALA 37 3.497 10.537 -0.538 304 HB3 ALA 37 HB3 ALA 37 2.151 11.353 0.256 305 H ARG 38 HN ARG 38 5.926 11.332 -0.661 306 HA ARG 38 HA ARG 38 5.471 13.719 -2.352 307 HB2 ARG 38 HB2 ARG 38 7.941 14.110 -2.522 308 HB3 ARG 38 HB1 ARG 38 7.257 14.495 -0.945 309 HG2 ARG 38 HG2 ARG 38 8.180 12.584 0.061 310 HG3 ARG 38 HG1 ARG 38 8.439 11.777 -1.489 311 HD2 ARG 38 HD2 ARG 38 10.152 13.471 -2.062 312 HD3 ARG 38 HD1 ARG 38 9.908 14.235 -0.493 313 HE ARG 38 HE ARG 38 10.508 11.505 -0.094 314 HH11 ARG 38 HH21 ARG 38 11.924 14.460 -1.204 315 HH12 ARG 38 HH22 ARG 38 13.532 14.032 -0.722 316 HH21 ARG 38 HH11 ARG 38 12.614 10.936 0.540 317 HH22 ARG 38 HH12 ARG 38 13.922 12.037 0.265 318 H ILE 39 HN ILE 39 5.709 13.350 -4.535 319 HA ILE 39 HA ILE 39 6.549 10.671 -5.353 320 HB ILE 39 HB ILE 39 4.162 11.320 -5.382 321 HG12 ILE 39 HG12 ILE 39 4.975 10.930 -8.240 322 HG13 ILE 39 HG11 ILE 39 5.366 9.671 -7.074 323 HG21 ILE 39 HG21 ILE 39 3.464 12.810 -7.117 324 HG22 ILE 39 HG22 ILE 39 4.543 13.602 -5.974 325 HG23 ILE 39 HG23 ILE 39 5.114 13.121 -7.564 326 HD11 ILE 39 HD11 ILE 39 2.987 9.701 -8.285 327 HD12 ILE 39 HD12 ILE 39 3.142 9.204 -6.608 328 HD13 ILE 39 HD13 ILE 39 2.597 10.834 -7.002 329 H SER 40 HN SER 40 7.877 10.558 -7.203 330 HA SER 40 HA SER 40 8.405 13.002 -8.690 331 HB2 SER 40 HB2 SER 40 10.680 11.577 -7.354 332 HB3 SER 40 HB1 SER 40 10.751 13.055 -8.296 333 HG SER 40 HG SER 40 9.111 12.842 -6.016 334 H PHE 41 HN PHE 41 9.711 12.590 -10.630 335 HA PHE 41 HA PHE 41 9.125 9.892 -11.621 336 HB2 PHE 41 HB2 PHE 41 9.745 12.476 -13.037 337 HB3 PHE 41 HB1 PHE 41 9.504 10.935 -13.861 338 HD1 PHE 41 HD2 PHE 41 7.871 13.196 -11.356 339 HD2 PHE 41 HD1 PHE 41 7.332 10.264 -14.451 340 HE1 PHE 41 HE2 PHE 41 5.415 13.516 -11.231 341 HE2 PHE 41 HE1 PHE 41 4.876 10.584 -14.324 342 HZ PHE 41 HZ PHE 41 3.918 12.209 -12.715 343 H LEU 42 HN LEU 42 10.882 8.769 -10.738 344 HA LEU 42 HA LEU 42 13.616 9.393 -11.088 345 HB2 LEU 42 HB2 LEU 42 12.181 6.726 -10.970 346 HB3 LEU 42 HB1 LEU 42 13.931 6.864 -11.043 347 HG LEU 42 HG LEU 42 12.396 8.373 -8.935 348 HD11 LEU 42 HD11 LEU 42 12.992 5.421 -9.032 349 HD12 LEU 42 HD12 LEU 42 13.010 6.264 -7.484 350 HD13 LEU 42 HD13 LEU 42 11.541 6.243 -8.461 351 HD21 LEU 42 HD21 LEU 42 14.770 8.885 -9.165 352 HD22 LEU 42 HD22 LEU 42 14.538 7.962 -7.683 353 HD23 LEU 42 HD23 LEU 42 15.181 7.171 -9.121 354 H GLY 43 HN GLY 43 11.215 7.852 -13.049 355 HA2 GLY 43 HA2 GLY 43 12.410 8.550 -15.543 356 HA3 GLY 43 HA1 GLY 43 12.575 6.824 -15.203 357 H GLU 44 HN GLU 44 10.980 7.807 -17.351 358 HA GLU 44 HA GLU 44 8.285 8.201 -16.832 359 HB2 GLU 44 HB2 GLU 44 9.414 8.219 -19.098 360 HB3 GLU 44 HB1 GLU 44 9.329 6.458 -19.075 361 HG2 GLU 44 HG2 GLU 44 7.388 7.232 -20.261 362 HG3 GLU 44 HG1 GLU 44 6.837 6.683 -18.679 363 H ASP 45 HN ASP 45 10.157 5.239 -16.685 364 HA ASP 45 HA ASP 45 7.719 3.745 -15.921 365 HB2 ASP 45 HB2 ASP 45 9.439 1.761 -16.241 366 HB3 ASP 45 HB1 ASP 45 8.637 2.488 -17.630 367 H GLU 46 HN GLU 46 9.714 5.575 -14.380 368 HA GLU 46 HA GLU 46 9.861 3.809 -12.034 369 HB2 GLU 46 HB2 GLU 46 12.189 5.501 -12.967 370 HB3 GLU 46 HB1 GLU 46 12.147 4.450 -11.552 371 HG2 GLU 46 HG2 GLU 46 11.731 2.506 -13.066 372 HG3 GLU 46 HG1 GLU 46 11.922 3.584 -14.448 373 H LEU 47 HN LEU 47 8.802 4.807 -10.468 374 HA LEU 47 HA LEU 47 9.091 7.741 -10.162 375 HB2 LEU 47 HB2 LEU 47 6.575 6.253 -9.420 376 HB3 LEU 47 HB1 LEU 47 6.806 7.986 -9.616 377 HG LEU 47 HG LEU 47 7.042 5.998 -11.892 378 HD11 LEU 47 HD11 LEU 47 4.718 7.779 -11.114 379 HD12 LEU 47 HD12 LEU 47 4.794 6.721 -12.522 380 HD13 LEU 47 HD13 LEU 47 4.769 6.029 -10.900 381 HD21 LEU 47 HD21 LEU 47 6.984 9.015 -11.670 382 HD22 LEU 47 HD22 LEU 47 8.170 8.000 -12.488 383 HD23 LEU 47 HD23 LEU 47 6.561 8.197 -13.173 384 H LYS 48 HN LYS 48 9.362 8.463 -8.076 385 HA LYS 48 HA LYS 48 9.719 6.369 -6.021 386 HB2 LYS 48 HB2 LYS 48 11.631 7.969 -6.769 387 HB3 LYS 48 HB1 LYS 48 10.771 9.184 -5.830 388 HG2 LYS 48 HG2 LYS 48 10.995 7.913 -3.810 389 HG3 LYS 48 HG1 LYS 48 11.560 6.492 -4.688 390 HD2 LYS 48 HD2 LYS 48 13.477 7.604 -3.681 391 HD3 LYS 48 HD1 LYS 48 13.558 7.792 -5.431 392 HE2 LYS 48 HE2 LYS 48 12.888 10.052 -5.343 393 HE3 LYS 48 HE1 LYS 48 12.236 9.890 -3.713 394 HZ1 LYS 48 HZ1 LYS 48 14.282 10.020 -2.774 395 HZ2 LYS 48 HZ2 LYS 48 15.079 9.341 -4.112 396 HZ3 LYS 48 HZ3 LYS 48 14.578 10.960 -4.158 397 H VAL 49 HN VAL 49 8.140 6.234 -4.522 398 HA VAL 49 HA VAL 49 6.743 8.730 -3.781 399 HB VAL 49 HB VAL 49 5.617 6.095 -4.554 400 HG11 VAL 49 HG11 VAL 49 5.024 5.981 -2.200 401 HG12 VAL 49 HG12 VAL 49 4.507 7.668 -2.212 402 HG13 VAL 49 HG13 VAL 49 3.598 6.461 -3.121 403 HG21 VAL 49 HG21 VAL 49 3.649 7.673 -4.972 404 HG22 VAL 49 HG22 VAL 49 4.735 8.985 -4.520 405 HG23 VAL 49 HG23 VAL 49 5.109 7.961 -5.903 406 H SER 50 HN SER 50 6.495 9.194 -1.772 407 HA SER 50 HA SER 50 7.790 7.441 0.246 408 HB2 SER 50 HB2 SER 50 8.987 9.513 -0.545 409 HB3 SER 50 HB1 SER 50 7.678 10.430 0.170 410 HG SER 50 HG SER 50 8.174 9.404 2.170 411 H TYR 51 HN TYR 51 6.973 7.452 2.347 412 HA TYR 51 HA TYR 51 4.351 8.782 2.733 413 HB2 TYR 51 HB2 TYR 51 5.057 6.171 4.064 414 HB3 TYR 51 HB1 TYR 51 3.472 6.900 3.831 415 HD1 TYR 51 HD1 TYR 51 3.262 7.542 1.076 416 HD2 TYR 51 HD2 TYR 51 5.233 4.185 2.874 417 HE1 TYR 51 HE1 TYR 51 2.916 6.225 -0.985 418 HE2 TYR 51 HE2 TYR 51 4.906 2.878 0.794 419 HH TYR 51 HH TYR 51 4.087 4.233 -2.117 420 H ALA 52 HN ALA 52 4.134 9.923 4.566 421 HA ALA 52 HA ALA 52 6.145 9.580 6.717 422 HB1 ALA 52 HB1 ALA 52 5.186 12.042 5.327 423 HB2 ALA 52 HB2 ALA 52 6.771 11.686 6.013 424 HB3 ALA 52 HB3 ALA 52 5.440 12.150 7.070 425 H VAL 53 HN VAL 53 5.031 8.560 8.330 426 HA VAL 53 HA VAL 53 2.265 9.445 8.851 427 HB VAL 53 HB VAL 53 3.447 6.811 9.697 428 HG11 VAL 53 HG11 VAL 53 1.264 7.769 10.649 429 HG12 VAL 53 HG12 VAL 53 0.589 7.544 9.036 430 HG13 VAL 53 HG13 VAL 53 1.173 6.153 9.949 431 HG21 VAL 53 HG21 VAL 53 2.021 7.474 7.100 432 HG22 VAL 53 HG22 VAL 53 3.708 6.986 7.255 433 HG23 VAL 53 HG23 VAL 53 2.422 5.849 7.656 434 HA PRO 54 HA PRO 54 4.201 10.675 12.752 435 HB2 PRO 54 HB2 PRO 54 2.135 12.119 13.752 436 HB3 PRO 54 HB1 PRO 54 3.168 12.735 12.446 437 HG2 PRO 54 HG2 PRO 54 0.438 11.556 12.306 438 HG3 PRO 54 HG1 PRO 54 1.136 12.904 11.393 439 HD2 PRO 54 HD2 PRO 54 0.872 10.318 10.415 440 HD3 PRO 54 HD1 PRO 54 2.027 11.518 9.790 441 H LYS 55 HN LYS 55 4.273 9.537 14.633 442 HA LYS 55 HA LYS 55 1.828 8.329 15.708 443 HB2 LYS 55 HB2 LYS 55 2.938 6.659 14.176 444 HB3 LYS 55 HB1 LYS 55 4.324 6.690 15.267 445 HG2 LYS 55 HG2 LYS 55 2.949 5.937 17.123 446 HG3 LYS 55 HG1 LYS 55 1.492 6.045 16.134 447 HD2 LYS 55 HD2 LYS 55 2.406 4.320 14.612 448 HD3 LYS 55 HD1 LYS 55 3.841 4.195 15.631 449 HE2 LYS 55 HE2 LYS 55 2.579 3.347 17.473 450 HE3 LYS 55 HE1 LYS 55 1.048 3.772 16.708 451 HZ1 LYS 55 HZ1 LYS 55 1.734 1.367 16.579 452 HZ2 LYS 55 HZ2 LYS 55 1.315 2.100 15.105 453 HZ3 LYS 55 HZ3 LYS 55 2.947 1.854 15.495 454 HA PRO 56 HA PRO 56 4.377 10.624 18.887 455 HB2 PRO 56 HB2 PRO 56 1.817 9.790 20.232 456 HB3 PRO 56 HB1 PRO 56 2.744 11.293 20.420 457 HG2 PRO 56 HG2 PRO 56 0.563 11.195 18.887 458 HG3 PRO 56 HG1 PRO 56 1.967 12.180 18.444 459 HD2 PRO 56 HD2 PRO 56 0.974 9.688 17.194 460 HD3 PRO 56 HD1 PRO 56 2.029 10.944 16.506 461 H ASN 57 HN ASN 57 2.946 7.447 18.760 462 HA ASN 57 HA ASN 57 4.394 6.529 21.143 463 HB2 ASN 57 HB2 ASN 57 2.502 5.060 19.291 464 HB3 ASN 57 HB1 ASN 57 3.180 4.422 20.790 465 HD21 ASN 57 HD21 ASN 57 0.295 5.237 19.920 466 HD22 ASN 57 HD22 ASN 57 -0.231 6.214 21.204 467 H GLY 58 HN GLY 58 5.516 7.271 18.336 468 HA2 GLY 58 HA2 GLY 58 7.833 6.162 18.065 469 HA3 GLY 58 HA1 GLY 58 6.876 4.725 17.708 470 H CYS 59 HN CYS 59 7.328 8.107 16.698 471 HA CYS 59 HA CYS 59 5.915 8.119 14.326 472 HB2 CYS 59 HB2 CYS 59 7.070 10.087 15.329 473 HB3 CYS 59 HB1 CYS 59 8.608 9.428 14.774 474 H ARG 60 HN ARG 60 6.278 7.481 12.235 475 HA ARG 60 HA ARG 60 8.751 5.959 11.665 476 HB2 ARG 60 HB2 ARG 60 5.892 5.116 11.188 477 HB3 ARG 60 HB1 ARG 60 7.241 4.412 10.296 478 HG2 ARG 60 HG2 ARG 60 8.311 3.826 12.488 479 HG3 ARG 60 HG1 ARG 60 6.856 4.397 13.303 480 HD2 ARG 60 HD2 ARG 60 5.506 2.746 12.087 481 HD3 ARG 60 HD1 ARG 60 6.938 2.193 11.225 482 HE ARG 60 HE ARG 60 7.622 1.063 13.155 483 HH11 ARG 60 HH21 ARG 60 4.944 3.167 13.767 484 HH12 ARG 60 HH22 ARG 60 4.633 2.538 15.350 485 HH21 ARG 60 HH11 ARG 60 7.220 0.232 15.231 486 HH22 ARG 60 HH12 ARG 60 5.922 0.877 16.178 487 H LYS 61 HN LYS 61 9.752 6.735 9.955 488 HA LYS 61 HA LYS 61 8.181 7.884 7.729 489 HB2 LYS 61 HB2 LYS 61 10.121 9.569 7.518 490 HB3 LYS 61 HB1 LYS 61 8.942 9.843 8.801 491 HG2 LYS 61 HG2 LYS 61 10.404 8.925 10.465 492 HG3 LYS 61 HG1 LYS 61 11.513 8.311 9.241 493 HD2 LYS 61 HD2 LYS 61 12.446 10.349 10.190 494 HD3 LYS 61 HD1 LYS 61 11.958 10.666 8.525 495 HE2 LYS 61 HE2 LYS 61 10.035 11.868 9.192 496 HE3 LYS 61 HE1 LYS 61 10.082 11.210 10.828 497 HZ1 LYS 61 HZ1 LYS 61 12.325 12.377 10.986 498 HZ2 LYS 61 HZ2 LYS 61 11.838 13.250 9.614 499 HZ3 LYS 61 HZ3 LYS 61 10.931 13.346 11.043 500 H TRP 62 HN TRP 62 8.821 7.178 5.755 501 HA TRP 62 HA TRP 62 11.534 6.333 5.271 502 HB2 TRP 62 HB2 TRP 62 11.350 4.078 5.362 503 HB3 TRP 62 HB1 TRP 62 9.963 4.401 6.393 504 HD1 TRP 62 HD1 TRP 62 7.694 5.083 4.521 505 HE1 TRP 62 HE1 TRP 62 6.816 3.416 2.757 506 HE3 TRP 62 HE3 TRP 62 11.770 2.042 4.063 507 HZ2 TRP 62 HZ2 TRP 62 7.723 1.105 1.338 508 HZ3 TRP 62 HZ3 TRP 62 11.737 0.119 2.502 509 HH2 TRP 62 HH2 TRP 62 9.720 -0.353 1.139 510 H GLU 63 HN GLU 63 11.592 5.183 3.029 511 HA GLU 63 HA GLU 63 9.844 6.725 1.190 512 HB2 GLU 63 HB2 GLU 63 12.213 7.516 1.273 513 HB3 GLU 63 HB1 GLU 63 12.723 5.922 0.718 514 HG2 GLU 63 HG2 GLU 63 11.642 6.183 -1.378 515 HG3 GLU 63 HG1 GLU 63 10.686 7.551 -0.807 516 H THR 64 HN THR 64 9.638 5.760 -0.984 517 HA THR 64 HA THR 64 10.062 2.876 -1.178 518 HB THR 64 HB THR 64 7.287 4.030 -1.468 519 HG1 THR 64 HG1 THR 64 7.337 4.000 0.624 520 HG21 THR 64 HG21 THR 64 7.618 2.024 -2.768 521 HG22 THR 64 HG22 THR 64 8.426 1.224 -1.419 522 HG23 THR 64 HG23 THR 64 6.701 1.580 -1.329 523 H THR 65 HN THR 65 10.147 2.146 -3.286 524 HA THR 65 HA THR 65 10.071 4.239 -5.367 525 HB THR 65 HB THR 65 11.369 1.512 -5.482 526 HG1 THR 65 HG1 THR 65 12.555 4.046 -5.040 527 HG21 THR 65 HG21 THR 65 11.652 3.998 -7.194 528 HG22 THR 65 HG22 THR 65 12.574 2.508 -7.394 529 HG23 THR 65 HG23 THR 65 10.832 2.510 -7.668 530 H PHE 66 HN PHE 66 8.540 4.203 -6.914 531 HA PHE 66 HA PHE 66 6.959 1.722 -7.287 532 HB2 PHE 66 HB2 PHE 66 6.186 4.627 -7.159 533 HB3 PHE 66 HB1 PHE 66 5.218 3.517 -8.124 534 HD1 PHE 66 HD1 PHE 66 6.699 3.913 -4.709 535 HD2 PHE 66 HD2 PHE 66 3.563 2.213 -7.101 536 HE1 PHE 66 HE1 PHE 66 5.550 3.129 -2.658 537 HE2 PHE 66 HE2 PHE 66 2.419 1.434 -5.048 538 HZ PHE 66 HZ PHE 66 3.414 1.891 -2.827 539 H LYS 67 HN LYS 67 6.789 0.959 -9.342 540 HA LYS 67 HA LYS 67 7.948 2.610 -11.522 541 HB2 LYS 67 HB2 LYS 67 7.917 -0.396 -11.164 542 HB3 LYS 67 HB1 LYS 67 8.452 0.428 -12.629 543 HG2 LYS 67 HG2 LYS 67 10.012 1.756 -10.956 544 HG3 LYS 67 HG1 LYS 67 9.740 0.359 -9.914 545 HD2 LYS 67 HD2 LYS 67 10.426 -1.106 -11.853 546 HD3 LYS 67 HD1 LYS 67 10.899 0.361 -12.709 547 HE2 LYS 67 HE2 LYS 67 12.045 -0.714 -10.121 548 HE3 LYS 67 HE1 LYS 67 12.887 -0.469 -11.652 549 HZ1 LYS 67 HZ1 LYS 67 12.268 1.954 -11.381 550 HZ2 LYS 67 HZ2 LYS 67 11.871 1.578 -9.772 551 HZ3 LYS 67 HZ3 LYS 67 13.459 1.355 -10.327 552 H LYS 68 HN LYS 68 6.878 2.707 -13.477 553 HA LYS 68 HA LYS 68 4.044 2.361 -13.376 554 HB2 LYS 68 HB2 LYS 68 5.394 4.103 -14.714 555 HB3 LYS 68 HB1 LYS 68 5.615 2.820 -15.903 556 HG2 LYS 68 HG2 LYS 68 3.142 2.526 -16.002 557 HG3 LYS 68 HG1 LYS 68 2.964 3.892 -14.900 558 HD2 LYS 68 HD2 LYS 68 4.183 5.328 -16.533 559 HD3 LYS 68 HD1 LYS 68 4.241 3.963 -17.650 560 HE2 LYS 68 HE2 LYS 68 2.348 5.337 -18.265 561 HE3 LYS 68 HE1 LYS 68 1.725 3.858 -17.532 562 HZ1 LYS 68 HZ1 LYS 68 0.585 5.245 -16.230 563 HZ2 LYS 68 HZ2 LYS 68 2.051 5.476 -15.403 564 HZ3 LYS 68 HZ3 LYS 68 1.571 6.579 -16.598 565 H THR 69 HN THR 69 2.811 0.714 -13.986 566 HA THR 69 HA THR 69 3.985 -1.433 -15.655 567 HB THR 69 HB THR 69 3.933 -2.235 -13.360 568 HG1 THR 69 HG1 THR 69 2.885 -4.047 -13.831 569 HG21 THR 69 HG21 THR 69 2.271 -0.644 -12.486 570 HG22 THR 69 HG22 THR 69 1.008 -1.443 -13.421 571 HG23 THR 69 HG23 THR 69 1.806 -2.301 -12.105 572 H SER 70 HN SER 70 2.144 -2.907 -16.471 573 HA SER 70 HA SER 70 0.057 -1.158 -17.583 574 HB2 SER 70 HB2 SER 70 1.546 -2.578 -19.076 575 HB3 SER 70 HB1 SER 70 0.715 -3.984 -18.416 576 HG SER 70 HG SER 70 -0.154 -2.057 -20.190 577 H ASP 71 HN ASP 71 0.402 -2.984 -14.968 578 HA ASP 71 HA ASP 71 -1.230 -4.899 -14.427 579 HB2 ASP 71 HB2 ASP 71 -0.280 -3.267 -12.743 580 HB3 ASP 71 HB1 ASP 71 -1.749 -2.318 -12.964 581 H ASP 72 HN ASP 72 -2.652 -1.685 -15.200 582 HA ASP 72 HA ASP 72 -4.846 -2.812 -16.561 583 HB2 ASP 72 HB2 ASP 72 -5.645 -3.538 -14.414 584 HB3 ASP 72 HB1 ASP 72 -5.358 -1.950 -13.711 585 H GLY 73 HN GLY 73 -4.137 -1.205 -17.981 586 HA2 GLY 73 HA2 GLY 73 -4.566 0.817 -19.039 587 HA3 GLY 73 HA1 GLY 73 -5.437 1.346 -17.604 588 H GLU 74 HN GLU 74 -4.449 2.676 -16.179 589 HA GLU 74 HA GLU 74 -1.558 3.234 -16.558 590 HB2 GLU 74 HB2 GLU 74 -3.793 5.181 -15.941 591 HB3 GLU 74 HB1 GLU 74 -2.076 5.582 -15.916 592 HG2 GLU 74 HG2 GLU 74 -2.849 6.235 -18.076 593 HG3 GLU 74 HG1 GLU 74 -1.983 4.720 -18.321 594 H VAL 75 HN VAL 75 -0.936 1.863 -14.824 595 HA VAL 75 HA VAL 75 -1.649 2.916 -12.164 596 HB VAL 75 HB VAL 75 -1.473 -0.019 -12.850 597 HG11 VAL 75 HG11 VAL 75 -2.590 -0.022 -10.457 598 HG12 VAL 75 HG12 VAL 75 -0.843 0.141 -10.610 599 HG13 VAL 75 HG13 VAL 75 -1.834 1.565 -10.313 600 HG21 VAL 75 HG21 VAL 75 -3.997 0.232 -12.099 601 HG22 VAL 75 HG22 VAL 75 -3.772 1.908 -12.598 602 HG23 VAL 75 HG23 VAL 75 -3.534 0.604 -13.758 603 H TYR 76 HN TYR 76 -0.095 2.658 -10.548 604 HA TYR 76 HA TYR 76 2.623 1.997 -11.532 605 HB2 TYR 76 HB2 TYR 76 1.925 3.876 -9.271 606 HB3 TYR 76 HB1 TYR 76 3.484 3.687 -10.083 607 HD1 TYR 76 HD1 TYR 76 3.814 4.490 -12.391 608 HD2 TYR 76 HD2 TYR 76 0.100 5.094 -10.323 609 HE1 TYR 76 HE1 TYR 76 3.126 6.142 -14.109 610 HE2 TYR 76 HE2 TYR 76 -0.586 6.749 -12.038 611 HH TYR 76 HH TYR 76 1.133 8.340 -13.848 612 H TYR 77 HN TYR 77 4.039 0.948 -9.987 613 HA TYR 77 HA TYR 77 2.870 -0.097 -7.545 614 HB2 TYR 77 HB2 TYR 77 2.568 -2.308 -8.107 615 HB3 TYR 77 HB1 TYR 77 2.181 -1.556 -9.652 616 HD1 TYR 77 HD2 TYR 77 4.202 -1.180 -11.289 617 HD2 TYR 77 HD1 TYR 77 4.220 -3.972 -8.026 618 HE1 TYR 77 HE2 TYR 77 6.048 -2.433 -12.372 619 HE2 TYR 77 HE1 TYR 77 6.066 -5.225 -9.107 620 HH TYR 77 HH TYR 77 7.618 -4.028 -12.055 621 H SER 78 HN SER 78 4.335 -0.814 -6.043 622 HA SER 78 HA SER 78 7.184 -0.552 -6.777 623 HB2 SER 78 HB2 SER 78 6.448 0.884 -4.935 624 HB3 SER 78 HB1 SER 78 5.799 -0.511 -4.081 625 HG SER 78 HG SER 78 7.937 -1.352 -4.042 626 H GLU 79 HN GLU 79 7.816 -2.506 -7.485 627 HA GLU 79 HA GLU 79 6.826 -5.003 -6.795 628 HB2 GLU 79 HB2 GLU 79 8.398 -4.444 -8.688 629 HB3 GLU 79 HB1 GLU 79 9.708 -4.462 -7.507 630 HG2 GLU 79 HG2 GLU 79 9.110 -6.782 -6.889 631 HG3 GLU 79 HG1 GLU 79 7.826 -6.766 -8.097 632 H GLU 80 HN GLU 80 9.399 -3.152 -5.211 633 HA GLU 80 HA GLU 80 10.189 -5.272 -3.470 634 HB2 GLU 80 HB2 GLU 80 11.491 -3.562 -2.315 635 HB3 GLU 80 HB1 GLU 80 11.675 -3.395 -4.060 636 HG2 GLU 80 HG2 GLU 80 9.859 -1.658 -4.019 637 HG3 GLU 80 HG1 GLU 80 9.878 -1.749 -2.259 638 H ALA 81 HN ALA 81 7.793 -2.699 -3.217 639 HA ALA 81 HA ALA 81 7.273 -3.457 -0.409 640 HB1 ALA 81 HB1 ALA 81 6.043 -1.114 -1.842 641 HB2 ALA 81 HB2 ALA 81 7.662 -1.025 -1.148 642 HB3 ALA 81 HB3 ALA 81 6.277 -1.354 -0.110 643 H LYS 82 HN LYS 82 6.256 -4.601 -3.233 644 HA LYS 82 HA LYS 82 4.205 -5.302 -4.126 645 HB2 LYS 82 HB2 LYS 82 4.090 -6.227 -1.244 646 HB3 LYS 82 HB1 LYS 82 3.082 -6.862 -2.545 647 HG2 LYS 82 HG2 LYS 82 5.259 -7.373 -3.788 648 HG3 LYS 82 HG1 LYS 82 6.086 -7.053 -2.265 649 HD2 LYS 82 HD2 LYS 82 3.891 -9.108 -2.671 650 HD3 LYS 82 HD1 LYS 82 5.611 -9.467 -2.540 651 HE2 LYS 82 HE2 LYS 82 3.765 -8.377 -0.413 652 HE3 LYS 82 HE1 LYS 82 4.758 -9.833 -0.357 653 HZ1 LYS 82 HZ1 LYS 82 5.494 -7.066 0.112 654 HZ2 LYS 82 HZ2 LYS 82 6.145 -8.493 0.766 655 HZ3 LYS 82 HZ3 LYS 82 6.615 -7.980 -0.780 656 H LYS 83 HN LYS 83 3.768 -2.825 -3.998 657 HA LYS 83 HA LYS 83 1.081 -2.502 -2.834 658 HB2 LYS 83 HB2 LYS 83 2.566 -1.463 -1.212 659 HB3 LYS 83 HB1 LYS 83 3.365 -0.544 -2.488 660 HG2 LYS 83 HG2 LYS 83 1.383 0.731 -2.931 661 HG3 LYS 83 HG1 LYS 83 0.401 -0.326 -1.914 662 HD2 LYS 83 HD2 LYS 83 1.356 0.491 0.077 663 HD3 LYS 83 HD1 LYS 83 2.762 1.150 -0.751 664 HE2 LYS 83 HE2 LYS 83 1.507 2.950 -1.673 665 HE3 LYS 83 HE1 LYS 83 -0.029 2.188 -1.268 666 HZ1 LYS 83 HZ1 LYS 83 1.445 3.966 0.275 667 HZ2 LYS 83 HZ2 LYS 83 0.019 3.151 0.709 668 HZ3 LYS 83 HZ3 LYS 83 1.529 2.462 1.061 669 H LYS 84 HN LYS 84 -0.290 -1.710 -4.278 670 HA LYS 84 HA LYS 84 0.774 -0.254 -6.637 671 HB2 LYS 84 HB2 LYS 84 -0.012 -2.635 -7.027 672 HB3 LYS 84 HB1 LYS 84 -1.627 -2.083 -6.592 673 HG2 LYS 84 HG2 LYS 84 -1.451 -0.347 -8.400 674 HG3 LYS 84 HG1 LYS 84 0.076 -1.080 -8.877 675 HD2 LYS 84 HD2 LYS 84 -1.528 -2.087 -10.307 676 HD3 LYS 84 HD1 LYS 84 -1.208 -3.293 -9.063 677 HE2 LYS 84 HE2 LYS 84 -3.264 -2.920 -7.990 678 HE3 LYS 84 HE1 LYS 84 -3.468 -1.326 -8.714 679 HZ1 LYS 84 HZ1 LYS 84 -3.672 -3.955 -10.071 680 HZ2 LYS 84 HZ2 LYS 84 -4.917 -2.827 -9.816 681 HZ3 LYS 84 HZ3 LYS 84 -3.656 -2.468 -10.893 682 H VAL 85 HN VAL 85 -0.140 1.612 -7.197 683 HA VAL 85 HA VAL 85 -2.761 2.278 -6.035 684 HB VAL 85 HB VAL 85 -2.083 4.252 -5.089 685 HG11 VAL 85 HG11 VAL 85 -0.972 2.238 -4.053 686 HG12 VAL 85 HG12 VAL 85 0.501 2.720 -4.893 687 HG13 VAL 85 HG13 VAL 85 -0.213 3.785 -3.684 688 HG21 VAL 85 HG21 VAL 85 0.334 5.209 -5.618 689 HG22 VAL 85 HG22 VAL 85 0.154 4.297 -7.111 690 HG23 VAL 85 HG23 VAL 85 -1.002 5.569 -6.709 691 H GLU 86 HN GLU 86 -4.137 2.961 -7.465 692 HA GLU 86 HA GLU 86 -3.154 3.970 -10.080 693 HB2 GLU 86 HB2 GLU 86 -5.176 2.909 -11.053 694 HB3 GLU 86 HB1 GLU 86 -4.096 1.737 -10.305 695 HG2 GLU 86 HG2 GLU 86 -5.503 1.940 -8.205 696 HG3 GLU 86 HG1 GLU 86 -6.660 2.859 -9.166 697 H VAL 87 HN VAL 87 -3.993 5.797 -10.854 698 HA VAL 87 HA VAL 87 -5.408 7.577 -9.228 699 HB VAL 87 HB VAL 87 -4.213 8.553 -10.988 700 HG11 VAL 87 HG11 VAL 87 -5.560 6.476 -12.719 701 HG12 VAL 87 HG12 VAL 87 -4.729 7.870 -13.410 702 HG13 VAL 87 HG13 VAL 87 -3.836 6.707 -12.428 703 HG21 VAL 87 HG21 VAL 87 -6.905 8.619 -12.333 704 HG22 VAL 87 HG22 VAL 87 -6.753 9.282 -10.707 705 HG23 VAL 87 HG23 VAL 87 -5.778 9.939 -12.020 706 H LEU 88 HN LEU 88 -7.250 6.770 -8.349 707 HA LEU 88 HA LEU 88 -9.379 5.703 -10.046 708 HB2 LEU 88 HB2 LEU 88 -8.615 5.047 -7.529 709 HB3 LEU 88 HB1 LEU 88 -9.827 6.261 -7.142 710 HG LEU 88 HG LEU 88 -10.882 4.072 -7.194 711 HD11 LEU 88 HD11 LEU 88 -12.698 4.571 -8.629 712 HD12 LEU 88 HD12 LEU 88 -12.021 6.139 -8.194 713 HD13 LEU 88 HD13 LEU 88 -11.669 5.431 -9.771 714 HD21 LEU 88 HD21 LEU 88 -9.042 3.340 -9.047 715 HD22 LEU 88 HD22 LEU 88 -10.560 2.478 -8.814 716 HD23 LEU 88 HD23 LEU 88 -10.411 3.659 -10.113 717 H ASP 89 HN ASP 89 -8.270 8.572 -8.681 718 HA ASP 89 HA ASP 89 -10.005 10.299 -9.977 719 HB2 ASP 89 HB2 ASP 89 -11.372 9.206 -7.850 720 HB3 ASP 89 HB1 ASP 89 -10.639 10.616 -7.095 721 H THR 90 HN THR 90 -8.623 11.990 -10.219 722 HA THR 90 HA THR 90 -7.055 12.867 -7.914 723 HB THR 90 HB THR 90 -5.917 11.046 -9.471 724 HG1 THR 90 HG1 THR 90 -5.069 12.799 -7.769 725 HG21 THR 90 HG21 THR 90 -5.135 13.631 -10.844 726 HG22 THR 90 HG22 THR 90 -4.574 12.008 -11.236 727 HG23 THR 90 HG23 THR 90 -6.255 12.449 -11.522 728 H ASP 91 HN ASP 91 -7.201 14.953 -7.742 729 HA ASP 91 HA ASP 91 -8.130 16.592 -9.963 730 HB2 ASP 91 HB2 ASP 91 -8.946 16.888 -7.603 731 HB3 ASP 91 HB1 ASP 91 -7.324 17.433 -7.180 732 H TYR 92 HN TYR 92 -5.228 15.879 -8.208 733 HA TYR 92 HA TYR 92 -3.031 16.433 -8.536 734 HB2 TYR 92 HB2 TYR 92 -4.285 16.679 -11.188 735 HB3 TYR 92 HB1 TYR 92 -2.860 17.691 -11.013 736 HD1 TYR 92 HD2 TYR 92 -3.520 14.383 -9.380 737 HD2 TYR 92 HD1 TYR 92 -1.274 16.554 -12.333 738 HE1 TYR 92 HE2 TYR 92 -2.072 12.407 -9.735 739 HE2 TYR 92 HE1 TYR 92 0.167 14.571 -12.691 740 HH TYR 92 HH TYR 92 -0.615 11.534 -11.714 741 H LYS 93 HN LYS 93 -5.223 18.573 -7.657 742 HA LYS 93 HA LYS 93 -3.267 20.696 -7.437 743 HB2 LYS 93 HB2 LYS 93 -5.838 20.991 -8.998 744 HB3 LYS 93 HB1 LYS 93 -4.949 22.366 -8.342 745 HG2 LYS 93 HG2 LYS 93 -2.900 21.414 -9.586 746 HG3 LYS 93 HG1 LYS 93 -4.049 20.392 -10.447 747 HD2 LYS 93 HD2 LYS 93 -4.182 23.419 -10.312 748 HD3 LYS 93 HD1 LYS 93 -3.564 22.495 -11.681 749 HE2 LYS 93 HE2 LYS 93 -5.799 22.918 -12.288 750 HE3 LYS 93 HE1 LYS 93 -5.870 21.288 -11.621 751 HZ1 LYS 93 HZ1 LYS 93 -7.250 23.547 -10.765 752 HZ2 LYS 93 HZ2 LYS 93 -7.260 21.996 -10.071 753 HZ3 LYS 93 HZ3 LYS 93 -6.143 23.155 -9.537 754 H SER 94 HN SER 94 -6.490 19.404 -6.803 755 HA SER 94 HA SER 94 -6.666 21.090 -4.368 756 HB2 SER 94 HB2 SER 94 -9.027 20.958 -4.524 757 HB3 SER 94 HB1 SER 94 -8.465 21.291 -6.159 758 HG SER 94 HG SER 94 -9.901 19.608 -6.285 759 H TYR 95 HN TYR 95 -7.859 17.898 -5.488 760 HA TYR 95 HA TYR 95 -6.701 16.588 -3.168 761 HB2 TYR 95 HB2 TYR 95 -8.993 15.652 -2.523 762 HB3 TYR 95 HB1 TYR 95 -8.671 17.326 -2.069 763 HD1 TYR 95 HD2 TYR 95 -10.464 15.127 -4.443 764 HD2 TYR 95 HD1 TYR 95 -9.825 19.168 -3.133 765 HE1 TYR 95 HE2 TYR 95 -12.426 15.868 -5.766 766 HE2 TYR 95 HE1 TYR 95 -11.788 19.908 -4.456 767 HH TYR 95 HH TYR 95 -13.049 18.444 -6.846 768 H ALA 96 HN ALA 96 -7.041 14.205 -3.256 769 HA ALA 96 HA ALA 96 -7.991 13.202 -5.846 770 HB1 ALA 96 HB1 ALA 96 -5.175 12.763 -4.831 771 HB2 ALA 96 HB2 ALA 96 -5.637 13.679 -6.262 772 HB3 ALA 96 HB3 ALA 96 -5.893 11.935 -6.207 773 H VAL 97 HN VAL 97 -8.666 11.139 -5.861 774 HA VAL 97 HA VAL 97 -8.486 9.600 -3.322 775 HB VAL 97 HB VAL 97 -10.745 9.255 -5.289 776 HG11 VAL 97 HG11 VAL 97 -10.408 8.788 -2.312 777 HG12 VAL 97 HG12 VAL 97 -11.894 8.498 -3.210 778 HG13 VAL 97 HG13 VAL 97 -10.453 7.551 -3.568 779 HG21 VAL 97 HG21 VAL 97 -10.565 11.275 -3.032 780 HG22 VAL 97 HG22 VAL 97 -10.786 11.630 -4.745 781 HG23 VAL 97 HG23 VAL 97 -12.066 10.823 -3.840 782 H ILE 98 HN ILE 98 -7.302 7.806 -3.572 783 HA ILE 98 HA ILE 98 -7.130 6.611 -6.274 784 HB ILE 98 HB ILE 98 -4.891 6.754 -4.265 785 HG12 ILE 98 HG12 ILE 98 -5.486 8.671 -6.547 786 HG13 ILE 98 HG11 ILE 98 -5.681 9.053 -4.839 787 HG21 ILE 98 HG21 ILE 98 -4.953 5.127 -6.295 788 HG22 ILE 98 HG22 ILE 98 -4.700 6.576 -7.267 789 HG23 ILE 98 HG23 ILE 98 -3.509 6.107 -6.057 790 HD11 ILE 98 HD11 ILE 98 -3.189 8.723 -6.430 791 HD12 ILE 98 HD12 ILE 98 -3.562 9.879 -5.153 792 HD13 ILE 98 HD13 ILE 98 -3.160 8.215 -4.739 793 H TYR 99 HN TYR 99 -6.857 4.410 -6.403 794 HA TYR 99 HA TYR 99 -7.798 2.900 -4.065 795 HB2 TYR 99 HB2 TYR 99 -8.993 2.533 -6.146 796 HB3 TYR 99 HB1 TYR 99 -7.489 2.164 -6.987 797 HD1 TYR 99 HD1 TYR 99 -9.974 0.954 -4.552 798 HD2 TYR 99 HD2 TYR 99 -6.329 0.047 -6.634 799 HE1 TYR 99 HE1 TYR 99 -10.196 -1.428 -3.902 800 HE2 TYR 99 HE2 TYR 99 -6.548 -2.335 -5.980 801 HH TYR 99 HH TYR 99 -9.091 -3.788 -5.172 802 H ALA 100 HN ALA 100 -6.189 2.380 -2.761 803 HA ALA 100 HA ALA 100 -3.625 1.413 -3.866 804 HB1 ALA 100 HB1 ALA 100 -3.333 3.168 -2.253 805 HB2 ALA 100 HB2 ALA 100 -2.832 1.660 -1.487 806 HB3 ALA 100 HB3 ALA 100 -4.403 2.365 -1.104 807 H THR 101 HN THR 101 -2.864 -0.608 -3.487 808 HA THR 101 HA THR 101 -4.366 -2.396 -1.704 809 HB THR 101 HB THR 101 -5.434 -2.741 -3.852 810 HG1 THR 101 HG1 THR 101 -5.196 -4.868 -3.828 811 HG21 THR 101 HG21 THR 101 -4.225 -3.244 -5.857 812 HG22 THR 101 HG22 THR 101 -3.464 -1.813 -5.164 813 HG23 THR 101 HG23 THR 101 -2.703 -3.393 -4.978 814 H ARG 102 HN ARG 102 -3.084 -3.675 -0.579 815 HA ARG 102 HA ARG 102 -0.286 -4.073 -1.469 816 HB2 ARG 102 HB2 ARG 102 -0.506 -2.656 0.576 817 HB3 ARG 102 HB1 ARG 102 -1.332 -3.997 1.371 818 HG2 ARG 102 HG2 ARG 102 0.655 -5.426 1.018 819 HG3 ARG 102 HG1 ARG 102 1.483 -4.075 0.243 820 HD2 ARG 102 HD2 ARG 102 1.225 -2.754 2.335 821 HD3 ARG 102 HD1 ARG 102 0.488 -4.156 3.104 822 HE ARG 102 HE ARG 102 2.608 -5.068 3.336 823 HH11 ARG 102 HH21 ARG 102 2.604 -2.524 0.990 824 HH12 ARG 102 HH22 ARG 102 4.325 -2.515 0.793 825 HH21 ARG 102 HH11 ARG 102 4.866 -5.061 3.084 826 HH22 ARG 102 HH12 ARG 102 5.605 -3.951 1.979 827 H VAL 103 HN VAL 103 0.237 -6.236 -1.877 828 HA VAL 103 HA VAL 103 -1.627 -8.234 -0.738 829 HB VAL 103 HB VAL 103 -1.784 -8.008 -3.181 830 HG11 VAL 103 HG11 VAL 103 1.051 -8.999 -3.415 831 HG12 VAL 103 HG12 VAL 103 0.048 -8.202 -4.626 832 HG13 VAL 103 HG13 VAL 103 0.726 -7.270 -3.292 833 HG21 VAL 103 HG21 VAL 103 -0.360 -10.549 -2.312 834 HG22 VAL 103 HG22 VAL 103 -2.088 -10.237 -2.151 835 HG23 VAL 103 HG23 VAL 103 -1.362 -10.370 -3.750 836 H LYS 104 HN LYS 104 -0.741 -9.419 0.814 837 HA LYS 104 HA LYS 104 2.168 -9.773 0.902 838 HB2 LYS 104 HB2 LYS 104 0.716 -9.004 2.909 839 HB3 LYS 104 HB1 LYS 104 0.183 -10.681 2.988 840 HG2 LYS 104 HG2 LYS 104 2.465 -11.453 3.290 841 HG3 LYS 104 HG1 LYS 104 3.091 -9.824 3.035 842 HD2 LYS 104 HD2 LYS 104 1.792 -9.069 5.039 843 HD3 LYS 104 HD1 LYS 104 1.336 -10.749 5.326 844 HE2 LYS 104 HE2 LYS 104 3.602 -11.399 5.712 845 HE3 LYS 104 HE1 LYS 104 4.220 -9.870 5.088 846 HZ1 LYS 104 HZ1 LYS 104 2.474 -9.187 7.096 847 HZ2 LYS 104 HZ2 LYS 104 3.338 -10.514 7.713 848 HZ3 LYS 104 HZ3 LYS 104 4.172 -9.141 7.167 849 H ASP 105 HN ASP 105 2.854 -12.033 1.642 850 HA ASP 105 HA ASP 105 2.135 -13.900 -0.310 851 HB2 ASP 105 HB2 ASP 105 3.402 -14.323 2.404 852 HB3 ASP 105 HB1 ASP 105 3.306 -15.556 1.148 853 H GLY 106 HN GLY 106 0.162 -14.685 -0.569 854 HA2 GLY 106 HA2 GLY 106 -1.572 -16.173 -0.113 855 HA3 GLY 106 HA1 GLY 106 -1.057 -16.229 1.565 856 H ARG 107 HN ARG 107 -1.234 -13.002 0.954 857 HA ARG 107 HA ARG 107 -4.145 -12.855 1.502 858 HB2 ARG 107 HB2 ARG 107 -2.725 -12.714 3.599 859 HB3 ARG 107 HB1 ARG 107 -2.100 -11.192 2.966 860 HG2 ARG 107 HG2 ARG 107 -4.393 -10.297 2.832 861 HG3 ARG 107 HG1 ARG 107 -5.025 -11.820 3.460 862 HD2 ARG 107 HD2 ARG 107 -3.608 -11.484 5.508 863 HD3 ARG 107 HD1 ARG 107 -3.178 -9.890 4.890 864 HE ARG 107 HE ARG 107 -5.699 -10.655 6.082 865 HH11 ARG 107 HH21 ARG 107 -4.047 -8.512 3.926 866 HH12 ARG 107 HH22 ARG 107 -5.207 -7.236 4.086 867 HH21 ARG 107 HH11 ARG 107 -7.223 -8.985 6.298 868 HH22 ARG 107 HH12 ARG 107 -7.005 -7.503 5.429 869 H THR 108 HN THR 108 -5.222 -11.117 0.731 870 HA THR 108 HA THR 108 -3.709 -9.141 -0.883 871 HB THR 108 HB THR 108 -6.474 -10.233 -1.458 872 HG1 THR 108 HG1 THR 108 -4.779 -11.746 -1.806 873 HG21 THR 108 HG21 THR 108 -6.151 -9.052 -3.614 874 HG22 THR 108 HG22 THR 108 -6.120 -7.940 -2.246 875 HG23 THR 108 HG23 THR 108 -4.613 -8.425 -3.023 876 H LEU 109 HN LEU 109 -4.498 -6.978 -0.827 877 HA LEU 109 HA LEU 109 -6.714 -6.418 1.025 878 HB2 LEU 109 HB2 LEU 109 -4.755 -6.418 2.425 879 HB3 LEU 109 HB1 LEU 109 -3.910 -5.351 1.336 880 HG LEU 109 HG LEU 109 -5.650 -3.603 1.791 881 HD11 LEU 109 HD11 LEU 109 -6.631 -5.765 3.661 882 HD12 LEU 109 HD12 LEU 109 -6.983 -4.063 3.954 883 HD13 LEU 109 HD13 LEU 109 -7.559 -4.841 2.482 884 HD21 LEU 109 HD21 LEU 109 -3.437 -3.964 3.095 885 HD22 LEU 109 HD22 LEU 109 -4.658 -2.917 3.816 886 HD23 LEU 109 HD23 LEU 109 -4.467 -4.573 4.389 887 H HIS 110 HN HIS 110 -7.656 -4.465 0.801 888 HA HIS 110 HA HIS 110 -6.646 -2.676 -1.281 889 HB2 HIS 110 HB2 HIS 110 -8.911 -2.398 -2.207 890 HB3 HIS 110 HB1 HIS 110 -8.396 -4.081 -2.318 891 HD1 HIS 110 HD1 HIS 110 -9.483 -5.780 -0.642 892 HD2 HIS 110 HD2 HIS 110 -11.083 -1.936 -0.453 893 HE1 HIS 110 HE1 HIS 110 -11.627 -5.962 0.693 894 H MET 111 HN MET 111 -7.137 -0.437 -0.930 895 HA MET 111 HA MET 111 -8.847 0.308 1.264 896 HB2 MET 111 HB2 MET 111 -6.848 1.600 2.334 897 HB3 MET 111 HB1 MET 111 -7.050 -0.112 2.698 898 HG2 MET 111 HG2 MET 111 -5.323 -0.747 1.208 899 HG3 MET 111 HG1 MET 111 -5.330 0.821 0.400 900 HE1 MET 111 HE1 MET 111 -4.581 2.891 1.207 901 HE2 MET 111 HE2 MET 111 -3.189 3.084 2.270 902 HE3 MET 111 HE3 MET 111 -3.049 2.131 0.787 903 H MET 112 HN MET 112 -9.227 2.583 1.354 904 HA MET 112 HA MET 112 -8.524 3.970 -1.166 905 HB2 MET 112 HB2 MET 112 -10.461 5.203 0.735 906 HB3 MET 112 HB1 MET 112 -10.482 5.173 -1.017 907 HG2 MET 112 HG2 MET 112 -11.004 2.676 0.598 908 HG3 MET 112 HG1 MET 112 -12.286 3.825 0.240 909 HE1 MET 112 HE1 MET 112 -13.020 3.836 -3.261 910 HE2 MET 112 HE2 MET 112 -12.751 4.792 -1.807 911 HE3 MET 112 HE3 MET 112 -11.517 4.735 -3.072 912 H ARG 113 HN ARG 113 -7.417 5.892 -1.148 913 HA ARG 113 HA ARG 113 -6.595 6.955 1.496 914 HB2 ARG 113 HB2 ARG 113 -4.708 5.763 0.637 915 HB3 ARG 113 HB1 ARG 113 -4.923 6.452 -0.968 916 HG2 ARG 113 HG2 ARG 113 -4.595 8.444 1.219 917 HG3 ARG 113 HG1 ARG 113 -3.180 7.443 0.912 918 HD2 ARG 113 HD2 ARG 113 -3.518 8.044 -1.581 919 HD3 ARG 113 HD1 ARG 113 -4.598 9.308 -0.994 920 HE ARG 113 HE ARG 113 -2.263 9.582 0.463 921 HH11 ARG 113 HH21 ARG 113 -3.224 9.584 -2.860 922 HH12 ARG 113 HH22 ARG 113 -1.965 10.660 -3.367 923 HH21 ARG 113 HH11 ARG 113 -0.609 10.992 -0.193 924 HH22 ARG 113 HH12 ARG 113 -0.483 11.456 -1.857 925 H LEU 114 HN LEU 114 -6.965 9.067 1.763 926 HA LEU 114 HA LEU 114 -7.591 10.699 -0.619 927 HB2 LEU 114 HB2 LEU 114 -9.540 10.420 0.758 928 HB3 LEU 114 HB1 LEU 114 -8.634 10.790 2.212 929 HG LEU 114 HG LEU 114 -8.291 13.097 1.461 930 HD11 LEU 114 HD11 LEU 114 -8.103 12.956 -0.888 931 HD12 LEU 114 HD12 LEU 114 -9.606 12.047 -1.045 932 HD13 LEU 114 HD13 LEU 114 -9.650 13.765 -0.652 933 HD21 LEU 114 HD21 LEU 114 -10.307 12.838 2.700 934 HD22 LEU 114 HD22 LEU 114 -10.768 13.769 1.276 935 HD23 LEU 114 HD23 LEU 114 -11.125 12.044 1.354 936 H TYR 115 HN TYR 115 -6.276 12.302 -1.038 937 HA TYR 115 HA TYR 115 -4.523 13.346 1.100 938 HB2 TYR 115 HB2 TYR 115 -2.722 12.927 -0.217 939 HB3 TYR 115 HB1 TYR 115 -3.804 12.016 -1.258 940 HD1 TYR 115 HD1 TYR 115 -5.369 13.714 -2.767 941 HD2 TYR 115 HD2 TYR 115 -1.392 14.490 -1.343 942 HE1 TYR 115 HE1 TYR 115 -5.030 15.350 -4.599 943 HE2 TYR 115 HE2 TYR 115 -1.061 16.132 -3.174 944 HH TYR 115 HH TYR 115 -3.621 16.746 -5.578 945 H SER 116 HN SER 116 -3.820 15.557 0.831 946 HA SER 116 HA SER 116 -5.726 17.258 -0.677 947 HB2 SER 116 HB2 SER 116 -6.247 17.444 1.693 948 HB3 SER 116 HB1 SER 116 -4.549 17.714 2.080 949 HG SER 116 HG SER 116 -6.181 19.357 0.429 950 H ARG 117 HN ARG 117 -4.824 19.153 -1.623 951 HA ARG 117 HA ARG 117 -1.996 18.947 -2.203 952 HB2 ARG 117 HB2 ARG 117 -3.626 19.573 -3.948 953 HB3 ARG 117 HB1 ARG 117 -4.045 21.015 -3.039 954 HG2 ARG 117 HG2 ARG 117 -2.452 21.609 -4.788 955 HG3 ARG 117 HG1 ARG 117 -1.676 21.784 -3.221 956 HD2 ARG 117 HD2 ARG 117 -0.388 19.829 -3.509 957 HD3 ARG 117 HD1 ARG 117 -1.445 19.210 -4.775 958 HE ARG 117 HE ARG 117 -0.156 20.391 -6.286 959 HH11 ARG 117 HH21 ARG 117 0.121 21.767 -3.124 960 HH12 ARG 117 HH22 ARG 117 1.298 22.949 -3.589 961 HH21 ARG 117 HH11 ARG 117 1.394 21.939 -6.903 962 HH22 ARG 117 HH12 ARG 117 2.018 23.046 -5.727 963 H SER 118 HN SER 118 -4.088 20.713 -0.116 964 HA SER 118 HA SER 118 -1.823 22.388 0.798 965 HB2 SER 118 HB2 SER 118 -3.573 23.715 -0.317 966 HB3 SER 118 HB1 SER 118 -4.772 23.069 0.799 967 HG SER 118 HG SER 118 -4.188 24.775 1.911 968 HA PRO 119 HA PRO 119 -1.915 20.490 4.795 969 HB2 PRO 119 HB2 PRO 119 -2.399 23.305 5.734 970 HB3 PRO 119 HB1 PRO 119 -1.274 22.088 6.370 971 HG2 PRO 119 HG2 PRO 119 -0.461 24.075 4.756 972 HG3 PRO 119 HG1 PRO 119 0.280 22.467 4.726 973 HD2 PRO 119 HD2 PRO 119 -1.425 23.757 2.694 974 HD3 PRO 119 HD1 PRO 119 -0.357 22.349 2.531 975 H GLU 120 HN GLU 120 -4.462 22.639 3.729 976 HA GLU 120 HA GLU 120 -6.315 21.718 5.795 977 HB2 GLU 120 HB2 GLU 120 -6.717 23.671 3.519 978 HB3 GLU 120 HB1 GLU 120 -7.853 23.358 4.830 979 HG2 GLU 120 HG2 GLU 120 -6.664 25.318 5.482 980 HG3 GLU 120 HG1 GLU 120 -5.968 24.007 6.431 981 H VAL 121 HN VAL 121 -8.506 21.086 5.056 982 HA VAL 121 HA VAL 121 -8.369 19.331 2.667 983 HB VAL 121 HB VAL 121 -10.094 18.886 5.108 984 HG11 VAL 121 HG11 VAL 121 -10.668 17.828 2.865 985 HG12 VAL 121 HG12 VAL 121 -9.144 16.950 2.982 986 HG13 VAL 121 HG13 VAL 121 -10.405 16.692 4.188 987 HG21 VAL 121 HG21 VAL 121 -7.291 17.945 4.463 988 HG22 VAL 121 HG22 VAL 121 -7.861 18.732 5.934 989 HG23 VAL 121 HG23 VAL 121 -8.338 17.071 5.581 990 H SER 122 HN SER 122 -9.777 19.767 1.096 991 HA SER 122 HA SER 122 -11.705 21.873 1.400 992 HB2 SER 122 HB2 SER 122 -10.367 21.345 -0.697 993 HB3 SER 122 HB1 SER 122 -11.457 19.983 -0.935 994 HG SER 122 HG SER 122 -13.036 21.323 -1.413 995 HA PRO 123 HA PRO 123 -14.959 19.225 3.103 996 HB2 PRO 123 HB2 PRO 123 -16.609 21.258 1.628 997 HB3 PRO 123 HB1 PRO 123 -16.830 20.606 3.264 998 HG2 PRO 123 HG2 PRO 123 -15.767 23.015 2.874 999 HG3 PRO 123 HG1 PRO 123 -15.190 21.947 4.167 1000 HD2 PRO 123 HD2 PRO 123 -13.850 22.688 1.615 1001 HD3 PRO 123 HD1 PRO 123 -13.135 22.156 3.154 1002 H ALA 124 HN ALA 124 -14.712 20.257 -0.246 1003 HA ALA 124 HA ALA 124 -16.644 18.410 -1.286 1004 HB1 ALA 124 HB1 ALA 124 -16.012 20.469 -2.491 1005 HB2 ALA 124 HB2 ALA 124 -15.732 19.033 -3.476 1006 HB3 ALA 124 HB3 ALA 124 -14.375 19.842 -2.692 1007 H ALA 125 HN ALA 125 -13.194 18.342 -0.659 1008 HA ALA 125 HA ALA 125 -12.558 16.024 -2.159 1009 HB1 ALA 125 HB1 ALA 125 -11.241 17.077 0.356 1010 HB2 ALA 125 HB2 ALA 125 -10.863 17.602 -1.285 1011 HB3 ALA 125 HB3 ALA 125 -10.533 15.941 -0.792 1012 H THR 126 HN THR 126 -13.669 16.517 1.148 1013 HA THR 126 HA THR 126 -13.447 13.742 1.872 1014 HB THR 126 HB THR 126 -15.259 15.618 3.345 1015 HG1 THR 126 HG1 THR 126 -13.526 16.920 2.968 1016 HG21 THR 126 HG21 THR 126 -13.195 13.558 4.190 1017 HG22 THR 126 HG22 THR 126 -14.227 14.473 5.289 1018 HG23 THR 126 HG23 THR 126 -14.941 13.316 4.165 1019 H ALA 127 HN ALA 127 -15.982 15.806 0.508 1020 HA ALA 127 HA ALA 127 -18.094 13.936 0.942 1021 HB1 ALA 127 HB1 ALA 127 -17.855 16.287 -0.927 1022 HB2 ALA 127 HB2 ALA 127 -18.493 16.325 0.717 1023 HB3 ALA 127 HB3 ALA 127 -19.348 15.431 -0.542 1024 H ILE 128 HN ILE 128 -16.170 14.851 -1.953 1025 HA ILE 128 HA ILE 128 -17.470 13.108 -3.742 1026 HB ILE 128 HB ILE 128 -15.673 14.998 -4.108 1027 HG12 ILE 128 HG12 ILE 128 -16.771 13.865 -5.940 1028 HG13 ILE 128 HG11 ILE 128 -15.047 13.966 -6.271 1029 HG21 ILE 128 HG21 ILE 128 -13.857 12.574 -4.062 1030 HG22 ILE 128 HG22 ILE 128 -13.408 14.246 -4.391 1031 HG23 ILE 128 HG23 ILE 128 -13.920 13.775 -2.773 1032 HD11 ILE 128 HD11 ILE 128 -16.675 11.564 -5.485 1033 HD12 ILE 128 HD12 ILE 128 -15.536 11.737 -6.818 1034 HD13 ILE 128 HD13 ILE 128 -14.941 11.596 -5.166 1035 H PHE 129 HN PHE 129 -14.851 12.812 -1.530 1036 HA PHE 129 HA PHE 129 -13.862 10.269 -1.971 1037 HB2 PHE 129 HB2 PHE 129 -12.946 11.777 -0.277 1038 HB3 PHE 129 HB1 PHE 129 -14.393 11.555 0.701 1039 HD1 PHE 129 HD1 PHE 129 -14.907 9.408 1.755 1040 HD2 PHE 129 HD2 PHE 129 -11.318 9.979 -0.523 1041 HE1 PHE 129 HE1 PHE 129 -13.989 7.301 2.679 1042 HE2 PHE 129 HE2 PHE 129 -10.385 7.878 0.415 1043 HZ PHE 129 HZ PHE 129 -11.728 6.543 2.020 1044 H ARG 130 HN ARG 130 -16.731 11.255 -0.140 1045 HA ARG 130 HA ARG 130 -17.440 8.638 0.745 1046 HB2 ARG 130 HB2 ARG 130 -18.259 10.499 1.992 1047 HB3 ARG 130 HB1 ARG 130 -18.983 11.226 0.560 1048 HG2 ARG 130 HG2 ARG 130 -20.675 9.559 0.433 1049 HG3 ARG 130 HG1 ARG 130 -19.827 8.503 1.563 1050 HD2 ARG 130 HD2 ARG 130 -21.038 11.199 2.234 1051 HD3 ARG 130 HD1 ARG 130 -21.718 9.634 2.667 1052 HE ARG 130 HE ARG 130 -19.191 9.570 3.722 1053 HH11 ARG 130 HH21 ARG 130 -21.893 11.727 3.886 1054 HH12 ARG 130 HH22 ARG 130 -21.537 12.272 5.491 1055 HH21 ARG 130 HH11 ARG 130 -18.718 10.281 5.828 1056 HH22 ARG 130 HH12 ARG 130 -19.740 11.453 6.590 1057 H LYS 131 HN LYS 131 -18.443 10.601 -2.056 1058 HA LYS 131 HA LYS 131 -20.617 9.167 -2.934 1059 HB2 LYS 131 HB2 LYS 131 -19.650 11.254 -3.965 1060 HB3 LYS 131 HB1 LYS 131 -18.462 10.225 -4.767 1061 HG2 LYS 131 HG2 LYS 131 -20.334 8.919 -5.777 1062 HG3 LYS 131 HG1 LYS 131 -21.475 10.055 -5.057 1063 HD2 LYS 131 HD2 LYS 131 -20.219 11.906 -6.265 1064 HD3 LYS 131 HD1 LYS 131 -19.362 10.639 -7.143 1065 HE2 LYS 131 HE2 LYS 131 -21.200 11.220 -8.538 1066 HE3 LYS 131 HE1 LYS 131 -21.679 9.715 -7.753 1067 HZ1 LYS 131 HZ1 LYS 131 -22.429 12.445 -6.856 1068 HZ2 LYS 131 HZ2 LYS 131 -23.447 11.361 -7.678 1069 HZ3 LYS 131 HZ3 LYS 131 -22.902 10.991 -6.115 1070 H LEU 132 HN LEU 132 -17.273 8.586 -4.087 1071 HA LEU 132 HA LEU 132 -17.918 6.189 -5.435 1072 HB2 LEU 132 HB2 LEU 132 -15.413 5.744 -5.253 1073 HB3 LEU 132 HB1 LEU 132 -15.895 7.227 -6.065 1074 HG LEU 132 HG LEU 132 -15.692 7.975 -3.354 1075 HD11 LEU 132 HD11 LEU 132 -13.192 6.442 -4.063 1076 HD12 LEU 132 HD12 LEU 132 -13.650 7.140 -2.509 1077 HD13 LEU 132 HD13 LEU 132 -14.489 5.713 -3.116 1078 HD21 LEU 132 HD21 LEU 132 -14.990 9.232 -5.436 1079 HD22 LEU 132 HD22 LEU 132 -13.845 9.333 -4.104 1080 HD23 LEU 132 HD23 LEU 132 -13.525 8.250 -5.456 1081 H ALA 133 HN ALA 133 -16.651 6.790 -2.175 1082 HA ALA 133 HA ALA 133 -16.232 4.152 -1.385 1083 HB1 ALA 133 HB1 ALA 133 -16.265 4.930 0.836 1084 HB2 ALA 133 HB2 ALA 133 -17.373 6.245 0.452 1085 HB3 ALA 133 HB3 ALA 133 -15.703 6.307 -0.107 1086 H GLY 134 HN GLY 134 -19.225 6.056 -1.508 1087 HA2 GLY 134 HA2 GLY 134 -20.873 4.199 -0.143 1088 HA3 GLY 134 HA1 GLY 134 -21.424 5.433 -1.277 1089 H GLU 135 HN GLU 135 -19.869 4.597 -3.493 1090 HA GLU 135 HA GLU 135 -21.574 2.660 -4.650 1091 HB2 GLU 135 HB2 GLU 135 -20.163 4.411 -5.861 1092 HB3 GLU 135 HB1 GLU 135 -18.787 3.335 -5.606 1093 HG2 GLU 135 HG2 GLU 135 -20.004 1.519 -6.766 1094 HG3 GLU 135 HG1 GLU 135 -21.358 2.614 -7.046 1095 H ARG 136 HN ARG 136 -18.887 2.427 -2.555 1096 HA ARG 136 HA ARG 136 -18.376 -0.386 -3.280 1097 HB2 ARG 136 HB2 ARG 136 -16.512 1.412 -2.928 1098 HB3 ARG 136 HB1 ARG 136 -16.837 1.171 -1.211 1099 HG2 ARG 136 HG2 ARG 136 -16.392 -1.230 -1.437 1100 HG3 ARG 136 HG1 ARG 136 -16.136 -1.037 -3.171 1101 HD2 ARG 136 HD2 ARG 136 -14.317 0.673 -2.528 1102 HD3 ARG 136 HD1 ARG 136 -14.438 0.004 -0.903 1103 HE ARG 136 HE ARG 136 -13.129 -1.210 -3.129 1104 HH11 ARG 136 HH21 ARG 136 -15.084 -1.854 -0.346 1105 HH12 ARG 136 HH22 ARG 136 -14.486 -3.465 -0.127 1106 HH21 ARG 136 HH11 ARG 136 -12.341 -3.321 -2.848 1107 HH22 ARG 136 HH12 ARG 136 -12.933 -4.296 -1.544 1108 H ASN 137 HN ASN 137 -20.581 1.117 -1.577 1109 HA ASN 137 HA ASN 137 -21.893 0.632 0.263 1110 HB2 ASN 137 HB2 ASN 137 -20.597 -2.048 -0.045 1111 HB3 ASN 137 HB1 ASN 137 -22.126 -1.728 0.765 1112 HD21 ASN 137 HD21 ASN 137 -23.247 0.112 -1.135 1113 HD22 ASN 137 HD22 ASN 137 -23.546 -0.730 -2.578 1114 H TYR 138 HN TYR 138 -19.329 1.727 0.852 1115 HA TYR 138 HA TYR 138 -18.251 0.270 3.127 1116 HB2 TYR 138 HB2 TYR 138 -16.485 1.762 3.061 1117 HB3 TYR 138 HB1 TYR 138 -17.027 1.866 1.387 1118 HD1 TYR 138 HD1 TYR 138 -19.463 3.467 1.555 1119 HD2 TYR 138 HD2 TYR 138 -15.755 3.913 3.672 1120 HE1 TYR 138 HE1 TYR 138 -19.937 5.880 1.873 1121 HE2 TYR 138 HE2 TYR 138 -16.231 6.317 3.982 1122 HH TYR 138 HH TYR 138 -17.966 8.079 2.408 1123 H THR 139 HN THR 139 -17.932 1.502 5.222 1124 HA THR 139 HA THR 139 -20.335 3.116 5.888 1125 HB THR 139 HB THR 139 -20.782 1.841 7.723 1126 HG1 THR 139 HG1 THR 139 -19.153 1.083 9.079 1127 HG21 THR 139 HG21 THR 139 -20.461 -0.448 7.361 1128 HG22 THR 139 HG22 THR 139 -20.256 0.209 5.738 1129 HG23 THR 139 HG23 THR 139 -18.846 -0.223 6.704 1130 H ASP 140 HN ASP 140 -20.022 4.765 7.507 1131 HA ASP 140 HA ASP 140 -17.871 6.389 7.186 1132 HB2 ASP 140 HB2 ASP 140 -18.416 7.408 9.369 1133 HB3 ASP 140 HB1 ASP 140 -19.860 7.083 8.411 1134 H GLU 141 HN GLU 141 -18.110 4.000 9.887 1135 HA GLU 141 HA GLU 141 -15.651 4.527 11.029 1136 HB2 GLU 141 HB2 GLU 141 -17.462 2.969 11.876 1137 HB3 GLU 141 HB1 GLU 141 -16.827 1.758 10.762 1138 HG2 GLU 141 HG2 GLU 141 -14.627 1.891 11.832 1139 HG3 GLU 141 HG1 GLU 141 -15.210 3.155 12.913 1140 H MET 142 HN MET 142 -16.307 3.080 7.977 1141 HA MET 142 HA MET 142 -13.835 1.620 7.771 1142 HB2 MET 142 HB2 MET 142 -15.624 2.505 5.511 1143 HB3 MET 142 HB1 MET 142 -14.485 1.165 5.524 1144 HG2 MET 142 HG2 MET 142 -15.983 0.439 7.647 1145 HG3 MET 142 HG1 MET 142 -17.192 1.351 6.759 1146 HE1 MET 142 HE1 MET 142 -14.229 -1.083 4.965 1147 HE2 MET 142 HE2 MET 142 -14.425 -0.942 6.709 1148 HE3 MET 142 HE3 MET 142 -14.967 -2.401 5.870 1149 H VAL 143 HN VAL 143 -14.709 4.875 7.462 1150 HA VAL 143 HA VAL 143 -12.121 5.469 6.133 1151 HB VAL 143 HB VAL 143 -14.040 6.044 4.653 1152 HG11 VAL 143 HG11 VAL 143 -15.467 7.965 5.259 1153 HG12 VAL 143 HG12 VAL 143 -15.685 6.636 6.395 1154 HG13 VAL 143 HG13 VAL 143 -14.716 8.038 6.841 1155 HG21 VAL 143 HG21 VAL 143 -12.173 8.150 5.738 1156 HG22 VAL 143 HG22 VAL 143 -12.127 7.321 4.190 1157 HG23 VAL 143 HG23 VAL 143 -13.332 8.570 4.483 1158 H ALA 144 HN ALA 144 -10.733 6.497 7.377 1159 HA ALA 144 HA ALA 144 -11.768 7.907 9.762 1160 HB1 ALA 144 HB1 ALA 144 -10.314 6.163 10.427 1161 HB2 ALA 144 HB2 ALA 144 -9.348 7.634 10.532 1162 HB3 ALA 144 HB3 ALA 144 -9.147 6.543 9.161 1163 H MET 145 HN MET 145 -11.942 10.037 9.433 1164 HA MET 145 HA MET 145 -10.228 11.457 7.625 1165 HB2 MET 145 HB2 MET 145 -12.349 12.359 7.528 1166 HB3 MET 145 HB1 MET 145 -12.719 11.902 9.180 1167 HG2 MET 145 HG2 MET 145 -12.356 14.020 9.838 1168 HG3 MET 145 HG1 MET 145 -10.695 13.908 9.300 1169 HE1 MET 145 HE1 MET 145 -10.153 13.697 6.936 1170 HE2 MET 145 HE2 MET 145 -11.467 13.577 5.770 1171 HE3 MET 145 HE3 MET 145 -10.483 15.043 5.853 1172 H LEU 146 HN LEU 146 -8.587 12.954 8.301 1173 HA LEU 146 HA LEU 146 -7.963 12.903 11.127 1174 HB2 LEU 146 HB2 LEU 146 -6.608 11.548 9.185 1175 HB3 LEU 146 HB1 LEU 146 -5.732 13.075 9.191 1176 HG LEU 146 HG LEU 146 -5.188 12.866 11.450 1177 HD11 LEU 146 HD11 LEU 146 -6.900 11.944 12.783 1178 HD12 LEU 146 HD12 LEU 146 -7.384 10.819 11.515 1179 HD13 LEU 146 HD13 LEU 146 -5.993 10.466 12.531 1180 HD21 LEU 146 HD21 LEU 146 -3.936 11.414 9.844 1181 HD22 LEU 146 HD22 LEU 146 -3.899 10.831 11.504 1182 HD23 LEU 146 HD23 LEU 146 -4.963 10.077 10.331 1183 HA PRO 147 HA PRO 147 -8.049 17.327 10.693 1184 HB2 PRO 147 HB2 PRO 147 -6.943 18.039 13.052 1185 HB3 PRO 147 HB1 PRO 147 -8.525 17.231 12.974 1186 HG2 PRO 147 HG2 PRO 147 -5.825 16.013 13.465 1187 HG3 PRO 147 HG1 PRO 147 -7.320 15.816 14.402 1188 HD2 PRO 147 HD2 PRO 147 -6.560 14.011 12.589 1189 HD3 PRO 147 HD1 PRO 147 -8.274 14.392 12.832 1190 H ARG 148 HN ARG 148 -6.653 19.256 10.798 1191 HA ARG 148 HA ARG 148 -4.377 19.108 9.239 1192 HB2 ARG 148 HB2 ARG 148 -5.426 21.228 11.089 1193 HB3 ARG 148 HB1 ARG 148 -3.964 21.469 10.137 1194 HG2 ARG 148 HG2 ARG 148 -5.859 22.364 8.900 1195 HG3 ARG 148 HG1 ARG 148 -5.262 20.928 8.072 1196 HD2 ARG 148 HD2 ARG 148 -7.816 21.145 8.397 1197 HD3 ARG 148 HD1 ARG 148 -7.071 19.604 8.805 1198 HE ARG 148 HE ARG 148 -7.748 19.962 10.985 1199 HH11 ARG 148 HH21 ARG 148 -7.520 22.967 9.284 1200 HH12 ARG 148 HH22 ARG 148 -8.119 23.917 10.602 1201 HH21 ARG 148 HH11 ARG 148 -8.536 21.201 12.717 1202 HH22 ARG 148 HH12 ARG 148 -8.695 22.917 12.547 1203 H GLN 149 HN GLN 149 -4.613 18.130 12.403 1204 HA GLN 149 HA GLN 149 -2.274 19.120 13.589 1205 HB2 GLN 149 HB2 GLN 149 -4.335 17.511 14.408 1206 HB3 GLN 149 HB1 GLN 149 -3.005 16.360 14.359 1207 HG2 GLN 149 HG2 GLN 149 -3.163 18.946 15.927 1208 HG3 GLN 149 HG1 GLN 149 -3.009 17.311 16.561 1209 HE21 GLN 149 HE21 GLN 149 -1.184 19.870 16.604 1210 HE22 GLN 149 HE22 GLN 149 0.338 19.249 16.181 1211 H GLU 150 HN GLU 150 -0.185 18.654 13.451 1212 HA GLU 150 HA GLU 150 0.695 16.217 12.016 1213 HB2 GLU 150 HB2 GLU 150 2.405 17.532 10.862 1214 HB3 GLU 150 HB1 GLU 150 0.794 18.135 10.470 1215 HG2 GLU 150 HG2 GLU 150 1.076 19.846 12.300 1216 HG3 GLU 150 HG1 GLU 150 2.751 19.317 12.457 1217 H GLU 151 HN GLU 151 2.568 15.285 12.767 1218 HA GLU 151 HA GLU 151 3.944 16.587 15.046 1219 HB2 GLU 151 HB2 GLU 151 2.350 14.702 15.737 1220 HB3 GLU 151 HB1 GLU 151 3.451 13.612 14.898 1221 HG2 GLU 151 HG2 GLU 151 5.322 14.622 16.296 1222 HG3 GLU 151 HG1 GLU 151 4.065 15.396 17.260 1223 H CYS 152 HN CYS 152 3.985 14.416 12.314 1224 HA CYS 152 HA CYS 152 6.942 14.614 12.198 1225 HB2 CYS 152 HB2 CYS 152 5.177 12.309 11.333 1226 HB3 CYS 152 HB1 CYS 152 6.906 12.425 11.017 1227 H THR 153 HN THR 153 7.795 15.124 10.189 1228 HA THR 153 HA THR 153 5.957 15.398 7.915 1229 HB THR 153 HB THR 153 6.337 17.695 7.586 1230 HG1 THR 153 HG1 THR 153 8.661 17.336 8.237 1231 HG21 THR 153 HG21 THR 153 5.651 18.743 9.677 1232 HG22 THR 153 HG22 THR 153 4.849 17.183 9.533 1233 HG23 THR 153 HG23 THR 153 6.238 17.360 10.599 1234 H VAL 154 HN VAL 154 7.037 15.647 5.877 1235 HA VAL 154 HA VAL 154 9.463 14.172 5.703 1236 HB VAL 154 HB VAL 154 9.159 14.327 3.357 1237 HG11 VAL 154 HG11 VAL 154 7.509 12.858 4.176 1238 HG12 VAL 154 HG12 VAL 154 6.545 14.170 4.848 1239 HG13 VAL 154 HG13 VAL 154 6.623 13.936 3.103 1240 HG21 VAL 154 HG21 VAL 154 8.895 16.639 2.948 1241 HG22 VAL 154 HG22 VAL 154 7.349 15.943 2.461 1242 HG23 VAL 154 HG23 VAL 154 7.501 16.753 4.022 1243 H ASP 155 HN ASP 155 11.327 14.957 4.535 1244 HA ASP 155 HA ASP 155 12.145 17.569 5.490 1245 HB2 ASP 155 HB2 ASP 155 13.789 15.833 5.623 1246 HB3 ASP 155 HB1 ASP 155 13.624 15.468 3.914 1247 H GLU 156 HN GLU 156 13.305 18.984 4.044 1248 HA GLU 156 HA GLU 156 11.658 20.001 2.023 1249 HB2 GLU 156 HB2 GLU 156 14.553 20.457 2.736 1250 HB3 GLU 156 HB1 GLU 156 13.752 21.336 1.440 1251 HG2 GLU 156 HG2 GLU 156 12.009 22.080 3.049 1252 HG3 GLU 156 HG1 GLU 156 12.887 21.264 4.339 1253 H VAL 157 HN VAL 157 14.370 17.766 1.918 1254 HA VAL 157 HA VAL 157 13.625 16.918 -0.744 1255 HB VAL 157 HB VAL 157 15.012 18.870 -1.279 1256 HG11 VAL 157 HG11 VAL 157 17.270 19.080 -0.519 1257 HG12 VAL 157 HG12 VAL 157 16.311 18.712 0.914 1258 HG13 VAL 157 HG13 VAL 157 17.270 17.447 0.146 1259 HG21 VAL 157 HG21 VAL 157 16.544 17.757 -2.771 1260 HG22 VAL 157 HG22 VAL 157 16.583 16.321 -1.747 1261 HG23 VAL 157 HG23 VAL 157 15.116 16.730 -2.636 1262 HN1 EB4 200 H17 EB4 200 0.069 -0.887 5.685 1263 H8 EB4 200 H8 EB4 200 5.076 0.853 1.300 1264 HN2 EB4 200 H25 EB4 200 3.185 -0.225 6.512 1265 H9 EB4 200 H9 EB4 200 0.992 6.041 3.220 1266 H10 EB4 200 H10 EB4 200 -2.535 -0.700 0.366 1267 HN3 EB4 200 H32 EB4 200 0.634 1.892 7.264 1268 H7 EB4 200 H7 EB4 200 -0.896 1.158 0.356 1269 H11 EB4 200 H11 EB4 200 6.829 -0.735 2.041 1270 H12 EB4 200 H12 EB4 200 -0.021 7.351 5.067 1271 H15 EB4 200 H15 EB4 200 -0.361 6.304 7.289 1272 H14 EB4 200 H14 EB4 200 6.807 -1.617 4.359 1273 H13 EB4 200 H13 EB4 200 -2.763 -2.142 2.372 1274 H22 EB4 200 H22 EB4 200 -1.389 -3.155 6.887 1275 H30 EB4 200 H30 EB4 200 -0.966 0.056 10.042 1276 H30A EB4 200 H9N EB4 200 -1.820 1.171 8.865 1277 H24 EB4 200 H24 EB4 200 -0.087 2.379 10.099 1278 H28 EB4 200 H28 EB4 200 0.669 -3.701 8.099 1279 H28A EB4 200 H9L EB4 200 0.831 -3.862 6.343 1280 H23 EB4 200 H23 EB4 200 4.602 -1.781 8.625 1281 H29 EB4 200 H29 EB4 200 3.406 -0.368 10.252 1282 H29A EB4 200 H9M EB4 200 4.445 0.638 9.129 1283 H21 ACD 300 HA3 ACD 300 0.212 9.021 -11.960 1284 H22 ACD 300 HA4 ACD 300 0.405 10.374 -10.824 1285 H31 ACD 300 HA1 ACD 300 0.329 7.416 -10.081 1286 H32 ACD 300 HA2 ACD 300 1.779 8.445 -10.121 1287 H41 ACD 300 HA0 ACD 300 -0.662 8.830 -8.326 1288 H42 ACD 300 HAZ ACD 300 0.731 9.934 -8.409 1289 H5 ACD 300 HAY ACD 300 2.138 7.605 -7.796 1290 H6 ACD 300 HAX ACD 300 1.125 7.115 -5.432 1291 H71 ACD 300 HAV ACD 300 -1.028 9.144 -6.423 1292 H72 ACD 300 HAW ACD 300 -1.546 7.541 -5.854 1293 H8 ACD 300 HAU ACD 300 -0.633 9.882 -4.110 1294 H9 ACD 300 HAT ACD 300 -0.866 8.211 -2.121 1295 H101 ACD 300 HAR ACD 300 -1.620 6.194 -4.331 1296 H102 ACD 300 HAS ACD 300 -0.092 5.866 -3.481 1297 H11 ACD 300 HAQ ACD 300 -2.909 5.497 -2.347 1298 H12 ACD 300 HAP ACD 300 -1.685 5.004 -0.077 1299 H131 ACD 300 HAN ACD 300 0.673 6.608 -1.379 1300 H132 ACD 300 HAO ACD 300 0.935 4.857 -0.910 1301 H14 ACD 300 HAM ACD 300 0.682 5.423 1.453 1302 H15 ACD 300 HAL ACD 300 0.857 7.937 2.113 1303 H161 ACD 300 HAJ ACD 300 -0.419 8.693 -0.460 1304 H162 ACD 300 HAK ACD 300 0.644 9.740 0.502 1305 H171 ACD 300 HAH ACD 300 2.629 8.765 -0.571 1306 H172 ACD 300 HAI ACD 300 1.611 7.650 -1.503 1307 H181 ACD 300 HAF ACD 300 0.411 9.710 -2.437 1308 H182 ACD 300 HAG ACD 300 1.714 10.681 -1.715 1309 H191 ACD 300 HAD ACD 300 3.399 9.523 -3.015 1310 H192 ACD 300 HAE ACD 300 2.207 8.350 -3.616 1311 H201 ACD 300 HAA ACD 300 2.680 10.067 -5.318 1312 H202 ACD 300 HAB ACD 300 2.207 11.352 -4.189 1313 H203 ACD 300 HAC ACD 300 0.994 10.193 -4.782 Start of MODEL 9 1 H1 MET 1 HT1 MET 1 -1.821 18.013 -26.262 2 H2 MET 1 HT2 MET 1 -1.933 16.772 -25.106 3 H3 MET 1 HT3 MET 1 -0.974 16.562 -26.493 4 HA MET 1 HA MET 1 0.458 17.011 -24.645 5 HB2 MET 1 HB2 MET 1 0.126 19.400 -26.487 6 HB3 MET 1 HB1 MET 1 1.553 19.069 -25.505 7 HG2 MET 1 HG2 MET 1 1.818 16.887 -26.675 8 HG3 MET 1 HG1 MET 1 0.441 17.293 -27.697 9 HE1 MET 1 HE1 MET 1 4.617 19.029 -27.534 10 HE2 MET 1 HE2 MET 1 3.468 19.934 -26.553 11 HE3 MET 1 HE3 MET 1 3.694 18.200 -26.285 12 H THR 2 HN THR 2 -2.517 18.171 -24.277 13 HA THR 2 HA THR 2 -1.992 20.486 -22.610 14 HB THR 2 HB THR 2 -4.383 20.552 -22.285 15 HG1 THR 2 HG1 THR 2 -4.206 17.985 -22.416 16 HG21 THR 2 HG21 THR 2 -3.483 21.273 -24.494 17 HG22 THR 2 HG22 THR 2 -3.783 19.650 -25.115 18 HG23 THR 2 HG23 THR 2 -5.134 20.662 -24.604 19 H VAL 3 HN VAL 3 -0.724 17.945 -21.871 20 HA VAL 3 HA VAL 3 -2.003 16.635 -19.765 21 HB VAL 3 HB VAL 3 0.327 16.070 -19.007 22 HG11 VAL 3 HG11 VAL 3 -0.368 15.830 -21.946 23 HG12 VAL 3 HG12 VAL 3 0.940 14.934 -21.174 24 HG13 VAL 3 HG13 VAL 3 -0.728 14.669 -20.668 25 HG21 VAL 3 HG21 VAL 3 1.031 17.941 -21.290 26 HG22 VAL 3 HG22 VAL 3 1.425 18.175 -19.587 27 HG23 VAL 3 HG23 VAL 3 2.175 16.860 -20.493 28 HA PRO 4 HA PRO 4 -2.010 19.695 -16.555 29 HB2 PRO 4 HB2 PRO 4 -2.042 18.113 -14.326 30 HB3 PRO 4 HB1 PRO 4 -3.445 18.293 -15.399 31 HG2 PRO 4 HG2 PRO 4 -1.428 16.093 -15.281 32 HG3 PRO 4 HG1 PRO 4 -3.188 15.998 -15.468 33 HD2 PRO 4 HD2 PRO 4 -1.478 15.761 -17.584 34 HD3 PRO 4 HD1 PRO 4 -3.109 16.450 -17.743 35 H ASP 5 HN ASP 5 -0.732 20.539 -14.743 36 HA ASP 5 HA ASP 5 2.097 20.152 -15.166 37 HB2 ASP 5 HB2 ASP 5 2.271 21.873 -13.316 38 HB3 ASP 5 HB1 ASP 5 1.382 22.390 -14.747 39 H ARG 6 HN ARG 6 2.614 18.079 -14.486 40 HA ARG 6 HA ARG 6 1.790 16.878 -12.079 41 HB2 ARG 6 HB2 ARG 6 3.718 15.365 -12.416 42 HB3 ARG 6 HB1 ARG 6 2.793 15.592 -13.901 43 HG2 ARG 6 HG2 ARG 6 4.452 17.484 -14.446 44 HG3 ARG 6 HG1 ARG 6 5.451 16.819 -13.154 45 HD2 ARG 6 HD2 ARG 6 6.122 15.875 -15.318 46 HD3 ARG 6 HD1 ARG 6 5.440 14.620 -14.286 47 HE ARG 6 HE ARG 6 3.285 15.456 -15.709 48 HH11 ARG 6 HH21 ARG 6 6.510 14.523 -16.547 49 HH12 ARG 6 HH22 ARG 6 6.071 13.889 -18.098 50 HH21 ARG 6 HH11 ARG 6 2.702 14.628 -17.741 51 HH22 ARG 6 HH12 ARG 6 3.915 13.948 -18.774 52 H SER 7 HN SER 7 4.419 19.079 -12.819 53 HA SER 7 HA SER 7 5.978 18.796 -10.522 54 HB2 SER 7 HB2 SER 7 6.564 20.173 -12.529 55 HB3 SER 7 HB1 SER 7 5.404 21.381 -11.986 56 HG SER 7 HG SER 7 7.179 22.058 -11.003 57 H GLU 8 HN GLU 8 2.928 20.443 -11.021 58 HA GLU 8 HA GLU 8 2.891 22.083 -8.752 59 HB2 GLU 8 HB2 GLU 8 1.256 22.102 -10.677 60 HB3 GLU 8 HB1 GLU 8 0.488 20.695 -9.944 61 HG2 GLU 8 HG2 GLU 8 -0.710 22.632 -9.171 62 HG3 GLU 8 HG1 GLU 8 0.256 22.050 -7.818 63 H ILE 9 HN ILE 9 1.543 18.772 -9.124 64 HA ILE 9 HA ILE 9 1.021 18.642 -6.270 65 HB ILE 9 HB ILE 9 -0.484 17.563 -7.981 66 HG12 ILE 9 HG12 ILE 9 0.784 15.908 -5.772 67 HG13 ILE 9 HG11 ILE 9 -0.634 16.933 -5.645 68 HG21 ILE 9 HG21 ILE 9 0.207 15.547 -9.066 69 HG22 ILE 9 HG22 ILE 9 1.518 16.697 -9.322 70 HG23 ILE 9 HG23 ILE 9 1.674 15.442 -8.094 71 HD11 ILE 9 HD11 ILE 9 -0.914 14.331 -5.887 72 HD12 ILE 9 HD12 ILE 9 -1.999 15.402 -6.751 73 HD13 ILE 9 HD13 ILE 9 -0.661 14.639 -7.597 74 H ALA 10 HN ALA 10 3.446 17.459 -8.517 75 HA ALA 10 HA ALA 10 4.561 15.605 -6.655 76 HB1 ALA 10 HB1 ALA 10 5.960 16.791 -9.046 77 HB2 ALA 10 HB2 ALA 10 4.917 15.370 -9.103 78 HB3 ALA 10 HB3 ALA 10 6.413 15.329 -8.171 79 H GLY 11 HN GLY 11 6.185 15.778 -5.230 80 HA2 GLY 11 HA2 GLY 11 8.176 17.003 -4.465 81 HA3 GLY 11 HA1 GLY 11 7.275 18.490 -4.762 82 H LYS 12 HN LYS 12 4.745 17.380 -3.762 83 HA LYS 12 HA LYS 12 5.153 16.570 -1.035 84 HB2 LYS 12 HB2 LYS 12 5.738 19.011 -0.978 85 HB3 LYS 12 HB1 LYS 12 4.078 19.360 -1.461 86 HG2 LYS 12 HG2 LYS 12 3.255 18.128 0.529 87 HG3 LYS 12 HG1 LYS 12 4.925 17.843 1.025 88 HD2 LYS 12 HD2 LYS 12 5.240 20.372 0.967 89 HD3 LYS 12 HD1 LYS 12 3.487 20.496 0.810 90 HE2 LYS 12 HE2 LYS 12 5.107 19.469 3.127 91 HE3 LYS 12 HE1 LYS 12 3.779 20.629 3.130 92 HZ1 LYS 12 HZ1 LYS 12 2.236 18.888 2.644 93 HZ2 LYS 12 HZ2 LYS 12 3.487 17.750 2.473 94 HZ3 LYS 12 HZ3 LYS 12 3.156 18.422 3.994 95 H TRP 13 HN TRP 13 3.544 15.079 -0.948 96 HA TRP 13 HA TRP 13 0.827 15.836 -1.881 97 HB2 TRP 13 HB2 TRP 13 2.237 13.162 -1.585 98 HB3 TRP 13 HB1 TRP 13 0.516 13.262 -1.853 99 HD1 TRP 13 HD1 TRP 13 3.376 15.164 -3.617 100 HE1 TRP 13 HE1 TRP 13 3.138 14.648 -6.127 101 HE3 TRP 13 HE3 TRP 13 -0.681 12.078 -3.525 102 HZ2 TRP 13 HZ2 TRP 13 1.514 13.122 -7.842 103 HZ3 TRP 13 HZ3 TRP 13 -1.570 11.114 -5.630 104 HH2 TRP 13 HH2 TRP 13 -0.491 11.646 -7.798 105 H TYR 14 HN TYR 14 -0.635 16.135 -0.161 106 HA TYR 14 HA TYR 14 0.257 15.292 2.500 107 HB2 TYR 14 HB2 TYR 14 -1.073 17.572 1.417 108 HB3 TYR 14 HB1 TYR 14 -2.171 16.823 2.566 109 HD1 TYR 14 HD2 TYR 14 -0.629 15.803 4.694 110 HD2 TYR 14 HD1 TYR 14 0.129 19.324 2.355 111 HE1 TYR 14 HE2 TYR 14 0.676 16.768 6.563 112 HE2 TYR 14 HE1 TYR 14 1.431 20.285 4.226 113 HH TYR 14 HH TYR 14 2.795 19.021 6.360 114 H VAL 15 HN VAL 15 -0.527 13.571 3.431 115 HA VAL 15 HA VAL 15 -3.012 12.316 2.460 116 HB VAL 15 HB VAL 15 -0.867 11.341 4.363 117 HG11 VAL 15 HG11 VAL 15 -3.449 10.097 3.395 118 HG12 VAL 15 HG12 VAL 15 -2.121 9.134 4.042 119 HG13 VAL 15 HG13 VAL 15 -2.918 10.332 5.060 120 HG21 VAL 15 HG21 VAL 15 0.038 11.221 2.193 121 HG22 VAL 15 HG22 VAL 15 -0.667 9.620 2.413 122 HG23 VAL 15 HG23 VAL 15 -1.518 10.837 1.462 123 H VAL 16 HN VAL 16 -4.904 12.569 3.593 124 HA VAL 16 HA VAL 16 -4.696 13.298 6.453 125 HB VAL 16 HB VAL 16 -6.444 14.980 6.160 126 HG11 VAL 16 HG11 VAL 16 -4.407 15.863 4.168 127 HG12 VAL 16 HG12 VAL 16 -4.886 16.614 5.689 128 HG13 VAL 16 HG13 VAL 16 -3.763 15.256 5.688 129 HG21 VAL 16 HG21 VAL 16 -7.594 14.239 4.207 130 HG22 VAL 16 HG22 VAL 16 -6.820 15.754 3.741 131 HG23 VAL 16 HG23 VAL 16 -6.112 14.214 3.252 132 H ALA 17 HN ALA 17 -5.864 10.973 4.547 133 HA ALA 17 HA ALA 17 -7.627 10.017 6.484 134 HB1 ALA 17 HB1 ALA 17 -9.830 10.356 5.589 135 HB2 ALA 17 HB2 ALA 17 -9.190 11.147 4.160 136 HB3 ALA 17 HB3 ALA 17 -9.077 11.940 5.712 137 H LEU 18 HN LEU 18 -8.069 7.868 6.121 138 HA LEU 18 HA LEU 18 -7.942 6.877 3.360 139 HB2 LEU 18 HB2 LEU 18 -5.696 6.556 3.807 140 HB3 LEU 18 HB1 LEU 18 -5.950 6.405 5.539 141 HG LEU 18 HG LEU 18 -7.095 4.229 3.827 142 HD11 LEU 18 HD11 LEU 18 -4.912 4.551 2.782 143 HD12 LEU 18 HD12 LEU 18 -4.132 4.541 4.364 144 HD13 LEU 18 HD13 LEU 18 -4.903 3.078 3.751 145 HD21 LEU 18 HD21 LEU 18 -7.299 4.179 6.295 146 HD22 LEU 18 HD22 LEU 18 -6.294 2.851 5.725 147 HD23 LEU 18 HD23 LEU 18 -5.546 4.277 6.440 148 H ALA 19 HN ALA 19 -9.011 4.960 3.034 149 HA ALA 19 HA ALA 19 -10.544 3.894 5.331 150 HB1 ALA 19 HB1 ALA 19 -11.385 3.902 2.424 151 HB2 ALA 19 HB2 ALA 19 -11.943 5.068 3.618 152 HB3 ALA 19 HB3 ALA 19 -12.346 3.365 3.797 153 H SER 20 HN SER 20 -11.155 1.593 5.082 154 HA SER 20 HA SER 20 -9.713 -0.052 3.231 155 HB2 SER 20 HB2 SER 20 -7.926 0.642 4.876 156 HB3 SER 20 HB1 SER 20 -8.829 -0.232 6.109 157 HG SER 20 HG SER 20 -8.526 -1.693 3.845 158 H ASN 21 HN ASN 21 -9.748 -2.413 4.109 159 HA ASN 21 HA ASN 21 -12.463 -2.907 5.186 160 HB2 ASN 21 HB2 ASN 21 -10.739 -4.626 3.376 161 HB3 ASN 21 HB1 ASN 21 -12.316 -5.088 4.015 162 HD21 ASN 21 HD21 ASN 21 -11.523 -4.642 1.146 163 HD22 ASN 21 HD22 ASN 21 -12.574 -3.438 0.575 164 H THR 22 HN THR 22 -9.150 -3.073 5.719 165 HA THR 22 HA THR 22 -9.280 -5.318 7.589 166 HB THR 22 HB THR 22 -7.337 -4.998 6.006 167 HG1 THR 22 HG1 THR 22 -6.548 -4.845 8.706 168 HG21 THR 22 HG21 THR 22 -6.281 -2.945 7.911 169 HG22 THR 22 HG22 THR 22 -5.845 -3.236 6.229 170 HG23 THR 22 HG23 THR 22 -7.356 -2.411 6.616 171 H GLU 23 HN GLU 23 -10.231 -4.792 9.433 172 HA GLU 23 HA GLU 23 -10.688 -2.411 10.610 173 HB2 GLU 23 HB2 GLU 23 -9.967 -4.991 12.003 174 HB3 GLU 23 HB1 GLU 23 -10.689 -3.596 12.806 175 HG2 GLU 23 HG2 GLU 23 -12.614 -3.712 11.249 176 HG3 GLU 23 HG1 GLU 23 -11.902 -5.135 10.492 177 H PHE 24 HN PHE 24 -7.604 -4.039 10.535 178 HA PHE 24 HA PHE 24 -6.315 -2.745 12.647 179 HB2 PHE 24 HB2 PHE 24 -4.892 -3.341 10.070 180 HB3 PHE 24 HB1 PHE 24 -4.301 -3.489 11.723 181 HD1 PHE 24 HD1 PHE 24 -6.515 -4.956 13.048 182 HD2 PHE 24 HD2 PHE 24 -4.753 -5.506 9.166 183 HE1 PHE 24 HE1 PHE 24 -7.205 -7.334 13.070 184 HE2 PHE 24 HE2 PHE 24 -5.445 -7.886 9.192 185 HZ PHE 24 HZ PHE 24 -6.670 -8.800 11.144 186 H PHE 25 HN PHE 25 -6.470 -1.671 9.195 187 HA PHE 25 HA PHE 25 -4.928 0.648 9.660 188 HB2 PHE 25 HB2 PHE 25 -5.810 -0.722 7.459 189 HB3 PHE 25 HB1 PHE 25 -6.806 0.725 7.379 190 HD1 PHE 25 HD1 PHE 25 -4.920 2.730 8.588 191 HD2 PHE 25 HD2 PHE 25 -4.243 -0.397 5.726 192 HE1 PHE 25 HE1 PHE 25 -2.996 3.990 7.671 193 HE2 PHE 25 HE2 PHE 25 -2.318 0.864 4.808 194 HZ PHE 25 HZ PHE 25 -1.693 3.057 5.779 195 H LEU 26 HN LEU 26 -8.492 0.286 9.326 196 HA LEU 26 HA LEU 26 -8.937 3.100 9.634 197 HB2 LEU 26 HB2 LEU 26 -11.335 2.377 10.127 198 HB3 LEU 26 HB1 LEU 26 -10.685 1.981 8.541 199 HG LEU 26 HG LEU 26 -10.051 -0.191 10.339 200 HD11 LEU 26 HD11 LEU 26 -12.941 0.720 10.362 201 HD12 LEU 26 HD12 LEU 26 -12.441 -0.919 10.772 202 HD13 LEU 26 HD13 LEU 26 -11.893 0.440 11.753 203 HD21 LEU 26 HD21 LEU 26 -11.908 0.109 7.957 204 HD22 LEU 26 HD22 LEU 26 -10.253 -0.499 7.950 205 HD23 LEU 26 HD23 LEU 26 -11.537 -1.440 8.708 206 H ARG 27 HN ARG 27 -8.989 0.361 11.809 207 HA ARG 27 HA ARG 27 -9.965 1.640 14.113 208 HB2 ARG 27 HB2 ARG 27 -9.648 -0.796 14.006 209 HB3 ARG 27 HB1 ARG 27 -7.898 -0.571 13.965 210 HG2 ARG 27 HG2 ARG 27 -7.934 0.452 16.175 211 HG3 ARG 27 HG1 ARG 27 -9.697 0.392 16.208 212 HD2 ARG 27 HD2 ARG 27 -7.847 -2.005 16.078 213 HD3 ARG 27 HD1 ARG 27 -8.736 -1.470 17.500 214 HE ARG 27 HE ARG 27 -10.630 -1.834 15.502 215 HH11 ARG 27 HH21 ARG 27 -8.234 -3.695 17.166 216 HH12 ARG 27 HH22 ARG 27 -9.103 -5.187 17.036 217 HH21 ARG 27 HH11 ARG 27 -11.776 -3.788 15.327 218 HH22 ARG 27 HH12 ARG 27 -11.109 -5.240 15.994 219 H GLU 28 HN GLU 28 -6.606 1.246 12.990 220 HA GLU 28 HA GLU 28 -5.572 2.898 15.117 221 HB2 GLU 28 HB2 GLU 28 -4.271 1.728 12.654 222 HB3 GLU 28 HB1 GLU 28 -3.407 2.606 13.917 223 HG2 GLU 28 HG2 GLU 28 -4.222 0.968 15.591 224 HG3 GLU 28 HG1 GLU 28 -5.026 0.072 14.304 225 H LYS 29 HN LYS 29 -6.135 3.390 11.585 226 HA LYS 29 HA LYS 29 -4.801 5.756 11.258 227 HB2 LYS 29 HB2 LYS 29 -5.946 4.648 9.416 228 HB3 LYS 29 HB1 LYS 29 -7.511 4.988 10.151 229 HG2 LYS 29 HG2 LYS 29 -6.961 6.593 8.333 230 HG3 LYS 29 HG1 LYS 29 -7.144 7.399 9.888 231 HD2 LYS 29 HD2 LYS 29 -4.821 7.725 10.132 232 HD3 LYS 29 HD1 LYS 29 -4.429 6.483 8.942 233 HE2 LYS 29 HE2 LYS 29 -5.063 7.865 7.128 234 HE3 LYS 29 HE1 LYS 29 -5.952 8.973 8.171 235 HZ1 LYS 29 HZ1 LYS 29 -3.010 8.595 8.071 236 HZ2 LYS 29 HZ2 LYS 29 -3.880 9.968 7.578 237 HZ3 LYS 29 HZ3 LYS 29 -3.810 9.554 9.221 238 H ASP 30 HN ASP 30 -7.708 5.147 13.044 239 HA ASP 30 HA ASP 30 -8.625 7.819 13.235 240 HB2 ASP 30 HB2 ASP 30 -10.001 5.796 13.698 241 HB3 ASP 30 HB1 ASP 30 -9.084 5.559 15.185 242 H LYS 31 HN LYS 31 -6.073 6.110 14.954 243 HA LYS 31 HA LYS 31 -6.087 8.174 17.026 244 HB2 LYS 31 HB2 LYS 31 -4.694 6.818 18.354 245 HB3 LYS 31 HB1 LYS 31 -5.904 5.755 17.652 246 HG2 LYS 31 HG2 LYS 31 -3.952 4.532 17.326 247 HG3 LYS 31 HG1 LYS 31 -4.125 5.357 15.793 248 HD2 LYS 31 HD2 LYS 31 -2.634 7.126 17.469 249 HD3 LYS 31 HD1 LYS 31 -1.952 5.525 17.707 250 HE2 LYS 31 HE2 LYS 31 -2.504 6.376 14.891 251 HE3 LYS 31 HE1 LYS 31 -1.126 7.099 15.708 252 HZ1 LYS 31 HZ1 LYS 31 -0.842 4.526 16.370 253 HZ2 LYS 31 HZ2 LYS 31 -1.531 4.374 14.824 254 HZ3 LYS 31 HZ3 LYS 31 -0.092 5.249 15.028 255 H MET 32 HN MET 32 -4.242 7.491 14.120 256 HA MET 32 HA MET 32 -1.948 8.992 15.102 257 HB2 MET 32 HB2 MET 32 -1.202 8.949 12.686 258 HB3 MET 32 HB1 MET 32 -1.398 7.372 13.415 259 HG2 MET 32 HG2 MET 32 -3.868 7.607 12.416 260 HG3 MET 32 HG1 MET 32 -3.050 8.711 11.316 261 HE1 MET 32 HE1 MET 32 -3.269 5.494 12.985 262 HE2 MET 32 HE2 MET 32 -2.698 4.262 11.877 263 HE3 MET 32 HE3 MET 32 -1.554 5.127 12.909 264 H LYS 33 HN LYS 33 -1.187 10.663 13.246 265 HA LYS 33 HA LYS 33 -3.306 12.723 13.156 266 HB2 LYS 33 HB2 LYS 33 -0.321 12.884 13.557 267 HB3 LYS 33 HB1 LYS 33 -1.230 14.267 12.960 268 HG2 LYS 33 HG2 LYS 33 -2.533 14.409 14.934 269 HG3 LYS 33 HG1 LYS 33 -2.087 12.782 15.444 270 HD2 LYS 33 HD2 LYS 33 0.152 13.460 15.958 271 HD3 LYS 33 HD1 LYS 33 -0.074 15.027 15.179 272 HE2 LYS 33 HE2 LYS 33 -1.861 15.532 16.878 273 HE3 LYS 33 HE1 LYS 33 -1.426 14.038 17.705 274 HZ1 LYS 33 HZ1 LYS 33 -0.104 16.569 17.719 275 HZ2 LYS 33 HZ2 LYS 33 0.096 15.240 18.759 276 HZ3 LYS 33 HZ3 LYS 33 0.954 15.308 17.298 277 H MET 34 HN MET 34 -2.601 14.375 11.269 278 HA MET 34 HA MET 34 -3.078 13.004 8.875 279 HB2 MET 34 HB2 MET 34 -3.142 15.074 7.934 280 HB3 MET 34 HB1 MET 34 -3.264 15.540 9.617 281 HG2 MET 34 HG2 MET 34 -0.695 15.696 9.588 282 HG3 MET 34 HG1 MET 34 -0.844 15.659 7.832 283 HE1 MET 34 HE1 MET 34 -3.985 17.125 8.036 284 HE2 MET 34 HE2 MET 34 -3.378 18.566 7.226 285 HE3 MET 34 HE3 MET 34 -2.816 16.972 6.727 286 H ALA 35 HN ALA 35 -1.753 12.437 7.119 287 HA ALA 35 HA ALA 35 1.133 12.215 7.752 288 HB1 ALA 35 HB1 ALA 35 0.470 10.016 7.572 289 HB2 ALA 35 HB2 ALA 35 0.846 10.340 5.880 290 HB3 ALA 35 HB3 ALA 35 -0.827 10.387 6.440 291 H MET 36 HN MET 36 2.596 12.206 5.919 292 HA MET 36 HA MET 36 1.698 13.868 3.648 293 HB2 MET 36 HB2 MET 36 4.332 14.614 4.027 294 HB3 MET 36 HB1 MET 36 2.936 15.534 4.578 295 HG2 MET 36 HG2 MET 36 3.953 13.339 6.346 296 HG3 MET 36 HG1 MET 36 4.867 14.837 6.266 297 HE1 MET 36 HE1 MET 36 2.882 17.478 7.864 298 HE2 MET 36 HE2 MET 36 4.438 16.818 7.372 299 HE3 MET 36 HE3 MET 36 3.234 17.244 6.154 300 H ALA 37 HN ALA 37 3.109 13.756 1.788 301 HA ALA 37 HA ALA 37 5.017 11.581 1.574 302 HB1 ALA 37 HB1 ALA 37 3.208 10.158 1.189 303 HB2 ALA 37 HB2 ALA 37 3.641 10.660 -0.447 304 HB3 ALA 37 HB3 ALA 37 2.271 11.409 0.373 305 H ARG 38 HN ARG 38 6.021 11.484 -0.590 306 HA ARG 38 HA ARG 38 5.556 13.880 -2.263 307 HB2 ARG 38 HB2 ARG 38 8.025 14.258 -2.448 308 HB3 ARG 38 HB1 ARG 38 7.363 14.623 -0.857 309 HG2 ARG 38 HG2 ARG 38 8.265 12.670 0.100 310 HG3 ARG 38 HG1 ARG 38 8.527 11.911 -1.473 311 HD2 ARG 38 HD2 ARG 38 10.238 13.632 -1.989 312 HD3 ARG 38 HD1 ARG 38 10.000 14.329 -0.390 313 HE ARG 38 HE ARG 38 10.589 11.605 -0.056 314 HH11 ARG 38 HH21 ARG 38 12.034 14.521 -1.234 315 HH12 ARG 38 HH22 ARG 38 13.650 14.049 -0.823 316 HH21 ARG 38 HH11 ARG 38 12.705 10.979 0.484 317 HH22 ARG 38 HH12 ARG 38 14.030 12.044 0.149 318 H ILE 39 HN ILE 39 5.815 13.529 -4.462 319 HA ILE 39 HA ILE 39 6.622 10.842 -5.299 320 HB ILE 39 HB ILE 39 4.237 11.460 -5.283 321 HG12 ILE 39 HG12 ILE 39 4.999 11.188 -8.170 322 HG13 ILE 39 HG11 ILE 39 5.413 9.886 -7.061 323 HG21 ILE 39 HG21 ILE 39 3.500 13.007 -6.961 324 HG22 ILE 39 HG22 ILE 39 4.574 13.766 -5.794 325 HG23 ILE 39 HG23 ILE 39 5.139 13.359 -7.407 326 HD11 ILE 39 HD11 ILE 39 3.015 9.945 -8.227 327 HD12 ILE 39 HD12 ILE 39 3.193 9.405 -6.566 328 HD13 ILE 39 HD13 ILE 39 2.643 11.042 -6.909 329 H SER 40 HN SER 40 7.885 10.733 -7.198 330 HA SER 40 HA SER 40 8.376 13.191 -8.676 331 HB2 SER 40 HB2 SER 40 10.683 11.732 -7.437 332 HB3 SER 40 HB1 SER 40 10.733 13.221 -8.363 333 HG SER 40 HG SER 40 10.070 12.773 -5.731 334 H PHE 41 HN PHE 41 9.593 12.800 -10.670 335 HA PHE 41 HA PHE 41 8.936 10.136 -11.698 336 HB2 PHE 41 HB2 PHE 41 9.648 12.702 -13.118 337 HB3 PHE 41 HB1 PHE 41 9.218 11.188 -13.915 338 HD1 PHE 41 HD2 PHE 41 7.974 13.844 -11.631 339 HD2 PHE 41 HD1 PHE 41 6.944 10.461 -14.070 340 HE1 PHE 41 HE2 PHE 41 5.569 14.384 -11.366 341 HE2 PHE 41 HE1 PHE 41 4.539 11.001 -13.804 342 HZ PHE 41 HZ PHE 41 3.851 12.964 -12.452 343 H LEU 42 HN LEU 42 10.700 8.938 -10.894 344 HA LEU 42 HA LEU 42 13.437 9.537 -11.330 345 HB2 LEU 42 HB2 LEU 42 12.003 6.869 -11.196 346 HB3 LEU 42 HB1 LEU 42 13.748 7.024 -11.285 347 HG LEU 42 HG LEU 42 12.194 8.472 -9.146 348 HD11 LEU 42 HD11 LEU 42 12.881 5.546 -9.308 349 HD12 LEU 42 HD12 LEU 42 12.951 6.354 -7.743 350 HD13 LEU 42 HD13 LEU 42 11.440 6.319 -8.650 351 HD21 LEU 42 HD21 LEU 42 14.519 9.114 -9.349 352 HD22 LEU 42 HD22 LEU 42 14.385 8.085 -7.926 353 HD23 LEU 42 HD23 LEU 42 15.034 7.430 -9.428 354 H GLY 43 HN GLY 43 10.962 7.978 -13.206 355 HA2 GLY 43 HA2 GLY 43 12.060 8.701 -15.737 356 HA3 GLY 43 HA1 GLY 43 12.271 6.979 -15.407 357 H GLU 44 HN GLU 44 10.609 7.910 -17.504 358 HA GLU 44 HA GLU 44 7.922 8.268 -16.939 359 HB2 GLU 44 HB2 GLU 44 9.167 6.665 -19.190 360 HB3 GLU 44 HB1 GLU 44 7.480 7.174 -19.138 361 HG2 GLU 44 HG2 GLU 44 8.572 8.841 -20.428 362 HG3 GLU 44 HG1 GLU 44 8.378 9.562 -18.832 363 H ASP 45 HN ASP 45 9.823 5.312 -16.844 364 HA ASP 45 HA ASP 45 7.421 3.813 -15.981 365 HB2 ASP 45 HB2 ASP 45 9.086 1.823 -16.379 366 HB3 ASP 45 HB1 ASP 45 8.292 2.591 -17.751 367 H GLU 46 HN GLU 46 9.366 5.660 -14.469 368 HA GLU 46 HA GLU 46 9.635 3.887 -12.152 369 HB2 GLU 46 HB2 GLU 46 11.952 5.562 -13.136 370 HB3 GLU 46 HB1 GLU 46 11.942 4.459 -11.759 371 HG2 GLU 46 HG2 GLU 46 11.380 2.599 -13.380 372 HG3 GLU 46 HG1 GLU 46 11.680 3.740 -14.689 373 H LEU 47 HN LEU 47 8.652 4.899 -10.542 374 HA LEU 47 HA LEU 47 8.985 7.831 -10.258 375 HB2 LEU 47 HB2 LEU 47 6.484 6.351 -9.445 376 HB3 LEU 47 HB1 LEU 47 6.722 8.088 -9.607 377 HG LEU 47 HG LEU 47 6.885 6.158 -11.938 378 HD11 LEU 47 HD11 LEU 47 4.582 7.891 -11.008 379 HD12 LEU 47 HD12 LEU 47 4.616 6.926 -12.484 380 HD13 LEU 47 HD13 LEU 47 4.645 6.132 -10.909 381 HD21 LEU 47 HD21 LEU 47 6.812 9.169 -11.638 382 HD22 LEU 47 HD22 LEU 47 7.998 8.188 -12.494 383 HD23 LEU 47 HD23 LEU 47 6.376 8.379 -13.152 384 H LYS 48 HN LYS 48 9.345 8.560 -8.192 385 HA LYS 48 HA LYS 48 9.752 6.477 -6.133 386 HB2 LYS 48 HB2 LYS 48 11.649 8.059 -6.927 387 HB3 LYS 48 HB1 LYS 48 10.807 9.296 -6.002 388 HG2 LYS 48 HG2 LYS 48 11.043 8.049 -3.960 389 HG3 LYS 48 HG1 LYS 48 11.623 6.626 -4.826 390 HD2 LYS 48 HD2 LYS 48 13.527 7.786 -3.836 391 HD3 LYS 48 HD1 LYS 48 13.602 7.935 -5.590 392 HE2 LYS 48 HE2 LYS 48 12.215 10.066 -3.978 393 HE3 LYS 48 HE1 LYS 48 13.974 10.068 -4.106 394 HZ1 LYS 48 HZ1 LYS 48 12.918 9.605 -6.650 395 HZ2 LYS 48 HZ2 LYS 48 12.098 10.939 -5.993 396 HZ3 LYS 48 HZ3 LYS 48 13.790 10.957 -6.107 397 H VAL 49 HN VAL 49 8.209 6.353 -4.599 398 HA VAL 49 HA VAL 49 6.854 8.858 -3.814 399 HB VAL 49 HB VAL 49 5.671 6.268 -4.633 400 HG11 VAL 49 HG11 VAL 49 5.130 6.072 -2.268 401 HG12 VAL 49 HG12 VAL 49 4.627 7.763 -2.209 402 HG13 VAL 49 HG13 VAL 49 3.690 6.596 -3.142 403 HG21 VAL 49 HG21 VAL 49 3.720 7.865 -4.966 404 HG22 VAL 49 HG22 VAL 49 4.803 9.157 -4.449 405 HG23 VAL 49 HG23 VAL 49 5.176 8.211 -5.886 406 H SER 50 HN SER 50 6.650 9.294 -1.804 407 HA SER 50 HA SER 50 7.930 7.480 0.167 408 HB2 SER 50 HB2 SER 50 9.166 9.549 -0.584 409 HB3 SER 50 HB1 SER 50 7.884 10.475 0.172 410 HG SER 50 HG SER 50 9.209 8.432 1.588 411 H TYR 51 HN TYR 51 7.121 7.428 2.248 412 HA TYR 51 HA TYR 51 4.504 8.763 2.674 413 HB2 TYR 51 HB2 TYR 51 5.261 6.160 3.994 414 HB3 TYR 51 HB1 TYR 51 3.664 6.873 3.791 415 HD1 TYR 51 HD1 TYR 51 3.390 7.521 1.042 416 HD2 TYR 51 HD2 TYR 51 5.441 4.183 2.787 417 HE1 TYR 51 HE1 TYR 51 3.037 6.214 -1.025 418 HE2 TYR 51 HE2 TYR 51 5.105 2.884 0.703 419 HH TYR 51 HH TYR 51 4.091 2.832 -1.282 420 H ALA 52 HN ALA 52 4.340 9.951 4.463 421 HA ALA 52 HA ALA 52 6.342 9.599 6.612 422 HB1 ALA 52 HB1 ALA 52 5.830 12.177 6.925 423 HB2 ALA 52 HB2 ALA 52 5.440 12.082 5.206 424 HB3 ALA 52 HB3 ALA 52 7.048 11.642 5.770 425 H VAL 53 HN VAL 53 5.193 8.633 8.185 426 HA VAL 53 HA VAL 53 2.451 9.599 8.695 427 HB VAL 53 HB VAL 53 3.518 6.930 9.569 428 HG11 VAL 53 HG11 VAL 53 1.379 7.755 10.513 429 HG12 VAL 53 HG12 VAL 53 0.744 7.947 8.879 430 HG13 VAL 53 HG13 VAL 53 1.135 6.340 9.491 431 HG21 VAL 53 HG21 VAL 53 2.308 7.684 6.891 432 HG22 VAL 53 HG22 VAL 53 3.921 7.029 7.170 433 HG23 VAL 53 HG23 VAL 53 2.500 6.027 7.462 434 HA PRO 54 HA PRO 54 4.164 10.765 12.691 435 HB2 PRO 54 HB2 PRO 54 1.971 11.916 13.748 436 HB3 PRO 54 HB1 PRO 54 2.844 12.676 12.398 437 HG2 PRO 54 HG2 PRO 54 0.349 11.031 12.347 438 HG3 PRO 54 HG1 PRO 54 0.714 12.544 11.498 439 HD2 PRO 54 HD2 PRO 54 0.902 10.064 10.317 440 HD3 PRO 54 HD1 PRO 54 1.867 11.472 9.809 441 H LYS 55 HN LYS 55 4.256 9.746 14.675 442 HA LYS 55 HA LYS 55 2.012 8.167 15.635 443 HB2 LYS 55 HB2 LYS 55 3.333 6.690 14.047 444 HB3 LYS 55 HB1 LYS 55 4.667 6.812 15.192 445 HG2 LYS 55 HG2 LYS 55 3.074 6.006 16.988 446 HG3 LYS 55 HG1 LYS 55 1.914 5.668 15.704 447 HD2 LYS 55 HD2 LYS 55 3.765 4.285 14.598 448 HD3 LYS 55 HD1 LYS 55 4.630 4.413 16.130 449 HE2 LYS 55 HE2 LYS 55 2.580 3.484 17.271 450 HE3 LYS 55 HE1 LYS 55 1.899 3.183 15.672 451 HZ1 LYS 55 HZ1 LYS 55 2.986 1.265 15.721 452 HZ2 LYS 55 HZ2 LYS 55 4.431 2.146 15.568 453 HZ3 LYS 55 HZ3 LYS 55 3.869 1.703 17.105 454 HA PRO 56 HA PRO 56 4.357 10.707 18.802 455 HB2 PRO 56 HB2 PRO 56 1.831 9.736 20.114 456 HB3 PRO 56 HB1 PRO 56 2.655 11.300 20.285 457 HG2 PRO 56 HG2 PRO 56 0.509 11.011 18.714 458 HG3 PRO 56 HG1 PRO 56 1.838 12.101 18.288 459 HD2 PRO 56 HD2 PRO 56 1.065 9.544 17.032 460 HD3 PRO 56 HD1 PRO 56 2.065 10.856 16.374 461 H ASN 57 HN ASN 57 3.216 7.430 18.648 462 HA ASN 57 HA ASN 57 4.678 6.665 21.090 463 HB2 ASN 57 HB2 ASN 57 2.814 5.089 19.300 464 HB3 ASN 57 HB1 ASN 57 3.592 4.462 20.753 465 HD21 ASN 57 HD21 ASN 57 0.733 4.618 20.528 466 HD22 ASN 57 HD22 ASN 57 0.179 5.771 21.642 467 H GLY 58 HN GLY 58 5.729 7.363 18.225 468 HA2 GLY 58 HA2 GLY 58 8.109 6.340 18.002 469 HA3 GLY 58 HA1 GLY 58 7.201 4.869 17.660 470 H CYS 59 HN CYS 59 7.696 8.209 16.586 471 HA CYS 59 HA CYS 59 6.235 8.274 14.257 472 HB2 CYS 59 HB2 CYS 59 7.570 10.160 15.213 473 HB3 CYS 59 HB1 CYS 59 9.026 9.397 14.573 474 H ARG 60 HN ARG 60 6.500 7.624 12.151 475 HA ARG 60 HA ARG 60 8.831 5.903 11.530 476 HB2 ARG 60 HB2 ARG 60 5.900 5.295 11.139 477 HB3 ARG 60 HB1 ARG 60 7.157 4.486 10.201 478 HG2 ARG 60 HG2 ARG 60 8.198 3.634 12.219 479 HG3 ARG 60 HG1 ARG 60 7.095 4.569 13.230 480 HD2 ARG 60 HD2 ARG 60 5.224 3.247 12.596 481 HD3 ARG 60 HD1 ARG 60 6.092 2.529 11.241 482 HE ARG 60 HE ARG 60 6.903 0.949 12.717 483 HH11 ARG 60 HH21 ARG 60 5.963 3.814 14.416 484 HH12 ARG 60 HH22 ARG 60 6.286 3.155 15.985 485 HH21 ARG 60 HH11 ARG 60 7.329 0.080 14.770 486 HH22 ARG 60 HH12 ARG 60 7.059 1.041 16.186 487 H LYS 61 HN LYS 61 9.877 6.745 9.870 488 HA LYS 61 HA LYS 61 8.339 7.896 7.620 489 HB2 LYS 61 HB2 LYS 61 10.020 9.680 7.400 490 HB3 LYS 61 HB1 LYS 61 9.209 9.762 8.965 491 HG2 LYS 61 HG2 LYS 61 11.138 8.388 9.900 492 HG3 LYS 61 HG1 LYS 61 11.967 8.670 8.370 493 HD2 LYS 61 HD2 LYS 61 11.632 11.144 8.737 494 HD3 LYS 61 HD1 LYS 61 11.033 10.762 10.352 495 HE2 LYS 61 HE2 LYS 61 13.355 11.248 10.625 496 HE3 LYS 61 HE1 LYS 61 13.218 9.492 10.717 497 HZ1 LYS 61 HZ1 LYS 61 13.909 11.011 8.260 498 HZ2 LYS 61 HZ2 LYS 61 15.036 10.231 9.265 499 HZ3 LYS 61 HZ3 LYS 61 13.876 9.321 8.427 500 H TRP 62 HN TRP 62 8.980 7.171 5.663 501 HA TRP 62 HA TRP 62 11.690 6.320 5.181 502 HB2 TRP 62 HB2 TRP 62 11.500 4.066 5.278 503 HB3 TRP 62 HB1 TRP 62 10.108 4.392 6.303 504 HD1 TRP 62 HD1 TRP 62 7.842 5.066 4.443 505 HE1 TRP 62 HE1 TRP 62 6.971 3.417 2.661 506 HE3 TRP 62 HE3 TRP 62 11.935 2.053 3.944 507 HZ2 TRP 62 HZ2 TRP 62 7.888 1.128 1.212 508 HZ3 TRP 62 HZ3 TRP 62 11.910 0.149 2.359 509 HH2 TRP 62 HH2 TRP 62 9.894 -0.317 0.993 510 H GLU 63 HN GLU 63 11.745 5.174 2.937 511 HA GLU 63 HA GLU 63 10.002 6.725 1.101 512 HB2 GLU 63 HB2 GLU 63 12.388 7.482 1.184 513 HB3 GLU 63 HB1 GLU 63 12.865 5.887 0.605 514 HG2 GLU 63 HG2 GLU 63 11.751 6.190 -1.472 515 HG3 GLU 63 HG1 GLU 63 10.849 7.583 -0.875 516 H THR 64 HN THR 64 9.752 5.765 -1.057 517 HA THR 64 HA THR 64 10.184 2.891 -1.293 518 HB THR 64 HB THR 64 7.376 3.964 -1.548 519 HG1 THR 64 HG1 THR 64 7.209 3.863 0.522 520 HG21 THR 64 HG21 THR 64 7.785 1.879 -2.713 521 HG22 THR 64 HG22 THR 64 8.592 1.199 -1.300 522 HG23 THR 64 HG23 THR 64 6.861 1.522 -1.254 523 H THR 65 HN THR 65 10.209 2.192 -3.415 524 HA THR 65 HA THR 65 10.029 4.316 -5.459 525 HB THR 65 HB THR 65 11.417 1.631 -5.567 526 HG1 THR 65 HG1 THR 65 12.672 2.823 -4.312 527 HG21 THR 65 HG21 THR 65 11.227 3.957 -7.488 528 HG22 THR 65 HG22 THR 65 12.500 2.739 -7.591 529 HG23 THR 65 HG23 THR 65 10.811 2.270 -7.787 530 H PHE 66 HN PHE 66 8.501 4.252 -7.005 531 HA PHE 66 HA PHE 66 6.923 1.758 -7.325 532 HB2 PHE 66 HB2 PHE 66 6.122 4.650 -7.164 533 HB3 PHE 66 HB1 PHE 66 5.149 3.548 -8.133 534 HD1 PHE 66 HD1 PHE 66 6.762 3.756 -4.750 535 HD2 PHE 66 HD2 PHE 66 3.442 2.348 -7.085 536 HE1 PHE 66 HE1 PHE 66 5.663 2.919 -2.692 537 HE2 PHE 66 HE2 PHE 66 2.348 1.513 -5.025 538 HZ PHE 66 HZ PHE 66 3.459 1.799 -2.829 539 H LYS 67 HN LYS 67 6.708 0.981 -9.360 540 HA LYS 67 HA LYS 67 7.798 2.619 -11.584 541 HB2 LYS 67 HB2 LYS 67 7.859 -0.380 -11.176 542 HB3 LYS 67 HB1 LYS 67 8.333 0.431 -12.668 543 HG2 LYS 67 HG2 LYS 67 9.905 1.831 -11.089 544 HG3 LYS 67 HG1 LYS 67 9.679 0.481 -9.978 545 HD2 LYS 67 HD2 LYS 67 10.317 -1.045 -11.926 546 HD3 LYS 67 HD1 LYS 67 10.841 0.415 -12.765 547 HE2 LYS 67 HE2 LYS 67 11.854 -0.513 -10.060 548 HE3 LYS 67 HE1 LYS 67 12.732 -0.655 -11.583 549 HZ1 LYS 67 HZ1 LYS 67 13.496 1.290 -10.500 550 HZ2 LYS 67 HZ2 LYS 67 12.511 1.806 -11.786 551 HZ3 LYS 67 HZ3 LYS 67 11.915 1.836 -10.198 552 H LYS 68 HN LYS 68 6.695 2.639 -13.530 553 HA LYS 68 HA LYS 68 3.870 2.222 -13.362 554 HB2 LYS 68 HB2 LYS 68 5.126 3.989 -14.743 555 HB3 LYS 68 HB1 LYS 68 5.398 2.700 -15.915 556 HG2 LYS 68 HG2 LYS 68 2.941 2.300 -16.000 557 HG3 LYS 68 HG1 LYS 68 2.706 3.665 -14.909 558 HD2 LYS 68 HD2 LYS 68 3.850 5.141 -16.561 559 HD3 LYS 68 HD1 LYS 68 3.965 3.770 -17.666 560 HE2 LYS 68 HE2 LYS 68 2.002 5.152 -18.211 561 HE3 LYS 68 HE1 LYS 68 1.499 3.558 -17.650 562 HZ1 LYS 68 HZ1 LYS 68 1.159 4.489 -15.441 563 HZ2 LYS 68 HZ2 LYS 68 1.612 6.028 -16.004 564 HZ3 LYS 68 HZ3 LYS 68 0.204 5.290 -16.596 565 H THR 69 HN THR 69 2.670 0.535 -13.946 566 HA THR 69 HA THR 69 3.883 -1.599 -15.604 567 HB THR 69 HB THR 69 3.896 -2.378 -13.301 568 HG1 THR 69 HG1 THR 69 1.632 -3.682 -14.114 569 HG21 THR 69 HG21 THR 69 2.206 -0.842 -12.399 570 HG22 THR 69 HG22 THR 69 0.950 -1.669 -13.320 571 HG23 THR 69 HG23 THR 69 1.787 -2.510 -12.015 572 H SER 70 HN SER 70 2.068 -3.145 -16.360 573 HA SER 70 HA SER 70 -0.073 -1.471 -17.473 574 HB2 SER 70 HB2 SER 70 1.428 -2.916 -18.943 575 HB3 SER 70 HB1 SER 70 0.602 -4.307 -18.248 576 HG SER 70 HG SER 70 -0.799 -2.125 -19.376 577 H ASP 71 HN ASP 71 0.377 -3.300 -14.857 578 HA ASP 71 HA ASP 71 -1.235 -5.202 -14.244 579 HB2 ASP 71 HB2 ASP 71 -0.238 -3.555 -12.604 580 HB3 ASP 71 HB1 ASP 71 -1.712 -2.608 -12.788 581 H ASP 72 HN ASP 72 -2.700 -1.996 -14.950 582 HA ASP 72 HA ASP 72 -4.930 -3.130 -16.253 583 HB2 ASP 72 HB2 ASP 72 -5.650 -3.866 -14.083 584 HB3 ASP 72 HB1 ASP 72 -5.355 -2.275 -13.386 585 H GLY 73 HN GLY 73 -4.255 -1.516 -17.685 586 HA2 GLY 73 HA2 GLY 73 -4.698 0.508 -18.727 587 HA3 GLY 73 HA1 GLY 73 -5.571 1.019 -17.285 588 H GLU 74 HN GLU 74 -4.596 2.360 -15.864 589 HA GLU 74 HA GLU 74 -1.713 2.955 -16.252 590 HB2 GLU 74 HB2 GLU 74 -4.009 4.838 -15.682 591 HB3 GLU 74 HB1 GLU 74 -2.313 5.290 -15.514 592 HG2 GLU 74 HG2 GLU 74 -2.996 5.984 -17.709 593 HG3 GLU 74 HG1 GLU 74 -1.988 4.555 -17.921 594 H VAL 75 HN VAL 75 -1.047 1.589 -14.524 595 HA VAL 75 HA VAL 75 -1.761 2.624 -11.857 596 HB VAL 75 HB VAL 75 -1.462 -0.308 -12.519 597 HG11 VAL 75 HG11 VAL 75 -2.723 -0.206 -10.120 598 HG12 VAL 75 HG12 VAL 75 -0.968 -0.245 -10.267 599 HG13 VAL 75 HG13 VAL 75 -1.794 1.289 -10.009 600 HG21 VAL 75 HG21 VAL 75 -4.037 -0.085 -11.770 601 HG22 VAL 75 HG22 VAL 75 -3.832 1.523 -12.462 602 HG23 VAL 75 HG23 VAL 75 -3.540 0.095 -13.451 603 H TYR 76 HN TYR 76 -0.173 2.450 -10.279 604 HA TYR 76 HA TYR 76 2.549 1.885 -11.318 605 HB2 TYR 76 HB2 TYR 76 1.775 3.713 -9.036 606 HB3 TYR 76 HB1 TYR 76 3.368 3.554 -9.784 607 HD1 TYR 76 HD1 TYR 76 3.711 4.250 -12.164 608 HD2 TYR 76 HD2 TYR 76 0.041 5.022 -10.070 609 HE1 TYR 76 HE1 TYR 76 3.063 5.894 -13.903 610 HE2 TYR 76 HE2 TYR 76 -0.602 6.669 -11.808 611 HH TYR 76 HH TYR 76 -0.078 7.125 -14.189 612 H TYR 77 HN TYR 77 4.023 0.819 -9.894 613 HA TYR 77 HA TYR 77 2.989 -0.319 -7.427 614 HB2 TYR 77 HB2 TYR 77 2.738 -2.517 -8.037 615 HB3 TYR 77 HB1 TYR 77 2.266 -1.739 -9.544 616 HD1 TYR 77 HD2 TYR 77 4.207 -1.274 -11.258 617 HD2 TYR 77 HD1 TYR 77 4.451 -4.115 -8.047 618 HE1 TYR 77 HE2 TYR 77 6.057 -2.441 -12.429 619 HE2 TYR 77 HE1 TYR 77 6.297 -5.282 -9.218 620 HH TYR 77 HH TYR 77 7.930 -3.922 -11.887 621 H SER 78 HN SER 78 4.485 -0.973 -5.988 622 HA SER 78 HA SER 78 7.318 -0.678 -6.775 623 HB2 SER 78 HB2 SER 78 6.508 0.771 -4.926 624 HB3 SER 78 HB1 SER 78 6.043 -0.666 -4.025 625 HG SER 78 HG SER 78 8.043 -0.860 -3.442 626 H GLU 79 HN GLU 79 7.942 -2.643 -7.466 627 HA GLU 79 HA GLU 79 6.993 -5.136 -6.765 628 HB2 GLU 79 HB2 GLU 79 8.603 -4.578 -8.622 629 HB3 GLU 79 HB1 GLU 79 9.885 -4.566 -7.412 630 HG2 GLU 79 HG2 GLU 79 9.231 -6.896 -6.767 631 HG3 GLU 79 HG1 GLU 79 8.071 -6.896 -8.096 632 H GLU 80 HN GLU 80 9.497 -3.250 -5.117 633 HA GLU 80 HA GLU 80 10.241 -5.375 -3.351 634 HB2 GLU 80 HB2 GLU 80 11.421 -3.529 -2.100 635 HB3 GLU 80 HB1 GLU 80 11.881 -3.708 -3.792 636 HG2 GLU 80 HG2 GLU 80 9.675 -1.805 -3.020 637 HG3 GLU 80 HG1 GLU 80 11.360 -1.316 -2.864 638 H ALA 81 HN ALA 81 7.878 -2.761 -3.148 639 HA ALA 81 HA ALA 81 7.338 -3.485 -0.333 640 HB1 ALA 81 HB1 ALA 81 7.751 -1.057 -1.141 641 HB2 ALA 81 HB2 ALA 81 6.411 -1.364 -0.036 642 HB3 ALA 81 HB3 ALA 81 6.103 -1.147 -1.758 643 H LYS 82 HN LYS 82 6.311 -4.639 -3.152 644 HA LYS 82 HA LYS 82 4.252 -5.322 -4.037 645 HB2 LYS 82 HB2 LYS 82 4.075 -6.236 -1.154 646 HB3 LYS 82 HB1 LYS 82 3.158 -6.909 -2.503 647 HG2 LYS 82 HG2 LYS 82 5.359 -7.433 -3.625 648 HG3 LYS 82 HG1 LYS 82 6.164 -6.965 -2.128 649 HD2 LYS 82 HD2 LYS 82 4.104 -9.172 -2.432 650 HD3 LYS 82 HD1 LYS 82 5.835 -9.397 -2.181 651 HE2 LYS 82 HE2 LYS 82 3.768 -8.363 -0.251 652 HE3 LYS 82 HE1 LYS 82 4.972 -9.627 -0.011 653 HZ1 LYS 82 HZ1 LYS 82 5.635 -6.762 -0.408 654 HZ2 LYS 82 HZ2 LYS 82 5.497 -7.501 1.116 655 HZ3 LYS 82 HZ3 LYS 82 6.700 -8.010 0.034 656 H LYS 83 HN LYS 83 3.828 -2.840 -3.903 657 HA LYS 83 HA LYS 83 1.120 -2.523 -2.816 658 HB2 LYS 83 HB2 LYS 83 2.501 -1.594 -1.049 659 HB3 LYS 83 HB1 LYS 83 3.417 -0.641 -2.215 660 HG2 LYS 83 HG2 LYS 83 1.414 0.653 -2.780 661 HG3 LYS 83 HG1 LYS 83 0.442 -0.344 -1.696 662 HD2 LYS 83 HD2 LYS 83 1.497 0.518 0.233 663 HD3 LYS 83 HD1 LYS 83 2.867 1.139 -0.683 664 HE2 LYS 83 HE2 LYS 83 1.640 2.953 -1.538 665 HE3 LYS 83 HE1 LYS 83 0.089 2.183 -1.209 666 HZ1 LYS 83 HZ1 LYS 83 1.292 4.018 0.371 667 HZ2 LYS 83 HZ2 LYS 83 0.076 2.943 0.872 668 HZ3 LYS 83 HZ3 LYS 83 1.706 2.559 1.136 669 H LYS 84 HN LYS 84 -0.163 -1.601 -4.291 670 HA LYS 84 HA LYS 84 1.070 0.047 -6.422 671 HB2 LYS 84 HB2 LYS 84 -1.340 -1.452 -7.213 672 HB3 LYS 84 HB1 LYS 84 0.186 -1.252 -8.070 673 HG2 LYS 84 HG2 LYS 84 1.181 -2.893 -6.367 674 HG3 LYS 84 HG1 LYS 84 -0.482 -3.245 -5.901 675 HD2 LYS 84 HD2 LYS 84 -0.971 -3.747 -8.324 676 HD3 LYS 84 HD1 LYS 84 0.757 -3.600 -8.643 677 HE2 LYS 84 HE2 LYS 84 0.059 -5.963 -8.265 678 HE3 LYS 84 HE1 LYS 84 1.239 -5.411 -7.076 679 HZ1 LYS 84 HZ1 LYS 84 -0.857 -6.638 -6.275 680 HZ2 LYS 84 HZ2 LYS 84 -0.358 -5.245 -5.439 681 HZ3 LYS 84 HZ3 LYS 84 -1.646 -5.156 -6.538 682 H VAL 85 HN VAL 85 -0.003 1.809 -7.131 683 HA VAL 85 HA VAL 85 -2.656 2.342 -5.986 684 HB VAL 85 HB VAL 85 -2.095 4.373 -5.052 685 HG11 VAL 85 HG11 VAL 85 -0.980 2.374 -3.964 686 HG12 VAL 85 HG12 VAL 85 0.516 2.898 -4.733 687 HG13 VAL 85 HG13 VAL 85 -0.281 3.936 -3.556 688 HG21 VAL 85 HG21 VAL 85 0.343 5.358 -5.496 689 HG22 VAL 85 HG22 VAL 85 0.210 4.446 -6.996 690 HG23 VAL 85 HG23 VAL 85 -0.967 5.707 -6.621 691 H GLU 86 HN GLU 86 -4.046 3.008 -7.421 692 HA GLU 86 HA GLU 86 -3.056 3.993 -10.042 693 HB2 GLU 86 HB2 GLU 86 -5.019 2.891 -11.029 694 HB3 GLU 86 HB1 GLU 86 -4.014 1.730 -10.164 695 HG2 GLU 86 HG2 GLU 86 -5.525 2.124 -8.148 696 HG3 GLU 86 HG1 GLU 86 -6.611 2.968 -9.250 697 H VAL 87 HN VAL 87 -3.892 5.794 -10.850 698 HA VAL 87 HA VAL 87 -5.338 7.588 -9.248 699 HB VAL 87 HB VAL 87 -4.112 8.559 -10.990 700 HG11 VAL 87 HG11 VAL 87 -5.418 6.468 -12.733 701 HG12 VAL 87 HG12 VAL 87 -4.597 7.869 -13.421 702 HG13 VAL 87 HG13 VAL 87 -3.701 6.723 -12.427 703 HG21 VAL 87 HG21 VAL 87 -6.780 8.620 -12.378 704 HG22 VAL 87 HG22 VAL 87 -6.656 9.285 -10.751 705 HG23 VAL 87 HG23 VAL 87 -5.662 9.942 -12.050 706 H LEU 88 HN LEU 88 -7.184 6.740 -8.402 707 HA LEU 88 HA LEU 88 -9.278 5.675 -10.143 708 HB2 LEU 88 HB2 LEU 88 -8.550 5.004 -7.619 709 HB3 LEU 88 HB1 LEU 88 -9.780 6.202 -7.241 710 HG LEU 88 HG LEU 88 -10.811 4.003 -7.330 711 HD11 LEU 88 HD11 LEU 88 -12.609 4.496 -8.788 712 HD12 LEU 88 HD12 LEU 88 -11.955 6.067 -8.331 713 HD13 LEU 88 HD13 LEU 88 -11.571 5.376 -9.908 714 HD21 LEU 88 HD21 LEU 88 -8.935 3.304 -9.157 715 HD22 LEU 88 HD22 LEU 88 -10.450 2.428 -8.960 716 HD23 LEU 88 HD23 LEU 88 -10.286 3.623 -10.245 717 H ASP 89 HN ASP 89 -8.226 8.545 -8.728 718 HA ASP 89 HA ASP 89 -9.974 10.257 -10.039 719 HB2 ASP 89 HB2 ASP 89 -11.345 9.132 -7.933 720 HB3 ASP 89 HB1 ASP 89 -10.638 10.546 -7.160 721 H THR 90 HN THR 90 -8.632 11.981 -10.254 722 HA THR 90 HA THR 90 -7.102 12.877 -7.935 723 HB THR 90 HB THR 90 -5.908 11.068 -9.468 724 HG1 THR 90 HG1 THR 90 -4.564 11.682 -7.996 725 HG21 THR 90 HG21 THR 90 -5.130 13.662 -10.827 726 HG22 THR 90 HG22 THR 90 -4.553 12.043 -11.213 727 HG23 THR 90 HG23 THR 90 -6.233 12.475 -11.526 728 H ASP 91 HN ASP 91 -7.219 14.966 -7.781 729 HA ASP 91 HA ASP 91 -8.153 16.586 -10.024 730 HB2 ASP 91 HB2 ASP 91 -8.989 16.862 -7.649 731 HB3 ASP 91 HB1 ASP 91 -7.392 17.490 -7.249 732 H TYR 92 HN TYR 92 -5.277 15.880 -8.234 733 HA TYR 92 HA TYR 92 -3.089 16.464 -8.496 734 HB2 TYR 92 HB2 TYR 92 -4.266 16.466 -11.153 735 HB3 TYR 92 HB1 TYR 92 -2.969 17.652 -11.057 736 HD1 TYR 92 HD2 TYR 92 -3.436 14.325 -9.382 737 HD2 TYR 92 HD1 TYR 92 -1.061 16.720 -12.045 738 HE1 TYR 92 HE2 TYR 92 -1.767 12.501 -9.537 739 HE2 TYR 92 HE1 TYR 92 0.606 14.891 -12.196 740 HH TYR 92 HH TYR 92 0.921 12.660 -11.793 741 H LYS 93 HN LYS 93 -5.288 18.622 -7.745 742 HA LYS 93 HA LYS 93 -3.349 20.776 -7.607 743 HB2 LYS 93 HB2 LYS 93 -5.934 20.968 -9.157 744 HB3 LYS 93 HB1 LYS 93 -5.102 22.387 -8.524 745 HG2 LYS 93 HG2 LYS 93 -3.024 21.574 -9.750 746 HG3 LYS 93 HG1 LYS 93 -4.062 20.389 -10.546 747 HD2 LYS 93 HD2 LYS 93 -5.493 22.218 -11.393 748 HD3 LYS 93 HD1 LYS 93 -4.436 23.398 -10.618 749 HE2 LYS 93 HE2 LYS 93 -3.839 23.182 -12.984 750 HE3 LYS 93 HE1 LYS 93 -2.534 22.552 -11.978 751 HZ1 LYS 93 HZ1 LYS 93 -3.746 21.224 -14.007 752 HZ2 LYS 93 HZ2 LYS 93 -2.820 20.508 -12.776 753 HZ3 LYS 93 HZ3 LYS 93 -4.509 20.578 -12.633 754 H SER 94 HN SER 94 -6.495 19.403 -6.845 755 HA SER 94 HA SER 94 -6.657 21.147 -4.449 756 HB2 SER 94 HB2 SER 94 -9.031 20.992 -4.558 757 HB3 SER 94 HB1 SER 94 -8.485 21.365 -6.191 758 HG SER 94 HG SER 94 -9.590 19.638 -6.679 759 H TYR 95 HN TYR 95 -7.874 17.950 -5.525 760 HA TYR 95 HA TYR 95 -6.693 16.659 -3.204 761 HB2 TYR 95 HB2 TYR 95 -8.987 15.720 -2.553 762 HB3 TYR 95 HB1 TYR 95 -8.661 17.393 -2.100 763 HD1 TYR 95 HD2 TYR 95 -10.478 15.197 -4.453 764 HD2 TYR 95 HD1 TYR 95 -9.795 19.243 -3.180 765 HE1 TYR 95 HE2 TYR 95 -12.440 15.943 -5.774 766 HE2 TYR 95 HE1 TYR 95 -11.757 19.989 -4.501 767 HH TYR 95 HH TYR 95 -13.500 19.343 -5.725 768 H ALA 96 HN ALA 96 -7.027 14.270 -3.280 769 HA ALA 96 HA ALA 96 -8.001 13.256 -5.856 770 HB1 ALA 96 HB1 ALA 96 -5.166 12.861 -4.884 771 HB2 ALA 96 HB2 ALA 96 -5.667 13.738 -6.326 772 HB3 ALA 96 HB3 ALA 96 -5.893 11.991 -6.227 773 H VAL 97 HN VAL 97 -8.657 11.185 -5.861 774 HA VAL 97 HA VAL 97 -8.453 9.662 -3.314 775 HB VAL 97 HB VAL 97 -10.700 9.262 -5.283 776 HG11 VAL 97 HG11 VAL 97 -10.372 8.857 -2.296 777 HG12 VAL 97 HG12 VAL 97 -11.855 8.540 -3.192 778 HG13 VAL 97 HG13 VAL 97 -10.405 7.597 -3.528 779 HG21 VAL 97 HG21 VAL 97 -12.020 10.819 -3.723 780 HG22 VAL 97 HG22 VAL 97 -10.453 11.406 -3.166 781 HG23 VAL 97 HG23 VAL 97 -10.915 11.596 -4.857 782 H ILE 98 HN ILE 98 -7.242 7.866 -3.555 783 HA ILE 98 HA ILE 98 -7.066 6.662 -6.253 784 HB ILE 98 HB ILE 98 -4.825 6.810 -4.245 785 HG12 ILE 98 HG12 ILE 98 -5.424 8.740 -6.517 786 HG13 ILE 98 HG11 ILE 98 -5.611 9.112 -4.805 787 HG21 ILE 98 HG21 ILE 98 -4.888 5.190 -6.277 788 HG22 ILE 98 HG22 ILE 98 -4.645 6.641 -7.249 789 HG23 ILE 98 HG23 ILE 98 -3.445 6.177 -6.046 790 HD11 ILE 98 HD11 ILE 98 -3.130 8.802 -6.413 791 HD12 ILE 98 HD12 ILE 98 -3.490 9.934 -5.109 792 HD13 ILE 98 HD13 ILE 98 -3.086 8.260 -4.732 793 H TYR 99 HN TYR 99 -6.814 4.459 -6.369 794 HA TYR 99 HA TYR 99 -7.721 2.978 -3.998 795 HB2 TYR 99 HB2 TYR 99 -8.694 2.823 -6.437 796 HB3 TYR 99 HB1 TYR 99 -7.328 1.747 -6.713 797 HD1 TYR 99 HD1 TYR 99 -10.320 2.307 -4.569 798 HD2 TYR 99 HD2 TYR 99 -7.323 -0.482 -5.870 799 HE1 TYR 99 HE1 TYR 99 -11.562 0.464 -3.473 800 HE2 TYR 99 HE2 TYR 99 -8.566 -2.326 -4.771 801 HH TYR 99 HH TYR 99 -11.767 -1.847 -3.441 802 H ALA 100 HN ALA 100 -6.097 2.443 -2.723 803 HA ALA 100 HA ALA 100 -3.562 1.439 -3.868 804 HB1 ALA 100 HB1 ALA 100 -4.288 2.416 -1.103 805 HB2 ALA 100 HB2 ALA 100 -3.214 3.189 -2.268 806 HB3 ALA 100 HB3 ALA 100 -2.736 1.678 -1.496 807 H THR 101 HN THR 101 -2.782 -0.576 -3.443 808 HA THR 101 HA THR 101 -4.302 -2.352 -1.665 809 HB THR 101 HB THR 101 -5.368 -2.733 -3.791 810 HG1 THR 101 HG1 THR 101 -3.604 -4.842 -3.888 811 HG21 THR 101 HG21 THR 101 -3.499 -1.738 -5.152 812 HG22 THR 101 HG22 THR 101 -2.614 -3.248 -4.936 813 HG23 THR 101 HG23 THR 101 -4.143 -3.241 -5.811 814 H ARG 102 HN ARG 102 -3.040 -3.671 -0.541 815 HA ARG 102 HA ARG 102 -0.235 -4.064 -1.406 816 HB2 ARG 102 HB2 ARG 102 -0.349 -2.665 0.606 817 HB3 ARG 102 HB1 ARG 102 -1.351 -3.878 1.403 818 HG2 ARG 102 HG2 ARG 102 0.453 -5.501 1.324 819 HG3 ARG 102 HG1 ARG 102 1.446 -4.408 0.360 820 HD2 ARG 102 HD2 ARG 102 1.420 -2.775 2.237 821 HD3 ARG 102 HD1 ARG 102 0.501 -3.927 3.201 822 HE ARG 102 HE ARG 102 2.452 -5.179 3.496 823 HH11 ARG 102 HH21 ARG 102 2.847 -2.721 1.094 824 HH12 ARG 102 HH22 ARG 102 4.564 -2.918 0.976 825 HH21 ARG 102 HH11 ARG 102 4.704 -5.442 3.348 826 HH22 ARG 102 HH12 ARG 102 5.616 -4.458 2.252 827 H VAL 103 HN VAL 103 0.277 -6.222 -1.826 828 HA VAL 103 HA VAL 103 -1.582 -8.224 -0.690 829 HB VAL 103 HB VAL 103 -1.752 -8.013 -3.125 830 HG11 VAL 103 HG11 VAL 103 1.104 -8.939 -3.376 831 HG12 VAL 103 HG12 VAL 103 0.074 -8.174 -4.585 832 HG13 VAL 103 HG13 VAL 103 0.735 -7.219 -3.260 833 HG21 VAL 103 HG21 VAL 103 -0.263 -10.527 -2.292 834 HG22 VAL 103 HG22 VAL 103 -1.992 -10.252 -2.086 835 HG23 VAL 103 HG23 VAL 103 -1.304 -10.360 -3.703 836 H LYS 104 HN LYS 104 -0.698 -9.402 0.867 837 HA LYS 104 HA LYS 104 2.212 -9.757 0.956 838 HB2 LYS 104 HB2 LYS 104 0.077 -10.433 2.999 839 HB3 LYS 104 HB1 LYS 104 1.820 -10.541 3.244 840 HG2 LYS 104 HG2 LYS 104 2.011 -8.103 2.802 841 HG3 LYS 104 HG1 LYS 104 0.256 -8.013 2.647 842 HD2 LYS 104 HD2 LYS 104 0.076 -8.962 4.974 843 HD3 LYS 104 HD1 LYS 104 1.828 -8.805 5.113 844 HE2 LYS 104 HE2 LYS 104 0.789 -6.835 6.094 845 HE3 LYS 104 HE1 LYS 104 1.602 -6.366 4.600 846 HZ1 LYS 104 HZ1 LYS 104 -0.680 -5.464 4.850 847 HZ2 LYS 104 HZ2 LYS 104 -0.458 -6.383 3.440 848 HZ3 LYS 104 HZ3 LYS 104 -1.279 -7.051 4.765 849 H ASP 105 HN ASP 105 2.894 -12.002 1.727 850 HA ASP 105 HA ASP 105 2.201 -13.892 -0.214 851 HB2 ASP 105 HB2 ASP 105 3.422 -14.333 2.520 852 HB3 ASP 105 HB1 ASP 105 3.410 -15.512 1.209 853 H GLY 106 HN GLY 106 0.220 -14.674 -0.473 854 HA2 GLY 106 HA2 GLY 106 -1.489 -16.193 -0.005 855 HA3 GLY 106 HA1 GLY 106 -0.989 -16.210 1.679 856 H ARG 107 HN ARG 107 -1.203 -12.998 1.015 857 HA ARG 107 HA ARG 107 -4.124 -12.875 1.493 858 HB2 ARG 107 HB2 ARG 107 -2.822 -12.739 3.645 859 HB3 ARG 107 HB1 ARG 107 -2.114 -11.241 3.041 860 HG2 ARG 107 HG2 ARG 107 -4.358 -10.259 2.804 861 HG3 ARG 107 HG1 ARG 107 -5.081 -11.761 3.382 862 HD2 ARG 107 HD2 ARG 107 -3.785 -11.500 5.509 863 HD3 ARG 107 HD1 ARG 107 -3.231 -9.931 4.933 864 HE ARG 107 HE ARG 107 -5.316 -9.067 5.468 865 HH11 ARG 107 HH21 ARG 107 -5.420 -12.521 5.272 866 HH12 ARG 107 HH22 ARG 107 -7.044 -12.642 5.862 867 HH21 ARG 107 HH11 ARG 107 -7.445 -9.220 6.242 868 HH22 ARG 107 HH12 ARG 107 -8.191 -10.773 6.412 869 H THR 108 HN THR 108 -5.187 -11.129 0.708 870 HA THR 108 HA THR 108 -3.636 -9.143 -0.857 871 HB THR 108 HB THR 108 -6.359 -10.307 -1.502 872 HG1 THR 108 HG1 THR 108 -5.190 -11.180 -3.282 873 HG21 THR 108 HG21 THR 108 -5.979 -9.037 -3.655 874 HG22 THR 108 HG22 THR 108 -6.242 -8.018 -2.240 875 HG23 THR 108 HG23 THR 108 -4.611 -8.248 -2.869 876 H LEU 109 HN LEU 109 -4.426 -6.984 -0.811 877 HA LEU 109 HA LEU 109 -6.693 -6.432 0.982 878 HB2 LEU 109 HB2 LEU 109 -4.789 -6.433 2.444 879 HB3 LEU 109 HB1 LEU 109 -3.892 -5.386 1.378 880 HG LEU 109 HG LEU 109 -5.637 -3.615 1.763 881 HD11 LEU 109 HD11 LEU 109 -6.672 -5.749 3.637 882 HD12 LEU 109 HD12 LEU 109 -7.023 -4.041 3.898 883 HD13 LEU 109 HD13 LEU 109 -7.566 -4.838 2.422 884 HD21 LEU 109 HD21 LEU 109 -3.456 -3.966 3.117 885 HD22 LEU 109 HD22 LEU 109 -4.691 -2.917 3.810 886 HD23 LEU 109 HD23 LEU 109 -4.510 -4.571 4.392 887 H HIS 110 HN HIS 110 -7.653 -4.513 0.709 888 HA HIS 110 HA HIS 110 -6.583 -2.709 -1.336 889 HB2 HIS 110 HB2 HIS 110 -9.518 -3.414 -1.148 890 HB3 HIS 110 HB1 HIS 110 -8.721 -2.467 -2.404 891 HD1 HIS 110 HD1 HIS 110 -6.782 -3.883 -3.771 892 HD2 HIS 110 HD2 HIS 110 -9.693 -6.101 -1.774 893 HE1 HIS 110 HE1 HIS 110 -6.720 -6.210 -4.769 894 H MET 111 HN MET 111 -7.087 -0.459 -0.995 895 HA MET 111 HA MET 111 -8.793 0.273 1.203 896 HB2 MET 111 HB2 MET 111 -6.805 1.561 2.285 897 HB3 MET 111 HB1 MET 111 -6.989 -0.159 2.628 898 HG2 MET 111 HG2 MET 111 -5.275 -0.754 1.092 899 HG3 MET 111 HG1 MET 111 -5.275 0.846 0.353 900 HE1 MET 111 HE1 MET 111 -4.479 2.867 1.219 901 HE2 MET 111 HE2 MET 111 -3.089 3.000 2.294 902 HE3 MET 111 HE3 MET 111 -2.962 2.089 0.784 903 H MET 112 HN MET 112 -9.181 2.541 1.316 904 HA MET 112 HA MET 112 -8.488 3.951 -1.193 905 HB2 MET 112 HB2 MET 112 -10.431 5.137 0.741 906 HB3 MET 112 HB1 MET 112 -10.441 5.170 -1.012 907 HG2 MET 112 HG2 MET 112 -10.956 2.600 0.477 908 HG3 MET 112 HG1 MET 112 -12.244 3.769 0.220 909 HE1 MET 112 HE1 MET 112 -12.743 4.867 -1.749 910 HE2 MET 112 HE2 MET 112 -11.568 4.874 -3.061 911 HE3 MET 112 HE3 MET 112 -13.086 3.983 -3.233 912 H ARG 113 HN ARG 113 -7.380 5.868 -1.154 913 HA ARG 113 HA ARG 113 -6.568 6.915 1.503 914 HB2 ARG 113 HB2 ARG 113 -4.677 5.732 0.631 915 HB3 ARG 113 HB1 ARG 113 -4.887 6.445 -0.964 916 HG2 ARG 113 HG2 ARG 113 -4.577 8.408 1.251 917 HG3 ARG 113 HG1 ARG 113 -3.158 7.415 0.942 918 HD2 ARG 113 HD2 ARG 113 -3.469 8.046 -1.541 919 HD3 ARG 113 HD1 ARG 113 -4.572 9.289 -0.958 920 HE ARG 113 HE ARG 113 -2.267 9.587 0.535 921 HH11 ARG 113 HH21 ARG 113 -3.162 9.576 -2.805 922 HH12 ARG 113 HH22 ARG 113 -1.908 10.668 -3.289 923 HH21 ARG 113 HH11 ARG 113 -0.617 11.021 -0.090 924 HH22 ARG 113 HH12 ARG 113 -0.468 11.487 -1.751 925 H LEU 114 HN LEU 114 -6.959 9.020 1.776 926 HA LEU 114 HA LEU 114 -7.578 10.662 -0.605 927 HB2 LEU 114 HB2 LEU 114 -9.539 10.344 0.751 928 HB3 LEU 114 HB1 LEU 114 -8.652 10.736 2.207 929 HG LEU 114 HG LEU 114 -8.335 13.044 1.443 930 HD11 LEU 114 HD11 LEU 114 -8.151 12.895 -0.905 931 HD12 LEU 114 HD12 LEU 114 -9.639 11.960 -1.052 932 HD13 LEU 114 HD13 LEU 114 -9.711 13.680 -0.668 933 HD21 LEU 114 HD21 LEU 114 -10.717 13.763 1.446 934 HD22 LEU 114 HD22 LEU 114 -11.205 12.090 1.182 935 HD23 LEU 114 HD23 LEU 114 -10.395 12.545 2.680 936 H TYR 115 HN TYR 115 -6.300 12.290 -0.990 937 HA TYR 115 HA TYR 115 -4.589 13.344 1.172 938 HB2 TYR 115 HB2 TYR 115 -2.753 12.949 -0.110 939 HB3 TYR 115 HB1 TYR 115 -3.803 11.998 -1.147 940 HD1 TYR 115 HD1 TYR 115 -5.371 13.621 -2.717 941 HD2 TYR 115 HD2 TYR 115 -1.443 14.527 -1.238 942 HE1 TYR 115 HE1 TYR 115 -5.043 15.229 -4.576 943 HE2 TYR 115 HE2 TYR 115 -1.120 16.140 -3.096 944 HH TYR 115 HH TYR 115 -2.160 17.271 -4.747 945 H SER 116 HN SER 116 -3.902 15.547 0.921 946 HA SER 116 HA SER 116 -5.812 17.249 -0.587 947 HB2 SER 116 HB2 SER 116 -6.235 17.444 1.813 948 HB3 SER 116 HB1 SER 116 -4.523 17.751 2.114 949 HG SER 116 HG SER 116 -5.234 19.750 1.910 950 H ARG 117 HN ARG 117 -4.920 19.153 -1.567 951 HA ARG 117 HA ARG 117 -2.109 18.911 -2.222 952 HB2 ARG 117 HB2 ARG 117 -3.823 19.554 -3.912 953 HB3 ARG 117 HB1 ARG 117 -4.124 21.033 -3.009 954 HG2 ARG 117 HG2 ARG 117 -2.573 21.493 -4.846 955 HG3 ARG 117 HG1 ARG 117 -1.741 21.679 -3.307 956 HD2 ARG 117 HD2 ARG 117 -1.658 18.985 -4.606 957 HD3 ARG 117 HD1 ARG 117 -0.674 20.264 -5.309 958 HE ARG 117 HE ARG 117 -0.156 18.894 -2.856 959 HH11 ARG 117 HH21 ARG 117 0.022 21.960 -4.451 960 HH12 ARG 117 HH22 ARG 117 1.358 22.529 -3.507 961 HH21 ARG 117 HH11 ARG 117 1.596 19.634 -1.615 962 HH22 ARG 117 HH12 ARG 117 2.249 21.212 -1.901 963 H SER 118 HN SER 118 -4.137 20.695 -0.081 964 HA SER 118 HA SER 118 -1.835 22.349 0.781 965 HB2 SER 118 HB2 SER 118 -3.571 23.708 -0.303 966 HB3 SER 118 HB1 SER 118 -4.777 23.064 0.804 967 HG SER 118 HG SER 118 -3.999 25.047 1.556 968 HA PRO 119 HA PRO 119 -1.879 20.483 4.795 969 HB2 PRO 119 HB2 PRO 119 -2.356 23.305 5.716 970 HB3 PRO 119 HB1 PRO 119 -1.224 22.094 6.353 971 HG2 PRO 119 HG2 PRO 119 -0.429 24.067 4.711 972 HG3 PRO 119 HG1 PRO 119 0.315 22.460 4.693 973 HD2 PRO 119 HD2 PRO 119 -1.398 23.723 2.655 974 HD3 PRO 119 HD1 PRO 119 -0.341 22.304 2.508 975 H GLU 120 HN GLU 120 -4.441 22.635 3.758 976 HA GLU 120 HA GLU 120 -6.270 21.698 5.844 977 HB2 GLU 120 HB2 GLU 120 -6.702 23.684 3.601 978 HB3 GLU 120 HB1 GLU 120 -7.810 23.364 4.936 979 HG2 GLU 120 HG2 GLU 120 -6.592 25.310 5.579 980 HG3 GLU 120 HG1 GLU 120 -5.885 23.984 6.499 981 H VAL 121 HN VAL 121 -8.482 21.095 5.114 982 HA VAL 121 HA VAL 121 -8.372 19.371 2.701 983 HB VAL 121 HB VAL 121 -10.091 18.908 5.141 984 HG11 VAL 121 HG11 VAL 121 -10.648 17.881 2.864 985 HG12 VAL 121 HG12 VAL 121 -9.147 16.970 3.019 986 HG13 VAL 121 HG13 VAL 121 -10.441 16.742 4.195 987 HG21 VAL 121 HG21 VAL 121 -7.303 17.931 4.475 988 HG22 VAL 121 HG22 VAL 121 -7.838 18.751 5.942 989 HG23 VAL 121 HG23 VAL 121 -8.353 17.096 5.619 990 H SER 122 HN SER 122 -9.796 19.812 1.148 991 HA SER 122 HA SER 122 -11.715 21.930 1.495 992 HB2 SER 122 HB2 SER 122 -10.387 21.502 -0.609 993 HB3 SER 122 HB1 SER 122 -11.410 20.094 -0.880 994 HG SER 122 HG SER 122 -12.157 22.041 -1.912 995 HA PRO 123 HA PRO 123 -14.967 19.236 3.125 996 HB2 PRO 123 HB2 PRO 123 -16.616 21.298 1.688 997 HB3 PRO 123 HB1 PRO 123 -16.844 20.606 3.307 998 HG2 PRO 123 HG2 PRO 123 -15.784 23.025 2.982 999 HG3 PRO 123 HG1 PRO 123 -15.211 21.928 4.250 1000 HD2 PRO 123 HD2 PRO 123 -13.862 22.735 1.722 1001 HD3 PRO 123 HD1 PRO 123 -13.152 22.167 3.251 1002 H ALA 124 HN ALA 124 -14.716 20.342 -0.201 1003 HA ALA 124 HA ALA 124 -16.640 18.516 -1.288 1004 HB1 ALA 124 HB1 ALA 124 -16.147 20.488 -2.554 1005 HB2 ALA 124 HB2 ALA 124 -15.512 19.123 -3.472 1006 HB3 ALA 124 HB3 ALA 124 -14.417 20.141 -2.536 1007 H ALA 125 HN ALA 125 -13.180 18.439 -0.683 1008 HA ALA 125 HA ALA 125 -12.553 16.142 -2.212 1009 HB1 ALA 125 HB1 ALA 125 -11.235 17.163 0.315 1010 HB2 ALA 125 HB2 ALA 125 -10.851 17.697 -1.320 1011 HB3 ALA 125 HB3 ALA 125 -10.528 16.032 -0.837 1012 H THR 126 HN THR 126 -13.669 16.589 1.093 1013 HA THR 126 HA THR 126 -13.448 13.804 1.782 1014 HB THR 126 HB THR 126 -15.254 15.644 3.298 1015 HG1 THR 126 HG1 THR 126 -13.714 17.050 3.371 1016 HG21 THR 126 HG21 THR 126 -13.141 13.614 4.089 1017 HG22 THR 126 HG22 THR 126 -14.170 14.498 5.214 1018 HG23 THR 126 HG23 THR 126 -14.883 13.341 4.090 1019 H ALA 127 HN ALA 127 -15.981 15.889 0.438 1020 HA ALA 127 HA ALA 127 -18.098 14.027 0.869 1021 HB1 ALA 127 HB1 ALA 127 -17.967 16.273 -1.129 1022 HB2 ALA 127 HB2 ALA 127 -18.325 16.509 0.582 1023 HB3 ALA 127 HB3 ALA 127 -19.407 15.542 -0.421 1024 H ILE 128 HN ILE 128 -16.167 14.929 -2.029 1025 HA ILE 128 HA ILE 128 -17.474 13.200 -3.823 1026 HB ILE 128 HB ILE 128 -15.639 15.061 -4.172 1027 HG12 ILE 128 HG12 ILE 128 -16.752 13.952 -6.012 1028 HG13 ILE 128 HG11 ILE 128 -15.026 14.027 -6.337 1029 HG21 ILE 128 HG21 ILE 128 -13.874 12.600 -4.125 1030 HG22 ILE 128 HG22 ILE 128 -13.388 14.263 -4.450 1031 HG23 ILE 128 HG23 ILE 128 -13.916 13.801 -2.835 1032 HD11 ILE 128 HD11 ILE 128 -16.695 11.649 -5.568 1033 HD12 ILE 128 HD12 ILE 128 -15.547 11.807 -6.894 1034 HD13 ILE 128 HD13 ILE 128 -14.964 11.650 -5.238 1035 H PHE 129 HN PHE 129 -14.878 12.865 -1.594 1036 HA PHE 129 HA PHE 129 -13.923 10.304 -2.030 1037 HB2 PHE 129 HB2 PHE 129 -13.010 11.842 -0.338 1038 HB3 PHE 129 HB1 PHE 129 -14.445 11.579 0.649 1039 HD1 PHE 129 HD1 PHE 129 -14.926 9.389 1.650 1040 HD2 PHE 129 HD2 PHE 129 -11.336 10.106 -0.586 1041 HE1 PHE 129 HE1 PHE 129 -13.953 7.294 2.548 1042 HE2 PHE 129 HE2 PHE 129 -10.350 8.017 0.324 1043 HZ PHE 129 HZ PHE 129 -11.664 6.615 1.894 1044 H ARG 130 HN ARG 130 -16.777 11.334 -0.202 1045 HA ARG 130 HA ARG 130 -17.521 8.738 0.706 1046 HB2 ARG 130 HB2 ARG 130 -18.314 10.654 1.903 1047 HB3 ARG 130 HB1 ARG 130 -19.061 11.325 0.457 1048 HG2 ARG 130 HG2 ARG 130 -20.727 9.611 0.402 1049 HG3 ARG 130 HG1 ARG 130 -19.872 8.646 1.604 1050 HD2 ARG 130 HD2 ARG 130 -21.179 11.341 2.060 1051 HD3 ARG 130 HD1 ARG 130 -21.749 9.789 2.666 1052 HE ARG 130 HE ARG 130 -19.543 11.361 3.723 1053 HH11 ARG 130 HH21 ARG 130 -21.110 8.283 3.494 1054 HH12 ARG 130 HH22 ARG 130 -20.422 7.670 4.960 1055 HH21 ARG 130 HH11 ARG 130 -18.637 10.562 5.645 1056 HH22 ARG 130 HH12 ARG 130 -19.021 8.960 6.178 1057 H LYS 131 HN LYS 131 -18.504 10.677 -2.117 1058 HA LYS 131 HA LYS 131 -20.680 9.232 -2.988 1059 HB2 LYS 131 HB2 LYS 131 -18.493 10.463 -4.674 1060 HB3 LYS 131 HB1 LYS 131 -20.079 9.976 -5.270 1061 HG2 LYS 131 HG2 LYS 131 -21.130 11.520 -3.610 1062 HG3 LYS 131 HG1 LYS 131 -19.519 12.069 -3.150 1063 HD2 LYS 131 HD2 LYS 131 -19.114 12.735 -5.526 1064 HD3 LYS 131 HD1 LYS 131 -20.783 12.300 -5.896 1065 HE2 LYS 131 HE2 LYS 131 -19.916 14.381 -3.867 1066 HE3 LYS 131 HE1 LYS 131 -20.578 14.723 -5.465 1067 HZ1 LYS 131 HZ1 LYS 131 -22.484 14.797 -4.280 1068 HZ2 LYS 131 HZ2 LYS 131 -22.454 13.119 -4.546 1069 HZ3 LYS 131 HZ3 LYS 131 -21.919 13.752 -3.066 1070 H LEU 132 HN LEU 132 -17.329 8.660 -4.128 1071 HA LEU 132 HA LEU 132 -17.959 6.266 -5.483 1072 HB2 LEU 132 HB2 LEU 132 -15.452 5.831 -5.288 1073 HB3 LEU 132 HB1 LEU 132 -15.939 7.311 -6.104 1074 HG LEU 132 HG LEU 132 -15.749 8.113 -3.429 1075 HD11 LEU 132 HD11 LEU 132 -13.324 6.412 -4.029 1076 HD12 LEU 132 HD12 LEU 132 -13.710 7.258 -2.531 1077 HD13 LEU 132 HD13 LEU 132 -14.656 5.851 -3.018 1078 HD21 LEU 132 HD21 LEU 132 -14.941 9.298 -5.494 1079 HD22 LEU 132 HD22 LEU 132 -13.791 9.348 -4.160 1080 HD23 LEU 132 HD23 LEU 132 -13.536 8.232 -5.500 1081 H ALA 133 HN ALA 133 -16.698 6.855 -2.216 1082 HA ALA 133 HA ALA 133 -16.280 4.215 -1.439 1083 HB1 ALA 133 HB1 ALA 133 -16.336 4.981 0.790 1084 HB2 ALA 133 HB2 ALA 133 -17.430 6.305 0.397 1085 HB3 ALA 133 HB3 ALA 133 -15.754 6.354 -0.146 1086 H GLY 134 HN GLY 134 -19.280 6.119 -1.535 1087 HA2 GLY 134 HA2 GLY 134 -20.923 4.245 -0.192 1088 HA3 GLY 134 HA1 GLY 134 -21.477 5.484 -1.319 1089 H GLU 135 HN GLU 135 -19.910 4.663 -3.536 1090 HA GLU 135 HA GLU 135 -21.606 2.723 -4.705 1091 HB2 GLU 135 HB2 GLU 135 -20.192 4.491 -5.900 1092 HB3 GLU 135 HB1 GLU 135 -18.823 3.406 -5.661 1093 HG2 GLU 135 HG2 GLU 135 -20.076 1.603 -6.824 1094 HG3 GLU 135 HG1 GLU 135 -21.398 2.731 -7.112 1095 H ARG 136 HN ARG 136 -18.927 2.499 -2.601 1096 HA ARG 136 HA ARG 136 -18.384 -0.304 -3.338 1097 HB2 ARG 136 HB2 ARG 136 -16.548 1.516 -2.946 1098 HB3 ARG 136 HB1 ARG 136 -16.887 1.249 -1.237 1099 HG2 ARG 136 HG2 ARG 136 -16.485 -1.195 -1.584 1100 HG3 ARG 136 HG1 ARG 136 -16.031 -0.850 -3.254 1101 HD2 ARG 136 HD2 ARG 136 -14.255 0.688 -2.405 1102 HD3 ARG 136 HD1 ARG 136 -14.666 0.205 -0.761 1103 HE ARG 136 HE ARG 136 -13.072 -1.281 -2.605 1104 HH11 ARG 136 HH21 ARG 136 -15.463 -1.559 -0.119 1105 HH12 ARG 136 HH22 ARG 136 -14.968 -3.145 0.370 1106 HH21 ARG 136 HH11 ARG 136 -12.417 -3.360 -1.969 1107 HH22 ARG 136 HH12 ARG 136 -13.244 -4.165 -0.677 1108 H ASN 137 HN ASN 137 -20.613 1.186 -1.638 1109 HA ASN 137 HA ASN 137 -21.941 0.681 0.186 1110 HB2 ASN 137 HB2 ASN 137 -20.642 -1.996 -0.148 1111 HB3 ASN 137 HB1 ASN 137 -22.172 -1.686 0.667 1112 HD21 ASN 137 HD21 ASN 137 -24.040 -1.136 -0.686 1113 HD22 ASN 137 HD22 ASN 137 -24.021 -1.408 -2.362 1114 H TYR 138 HN TYR 138 -19.379 1.769 0.797 1115 HA TYR 138 HA TYR 138 -18.316 0.292 3.069 1116 HB2 TYR 138 HB2 TYR 138 -16.541 1.777 3.015 1117 HB3 TYR 138 HB1 TYR 138 -17.076 1.880 1.338 1118 HD1 TYR 138 HD1 TYR 138 -19.514 3.491 1.506 1119 HD2 TYR 138 HD2 TYR 138 -15.797 3.928 3.610 1120 HE1 TYR 138 HE1 TYR 138 -19.978 5.905 1.821 1121 HE2 TYR 138 HE2 TYR 138 -16.265 6.334 3.917 1122 HH TYR 138 HH TYR 138 -18.196 7.842 3.985 1123 H THR 139 HN THR 139 -17.991 1.525 5.167 1124 HA THR 139 HA THR 139 -20.384 3.153 5.828 1125 HB THR 139 HB THR 139 -20.840 1.885 7.667 1126 HG1 THR 139 HG1 THR 139 -18.890 2.564 8.664 1127 HG21 THR 139 HG21 THR 139 -20.546 -0.406 7.302 1128 HG22 THR 139 HG22 THR 139 -20.336 0.250 5.680 1129 HG23 THR 139 HG23 THR 139 -18.929 -0.197 6.642 1130 H ASP 140 HN ASP 140 -20.056 4.801 7.452 1131 HA ASP 140 HA ASP 140 -17.893 6.407 7.124 1132 HB2 ASP 140 HB2 ASP 140 -18.434 7.458 9.272 1133 HB3 ASP 140 HB1 ASP 140 -19.901 7.075 8.371 1134 H GLU 141 HN GLU 141 -18.143 4.011 9.816 1135 HA GLU 141 HA GLU 141 -15.675 4.513 10.952 1136 HB2 GLU 141 HB2 GLU 141 -17.501 2.968 11.798 1137 HB3 GLU 141 HB1 GLU 141 -16.874 1.754 10.682 1138 HG2 GLU 141 HG2 GLU 141 -14.663 1.894 11.750 1139 HG3 GLU 141 HG1 GLU 141 -15.264 3.131 12.852 1140 H MET 142 HN MET 142 -16.359 3.072 7.900 1141 HA MET 142 HA MET 142 -13.903 1.589 7.677 1142 HB2 MET 142 HB2 MET 142 -15.693 2.515 5.434 1143 HB3 MET 142 HB1 MET 142 -14.557 1.174 5.420 1144 HG2 MET 142 HG2 MET 142 -16.027 0.384 7.515 1145 HG3 MET 142 HG1 MET 142 -17.246 1.359 6.709 1146 HE1 MET 142 HE1 MET 142 -15.096 -2.366 5.570 1147 HE2 MET 142 HE2 MET 142 -14.395 -1.026 4.667 1148 HE3 MET 142 HE3 MET 142 -14.503 -0.950 6.430 1149 H VAL 143 HN VAL 143 -14.748 4.854 7.371 1150 HA VAL 143 HA VAL 143 -12.151 5.427 6.045 1151 HB VAL 143 HB VAL 143 -14.076 6.016 4.570 1152 HG11 VAL 143 HG11 VAL 143 -15.476 7.956 5.178 1153 HG12 VAL 143 HG12 VAL 143 -15.702 6.636 6.322 1154 HG13 VAL 143 HG13 VAL 143 -14.713 8.028 6.753 1155 HG21 VAL 143 HG21 VAL 143 -12.172 8.097 5.634 1156 HG22 VAL 143 HG22 VAL 143 -12.154 7.269 4.083 1157 HG23 VAL 143 HG23 VAL 143 -13.337 8.534 4.389 1158 H ALA 144 HN ALA 144 -10.758 6.471 7.290 1159 HA ALA 144 HA ALA 144 -11.804 7.876 9.675 1160 HB1 ALA 144 HB1 ALA 144 -10.361 6.110 10.330 1161 HB2 ALA 144 HB2 ALA 144 -9.409 7.587 10.481 1162 HB3 ALA 144 HB3 ALA 144 -9.172 6.523 9.095 1163 H MET 145 HN MET 145 -11.973 10.010 9.339 1164 HA MET 145 HA MET 145 -10.219 11.430 7.563 1165 HB2 MET 145 HB2 MET 145 -12.349 12.315 7.433 1166 HB3 MET 145 HB1 MET 145 -12.735 11.879 9.087 1167 HG2 MET 145 HG2 MET 145 -12.373 14.000 9.722 1168 HG3 MET 145 HG1 MET 145 -10.708 13.879 9.203 1169 HE1 MET 145 HE1 MET 145 -10.128 13.659 6.854 1170 HE2 MET 145 HE2 MET 145 -11.433 13.501 5.681 1171 HE3 MET 145 HE3 MET 145 -10.464 14.978 5.740 1172 H LEU 146 HN LEU 146 -8.603 12.929 8.287 1173 HA LEU 146 HA LEU 146 -8.044 12.877 11.124 1174 HB2 LEU 146 HB2 LEU 146 -6.652 11.488 9.236 1175 HB3 LEU 146 HB1 LEU 146 -5.766 13.008 9.238 1176 HG LEU 146 HG LEU 146 -5.264 12.824 11.508 1177 HD11 LEU 146 HD11 LEU 146 -7.028 11.951 12.810 1178 HD12 LEU 146 HD12 LEU 146 -7.468 10.781 11.568 1179 HD13 LEU 146 HD13 LEU 146 -6.103 10.474 12.635 1180 HD21 LEU 146 HD21 LEU 146 -4.013 11.326 9.933 1181 HD22 LEU 146 HD22 LEU 146 -3.990 10.783 11.607 1182 HD23 LEU 146 HD23 LEU 146 -5.057 10.013 10.448 1183 HA PRO 147 HA PRO 147 -8.084 17.297 10.619 1184 HB2 PRO 147 HB2 PRO 147 -7.001 18.042 12.981 1185 HB3 PRO 147 HB1 PRO 147 -8.592 17.255 12.894 1186 HG2 PRO 147 HG2 PRO 147 -5.920 16.013 13.454 1187 HG3 PRO 147 HG1 PRO 147 -7.432 15.848 14.366 1188 HD2 PRO 147 HD2 PRO 147 -6.659 14.003 12.600 1189 HD3 PRO 147 HD1 PRO 147 -8.374 14.405 12.805 1190 H ARG 148 HN ARG 148 -6.616 19.228 10.801 1191 HA ARG 148 HA ARG 148 -4.362 19.018 9.215 1192 HB2 ARG 148 HB2 ARG 148 -5.207 21.145 11.168 1193 HB3 ARG 148 HB1 ARG 148 -3.840 21.329 10.068 1194 HG2 ARG 148 HG2 ARG 148 -5.268 21.063 8.137 1195 HG3 ARG 148 HG1 ARG 148 -6.644 20.632 9.154 1196 HD2 ARG 148 HD2 ARG 148 -6.901 22.944 8.515 1197 HD3 ARG 148 HD1 ARG 148 -6.473 22.905 10.222 1198 HE ARG 148 HE ARG 148 -4.793 23.855 8.023 1199 HH11 ARG 148 HH21 ARG 148 -5.100 22.941 11.351 1200 HH12 ARG 148 HH22 ARG 148 -3.684 23.797 11.857 1201 HH21 ARG 148 HH11 ARG 148 -2.936 24.978 8.686 1202 HH22 ARG 148 HH12 ARG 148 -2.459 24.950 10.350 1203 H GLN 149 HN GLN 149 -4.629 18.024 12.388 1204 HA GLN 149 HA GLN 149 -2.303 18.819 13.657 1205 HB2 GLN 149 HB2 GLN 149 -3.645 16.117 13.811 1206 HB3 GLN 149 HB1 GLN 149 -2.492 16.757 14.981 1207 HG2 GLN 149 HG2 GLN 149 -5.048 18.200 14.254 1208 HG3 GLN 149 HG1 GLN 149 -4.951 17.052 15.587 1209 HE21 GLN 149 HE21 GLN 149 -5.362 20.065 15.636 1210 HE22 GLN 149 HE22 GLN 149 -4.130 20.648 16.648 1211 H GLU 150 HN GLU 150 -0.221 18.531 13.338 1212 HA GLU 150 HA GLU 150 0.737 16.198 11.775 1213 HB2 GLU 150 HB2 GLU 150 2.415 17.632 10.736 1214 HB3 GLU 150 HB1 GLU 150 0.802 18.263 10.402 1215 HG2 GLU 150 HG2 GLU 150 1.085 19.794 12.392 1216 HG3 GLU 150 HG1 GLU 150 2.766 19.269 12.476 1217 H GLU 151 HN GLU 151 2.533 15.171 12.594 1218 HA GLU 151 HA GLU 151 3.843 16.391 14.958 1219 HB2 GLU 151 HB2 GLU 151 2.183 14.421 15.384 1220 HB3 GLU 151 HB1 GLU 151 3.457 13.416 14.700 1221 HG2 GLU 151 HG2 GLU 151 3.811 15.318 17.034 1222 HG3 GLU 151 HG1 GLU 151 3.625 13.572 17.172 1223 H CYS 152 HN CYS 152 4.028 14.288 12.160 1224 HA CYS 152 HA CYS 152 6.985 14.510 12.219 1225 HB2 CYS 152 HB2 CYS 152 5.266 12.238 11.233 1226 HB3 CYS 152 HB1 CYS 152 6.990 12.370 10.937 1227 H THR 153 HN THR 153 7.966 15.115 10.373 1228 HA THR 153 HA THR 153 6.453 15.349 7.882 1229 HB THR 153 HB THR 153 6.586 17.663 7.675 1230 HG1 THR 153 HG1 THR 153 8.400 17.851 9.819 1231 HG21 THR 153 HG21 THR 153 6.408 17.290 10.682 1232 HG22 THR 153 HG22 THR 153 5.784 18.658 9.763 1233 HG23 THR 153 HG23 THR 153 5.068 17.063 9.563 1234 H VAL 154 HN VAL 154 7.847 15.787 6.029 1235 HA VAL 154 HA VAL 154 10.380 14.501 6.248 1236 HB VAL 154 HB VAL 154 10.465 14.694 3.895 1237 HG11 VAL 154 HG11 VAL 154 7.505 14.613 4.478 1238 HG12 VAL 154 HG12 VAL 154 8.370 13.790 3.181 1239 HG13 VAL 154 HG13 VAL 154 8.593 13.276 4.853 1240 HG21 VAL 154 HG21 VAL 154 10.140 17.001 3.486 1241 HG22 VAL 154 HG22 VAL 154 8.751 16.235 2.719 1242 HG23 VAL 154 HG23 VAL 154 8.574 17.008 4.295 1243 H ASP 155 HN ASP 155 12.352 15.494 5.460 1244 HA ASP 155 HA ASP 155 12.820 18.023 6.724 1245 HB2 ASP 155 HB2 ASP 155 14.604 16.427 6.750 1246 HB3 ASP 155 HB1 ASP 155 14.609 16.321 4.996 1247 H GLU 156 HN GLU 156 13.943 19.737 5.617 1248 HA GLU 156 HA GLU 156 12.365 20.826 3.535 1249 HB2 GLU 156 HB2 GLU 156 14.984 21.648 4.790 1250 HB3 GLU 156 HB1 GLU 156 14.183 22.593 3.542 1251 HG2 GLU 156 HG2 GLU 156 12.131 22.663 4.968 1252 HG3 GLU 156 HG1 GLU 156 13.033 21.837 6.238 1253 H VAL 157 HN VAL 157 15.506 19.225 3.623 1254 HA VAL 157 HA VAL 157 15.365 18.473 0.882 1255 HB VAL 157 HB VAL 157 15.935 20.886 0.613 1256 HG11 VAL 157 HG11 VAL 157 18.030 21.742 1.404 1257 HG12 VAL 157 HG12 VAL 157 17.268 20.950 2.783 1258 HG13 VAL 157 HG13 VAL 157 18.568 20.139 1.909 1259 HG21 VAL 157 HG21 VAL 157 17.823 20.501 -0.911 1260 HG22 VAL 157 HG22 VAL 157 18.166 18.962 -0.121 1261 HG23 VAL 157 HG23 VAL 157 16.671 19.172 -1.032 1262 HN1 EB4 200 H17 EB4 200 0.141 -0.921 5.684 1263 H8 EB4 200 H8 EB4 200 5.140 0.877 1.315 1264 HN2 EB4 200 H25 EB4 200 3.246 -0.223 6.520 1265 H9 EB4 200 H9 EB4 200 0.997 6.016 3.220 1266 H10 EB4 200 H10 EB4 200 -2.445 -0.765 0.356 1267 HN3 EB4 200 H32 EB4 200 0.670 1.864 7.265 1268 H7 EB4 200 H7 EB4 200 -0.828 1.112 0.352 1269 H11 EB4 200 H11 EB4 200 6.910 -0.692 2.061 1270 H12 EB4 200 H12 EB4 200 -0.037 7.315 5.063 1271 H15 EB4 200 H15 EB4 200 -0.373 6.265 7.284 1272 H14 EB4 200 H14 EB4 200 6.889 -1.574 4.378 1273 H13 EB4 200 H13 EB4 200 -2.665 -2.208 2.362 1274 H22 EB4 200 H22 EB4 200 -1.296 -3.205 6.882 1275 H30 EB4 200 H30 EB4 200 -0.918 0.012 10.036 1276 H30A EB4 200 H9N EB4 200 -1.780 1.116 8.858 1277 H24 EB4 200 H24 EB4 200 -0.067 2.345 10.096 1278 H28 EB4 200 H28 EB4 200 0.764 -3.727 8.101 1279 H28A EB4 200 H9L EB4 200 0.933 -3.887 6.345 1280 H23 EB4 200 H23 EB4 200 4.674 -1.762 8.638 1281 H29 EB4 200 H29 EB4 200 3.457 -0.363 10.262 1282 H29A EB4 200 H9M EB4 200 4.489 0.654 9.142 1283 H21 ACD 300 HA3 ACD 300 0.221 9.187 -11.933 1284 H22 ACD 300 HA4 ACD 300 0.465 10.547 -10.815 1285 H31 ACD 300 HA1 ACD 300 0.370 7.594 -10.054 1286 H32 ACD 300 HA2 ACD 300 1.826 8.610 -10.123 1287 H41 ACD 300 HA0 ACD 300 -0.577 9.026 -8.287 1288 H42 ACD 300 HAZ ACD 300 0.830 10.110 -8.393 1289 H5 ACD 300 HAY ACD 300 2.227 7.786 -7.787 1290 H6 ACD 300 HAX ACD 300 1.203 7.243 -5.440 1291 H71 ACD 300 HAV ACD 300 -0.968 9.262 -6.415 1292 H72 ACD 300 HAW ACD 300 -1.466 7.650 -5.857 1293 H8 ACD 300 HAU ACD 300 -0.593 9.994 -4.099 1294 H9 ACD 300 HAT ACD 300 -0.792 8.310 -2.118 1295 H101 ACD 300 HAR ACD 300 -1.508 6.292 -4.340 1296 H102 ACD 300 HAS ACD 300 0.022 5.987 -3.485 1297 H11 ACD 300 HAQ ACD 300 -2.798 5.582 -2.358 1298 H12 ACD 300 HAP ACD 300 -1.564 5.047 -0.104 1299 H131 ACD 300 HAN ACD 300 0.791 6.674 -1.383 1300 H132 ACD 300 HAO ACD 300 1.051 4.910 -0.956 1301 H14 ACD 300 HAM ACD 300 0.830 5.422 1.419 1302 H15 ACD 300 HAL ACD 300 0.973 7.922 2.139 1303 H161 ACD 300 HAJ ACD 300 -0.332 8.703 -0.422 1304 H162 ACD 300 HAK ACD 300 0.690 9.760 0.575 1305 H171 ACD 300 HAH ACD 300 2.712 8.891 -0.505 1306 H172 ACD 300 HAI ACD 300 1.751 7.741 -1.457 1307 H181 ACD 300 HAF ACD 300 0.468 9.768 -2.370 1308 H182 ACD 300 HAG ACD 300 1.734 10.777 -1.635 1309 H191 ACD 300 HAD ACD 300 3.462 9.692 -2.944 1310 H192 ACD 300 HAE ACD 300 2.309 8.492 -3.567 1311 H201 ACD 300 HAA ACD 300 2.726 10.247 -5.242 1312 H202 ACD 300 HAB ACD 300 2.219 11.501 -4.090 1313 H203 ACD 300 HAC ACD 300 1.038 10.319 -4.701 Start of MODEL 10 1 H1 MET 1 HT1 MET 1 -0.392 20.119 -22.972 2 H2 MET 1 HT2 MET 1 0.892 19.481 -23.882 3 H3 MET 1 HT3 MET 1 0.238 18.592 -22.589 4 HA MET 1 HA MET 1 -0.893 19.091 -25.261 5 HB2 MET 1 HB2 MET 1 0.423 17.016 -24.688 6 HB3 MET 1 HB1 MET 1 -0.829 16.619 -23.510 7 HG2 MET 1 HG2 MET 1 -2.520 16.735 -25.364 8 HG3 MET 1 HG1 MET 1 -1.190 16.942 -26.502 9 HE1 MET 1 HE1 MET 1 1.113 14.807 -25.107 10 HE2 MET 1 HE2 MET 1 0.781 13.842 -26.543 11 HE3 MET 1 HE3 MET 1 0.738 15.608 -26.630 12 H THR 2 HN THR 2 -1.903 17.677 -22.135 13 HA THR 2 HA THR 2 -4.289 19.286 -22.032 14 HB THR 2 HB THR 2 -4.582 16.318 -22.552 15 HG1 THR 2 HG1 THR 2 -5.197 16.882 -24.530 16 HG21 THR 2 HG21 THR 2 -6.313 17.025 -21.068 17 HG22 THR 2 HG22 THR 2 -6.539 18.540 -21.944 18 HG23 THR 2 HG23 THR 2 -7.032 17.015 -22.679 19 H VAL 3 HN VAL 3 -2.369 16.597 -20.856 20 HA VAL 3 HA VAL 3 -3.701 16.155 -18.415 21 HB VAL 3 HB VAL 3 -1.369 15.300 -17.699 22 HG11 VAL 3 HG11 VAL 3 -2.669 14.239 -20.229 23 HG12 VAL 3 HG12 VAL 3 -1.580 13.332 -19.179 24 HG13 VAL 3 HG13 VAL 3 -3.157 13.845 -18.579 25 HG21 VAL 3 HG21 VAL 3 -0.811 15.699 -20.647 26 HG22 VAL 3 HG22 VAL 3 -0.234 16.820 -19.415 27 HG23 VAL 3 HG23 VAL 3 0.305 15.141 -19.402 28 HA PRO 4 HA PRO 4 -2.599 19.744 -16.074 29 HB2 PRO 4 HB2 PRO 4 -2.533 18.722 -13.528 30 HB3 PRO 4 HB1 PRO 4 -4.039 19.003 -14.426 31 HG2 PRO 4 HG2 PRO 4 -2.526 16.462 -14.025 32 HG3 PRO 4 HG1 PRO 4 -4.275 16.752 -13.974 33 HD2 PRO 4 HD2 PRO 4 -3.045 15.669 -16.152 34 HD3 PRO 4 HD1 PRO 4 -4.490 16.694 -16.287 35 H ASP 5 HN ASP 5 -0.962 20.522 -14.389 36 HA ASP 5 HA ASP 5 1.668 19.692 -15.216 37 HB2 ASP 5 HB2 ASP 5 1.093 22.059 -14.733 38 HB3 ASP 5 HB1 ASP 5 0.861 21.633 -13.038 39 H ARG 6 HN ARG 6 2.609 17.928 -14.423 40 HA ARG 6 HA ARG 6 1.810 16.654 -12.004 41 HB2 ARG 6 HB2 ARG 6 3.747 15.181 -12.408 42 HB3 ARG 6 HB1 ARG 6 2.784 15.396 -13.869 43 HG2 ARG 6 HG2 ARG 6 4.383 17.302 -14.469 44 HG3 ARG 6 HG1 ARG 6 5.421 16.700 -13.177 45 HD2 ARG 6 HD2 ARG 6 6.119 15.716 -15.299 46 HD3 ARG 6 HD1 ARG 6 5.436 14.465 -14.266 47 HE ARG 6 HE ARG 6 3.424 15.583 -15.948 48 HH11 ARG 6 HH21 ARG 6 6.185 13.498 -15.910 49 HH12 ARG 6 HH22 ARG 6 5.650 12.537 -17.249 50 HH21 ARG 6 HH11 ARG 6 2.717 14.328 -17.704 51 HH22 ARG 6 HH12 ARG 6 3.687 13.007 -18.265 52 H SER 7 HN SER 7 4.394 18.880 -12.861 53 HA SER 7 HA SER 7 6.004 18.647 -10.588 54 HB2 SER 7 HB2 SER 7 6.580 19.965 -12.624 55 HB3 SER 7 HB1 SER 7 5.402 21.179 -12.135 56 HG SER 7 HG SER 7 6.621 21.276 -10.119 57 H GLU 8 HN GLU 8 2.956 20.313 -11.080 58 HA GLU 8 HA GLU 8 2.971 21.988 -8.836 59 HB2 GLU 8 HB2 GLU 8 1.315 21.999 -10.748 60 HB3 GLU 8 HB1 GLU 8 0.531 20.622 -9.974 61 HG2 GLU 8 HG2 GLU 8 -0.624 22.591 -9.224 62 HG3 GLU 8 HG1 GLU 8 0.358 22.026 -7.873 63 H ILE 9 HN ILE 9 1.593 18.689 -9.159 64 HA ILE 9 HA ILE 9 1.089 18.593 -6.298 65 HB ILE 9 HB ILE 9 -0.449 17.529 -7.987 66 HG12 ILE 9 HG12 ILE 9 0.813 15.869 -5.780 67 HG13 ILE 9 HG11 ILE 9 -0.595 16.906 -5.652 68 HG21 ILE 9 HG21 ILE 9 0.201 15.484 -9.056 69 HG22 ILE 9 HG22 ILE 9 1.506 16.630 -9.358 70 HG23 ILE 9 HG23 ILE 9 1.691 15.389 -8.120 71 HD11 ILE 9 HD11 ILE 9 -0.885 14.297 -5.887 72 HD12 ILE 9 HD12 ILE 9 -1.981 15.377 -6.724 73 HD13 ILE 9 HD13 ILE 9 -0.663 14.612 -7.600 74 H ALA 10 HN ALA 10 3.486 17.379 -8.556 75 HA ALA 10 HA ALA 10 4.591 15.517 -6.691 76 HB1 ALA 10 HB1 ALA 10 5.944 16.662 -9.130 77 HB2 ALA 10 HB2 ALA 10 4.941 15.211 -9.112 78 HB3 ALA 10 HB3 ALA 10 6.458 15.244 -8.216 79 H GLY 11 HN GLY 11 6.242 15.676 -5.292 80 HA2 GLY 11 HA2 GLY 11 8.244 16.886 -4.543 81 HA3 GLY 11 HA1 GLY 11 7.362 18.381 -4.850 82 H LYS 12 HN LYS 12 4.822 17.305 -3.833 83 HA LYS 12 HA LYS 12 5.231 16.520 -1.099 84 HB2 LYS 12 HB2 LYS 12 5.824 18.979 -1.119 85 HB3 LYS 12 HB1 LYS 12 4.136 19.300 -1.518 86 HG2 LYS 12 HG2 LYS 12 3.550 17.868 0.537 87 HG3 LYS 12 HG1 LYS 12 5.250 18.016 0.981 88 HD2 LYS 12 HD2 LYS 12 3.382 20.349 0.462 89 HD3 LYS 12 HD1 LYS 12 3.855 19.767 2.059 90 HE2 LYS 12 HE2 LYS 12 5.365 21.529 1.671 91 HE3 LYS 12 HE1 LYS 12 6.295 20.105 1.209 92 HZ1 LYS 12 HZ1 LYS 12 6.394 20.794 -0.883 93 HZ2 LYS 12 HZ2 LYS 12 4.726 21.105 -0.952 94 HZ3 LYS 12 HZ3 LYS 12 5.783 22.288 -0.355 95 H TRP 13 HN TRP 13 3.620 15.045 -1.000 96 HA TRP 13 HA TRP 13 0.902 15.808 -1.927 97 HB2 TRP 13 HB2 TRP 13 2.302 13.130 -1.629 98 HB3 TRP 13 HB1 TRP 13 0.577 13.233 -1.880 99 HD1 TRP 13 HD1 TRP 13 3.426 15.121 -3.676 100 HE1 TRP 13 HE1 TRP 13 3.159 14.612 -6.183 101 HE3 TRP 13 HE3 TRP 13 -0.639 12.042 -3.548 102 HZ2 TRP 13 HZ2 TRP 13 1.522 13.081 -7.883 103 HZ3 TRP 13 HZ3 TRP 13 -1.546 11.081 -5.648 104 HH2 TRP 13 HH2 TRP 13 -0.487 11.613 -7.825 105 H TYR 14 HN TYR 14 -0.550 16.136 -0.206 106 HA TYR 14 HA TYR 14 0.332 15.295 2.456 107 HB2 TYR 14 HB2 TYR 14 -0.886 17.611 1.385 108 HB3 TYR 14 HB1 TYR 14 -2.098 16.874 2.423 109 HD1 TYR 14 HD1 TYR 14 1.649 17.216 2.572 110 HD2 TYR 14 HD2 TYR 14 -2.119 17.859 4.533 111 HE1 TYR 14 HE1 TYR 14 2.832 18.123 4.551 112 HE2 TYR 14 HE2 TYR 14 -0.935 18.765 6.509 113 HH TYR 14 HH TYR 14 2.189 19.773 6.481 114 H VAL 15 HN VAL 15 -0.473 13.595 3.403 115 HA VAL 15 HA VAL 15 -2.966 12.354 2.427 116 HB VAL 15 HB VAL 15 -0.867 11.354 4.364 117 HG11 VAL 15 HG11 VAL 15 -3.427 10.143 3.310 118 HG12 VAL 15 HG12 VAL 15 -2.128 9.162 3.984 119 HG13 VAL 15 HG13 VAL 15 -2.943 10.358 4.991 120 HG21 VAL 15 HG21 VAL 15 0.086 11.270 2.206 121 HG22 VAL 15 HG22 VAL 15 -0.597 9.659 2.421 122 HG23 VAL 15 HG23 VAL 15 -1.450 10.858 1.448 123 H VAL 16 HN VAL 16 -4.857 12.560 3.577 124 HA VAL 16 HA VAL 16 -4.647 13.323 6.424 125 HB VAL 16 HB VAL 16 -6.380 15.013 6.130 126 HG11 VAL 16 HG11 VAL 16 -4.318 15.806 4.106 127 HG12 VAL 16 HG12 VAL 16 -4.851 16.659 5.554 128 HG13 VAL 16 HG13 VAL 16 -3.728 15.311 5.687 129 HG21 VAL 16 HG21 VAL 16 -7.550 14.247 4.193 130 HG22 VAL 16 HG22 VAL 16 -6.798 15.771 3.722 131 HG23 VAL 16 HG23 VAL 16 -6.080 14.239 3.219 132 H ALA 17 HN ALA 17 -5.828 10.995 4.513 133 HA ALA 17 HA ALA 17 -7.596 10.049 6.453 134 HB1 ALA 17 HB1 ALA 17 -9.799 10.390 5.504 135 HB2 ALA 17 HB2 ALA 17 -9.118 11.262 4.141 136 HB3 ALA 17 HB3 ALA 17 -9.044 11.958 5.741 137 H LEU 18 HN LEU 18 -8.065 7.898 6.084 138 HA LEU 18 HA LEU 18 -7.973 6.930 3.313 139 HB2 LEU 18 HB2 LEU 18 -5.780 6.386 3.613 140 HB3 LEU 18 HB1 LEU 18 -5.877 6.576 5.354 141 HG LEU 18 HG LEU 18 -7.050 4.168 3.939 142 HD11 LEU 18 HD11 LEU 18 -4.640 4.351 3.402 143 HD12 LEU 18 HD12 LEU 18 -4.274 4.445 5.125 144 HD13 LEU 18 HD13 LEU 18 -4.974 2.974 4.450 145 HD21 LEU 18 HD21 LEU 18 -6.971 5.095 6.683 146 HD22 LEU 18 HD22 LEU 18 -7.736 3.650 6.028 147 HD23 LEU 18 HD23 LEU 18 -6.059 3.596 6.554 148 H ALA 19 HN ALA 19 -9.035 4.998 2.981 149 HA ALA 19 HA ALA 19 -10.560 3.930 5.284 150 HB1 ALA 19 HB1 ALA 19 -12.488 3.946 4.059 151 HB2 ALA 19 HB2 ALA 19 -11.669 3.447 2.584 152 HB3 ALA 19 HB3 ALA 19 -11.648 5.134 3.077 153 H SER 20 HN SER 20 -11.196 1.636 5.047 154 HA SER 20 HA SER 20 -9.769 -0.025 3.202 155 HB2 SER 20 HB2 SER 20 -7.996 0.683 4.887 156 HB3 SER 20 HB1 SER 20 -8.892 -0.262 6.072 157 HG SER 20 HG SER 20 -8.624 -1.703 3.850 158 H ASN 21 HN ASN 21 -9.814 -2.385 4.072 159 HA ASN 21 HA ASN 21 -12.535 -2.875 5.131 160 HB2 ASN 21 HB2 ASN 21 -12.019 -3.655 2.772 161 HB3 ASN 21 HB1 ASN 21 -10.839 -4.758 3.477 162 HD21 ASN 21 HD21 ASN 21 -12.120 -6.642 2.798 163 HD22 ASN 21 HD22 ASN 21 -13.561 -7.046 3.599 164 H THR 22 HN THR 22 -9.238 -3.020 5.724 165 HA THR 22 HA THR 22 -9.380 -5.289 7.565 166 HB THR 22 HB THR 22 -7.410 -4.917 6.020 167 HG1 THR 22 HG1 THR 22 -6.404 -4.799 8.591 168 HG21 THR 22 HG21 THR 22 -6.410 -2.915 8.005 169 HG22 THR 22 HG22 THR 22 -5.926 -3.162 6.330 170 HG23 THR 22 HG23 THR 22 -7.450 -2.350 6.695 171 H GLU 23 HN GLU 23 -10.396 -4.787 9.392 172 HA GLU 23 HA GLU 23 -10.889 -2.412 10.582 173 HB2 GLU 23 HB2 GLU 23 -10.222 -5.016 11.959 174 HB3 GLU 23 HB1 GLU 23 -10.960 -3.630 12.761 175 HG2 GLU 23 HG2 GLU 23 -12.834 -3.710 11.133 176 HG3 GLU 23 HG1 GLU 23 -12.112 -5.140 10.399 177 H PHE 24 HN PHE 24 -7.822 -4.062 10.573 178 HA PHE 24 HA PHE 24 -6.573 -2.813 12.734 179 HB2 PHE 24 HB2 PHE 24 -5.052 -3.358 10.209 180 HB3 PHE 24 HB1 PHE 24 -4.571 -3.626 11.884 181 HD1 PHE 24 HD1 PHE 24 -7.104 -5.014 12.858 182 HD2 PHE 24 HD2 PHE 24 -4.744 -5.534 9.303 183 HE1 PHE 24 HE1 PHE 24 -7.874 -7.360 12.688 184 HE2 PHE 24 HE2 PHE 24 -5.517 -7.883 9.138 185 HZ PHE 24 HZ PHE 24 -7.082 -8.796 10.830 186 H PHE 25 HN PHE 25 -6.632 -1.693 9.296 187 HA PHE 25 HA PHE 25 -5.063 0.584 9.814 188 HB2 PHE 25 HB2 PHE 25 -5.978 -0.702 7.573 189 HB3 PHE 25 HB1 PHE 25 -6.926 0.776 7.531 190 HD1 PHE 25 HD1 PHE 25 -4.922 2.656 8.839 191 HD2 PHE 25 HD2 PHE 25 -4.450 -0.346 5.802 192 HE1 PHE 25 HE1 PHE 25 -2.958 3.868 7.949 193 HE2 PHE 25 HE2 PHE 25 -2.488 0.873 4.912 194 HZ PHE 25 HZ PHE 25 -1.739 2.978 5.982 195 H LEU 26 HN LEU 26 -8.643 0.296 9.531 196 HA LEU 26 HA LEU 26 -9.014 3.120 9.870 197 HB2 LEU 26 HB2 LEU 26 -11.415 2.350 10.571 198 HB3 LEU 26 HB1 LEU 26 -10.900 2.189 8.898 199 HG LEU 26 HG LEU 26 -10.194 -0.177 10.507 200 HD11 LEU 26 HD11 LEU 26 -13.068 0.747 10.358 201 HD12 LEU 26 HD12 LEU 26 -12.658 -0.961 10.482 202 HD13 LEU 26 HD13 LEU 26 -12.180 0.153 11.761 203 HD21 LEU 26 HD21 LEU 26 -11.857 0.260 8.000 204 HD22 LEU 26 HD22 LEU 26 -10.136 -0.123 8.046 205 HD23 LEU 26 HD23 LEU 26 -11.321 -1.310 8.592 206 H ARG 27 HN ARG 27 -8.849 0.378 12.000 207 HA ARG 27 HA ARG 27 -9.738 1.595 14.381 208 HB2 ARG 27 HB2 ARG 27 -9.407 -0.817 14.241 209 HB3 ARG 27 HB1 ARG 27 -7.674 -0.589 13.998 210 HG2 ARG 27 HG2 ARG 27 -7.410 0.335 16.209 211 HG3 ARG 27 HG1 ARG 27 -9.156 0.403 16.447 212 HD2 ARG 27 HD2 ARG 27 -9.233 -2.086 16.235 213 HD3 ARG 27 HD1 ARG 27 -7.474 -2.099 16.142 214 HE ARG 27 HE ARG 27 -8.496 -0.731 18.476 215 HH11 ARG 27 HH21 ARG 27 -7.601 -3.757 17.053 216 HH12 ARG 27 HH22 ARG 27 -7.271 -4.528 18.569 217 HH21 ARG 27 HH11 ARG 27 -8.065 -1.737 20.466 218 HH22 ARG 27 HH12 ARG 27 -7.534 -3.385 20.501 219 H GLU 28 HN GLU 28 -6.446 1.276 13.043 220 HA GLU 28 HA GLU 28 -5.322 2.923 15.131 221 HB2 GLU 28 HB2 GLU 28 -4.130 1.793 12.596 222 HB3 GLU 28 HB1 GLU 28 -3.216 2.661 13.830 223 HG2 GLU 28 HG2 GLU 28 -3.948 0.992 15.517 224 HG3 GLU 28 HG1 GLU 28 -4.791 0.104 14.248 225 H LYS 29 HN LYS 29 -6.005 3.447 11.608 226 HA LYS 29 HA LYS 29 -4.731 5.859 11.299 227 HB2 LYS 29 HB2 LYS 29 -6.052 4.574 9.554 228 HB3 LYS 29 HB1 LYS 29 -7.504 5.299 10.238 229 HG2 LYS 29 HG2 LYS 29 -7.014 6.842 8.567 230 HG3 LYS 29 HG1 LYS 29 -6.145 7.560 9.922 231 HD2 LYS 29 HD2 LYS 29 -4.066 6.441 9.173 232 HD3 LYS 29 HD1 LYS 29 -4.941 5.742 7.811 233 HE2 LYS 29 HE2 LYS 29 -5.541 8.098 7.111 234 HE3 LYS 29 HE1 LYS 29 -4.427 8.678 8.348 235 HZ1 LYS 29 HZ1 LYS 29 -3.836 7.145 5.899 236 HZ2 LYS 29 HZ2 LYS 29 -3.123 8.582 6.458 237 HZ3 LYS 29 HZ3 LYS 29 -2.765 7.109 7.219 238 H ASP 30 HN ASP 30 -7.613 5.128 13.090 239 HA ASP 30 HA ASP 30 -8.617 7.752 13.360 240 HB2 ASP 30 HB2 ASP 30 -9.825 5.581 13.851 241 HB3 ASP 30 HB1 ASP 30 -8.933 5.528 15.370 242 H LYS 31 HN LYS 31 -5.957 6.123 15.005 243 HA LYS 31 HA LYS 31 -5.992 8.195 17.073 244 HB2 LYS 31 HB2 LYS 31 -4.570 6.871 18.399 245 HB3 LYS 31 HB1 LYS 31 -5.768 5.783 17.714 246 HG2 LYS 31 HG2 LYS 31 -3.796 4.591 17.391 247 HG3 LYS 31 HG1 LYS 31 -3.998 5.390 15.849 248 HD2 LYS 31 HD2 LYS 31 -2.522 7.201 17.507 249 HD3 LYS 31 HD1 LYS 31 -1.802 5.613 17.721 250 HE2 LYS 31 HE2 LYS 31 -2.424 6.460 14.920 251 HE3 LYS 31 HE1 LYS 31 -1.056 7.224 15.716 252 HZ1 LYS 31 HZ1 LYS 31 0.094 5.420 15.205 253 HZ2 LYS 31 HZ2 LYS 31 -0.846 4.556 16.325 254 HZ3 LYS 31 HZ3 LYS 31 -1.291 4.585 14.689 255 H MET 32 HN MET 32 -4.172 7.551 14.137 256 HA MET 32 HA MET 32 -1.901 9.105 15.107 257 HB2 MET 32 HB2 MET 32 -1.147 9.043 12.700 258 HB3 MET 32 HB1 MET 32 -1.320 7.466 13.435 259 HG2 MET 32 HG2 MET 32 -3.791 7.659 12.431 260 HG3 MET 32 HG1 MET 32 -2.986 8.767 11.326 261 HE1 MET 32 HE1 MET 32 -3.163 5.554 13.008 262 HE2 MET 32 HE2 MET 32 -2.566 4.325 11.910 263 HE3 MET 32 HE3 MET 32 -1.442 5.216 12.942 264 H LYS 33 HN LYS 33 -1.184 10.779 13.252 265 HA LYS 33 HA LYS 33 -3.384 12.750 13.104 266 HB2 LYS 33 HB2 LYS 33 -0.521 13.593 12.884 267 HB3 LYS 33 HB1 LYS 33 -1.896 14.444 13.585 268 HG2 LYS 33 HG2 LYS 33 -1.868 12.574 15.387 269 HG3 LYS 33 HG1 LYS 33 -0.239 12.239 14.796 270 HD2 LYS 33 HD2 LYS 33 0.157 14.794 15.093 271 HD3 LYS 33 HD1 LYS 33 -1.291 14.749 16.097 272 HE2 LYS 33 HE2 LYS 33 1.130 12.979 16.516 273 HE3 LYS 33 HE1 LYS 33 0.815 14.463 17.415 274 HZ1 LYS 33 HZ1 LYS 33 -0.162 12.968 18.792 275 HZ2 LYS 33 HZ2 LYS 33 -1.489 13.276 17.776 276 HZ3 LYS 33 HZ3 LYS 33 -0.552 11.882 17.545 277 H MET 34 HN MET 34 -2.658 14.420 11.245 278 HA MET 34 HA MET 34 -3.096 13.061 8.838 279 HB2 MET 34 HB2 MET 34 -3.172 15.140 7.923 280 HB3 MET 34 HB1 MET 34 -3.279 15.592 9.607 281 HG2 MET 34 HG2 MET 34 -0.699 15.743 9.543 282 HG3 MET 34 HG1 MET 34 -0.889 15.767 7.787 283 HE1 MET 34 HE1 MET 34 -4.043 17.193 8.108 284 HE2 MET 34 HE2 MET 34 -3.459 18.660 7.332 285 HE3 MET 34 HE3 MET 34 -2.897 17.085 6.775 286 H ALA 35 HN ALA 35 -1.738 12.479 7.118 287 HA ALA 35 HA ALA 35 1.148 12.292 7.777 288 HB1 ALA 35 HB1 ALA 35 0.390 10.086 7.733 289 HB2 ALA 35 HB2 ALA 35 0.970 10.312 6.084 290 HB3 ALA 35 HB3 ALA 35 -0.756 10.398 6.435 291 H MET 36 HN MET 36 2.590 12.162 5.860 292 HA MET 36 HA MET 36 1.571 13.711 3.560 293 HB2 MET 36 HB2 MET 36 4.339 14.364 4.027 294 HB3 MET 36 HB1 MET 36 2.950 15.443 3.980 295 HG2 MET 36 HG2 MET 36 3.670 13.809 6.424 296 HG3 MET 36 HG1 MET 36 4.267 15.443 6.144 297 HE1 MET 36 HE1 MET 36 1.842 17.145 8.228 298 HE2 MET 36 HE2 MET 36 3.061 15.929 8.590 299 HE3 MET 36 HE3 MET 36 3.369 17.154 7.352 300 H ALA 37 HN ALA 37 3.058 13.641 1.712 301 HA ALA 37 HA ALA 37 4.892 11.408 1.517 302 HB1 ALA 37 HB1 ALA 37 3.025 10.062 1.100 303 HB2 ALA 37 HB2 ALA 37 3.507 10.555 -0.525 304 HB3 ALA 37 HB3 ALA 37 2.157 11.358 0.277 305 H ARG 38 HN ARG 38 5.964 11.344 -0.595 306 HA ARG 38 HA ARG 38 5.536 13.759 -2.258 307 HB2 ARG 38 HB2 ARG 38 7.978 14.178 -2.404 308 HB3 ARG 38 HB1 ARG 38 7.329 14.462 -0.793 309 HG2 ARG 38 HG2 ARG 38 8.356 12.575 0.104 310 HG3 ARG 38 HG1 ARG 38 8.468 11.760 -1.458 311 HD2 ARG 38 HD2 ARG 38 10.175 13.396 -2.176 312 HD3 ARG 38 HD1 ARG 38 10.070 14.187 -0.606 313 HE ARG 38 HE ARG 38 11.380 11.655 -1.195 314 HH11 ARG 38 HH21 ARG 38 10.022 13.787 1.170 315 HH12 ARG 38 HH22 ARG 38 10.922 13.118 2.491 316 HH21 ARG 38 HH11 ARG 38 12.563 10.774 0.532 317 HH22 ARG 38 HH12 ARG 38 12.361 11.413 2.129 318 H ILE 39 HN ILE 39 5.774 13.422 -4.450 319 HA ILE 39 HA ILE 39 6.592 10.746 -5.305 320 HB ILE 39 HB ILE 39 4.205 11.393 -5.307 321 HG12 ILE 39 HG12 ILE 39 5.005 11.048 -8.175 322 HG13 ILE 39 HG11 ILE 39 5.388 9.767 -7.030 323 HG21 ILE 39 HG21 ILE 39 3.501 12.910 -7.020 324 HG22 ILE 39 HG22 ILE 39 4.575 13.684 -5.864 325 HG23 ILE 39 HG23 ILE 39 5.148 13.235 -7.463 326 HD11 ILE 39 HD11 ILE 39 3.008 9.833 -8.238 327 HD12 ILE 39 HD12 ILE 39 3.163 9.309 -6.568 328 HD13 ILE 39 HD13 ILE 39 2.628 10.948 -6.937 329 H SER 40 HN SER 40 7.888 10.642 -7.174 330 HA SER 40 HA SER 40 8.406 13.100 -8.644 331 HB2 SER 40 HB2 SER 40 10.691 11.627 -7.379 332 HB3 SER 40 HB1 SER 40 10.761 13.114 -8.306 333 HG SER 40 HG SER 40 10.031 14.200 -6.632 334 H PHE 41 HN PHE 41 9.640 12.701 -10.623 335 HA PHE 41 HA PHE 41 8.996 10.032 -11.648 336 HB2 PHE 41 HB2 PHE 41 9.693 12.606 -13.057 337 HB3 PHE 41 HB1 PHE 41 9.320 11.086 -13.871 338 HD1 PHE 41 HD2 PHE 41 7.956 13.647 -11.534 339 HD2 PHE 41 HD1 PHE 41 7.071 10.355 -14.148 340 HE1 PHE 41 HE2 PHE 41 5.533 14.126 -11.318 341 HE2 PHE 41 HE1 PHE 41 4.648 10.834 -13.932 342 HZ PHE 41 HZ PHE 41 3.878 12.720 -12.516 343 H LEU 42 HN LEU 42 10.748 8.833 -10.837 344 HA LEU 42 HA LEU 42 13.488 9.445 -11.241 345 HB2 LEU 42 HB2 LEU 42 12.062 6.772 -11.112 346 HB3 LEU 42 HB1 LEU 42 13.809 6.940 -11.153 347 HG LEU 42 HG LEU 42 12.186 8.397 -9.071 348 HD11 LEU 42 HD11 LEU 42 12.886 5.472 -9.187 349 HD12 LEU 42 HD12 LEU 42 12.906 6.294 -7.628 350 HD13 LEU 42 HD13 LEU 42 11.423 6.246 -8.580 351 HD21 LEU 42 HD21 LEU 42 14.519 9.040 -9.225 352 HD22 LEU 42 HD22 LEU 42 14.338 8.041 -7.785 353 HD23 LEU 42 HD23 LEU 42 15.034 7.354 -9.251 354 H GLY 43 HN GLY 43 11.042 7.842 -13.123 355 HA2 GLY 43 HA2 GLY 43 12.173 8.545 -15.651 356 HA3 GLY 43 HA1 GLY 43 12.362 6.825 -15.300 357 H GLU 44 HN GLU 44 10.734 7.753 -17.429 358 HA GLU 44 HA GLU 44 8.042 8.141 -16.898 359 HB2 GLU 44 HB2 GLU 44 9.165 8.115 -19.170 360 HB3 GLU 44 HB1 GLU 44 9.076 6.354 -19.109 361 HG2 GLU 44 HG2 GLU 44 7.130 7.103 -20.300 362 HG3 GLU 44 HG1 GLU 44 6.586 6.596 -18.703 363 H ASP 45 HN ASP 45 9.922 5.178 -16.742 364 HA ASP 45 HA ASP 45 7.499 3.702 -15.896 365 HB2 ASP 45 HB2 ASP 45 9.185 1.703 -16.261 366 HB3 ASP 45 HB1 ASP 45 8.360 2.436 -17.632 367 H GLU 46 HN GLU 46 9.429 5.550 -14.379 368 HA GLU 46 HA GLU 46 9.685 3.783 -12.052 369 HB2 GLU 46 HB2 GLU 46 11.993 5.470 -13.044 370 HB3 GLU 46 HB1 GLU 46 11.986 4.408 -11.635 371 HG2 GLU 46 HG2 GLU 46 11.471 2.491 -13.196 372 HG3 GLU 46 HG1 GLU 46 11.742 3.595 -14.542 373 H LEU 47 HN LEU 47 8.668 4.791 -10.460 374 HA LEU 47 HA LEU 47 8.978 7.726 -10.173 375 HB2 LEU 47 HB2 LEU 47 6.476 6.212 -9.421 376 HB3 LEU 47 HB1 LEU 47 6.698 7.955 -9.533 377 HG LEU 47 HG LEU 47 6.921 6.082 -11.905 378 HD11 LEU 47 HD11 LEU 47 4.600 7.821 -11.036 379 HD12 LEU 47 HD12 LEU 47 4.669 6.820 -12.485 380 HD13 LEU 47 HD13 LEU 47 4.655 6.064 -10.892 381 HD21 LEU 47 HD21 LEU 47 8.040 8.104 -12.424 382 HD22 LEU 47 HD22 LEU 47 6.421 8.351 -13.066 383 HD23 LEU 47 HD23 LEU 47 6.880 9.082 -11.530 384 H LYS 48 HN LYS 48 9.297 8.460 -8.102 385 HA LYS 48 HA LYS 48 9.690 6.382 -6.035 386 HB2 LYS 48 HB2 LYS 48 11.578 7.999 -6.854 387 HB3 LYS 48 HB1 LYS 48 10.751 9.193 -5.862 388 HG2 LYS 48 HG2 LYS 48 11.041 7.863 -3.877 389 HG3 LYS 48 HG1 LYS 48 11.616 6.482 -4.814 390 HD2 LYS 48 HD2 LYS 48 13.522 7.641 -3.807 391 HD3 LYS 48 HD1 LYS 48 13.568 7.826 -5.560 392 HE2 LYS 48 HE2 LYS 48 12.886 10.071 -5.471 393 HE3 LYS 48 HE1 LYS 48 12.203 9.902 -3.854 394 HZ1 LYS 48 HZ1 LYS 48 14.239 11.067 -3.655 395 HZ2 LYS 48 HZ2 LYS 48 14.516 9.499 -3.062 396 HZ3 LYS 48 HZ3 LYS 48 15.071 9.930 -4.605 397 H VAL 49 HN VAL 49 8.121 6.266 -4.524 398 HA VAL 49 HA VAL 49 6.762 8.777 -3.766 399 HB VAL 49 HB VAL 49 5.599 6.160 -4.534 400 HG11 VAL 49 HG11 VAL 49 5.021 6.043 -2.177 401 HG12 VAL 49 HG12 VAL 49 4.526 7.738 -2.178 402 HG13 VAL 49 HG13 VAL 49 3.595 6.547 -3.086 403 HG21 VAL 49 HG21 VAL 49 3.651 7.752 -4.946 404 HG22 VAL 49 HG22 VAL 49 4.741 9.056 -4.477 405 HG23 VAL 49 HG23 VAL 49 5.116 8.046 -5.870 406 H SER 50 HN SER 50 6.520 9.244 -1.752 407 HA SER 50 HA SER 50 7.830 7.495 0.256 408 HB2 SER 50 HB2 SER 50 8.969 9.625 -0.507 409 HB3 SER 50 HB1 SER 50 7.638 10.482 0.238 410 HG SER 50 HG SER 50 8.194 9.190 2.175 411 H TYR 51 HN TYR 51 6.983 7.436 2.345 412 HA TYR 51 HA TYR 51 4.341 8.729 2.728 413 HB2 TYR 51 HB2 TYR 51 5.094 6.109 4.025 414 HB3 TYR 51 HB1 TYR 51 3.498 6.824 3.838 415 HD1 TYR 51 HD1 TYR 51 3.240 7.510 1.084 416 HD2 TYR 51 HD2 TYR 51 5.244 4.135 2.810 417 HE1 TYR 51 HE1 TYR 51 2.872 6.220 -0.991 418 HE2 TYR 51 HE2 TYR 51 4.893 2.853 0.719 419 HH TYR 51 HH TYR 51 3.382 2.857 -1.198 420 H ALA 52 HN ALA 52 4.124 9.877 4.561 421 HA ALA 52 HA ALA 52 6.139 9.535 6.707 422 HB1 ALA 52 HB1 ALA 52 5.650 12.062 7.097 423 HB2 ALA 52 HB2 ALA 52 5.066 12.044 5.432 424 HB3 ALA 52 HB3 ALA 52 6.738 11.610 5.786 425 H VAL 53 HN VAL 53 5.034 8.557 8.332 426 HA VAL 53 HA VAL 53 2.288 9.488 8.886 427 HB VAL 53 HB VAL 53 3.420 6.845 9.768 428 HG11 VAL 53 HG11 VAL 53 1.243 7.833 10.675 429 HG12 VAL 53 HG12 VAL 53 0.588 7.637 9.049 430 HG13 VAL 53 HG13 VAL 53 1.120 6.225 9.962 431 HG21 VAL 53 HG21 VAL 53 2.097 7.523 7.121 432 HG22 VAL 53 HG22 VAL 53 3.741 6.927 7.348 433 HG23 VAL 53 HG23 VAL 53 2.368 5.885 7.714 434 HA PRO 54 HA PRO 54 4.311 10.743 12.735 435 HB2 PRO 54 HB2 PRO 54 2.278 12.202 13.774 436 HB3 PRO 54 HB1 PRO 54 3.267 12.799 12.425 437 HG2 PRO 54 HG2 PRO 54 0.541 11.593 12.388 438 HG3 PRO 54 HG1 PRO 54 1.188 12.950 11.450 439 HD2 PRO 54 HD2 PRO 54 0.928 10.371 10.472 440 HD3 PRO 54 HD1 PRO 54 2.072 11.573 9.830 441 H LYS 55 HN LYS 55 4.501 9.394 14.447 442 HA LYS 55 HA LYS 55 2.061 8.233 15.635 443 HB2 LYS 55 HB2 LYS 55 3.184 6.591 14.103 444 HB3 LYS 55 HB1 LYS 55 4.603 6.678 15.147 445 HG2 LYS 55 HG2 LYS 55 3.182 6.001 17.080 446 HG3 LYS 55 HG1 LYS 55 1.816 5.818 15.980 447 HD2 LYS 55 HD2 LYS 55 4.443 4.321 15.729 448 HD3 LYS 55 HD1 LYS 55 2.974 3.654 16.440 449 HE2 LYS 55 HE2 LYS 55 1.874 4.373 14.158 450 HE3 LYS 55 HE1 LYS 55 3.537 4.351 13.570 451 HZ1 LYS 55 HZ1 LYS 55 3.746 2.111 13.972 452 HZ2 LYS 55 HZ2 LYS 55 2.492 2.077 15.117 453 HZ3 LYS 55 HZ3 LYS 55 2.128 2.211 13.466 454 HA PRO 56 HA PRO 56 4.546 10.651 18.789 455 HB2 PRO 56 HB2 PRO 56 2.059 9.638 20.147 456 HB3 PRO 56 HB1 PRO 56 2.896 11.190 20.356 457 HG2 PRO 56 HG2 PRO 56 0.704 10.957 18.825 458 HG3 PRO 56 HG1 PRO 56 2.019 12.078 18.432 459 HD2 PRO 56 HD2 PRO 56 1.214 9.621 17.031 460 HD3 PRO 56 HD1 PRO 56 2.260 10.937 16.457 461 H ASN 57 HN ASN 57 3.217 7.399 18.762 462 HA ASN 57 HA ASN 57 4.814 6.573 21.075 463 HB2 ASN 57 HB2 ASN 57 2.934 4.992 19.306 464 HB3 ASN 57 HB1 ASN 57 3.692 4.406 20.786 465 HD21 ASN 57 HD21 ASN 57 3.405 6.733 22.419 466 HD22 ASN 57 HD22 ASN 57 1.751 6.997 22.692 467 H GLY 58 HN GLY 58 5.830 7.342 18.247 468 HA2 GLY 58 HA2 GLY 58 8.180 6.316 17.918 469 HA3 GLY 58 HA1 GLY 58 7.264 4.849 17.575 470 H CYS 59 HN CYS 59 7.602 8.244 16.572 471 HA CYS 59 HA CYS 59 6.113 8.251 14.254 472 HB2 CYS 59 HB2 CYS 59 7.270 10.231 15.201 473 HB3 CYS 59 HB1 CYS 59 8.807 9.580 14.633 474 H ARG 60 HN ARG 60 6.339 7.511 12.204 475 HA ARG 60 HA ARG 60 8.800 5.991 11.546 476 HB2 ARG 60 HB2 ARG 60 6.755 4.570 12.064 477 HB3 ARG 60 HB1 ARG 60 6.023 5.260 10.614 478 HG2 ARG 60 HG2 ARG 60 8.182 4.522 9.398 479 HG3 ARG 60 HG1 ARG 60 8.488 3.528 10.823 480 HD2 ARG 60 HD2 ARG 60 6.311 2.418 10.528 481 HD3 ARG 60 HD1 ARG 60 5.982 3.427 9.121 482 HE ARG 60 HE ARG 60 8.427 1.829 9.012 483 HH11 ARG 60 HH21 ARG 60 5.075 2.186 8.217 484 HH12 ARG 60 HH22 ARG 60 5.123 1.047 6.914 485 HH21 ARG 60 HH11 ARG 60 8.493 0.333 7.307 486 HH22 ARG 60 HH12 ARG 60 7.056 -0.004 6.399 487 H LYS 61 HN LYS 61 9.826 6.840 9.883 488 HA LYS 61 HA LYS 61 8.275 8.023 7.660 489 HB2 LYS 61 HB2 LYS 61 9.957 9.812 7.464 490 HB3 LYS 61 HB1 LYS 61 9.150 9.870 9.030 491 HG2 LYS 61 HG2 LYS 61 11.078 8.486 9.946 492 HG3 LYS 61 HG1 LYS 61 11.905 8.780 8.415 493 HD2 LYS 61 HD2 LYS 61 11.589 11.248 8.801 494 HD3 LYS 61 HD1 LYS 61 10.973 10.862 10.409 495 HE2 LYS 61 HE2 LYS 61 13.731 10.227 9.324 496 HE3 LYS 61 HE1 LYS 61 13.337 11.377 10.602 497 HZ1 LYS 61 HZ1 LYS 61 12.348 9.431 11.819 498 HZ2 LYS 61 HZ2 LYS 61 13.097 8.427 10.671 499 HZ3 LYS 61 HZ3 LYS 61 14.041 9.420 11.669 500 H TRP 62 HN TRP 62 8.905 7.309 5.692 501 HA TRP 62 HA TRP 62 11.615 6.477 5.190 502 HB2 TRP 62 HB2 TRP 62 11.453 4.217 5.286 503 HB3 TRP 62 HB1 TRP 62 10.089 4.537 6.349 504 HD1 TRP 62 HD1 TRP 62 7.793 5.229 4.492 505 HE1 TRP 62 HE1 TRP 62 6.876 3.545 2.765 506 HE3 TRP 62 HE3 TRP 62 11.829 2.135 4.036 507 HZ2 TRP 62 HZ2 TRP 62 7.739 1.204 1.372 508 HZ3 TRP 62 HZ3 TRP 62 11.756 0.188 2.504 509 HH2 TRP 62 HH2 TRP 62 9.718 -0.281 1.173 510 H GLU 63 HN GLU 63 11.651 5.293 2.964 511 HA GLU 63 HA GLU 63 9.878 6.805 1.124 512 HB2 GLU 63 HB2 GLU 63 12.239 7.601 1.155 513 HB3 GLU 63 HB1 GLU 63 12.752 5.994 0.640 514 HG2 GLU 63 HG2 GLU 63 11.650 6.195 -1.453 515 HG3 GLU 63 HG1 GLU 63 10.700 7.578 -0.911 516 H THR 64 HN THR 64 9.642 5.799 -1.033 517 HA THR 64 HA THR 64 10.072 2.918 -1.191 518 HB THR 64 HB THR 64 7.268 3.999 -1.467 519 HG1 THR 64 HG1 THR 64 7.121 2.762 0.629 520 HG21 THR 64 HG21 THR 64 7.656 1.907 -2.620 521 HG22 THR 64 HG22 THR 64 8.475 1.231 -1.212 522 HG23 THR 64 HG23 THR 64 6.743 1.559 -1.152 523 H THR 65 HN THR 65 10.098 2.161 -3.294 524 HA THR 65 HA THR 65 9.958 4.232 -5.391 525 HB THR 65 HB THR 65 11.259 1.509 -5.521 526 HG1 THR 65 HG1 THR 65 12.688 3.893 -5.341 527 HG21 THR 65 HG21 THR 65 10.678 2.488 -7.698 528 HG22 THR 65 HG22 THR 65 11.486 3.990 -7.247 529 HG23 THR 65 HG23 THR 65 12.425 2.513 -7.458 530 H PHE 66 HN PHE 66 8.404 4.181 -6.903 531 HA PHE 66 HA PHE 66 6.829 1.688 -7.241 532 HB2 PHE 66 HB2 PHE 66 6.023 4.583 -7.092 533 HB3 PHE 66 HB1 PHE 66 5.051 3.465 -8.042 534 HD1 PHE 66 HD1 PHE 66 6.648 3.763 -4.659 535 HD2 PHE 66 HD2 PHE 66 3.369 2.238 -6.977 536 HE1 PHE 66 HE1 PHE 66 5.549 2.959 -2.587 537 HE2 PHE 66 HE2 PHE 66 2.276 1.437 -4.902 538 HZ PHE 66 HZ PHE 66 3.366 1.795 -2.708 539 H LYS 67 HN LYS 67 6.637 0.924 -9.295 540 HA LYS 67 HA LYS 67 7.762 2.582 -11.490 541 HB2 LYS 67 HB2 LYS 67 7.767 -0.423 -11.124 542 HB3 LYS 67 HB1 LYS 67 8.285 0.404 -12.592 543 HG2 LYS 67 HG2 LYS 67 9.848 1.749 -10.950 544 HG3 LYS 67 HG1 LYS 67 9.580 0.376 -9.876 545 HD2 LYS 67 HD2 LYS 67 10.236 -1.118 -11.830 546 HD3 LYS 67 HD1 LYS 67 10.770 0.346 -12.655 547 HE2 LYS 67 HE2 LYS 67 11.858 -0.878 -10.120 548 HE3 LYS 67 HE1 LYS 67 12.729 -0.447 -11.592 549 HZ1 LYS 67 HZ1 LYS 67 11.958 1.920 -11.048 550 HZ2 LYS 67 HZ2 LYS 67 11.676 1.324 -9.482 551 HZ3 LYS 67 HZ3 LYS 67 13.237 1.265 -10.142 552 H LYS 68 HN LYS 68 6.680 2.646 -13.448 553 HA LYS 68 HA LYS 68 3.849 2.214 -13.324 554 HB2 LYS 68 HB2 LYS 68 5.121 4.050 -14.611 555 HB3 LYS 68 HB1 LYS 68 5.381 2.816 -15.843 556 HG2 LYS 68 HG2 LYS 68 2.927 2.435 -15.951 557 HG3 LYS 68 HG1 LYS 68 2.695 3.735 -14.782 558 HD2 LYS 68 HD2 LYS 68 3.823 5.308 -16.343 559 HD3 LYS 68 HD1 LYS 68 3.963 4.004 -17.524 560 HE2 LYS 68 HE2 LYS 68 1.998 5.249 -18.115 561 HE3 LYS 68 HE1 LYS 68 1.439 3.748 -17.375 562 HZ1 LYS 68 HZ1 LYS 68 1.827 6.236 -15.818 563 HZ2 LYS 68 HZ2 LYS 68 0.354 5.861 -16.579 564 HZ3 LYS 68 HZ3 LYS 68 0.968 4.841 -15.370 565 H THR 69 HN THR 69 2.650 0.583 -14.039 566 HA THR 69 HA THR 69 3.881 -1.477 -15.775 567 HB THR 69 HB THR 69 3.888 -2.391 -13.532 568 HG1 THR 69 HG1 THR 69 1.555 -3.459 -14.661 569 HG21 THR 69 HG21 THR 69 2.170 -0.801 -12.633 570 HG22 THR 69 HG22 THR 69 0.929 -1.753 -13.446 571 HG23 THR 69 HG23 THR 69 1.891 -2.476 -12.157 572 H SER 70 HN SER 70 2.050 -3.007 -16.553 573 HA SER 70 HA SER 70 -0.089 -1.290 -17.617 574 HB2 SER 70 HB2 SER 70 -0.320 -2.883 -19.382 575 HB3 SER 70 HB1 SER 70 1.409 -2.629 -19.164 576 HG SER 70 HG SER 70 0.454 -4.893 -19.250 577 H ASP 71 HN ASP 71 0.362 -3.201 -15.067 578 HA ASP 71 HA ASP 71 -1.239 -5.153 -14.556 579 HB2 ASP 71 HB2 ASP 71 -0.248 -3.669 -12.809 580 HB3 ASP 71 HB1 ASP 71 -1.641 -2.606 -12.989 581 H ASP 72 HN ASP 72 -2.694 -1.924 -15.169 582 HA ASP 72 HA ASP 72 -4.938 -3.019 -16.475 583 HB2 ASP 72 HB2 ASP 72 -5.657 -3.788 -14.317 584 HB3 ASP 72 HB1 ASP 72 -5.337 -2.217 -13.589 585 H GLY 73 HN GLY 73 -4.219 -1.385 -17.870 586 HA2 GLY 73 HA2 GLY 73 -4.648 0.659 -18.882 587 HA3 GLY 73 HA1 GLY 73 -5.514 1.158 -17.433 588 H GLU 74 HN GLU 74 -4.523 2.460 -15.990 589 HA GLU 74 HA GLU 74 -1.628 3.009 -16.355 590 HB2 GLU 74 HB2 GLU 74 -3.871 4.946 -15.742 591 HB3 GLU 74 HB1 GLU 74 -2.157 5.349 -15.635 592 HG2 GLU 74 HG2 GLU 74 -2.864 6.061 -17.805 593 HG3 GLU 74 HG1 GLU 74 -1.955 4.572 -18.056 594 H VAL 75 HN VAL 75 -1.004 1.610 -14.646 595 HA VAL 75 HA VAL 75 -1.714 2.618 -11.967 596 HB VAL 75 HB VAL 75 -1.462 -0.313 -12.652 597 HG11 VAL 75 HG11 VAL 75 -2.767 -0.259 -10.312 598 HG12 VAL 75 HG12 VAL 75 -1.008 -0.204 -10.382 599 HG13 VAL 75 HG13 VAL 75 -1.926 1.280 -10.149 600 HG21 VAL 75 HG21 VAL 75 -4.043 -0.094 -12.015 601 HG22 VAL 75 HG22 VAL 75 -3.812 1.552 -12.606 602 HG23 VAL 75 HG23 VAL 75 -3.492 0.183 -13.668 603 H TYR 76 HN TYR 76 -0.139 2.377 -10.379 604 HA TYR 76 HA TYR 76 2.578 1.783 -11.425 605 HB2 TYR 76 HB2 TYR 76 1.859 3.565 -9.094 606 HB3 TYR 76 HB1 TYR 76 3.428 3.419 -9.894 607 HD1 TYR 76 HD1 TYR 76 3.747 4.251 -12.209 608 HD2 TYR 76 HD2 TYR 76 0.053 4.831 -10.096 609 HE1 TYR 76 HE1 TYR 76 3.047 5.934 -13.892 610 HE2 TYR 76 HE2 TYR 76 -0.641 6.520 -11.774 611 HH TYR 76 HH TYR 76 1.031 6.954 -14.741 612 H TYR 77 HN TYR 77 4.068 0.721 -9.976 613 HA TYR 77 HA TYR 77 2.968 -0.529 -7.581 614 HB2 TYR 77 HB2 TYR 77 2.939 -2.738 -8.272 615 HB3 TYR 77 HB1 TYR 77 2.378 -1.914 -9.726 616 HD1 TYR 77 HD2 TYR 77 4.151 -1.281 -11.496 617 HD2 TYR 77 HD1 TYR 77 4.870 -4.084 -8.326 618 HE1 TYR 77 HE2 TYR 77 6.077 -2.210 -12.755 619 HE2 TYR 77 HE1 TYR 77 6.793 -5.015 -9.584 620 HH TYR 77 HH TYR 77 7.460 -4.065 -12.887 621 H SER 78 HN SER 78 4.437 -1.028 -6.061 622 HA SER 78 HA SER 78 7.280 -0.624 -6.733 623 HB2 SER 78 HB2 SER 78 6.378 0.769 -4.916 624 HB3 SER 78 HB1 SER 78 5.844 -0.674 -4.064 625 HG SER 78 HG SER 78 8.530 -0.207 -4.843 626 H GLU 79 HN GLU 79 8.056 -2.548 -7.401 627 HA GLU 79 HA GLU 79 7.199 -5.095 -6.718 628 HB2 GLU 79 HB2 GLU 79 8.822 -4.447 -8.548 629 HB3 GLU 79 HB1 GLU 79 10.074 -4.388 -7.307 630 HG2 GLU 79 HG2 GLU 79 9.536 -6.740 -6.693 631 HG3 GLU 79 HG1 GLU 79 8.366 -6.791 -8.010 632 H GLU 80 HN GLU 80 9.625 -3.084 -5.092 633 HA GLU 80 HA GLU 80 10.483 -5.092 -3.273 634 HB2 GLU 80 HB2 GLU 80 10.662 -2.078 -3.135 635 HB3 GLU 80 HB1 GLU 80 11.486 -3.182 -2.031 636 HG2 GLU 80 HG2 GLU 80 12.618 -4.241 -3.974 637 HG3 GLU 80 HG1 GLU 80 11.843 -3.070 -5.040 638 H ALA 81 HN ALA 81 7.999 -2.557 -3.036 639 HA ALA 81 HA ALA 81 7.376 -3.450 -0.295 640 HB1 ALA 81 HB1 ALA 81 7.616 -1.090 -0.447 641 HB2 ALA 81 HB2 ALA 81 5.885 -1.403 -0.315 642 HB3 ALA 81 HB3 ALA 81 6.593 -1.007 -1.881 643 H LYS 82 HN LYS 82 6.494 -4.542 -3.192 644 HA LYS 82 HA LYS 82 4.510 -5.324 -4.157 645 HB2 LYS 82 HB2 LYS 82 4.219 -6.260 -1.290 646 HB3 LYS 82 HB1 LYS 82 3.422 -6.968 -2.696 647 HG2 LYS 82 HG2 LYS 82 5.645 -7.478 -3.677 648 HG3 LYS 82 HG1 LYS 82 6.416 -6.827 -2.229 649 HD2 LYS 82 HD2 LYS 82 5.159 -8.508 -0.865 650 HD3 LYS 82 HD1 LYS 82 4.548 -9.211 -2.363 651 HE2 LYS 82 HE2 LYS 82 6.574 -10.393 -1.475 652 HE3 LYS 82 HE1 LYS 82 6.804 -9.740 -3.098 653 HZ1 LYS 82 HZ1 LYS 82 7.524 -8.141 -0.728 654 HZ2 LYS 82 HZ2 LYS 82 8.595 -9.317 -1.324 655 HZ3 LYS 82 HZ3 LYS 82 8.117 -8.027 -2.317 656 H LYS 83 HN LYS 83 3.917 -2.890 -4.110 657 HA LYS 83 HA LYS 83 1.173 -2.706 -3.135 658 HB2 LYS 83 HB2 LYS 83 2.373 -1.823 -1.228 659 HB3 LYS 83 HB1 LYS 83 3.341 -0.779 -2.267 660 HG2 LYS 83 HG2 LYS 83 1.349 0.488 -2.912 661 HG3 LYS 83 HG1 LYS 83 0.326 -0.602 -1.974 662 HD2 LYS 83 HD2 LYS 83 1.201 0.164 0.084 663 HD3 LYS 83 HD1 LYS 83 2.607 0.896 -0.685 664 HE2 LYS 83 HE2 LYS 83 1.337 2.688 -1.570 665 HE3 LYS 83 HE1 LYS 83 -0.192 1.851 -1.299 666 HZ1 LYS 83 HZ1 LYS 83 1.386 2.232 1.082 667 HZ2 LYS 83 HZ2 LYS 83 0.877 3.683 0.359 668 HZ3 LYS 83 HZ3 LYS 83 -0.267 2.517 0.817 669 H LYS 84 HN LYS 84 -0.075 -1.645 -4.550 670 HA LYS 84 HA LYS 84 1.205 0.152 -6.515 671 HB2 LYS 84 HB2 LYS 84 -0.515 -0.794 -8.173 672 HB3 LYS 84 HB1 LYS 84 0.874 -1.806 -7.793 673 HG2 LYS 84 HG2 LYS 84 -0.573 -2.920 -6.018 674 HG3 LYS 84 HG1 LYS 84 -1.939 -2.046 -6.711 675 HD2 LYS 84 HD2 LYS 84 -1.506 -3.079 -8.902 676 HD3 LYS 84 HD1 LYS 84 -0.122 -3.940 -8.229 677 HE2 LYS 84 HE2 LYS 84 -1.833 -5.544 -8.117 678 HE3 LYS 84 HE1 LYS 84 -1.838 -4.860 -6.491 679 HZ1 LYS 84 HZ1 LYS 84 -3.558 -3.255 -7.389 680 HZ2 LYS 84 HZ2 LYS 84 -3.696 -4.299 -8.723 681 HZ3 LYS 84 HZ3 LYS 84 -4.060 -4.864 -7.165 682 H VAL 85 HN VAL 85 0.037 1.852 -7.259 683 HA VAL 85 HA VAL 85 -2.619 2.264 -6.060 684 HB VAL 85 HB VAL 85 -2.114 4.371 -5.212 685 HG11 VAL 85 HG11 VAL 85 -0.983 2.339 -4.106 686 HG12 VAL 85 HG12 VAL 85 0.520 2.973 -4.777 687 HG13 VAL 85 HG13 VAL 85 -0.411 3.931 -3.630 688 HG21 VAL 85 HG21 VAL 85 0.425 5.237 -5.669 689 HG22 VAL 85 HG22 VAL 85 0.137 4.403 -7.191 690 HG23 VAL 85 HG23 VAL 85 -0.927 5.718 -6.690 691 H GLU 86 HN GLU 86 -4.082 2.896 -7.436 692 HA GLU 86 HA GLU 86 -3.220 3.801 -10.130 693 HB2 GLU 86 HB2 GLU 86 -4.179 1.616 -10.304 694 HB3 GLU 86 HB1 GLU 86 -5.508 2.039 -9.233 695 HG2 GLU 86 HG2 GLU 86 -6.476 3.507 -10.879 696 HG3 GLU 86 HG1 GLU 86 -5.049 3.388 -11.907 697 H VAL 87 HN VAL 87 -3.950 5.647 -10.860 698 HA VAL 87 HA VAL 87 -5.323 7.501 -9.277 699 HB VAL 87 HB VAL 87 -4.092 8.393 -11.061 700 HG11 VAL 87 HG11 VAL 87 -5.527 6.336 -12.741 701 HG12 VAL 87 HG12 VAL 87 -4.684 7.700 -13.473 702 HG13 VAL 87 HG13 VAL 87 -3.793 6.536 -12.493 703 HG21 VAL 87 HG21 VAL 87 -6.818 8.538 -12.338 704 HG22 VAL 87 HG22 VAL 87 -6.560 9.263 -10.752 705 HG23 VAL 87 HG23 VAL 87 -5.615 9.811 -12.135 706 H LEU 88 HN LEU 88 -7.181 6.755 -8.379 707 HA LEU 88 HA LEU 88 -9.338 5.709 -10.058 708 HB2 LEU 88 HB2 LEU 88 -8.569 5.054 -7.544 709 HB3 LEU 88 HB1 LEU 88 -9.762 6.287 -7.156 710 HG LEU 88 HG LEU 88 -10.846 4.113 -7.192 711 HD11 LEU 88 HD11 LEU 88 -12.664 4.630 -8.614 712 HD12 LEU 88 HD12 LEU 88 -11.961 6.191 -8.198 713 HD13 LEU 88 HD13 LEU 88 -11.631 5.466 -9.772 714 HD21 LEU 88 HD21 LEU 88 -9.027 3.347 -9.052 715 HD22 LEU 88 HD22 LEU 88 -10.556 2.507 -8.806 716 HD23 LEU 88 HD23 LEU 88 -10.397 3.680 -10.111 717 H ASP 89 HN ASP 89 -8.194 8.584 -8.705 718 HA ASP 89 HA ASP 89 -9.918 10.313 -10.010 719 HB2 ASP 89 HB2 ASP 89 -11.325 9.231 -7.915 720 HB3 ASP 89 HB1 ASP 89 -10.578 10.616 -7.129 721 H THR 90 HN THR 90 -8.564 12.025 -10.227 722 HA THR 90 HA THR 90 -7.008 12.897 -7.914 723 HB THR 90 HB THR 90 -5.853 11.095 -9.489 724 HG1 THR 90 HG1 THR 90 -4.954 13.131 -7.939 725 HG21 THR 90 HG21 THR 90 -5.065 13.705 -10.809 726 HG22 THR 90 HG22 THR 90 -4.492 12.091 -11.221 727 HG23 THR 90 HG23 THR 90 -6.172 12.531 -11.521 728 H ASP 91 HN ASP 91 -7.141 14.988 -7.735 729 HA ASP 91 HA ASP 91 -8.077 16.627 -9.961 730 HB2 ASP 91 HB2 ASP 91 -8.918 16.899 -7.599 731 HB3 ASP 91 HB1 ASP 91 -7.311 17.487 -7.171 732 H TYR 92 HN TYR 92 -5.186 15.918 -8.186 733 HA TYR 92 HA TYR 92 -2.998 16.506 -8.472 734 HB2 TYR 92 HB2 TYR 92 -4.216 16.619 -11.129 735 HB3 TYR 92 HB1 TYR 92 -2.858 17.729 -10.992 736 HD1 TYR 92 HD2 TYR 92 -3.412 14.406 -9.337 737 HD2 TYR 92 HD1 TYR 92 -1.091 16.696 -12.137 738 HE1 TYR 92 HE2 TYR 92 -1.835 12.510 -9.586 739 HE2 TYR 92 HE1 TYR 92 0.480 14.796 -12.386 740 HH TYR 92 HH TYR 92 1.064 12.793 -11.632 741 H LYS 93 HN LYS 93 -5.205 18.644 -7.660 742 HA LYS 93 HA LYS 93 -3.268 20.795 -7.488 743 HB2 LYS 93 HB2 LYS 93 -5.849 21.019 -9.042 744 HB3 LYS 93 HB1 LYS 93 -5.009 22.425 -8.390 745 HG2 LYS 93 HG2 LYS 93 -2.929 21.592 -9.622 746 HG3 LYS 93 HG1 LYS 93 -3.995 20.455 -10.451 747 HD2 LYS 93 HD2 LYS 93 -5.366 22.320 -11.279 748 HD3 LYS 93 HD1 LYS 93 -4.331 23.469 -10.430 749 HE2 LYS 93 HE2 LYS 93 -2.385 22.597 -11.763 750 HE3 LYS 93 HE1 LYS 93 -3.523 21.627 -12.697 751 HZ1 LYS 93 HZ1 LYS 93 -3.278 24.564 -12.560 752 HZ2 LYS 93 HZ2 LYS 93 -3.305 23.559 -13.930 753 HZ3 LYS 93 HZ3 LYS 93 -4.731 23.836 -13.055 754 H SER 94 HN SER 94 -6.391 19.383 -6.715 755 HA SER 94 HA SER 94 -6.546 21.114 -4.306 756 HB2 SER 94 HB2 SER 94 -8.927 21.005 -4.425 757 HB3 SER 94 HB1 SER 94 -8.358 21.425 -6.039 758 HG SER 94 HG SER 94 -9.227 19.650 -6.726 759 H TYR 95 HN TYR 95 -7.806 17.955 -5.457 760 HA TYR 95 HA TYR 95 -6.696 16.619 -3.125 761 HB2 TYR 95 HB2 TYR 95 -9.003 15.694 -2.536 762 HB3 TYR 95 HB1 TYR 95 -8.695 17.370 -2.078 763 HD1 TYR 95 HD2 TYR 95 -10.435 15.159 -4.475 764 HD2 TYR 95 HD1 TYR 95 -9.808 19.212 -3.196 765 HE1 TYR 95 HE2 TYR 95 -12.359 15.894 -5.857 766 HE2 TYR 95 HE1 TYR 95 -11.732 19.946 -4.578 767 HH TYR 95 HH TYR 95 -14.043 18.034 -5.672 768 H ALA 96 HN ALA 96 -6.984 14.251 -3.256 769 HA ALA 96 HA ALA 96 -7.922 13.260 -5.855 770 HB1 ALA 96 HB1 ALA 96 -5.104 12.862 -4.832 771 HB2 ALA 96 HB2 ALA 96 -5.582 13.746 -6.278 772 HB3 ALA 96 HB3 ALA 96 -5.804 11.998 -6.195 773 H VAL 97 HN VAL 97 -8.602 11.199 -5.877 774 HA VAL 97 HA VAL 97 -8.421 9.656 -3.342 775 HB VAL 97 HB VAL 97 -10.688 9.295 -5.291 776 HG11 VAL 97 HG11 VAL 97 -10.337 8.921 -2.305 777 HG12 VAL 97 HG12 VAL 97 -11.855 8.673 -3.162 778 HG13 VAL 97 HG13 VAL 97 -10.464 7.652 -3.522 779 HG21 VAL 97 HG21 VAL 97 -11.966 10.915 -3.773 780 HG22 VAL 97 HG22 VAL 97 -10.389 11.466 -3.206 781 HG23 VAL 97 HG23 VAL 97 -10.829 11.646 -4.904 782 H ILE 98 HN ILE 98 -7.179 7.904 -3.611 783 HA ILE 98 HA ILE 98 -7.092 6.638 -6.288 784 HB ILE 98 HB ILE 98 -4.798 6.892 -4.348 785 HG12 ILE 98 HG12 ILE 98 -5.376 8.618 -6.780 786 HG13 ILE 98 HG11 ILE 98 -5.665 9.136 -5.123 787 HG21 ILE 98 HG21 ILE 98 -4.908 5.122 -6.267 788 HG22 ILE 98 HG22 ILE 98 -4.645 6.502 -7.329 789 HG23 ILE 98 HG23 ILE 98 -3.451 6.099 -6.099 790 HD11 ILE 98 HD11 ILE 98 -3.091 8.741 -6.559 791 HD12 ILE 98 HD12 ILE 98 -3.549 9.984 -5.397 792 HD13 ILE 98 HD13 ILE 98 -3.131 8.369 -4.832 793 H TYR 99 HN TYR 99 -6.850 4.431 -6.360 794 HA TYR 99 HA TYR 99 -7.682 3.006 -3.931 795 HB2 TYR 99 HB2 TYR 99 -8.712 2.793 -6.342 796 HB3 TYR 99 HB1 TYR 99 -7.351 1.710 -6.623 797 HD1 TYR 99 HD1 TYR 99 -10.269 2.334 -4.390 798 HD2 TYR 99 HD2 TYR 99 -7.354 -0.507 -5.762 799 HE1 TYR 99 HE1 TYR 99 -11.490 0.519 -3.221 800 HE2 TYR 99 HE2 TYR 99 -8.574 -2.323 -4.593 801 HH TYR 99 HH TYR 99 -11.271 -2.534 -3.841 802 H ALA 100 HN ALA 100 -6.028 2.501 -2.680 803 HA ALA 100 HA ALA 100 -3.527 1.459 -3.859 804 HB1 ALA 100 HB1 ALA 100 -2.711 1.731 -1.435 805 HB2 ALA 100 HB2 ALA 100 -4.203 2.633 -1.166 806 HB3 ALA 100 HB3 ALA 100 -3.030 3.204 -2.352 807 H THR 101 HN THR 101 -2.717 -0.526 -3.350 808 HA THR 101 HA THR 101 -4.214 -2.258 -1.510 809 HB THR 101 HB THR 101 -5.322 -2.726 -3.586 810 HG1 THR 101 HG1 THR 101 -3.436 -4.772 -3.591 811 HG21 THR 101 HG21 THR 101 -2.579 -3.181 -4.785 812 HG22 THR 101 HG22 THR 101 -4.127 -3.278 -5.624 813 HG23 THR 101 HG23 THR 101 -3.542 -1.724 -5.034 814 H ARG 102 HN ARG 102 -2.977 -3.655 -0.427 815 HA ARG 102 HA ARG 102 -0.163 -4.006 -1.272 816 HB2 ARG 102 HB2 ARG 102 -0.421 -2.619 0.787 817 HB3 ARG 102 HB1 ARG 102 -1.242 -3.980 1.553 818 HG2 ARG 102 HG2 ARG 102 0.763 -5.383 1.201 819 HG3 ARG 102 HG1 ARG 102 1.585 -4.011 0.455 820 HD2 ARG 102 HD2 ARG 102 1.143 -2.734 2.615 821 HD3 ARG 102 HD1 ARG 102 0.652 -4.271 3.320 822 HE ARG 102 HE ARG 102 3.196 -4.565 2.111 823 HH11 ARG 102 HH21 ARG 102 1.590 -3.056 4.779 824 HH12 ARG 102 HH22 ARG 102 2.983 -3.080 5.809 825 HH21 ARG 102 HH11 ARG 102 5.026 -4.599 3.455 826 HH22 ARG 102 HH12 ARG 102 4.927 -3.954 5.059 827 H VAL 103 HN VAL 103 0.366 -6.155 -1.723 828 HA VAL 103 HA VAL 103 -1.477 -8.187 -0.613 829 HB VAL 103 HB VAL 103 -1.676 -7.935 -3.042 830 HG11 VAL 103 HG11 VAL 103 1.195 -8.816 -3.319 831 HG12 VAL 103 HG12 VAL 103 0.142 -8.075 -4.524 832 HG13 VAL 103 HG13 VAL 103 0.787 -7.103 -3.203 833 HG21 VAL 103 HG21 VAL 103 -0.139 -10.448 -2.299 834 HG22 VAL 103 HG22 VAL 103 -1.862 -10.199 -2.019 835 HG23 VAL 103 HG23 VAL 103 -1.237 -10.263 -3.665 836 H LYS 104 HN LYS 104 -0.591 -9.464 0.852 837 HA LYS 104 HA LYS 104 2.330 -9.798 0.918 838 HB2 LYS 104 HB2 LYS 104 0.176 -10.380 2.968 839 HB3 LYS 104 HB1 LYS 104 1.891 -10.721 3.195 840 HG2 LYS 104 HG2 LYS 104 2.443 -8.363 2.966 841 HG3 LYS 104 HG1 LYS 104 0.771 -7.975 2.567 842 HD2 LYS 104 HD2 LYS 104 0.892 -7.430 4.849 843 HD3 LYS 104 HD1 LYS 104 0.208 -9.053 4.876 844 HE2 LYS 104 HE2 LYS 104 2.050 -8.778 6.528 845 HE3 LYS 104 HE1 LYS 104 2.417 -10.011 5.324 846 HZ1 LYS 104 HZ1 LYS 104 3.291 -7.188 5.076 847 HZ2 LYS 104 HZ2 LYS 104 4.246 -8.394 5.797 848 HZ3 LYS 104 HZ3 LYS 104 3.813 -8.522 4.162 849 H ASP 105 HN ASP 105 3.016 -12.062 1.632 850 HA ASP 105 HA ASP 105 2.277 -13.909 -0.334 851 HB2 ASP 105 HB2 ASP 105 3.589 -14.345 2.355 852 HB3 ASP 105 HB1 ASP 105 3.465 -15.579 1.103 853 H GLY 106 HN GLY 106 0.311 -14.717 -0.577 854 HA2 GLY 106 HA2 GLY 106 -1.401 -16.226 -0.106 855 HA3 GLY 106 HA1 GLY 106 -0.876 -16.272 1.569 856 H ARG 107 HN ARG 107 -1.073 -13.055 1.009 857 HA ARG 107 HA ARG 107 -3.990 -12.922 1.515 858 HB2 ARG 107 HB2 ARG 107 -2.621 -12.836 3.643 859 HB3 ARG 107 HB1 ARG 107 -1.965 -11.306 3.061 860 HG2 ARG 107 HG2 ARG 107 -4.230 -10.368 2.912 861 HG3 ARG 107 HG1 ARG 107 -4.912 -11.904 3.452 862 HD2 ARG 107 HD2 ARG 107 -3.565 -11.687 5.559 863 HD3 ARG 107 HD1 ARG 107 -3.074 -10.082 5.027 864 HE ARG 107 HE ARG 107 -5.664 -10.836 6.082 865 HH11 ARG 107 HH21 ARG 107 -3.847 -8.624 4.136 866 HH12 ARG 107 HH22 ARG 107 -4.969 -7.320 4.328 867 HH21 ARG 107 HH11 ARG 107 -7.140 -9.129 6.337 868 HH22 ARG 107 HH12 ARG 107 -6.834 -7.605 5.574 869 H THR 108 HN THR 108 -5.055 -11.173 0.754 870 HA THR 108 HA THR 108 -3.511 -9.140 -0.758 871 HB THR 108 HB THR 108 -6.252 -10.208 -1.475 872 HG1 THR 108 HG1 THR 108 -3.759 -10.735 -2.712 873 HG21 THR 108 HG21 THR 108 -5.828 -9.017 -3.587 874 HG22 THR 108 HG22 THR 108 -5.750 -7.907 -2.219 875 HG23 THR 108 HG23 THR 108 -4.263 -8.480 -2.976 876 H LEU 109 HN LEU 109 -4.343 -7.002 -0.696 877 HA LEU 109 HA LEU 109 -6.645 -6.499 1.053 878 HB2 LEU 109 HB2 LEU 109 -4.870 -6.542 2.622 879 HB3 LEU 109 HB1 LEU 109 -3.831 -5.575 1.611 880 HG LEU 109 HG LEU 109 -5.512 -3.687 1.881 881 HD11 LEU 109 HD11 LEU 109 -6.652 -5.681 3.857 882 HD12 LEU 109 HD12 LEU 109 -7.000 -3.955 3.923 883 HD13 LEU 109 HD13 LEU 109 -7.493 -4.901 2.520 884 HD21 LEU 109 HD21 LEU 109 -3.383 -4.071 3.264 885 HD22 LEU 109 HD22 LEU 109 -4.606 -3.012 3.965 886 HD23 LEU 109 HD23 LEU 109 -4.453 -4.677 4.527 887 H HIS 110 HN HIS 110 -7.594 -4.573 0.797 888 HA HIS 110 HA HIS 110 -6.446 -2.742 -1.186 889 HB2 HIS 110 HB2 HIS 110 -8.663 -2.359 -2.150 890 HB3 HIS 110 HB1 HIS 110 -8.255 -4.071 -2.247 891 HD1 HIS 110 HD1 HIS 110 -9.291 -5.605 -0.261 892 HD2 HIS 110 HD2 HIS 110 -11.009 -1.838 -0.751 893 HE1 HIS 110 HE1 HIS 110 -11.509 -5.665 0.959 894 H MET 111 HN MET 111 -6.972 -0.478 -0.866 895 HA MET 111 HA MET 111 -8.589 0.250 1.395 896 HB2 MET 111 HB2 MET 111 -6.746 1.455 2.569 897 HB3 MET 111 HB1 MET 111 -6.579 -0.299 2.611 898 HG2 MET 111 HG2 MET 111 -4.877 -0.286 0.960 899 HG3 MET 111 HG1 MET 111 -5.245 1.370 0.479 900 HE1 MET 111 HE1 MET 111 -4.305 3.344 1.310 901 HE2 MET 111 HE2 MET 111 -2.833 3.386 2.276 902 HE3 MET 111 HE3 MET 111 -2.876 2.474 0.762 903 H MET 112 HN MET 112 -9.000 2.511 1.535 904 HA MET 112 HA MET 112 -8.518 3.923 -1.016 905 HB2 MET 112 HB2 MET 112 -10.359 4.759 1.219 906 HB3 MET 112 HB1 MET 112 -10.385 5.303 -0.451 907 HG2 MET 112 HG2 MET 112 -10.901 2.441 0.366 908 HG3 MET 112 HG1 MET 112 -12.182 3.638 0.204 909 HE1 MET 112 HE1 MET 112 -13.192 4.448 -1.710 910 HE2 MET 112 HE2 MET 112 -11.809 5.382 -2.273 911 HE3 MET 112 HE3 MET 112 -12.675 4.319 -3.387 912 H ARG 113 HN ARG 113 -7.385 5.829 -1.074 913 HA ARG 113 HA ARG 113 -6.483 6.965 1.514 914 HB2 ARG 113 HB2 ARG 113 -4.625 5.752 0.583 915 HB3 ARG 113 HB1 ARG 113 -4.878 6.479 -1.000 916 HG2 ARG 113 HG2 ARG 113 -4.518 8.430 1.212 917 HG3 ARG 113 HG1 ARG 113 -3.105 7.435 0.878 918 HD2 ARG 113 HD2 ARG 113 -3.420 8.066 -1.587 919 HD3 ARG 113 HD1 ARG 113 -4.562 9.283 -1.021 920 HE ARG 113 HE ARG 113 -2.272 9.659 0.480 921 HH11 ARG 113 HH21 ARG 113 -3.157 9.605 -2.864 922 HH12 ARG 113 HH22 ARG 113 -1.930 10.727 -3.349 923 HH21 ARG 113 HH11 ARG 113 -0.659 11.131 -0.148 924 HH22 ARG 113 HH12 ARG 113 -0.516 11.591 -1.811 925 H LEU 114 HN LEU 114 -6.856 9.075 1.754 926 HA LEU 114 HA LEU 114 -7.510 10.682 -0.644 927 HB2 LEU 114 HB2 LEU 114 -9.489 10.399 0.666 928 HB3 LEU 114 HB1 LEU 114 -8.634 10.738 2.151 929 HG LEU 114 HG LEU 114 -8.270 13.066 1.438 930 HD11 LEU 114 HD11 LEU 114 -9.604 12.062 -1.080 931 HD12 LEU 114 HD12 LEU 114 -9.600 13.776 -0.663 932 HD13 LEU 114 HD13 LEU 114 -8.077 12.927 -0.921 933 HD21 LEU 114 HD21 LEU 114 -10.689 13.781 1.363 934 HD22 LEU 114 HD22 LEU 114 -11.131 12.082 1.203 935 HD23 LEU 114 HD23 LEU 114 -10.321 12.650 2.663 936 H TYR 115 HN TYR 115 -6.255 12.330 -1.020 937 HA TYR 115 HA TYR 115 -4.534 13.375 1.139 938 HB2 TYR 115 HB2 TYR 115 -2.719 12.980 -0.171 939 HB3 TYR 115 HB1 TYR 115 -3.787 12.078 -1.232 940 HD1 TYR 115 HD1 TYR 115 -5.343 13.771 -2.741 941 HD2 TYR 115 HD2 TYR 115 -1.399 14.580 -1.255 942 HE1 TYR 115 HE1 TYR 115 -5.003 15.434 -4.548 943 HE2 TYR 115 HE2 TYR 115 -1.065 16.250 -3.059 944 HH TYR 115 HH TYR 115 -3.102 16.478 -5.750 945 H SER 116 HN SER 116 -3.871 15.588 0.913 946 HA SER 116 HA SER 116 -5.791 17.287 -0.585 947 HB2 SER 116 HB2 SER 116 -6.283 17.466 1.796 948 HB3 SER 116 HB1 SER 116 -4.580 17.748 2.160 949 HG SER 116 HG SER 116 -5.258 19.758 1.970 950 H ARG 117 HN ARG 117 -4.906 19.188 -1.546 951 HA ARG 117 HA ARG 117 -2.079 18.991 -2.136 952 HB2 ARG 117 HB2 ARG 117 -3.820 19.615 -3.839 953 HB3 ARG 117 HB1 ARG 117 -4.058 21.125 -2.967 954 HG2 ARG 117 HG2 ARG 117 -2.500 21.523 -4.791 955 HG3 ARG 117 HG1 ARG 117 -1.626 21.635 -3.267 956 HD2 ARG 117 HD2 ARG 117 -1.727 18.951 -4.581 957 HD3 ARG 117 HD1 ARG 117 -0.708 20.176 -5.327 958 HE ARG 117 HE ARG 117 -0.267 18.883 -2.765 959 HH11 ARG 117 HH21 ARG 117 0.388 21.572 -4.842 960 HH12 ARG 117 HH22 ARG 117 1.888 21.975 -4.076 961 HH21 ARG 117 HH11 ARG 117 1.698 19.406 -1.755 962 HH22 ARG 117 HH12 ARG 117 2.630 20.749 -2.328 963 H SER 118 HN SER 118 -4.157 20.723 -0.005 964 HA SER 118 HA SER 118 -1.891 22.410 0.884 965 HB2 SER 118 HB2 SER 118 -3.645 23.750 -0.205 966 HB3 SER 118 HB1 SER 118 -4.844 23.086 0.899 967 HG SER 118 HG SER 118 -3.380 23.934 2.596 968 HA PRO 119 HA PRO 119 -1.943 20.497 4.876 969 HB2 PRO 119 HB2 PRO 119 -2.438 23.305 5.831 970 HB3 PRO 119 HB1 PRO 119 -1.299 22.093 6.452 971 HG2 PRO 119 HG2 PRO 119 -0.517 24.093 4.838 972 HG3 PRO 119 HG1 PRO 119 0.240 22.493 4.800 973 HD2 PRO 119 HD2 PRO 119 -1.484 23.770 2.778 974 HD3 PRO 119 HD1 PRO 119 -0.412 22.365 2.612 975 H GLU 120 HN GLU 120 -4.518 22.615 3.826 976 HA GLU 120 HA GLU 120 -6.348 21.654 5.906 977 HB2 GLU 120 HB2 GLU 120 -6.783 23.671 3.694 978 HB3 GLU 120 HB1 GLU 120 -7.889 23.330 5.026 979 HG2 GLU 120 HG2 GLU 120 -6.674 25.272 5.690 980 HG3 GLU 120 HG1 GLU 120 -5.967 23.936 6.597 981 H VAL 121 HN VAL 121 -8.566 21.079 5.149 982 HA VAL 121 HA VAL 121 -8.449 19.389 2.713 983 HB VAL 121 HB VAL 121 -10.183 18.899 5.138 984 HG11 VAL 121 HG11 VAL 121 -10.748 17.914 2.848 985 HG12 VAL 121 HG12 VAL 121 -9.250 16.993 2.981 986 HG13 VAL 121 HG13 VAL 121 -10.542 16.748 4.156 987 HG21 VAL 121 HG21 VAL 121 -8.461 17.059 5.584 988 HG22 VAL 121 HG22 VAL 121 -7.399 17.918 4.467 989 HG23 VAL 121 HG23 VAL 121 -7.941 18.705 5.950 990 H SER 122 HN SER 122 -9.873 19.858 1.159 991 HA SER 122 HA SER 122 -11.779 21.985 1.545 992 HB2 SER 122 HB2 SER 122 -12.009 21.993 -0.771 993 HB3 SER 122 HB1 SER 122 -10.364 21.396 -0.569 994 HG SER 122 HG SER 122 -11.791 20.161 -2.009 995 HA PRO 123 HA PRO 123 -15.087 19.306 3.062 996 HB2 PRO 123 HB2 PRO 123 -16.694 21.360 1.568 997 HB3 PRO 123 HB1 PRO 123 -16.969 20.675 3.183 998 HG2 PRO 123 HG2 PRO 123 -15.900 23.094 2.874 999 HG3 PRO 123 HG1 PRO 123 -15.369 22.005 4.168 1000 HD2 PRO 123 HD2 PRO 123 -13.935 22.799 1.687 1001 HD3 PRO 123 HD1 PRO 123 -13.278 22.230 3.238 1002 H ALA 124 HN ALA 124 -14.760 20.407 -0.262 1003 HA ALA 124 HA ALA 124 -16.640 18.555 -1.385 1004 HB1 ALA 124 HB1 ALA 124 -15.797 19.282 -3.524 1005 HB2 ALA 124 HB2 ALA 124 -14.347 19.952 -2.777 1006 HB3 ALA 124 HB3 ALA 124 -15.917 20.698 -2.478 1007 H ALA 125 HN ALA 125 -13.204 18.526 -0.685 1008 HA ALA 125 HA ALA 125 -12.510 16.239 -2.212 1009 HB1 ALA 125 HB1 ALA 125 -11.239 17.295 0.325 1010 HB2 ALA 125 HB2 ALA 125 -10.850 17.831 -1.308 1011 HB3 ALA 125 HB3 ALA 125 -10.499 16.174 -0.817 1012 H THR 126 HN THR 126 -13.612 16.676 1.108 1013 HA THR 126 HA THR 126 -13.380 13.884 1.769 1014 HB THR 126 HB THR 126 -15.122 15.779 3.307 1015 HG1 THR 126 HG1 THR 126 -12.971 16.671 2.622 1016 HG21 THR 126 HG21 THR 126 -13.208 13.548 4.056 1017 HG22 THR 126 HG22 THR 126 -14.112 14.521 5.216 1018 HG23 THR 126 HG23 THR 126 -14.968 13.468 4.091 1019 H ALA 127 HN ALA 127 -15.941 15.984 0.500 1020 HA ALA 127 HA ALA 127 -18.046 14.111 0.956 1021 HB1 ALA 127 HB1 ALA 127 -17.803 16.534 -0.818 1022 HB2 ALA 127 HB2 ALA 127 -18.546 16.450 0.780 1023 HB3 ALA 127 HB3 ALA 127 -19.294 15.622 -0.586 1024 H ILE 128 HN ILE 128 -16.161 15.036 -1.965 1025 HA ILE 128 HA ILE 128 -17.495 13.329 -3.756 1026 HB ILE 128 HB ILE 128 -15.642 15.182 -4.101 1027 HG12 ILE 128 HG12 ILE 128 -16.802 14.127 -5.940 1028 HG13 ILE 128 HG11 ILE 128 -15.080 14.169 -6.294 1029 HG21 ILE 128 HG21 ILE 128 -13.911 12.695 -4.133 1030 HG22 ILE 128 HG22 ILE 128 -13.406 14.357 -4.435 1031 HG23 ILE 128 HG23 ILE 128 -13.911 13.871 -2.819 1032 HD11 ILE 128 HD11 ILE 128 -16.785 11.816 -5.523 1033 HD12 ILE 128 HD12 ILE 128 -15.664 11.970 -6.873 1034 HD13 ILE 128 HD13 ILE 128 -15.047 11.778 -5.233 1035 H PHE 129 HN PHE 129 -14.894 12.960 -1.546 1036 HA PHE 129 HA PHE 129 -13.952 10.402 -2.028 1037 HB2 PHE 129 HB2 PHE 129 -13.061 11.974 -0.305 1038 HB3 PHE 129 HB1 PHE 129 -14.438 11.552 0.712 1039 HD1 PHE 129 HD1 PHE 129 -14.724 9.294 1.608 1040 HD2 PHE 129 HD2 PHE 129 -11.313 10.357 -0.765 1041 HE1 PHE 129 HE1 PHE 129 -13.589 7.206 2.308 1042 HE2 PHE 129 HE2 PHE 129 -10.169 8.276 -0.055 1043 HZ PHE 129 HZ PHE 129 -11.309 6.713 1.482 1044 H ARG 130 HN ARG 130 -16.777 11.421 -0.152 1045 HA ARG 130 HA ARG 130 -17.507 8.819 0.746 1046 HB2 ARG 130 HB2 ARG 130 -18.285 10.729 1.967 1047 HB3 ARG 130 HB1 ARG 130 -19.056 11.404 0.533 1048 HG2 ARG 130 HG2 ARG 130 -20.730 9.716 0.506 1049 HG3 ARG 130 HG1 ARG 130 -19.838 8.702 1.638 1050 HD2 ARG 130 HD2 ARG 130 -20.133 10.452 3.386 1051 HD3 ARG 130 HD1 ARG 130 -21.108 11.384 2.253 1052 HE ARG 130 HE ARG 130 -22.139 8.743 2.504 1053 HH11 ARG 130 HH21 ARG 130 -21.839 11.776 4.143 1054 HH12 ARG 130 HH22 ARG 130 -23.285 11.574 5.074 1055 HH21 ARG 130 HH11 ARG 130 -24.038 8.471 3.722 1056 HH22 ARG 130 HH12 ARG 130 -24.530 9.702 4.836 1057 H LYS 131 HN LYS 131 -18.527 10.777 -2.049 1058 HA LYS 131 HA LYS 131 -20.715 9.336 -2.900 1059 HB2 LYS 131 HB2 LYS 131 -18.551 10.606 -4.589 1060 HB3 LYS 131 HB1 LYS 131 -20.126 10.089 -5.191 1061 HG2 LYS 131 HG2 LYS 131 -21.255 11.630 -3.659 1062 HG3 LYS 131 HG1 LYS 131 -19.707 12.101 -2.961 1063 HD2 LYS 131 HD2 LYS 131 -20.115 13.824 -4.505 1064 HD3 LYS 131 HD1 LYS 131 -19.056 12.742 -5.406 1065 HE2 LYS 131 HE2 LYS 131 -20.947 11.760 -6.565 1066 HE3 LYS 131 HE1 LYS 131 -22.084 12.658 -5.560 1067 HZ1 LYS 131 HZ1 LYS 131 -22.001 14.066 -7.299 1068 HZ2 LYS 131 HZ2 LYS 131 -20.623 14.650 -6.495 1069 HZ3 LYS 131 HZ3 LYS 131 -20.453 13.569 -7.791 1070 H LEU 132 HN LEU 132 -17.377 8.783 -4.090 1071 HA LEU 132 HA LEU 132 -18.019 6.408 -5.468 1072 HB2 LEU 132 HB2 LEU 132 -15.512 5.966 -5.305 1073 HB3 LEU 132 HB1 LEU 132 -16.005 7.460 -6.092 1074 HG LEU 132 HG LEU 132 -15.786 8.233 -3.417 1075 HD11 LEU 132 HD11 LEU 132 -13.365 6.531 -4.025 1076 HD12 LEU 132 HD12 LEU 132 -13.781 7.334 -2.511 1077 HD13 LEU 132 HD13 LEU 132 -14.712 5.937 -3.053 1078 HD21 LEU 132 HD21 LEU 132 -14.969 9.428 -5.466 1079 HD22 LEU 132 HD22 LEU 132 -13.803 9.439 -4.146 1080 HD23 LEU 132 HD23 LEU 132 -13.585 8.335 -5.503 1081 H ALA 133 HN ALA 133 -16.716 6.933 -2.202 1082 HA ALA 133 HA ALA 133 -16.300 4.277 -1.481 1083 HB1 ALA 133 HB1 ALA 133 -16.378 4.993 0.775 1084 HB2 ALA 133 HB2 ALA 133 -17.426 6.355 0.387 1085 HB3 ALA 133 HB3 ALA 133 -15.743 6.359 -0.136 1086 H GLY 134 HN GLY 134 -19.299 6.173 -1.560 1087 HA2 GLY 134 HA2 GLY 134 -20.935 4.287 -0.220 1088 HA3 GLY 134 HA1 GLY 134 -21.495 5.540 -1.330 1089 H GLU 135 HN GLU 135 -19.956 4.745 -3.574 1090 HA GLU 135 HA GLU 135 -21.667 2.818 -4.739 1091 HB2 GLU 135 HB2 GLU 135 -20.345 4.566 -5.989 1092 HB3 GLU 135 HB1 GLU 135 -18.898 3.607 -5.688 1093 HG2 GLU 135 HG2 GLU 135 -21.318 2.330 -6.957 1094 HG3 GLU 135 HG1 GLU 135 -20.194 3.270 -7.935 1095 H ARG 136 HN ARG 136 -18.958 2.567 -2.672 1096 HA ARG 136 HA ARG 136 -18.434 -0.231 -3.440 1097 HB2 ARG 136 HB2 ARG 136 -16.584 1.575 -3.035 1098 HB3 ARG 136 HB1 ARG 136 -16.925 1.298 -1.328 1099 HG2 ARG 136 HG2 ARG 136 -15.261 -0.289 -1.678 1100 HG3 ARG 136 HG1 ARG 136 -16.691 -1.258 -2.027 1101 HD2 ARG 136 HD2 ARG 136 -16.385 -0.503 -4.474 1102 HD3 ARG 136 HD1 ARG 136 -14.782 0.031 -3.980 1103 HE ARG 136 HE ARG 136 -15.634 -2.690 -4.375 1104 HH11 ARG 136 HH21 ARG 136 -13.522 -0.575 -2.630 1105 HH12 ARG 136 HH22 ARG 136 -12.325 -1.790 -2.333 1106 HH21 ARG 136 HH11 ARG 136 -14.067 -4.289 -3.989 1107 HH22 ARG 136 HH12 ARG 136 -12.634 -3.893 -3.101 1108 H ASN 137 HN ASN 137 -20.645 1.247 -1.713 1109 HA ASN 137 HA ASN 137 -21.965 0.727 0.116 1110 HB2 ASN 137 HB2 ASN 137 -20.694 -1.955 -0.267 1111 HB3 ASN 137 HB1 ASN 137 -22.221 -1.643 0.552 1112 HD21 ASN 137 HD21 ASN 137 -23.357 0.235 -1.276 1113 HD22 ASN 137 HD22 ASN 137 -23.649 -0.554 -2.750 1114 H TYR 138 HN TYR 138 -19.387 1.778 0.736 1115 HA TYR 138 HA TYR 138 -18.330 0.245 2.977 1116 HB2 TYR 138 HB2 TYR 138 -16.547 1.724 2.953 1117 HB3 TYR 138 HB1 TYR 138 -17.076 1.849 1.275 1118 HD1 TYR 138 HD1 TYR 138 -19.496 3.472 1.429 1119 HD2 TYR 138 HD2 TYR 138 -15.812 3.860 3.599 1120 HE1 TYR 138 HE1 TYR 138 -19.954 5.882 1.772 1121 HE2 TYR 138 HE2 TYR 138 -16.274 6.263 3.931 1122 HH TYR 138 HH TYR 138 -18.093 8.046 2.292 1123 H THR 139 HN THR 139 -17.975 1.459 5.098 1124 HA THR 139 HA THR 139 -20.364 3.083 5.791 1125 HB THR 139 HB THR 139 -20.813 1.793 7.615 1126 HG1 THR 139 HG1 THR 139 -19.046 0.834 8.832 1127 HG21 THR 139 HG21 THR 139 -20.500 -0.499 7.234 1128 HG22 THR 139 HG22 THR 139 -20.322 0.177 5.616 1129 HG23 THR 139 HG23 THR 139 -18.895 -0.267 6.551 1130 H ASP 140 HN ASP 140 -20.032 4.712 7.423 1131 HA ASP 140 HA ASP 140 -17.872 6.323 7.116 1132 HB2 ASP 140 HB2 ASP 140 -18.413 7.328 9.303 1133 HB3 ASP 140 HB1 ASP 140 -19.859 7.015 8.346 1134 H GLU 141 HN GLU 141 -18.131 3.905 9.787 1135 HA GLU 141 HA GLU 141 -15.674 4.406 10.947 1136 HB2 GLU 141 HB2 GLU 141 -17.141 1.778 10.652 1137 HB3 GLU 141 HB1 GLU 141 -15.780 2.045 11.741 1138 HG2 GLU 141 HG2 GLU 141 -17.063 3.890 12.827 1139 HG3 GLU 141 HG1 GLU 141 -18.439 3.496 11.800 1140 H MET 142 HN MET 142 -16.324 2.968 7.884 1141 HA MET 142 HA MET 142 -13.857 1.500 7.682 1142 HB2 MET 142 HB2 MET 142 -15.613 2.430 5.415 1143 HB3 MET 142 HB1 MET 142 -14.488 1.080 5.423 1144 HG2 MET 142 HG2 MET 142 -16.002 0.300 7.489 1145 HG3 MET 142 HG1 MET 142 -17.196 1.292 6.664 1146 HE1 MET 142 HE1 MET 142 -14.333 -1.123 4.676 1147 HE2 MET 142 HE2 MET 142 -14.477 -1.053 6.429 1148 HE3 MET 142 HE3 MET 142 -15.077 -2.462 5.545 1149 H VAL 143 HN VAL 143 -14.738 4.754 7.358 1150 HA VAL 143 HA VAL 143 -12.137 5.365 6.064 1151 HB VAL 143 HB VAL 143 -14.091 5.902 4.579 1152 HG11 VAL 143 HG11 VAL 143 -15.456 7.873 5.146 1153 HG12 VAL 143 HG12 VAL 143 -15.679 6.601 6.346 1154 HG13 VAL 143 HG13 VAL 143 -14.664 7.996 6.703 1155 HG21 VAL 143 HG21 VAL 143 -12.188 8.023 5.579 1156 HG22 VAL 143 HG22 VAL 143 -12.105 7.087 4.093 1157 HG23 VAL 143 HG23 VAL 143 -13.308 8.361 4.263 1158 H ALA 144 HN ALA 144 -10.779 6.460 7.292 1159 HA ALA 144 HA ALA 144 -11.872 7.881 9.648 1160 HB1 ALA 144 HB1 ALA 144 -10.454 6.138 10.387 1161 HB2 ALA 144 HB2 ALA 144 -9.476 7.601 10.493 1162 HB3 ALA 144 HB3 ALA 144 -9.249 6.484 9.147 1163 H MET 145 HN MET 145 -12.007 10.009 9.309 1164 HA MET 145 HA MET 145 -10.255 11.408 7.528 1165 HB2 MET 145 HB2 MET 145 -12.411 12.258 7.430 1166 HB3 MET 145 HB1 MET 145 -12.742 11.876 9.109 1167 HG2 MET 145 HG2 MET 145 -12.353 14.011 9.667 1168 HG3 MET 145 HG1 MET 145 -10.710 13.872 9.084 1169 HE1 MET 145 HE1 MET 145 -10.179 13.643 6.749 1170 HE2 MET 145 HE2 MET 145 -11.521 13.359 5.646 1171 HE3 MET 145 HE3 MET 145 -10.619 14.877 5.573 1172 H LEU 146 HN LEU 146 -8.625 12.914 8.261 1173 HA LEU 146 HA LEU 146 -8.065 12.831 11.098 1174 HB2 LEU 146 HB2 LEU 146 -6.676 11.449 9.218 1175 HB3 LEU 146 HB1 LEU 146 -5.791 12.970 9.202 1176 HG LEU 146 HG LEU 146 -5.295 12.811 11.482 1177 HD11 LEU 146 HD11 LEU 146 -7.035 11.900 12.786 1178 HD12 LEU 146 HD12 LEU 146 -7.464 10.736 11.536 1179 HD13 LEU 146 HD13 LEU 146 -6.092 10.436 12.595 1180 HD21 LEU 146 HD21 LEU 146 -4.016 11.340 9.903 1181 HD22 LEU 146 HD22 LEU 146 -3.981 10.799 11.578 1182 HD23 LEU 146 HD23 LEU 146 -5.032 10.005 10.419 1183 HA PRO 147 HA PRO 147 -8.077 17.263 10.636 1184 HB2 PRO 147 HB2 PRO 147 -7.075 17.970 13.040 1185 HB3 PRO 147 HB1 PRO 147 -8.662 17.181 12.893 1186 HG2 PRO 147 HG2 PRO 147 -6.005 15.936 13.516 1187 HG3 PRO 147 HG1 PRO 147 -7.542 15.758 14.382 1188 HD2 PRO 147 HD2 PRO 147 -6.709 13.941 12.611 1189 HD3 PRO 147 HD1 PRO 147 -8.431 14.329 12.781 1190 H ARG 148 HN ARG 148 -6.590 19.182 10.962 1191 HA ARG 148 HA ARG 148 -4.296 19.019 9.426 1192 HB2 ARG 148 HB2 ARG 148 -5.054 21.072 11.496 1193 HB3 ARG 148 HB1 ARG 148 -3.792 21.282 10.282 1194 HG2 ARG 148 HG2 ARG 148 -5.431 21.007 8.485 1195 HG3 ARG 148 HG1 ARG 148 -6.705 20.705 9.667 1196 HD2 ARG 148 HD2 ARG 148 -6.865 23.019 8.995 1197 HD3 ARG 148 HD1 ARG 148 -6.239 22.978 10.640 1198 HE ARG 148 HE ARG 148 -4.018 22.990 8.971 1199 HH11 ARG 148 HH21 ARG 148 -6.781 24.969 9.619 1200 HH12 ARG 148 HH22 ARG 148 -5.982 26.455 9.227 1201 HH21 ARG 148 HH11 ARG 148 -2.963 24.933 8.454 1202 HH22 ARG 148 HH12 ARG 148 -3.819 26.435 8.568 1203 H GLN 149 HN GLN 149 -4.659 17.864 12.526 1204 HA GLN 149 HA GLN 149 -2.391 18.565 13.927 1205 HB2 GLN 149 HB2 GLN 149 -3.721 15.854 13.819 1206 HB3 GLN 149 HB1 GLN 149 -2.593 16.385 15.066 1207 HG2 GLN 149 HG2 GLN 149 -5.121 17.907 14.406 1208 HG3 GLN 149 HG1 GLN 149 -5.066 16.643 15.634 1209 HE21 GLN 149 HE21 GLN 149 -4.939 19.927 15.370 1210 HE22 GLN 149 HE22 GLN 149 -3.948 20.288 16.700 1211 H GLU 150 HN GLU 150 -0.307 18.437 13.531 1212 HA GLU 150 HA GLU 150 0.763 16.167 11.951 1213 HB2 GLU 150 HB2 GLU 150 2.295 17.679 10.829 1214 HB3 GLU 150 HB1 GLU 150 0.641 18.230 10.565 1215 HG2 GLU 150 HG2 GLU 150 0.953 19.769 12.561 1216 HG3 GLU 150 HG1 GLU 150 2.665 19.349 12.518 1217 H GLU 151 HN GLU 151 2.660 15.301 12.682 1218 HA GLU 151 HA GLU 151 4.027 16.627 14.946 1219 HB2 GLU 151 HB2 GLU 151 2.433 14.640 15.558 1220 HB3 GLU 151 HB1 GLU 151 3.710 13.635 14.879 1221 HG2 GLU 151 HG2 GLU 151 4.111 15.688 17.074 1222 HG3 GLU 151 HG1 GLU 151 3.961 13.951 17.334 1223 H CYS 152 HN CYS 152 4.084 14.495 12.188 1224 HA CYS 152 HA CYS 152 7.040 14.718 12.080 1225 HB2 CYS 152 HB2 CYS 152 5.299 12.403 11.194 1226 HB3 CYS 152 HB1 CYS 152 7.029 12.538 10.887 1227 H THR 153 HN THR 153 7.903 15.242 10.083 1228 HA THR 153 HA THR 153 6.091 15.512 7.789 1229 HB THR 153 HB THR 153 6.559 17.828 7.437 1230 HG1 THR 153 HG1 THR 153 7.900 18.653 9.463 1231 HG21 THR 153 HG21 THR 153 6.082 17.495 10.413 1232 HG22 THR 153 HG22 THR 153 5.566 18.843 9.400 1233 HG23 THR 153 HG23 THR 153 4.841 17.251 9.187 1234 H VAL 154 HN VAL 154 7.201 15.817 5.770 1235 HA VAL 154 HA VAL 154 9.623 14.349 5.596 1236 HB VAL 154 HB VAL 154 9.336 14.515 3.266 1237 HG11 VAL 154 HG11 VAL 154 6.573 14.736 4.488 1238 HG12 VAL 154 HG12 VAL 154 6.942 14.056 2.904 1239 HG13 VAL 154 HG13 VAL 154 7.526 13.258 4.364 1240 HG21 VAL 154 HG21 VAL 154 9.234 16.848 2.864 1241 HG22 VAL 154 HG22 VAL 154 7.659 16.256 2.339 1242 HG23 VAL 154 HG23 VAL 154 7.826 17.048 3.905 1243 H ASP 155 HN ASP 155 11.520 15.145 4.502 1244 HA ASP 155 HA ASP 155 12.434 17.618 5.639 1245 HB2 ASP 155 HB2 ASP 155 14.021 15.835 5.459 1246 HB3 ASP 155 HB1 ASP 155 13.762 15.703 3.727 1247 H GLU 156 HN GLU 156 13.581 19.180 4.327 1248 HA GLU 156 HA GLU 156 11.869 20.504 2.550 1249 HB2 GLU 156 HB2 GLU 156 14.815 20.780 3.140 1250 HB3 GLU 156 HB1 GLU 156 13.962 21.852 2.039 1251 HG2 GLU 156 HG2 GLU 156 12.353 22.404 3.852 1252 HG3 GLU 156 HG1 GLU 156 13.284 21.389 4.952 1253 H VAL 157 HN VAL 157 14.461 18.198 2.013 1254 HA VAL 157 HA VAL 157 13.568 17.750 -0.698 1255 HB VAL 157 HB VAL 157 15.017 19.697 -1.045 1256 HG11 VAL 157 HG11 VAL 157 17.340 19.683 -0.399 1257 HG12 VAL 157 HG12 VAL 157 16.400 19.262 1.032 1258 HG13 VAL 157 HG13 VAL 157 17.240 18.003 0.126 1259 HG21 VAL 157 HG21 VAL 157 16.418 18.736 -2.747 1260 HG22 VAL 157 HG22 VAL 157 16.478 17.186 -1.907 1261 HG23 VAL 157 HG23 VAL 157 14.975 17.725 -2.656 1262 HN1 EB4 200 H17 EB4 200 0.025 -0.901 5.862 1263 H8 EB4 200 H8 EB4 200 5.018 0.873 1.469 1264 HN2 EB4 200 H25 EB4 200 3.136 -0.204 6.684 1265 H9 EB4 200 H9 EB4 200 0.889 6.017 3.354 1266 H10 EB4 200 H10 EB4 200 -2.580 -0.763 0.542 1267 HN3 EB4 200 H32 EB4 200 0.567 1.890 7.425 1268 H7 EB4 200 H7 EB4 200 -0.956 1.110 0.524 1269 H11 EB4 200 H11 EB4 200 6.786 -0.697 2.216 1270 H12 EB4 200 H12 EB4 200 -0.136 7.329 5.194 1271 H15 EB4 200 H15 EB4 200 -0.466 6.294 7.422 1272 H14 EB4 200 H14 EB4 200 6.769 -1.573 4.536 1273 H13 EB4 200 H13 EB4 200 -2.796 -2.196 2.555 1274 H22 EB4 200 H22 EB4 200 -1.413 -3.174 7.077 1275 H30 EB4 200 H30 EB4 200 -1.016 0.058 10.212 1276 H30A EB4 200 H9N EB4 200 -1.880 1.158 9.031 1277 H24 EB4 200 H24 EB4 200 -0.158 2.389 10.257 1278 H28 EB4 200 H28 EB4 200 0.651 -3.696 8.290 1279 H28A EB4 200 H9L EB4 200 0.814 -3.865 6.534 1280 H23 EB4 200 H23 EB4 200 4.567 -1.738 8.803 1281 H29 EB4 200 H29 EB4 200 3.358 -0.328 10.425 1282 H29A EB4 200 H9M EB4 200 4.390 0.682 9.297 1283 H21 ACD 300 HA3 ACD 300 0.334 9.159 -11.944 1284 H22 ACD 300 HA4 ACD 300 0.516 10.497 -10.790 1285 H31 ACD 300 HA1 ACD 300 0.440 7.530 -10.091 1286 H32 ACD 300 HA2 ACD 300 1.882 8.568 -10.089 1287 H41 ACD 300 HA0 ACD 300 -0.589 8.907 -8.329 1288 H42 ACD 300 HAZ ACD 300 0.796 10.022 -8.369 1289 H5 ACD 300 HAY ACD 300 2.203 7.680 -7.776 1290 H6 ACD 300 HAX ACD 300 1.165 7.165 -5.429 1291 H71 ACD 300 HAV ACD 300 -0.983 9.195 -6.434 1292 H72 ACD 300 HAW ACD 300 -1.496 7.597 -5.851 1293 H8 ACD 300 HAU ACD 300 -0.578 9.957 -4.129 1294 H9 ACD 300 HAT ACD 300 -0.868 8.316 -2.124 1295 H101 ACD 300 HAR ACD 300 -1.638 6.290 -4.319 1296 H102 ACD 300 HAS ACD 300 -0.126 5.943 -3.449 1297 H11 ACD 300 HAQ ACD 300 -2.966 5.662 -2.335 1298 H12 ACD 300 HAP ACD 300 -1.767 5.116 -0.064 1299 H131 ACD 300 HAN ACD 300 0.660 6.621 -1.364 1300 H132 ACD 300 HAO ACD 300 0.845 4.864 -0.879 1301 H14 ACD 300 HAM ACD 300 0.643 5.457 1.472 1302 H15 ACD 300 HAL ACD 300 0.832 7.970 2.127 1303 H161 ACD 300 HAJ ACD 300 -0.452 8.724 -0.445 1304 H162 ACD 300 HAK ACD 300 0.609 9.773 0.518 1305 H171 ACD 300 HAH ACD 300 2.598 8.783 -0.549 1306 H172 ACD 300 HAI ACD 300 1.570 7.689 -1.496 1307 H181 ACD 300 HAF ACD 300 0.398 9.769 -2.416 1308 H182 ACD 300 HAG ACD 300 1.704 10.721 -1.675 1309 H191 ACD 300 HAD ACD 300 3.390 9.556 -2.971 1310 H192 ACD 300 HAE ACD 300 2.188 8.408 -3.601 1311 H201 ACD 300 HAA ACD 300 2.712 10.152 -5.267 1312 H202 ACD 300 HAB ACD 300 2.220 11.420 -4.124 1313 H203 ACD 300 HAC ACD 300 1.018 10.274 -4.762 Start of MODEL 11 1 H1 MET 1 HT1 MET 1 2.562 19.938 -24.278 2 H2 MET 1 HT2 MET 1 1.748 18.470 -24.018 3 H3 MET 1 HT3 MET 1 1.677 19.702 -22.851 4 HA MET 1 HA MET 1 0.483 21.127 -24.409 5 HB2 MET 1 HB2 MET 1 0.566 18.641 -26.145 6 HB3 MET 1 HB1 MET 1 -0.353 20.104 -26.502 7 HG2 MET 1 HG2 MET 1 1.776 21.403 -26.477 8 HG3 MET 1 HG1 MET 1 2.661 19.898 -26.235 9 HE1 MET 1 HE1 MET 1 3.683 20.378 -29.822 10 HE2 MET 1 HE2 MET 1 3.502 21.662 -28.630 11 HE3 MET 1 HE3 MET 1 4.126 20.080 -28.142 12 H THR 2 HN THR 2 -0.196 20.139 -22.091 13 HA THR 2 HA THR 2 -2.928 19.329 -22.422 14 HB THR 2 HB THR 2 -1.218 17.356 -20.917 15 HG1 THR 2 HG1 THR 2 -1.616 16.106 -22.949 16 HG21 THR 2 HG21 THR 2 -3.157 15.918 -21.217 17 HG22 THR 2 HG22 THR 2 -3.687 17.455 -20.535 18 HG23 THR 2 HG23 THR 2 -3.930 17.121 -22.249 19 H VAL 3 HN VAL 3 -1.907 21.565 -21.276 20 HA VAL 3 HA VAL 3 -1.560 22.731 -19.289 21 HB VAL 3 HB VAL 3 -3.909 22.939 -19.621 22 HG11 VAL 3 HG11 VAL 3 -4.091 20.155 -18.445 23 HG12 VAL 3 HG12 VAL 3 -5.486 21.201 -18.691 24 HG13 VAL 3 HG13 VAL 3 -4.535 20.664 -20.073 25 HG21 VAL 3 HG21 VAL 3 -2.780 23.192 -17.158 26 HG22 VAL 3 HG22 VAL 3 -4.467 23.578 -17.485 27 HG23 VAL 3 HG23 VAL 3 -4.040 22.017 -16.787 28 HA PRO 4 HA PRO 4 0.254 18.974 -17.078 29 HB2 PRO 4 HB2 PRO 4 2.265 21.168 -16.686 30 HB3 PRO 4 HB1 PRO 4 2.530 19.442 -17.010 31 HG2 PRO 4 HG2 PRO 4 2.824 21.254 -18.931 32 HG3 PRO 4 HG1 PRO 4 2.113 19.665 -19.269 33 HD2 PRO 4 HD2 PRO 4 0.764 22.325 -19.078 34 HD3 PRO 4 HD1 PRO 4 0.330 20.907 -20.058 35 H ASP 5 HN ASP 5 0.741 18.795 -14.767 36 HA ASP 5 HA ASP 5 0.330 20.998 -12.986 37 HB2 ASP 5 HB2 ASP 5 -1.766 20.186 -11.969 38 HB3 ASP 5 HB1 ASP 5 -2.001 20.669 -13.648 39 H ARG 6 HN ARG 6 1.740 18.237 -13.707 40 HA ARG 6 HA ARG 6 1.541 16.635 -11.379 41 HB2 ARG 6 HB2 ARG 6 3.683 16.903 -13.491 42 HB3 ARG 6 HB1 ARG 6 3.766 15.722 -12.183 43 HG2 ARG 6 HG2 ARG 6 1.843 14.573 -12.938 44 HG3 ARG 6 HG1 ARG 6 1.326 15.921 -13.951 45 HD2 ARG 6 HD2 ARG 6 2.503 13.825 -15.044 46 HD3 ARG 6 HD1 ARG 6 2.876 15.449 -15.617 47 HE ARG 6 HE ARG 6 4.643 14.757 -13.511 48 HH11 ARG 6 HH21 ARG 6 3.877 14.024 -16.805 49 HH12 ARG 6 HH22 ARG 6 5.494 13.569 -17.225 50 HH21 ARG 6 HH11 ARG 6 6.766 14.162 -14.054 51 HH22 ARG 6 HH12 ARG 6 7.130 13.646 -15.667 52 H SER 7 HN SER 7 3.622 19.327 -12.278 53 HA SER 7 HA SER 7 5.434 19.153 -10.112 54 HB2 SER 7 HB2 SER 7 5.932 20.475 -12.102 55 HB3 SER 7 HB1 SER 7 4.578 21.546 -11.756 56 HG SER 7 HG SER 7 5.794 22.555 -10.376 57 H GLU 8 HN GLU 8 2.242 20.555 -10.433 58 HA GLU 8 HA GLU 8 2.250 22.309 -8.257 59 HB2 GLU 8 HB2 GLU 8 -0.030 20.659 -9.366 60 HB3 GLU 8 HB1 GLU 8 -0.208 22.034 -8.275 61 HG2 GLU 8 HG2 GLU 8 0.930 23.479 -9.938 62 HG3 GLU 8 HG1 GLU 8 1.045 22.106 -11.036 63 H ILE 9 HN ILE 9 1.220 18.866 -8.319 64 HA ILE 9 HA ILE 9 1.004 18.892 -5.406 65 HB ILE 9 HB ILE 9 -0.658 17.681 -6.886 66 HG12 ILE 9 HG12 ILE 9 0.884 16.137 -4.771 67 HG13 ILE 9 HG11 ILE 9 -0.491 17.204 -4.492 68 HG21 ILE 9 HG21 ILE 9 -0.017 15.558 -7.824 69 HG22 ILE 9 HG22 ILE 9 1.156 16.747 -8.399 70 HG23 ILE 9 HG23 ILE 9 1.578 15.647 -7.091 71 HD11 ILE 9 HD11 ILE 9 -0.590 14.661 -6.145 72 HD12 ILE 9 HD12 ILE 9 -1.147 14.804 -4.486 73 HD13 ILE 9 HD13 ILE 9 -1.949 15.702 -5.769 74 H ALA 10 HN ALA 10 3.008 17.445 -7.916 75 HA ALA 10 HA ALA 10 4.442 15.678 -6.345 76 HB1 ALA 10 HB1 ALA 10 6.229 15.755 -7.966 77 HB2 ALA 10 HB2 ALA 10 5.621 17.283 -8.606 78 HB3 ALA 10 HB3 ALA 10 4.680 15.804 -8.808 79 H GLY 11 HN GLY 11 6.059 15.797 -4.874 80 HA2 GLY 11 HA2 GLY 11 7.975 17.006 -3.986 81 HA3 GLY 11 HA1 GLY 11 7.058 18.497 -4.207 82 H LYS 12 HN LYS 12 4.528 17.300 -3.355 83 HA LYS 12 HA LYS 12 4.861 16.339 -0.654 84 HB2 LYS 12 HB2 LYS 12 3.939 19.177 -1.151 85 HB3 LYS 12 HB1 LYS 12 3.626 18.308 0.350 86 HG2 LYS 12 HG2 LYS 12 6.182 17.901 0.420 87 HG3 LYS 12 HG1 LYS 12 6.280 19.174 -0.798 88 HD2 LYS 12 HD2 LYS 12 4.971 20.662 0.745 89 HD3 LYS 12 HD1 LYS 12 5.096 19.408 1.979 90 HE2 LYS 12 HE2 LYS 12 7.494 19.575 2.022 91 HE3 LYS 12 HE1 LYS 12 7.504 20.612 0.596 92 HZ1 LYS 12 HZ1 LYS 12 5.936 22.042 2.141 93 HZ2 LYS 12 HZ2 LYS 12 6.824 21.257 3.360 94 HZ3 LYS 12 HZ3 LYS 12 7.627 22.192 2.194 95 H TRP 13 HN TRP 13 3.288 14.783 -0.685 96 HA TRP 13 HA TRP 13 0.595 15.512 -1.710 97 HB2 TRP 13 HB2 TRP 13 2.000 12.824 -1.470 98 HB3 TRP 13 HB1 TRP 13 0.310 12.972 -1.894 99 HD1 TRP 13 HD1 TRP 13 3.450 14.786 -3.214 100 HE1 TRP 13 HE1 TRP 13 3.402 14.554 -5.766 101 HE3 TRP 13 HE3 TRP 13 -0.862 12.124 -3.818 102 HZ2 TRP 13 HZ2 TRP 13 1.846 13.368 -7.780 103 HZ3 TRP 13 HZ3 TRP 13 -1.617 11.471 -6.088 104 HH2 TRP 13 HH2 TRP 13 -0.286 12.107 -8.080 105 H TYR 14 HN TYR 14 -0.938 15.680 -0.067 106 HA TYR 14 HA TYR 14 -0.122 14.792 2.610 107 HB2 TYR 14 HB2 TYR 14 -1.656 16.988 1.487 108 HB3 TYR 14 HB1 TYR 14 -2.565 16.192 2.762 109 HD1 TYR 14 HD2 TYR 14 -0.788 15.415 4.765 110 HD2 TYR 14 HD1 TYR 14 -0.504 18.866 2.243 111 HE1 TYR 14 HE2 TYR 14 0.583 16.554 6.488 112 HE2 TYR 14 HE1 TYR 14 0.855 20.008 3.964 113 HH TYR 14 HH TYR 14 2.174 19.593 5.845 114 H VAL 15 HN VAL 15 -0.976 13.084 3.608 115 HA VAL 15 HA VAL 15 -3.381 11.796 2.465 116 HB VAL 15 HB VAL 15 -1.191 10.768 4.288 117 HG11 VAL 15 HG11 VAL 15 -3.774 9.512 3.340 118 HG12 VAL 15 HG12 VAL 15 -2.401 8.548 3.886 119 HG13 VAL 15 HG13 VAL 15 -3.186 9.672 4.995 120 HG21 VAL 15 HG21 VAL 15 -0.475 9.480 2.440 121 HG22 VAL 15 HG22 VAL 15 -1.975 9.757 1.557 122 HG23 VAL 15 HG23 VAL 15 -0.812 11.069 1.753 123 H VAL 16 HN VAL 16 -5.158 12.670 3.485 124 HA VAL 16 HA VAL 16 -5.026 12.961 6.430 125 HB VAL 16 HB VAL 16 -6.597 14.680 6.323 126 HG11 VAL 16 HG11 VAL 16 -4.959 14.964 3.782 127 HG12 VAL 16 HG12 VAL 16 -5.612 16.277 4.754 128 HG13 VAL 16 HG13 VAL 16 -4.333 15.257 5.388 129 HG21 VAL 16 HG21 VAL 16 -7.202 13.599 3.564 130 HG22 VAL 16 HG22 VAL 16 -8.310 13.850 4.912 131 HG23 VAL 16 HG23 VAL 16 -7.679 15.233 4.019 132 H ALA 17 HN ALA 17 -6.729 11.473 3.795 133 HA ALA 17 HA ALA 17 -8.664 10.317 5.717 134 HB1 ALA 17 HB1 ALA 17 -10.170 11.129 4.238 135 HB2 ALA 17 HB2 ALA 17 -9.655 9.819 3.173 136 HB3 ALA 17 HB3 ALA 17 -8.925 11.418 3.030 137 H LEU 18 HN LEU 18 -9.163 8.156 5.543 138 HA LEU 18 HA LEU 18 -7.606 6.447 3.784 139 HB2 LEU 18 HB2 LEU 18 -6.061 6.813 5.665 140 HB3 LEU 18 HB1 LEU 18 -7.286 6.217 6.782 141 HG LEU 18 HG LEU 18 -6.744 4.409 4.491 142 HD11 LEU 18 HD11 LEU 18 -4.473 4.974 4.712 143 HD12 LEU 18 HD12 LEU 18 -4.590 5.151 6.460 144 HD13 LEU 18 HD13 LEU 18 -4.644 3.547 5.731 145 HD21 LEU 18 HD21 LEU 18 -6.958 4.082 7.501 146 HD22 LEU 18 HD22 LEU 18 -8.170 3.661 6.293 147 HD23 LEU 18 HD23 LEU 18 -6.669 2.743 6.393 148 H ALA 19 HN ALA 19 -8.332 4.316 3.693 149 HA ALA 19 HA ALA 19 -10.613 3.496 5.283 150 HB1 ALA 19 HB1 ALA 19 -11.051 3.367 2.325 151 HB2 ALA 19 HB2 ALA 19 -11.327 4.906 3.137 152 HB3 ALA 19 HB3 ALA 19 -12.232 3.475 3.630 153 H SER 20 HN SER 20 -11.016 1.240 5.102 154 HA SER 20 HA SER 20 -9.519 -0.401 3.277 155 HB2 SER 20 HB2 SER 20 -7.823 0.393 5.050 156 HB3 SER 20 HB1 SER 20 -8.677 -0.688 6.147 157 HG SER 20 HG SER 20 -8.061 -2.392 4.967 158 H ASN 21 HN ASN 21 -9.545 -2.769 4.146 159 HA ASN 21 HA ASN 21 -12.237 -3.271 5.253 160 HB2 ASN 21 HB2 ASN 21 -11.727 -4.029 2.844 161 HB3 ASN 21 HB1 ASN 21 -10.658 -5.217 3.583 162 HD21 ASN 21 HD21 ASN 21 -12.724 -6.336 2.211 163 HD22 ASN 21 HD22 ASN 21 -13.934 -6.899 3.262 164 H THR 22 HN THR 22 -8.963 -3.431 5.699 165 HA THR 22 HA THR 22 -8.942 -5.717 7.468 166 HB THR 22 HB THR 22 -6.961 -3.742 6.420 167 HG1 THR 22 HG1 THR 22 -6.997 -6.550 6.806 168 HG21 THR 22 HG21 THR 22 -5.322 -4.896 8.061 169 HG22 THR 22 HG22 THR 22 -6.309 -3.563 8.653 170 HG23 THR 22 HG23 THR 22 -6.763 -5.227 9.023 171 H GLU 23 HN GLU 23 -10.170 -5.394 9.240 172 HA GLU 23 HA GLU 23 -10.964 -3.132 10.498 173 HB2 GLU 23 HB2 GLU 23 -10.128 -5.660 11.928 174 HB3 GLU 23 HB1 GLU 23 -11.249 -4.439 12.532 175 HG2 GLU 23 HG2 GLU 23 -12.723 -4.869 10.570 176 HG3 GLU 23 HG1 GLU 23 -11.628 -6.153 10.060 177 H PHE 24 HN PHE 24 -7.776 -4.583 10.759 178 HA PHE 24 HA PHE 24 -6.877 -3.233 13.049 179 HB2 PHE 24 HB2 PHE 24 -5.612 -5.077 12.209 180 HB3 PHE 24 HB1 PHE 24 -5.389 -4.296 10.649 181 HD1 PHE 24 HD1 PHE 24 -3.910 -2.323 10.421 182 HD2 PHE 24 HD2 PHE 24 -4.257 -4.485 14.116 183 HE1 PHE 24 HE1 PHE 24 -1.829 -1.255 11.239 184 HE2 PHE 24 HE2 PHE 24 -2.177 -3.415 14.936 185 HZ PHE 24 HZ PHE 24 -0.961 -1.801 13.499 186 H PHE 25 HN PHE 25 -6.710 -2.217 9.597 187 HA PHE 25 HA PHE 25 -5.194 0.103 10.072 188 HB2 PHE 25 HB2 PHE 25 -6.631 -1.146 7.850 189 HB3 PHE 25 HB1 PHE 25 -6.679 0.613 7.773 190 HD1 PHE 25 HD1 PHE 25 -4.439 -2.345 7.899 191 HD2 PHE 25 HD2 PHE 25 -4.707 1.901 7.353 192 HE1 PHE 25 HE1 PHE 25 -2.098 -2.302 7.077 193 HE2 PHE 25 HE2 PHE 25 -2.369 1.949 6.532 194 HZ PHE 25 HZ PHE 25 -1.066 -0.151 6.394 195 H LEU 26 HN LEU 26 -8.738 -0.301 9.763 196 HA LEU 26 HA LEU 26 -9.283 2.490 10.048 197 HB2 LEU 26 HB2 LEU 26 -11.560 1.161 11.018 198 HB3 LEU 26 HB1 LEU 26 -11.301 1.718 9.370 199 HG LEU 26 HG LEU 26 -10.223 -0.955 10.260 200 HD11 LEU 26 HD11 LEU 26 -12.399 -1.843 9.166 201 HD12 LEU 26 HD12 LEU 26 -12.495 -1.243 10.821 202 HD13 LEU 26 HD13 LEU 26 -13.046 -0.234 9.485 203 HD21 LEU 26 HD21 LEU 26 -10.182 -1.418 7.930 204 HD22 LEU 26 HD22 LEU 26 -11.302 -0.105 7.566 205 HD23 LEU 26 HD23 LEU 26 -9.643 0.258 8.042 206 H ARG 27 HN ARG 27 -8.782 -0.139 12.219 207 HA ARG 27 HA ARG 27 -9.776 1.052 14.596 208 HB2 ARG 27 HB2 ARG 27 -9.289 -1.370 14.354 209 HB3 ARG 27 HB1 ARG 27 -7.566 -0.996 14.319 210 HG2 ARG 27 HG2 ARG 27 -7.719 0.001 16.561 211 HG3 ARG 27 HG1 ARG 27 -9.453 -0.322 16.597 212 HD2 ARG 27 HD2 ARG 27 -8.998 -2.743 16.382 213 HD3 ARG 27 HD1 ARG 27 -7.268 -2.412 16.376 214 HE ARG 27 HE ARG 27 -8.212 -1.238 18.687 215 HH11 ARG 27 HH21 ARG 27 -8.260 -4.379 17.239 216 HH12 ARG 27 HH22 ARG 27 -8.266 -5.229 18.748 217 HH21 ARG 27 HH11 ARG 27 -8.219 -2.343 20.673 218 HH22 ARG 27 HH12 ARG 27 -8.242 -4.074 20.694 219 H GLU 28 HN GLU 28 -6.452 0.845 13.291 220 HA GLU 28 HA GLU 28 -5.472 2.592 15.387 221 HB2 GLU 28 HB2 GLU 28 -4.100 1.314 13.023 222 HB3 GLU 28 HB1 GLU 28 -3.280 2.279 14.251 223 HG2 GLU 28 HG2 GLU 28 -4.289 0.694 15.981 224 HG3 GLU 28 HG1 GLU 28 -4.743 -0.341 14.628 225 H LYS 29 HN LYS 29 -5.931 2.972 11.798 226 HA LYS 29 HA LYS 29 -4.634 5.462 11.720 227 HB2 LYS 29 HB2 LYS 29 -6.720 4.199 9.959 228 HB3 LYS 29 HB1 LYS 29 -6.039 5.777 9.605 229 HG2 LYS 29 HG2 LYS 29 -4.445 3.211 9.949 230 HG3 LYS 29 HG1 LYS 29 -4.853 3.938 8.406 231 HD2 LYS 29 HD2 LYS 29 -2.929 4.952 10.502 232 HD3 LYS 29 HD1 LYS 29 -2.637 4.638 8.801 233 HE2 LYS 29 HE2 LYS 29 -4.318 6.527 8.323 234 HE3 LYS 29 HE1 LYS 29 -4.137 6.955 10.025 235 HZ1 LYS 29 HZ1 LYS 29 -1.639 6.851 9.497 236 HZ2 LYS 29 HZ2 LYS 29 -2.126 7.006 7.876 237 HZ3 LYS 29 HZ3 LYS 29 -2.523 8.213 8.999 238 H ASP 30 HN ASP 30 -7.929 4.593 12.515 239 HA ASP 30 HA ASP 30 -9.104 7.140 12.354 240 HB2 ASP 30 HB2 ASP 30 -10.396 5.053 12.685 241 HB3 ASP 30 HB1 ASP 30 -9.733 4.915 14.312 242 H LYS 31 HN LYS 31 -6.743 5.868 14.407 243 HA LYS 31 HA LYS 31 -7.197 7.834 16.537 244 HB2 LYS 31 HB2 LYS 31 -6.810 5.607 17.309 245 HB3 LYS 31 HB1 LYS 31 -5.405 5.422 16.278 246 HG2 LYS 31 HG2 LYS 31 -5.068 7.725 18.037 247 HG3 LYS 31 HG1 LYS 31 -5.432 6.285 18.965 248 HD2 LYS 31 HD2 LYS 31 -3.051 6.376 18.736 249 HD3 LYS 31 HD1 LYS 31 -3.617 5.090 17.673 250 HE2 LYS 31 HE2 LYS 31 -3.407 6.511 15.722 251 HE3 LYS 31 HE1 LYS 31 -3.095 7.923 16.733 252 HZ1 LYS 31 HZ1 LYS 31 -1.160 6.491 17.629 253 HZ2 LYS 31 HZ2 LYS 31 -1.342 5.633 16.175 254 HZ3 LYS 31 HZ3 LYS 31 -0.986 7.291 16.141 255 H MET 32 HN MET 32 -5.043 7.238 13.795 256 HA MET 32 HA MET 32 -2.978 9.000 14.779 257 HB2 MET 32 HB2 MET 32 -3.387 7.212 12.505 258 HB3 MET 32 HB1 MET 32 -2.646 8.724 12.006 259 HG2 MET 32 HG2 MET 32 -0.702 8.320 13.190 260 HG3 MET 32 HG1 MET 32 -1.525 7.404 14.447 261 HE1 MET 32 HE1 MET 32 -2.924 5.356 13.818 262 HE2 MET 32 HE2 MET 32 -2.052 3.965 13.193 263 HE3 MET 32 HE3 MET 32 -1.439 4.837 14.603 264 H LYS 33 HN LYS 33 -2.276 10.556 12.757 265 HA LYS 33 HA LYS 33 -4.573 12.353 12.273 266 HB2 LYS 33 HB2 LYS 33 -1.753 13.148 13.045 267 HB3 LYS 33 HB1 LYS 33 -3.074 14.253 12.667 268 HG2 LYS 33 HG2 LYS 33 -4.281 13.679 14.609 269 HG3 LYS 33 HG1 LYS 33 -3.375 12.184 14.841 270 HD2 LYS 33 HD2 LYS 33 -1.447 13.330 15.599 271 HD3 LYS 33 HD1 LYS 33 -2.016 14.876 14.972 272 HE2 LYS 33 HE2 LYS 33 -2.288 14.794 17.414 273 HE3 LYS 33 HE1 LYS 33 -3.863 14.855 16.624 274 HZ1 LYS 33 HZ1 LYS 33 -2.655 12.246 17.229 275 HZ2 LYS 33 HZ2 LYS 33 -3.406 13.120 18.478 276 HZ3 LYS 33 HZ3 LYS 33 -4.295 12.671 17.105 277 H MET 34 HN MET 34 -3.112 14.262 10.826 278 HA MET 34 HA MET 34 -3.155 13.241 8.259 279 HB2 MET 34 HB2 MET 34 -3.384 15.610 9.121 280 HB3 MET 34 HB1 MET 34 -1.637 15.654 9.240 281 HG2 MET 34 HG2 MET 34 -1.328 15.582 6.956 282 HG3 MET 34 HG1 MET 34 -2.845 14.767 6.653 283 HE1 MET 34 HE1 MET 34 -5.545 17.174 6.801 284 HE2 MET 34 HE2 MET 34 -4.949 15.665 7.481 285 HE3 MET 34 HE3 MET 34 -4.965 17.133 8.455 286 H ALA 35 HN ALA 35 -1.691 12.341 6.936 287 HA ALA 35 HA ALA 35 1.123 12.128 7.837 288 HB1 ALA 35 HB1 ALA 35 -0.744 10.225 6.494 289 HB2 ALA 35 HB2 ALA 35 0.523 9.905 7.676 290 HB3 ALA 35 HB3 ALA 35 0.945 10.183 5.986 291 H MET 36 HN MET 36 2.706 12.107 5.983 292 HA MET 36 HA MET 36 1.747 13.723 3.694 293 HB2 MET 36 HB2 MET 36 4.363 14.567 4.092 294 HB3 MET 36 HB1 MET 36 2.917 15.452 4.570 295 HG2 MET 36 HG2 MET 36 4.123 13.363 6.375 296 HG3 MET 36 HG1 MET 36 4.711 15.021 6.380 297 HE1 MET 36 HE1 MET 36 2.441 14.375 9.572 298 HE2 MET 36 HE2 MET 36 3.127 13.047 8.640 299 HE3 MET 36 HE3 MET 36 4.088 14.495 8.959 300 H ALA 37 HN ALA 37 3.187 13.705 1.841 301 HA ALA 37 HA ALA 37 5.111 11.536 1.616 302 HB1 ALA 37 HB1 ALA 37 3.764 10.675 -0.450 303 HB2 ALA 37 HB2 ALA 37 2.391 11.434 0.355 304 HB3 ALA 37 HB3 ALA 37 3.287 10.152 1.167 305 H ARG 38 HN ARG 38 6.186 11.484 -0.485 306 HA ARG 38 HA ARG 38 5.894 13.940 -2.109 307 HB2 ARG 38 HB2 ARG 38 8.566 12.850 -1.196 308 HB3 ARG 38 HB1 ARG 38 8.263 14.345 -2.080 309 HG2 ARG 38 HG2 ARG 38 6.896 15.136 -0.113 310 HG3 ARG 38 HG1 ARG 38 7.453 13.713 0.769 311 HD2 ARG 38 HD2 ARG 38 9.128 15.983 -0.320 312 HD3 ARG 38 HD1 ARG 38 8.937 15.498 1.361 313 HE ARG 38 HE ARG 38 10.003 13.363 -0.215 314 HH11 ARG 38 HH21 ARG 38 10.754 16.374 1.316 315 HH12 ARG 38 HH22 ARG 38 12.430 16.000 1.542 316 HH21 ARG 38 HH11 ARG 38 12.200 12.865 0.077 317 HH22 ARG 38 HH12 ARG 38 13.249 14.014 0.840 318 H ILE 39 HN ILE 39 5.996 13.513 -4.321 319 HA ILE 39 HA ILE 39 6.785 10.821 -5.147 320 HB ILE 39 HB ILE 39 4.429 11.464 -5.206 321 HG12 ILE 39 HG12 ILE 39 5.295 11.293 -8.077 322 HG13 ILE 39 HG11 ILE 39 5.594 9.932 -7.002 323 HG21 ILE 39 HG21 ILE 39 3.734 13.099 -6.791 324 HG22 ILE 39 HG22 ILE 39 4.837 13.795 -5.612 325 HG23 ILE 39 HG23 ILE 39 5.378 13.429 -7.243 326 HD11 ILE 39 HD11 ILE 39 2.869 11.180 -6.890 327 HD12 ILE 39 HD12 ILE 39 3.248 10.195 -8.296 328 HD13 ILE 39 HD13 ILE 39 3.345 9.491 -6.689 329 H SER 40 HN SER 40 8.202 10.683 -6.937 330 HA SER 40 HA SER 40 8.862 13.190 -8.318 331 HB2 SER 40 HB2 SER 40 11.075 13.244 -7.760 332 HB3 SER 40 HB1 SER 40 10.418 12.577 -6.274 333 HG SER 40 HG SER 40 12.133 11.295 -6.955 334 H PHE 41 HN PHE 41 9.735 12.934 -10.370 335 HA PHE 41 HA PHE 41 9.011 10.416 -11.598 336 HB2 PHE 41 HB2 PHE 41 9.859 13.063 -12.748 337 HB3 PHE 41 HB1 PHE 41 9.410 11.660 -13.719 338 HD1 PHE 41 HD1 PHE 41 8.190 14.214 -11.349 339 HD2 PHE 41 HD2 PHE 41 7.113 10.875 -13.826 340 HE1 PHE 41 HE1 PHE 41 5.792 14.779 -11.069 341 HE2 PHE 41 HE2 PHE 41 4.714 11.439 -13.547 342 HZ PHE 41 HZ PHE 41 4.054 13.392 -12.168 343 H LEU 42 HN LEU 42 10.659 8.983 -10.998 344 HA LEU 42 HA LEU 42 13.444 9.433 -11.426 345 HB2 LEU 42 HB2 LEU 42 11.921 6.814 -11.579 346 HB3 LEU 42 HB1 LEU 42 13.660 6.982 -11.407 347 HG LEU 42 HG LEU 42 11.741 8.177 -9.403 348 HD11 LEU 42 HD11 LEU 42 12.880 5.375 -9.561 349 HD12 LEU 42 HD12 LEU 42 12.317 6.078 -8.047 350 HD13 LEU 42 HD13 LEU 42 11.192 5.847 -9.384 351 HD21 LEU 42 HD21 LEU 42 13.813 7.813 -7.942 352 HD22 LEU 42 HD22 LEU 42 14.686 7.448 -9.427 353 HD23 LEU 42 HD23 LEU 42 13.969 9.042 -9.194 354 H GLY 43 HN GLY 43 10.875 7.969 -13.301 355 HA2 GLY 43 HA2 GLY 43 11.942 8.824 -15.829 356 HA3 GLY 43 HA1 GLY 43 12.053 7.079 -15.583 357 H GLU 44 HN GLU 44 10.413 8.260 -17.586 358 HA GLU 44 HA GLU 44 7.759 8.714 -16.927 359 HB2 GLU 44 HB2 GLU 44 8.853 7.257 -19.348 360 HB3 GLU 44 HB1 GLU 44 7.218 7.901 -19.205 361 HG2 GLU 44 HG2 GLU 44 8.428 9.590 -20.351 362 HG3 GLU 44 HG1 GLU 44 8.327 10.161 -18.686 363 H ASP 45 HN ASP 45 9.546 5.753 -16.784 364 HA ASP 45 HA ASP 45 7.044 4.243 -16.263 365 HB2 ASP 45 HB2 ASP 45 9.741 3.247 -17.209 366 HB3 ASP 45 HB1 ASP 45 8.355 2.225 -16.836 367 H GLU 46 HN GLU 46 9.165 5.874 -14.554 368 HA GLU 46 HA GLU 46 9.027 4.025 -12.290 369 HB2 GLU 46 HB2 GLU 46 11.643 5.212 -13.246 370 HB3 GLU 46 HB1 GLU 46 11.415 4.275 -11.770 371 HG2 GLU 46 HG2 GLU 46 10.523 2.401 -13.245 372 HG3 GLU 46 HG1 GLU 46 11.107 3.327 -14.625 373 H LEU 47 HN LEU 47 8.560 5.084 -10.459 374 HA LEU 47 HA LEU 47 9.283 7.924 -10.185 375 HB2 LEU 47 HB2 LEU 47 6.589 7.201 -9.148 376 HB3 LEU 47 HB1 LEU 47 7.172 8.722 -9.807 377 HG LEU 47 HG LEU 47 6.534 6.252 -11.446 378 HD11 LEU 47 HD11 LEU 47 5.044 8.837 -10.935 379 HD12 LEU 47 HD12 LEU 47 4.610 7.694 -12.203 380 HD13 LEU 47 HD13 LEU 47 4.514 7.214 -10.509 381 HD21 LEU 47 HD21 LEU 47 8.115 8.521 -12.082 382 HD22 LEU 47 HD22 LEU 47 7.506 7.310 -13.197 383 HD23 LEU 47 HD23 LEU 47 6.579 8.774 -12.890 384 H LYS 48 HN LYS 48 9.488 8.646 -8.066 385 HA LYS 48 HA LYS 48 9.820 6.492 -6.058 386 HB2 LYS 48 HB2 LYS 48 11.817 7.921 -6.756 387 HB3 LYS 48 HB1 LYS 48 11.008 9.265 -5.954 388 HG2 LYS 48 HG2 LYS 48 10.847 7.740 -3.899 389 HG3 LYS 48 HG1 LYS 48 12.001 6.691 -4.722 390 HD2 LYS 48 HD2 LYS 48 12.434 9.621 -4.061 391 HD3 LYS 48 HD1 LYS 48 13.174 8.257 -3.224 392 HE2 LYS 48 HE2 LYS 48 13.647 9.186 -6.055 393 HE3 LYS 48 HE1 LYS 48 14.827 8.964 -4.764 394 HZ1 LYS 48 HZ1 LYS 48 14.284 6.563 -4.823 395 HZ2 LYS 48 HZ2 LYS 48 13.326 6.845 -6.198 396 HZ3 LYS 48 HZ3 LYS 48 14.997 7.135 -6.254 397 H VAL 49 HN VAL 49 8.300 6.428 -4.460 398 HA VAL 49 HA VAL 49 7.007 8.983 -3.729 399 HB VAL 49 HB VAL 49 5.758 6.345 -4.324 400 HG11 VAL 49 HG11 VAL 49 5.185 6.469 -1.954 401 HG12 VAL 49 HG12 VAL 49 4.759 8.170 -2.111 402 HG13 VAL 49 HG13 VAL 49 3.775 6.938 -2.898 403 HG21 VAL 49 HG21 VAL 49 5.428 8.210 -5.783 404 HG22 VAL 49 HG22 VAL 49 3.912 7.928 -4.944 405 HG23 VAL 49 HG23 VAL 49 4.957 9.259 -4.449 406 H SER 50 HN SER 50 6.831 9.518 -1.740 407 HA SER 50 HA SER 50 8.231 7.857 0.273 408 HB2 SER 50 HB2 SER 50 9.239 10.021 -0.532 409 HB3 SER 50 HB1 SER 50 7.869 10.843 0.193 410 HG SER 50 HG SER 50 8.767 10.580 2.077 411 H TYR 51 HN TYR 51 7.350 7.639 2.335 412 HA TYR 51 HA TYR 51 4.654 8.789 2.750 413 HB2 TYR 51 HB2 TYR 51 5.545 6.232 4.056 414 HB3 TYR 51 HB1 TYR 51 3.914 6.786 3.693 415 HD1 TYR 51 HD2 TYR 51 7.100 5.952 1.858 416 HD2 TYR 51 HD1 TYR 51 2.817 5.736 1.942 417 HE1 TYR 51 HE2 TYR 51 7.130 4.652 -0.236 418 HE2 TYR 51 HE1 TYR 51 2.846 4.417 -0.161 419 HH TYR 51 HH TYR 51 4.967 2.787 -1.273 420 H ALA 52 HN ALA 52 4.458 9.974 4.572 421 HA ALA 52 HA ALA 52 6.470 9.627 6.710 422 HB1 ALA 52 HB1 ALA 52 6.005 12.223 6.990 423 HB2 ALA 52 HB2 ALA 52 5.631 12.103 5.268 424 HB3 ALA 52 HB3 ALA 52 7.221 11.634 5.858 425 H VAL 53 HN VAL 53 5.396 8.787 8.374 426 HA VAL 53 HA VAL 53 2.648 9.723 8.909 427 HB VAL 53 HB VAL 53 3.983 7.179 9.849 428 HG11 VAL 53 HG11 VAL 53 2.045 8.046 11.189 429 HG12 VAL 53 HG12 VAL 53 1.057 7.962 9.729 430 HG13 VAL 53 HG13 VAL 53 1.729 6.489 10.425 431 HG21 VAL 53 HG21 VAL 53 2.234 7.772 7.451 432 HG22 VAL 53 HG22 VAL 53 3.836 7.037 7.461 433 HG23 VAL 53 HG23 VAL 53 2.453 6.144 8.093 434 HA PRO 54 HA PRO 54 4.438 11.523 12.601 435 HB2 PRO 54 HB2 PRO 54 2.143 12.270 13.862 436 HB3 PRO 54 HB1 PRO 54 2.765 13.123 12.434 437 HG2 PRO 54 HG2 PRO 54 0.595 11.084 12.627 438 HG3 PRO 54 HG1 PRO 54 0.656 12.578 11.675 439 HD2 PRO 54 HD2 PRO 54 1.152 10.104 10.604 440 HD3 PRO 54 HD1 PRO 54 1.871 11.598 9.970 441 H LYS 55 HN LYS 55 4.739 10.997 14.790 442 HA LYS 55 HA LYS 55 3.175 8.843 15.983 443 HB2 LYS 55 HB2 LYS 55 4.946 7.709 14.648 444 HB3 LYS 55 HB1 LYS 55 6.159 8.569 15.596 445 HG2 LYS 55 HG2 LYS 55 5.469 7.494 17.623 446 HG3 LYS 55 HG1 LYS 55 4.023 6.837 16.856 447 HD2 LYS 55 HD2 LYS 55 5.297 5.328 15.517 448 HD3 LYS 55 HD1 LYS 55 6.809 6.149 15.907 449 HE2 LYS 55 HE2 LYS 55 6.391 3.975 17.167 450 HE3 LYS 55 HE1 LYS 55 6.748 5.379 18.173 451 HZ1 LYS 55 HZ1 LYS 55 4.512 5.629 18.744 452 HZ2 LYS 55 HZ2 LYS 55 3.975 4.605 17.499 453 HZ3 LYS 55 HZ3 LYS 55 4.782 3.954 18.842 454 HA PRO 56 HA PRO 56 4.124 12.288 18.960 455 HB2 PRO 56 HB2 PRO 56 2.453 10.303 20.483 456 HB3 PRO 56 HB1 PRO 56 2.408 12.079 20.531 457 HG2 PRO 56 HG2 PRO 56 0.613 10.691 19.132 458 HG3 PRO 56 HG1 PRO 56 1.247 12.239 18.547 459 HD2 PRO 56 HD2 PRO 56 1.769 9.506 17.528 460 HD3 PRO 56 HD1 PRO 56 1.936 11.066 16.691 461 H ASN 57 HN ASN 57 4.731 8.875 18.996 462 HA ASN 57 HA ASN 57 6.559 9.113 21.310 463 HB2 ASN 57 HB2 ASN 57 5.718 6.575 19.906 464 HB3 ASN 57 HB1 ASN 57 6.446 6.743 21.503 465 HD21 ASN 57 HD21 ASN 57 3.430 7.055 19.691 466 HD22 ASN 57 HD22 ASN 57 2.433 7.278 21.046 467 H GLY 58 HN GLY 58 7.011 10.045 18.464 468 HA2 GLY 58 HA2 GLY 58 9.583 9.994 18.013 469 HA3 GLY 58 HA1 GLY 58 9.238 8.310 17.626 470 H CYS 59 HN CYS 59 9.844 8.570 15.447 471 HA CYS 59 HA CYS 59 7.772 9.814 13.767 472 HB2 CYS 59 HB2 CYS 59 10.742 10.349 13.523 473 HB3 CYS 59 HB1 CYS 59 9.552 10.768 12.292 474 H ARG 60 HN ARG 60 7.303 8.620 11.950 475 HA ARG 60 HA ARG 60 9.140 6.361 11.327 476 HB2 ARG 60 HB2 ARG 60 6.941 5.761 12.510 477 HB3 ARG 60 HB1 ARG 60 6.142 6.240 11.013 478 HG2 ARG 60 HG2 ARG 60 7.372 4.580 9.750 479 HG3 ARG 60 HG1 ARG 60 8.368 4.186 11.153 480 HD2 ARG 60 HD2 ARG 60 6.349 3.424 12.361 481 HD3 ARG 60 HD1 ARG 60 5.369 3.790 10.944 482 HE ARG 60 HE ARG 60 7.235 2.096 9.944 483 HH11 ARG 60 HH21 ARG 60 5.178 2.029 12.727 484 HH12 ARG 60 HH22 ARG 60 5.039 0.303 12.754 485 HH21 ARG 60 HH11 ARG 60 7.057 -0.169 9.973 486 HH22 ARG 60 HH12 ARG 60 6.102 -0.941 11.195 487 H LYS 61 HN LYS 61 10.056 6.798 9.429 488 HA LYS 61 HA LYS 61 8.322 7.619 7.190 489 HB2 LYS 61 HB2 LYS 61 9.345 9.668 7.876 490 HB3 LYS 61 HB1 LYS 61 10.938 8.920 7.960 491 HG2 LYS 61 HG2 LYS 61 11.023 8.641 5.580 492 HG3 LYS 61 HG1 LYS 61 9.314 9.042 5.408 493 HD2 LYS 61 HD2 LYS 61 9.824 11.332 6.301 494 HD3 LYS 61 HD1 LYS 61 11.538 10.912 6.272 495 HE2 LYS 61 HE2 LYS 61 11.334 10.430 3.829 496 HE3 LYS 61 HE1 LYS 61 9.663 10.988 3.890 497 HZ1 LYS 61 HZ1 LYS 61 11.892 12.536 3.500 498 HZ2 LYS 61 HZ2 LYS 61 10.324 13.091 3.847 499 HZ3 LYS 61 HZ3 LYS 61 11.435 12.855 5.105 500 H TRP 62 HN TRP 62 8.683 6.600 5.351 501 HA TRP 62 HA TRP 62 11.229 5.212 4.871 502 HB2 TRP 62 HB2 TRP 62 10.099 3.127 4.253 503 HB3 TRP 62 HB1 TRP 62 9.753 3.530 5.934 504 HD1 TRP 62 HD1 TRP 62 8.148 3.960 2.443 505 HE1 TRP 62 HE1 TRP 62 5.585 3.924 2.729 506 HE3 TRP 62 HE3 TRP 62 7.828 3.606 7.527 507 HZ2 TRP 62 HZ2 TRP 62 3.661 3.739 4.826 508 HZ3 TRP 62 HZ3 TRP 62 5.617 3.497 8.641 509 HH2 TRP 62 HH2 TRP 62 3.534 3.563 7.298 510 H GLU 63 HN GLU 63 11.385 4.470 2.570 511 HA GLU 63 HA GLU 63 9.686 6.107 0.772 512 HB2 GLU 63 HB2 GLU 63 11.876 7.172 1.052 513 HB3 GLU 63 HB1 GLU 63 12.676 5.673 0.578 514 HG2 GLU 63 HG2 GLU 63 10.619 6.918 -1.238 515 HG3 GLU 63 HG1 GLU 63 12.269 7.533 -1.225 516 H THR 64 HN THR 64 9.189 5.243 -1.220 517 HA THR 64 HA THR 64 10.153 2.522 -1.836 518 HB THR 64 HB THR 64 7.233 3.255 -2.031 519 HG1 THR 64 HG1 THR 64 8.756 2.242 0.099 520 HG21 THR 64 HG21 THR 64 7.017 0.775 -2.084 521 HG22 THR 64 HG22 THR 64 7.960 1.406 -3.433 522 HG23 THR 64 HG23 THR 64 8.776 0.648 -2.065 523 H THR 65 HN THR 65 10.257 2.016 -3.979 524 HA THR 65 HA THR 65 9.795 4.229 -5.879 525 HB THR 65 HB THR 65 11.547 1.768 -6.076 526 HG1 THR 65 HG1 THR 65 12.545 4.332 -6.286 527 HG21 THR 65 HG21 THR 65 10.824 2.219 -8.287 528 HG22 THR 65 HG22 THR 65 10.873 3.964 -8.034 529 HG23 THR 65 HG23 THR 65 12.375 3.047 -8.151 530 H PHE 66 HN PHE 66 8.583 3.895 -7.763 531 HA PHE 66 HA PHE 66 7.090 1.323 -7.855 532 HB2 PHE 66 HB2 PHE 66 5.252 2.615 -7.523 533 HB3 PHE 66 HB1 PHE 66 6.147 4.105 -7.827 534 HD1 PHE 66 HD1 PHE 66 5.152 1.065 -9.783 535 HD2 PHE 66 HD2 PHE 66 5.384 5.334 -9.662 536 HE1 PHE 66 HE1 PHE 66 4.210 1.179 -12.059 537 HE2 PHE 66 HE2 PHE 66 4.431 5.439 -11.959 538 HZ PHE 66 HZ PHE 66 3.860 3.362 -13.157 539 H LYS 67 HN LYS 67 7.144 0.218 -9.722 540 HA LYS 67 HA LYS 67 8.225 1.585 -12.117 541 HB2 LYS 67 HB2 LYS 67 8.560 -1.294 -11.235 542 HB3 LYS 67 HB1 LYS 67 9.105 -0.640 -12.780 543 HG2 LYS 67 HG2 LYS 67 10.350 1.132 -11.291 544 HG3 LYS 67 HG1 LYS 67 10.138 -0.063 -10.012 545 HD2 LYS 67 HD2 LYS 67 11.143 -1.766 -11.631 546 HD3 LYS 67 HD1 LYS 67 11.606 -0.391 -12.633 547 HE2 LYS 67 HE2 LYS 67 12.435 -0.888 -9.758 548 HE3 LYS 67 HE1 LYS 67 13.475 -0.967 -11.181 549 HZ1 LYS 67 HZ1 LYS 67 11.980 1.482 -10.461 550 HZ2 LYS 67 HZ2 LYS 67 13.530 1.161 -9.844 551 HZ3 LYS 67 HZ3 LYS 67 13.302 1.326 -11.517 552 H LYS 68 HN LYS 68 7.307 1.109 -14.083 553 HA LYS 68 HA LYS 68 4.520 0.472 -14.090 554 HB2 LYS 68 HB2 LYS 68 5.625 2.126 -15.607 555 HB3 LYS 68 HB1 LYS 68 6.363 0.769 -16.458 556 HG2 LYS 68 HG2 LYS 68 4.113 -0.150 -16.933 557 HG3 LYS 68 HG1 LYS 68 3.384 1.217 -16.095 558 HD2 LYS 68 HD2 LYS 68 3.293 1.934 -18.318 559 HD3 LYS 68 HD1 LYS 68 4.803 2.663 -17.773 560 HE2 LYS 68 HE2 LYS 68 5.046 1.532 -19.976 561 HE3 LYS 68 HE1 LYS 68 6.080 0.810 -18.747 562 HZ1 LYS 68 HZ1 LYS 68 4.708 -1.028 -18.551 563 HZ2 LYS 68 HZ2 LYS 68 3.373 -0.247 -19.255 564 HZ3 LYS 68 HZ3 LYS 68 4.683 -0.724 -20.222 565 H THR 69 HN THR 69 3.611 -1.454 -14.170 566 HA THR 69 HA THR 69 4.993 -3.653 -15.596 567 HB THR 69 HB THR 69 5.147 -3.960 -13.134 568 HG1 THR 69 HG1 THR 69 4.571 -6.039 -13.268 569 HG21 THR 69 HG21 THR 69 3.126 -4.316 -11.828 570 HG22 THR 69 HG22 THR 69 3.039 -2.731 -12.595 571 HG23 THR 69 HG23 THR 69 2.120 -4.084 -13.254 572 H SER 70 HN SER 70 3.359 -5.480 -16.049 573 HA SER 70 HA SER 70 1.162 -4.326 -17.518 574 HB2 SER 70 HB2 SER 70 0.694 -6.703 -18.130 575 HB3 SER 70 HB1 SER 70 2.348 -6.206 -18.475 576 HG SER 70 HG SER 70 1.822 -7.257 -15.952 577 H ASP 71 HN ASP 71 0.563 -3.527 -15.103 578 HA ASP 71 HA ASP 71 -0.866 -5.329 -13.444 579 HB2 ASP 71 HB2 ASP 71 -0.021 -3.213 -12.592 580 HB3 ASP 71 HB1 ASP 71 -1.065 -2.326 -13.700 581 H ASP 72 HN ASP 72 -2.581 -2.520 -14.673 582 HA ASP 72 HA ASP 72 -4.342 -3.949 -16.405 583 HB2 ASP 72 HB2 ASP 72 -5.180 -4.883 -14.321 584 HB3 ASP 72 HB1 ASP 72 -5.357 -3.266 -13.641 585 H GLY 73 HN GLY 73 -4.016 -2.268 -17.796 586 HA2 GLY 73 HA2 GLY 73 -4.740 -0.323 -18.827 587 HA3 GLY 73 HA1 GLY 73 -5.695 0.041 -17.391 588 H GLU 74 HN GLU 74 -4.965 1.534 -16.000 589 HA GLU 74 HA GLU 74 -2.166 2.486 -16.302 590 HB2 GLU 74 HB2 GLU 74 -4.750 4.002 -16.070 591 HB3 GLU 74 HB1 GLU 74 -3.267 4.718 -15.441 592 HG2 GLU 74 HG2 GLU 74 -3.648 5.412 -17.767 593 HG3 GLU 74 HG1 GLU 74 -2.192 4.426 -17.641 594 H VAL 75 HN VAL 75 -1.482 1.131 -14.550 595 HA VAL 75 HA VAL 75 -2.182 2.265 -11.939 596 HB VAL 75 HB VAL 75 -1.859 -0.711 -12.265 597 HG11 VAL 75 HG11 VAL 75 -3.299 -0.279 -9.983 598 HG12 VAL 75 HG12 VAL 75 -1.542 -0.351 -10.016 599 HG13 VAL 75 HG13 VAL 75 -2.355 1.208 -10.026 600 HG21 VAL 75 HG21 VAL 75 -4.447 -0.583 -11.774 601 HG22 VAL 75 HG22 VAL 75 -4.310 1.019 -12.498 602 HG23 VAL 75 HG23 VAL 75 -3.863 -0.409 -13.428 603 H TYR 76 HN TYR 76 -0.598 2.024 -10.350 604 HA TYR 76 HA TYR 76 2.105 1.650 -11.482 605 HB2 TYR 76 HB2 TYR 76 1.427 3.113 -8.938 606 HB3 TYR 76 HB1 TYR 76 2.829 3.319 -9.973 607 HD1 TYR 76 HD2 TYR 76 1.604 3.442 -12.679 608 HD2 TYR 76 HD1 TYR 76 0.332 5.216 -8.981 609 HE1 TYR 76 HE2 TYR 76 0.409 5.206 -13.933 610 HE2 TYR 76 HE1 TYR 76 -0.866 6.976 -10.237 611 HH TYR 76 HH TYR 76 -1.685 6.770 -13.357 612 H TYR 77 HN TYR 77 3.641 0.341 -10.470 613 HA TYR 77 HA TYR 77 2.761 -1.115 -8.035 614 HB2 TYR 77 HB2 TYR 77 2.103 -2.296 -10.240 615 HB3 TYR 77 HB1 TYR 77 3.821 -2.650 -10.393 616 HD1 TYR 77 HD2 TYR 77 4.969 -3.698 -8.243 617 HD2 TYR 77 HD1 TYR 77 0.743 -3.768 -9.030 618 HE1 TYR 77 HE2 TYR 77 4.706 -5.602 -6.684 619 HE2 TYR 77 HE1 TYR 77 0.489 -5.676 -7.468 620 HH TYR 77 HH TYR 77 2.652 -6.515 -5.223 621 H SER 78 HN SER 78 4.306 -1.454 -6.607 622 HA SER 78 HA SER 78 7.129 -1.109 -7.419 623 HB2 SER 78 HB2 SER 78 6.427 0.385 -5.627 624 HB3 SER 78 HB1 SER 78 5.788 -0.970 -4.703 625 HG SER 78 HG SER 78 7.876 -1.767 -4.503 626 H GLU 79 HN GLU 79 7.819 -3.064 -8.056 627 HA GLU 79 HA GLU 79 6.943 -5.570 -7.314 628 HB2 GLU 79 HB2 GLU 79 8.546 -4.978 -9.174 629 HB3 GLU 79 HB1 GLU 79 9.821 -4.946 -7.957 630 HG2 GLU 79 HG2 GLU 79 9.175 -7.285 -7.308 631 HG3 GLU 79 HG1 GLU 79 8.052 -7.301 -8.666 632 H GLU 80 HN GLU 80 9.422 -3.611 -5.697 633 HA GLU 80 HA GLU 80 10.214 -5.694 -3.905 634 HB2 GLU 80 HB2 GLU 80 10.634 -2.708 -3.700 635 HB3 GLU 80 HB1 GLU 80 11.486 -3.941 -2.770 636 HG2 GLU 80 HG2 GLU 80 12.311 -4.930 -4.906 637 HG3 GLU 80 HG1 GLU 80 11.541 -3.609 -5.783 638 H ALA 81 HN ALA 81 7.931 -2.988 -3.626 639 HA ALA 81 HA ALA 81 7.396 -3.713 -0.827 640 HB1 ALA 81 HB1 ALA 81 6.166 -1.626 -0.715 641 HB2 ALA 81 HB2 ALA 81 6.334 -1.404 -2.457 642 HB3 ALA 81 HB3 ALA 81 7.759 -1.342 -1.418 643 H LYS 82 HN LYS 82 6.332 -4.989 -3.568 644 HA LYS 82 HA LYS 82 4.241 -5.672 -4.405 645 HB2 LYS 82 HB2 LYS 82 4.024 -6.607 -1.536 646 HB3 LYS 82 HB1 LYS 82 3.325 -7.368 -2.965 647 HG2 LYS 82 HG2 LYS 82 6.302 -7.019 -2.500 648 HG3 LYS 82 HG1 LYS 82 5.411 -8.504 -2.169 649 HD2 LYS 82 HD2 LYS 82 4.627 -8.358 -4.630 650 HD3 LYS 82 HD1 LYS 82 5.930 -7.187 -4.836 651 HE2 LYS 82 HE2 LYS 82 6.214 -10.048 -3.879 652 HE3 LYS 82 HE1 LYS 82 6.768 -9.392 -5.419 653 HZ1 LYS 82 HZ1 LYS 82 7.936 -9.162 -2.781 654 HZ2 LYS 82 HZ2 LYS 82 8.679 -9.116 -4.308 655 HZ3 LYS 82 HZ3 LYS 82 7.931 -7.726 -3.688 656 H LYS 83 HN LYS 83 3.832 -3.184 -4.180 657 HA LYS 83 HA LYS 83 1.110 -2.938 -3.149 658 HB2 LYS 83 HB2 LYS 83 2.509 -2.187 -1.256 659 HB3 LYS 83 HB1 LYS 83 3.282 -1.003 -2.311 660 HG2 LYS 83 HG2 LYS 83 1.146 0.114 -2.694 661 HG3 LYS 83 HG1 LYS 83 0.301 -1.122 -1.767 662 HD2 LYS 83 HD2 LYS 83 0.552 0.633 -0.221 663 HD3 LYS 83 HD1 LYS 83 1.882 -0.451 0.180 664 HE2 LYS 83 HE2 LYS 83 2.553 1.964 0.054 665 HE3 LYS 83 HE1 LYS 83 3.450 0.931 -1.056 666 HZ1 LYS 83 HZ1 LYS 83 0.984 2.083 -2.075 667 HZ2 LYS 83 HZ2 LYS 83 2.254 3.176 -1.797 668 HZ3 LYS 83 HZ3 LYS 83 2.481 1.863 -2.846 669 H LYS 84 HN LYS 84 -0.115 -1.800 -4.488 670 HA LYS 84 HA LYS 84 1.183 -0.017 -6.472 671 HB2 LYS 84 HB2 LYS 84 -0.836 -0.869 -7.933 672 HB3 LYS 84 HB1 LYS 84 0.624 -1.842 -7.811 673 HG2 LYS 84 HG2 LYS 84 -0.362 -3.387 -6.360 674 HG3 LYS 84 HG1 LYS 84 -1.586 -2.242 -5.816 675 HD2 LYS 84 HD2 LYS 84 -2.841 -2.454 -7.817 676 HD3 LYS 84 HD1 LYS 84 -1.504 -3.222 -8.671 677 HE2 LYS 84 HE2 LYS 84 -1.801 -5.267 -7.558 678 HE3 LYS 84 HE1 LYS 84 -2.681 -4.526 -6.224 679 HZ1 LYS 84 HZ1 LYS 84 -4.495 -5.187 -7.303 680 HZ2 LYS 84 HZ2 LYS 84 -4.191 -3.917 -8.390 681 HZ3 LYS 84 HZ3 LYS 84 -3.652 -5.485 -8.749 682 H VAL 85 HN VAL 85 0.103 1.801 -7.078 683 HA VAL 85 HA VAL 85 -2.465 2.303 -5.731 684 HB VAL 85 HB VAL 85 -1.860 4.383 -4.970 685 HG11 VAL 85 HG11 VAL 85 -0.811 2.429 -3.788 686 HG12 VAL 85 HG12 VAL 85 0.694 2.832 -4.615 687 HG13 VAL 85 HG13 VAL 85 -0.027 3.980 -3.487 688 HG21 VAL 85 HG21 VAL 85 -0.706 5.663 -6.548 689 HG22 VAL 85 HG22 VAL 85 0.632 5.251 -5.482 690 HG23 VAL 85 HG23 VAL 85 0.377 4.336 -6.960 691 H GLU 86 HN GLU 86 -3.999 3.002 -6.961 692 HA GLU 86 HA GLU 86 -3.336 3.867 -9.722 693 HB2 GLU 86 HB2 GLU 86 -4.495 1.655 -9.489 694 HB3 GLU 86 HB1 GLU 86 -5.854 2.501 -8.764 695 HG2 GLU 86 HG2 GLU 86 -6.108 3.869 -10.790 696 HG3 GLU 86 HG1 GLU 86 -4.733 3.053 -11.517 697 H VAL 87 HN VAL 87 -3.974 5.727 -10.360 698 HA VAL 87 HA VAL 87 -5.496 7.458 -8.588 699 HB VAL 87 HB VAL 87 -3.374 8.147 -9.645 700 HG11 VAL 87 HG11 VAL 87 -4.744 8.598 -12.265 701 HG12 VAL 87 HG12 VAL 87 -3.051 8.248 -11.926 702 HG13 VAL 87 HG13 VAL 87 -4.238 6.946 -11.910 703 HG21 VAL 87 HG21 VAL 87 -5.116 9.754 -8.912 704 HG22 VAL 87 HG22 VAL 87 -4.148 10.366 -10.255 705 HG23 VAL 87 HG23 VAL 87 -5.774 9.748 -10.550 706 H LEU 88 HN LEU 88 -7.685 6.989 -8.718 707 HA LEU 88 HA LEU 88 -8.981 6.703 -11.301 708 HB2 LEU 88 HB2 LEU 88 -10.571 7.332 -8.828 709 HB3 LEU 88 HB1 LEU 88 -10.973 6.279 -10.176 710 HG LEU 88 HG LEU 88 -10.549 4.802 -8.398 711 HD11 LEU 88 HD11 LEU 88 -8.841 3.473 -9.229 712 HD12 LEU 88 HD12 LEU 88 -9.165 4.510 -10.615 713 HD13 LEU 88 HD13 LEU 88 -7.787 4.841 -9.565 714 HD21 LEU 88 HD21 LEU 88 -7.906 5.446 -7.502 715 HD22 LEU 88 HD22 LEU 88 -8.871 6.914 -7.421 716 HD23 LEU 88 HD23 LEU 88 -9.403 5.460 -6.581 717 H ASP 89 HN ASP 89 -9.207 9.131 -8.648 718 HA ASP 89 HA ASP 89 -9.681 11.195 -10.706 719 HB2 ASP 89 HB2 ASP 89 -11.781 10.491 -9.424 720 HB3 ASP 89 HB1 ASP 89 -11.002 11.145 -7.987 721 H THR 90 HN THR 90 -8.346 12.893 -10.494 722 HA THR 90 HA THR 90 -7.110 13.474 -7.897 723 HB THR 90 HB THR 90 -5.827 11.815 -9.487 724 HG1 THR 90 HG1 THR 90 -4.318 12.179 -8.115 725 HG21 THR 90 HG21 THR 90 -4.888 14.465 -10.539 726 HG22 THR 90 HG22 THR 90 -4.305 12.875 -11.020 727 HG23 THR 90 HG23 THR 90 -5.949 13.368 -11.422 728 H ASP 91 HN ASP 91 -7.252 15.588 -7.544 729 HA ASP 91 HA ASP 91 -8.039 17.409 -9.644 730 HB2 ASP 91 HB2 ASP 91 -8.762 17.565 -7.212 731 HB3 ASP 91 HB1 ASP 91 -7.134 18.147 -6.863 732 H TYR 92 HN TYR 92 -5.127 16.524 -7.990 733 HA TYR 92 HA TYR 92 -2.917 17.009 -8.365 734 HB2 TYR 92 HB2 TYR 92 -4.225 17.468 -10.952 735 HB3 TYR 92 HB1 TYR 92 -2.804 18.477 -10.748 736 HD1 TYR 92 HD1 TYR 92 -0.852 16.995 -9.400 737 HD2 TYR 92 HD2 TYR 92 -3.783 15.540 -12.173 738 HE1 TYR 92 HE1 TYR 92 0.606 15.050 -9.925 739 HE2 TYR 92 HE2 TYR 92 -2.337 13.595 -12.685 740 HH TYR 92 HH TYR 92 0.182 13.100 -12.560 741 H LYS 93 HN LYS 93 -5.025 19.168 -7.285 742 HA LYS 93 HA LYS 93 -2.998 21.201 -6.946 743 HB2 LYS 93 HB2 LYS 93 -4.223 21.576 -9.203 744 HB3 LYS 93 HB1 LYS 93 -5.585 22.081 -8.204 745 HG2 LYS 93 HG2 LYS 93 -3.887 23.628 -7.009 746 HG3 LYS 93 HG1 LYS 93 -2.836 23.324 -8.391 747 HD2 LYS 93 HD2 LYS 93 -5.669 24.387 -8.590 748 HD3 LYS 93 HD1 LYS 93 -4.217 25.384 -8.671 749 HE2 LYS 93 HE2 LYS 93 -3.458 23.872 -10.590 750 HE3 LYS 93 HE1 LYS 93 -5.104 23.238 -10.607 751 HZ1 LYS 93 HZ1 LYS 93 -5.973 25.334 -11.131 752 HZ2 LYS 93 HZ2 LYS 93 -4.522 26.136 -10.756 753 HZ3 LYS 93 HZ3 LYS 93 -4.618 25.162 -12.142 754 H SER 94 HN SER 94 -5.992 19.703 -6.133 755 HA SER 94 HA SER 94 -6.203 21.445 -3.742 756 HB2 SER 94 HB2 SER 94 -8.582 20.350 -5.241 757 HB3 SER 94 HB1 SER 94 -8.581 21.513 -3.918 758 HG SER 94 HG SER 94 -8.558 22.081 -6.425 759 H TYR 95 HN TYR 95 -7.449 18.422 -5.165 760 HA TYR 95 HA TYR 95 -6.591 16.895 -2.860 761 HB2 TYR 95 HB2 TYR 95 -8.946 16.070 -2.405 762 HB3 TYR 95 HB1 TYR 95 -8.609 17.720 -1.881 763 HD1 TYR 95 HD2 TYR 95 -10.294 15.641 -4.433 764 HD2 TYR 95 HD1 TYR 95 -9.621 19.627 -2.980 765 HE1 TYR 95 HE2 TYR 95 -12.132 16.476 -5.873 766 HE2 TYR 95 HE1 TYR 95 -11.459 20.462 -4.421 767 HH TYR 95 HH TYR 95 -13.161 19.875 -5.752 768 H ALA 96 HN ALA 96 -7.153 14.550 -3.123 769 HA ALA 96 HA ALA 96 -8.014 13.735 -5.779 770 HB1 ALA 96 HB1 ALA 96 -5.677 14.197 -6.216 771 HB2 ALA 96 HB2 ALA 96 -5.916 12.449 -6.196 772 HB3 ALA 96 HB3 ALA 96 -5.191 13.255 -4.808 773 H VAL 97 HN VAL 97 -8.611 11.612 -5.925 774 HA VAL 97 HA VAL 97 -8.604 10.047 -3.395 775 HB VAL 97 HB VAL 97 -10.630 9.940 -5.651 776 HG11 VAL 97 HG11 VAL 97 -10.616 7.848 -4.529 777 HG12 VAL 97 HG12 VAL 97 -10.382 8.603 -2.952 778 HG13 VAL 97 HG13 VAL 97 -11.934 8.747 -3.777 779 HG21 VAL 97 HG21 VAL 97 -10.836 11.216 -2.904 780 HG22 VAL 97 HG22 VAL 97 -10.702 12.096 -4.426 781 HG23 VAL 97 HG23 VAL 97 -12.131 11.116 -4.097 782 H ILE 98 HN ILE 98 -7.346 8.193 -3.535 783 HA ILE 98 HA ILE 98 -6.898 7.067 -6.222 784 HB ILE 98 HB ILE 98 -4.951 7.275 -3.924 785 HG12 ILE 98 HG12 ILE 98 -5.008 8.892 -6.487 786 HG13 ILE 98 HG11 ILE 98 -5.626 9.489 -4.949 787 HG21 ILE 98 HG21 ILE 98 -4.712 5.414 -5.711 788 HG22 ILE 98 HG22 ILE 98 -4.317 6.722 -6.820 789 HG23 ILE 98 HG23 ILE 98 -3.316 6.438 -5.403 790 HD11 ILE 98 HD11 ILE 98 -3.001 9.667 -5.835 791 HD12 ILE 98 HD12 ILE 98 -3.554 9.937 -4.187 792 HD13 ILE 98 HD13 ILE 98 -2.966 8.347 -4.667 793 H TYR 99 HN TYR 99 -6.733 4.883 -6.375 794 HA TYR 99 HA TYR 99 -7.815 3.311 -4.137 795 HB2 TYR 99 HB2 TYR 99 -8.746 3.209 -6.522 796 HB3 TYR 99 HB1 TYR 99 -7.278 2.329 -6.940 797 HD1 TYR 99 HD2 TYR 99 -10.310 2.283 -4.799 798 HD2 TYR 99 HD1 TYR 99 -6.956 0.047 -6.283 799 HE1 TYR 99 HE2 TYR 99 -11.312 0.194 -3.914 800 HE2 TYR 99 HE1 TYR 99 -7.960 -2.043 -5.400 801 HH TYR 99 HH TYR 99 -10.801 -1.993 -3.351 802 H ALA 100 HN ALA 100 -6.352 2.552 -2.799 803 HA ALA 100 HA ALA 100 -3.705 1.688 -3.797 804 HB1 ALA 100 HB1 ALA 100 -3.442 3.197 -1.995 805 HB2 ALA 100 HB2 ALA 100 -3.184 1.603 -1.285 806 HB3 ALA 100 HB3 ALA 100 -4.725 2.432 -1.058 807 H THR 101 HN THR 101 -3.108 -0.393 -3.831 808 HA THR 101 HA THR 101 -4.700 -2.381 -2.337 809 HB THR 101 HB THR 101 -3.776 -2.736 -5.196 810 HG1 THR 101 HG1 THR 101 -6.234 -1.892 -4.100 811 HG21 THR 101 HG21 THR 101 -4.278 -4.703 -3.493 812 HG22 THR 101 HG22 THR 101 -5.955 -4.291 -3.854 813 HG23 THR 101 HG23 THR 101 -4.869 -4.785 -5.152 814 H ARG 102 HN ARG 102 -3.416 -3.651 -1.144 815 HA ARG 102 HA ARG 102 -0.601 -4.039 -1.986 816 HB2 ARG 102 HB2 ARG 102 -0.642 -2.568 -0.060 817 HB3 ARG 102 HB1 ARG 102 -1.722 -3.665 0.797 818 HG2 ARG 102 HG2 ARG 102 0.776 -4.935 -0.183 819 HG3 ARG 102 HG1 ARG 102 1.025 -3.687 1.036 820 HD2 ARG 102 HD2 ARG 102 -0.295 -4.818 2.637 821 HD3 ARG 102 HD1 ARG 102 -1.047 -5.844 1.421 822 HE ARG 102 HE ARG 102 0.833 -7.236 1.479 823 HH11 ARG 102 HH21 ARG 102 1.343 -4.288 3.218 824 HH12 ARG 102 HH22 ARG 102 2.812 -4.820 3.965 825 HH21 ARG 102 HH11 ARG 102 2.759 -7.942 2.456 826 HH22 ARG 102 HH12 ARG 102 3.613 -6.889 3.534 827 H VAL 103 HN VAL 103 -0.030 -6.174 -2.261 828 HA VAL 103 HA VAL 103 -1.846 -8.179 -1.065 829 HB VAL 103 HB VAL 103 -2.014 -8.064 -3.511 830 HG11 VAL 103 HG11 VAL 103 0.444 -7.212 -3.675 831 HG12 VAL 103 HG12 VAL 103 0.869 -8.924 -3.699 832 HG13 VAL 103 HG13 VAL 103 -0.173 -8.255 -4.954 833 HG21 VAL 103 HG21 VAL 103 -0.488 -10.508 -2.544 834 HG22 VAL 103 HG22 VAL 103 -2.229 -10.267 -2.422 835 HG23 VAL 103 HG23 VAL 103 -1.472 -10.425 -4.003 836 H LYS 104 HN LYS 104 -0.943 -9.321 0.501 837 HA LYS 104 HA LYS 104 1.976 -9.549 0.645 838 HB2 LYS 104 HB2 LYS 104 0.614 -8.796 2.640 839 HB3 LYS 104 HB1 LYS 104 -0.099 -10.408 2.677 840 HG2 LYS 104 HG2 LYS 104 1.981 -11.441 3.169 841 HG3 LYS 104 HG1 LYS 104 2.895 -10.002 2.715 842 HD2 LYS 104 HD2 LYS 104 2.759 -10.262 5.178 843 HD3 LYS 104 HD1 LYS 104 1.972 -8.782 4.631 844 HE2 LYS 104 HE2 LYS 104 0.689 -10.220 6.340 845 HE3 LYS 104 HE1 LYS 104 -0.197 -9.700 4.907 846 HZ1 LYS 104 HZ1 LYS 104 -0.171 -11.782 4.013 847 HZ2 LYS 104 HZ2 LYS 104 1.255 -12.243 4.813 848 HZ3 LYS 104 HZ3 LYS 104 -0.211 -12.185 5.663 849 H ASP 105 HN ASP 105 2.748 -11.768 1.428 850 HA ASP 105 HA ASP 105 2.157 -13.683 -0.521 851 HB2 ASP 105 HB2 ASP 105 3.401 -13.997 2.217 852 HB3 ASP 105 HB1 ASP 105 3.357 -15.274 1.003 853 H GLY 106 HN GLY 106 0.221 -14.551 -0.813 854 HA2 GLY 106 HA2 GLY 106 -1.445 -16.120 -0.381 855 HA3 GLY 106 HA1 GLY 106 -0.960 -16.145 1.305 856 H ARG 107 HN ARG 107 -1.296 -12.926 0.665 857 HA ARG 107 HA ARG 107 -4.223 -12.927 1.119 858 HB2 ARG 107 HB2 ARG 107 -2.246 -11.327 2.751 859 HB3 ARG 107 HB1 ARG 107 -3.998 -11.360 2.950 860 HG2 ARG 107 HG2 ARG 107 -3.877 -13.790 3.446 861 HG3 ARG 107 HG1 ARG 107 -2.119 -13.713 3.313 862 HD2 ARG 107 HD2 ARG 107 -2.219 -11.883 5.102 863 HD3 ARG 107 HD1 ARG 107 -3.890 -12.372 5.361 864 HE ARG 107 HE ARG 107 -1.973 -14.548 5.469 865 HH11 ARG 107 HH21 ARG 107 -3.660 -12.051 7.169 866 HH12 ARG 107 HH22 ARG 107 -3.511 -12.813 8.716 867 HH21 ARG 107 HH11 ARG 107 -1.771 -15.553 7.495 868 HH22 ARG 107 HH12 ARG 107 -2.442 -14.796 8.901 869 H THR 108 HN THR 108 -5.337 -11.146 0.446 870 HA THR 108 HA THR 108 -3.854 -9.159 -1.184 871 HB THR 108 HB THR 108 -6.654 -10.249 -1.565 872 HG1 THR 108 HG1 THR 108 -4.156 -10.763 -2.672 873 HG21 THR 108 HG21 THR 108 -5.077 -8.084 -2.960 874 HG22 THR 108 HG22 THR 108 -6.443 -8.894 -3.726 875 HG23 THR 108 HG23 THR 108 -6.684 -7.968 -2.244 876 H LEU 109 HN LEU 109 -4.777 -6.988 -1.209 877 HA LEU 109 HA LEU 109 -6.705 -6.382 0.908 878 HB2 LEU 109 HB2 LEU 109 -4.243 -6.386 1.763 879 HB3 LEU 109 HB1 LEU 109 -4.116 -4.862 0.910 880 HG LEU 109 HG LEU 109 -6.326 -4.258 2.182 881 HD11 LEU 109 HD11 LEU 109 -5.322 -5.971 4.394 882 HD12 LEU 109 HD12 LEU 109 -6.973 -5.527 3.965 883 HD13 LEU 109 HD13 LEU 109 -6.156 -6.825 3.098 884 HD21 LEU 109 HD21 LEU 109 -4.900 -3.575 4.195 885 HD22 LEU 109 HD22 LEU 109 -3.567 -4.422 3.411 886 HD23 LEU 109 HD23 LEU 109 -4.321 -3.039 2.617 887 H HIS 110 HN HIS 110 -7.543 -4.319 0.838 888 HA HIS 110 HA HIS 110 -6.819 -2.604 -1.409 889 HB2 HIS 110 HB2 HIS 110 -9.302 -2.358 -1.963 890 HB3 HIS 110 HB1 HIS 110 -8.544 -3.873 -2.457 891 HD1 HIS 110 HD1 HIS 110 -11.485 -2.716 -0.834 892 HD2 HIS 110 HD2 HIS 110 -8.878 -5.893 -0.135 893 HE1 HIS 110 HE1 HIS 110 -12.745 -4.371 0.611 894 H MET 111 HN MET 111 -7.333 -0.394 -1.070 895 HA MET 111 HA MET 111 -8.917 0.369 1.216 896 HB2 MET 111 HB2 MET 111 -6.759 1.809 1.944 897 HB3 MET 111 HB1 MET 111 -7.097 0.214 2.614 898 HG2 MET 111 HG2 MET 111 -5.529 -0.840 1.193 899 HG3 MET 111 HG1 MET 111 -5.461 0.544 0.101 900 HE1 MET 111 HE1 MET 111 -4.862 -0.913 3.459 901 HE2 MET 111 HE2 MET 111 -3.658 0.087 4.270 902 HE3 MET 111 HE3 MET 111 -5.337 0.633 4.157 903 H MET 112 HN MET 112 -9.519 2.543 1.171 904 HA MET 112 HA MET 112 -8.796 3.988 -1.314 905 HB2 MET 112 HB2 MET 112 -11.249 3.263 -0.840 906 HB3 MET 112 HB1 MET 112 -11.242 4.559 0.354 907 HG2 MET 112 HG2 MET 112 -12.018 5.658 -1.563 908 HG3 MET 112 HG1 MET 112 -10.293 6.017 -1.604 909 HE1 MET 112 HE1 MET 112 -13.196 4.842 -3.825 910 HE2 MET 112 HE2 MET 112 -12.251 6.329 -3.802 911 HE3 MET 112 HE3 MET 112 -12.132 5.220 -5.177 912 H ARG 113 HN ARG 113 -8.241 6.178 -1.164 913 HA ARG 113 HA ARG 113 -8.065 7.371 1.522 914 HB2 ARG 113 HB2 ARG 113 -5.692 7.297 -0.351 915 HB3 ARG 113 HB1 ARG 113 -5.741 7.911 1.301 916 HG2 ARG 113 HG2 ARG 113 -6.423 5.542 2.003 917 HG3 ARG 113 HG1 ARG 113 -5.958 5.039 0.378 918 HD2 ARG 113 HD2 ARG 113 -3.694 5.819 0.715 919 HD3 ARG 113 HD1 ARG 113 -4.124 6.550 2.258 920 HE ARG 113 HE ARG 113 -4.769 3.911 2.584 921 HH11 ARG 113 HH21 ARG 113 -1.969 5.659 1.546 922 HH12 ARG 113 HH22 ARG 113 -0.843 4.495 2.164 923 HH21 ARG 113 HH11 ARG 113 -3.298 2.384 3.401 924 HH22 ARG 113 HH12 ARG 113 -1.596 2.641 3.213 925 H LEU 114 HN LEU 114 -7.595 9.676 1.465 926 HA LEU 114 HA LEU 114 -8.145 10.951 -1.153 927 HB2 LEU 114 HB2 LEU 114 -10.202 11.557 -0.463 928 HB3 LEU 114 HB1 LEU 114 -9.917 10.916 1.142 929 HG LEU 114 HG LEU 114 -8.625 13.139 1.586 930 HD11 LEU 114 HD11 LEU 114 -8.710 13.614 -0.985 931 HD12 LEU 114 HD12 LEU 114 -10.347 14.176 -0.656 932 HD13 LEU 114 HD13 LEU 114 -8.973 14.949 0.135 933 HD21 LEU 114 HD21 LEU 114 -11.587 12.772 1.300 934 HD22 LEU 114 HD22 LEU 114 -10.623 12.980 2.756 935 HD23 LEU 114 HD23 LEU 114 -10.966 14.365 1.724 936 H TYR 115 HN TYR 115 -6.896 12.642 -1.606 937 HA TYR 115 HA TYR 115 -4.963 13.488 0.450 938 HB2 TYR 115 HB2 TYR 115 -4.816 13.581 -2.564 939 HB3 TYR 115 HB1 TYR 115 -3.575 14.212 -1.481 940 HD1 TYR 115 HD1 TYR 115 -5.561 11.091 -2.120 941 HD2 TYR 115 HD2 TYR 115 -1.858 12.790 -0.763 942 HE1 TYR 115 HE1 TYR 115 -4.611 8.818 -1.880 943 HE2 TYR 115 HE2 TYR 115 -0.906 10.516 -0.528 944 HH TYR 115 HH TYR 115 -2.844 7.692 -0.658 945 H SER 116 HN SER 116 -4.197 15.739 0.351 946 HA SER 116 HA SER 116 -6.180 17.664 -0.668 947 HB2 SER 116 HB2 SER 116 -6.641 17.253 1.757 948 HB3 SER 116 HB1 SER 116 -4.984 17.737 2.121 949 HG SER 116 HG SER 116 -6.413 19.468 0.509 950 H ARG 117 HN ARG 117 -5.265 19.693 -1.198 951 HA ARG 117 HA ARG 117 -2.414 19.601 -1.736 952 HB2 ARG 117 HB2 ARG 117 -4.108 20.555 -3.328 953 HB3 ARG 117 HB1 ARG 117 -4.350 21.879 -2.200 954 HG2 ARG 117 HG2 ARG 117 -2.737 22.602 -3.862 955 HG3 ARG 117 HG1 ARG 117 -1.890 22.376 -2.339 956 HD2 ARG 117 HD2 ARG 117 -0.774 20.480 -3.084 957 HD3 ARG 117 HD1 ARG 117 -2.040 20.053 -4.231 958 HE ARG 117 HE ARG 117 -0.881 21.274 -5.808 959 HH11 ARG 117 HH21 ARG 117 -0.101 22.378 -2.624 960 HH12 ARG 117 HH22 ARG 117 1.076 23.529 -3.162 961 HH21 ARG 117 HH11 ARG 117 0.661 22.781 -6.521 962 HH22 ARG 117 HH12 ARG 117 1.507 23.758 -5.368 963 H SER 118 HN SER 118 -4.513 20.805 0.671 964 HA SER 118 HA SER 118 -2.290 22.316 1.911 965 HB2 SER 118 HB2 SER 118 -4.029 23.849 1.085 966 HB3 SER 118 HB1 SER 118 -5.244 22.972 2.011 967 HG SER 118 HG SER 118 -4.012 24.969 2.895 968 HA PRO 119 HA PRO 119 -2.431 19.604 5.409 969 HB2 PRO 119 HB2 PRO 119 -2.879 22.157 6.933 970 HB3 PRO 119 HB1 PRO 119 -1.767 20.818 7.287 971 HG2 PRO 119 HG2 PRO 119 -0.933 23.101 6.143 972 HG3 PRO 119 HG1 PRO 119 -0.207 21.531 5.765 973 HD2 PRO 119 HD2 PRO 119 -1.900 23.246 4.061 974 HD3 PRO 119 HD1 PRO 119 -0.837 21.900 3.598 975 H GLU 120 HN GLU 120 -4.931 21.956 4.782 976 HA GLU 120 HA GLU 120 -6.822 20.678 6.618 977 HB2 GLU 120 HB2 GLU 120 -7.282 23.002 4.742 978 HB3 GLU 120 HB1 GLU 120 -8.288 22.514 6.107 979 HG2 GLU 120 HG2 GLU 120 -6.347 22.945 7.628 980 HG3 GLU 120 HG1 GLU 120 -5.450 23.569 6.244 981 H VAL 121 HN VAL 121 -9.101 20.454 5.650 982 HA VAL 121 HA VAL 121 -8.916 19.044 3.047 983 HB VAL 121 HB VAL 121 -10.916 18.434 5.222 984 HG11 VAL 121 HG11 VAL 121 -11.185 16.362 4.005 985 HG12 VAL 121 HG12 VAL 121 -11.308 17.685 2.846 986 HG13 VAL 121 HG13 VAL 121 -9.819 16.745 2.956 987 HG21 VAL 121 HG21 VAL 121 -9.336 16.445 5.654 988 HG22 VAL 121 HG22 VAL 121 -8.107 17.391 4.812 989 HG23 VAL 121 HG23 VAL 121 -8.835 18.010 6.295 990 H SER 122 HN SER 122 -10.270 19.682 1.471 991 HA SER 122 HA SER 122 -12.023 21.942 1.986 992 HB2 SER 122 HB2 SER 122 -10.589 21.939 -0.008 993 HB3 SER 122 HB1 SER 122 -11.391 20.482 -0.587 994 HG SER 122 HG SER 122 -12.996 22.645 0.124 995 HA PRO 123 HA PRO 123 -15.748 19.569 2.731 996 HB2 PRO 123 HB2 PRO 123 -16.894 21.637 0.873 997 HB3 PRO 123 HB1 PRO 123 -17.533 21.037 2.418 998 HG2 PRO 123 HG2 PRO 123 -16.265 23.384 2.241 999 HG3 PRO 123 HG1 PRO 123 -16.115 22.343 3.667 1000 HD2 PRO 123 HD2 PRO 123 -14.096 22.940 1.578 1001 HD3 PRO 123 HD1 PRO 123 -13.863 22.348 3.238 1002 H ALA 124 HN ALA 124 -14.898 20.633 -0.542 1003 HA ALA 124 HA ALA 124 -16.529 18.682 -1.876 1004 HB1 ALA 124 HB1 ALA 124 -14.264 20.445 -2.825 1005 HB2 ALA 124 HB2 ALA 124 -15.993 20.702 -3.060 1006 HB3 ALA 124 HB3 ALA 124 -15.178 19.374 -3.887 1007 H ALA 125 HN ALA 125 -13.198 18.852 -0.775 1008 HA ALA 125 HA ALA 125 -12.233 16.582 -2.185 1009 HB1 ALA 125 HB1 ALA 125 -11.257 17.735 0.438 1010 HB2 ALA 125 HB2 ALA 125 -10.766 18.300 -1.158 1011 HB3 ALA 125 HB3 ALA 125 -10.355 16.667 -0.636 1012 H THR 126 HN THR 126 -13.578 17.020 1.060 1013 HA THR 126 HA THR 126 -13.292 14.263 1.795 1014 HB THR 126 HB THR 126 -15.315 15.980 3.167 1015 HG1 THR 126 HG1 THR 126 -13.951 17.491 3.596 1016 HG21 THR 126 HG21 THR 126 -14.499 14.895 5.118 1017 HG22 THR 126 HG22 THR 126 -14.472 13.636 3.883 1018 HG23 THR 126 HG23 THR 126 -12.978 14.457 4.340 1019 H ALA 127 HN ALA 127 -15.813 16.199 0.273 1020 HA ALA 127 HA ALA 127 -17.889 14.266 0.582 1021 HB1 ALA 127 HB1 ALA 127 -18.333 16.639 0.340 1022 HB2 ALA 127 HB2 ALA 127 -19.100 15.727 -0.961 1023 HB3 ALA 127 HB3 ALA 127 -17.611 16.624 -1.268 1024 H ILE 128 HN ILE 128 -15.875 15.231 -2.246 1025 HA ILE 128 HA ILE 128 -17.090 13.450 -4.065 1026 HB ILE 128 HB ILE 128 -15.301 15.406 -4.356 1027 HG12 ILE 128 HG12 ILE 128 -16.450 14.374 -6.214 1028 HG13 ILE 128 HG11 ILE 128 -14.732 14.451 -6.578 1029 HG21 ILE 128 HG21 ILE 128 -13.515 12.960 -4.462 1030 HG22 ILE 128 HG22 ILE 128 -13.051 14.635 -4.744 1031 HG23 ILE 128 HG23 ILE 128 -13.519 14.112 -3.127 1032 HD11 ILE 128 HD11 ILE 128 -14.621 12.048 -5.601 1033 HD12 ILE 128 HD12 ILE 128 -16.373 12.048 -5.793 1034 HD13 ILE 128 HD13 ILE 128 -15.332 12.252 -7.200 1035 H PHE 129 HN PHE 129 -14.557 13.251 -1.778 1036 HA PHE 129 HA PHE 129 -13.492 10.715 -2.243 1037 HB2 PHE 129 HB2 PHE 129 -12.480 12.315 -0.742 1038 HB3 PHE 129 HB1 PHE 129 -13.882 12.263 0.319 1039 HD1 PHE 129 HD1 PHE 129 -11.697 9.679 -1.355 1040 HD2 PHE 129 HD2 PHE 129 -13.486 11.089 2.288 1041 HE1 PHE 129 HE1 PHE 129 -10.711 7.769 -0.130 1042 HE2 PHE 129 HE2 PHE 129 -12.490 9.182 3.511 1043 HZ PHE 129 HZ PHE 129 -11.104 7.517 2.305 1044 H ARG 130 HN ARG 130 -16.225 11.729 -0.220 1045 HA ARG 130 HA ARG 130 -16.855 9.111 0.725 1046 HB2 ARG 130 HB2 ARG 130 -18.346 11.731 0.679 1047 HB3 ARG 130 HB1 ARG 130 -19.087 10.254 1.296 1048 HG2 ARG 130 HG2 ARG 130 -17.415 10.018 2.995 1049 HG3 ARG 130 HG1 ARG 130 -16.408 11.272 2.271 1050 HD2 ARG 130 HD2 ARG 130 -18.152 12.949 2.747 1051 HD3 ARG 130 HD1 ARG 130 -19.162 11.697 3.467 1052 HE ARG 130 HE ARG 130 -16.565 11.834 4.690 1053 HH11 ARG 130 HH21 ARG 130 -19.720 13.247 4.535 1054 HH12 ARG 130 HH22 ARG 130 -19.670 13.870 6.151 1055 HH21 ARG 130 HH11 ARG 130 -16.494 12.647 6.809 1056 HH22 ARG 130 HH12 ARG 130 -17.844 13.530 7.438 1057 H LYS 131 HN LYS 131 -18.035 11.098 -1.982 1058 HA LYS 131 HA LYS 131 -20.251 9.652 -2.755 1059 HB2 LYS 131 HB2 LYS 131 -19.391 11.772 -3.805 1060 HB3 LYS 131 HB1 LYS 131 -18.206 10.792 -4.670 1061 HG2 LYS 131 HG2 LYS 131 -20.075 9.448 -5.633 1062 HG3 LYS 131 HG1 LYS 131 -21.222 10.531 -4.843 1063 HD2 LYS 131 HD2 LYS 131 -20.140 12.448 -6.066 1064 HD3 LYS 131 HD1 LYS 131 -19.189 11.266 -6.966 1065 HE2 LYS 131 HE2 LYS 131 -21.080 11.732 -8.339 1066 HE3 LYS 131 HE1 LYS 131 -21.414 10.168 -7.594 1067 HZ1 LYS 131 HZ1 LYS 131 -22.654 12.767 -7.109 1068 HZ2 LYS 131 HZ2 LYS 131 -23.349 11.217 -7.122 1069 HZ3 LYS 131 HZ3 LYS 131 -22.466 11.739 -5.771 1070 H LEU 132 HN LEU 132 -16.948 9.157 -4.056 1071 HA LEU 132 HA LEU 132 -17.555 6.786 -5.449 1072 HB2 LEU 132 HB2 LEU 132 -14.871 7.387 -4.198 1073 HB3 LEU 132 HB1 LEU 132 -15.207 6.483 -5.675 1074 HG LEU 132 HG LEU 132 -15.592 9.456 -5.234 1075 HD11 LEU 132 HD11 LEU 132 -13.276 8.489 -5.732 1076 HD12 LEU 132 HD12 LEU 132 -13.920 8.021 -7.305 1077 HD13 LEU 132 HD13 LEU 132 -13.856 9.724 -6.850 1078 HD21 LEU 132 HD21 LEU 132 -16.197 9.331 -7.748 1079 HD22 LEU 132 HD22 LEU 132 -16.479 7.612 -7.460 1080 HD23 LEU 132 HD23 LEU 132 -17.429 8.820 -6.595 1081 H ALA 133 HN ALA 133 -16.270 7.333 -2.190 1082 HA ALA 133 HA ALA 133 -15.890 4.690 -1.414 1083 HB1 ALA 133 HB1 ALA 133 -15.425 6.945 -0.160 1084 HB2 ALA 133 HB2 ALA 133 -15.755 5.482 0.762 1085 HB3 ALA 133 HB3 ALA 133 -17.029 6.680 0.520 1086 H GLY 134 HN GLY 134 -18.862 6.596 -1.677 1087 HA2 GLY 134 HA2 GLY 134 -20.558 4.811 -0.270 1088 HA3 GLY 134 HA1 GLY 134 -21.064 6.023 -1.440 1089 H GLU 135 HN GLU 135 -19.547 5.136 -3.630 1090 HA GLU 135 HA GLU 135 -21.261 3.188 -4.739 1091 HB2 GLU 135 HB2 GLU 135 -18.481 3.975 -5.652 1092 HB3 GLU 135 HB1 GLU 135 -19.711 3.168 -6.626 1093 HG2 GLU 135 HG2 GLU 135 -21.206 5.122 -6.337 1094 HG3 GLU 135 HG1 GLU 135 -19.949 5.933 -5.404 1095 H ARG 136 HN ARG 136 -18.567 2.944 -2.634 1096 HA ARG 136 HA ARG 136 -18.130 0.110 -3.332 1097 HB2 ARG 136 HB2 ARG 136 -16.216 1.868 -3.073 1098 HB3 ARG 136 HB1 ARG 136 -16.487 1.662 -1.344 1099 HG2 ARG 136 HG2 ARG 136 -16.102 -0.754 -1.544 1100 HG3 ARG 136 HG1 ARG 136 -15.906 -0.594 -3.289 1101 HD2 ARG 136 HD2 ARG 136 -13.985 0.959 -2.872 1102 HD3 ARG 136 HD1 ARG 136 -14.137 0.619 -1.151 1103 HE ARG 136 HE ARG 136 -13.054 -1.388 -1.535 1104 HH11 ARG 136 HH21 ARG 136 -14.444 -0.175 -4.462 1105 HH12 ARG 136 HH22 ARG 136 -13.773 -1.422 -5.461 1106 HH21 ARG 136 HH11 ARG 136 -12.172 -3.027 -2.836 1107 HH22 ARG 136 HH12 ARG 136 -12.487 -3.038 -4.540 1108 H ASN 137 HN ASN 137 -20.320 1.583 -1.619 1109 HA ASN 137 HA ASN 137 -21.576 1.108 0.259 1110 HB2 ASN 137 HB2 ASN 137 -20.142 -1.512 0.052 1111 HB3 ASN 137 HB1 ASN 137 -21.662 -1.233 0.895 1112 HD21 ASN 137 HD21 ASN 137 -22.782 0.551 -1.166 1113 HD22 ASN 137 HD22 ASN 137 -23.141 -0.422 -2.509 1114 H TYR 138 HN TYR 138 -19.087 2.372 0.713 1115 HA TYR 138 HA TYR 138 -17.662 1.183 2.880 1116 HB2 TYR 138 HB2 TYR 138 -16.379 3.138 2.911 1117 HB3 TYR 138 HB1 TYR 138 -16.907 3.043 1.234 1118 HD1 TYR 138 HD1 TYR 138 -19.798 3.913 1.617 1119 HD2 TYR 138 HD2 TYR 138 -16.125 5.487 3.173 1120 HE1 TYR 138 HE1 TYR 138 -20.851 6.141 1.832 1121 HE2 TYR 138 HE2 TYR 138 -17.181 7.724 3.392 1122 HH TYR 138 HH TYR 138 -20.426 8.234 3.335 1123 H THR 139 HN THR 139 -17.633 1.796 5.079 1124 HA THR 139 HA THR 139 -20.087 3.151 6.062 1125 HB THR 139 HB THR 139 -20.387 1.552 7.708 1126 HG1 THR 139 HG1 THR 139 -17.623 1.434 7.569 1127 HG21 THR 139 HG21 THR 139 -18.855 -0.169 5.756 1128 HG22 THR 139 HG22 THR 139 -20.272 -0.603 6.712 1129 HG23 THR 139 HG23 THR 139 -20.430 0.519 5.360 1130 H ASP 140 HN ASP 140 -19.798 4.441 7.983 1131 HA ASP 140 HA ASP 140 -17.672 6.111 8.048 1132 HB2 ASP 140 HB2 ASP 140 -18.195 6.601 10.406 1133 HB3 ASP 140 HB1 ASP 140 -19.658 6.455 9.433 1134 H GLU 141 HN GLU 141 -17.874 3.217 10.202 1135 HA GLU 141 HA GLU 141 -15.324 3.471 11.288 1136 HB2 GLU 141 HB2 GLU 141 -16.925 0.958 10.761 1137 HB3 GLU 141 HB1 GLU 141 -15.531 1.070 11.837 1138 HG2 GLU 141 HG2 GLU 141 -16.710 2.771 13.185 1139 HG3 GLU 141 HG1 GLU 141 -18.106 2.645 12.117 1140 H MET 142 HN MET 142 -16.257 2.360 8.133 1141 HA MET 142 HA MET 142 -13.824 0.898 7.619 1142 HB2 MET 142 HB2 MET 142 -15.798 0.222 6.429 1143 HB3 MET 142 HB1 MET 142 -16.058 1.849 5.824 1144 HG2 MET 142 HG2 MET 142 -14.422 1.681 4.220 1145 HG3 MET 142 HG1 MET 142 -13.422 0.618 5.198 1146 HE1 MET 142 HE1 MET 142 -14.044 -1.484 5.965 1147 HE2 MET 142 HE2 MET 142 -15.719 -2.012 5.826 1148 HE3 MET 142 HE3 MET 142 -14.466 -2.762 4.830 1149 H VAL 143 HN VAL 143 -14.868 4.168 7.412 1150 HA VAL 143 HA VAL 143 -12.313 4.917 6.102 1151 HB VAL 143 HB VAL 143 -14.335 5.126 4.607 1152 HG11 VAL 143 HG11 VAL 143 -15.088 7.461 6.371 1153 HG12 VAL 143 HG12 VAL 143 -16.034 6.703 5.097 1154 HG13 VAL 143 HG13 VAL 143 -15.785 5.861 6.623 1155 HG21 VAL 143 HG21 VAL 143 -13.171 7.833 5.285 1156 HG22 VAL 143 HG22 VAL 143 -12.203 6.578 4.512 1157 HG23 VAL 143 HG23 VAL 143 -13.638 7.206 3.703 1158 H ALA 144 HN ALA 144 -11.107 6.322 7.264 1159 HA ALA 144 HA ALA 144 -12.493 7.986 9.303 1160 HB1 ALA 144 HB1 ALA 144 -9.730 6.887 9.736 1161 HB2 ALA 144 HB2 ALA 144 -11.159 5.939 10.148 1162 HB3 ALA 144 HB3 ALA 144 -10.884 7.499 10.922 1163 H MET 145 HN MET 145 -12.171 10.079 9.108 1164 HA MET 145 HA MET 145 -10.164 11.143 7.309 1165 HB2 MET 145 HB2 MET 145 -11.808 12.976 8.986 1166 HB3 MET 145 HB1 MET 145 -11.443 13.048 7.266 1167 HG2 MET 145 HG2 MET 145 -13.042 10.727 7.569 1168 HG3 MET 145 HG1 MET 145 -13.792 11.943 8.595 1169 HE1 MET 145 HE1 MET 145 -13.698 10.782 4.708 1170 HE2 MET 145 HE2 MET 145 -12.710 12.151 4.209 1171 HE3 MET 145 HE3 MET 145 -12.143 11.067 5.483 1172 H LEU 146 HN LEU 146 -8.558 12.702 7.954 1173 HA LEU 146 HA LEU 146 -7.803 12.531 10.818 1174 HB2 LEU 146 HB2 LEU 146 -5.935 12.877 8.472 1175 HB3 LEU 146 HB1 LEU 146 -5.474 12.692 10.156 1176 HG LEU 146 HG LEU 146 -7.142 10.572 8.820 1177 HD11 LEU 146 HD11 LEU 146 -4.255 11.173 8.345 1178 HD12 LEU 146 HD12 LEU 146 -4.684 9.482 8.598 1179 HD13 LEU 146 HD13 LEU 146 -5.428 10.393 7.289 1180 HD21 LEU 146 HD21 LEU 146 -5.025 10.458 10.990 1181 HD22 LEU 146 HD22 LEU 146 -6.759 10.549 11.294 1182 HD23 LEU 146 HD23 LEU 146 -6.078 9.136 10.490 1183 HA PRO 147 HA PRO 147 -8.202 16.996 10.538 1184 HB2 PRO 147 HB2 PRO 147 -7.436 17.683 13.023 1185 HB3 PRO 147 HB1 PRO 147 -8.940 16.785 12.736 1186 HG2 PRO 147 HG2 PRO 147 -6.274 15.762 13.624 1187 HG3 PRO 147 HG1 PRO 147 -7.890 15.368 14.240 1188 HD2 PRO 147 HD2 PRO 147 -6.531 13.777 12.444 1189 HD3 PRO 147 HD1 PRO 147 -8.305 13.838 12.562 1190 H ARG 148 HN ARG 148 -6.862 19.006 10.983 1191 HA ARG 148 HA ARG 148 -4.417 18.933 9.618 1192 HB2 ARG 148 HB2 ARG 148 -4.174 21.250 10.257 1193 HB3 ARG 148 HB1 ARG 148 -5.866 20.935 9.867 1194 HG2 ARG 148 HG2 ARG 148 -6.245 20.539 12.350 1195 HG3 ARG 148 HG1 ARG 148 -4.621 21.175 12.615 1196 HD2 ARG 148 HD2 ARG 148 -5.345 23.229 11.294 1197 HD3 ARG 148 HD1 ARG 148 -6.990 22.610 11.401 1198 HE ARG 148 HE ARG 148 -6.120 22.605 13.996 1199 HH11 ARG 148 HH21 ARG 148 -6.242 24.926 11.431 1200 HH12 ARG 148 HH22 ARG 148 -6.431 26.288 12.486 1201 HH21 ARG 148 HH11 ARG 148 -6.366 24.386 15.385 1202 HH22 ARG 148 HH12 ARG 148 -6.501 25.981 14.724 1203 H GLN 149 HN GLN 149 -5.058 18.041 12.836 1204 HA GLN 149 HA GLN 149 -2.877 18.877 14.291 1205 HB2 GLN 149 HB2 GLN 149 -4.063 16.090 14.323 1206 HB3 GLN 149 HB1 GLN 149 -3.103 16.828 15.606 1207 HG2 GLN 149 HG2 GLN 149 -5.721 17.949 14.575 1208 HG3 GLN 149 HG1 GLN 149 -5.563 16.967 16.030 1209 HE21 GLN 149 HE21 GLN 149 -5.460 20.176 14.860 1210 HE22 GLN 149 HE22 GLN 149 -4.756 20.897 16.225 1211 H GLU 150 HN GLU 150 -0.750 18.715 14.035 1212 HA GLU 150 HA GLU 150 0.361 16.411 12.535 1213 HB2 GLU 150 HB2 GLU 150 1.954 17.917 11.456 1214 HB3 GLU 150 HB1 GLU 150 0.301 18.396 11.074 1215 HG2 GLU 150 HG2 GLU 150 0.422 20.051 12.969 1216 HG3 GLU 150 HG1 GLU 150 2.133 19.657 13.131 1217 H GLU 151 HN GLU 151 2.221 15.564 13.307 1218 HA GLU 151 HA GLU 151 3.389 16.798 15.742 1219 HB2 GLU 151 HB2 GLU 151 3.353 13.859 15.009 1220 HB3 GLU 151 HB1 GLU 151 3.952 14.568 16.506 1221 HG2 GLU 151 HG2 GLU 151 1.089 14.850 15.563 1222 HG3 GLU 151 HG1 GLU 151 1.627 13.584 16.666 1223 H CYS 152 HN CYS 152 4.502 14.129 13.677 1224 HA CYS 152 HA CYS 152 7.063 15.481 13.341 1225 HB2 CYS 152 HB2 CYS 152 6.617 12.946 13.936 1226 HB3 CYS 152 HB1 CYS 152 6.439 12.782 12.189 1227 H THR 153 HN THR 153 8.053 15.423 11.182 1228 HA THR 153 HA THR 153 6.292 15.347 8.875 1229 HB THR 153 HB THR 153 6.849 17.712 8.224 1230 HG1 THR 153 HG1 THR 153 8.573 18.088 9.579 1231 HG21 THR 153 HG21 THR 153 5.362 17.613 10.856 1232 HG22 THR 153 HG22 THR 153 5.053 18.656 9.471 1233 HG23 THR 153 HG23 THR 153 4.683 16.935 9.377 1234 H VAL 154 HN VAL 154 7.524 15.785 6.828 1235 HA VAL 154 HA VAL 154 9.983 14.383 6.839 1236 HB VAL 154 HB VAL 154 10.044 15.063 4.442 1237 HG11 VAL 154 HG11 VAL 154 7.893 13.909 3.814 1238 HG12 VAL 154 HG12 VAL 154 8.875 13.030 4.986 1239 HG13 VAL 154 HG13 VAL 154 7.459 13.933 5.524 1240 HG21 VAL 154 HG21 VAL 154 9.037 17.264 4.617 1241 HG22 VAL 154 HG22 VAL 154 8.035 16.267 3.564 1242 HG23 VAL 154 HG23 VAL 154 7.539 16.565 5.230 1243 H ASP 155 HN ASP 155 12.020 15.131 6.730 1244 HA ASP 155 HA ASP 155 12.517 17.828 7.595 1245 HB2 ASP 155 HB2 ASP 155 14.933 16.544 6.699 1246 HB3 ASP 155 HB1 ASP 155 14.434 16.917 8.345 1247 H GLU 156 HN GLU 156 13.120 19.544 6.433 1248 HA GLU 156 HA GLU 156 12.737 19.605 3.635 1249 HB2 GLU 156 HB2 GLU 156 13.964 21.546 5.595 1250 HB3 GLU 156 HB1 GLU 156 13.763 21.908 3.886 1251 HG2 GLU 156 HG2 GLU 156 11.330 21.443 4.094 1252 HG3 GLU 156 HG1 GLU 156 11.555 21.170 5.820 1253 H VAL 157 HN VAL 157 15.537 19.138 5.674 1254 HA VAL 157 HA VAL 157 17.678 19.768 4.110 1255 HB VAL 157 HB VAL 157 17.440 17.141 5.587 1256 HG11 VAL 157 HG11 VAL 157 19.475 17.499 4.197 1257 HG12 VAL 157 HG12 VAL 157 19.789 18.993 5.081 1258 HG13 VAL 157 HG13 VAL 157 19.846 17.443 5.921 1259 HG21 VAL 157 HG21 VAL 157 16.656 18.872 7.079 1260 HG22 VAL 157 HG22 VAL 157 18.319 18.500 7.532 1261 HG23 VAL 157 HG23 VAL 157 17.964 19.951 6.595 1262 HN1 EB4 200 H17 EB4 200 0.735 -1.051 5.717 1263 H8 EB4 200 H8 EB4 200 4.501 2.031 0.819 1264 HN2 EB4 200 H25 EB4 200 3.707 0.323 6.145 1265 H9 EB4 200 H9 EB4 200 -0.354 5.960 3.612 1266 H10 EB4 200 H10 EB4 200 -2.635 -1.320 0.851 1267 HN3 EB4 200 H32 EB4 200 0.877 1.725 7.386 1268 H7 EB4 200 H7 EB4 200 -1.502 0.882 0.740 1269 H11 EB4 200 H11 EB4 200 6.669 0.887 1.199 1270 H12 EB4 200 H12 EB4 200 -1.357 6.930 5.664 1271 H15 EB4 200 H15 EB4 200 -1.106 5.765 7.837 1272 H14 EB4 200 H14 EB4 200 7.194 -0.066 3.428 1273 H13 EB4 200 H13 EB4 200 -2.202 -2.842 2.763 1274 H22 EB4 200 H22 EB4 200 0.054 -3.644 6.952 1275 H30 EB4 200 H30 EB4 200 0.187 -0.530 10.227 1276 H30A EB4 200 H9N EB4 200 -1.071 0.383 9.261 1277 H24 EB4 200 H24 EB4 200 0.496 1.934 10.319 1278 H28 EB4 200 H28 EB4 200 2.343 -3.715 7.820 1279 H28A EB4 200 H9L EB4 200 2.268 -3.771 6.050 1280 H23 EB4 200 H23 EB4 200 5.750 -0.921 7.927 1281 H29 EB4 200 H29 EB4 200 4.515 0.102 9.800 1282 H29A EB4 200 H9M EB4 200 5.112 1.369 8.618 1283 H21 ACD 300 HA3 ACD 300 0.597 10.541 -11.895 1284 H22 ACD 300 HA4 ACD 300 0.825 11.588 -10.477 1285 H31 ACD 300 HA1 ACD 300 0.515 8.555 -10.414 1286 H32 ACD 300 HA2 ACD 300 2.037 9.448 -10.201 1287 H41 ACD 300 HA0 ACD 300 -0.427 9.665 -8.413 1288 H42 ACD 300 HAZ ACD 300 1.076 10.599 -8.222 1289 H5 ACD 300 HAY ACD 300 2.218 8.070 -8.097 1290 H6 ACD 300 HAX ACD 300 1.041 7.158 -5.950 1291 H71 ACD 300 HAV ACD 300 -1.006 9.420 -6.678 1292 H72 ACD 300 HAW ACD 300 -1.525 7.817 -6.109 1293 H8 ACD 300 HAU ACD 300 -0.511 10.113 -4.383 1294 H9 ACD 300 HAT ACD 300 -0.569 8.411 -2.409 1295 H101 ACD 300 HAR ACD 300 -1.324 6.406 -4.653 1296 H102 ACD 300 HAS ACD 300 0.161 6.083 -3.728 1297 H11 ACD 300 HAQ ACD 300 -2.722 5.791 -2.695 1298 H12 ACD 300 HAP ACD 300 -1.549 5.075 -0.459 1299 H131 ACD 300 HAN ACD 300 0.926 6.598 -1.622 1300 H132 ACD 300 HAO ACD 300 1.059 4.791 -1.341 1301 H14 ACD 300 HAM ACD 300 0.900 5.122 1.063 1302 H15 ACD 300 HAL ACD 300 1.125 7.553 1.991 1303 H161 ACD 300 HAJ ACD 300 -0.139 8.535 -0.544 1304 H162 ACD 300 HAK ACD 300 0.825 9.516 0.582 1305 H171 ACD 300 HAH ACD 300 2.894 8.814 -0.483 1306 H172 ACD 300 HAI ACD 300 2.032 7.658 -1.520 1307 H181 ACD 300 HAF ACD 300 0.673 9.700 -2.364 1308 H182 ACD 300 HAG ACD 300 1.921 10.696 -1.583 1309 H191 ACD 300 HAD ACD 300 3.667 9.713 -2.928 1310 H192 ACD 300 HAE ACD 300 2.557 8.483 -3.576 1311 H201 ACD 300 HAA ACD 300 2.899 10.262 -5.229 1312 H202 ACD 300 HAB ACD 300 2.391 11.497 -4.056 1313 H203 ACD 300 HAC ACD 300 1.218 10.304 -4.660 Start of MODEL 12 1 H1 MET 1 HT1 MET 1 5.354 21.378 -20.825 2 H2 MET 1 HT2 MET 1 5.577 22.320 -22.221 3 H3 MET 1 HT3 MET 1 6.723 21.141 -21.796 4 HA MET 1 HA MET 1 5.005 20.639 -23.647 5 HB2 MET 1 HB2 MET 1 5.655 18.760 -21.356 6 HB3 MET 1 HB1 MET 1 5.019 18.244 -22.918 7 HG2 MET 1 HG2 MET 1 6.984 19.311 -24.027 8 HG3 MET 1 HG1 MET 1 7.637 19.695 -22.434 9 HE1 MET 1 HE1 MET 1 10.042 16.912 -23.369 10 HE2 MET 1 HE2 MET 1 9.471 18.370 -24.177 11 HE3 MET 1 HE3 MET 1 9.840 18.399 -22.447 12 H THR 2 HN THR 2 3.886 18.751 -20.973 13 HA THR 2 HA THR 2 1.143 19.288 -21.595 14 HB THR 2 HB THR 2 2.271 17.874 -19.169 15 HG1 THR 2 HG1 THR 2 2.983 16.595 -20.685 16 HG21 THR 2 HG21 THR 2 0.068 16.679 -19.311 17 HG22 THR 2 HG22 THR 2 -0.084 18.396 -18.937 18 HG23 THR 2 HG23 THR 2 -0.414 17.817 -20.569 19 H VAL 3 HN VAL 3 -0.365 20.469 -20.469 20 HA VAL 3 HA VAL 3 0.332 22.835 -19.260 21 HB VAL 3 HB VAL 3 -1.947 22.204 -20.080 22 HG11 VAL 3 HG11 VAL 3 -1.891 19.984 -18.796 23 HG12 VAL 3 HG12 VAL 3 -2.300 20.927 -17.363 24 HG13 VAL 3 HG13 VAL 3 -3.405 20.887 -18.736 25 HG21 VAL 3 HG21 VAL 3 -1.671 24.235 -18.764 26 HG22 VAL 3 HG22 VAL 3 -3.160 23.434 -18.262 27 HG23 VAL 3 HG23 VAL 3 -1.713 23.308 -17.263 28 HA PRO 4 HA PRO 4 2.205 21.810 -15.325 29 HB2 PRO 4 HB2 PRO 4 0.429 24.054 -14.406 30 HB3 PRO 4 HB1 PRO 4 2.138 23.752 -14.035 31 HG2 PRO 4 HG2 PRO 4 1.393 25.564 -15.858 32 HG3 PRO 4 HG1 PRO 4 2.864 24.593 -16.046 33 HD2 PRO 4 HD2 PRO 4 0.321 24.430 -17.559 34 HD3 PRO 4 HD1 PRO 4 1.940 23.847 -18.008 35 H ASP 5 HN ASP 5 1.647 20.393 -13.739 36 HA ASP 5 HA ASP 5 -0.824 20.340 -12.374 37 HB2 ASP 5 HB2 ASP 5 -1.673 18.166 -13.339 38 HB3 ASP 5 HB1 ASP 5 -1.837 19.563 -14.400 39 H ARG 6 HN ARG 6 1.595 18.074 -13.700 40 HA ARG 6 HA ARG 6 1.665 16.382 -11.432 41 HB2 ARG 6 HB2 ARG 6 3.794 16.881 -13.526 42 HB3 ARG 6 HB1 ARG 6 3.755 15.520 -12.405 43 HG2 ARG 6 HG2 ARG 6 1.606 14.785 -13.350 44 HG3 ARG 6 HG1 ARG 6 1.616 16.160 -14.457 45 HD2 ARG 6 HD2 ARG 6 3.601 13.873 -14.380 46 HD3 ARG 6 HD1 ARG 6 2.433 14.217 -15.652 47 HE ARG 6 HE ARG 6 4.148 16.454 -15.257 48 HH11 ARG 6 HH21 ARG 6 4.029 13.240 -16.534 49 HH12 ARG 6 HH22 ARG 6 5.263 13.518 -17.719 50 HH21 ARG 6 HH11 ARG 6 5.766 16.825 -16.807 51 HH22 ARG 6 HH12 ARG 6 6.245 15.547 -17.873 52 H SER 7 HN SER 7 3.600 19.180 -12.391 53 HA SER 7 HA SER 7 5.456 19.043 -10.246 54 HB2 SER 7 HB2 SER 7 6.115 21.268 -10.919 55 HB3 SER 7 HB1 SER 7 5.808 20.314 -12.367 56 HG SER 7 HG SER 7 4.582 22.555 -11.475 57 H GLU 8 HN GLU 8 2.268 20.454 -10.591 58 HA GLU 8 HA GLU 8 2.298 22.249 -8.447 59 HB2 GLU 8 HB2 GLU 8 0.013 20.609 -9.557 60 HB3 GLU 8 HB1 GLU 8 -0.172 21.963 -8.444 61 HG2 GLU 8 HG2 GLU 8 0.979 23.436 -10.082 62 HG3 GLU 8 HG1 GLU 8 1.075 22.081 -11.204 63 H ILE 9 HN ILE 9 1.260 18.813 -8.461 64 HA ILE 9 HA ILE 9 1.033 18.877 -5.549 65 HB ILE 9 HB ILE 9 -0.624 17.645 -7.003 66 HG12 ILE 9 HG12 ILE 9 0.938 16.070 -4.928 67 HG13 ILE 9 HG11 ILE 9 -0.386 17.184 -4.597 68 HG21 ILE 9 HG21 ILE 9 0.027 15.504 -7.924 69 HG22 ILE 9 HG22 ILE 9 1.147 16.718 -8.548 70 HG23 ILE 9 HG23 ILE 9 1.641 15.643 -7.242 71 HD11 ILE 9 HD11 ILE 9 -0.641 14.673 -6.281 72 HD12 ILE 9 HD12 ILE 9 -1.114 14.796 -4.593 73 HD13 ILE 9 HD13 ILE 9 -1.945 15.750 -5.815 74 H ALA 10 HN ALA 10 3.081 17.452 -8.032 75 HA ALA 10 HA ALA 10 4.513 15.709 -6.413 76 HB1 ALA 10 HB1 ALA 10 6.319 15.794 -8.043 77 HB2 ALA 10 HB2 ALA 10 5.615 17.244 -8.759 78 HB3 ALA 10 HB3 ALA 10 4.756 15.706 -8.854 79 H GLY 11 HN GLY 11 6.132 15.871 -4.970 80 HA2 GLY 11 HA2 GLY 11 8.053 17.094 -4.113 81 HA3 GLY 11 HA1 GLY 11 7.145 18.584 -4.378 82 H LYS 12 HN LYS 12 4.610 17.421 -3.486 83 HA LYS 12 HA LYS 12 4.947 16.551 -0.755 84 HB2 LYS 12 HB2 LYS 12 4.023 19.370 -1.348 85 HB3 LYS 12 HB1 LYS 12 3.715 18.553 0.183 86 HG2 LYS 12 HG2 LYS 12 6.272 18.151 0.261 87 HG3 LYS 12 HG1 LYS 12 6.366 19.378 -1.004 88 HD2 LYS 12 HD2 LYS 12 5.045 20.912 0.497 89 HD3 LYS 12 HD1 LYS 12 5.215 19.710 1.777 90 HE2 LYS 12 HE2 LYS 12 7.724 19.835 1.409 91 HE3 LYS 12 HE1 LYS 12 7.424 21.230 0.374 92 HZ1 LYS 12 HZ1 LYS 12 7.895 21.549 2.894 93 HZ2 LYS 12 HZ2 LYS 12 6.714 22.498 2.125 94 HZ3 LYS 12 HZ3 LYS 12 6.250 21.164 3.064 95 H TRP 13 HN TRP 13 3.391 14.974 -0.777 96 HA TRP 13 HA TRP 13 0.689 15.670 -1.803 97 HB2 TRP 13 HB2 TRP 13 2.135 13.010 -1.531 98 HB3 TRP 13 HB1 TRP 13 0.429 13.110 -1.898 99 HD1 TRP 13 HD1 TRP 13 3.450 15.005 -3.370 100 HE1 TRP 13 HE1 TRP 13 3.335 14.688 -5.916 101 HE3 TRP 13 HE3 TRP 13 -0.755 12.139 -3.754 102 HZ2 TRP 13 HZ2 TRP 13 1.775 13.372 -7.834 103 HZ3 TRP 13 HZ3 TRP 13 -1.552 11.383 -5.978 104 HH2 TRP 13 HH2 TRP 13 -0.314 12.019 -8.031 105 H TYR 14 HN TYR 14 -0.837 15.867 -0.164 106 HA TYR 14 HA TYR 14 -0.042 15.009 2.524 107 HB2 TYR 14 HB2 TYR 14 -1.436 17.249 1.379 108 HB3 TYR 14 HB1 TYR 14 -2.509 16.458 2.522 109 HD1 TYR 14 HD2 TYR 14 -0.861 15.509 4.635 110 HD2 TYR 14 HD1 TYR 14 -0.438 19.112 2.359 111 HE1 TYR 14 HE2 TYR 14 0.349 16.560 6.531 112 HE2 TYR 14 HE1 TYR 14 0.763 20.165 4.249 113 HH TYR 14 HH TYR 14 1.228 19.972 6.472 114 H VAL 15 HN VAL 15 -0.963 13.341 3.556 115 HA VAL 15 HA VAL 15 -3.365 12.069 2.380 116 HB VAL 15 HB VAL 15 -1.127 11.036 4.136 117 HG11 VAL 15 HG11 VAL 15 -2.409 8.823 3.931 118 HG12 VAL 15 HG12 VAL 15 -3.065 10.006 5.062 119 HG13 VAL 15 HG13 VAL 15 -3.806 9.799 3.475 120 HG21 VAL 15 HG21 VAL 15 -0.607 9.632 2.298 121 HG22 VAL 15 HG22 VAL 15 -2.161 9.936 1.523 122 HG23 VAL 15 HG23 VAL 15 -0.939 11.207 1.577 123 H VAL 16 HN VAL 16 -5.255 12.485 3.460 124 HA VAL 16 HA VAL 16 -5.058 13.075 6.360 125 HB VAL 16 HB VAL 16 -6.843 14.578 6.229 126 HG11 VAL 16 HG11 VAL 16 -5.258 15.065 3.693 127 HG12 VAL 16 HG12 VAL 16 -5.951 16.271 4.768 128 HG13 VAL 16 HG13 VAL 16 -4.585 15.304 5.289 129 HG21 VAL 16 HG21 VAL 16 -7.250 13.435 3.453 130 HG22 VAL 16 HG22 VAL 16 -8.411 13.533 4.776 131 HG23 VAL 16 HG23 VAL 16 -7.935 14.993 3.911 132 H ALA 17 HN ALA 17 -6.765 11.231 3.905 133 HA ALA 17 HA ALA 17 -8.331 10.005 6.111 134 HB1 ALA 17 HB1 ALA 17 -9.325 9.951 3.287 135 HB2 ALA 17 HB2 ALA 17 -9.586 11.387 4.280 136 HB3 ALA 17 HB3 ALA 17 -10.226 9.831 4.796 137 H LEU 18 HN LEU 18 -9.071 7.845 5.620 138 HA LEU 18 HA LEU 18 -7.520 6.266 3.760 139 HB2 LEU 18 HB2 LEU 18 -5.925 6.398 5.584 140 HB3 LEU 18 HB1 LEU 18 -7.154 5.890 6.741 141 HG LEU 18 HG LEU 18 -6.829 4.052 4.435 142 HD11 LEU 18 HD11 LEU 18 -4.526 4.378 4.533 143 HD12 LEU 18 HD12 LEU 18 -4.535 4.670 6.269 144 HD13 LEU 18 HD13 LEU 18 -4.758 3.035 5.650 145 HD21 LEU 18 HD21 LEU 18 -7.183 2.388 6.089 146 HD22 LEU 18 HD22 LEU 18 -6.620 3.441 7.386 147 HD23 LEU 18 HD23 LEU 18 -8.178 3.745 6.617 148 H ALA 19 HN ALA 19 -8.311 4.156 3.528 149 HA ALA 19 HA ALA 19 -10.698 3.392 5.020 150 HB1 ALA 19 HB1 ALA 19 -10.933 3.164 2.054 151 HB2 ALA 19 HB2 ALA 19 -11.156 4.768 2.752 152 HB3 ALA 19 HB3 ALA 19 -12.188 3.433 3.264 153 H SER 20 HN SER 20 -11.003 1.167 5.029 154 HA SER 20 HA SER 20 -9.532 -0.575 3.274 155 HB2 SER 20 HB2 SER 20 -7.734 0.273 4.813 156 HB3 SER 20 HB1 SER 20 -8.599 -0.490 6.144 157 HG SER 20 HG SER 20 -7.059 -1.593 4.160 158 H ASN 21 HN ASN 21 -9.470 -2.869 4.323 159 HA ASN 21 HA ASN 21 -12.135 -3.372 5.492 160 HB2 ASN 21 HB2 ASN 21 -10.418 -5.000 3.624 161 HB3 ASN 21 HB1 ASN 21 -11.736 -5.720 4.548 162 HD21 ASN 21 HD21 ASN 21 -11.006 -3.322 2.013 163 HD22 ASN 21 HD22 ASN 21 -12.591 -3.238 1.411 164 H THR 22 HN THR 22 -8.868 -3.299 5.992 165 HA THR 22 HA THR 22 -8.681 -5.470 7.866 166 HB THR 22 HB THR 22 -6.687 -3.261 7.889 167 HG1 THR 22 HG1 THR 22 -5.969 -4.614 5.867 168 HG21 THR 22 HG21 THR 22 -5.163 -5.039 8.131 169 HG22 THR 22 HG22 THR 22 -6.578 -5.554 9.051 170 HG23 THR 22 HG23 THR 22 -6.290 -6.207 7.439 171 H GLU 23 HN GLU 23 -10.140 -5.156 9.529 172 HA GLU 23 HA GLU 23 -11.005 -2.883 10.741 173 HB2 GLU 23 HB2 GLU 23 -10.246 -5.478 12.098 174 HB3 GLU 23 HB1 GLU 23 -11.201 -4.202 12.855 175 HG2 GLU 23 HG2 GLU 23 -12.855 -4.389 10.999 176 HG3 GLU 23 HG1 GLU 23 -11.928 -5.738 10.345 177 H PHE 24 HN PHE 24 -7.877 -4.358 11.027 178 HA PHE 24 HA PHE 24 -6.895 -3.042 13.290 179 HB2 PHE 24 HB2 PHE 24 -5.506 -4.755 12.651 180 HB3 PHE 24 HB1 PHE 24 -5.744 -4.447 10.935 181 HD1 PHE 24 HD1 PHE 24 -4.526 -2.585 9.813 182 HD2 PHE 24 HD2 PHE 24 -3.717 -3.719 13.874 183 HE1 PHE 24 HE1 PHE 24 -2.382 -1.350 9.727 184 HE2 PHE 24 HE2 PHE 24 -1.570 -2.486 13.790 185 HZ PHE 24 HZ PHE 24 -0.900 -1.299 11.717 186 H PHE 25 HN PHE 25 -6.682 -2.029 9.819 187 HA PHE 25 HA PHE 25 -5.166 0.281 10.378 188 HB2 PHE 25 HB2 PHE 25 -6.099 -1.065 8.098 189 HB3 PHE 25 HB1 PHE 25 -6.793 0.544 7.977 190 HD1 PHE 25 HD2 PHE 25 -4.749 2.246 9.229 191 HD2 PHE 25 HD1 PHE 25 -4.285 -1.131 6.614 192 HE1 PHE 25 HE2 PHE 25 -2.555 3.128 8.473 193 HE2 PHE 25 HE1 PHE 25 -2.098 -0.244 5.862 194 HZ PHE 25 HZ PHE 25 -1.232 1.882 6.791 195 H LEU 26 HN LEU 26 -8.692 -0.096 9.872 196 HA LEU 26 HA LEU 26 -9.241 2.696 10.094 197 HB2 LEU 26 HB2 LEU 26 -11.558 1.451 11.019 198 HB3 LEU 26 HB1 LEU 26 -11.219 1.873 9.344 199 HG LEU 26 HG LEU 26 -10.200 -0.734 10.460 200 HD11 LEU 26 HD11 LEU 26 -12.410 -1.646 9.360 201 HD12 LEU 26 HD12 LEU 26 -12.446 -1.050 11.018 202 HD13 LEU 26 HD13 LEU 26 -13.024 -0.031 9.703 203 HD21 LEU 26 HD21 LEU 26 -10.217 -1.395 8.156 204 HD22 LEU 26 HD22 LEU 26 -11.238 -0.031 7.703 205 HD23 LEU 26 HD23 LEU 26 -9.561 0.242 8.172 206 H ARG 27 HN ARG 27 -8.774 0.119 12.299 207 HA ARG 27 HA ARG 27 -9.776 1.373 14.659 208 HB2 ARG 27 HB2 ARG 27 -9.447 -1.040 14.583 209 HB3 ARG 27 HB1 ARG 27 -7.715 -0.821 14.337 210 HG2 ARG 27 HG2 ARG 27 -7.444 0.150 16.520 211 HG3 ARG 27 HG1 ARG 27 -9.189 0.253 16.753 212 HD2 ARG 27 HD2 ARG 27 -9.397 -2.138 16.857 213 HD3 ARG 27 HD1 ARG 27 -7.730 -2.364 16.335 214 HE ARG 27 HE ARG 27 -7.453 -0.923 18.620 215 HH11 ARG 27 HH21 ARG 27 -9.225 -3.768 17.762 216 HH12 ARG 27 HH22 ARG 27 -9.125 -4.474 19.341 217 HH21 ARG 27 HH11 ARG 27 -7.317 -1.841 20.692 218 HH22 ARG 27 HH12 ARG 27 -8.044 -3.382 21.000 219 H GLU 28 HN GLU 28 -6.475 1.039 13.335 220 HA GLU 28 HA GLU 28 -5.382 2.721 15.416 221 HB2 GLU 28 HB2 GLU 28 -4.143 1.453 12.977 222 HB3 GLU 28 HB1 GLU 28 -3.243 2.377 14.181 223 HG2 GLU 28 HG2 GLU 28 -4.086 0.820 15.944 224 HG3 GLU 28 HG1 GLU 28 -4.857 -0.140 14.682 225 H LYS 29 HN LYS 29 -5.924 3.189 11.853 226 HA LYS 29 HA LYS 29 -4.582 5.678 11.866 227 HB2 LYS 29 HB2 LYS 29 -6.368 4.260 9.953 228 HB3 LYS 29 HB1 LYS 29 -6.175 5.997 9.733 229 HG2 LYS 29 HG2 LYS 29 -3.773 4.216 10.125 230 HG3 LYS 29 HG1 LYS 29 -4.496 4.419 8.533 231 HD2 LYS 29 HD2 LYS 29 -3.914 6.903 10.109 232 HD3 LYS 29 HD1 LYS 29 -2.548 6.045 9.403 233 HE2 LYS 29 HE2 LYS 29 -4.932 6.570 7.667 234 HE3 LYS 29 HE1 LYS 29 -3.846 7.911 8.026 235 HZ1 LYS 29 HZ1 LYS 29 -2.199 7.023 6.818 236 HZ2 LYS 29 HZ2 LYS 29 -2.553 5.427 7.284 237 HZ3 LYS 29 HZ3 LYS 29 -3.450 6.167 6.049 238 H ASP 30 HN ASP 30 -7.870 4.779 12.591 239 HA ASP 30 HA ASP 30 -9.079 7.310 12.434 240 HB2 ASP 30 HB2 ASP 30 -10.416 5.298 12.745 241 HB3 ASP 30 HB1 ASP 30 -9.653 4.997 14.306 242 H LYS 31 HN LYS 31 -6.701 6.045 14.477 243 HA LYS 31 HA LYS 31 -7.151 8.015 16.601 244 HB2 LYS 31 HB2 LYS 31 -6.755 5.779 17.366 245 HB3 LYS 31 HB1 LYS 31 -5.335 5.618 16.351 246 HG2 LYS 31 HG2 LYS 31 -5.057 7.932 18.107 247 HG3 LYS 31 HG1 LYS 31 -5.412 6.489 19.038 248 HD2 LYS 31 HD2 LYS 31 -3.029 6.619 18.837 249 HD3 LYS 31 HD1 LYS 31 -3.563 5.314 17.782 250 HE2 LYS 31 HE2 LYS 31 -3.348 6.714 15.818 251 HE3 LYS 31 HE1 LYS 31 -3.072 8.145 16.814 252 HZ1 LYS 31 HZ1 LYS 31 -1.252 6.111 17.533 253 HZ2 LYS 31 HZ2 LYS 31 -1.166 6.384 15.859 254 HZ3 LYS 31 HZ3 LYS 31 -0.930 7.670 16.939 255 H MET 32 HN MET 32 -4.983 7.393 13.862 256 HA MET 32 HA MET 32 -2.957 9.215 14.842 257 HB2 MET 32 HB2 MET 32 -3.283 7.358 12.603 258 HB3 MET 32 HB1 MET 32 -2.545 8.866 12.095 259 HG2 MET 32 HG2 MET 32 -0.638 8.514 13.353 260 HG3 MET 32 HG1 MET 32 -1.490 7.601 14.592 261 HE1 MET 32 HE1 MET 32 -2.829 5.529 13.955 262 HE2 MET 32 HE2 MET 32 -1.943 4.142 13.341 263 HE3 MET 32 HE3 MET 32 -1.361 5.007 14.768 264 H LYS 33 HN LYS 33 -2.268 10.732 12.766 265 HA LYS 33 HA LYS 33 -4.627 12.418 12.209 266 HB2 LYS 33 HB2 LYS 33 -1.856 13.376 12.954 267 HB3 LYS 33 HB1 LYS 33 -3.245 14.389 12.566 268 HG2 LYS 33 HG2 LYS 33 -4.405 13.780 14.523 269 HG3 LYS 33 HG1 LYS 33 -3.406 12.355 14.786 270 HD2 LYS 33 HD2 LYS 33 -2.013 15.004 14.777 271 HD3 LYS 33 HD1 LYS 33 -3.031 14.637 16.167 272 HE2 LYS 33 HE2 LYS 33 -0.758 13.888 16.623 273 HE3 LYS 33 HE1 LYS 33 -1.803 12.481 16.453 274 HZ1 LYS 33 HZ1 LYS 33 0.342 12.339 15.232 275 HZ2 LYS 33 HZ2 LYS 33 -1.031 12.130 14.252 276 HZ3 LYS 33 HZ3 LYS 33 -0.193 13.605 14.232 277 H MET 34 HN MET 34 -3.227 14.344 10.732 278 HA MET 34 HA MET 34 -3.233 13.262 8.182 279 HB2 MET 34 HB2 MET 34 -3.517 15.659 9.028 280 HB3 MET 34 HB1 MET 34 -1.763 15.749 9.034 281 HG2 MET 34 HG2 MET 34 -1.608 15.564 6.730 282 HG3 MET 34 HG1 MET 34 -3.161 14.775 6.571 283 HE1 MET 34 HE1 MET 34 -5.797 17.220 6.776 284 HE2 MET 34 HE2 MET 34 -5.191 15.691 7.408 285 HE3 MET 34 HE3 MET 34 -5.150 17.144 8.402 286 H ALA 35 HN ALA 35 -1.734 12.431 6.855 287 HA ALA 35 HA ALA 35 1.074 12.266 7.785 288 HB1 ALA 35 HB1 ALA 35 -0.701 10.341 6.311 289 HB2 ALA 35 HB2 ALA 35 0.379 10.040 7.670 290 HB3 ALA 35 HB3 ALA 35 1.043 10.284 6.055 291 H MET 36 HN MET 36 2.673 12.218 5.936 292 HA MET 36 HA MET 36 1.720 13.812 3.627 293 HB2 MET 36 HB2 MET 36 4.342 14.655 4.043 294 HB3 MET 36 HB1 MET 36 2.889 15.556 4.467 295 HG2 MET 36 HG2 MET 36 4.086 13.513 6.338 296 HG3 MET 36 HG1 MET 36 4.613 15.193 6.336 297 HE1 MET 36 HE1 MET 36 3.133 13.149 8.484 298 HE2 MET 36 HE2 MET 36 3.832 14.682 8.999 299 HE3 MET 36 HE3 MET 36 2.159 14.285 9.415 300 H ALA 37 HN ALA 37 3.168 13.781 1.780 301 HA ALA 37 HA ALA 37 5.096 11.613 1.574 302 HB1 ALA 37 HB1 ALA 37 3.753 10.736 -0.489 303 HB2 ALA 37 HB2 ALA 37 2.377 11.499 0.309 304 HB3 ALA 37 HB3 ALA 37 3.273 10.223 1.130 305 H ARG 38 HN ARG 38 6.175 11.552 -0.529 306 HA ARG 38 HA ARG 38 5.879 14.005 -2.161 307 HB2 ARG 38 HB2 ARG 38 8.516 12.903 -1.148 308 HB3 ARG 38 HB1 ARG 38 8.300 14.317 -2.182 309 HG2 ARG 38 HG2 ARG 38 6.903 15.344 -0.355 310 HG3 ARG 38 HG1 ARG 38 7.357 13.991 0.679 311 HD2 ARG 38 HD2 ARG 38 9.336 15.849 -0.669 312 HD3 ARG 38 HD1 ARG 38 8.803 16.007 1.001 313 HE ARG 38 HE ARG 38 10.056 14.092 1.555 314 HH11 ARG 38 HH21 ARG 38 10.036 14.727 -1.851 315 HH12 ARG 38 HH22 ARG 38 11.338 13.640 -2.197 316 HH21 ARG 38 HH11 ARG 38 11.761 12.667 1.102 317 HH22 ARG 38 HH12 ARG 38 12.315 12.475 -0.528 318 H ILE 39 HN ILE 39 5.957 13.565 -4.375 319 HA ILE 39 HA ILE 39 6.752 10.873 -5.191 320 HB ILE 39 HB ILE 39 4.401 11.490 -5.240 321 HG12 ILE 39 HG12 ILE 39 5.238 11.337 -8.118 322 HG13 ILE 39 HG11 ILE 39 5.569 9.977 -7.051 323 HG21 ILE 39 HG21 ILE 39 3.688 13.111 -6.852 324 HG22 ILE 39 HG22 ILE 39 4.734 13.812 -5.624 325 HG23 ILE 39 HG23 ILE 39 5.336 13.492 -7.243 326 HD11 ILE 39 HD11 ILE 39 2.830 11.193 -6.910 327 HD12 ILE 39 HD12 ILE 39 3.207 10.207 -8.315 328 HD13 ILE 39 HD13 ILE 39 3.329 9.510 -6.705 329 H SER 40 HN SER 40 8.164 10.724 -6.979 330 HA SER 40 HA SER 40 8.832 13.228 -8.366 331 HB2 SER 40 HB2 SER 40 11.015 13.299 -7.756 332 HB3 SER 40 HB1 SER 40 10.404 12.484 -6.324 333 HG SER 40 HG SER 40 10.866 10.487 -7.460 334 H PHE 41 HN PHE 41 9.628 12.977 -10.437 335 HA PHE 41 HA PHE 41 8.913 10.446 -11.647 336 HB2 PHE 41 HB2 PHE 41 9.657 13.120 -12.802 337 HB3 PHE 41 HB1 PHE 41 9.257 11.708 -13.781 338 HD1 PHE 41 HD1 PHE 41 7.955 14.171 -11.351 339 HD2 PHE 41 HD2 PHE 41 6.994 10.849 -13.899 340 HE1 PHE 41 HE1 PHE 41 5.538 14.630 -11.037 341 HE2 PHE 41 HE2 PHE 41 4.578 11.308 -13.585 342 HZ PHE 41 HZ PHE 41 3.849 13.196 -12.153 343 H LEU 42 HN LEU 42 10.595 9.059 -11.073 344 HA LEU 42 HA LEU 42 13.360 9.543 -11.551 345 HB2 LEU 42 HB2 LEU 42 11.872 6.904 -11.694 346 HB3 LEU 42 HB1 LEU 42 13.611 7.095 -11.539 347 HG LEU 42 HG LEU 42 11.707 8.273 -9.511 348 HD11 LEU 42 HD11 LEU 42 12.839 5.469 -9.685 349 HD12 LEU 42 HD12 LEU 42 12.288 6.170 -8.166 350 HD13 LEU 42 HD13 LEU 42 11.152 5.945 -9.495 351 HD21 LEU 42 HD21 LEU 42 14.645 7.507 -9.538 352 HD22 LEU 42 HD22 LEU 42 13.960 9.121 -9.351 353 HD23 LEU 42 HD23 LEU 42 13.776 7.930 -8.067 354 H GLY 43 HN GLY 43 10.788 8.052 -13.396 355 HA2 GLY 43 HA2 GLY 43 11.804 8.937 -15.934 356 HA3 GLY 43 HA1 GLY 43 11.951 7.193 -15.699 357 H GLU 44 HN GLU 44 10.261 8.370 -17.671 358 HA GLU 44 HA GLU 44 7.608 8.761 -16.974 359 HB2 GLU 44 HB2 GLU 44 8.792 7.430 -19.420 360 HB3 GLU 44 HB1 GLU 44 7.083 7.836 -19.266 361 HG2 GLU 44 HG2 GLU 44 8.135 9.665 -20.418 362 HG3 GLU 44 HG1 GLU 44 7.796 10.218 -18.780 363 H ASP 45 HN ASP 45 9.459 5.841 -16.869 364 HA ASP 45 HA ASP 45 6.996 4.266 -16.357 365 HB2 ASP 45 HB2 ASP 45 9.727 3.268 -17.196 366 HB3 ASP 45 HB1 ASP 45 8.269 2.297 -17.000 367 H GLU 46 HN GLU 46 9.106 5.933 -14.636 368 HA GLU 46 HA GLU 46 8.967 4.085 -12.371 369 HB2 GLU 46 HB2 GLU 46 11.583 5.275 -13.326 370 HB3 GLU 46 HB1 GLU 46 11.354 4.343 -11.845 371 HG2 GLU 46 HG2 GLU 46 10.465 2.463 -13.318 372 HG3 GLU 46 HG1 GLU 46 11.053 3.387 -14.699 373 H LEU 47 HN LEU 47 8.512 5.138 -10.532 374 HA LEU 47 HA LEU 47 9.217 7.983 -10.263 375 HB2 LEU 47 HB2 LEU 47 6.542 7.250 -9.191 376 HB3 LEU 47 HB1 LEU 47 7.104 8.768 -9.873 377 HG LEU 47 HG LEU 47 6.446 6.278 -11.475 378 HD11 LEU 47 HD11 LEU 47 4.967 8.870 -10.967 379 HD12 LEU 47 HD12 LEU 47 4.511 7.714 -12.216 380 HD13 LEU 47 HD13 LEU 47 4.442 7.253 -10.515 381 HD21 LEU 47 HD21 LEU 47 8.011 8.549 -12.162 382 HD22 LEU 47 HD22 LEU 47 7.401 7.312 -13.249 383 HD23 LEU 47 HD23 LEU 47 6.464 8.774 -12.957 384 H LYS 48 HN LYS 48 9.436 8.704 -8.138 385 HA LYS 48 HA LYS 48 9.784 6.544 -6.139 386 HB2 LYS 48 HB2 LYS 48 11.766 8.021 -6.887 387 HB3 LYS 48 HB1 LYS 48 10.986 9.304 -5.966 388 HG2 LYS 48 HG2 LYS 48 10.907 7.606 -4.021 389 HG3 LYS 48 HG1 LYS 48 12.073 6.673 -4.959 390 HD2 LYS 48 HD2 LYS 48 12.425 9.559 -4.088 391 HD3 LYS 48 HD1 LYS 48 13.215 8.165 -3.354 392 HE2 LYS 48 HE2 LYS 48 13.600 9.252 -6.147 393 HE3 LYS 48 HE1 LYS 48 14.808 9.075 -4.876 394 HZ1 LYS 48 HZ1 LYS 48 14.216 6.601 -5.007 395 HZ2 LYS 48 HZ2 LYS 48 13.537 6.982 -6.519 396 HZ3 LYS 48 HZ3 LYS 48 15.186 7.260 -6.237 397 H VAL 49 HN VAL 49 8.300 6.491 -4.505 398 HA VAL 49 HA VAL 49 7.000 9.045 -3.781 399 HB VAL 49 HB VAL 49 5.761 6.398 -4.346 400 HG11 VAL 49 HG11 VAL 49 5.209 6.537 -1.971 401 HG12 VAL 49 HG12 VAL 49 4.766 8.232 -2.138 402 HG13 VAL 49 HG13 VAL 49 3.787 6.985 -2.909 403 HG21 VAL 49 HG21 VAL 49 5.411 8.259 -5.812 404 HG22 VAL 49 HG22 VAL 49 3.902 7.960 -4.966 405 HG23 VAL 49 HG23 VAL 49 4.934 9.303 -4.477 406 H SER 50 HN SER 50 6.830 9.596 -1.795 407 HA SER 50 HA SER 50 8.255 7.968 0.226 408 HB2 SER 50 HB2 SER 50 9.216 10.155 -0.586 409 HB3 SER 50 HB1 SER 50 7.831 10.947 0.148 410 HG SER 50 HG SER 50 9.216 10.926 1.793 411 H TYR 51 HN TYR 51 7.354 7.702 2.274 412 HA TYR 51 HA TYR 51 4.626 8.792 2.665 413 HB2 TYR 51 HB2 TYR 51 5.608 6.270 3.979 414 HB3 TYR 51 HB1 TYR 51 3.956 6.776 3.645 415 HD1 TYR 51 HD2 TYR 51 7.140 6.010 1.773 416 HD2 TYR 51 HD1 TYR 51 2.860 5.732 1.895 417 HE1 TYR 51 HE2 TYR 51 7.166 4.718 -0.330 418 HE2 TYR 51 HE1 TYR 51 2.886 4.424 -0.213 419 HH TYR 51 HH TYR 51 4.571 2.937 -1.427 420 H ALA 52 HN ALA 52 4.376 10.002 4.468 421 HA ALA 52 HA ALA 52 6.329 9.684 6.662 422 HB1 ALA 52 HB1 ALA 52 5.910 12.267 6.922 423 HB2 ALA 52 HB2 ALA 52 5.505 12.166 5.207 424 HB3 ALA 52 HB3 ALA 52 7.101 11.678 5.763 425 H VAL 53 HN VAL 53 5.191 8.827 8.242 426 HA VAL 53 HA VAL 53 2.471 9.864 8.777 427 HB VAL 53 HB VAL 53 3.549 7.177 9.620 428 HG11 VAL 53 HG11 VAL 53 1.592 8.073 10.853 429 HG12 VAL 53 HG12 VAL 53 0.738 8.282 9.324 430 HG13 VAL 53 HG13 VAL 53 1.160 6.663 9.885 431 HG21 VAL 53 HG21 VAL 53 1.946 7.937 7.155 432 HG22 VAL 53 HG22 VAL 53 3.597 7.316 7.168 433 HG23 VAL 53 HG23 VAL 53 2.262 6.284 7.685 434 HA PRO 54 HA PRO 54 4.339 11.162 12.652 435 HB2 PRO 54 HB2 PRO 54 2.158 12.254 13.821 436 HB3 PRO 54 HB1 PRO 54 2.953 13.027 12.432 437 HG2 PRO 54 HG2 PRO 54 0.488 11.344 12.503 438 HG3 PRO 54 HG1 PRO 54 0.803 12.841 11.606 439 HD2 PRO 54 HD2 PRO 54 0.972 10.333 10.472 440 HD3 PRO 54 HD1 PRO 54 1.890 11.742 9.893 441 H LYS 55 HN LYS 55 4.576 10.233 14.666 442 HA LYS 55 HA LYS 55 2.476 8.538 15.761 443 HB2 LYS 55 HB2 LYS 55 3.996 7.198 14.126 444 HB3 LYS 55 HB1 LYS 55 5.190 7.298 15.417 445 HG2 LYS 55 HG2 LYS 55 3.624 6.253 16.989 446 HG3 LYS 55 HG1 LYS 55 2.374 6.218 15.746 447 HD2 LYS 55 HD2 LYS 55 3.218 4.055 15.565 448 HD3 LYS 55 HD1 LYS 55 4.202 4.890 14.366 449 HE2 LYS 55 HE2 LYS 55 5.887 3.838 15.549 450 HE3 LYS 55 HE1 LYS 55 5.767 5.311 16.510 451 HZ1 LYS 55 HZ1 LYS 55 4.976 2.601 17.163 452 HZ2 LYS 55 HZ2 LYS 55 5.479 3.865 18.182 453 HZ3 LYS 55 HZ3 LYS 55 3.875 3.805 17.634 454 HA PRO 56 HA PRO 56 4.531 11.194 18.961 455 HB2 PRO 56 HB2 PRO 56 2.349 9.719 20.412 456 HB3 PRO 56 HB1 PRO 56 2.864 11.411 20.580 457 HG2 PRO 56 HG2 PRO 56 0.690 10.761 19.181 458 HG3 PRO 56 HG1 PRO 56 1.760 12.077 18.669 459 HD2 PRO 56 HD2 PRO 56 1.386 9.397 17.458 460 HD3 PRO 56 HD1 PRO 56 1.983 10.893 16.708 461 H ASN 57 HN ASN 57 4.075 7.793 18.626 462 HA ASN 57 HA ASN 57 5.759 7.166 20.958 463 HB2 ASN 57 HB2 ASN 57 4.371 5.271 19.052 464 HB3 ASN 57 HB1 ASN 57 5.099 4.871 20.606 465 HD21 ASN 57 HD21 ASN 57 4.113 7.144 22.102 466 HD22 ASN 57 HD22 ASN 57 2.430 6.978 22.239 467 H GLY 58 HN GLY 58 6.585 8.367 18.231 468 HA2 GLY 58 HA2 GLY 58 9.004 8.115 17.681 469 HA3 GLY 58 HA1 GLY 58 8.703 6.382 17.597 470 H CYS 59 HN CYS 59 8.597 9.369 15.912 471 HA CYS 59 HA CYS 59 6.797 8.985 13.863 472 HB2 CYS 59 HB2 CYS 59 9.556 10.055 13.308 473 HB3 CYS 59 HB1 CYS 59 8.012 10.572 12.629 474 H ARG 60 HN ARG 60 6.876 8.057 11.794 475 HA ARG 60 HA ARG 60 9.063 6.120 11.308 476 HB2 ARG 60 HB2 ARG 60 6.816 5.155 12.251 477 HB3 ARG 60 HB1 ARG 60 6.210 5.442 10.623 478 HG2 ARG 60 HG2 ARG 60 7.867 3.990 9.661 479 HG3 ARG 60 HG1 ARG 60 8.744 3.876 11.188 480 HD2 ARG 60 HD2 ARG 60 6.777 2.774 12.216 481 HD3 ARG 60 HD1 ARG 60 5.943 2.842 10.666 482 HE ARG 60 HE ARG 60 8.225 1.539 10.027 483 HH11 ARG 60 HH21 ARG 60 5.915 1.181 12.580 484 HH12 ARG 60 HH22 ARG 60 6.149 -0.527 12.738 485 HH21 ARG 60 HH11 ARG 60 8.536 -0.702 10.230 486 HH22 ARG 60 HH12 ARG 60 7.633 -1.593 11.408 487 H LYS 61 HN LYS 61 10.003 6.594 9.431 488 HA LYS 61 HA LYS 61 8.321 7.508 7.179 489 HB2 LYS 61 HB2 LYS 61 9.287 9.521 8.020 490 HB3 LYS 61 HB1 LYS 61 10.885 8.787 8.137 491 HG2 LYS 61 HG2 LYS 61 11.091 8.658 5.752 492 HG3 LYS 61 HG1 LYS 61 9.386 9.047 5.518 493 HD2 LYS 61 HD2 LYS 61 9.799 11.286 6.546 494 HD3 LYS 61 HD1 LYS 61 11.516 10.892 6.637 495 HE2 LYS 61 HE2 LYS 61 11.522 10.542 4.163 496 HE3 LYS 61 HE1 LYS 61 9.842 11.073 4.116 497 HZ1 LYS 61 HZ1 LYS 61 10.962 13.054 5.498 498 HZ2 LYS 61 HZ2 LYS 61 12.264 12.620 4.496 499 HZ3 LYS 61 HZ3 LYS 61 10.781 13.074 3.809 500 H TRP 62 HN TRP 62 8.738 6.603 5.302 501 HA TRP 62 HA TRP 62 11.318 5.302 4.774 502 HB2 TRP 62 HB2 TRP 62 10.254 3.207 4.090 503 HB3 TRP 62 HB1 TRP 62 9.880 3.547 5.781 504 HD1 TRP 62 HD1 TRP 62 8.306 3.983 2.282 505 HE1 TRP 62 HE1 TRP 62 5.740 3.928 2.544 506 HE3 TRP 62 HE3 TRP 62 7.939 3.651 7.362 507 HZ2 TRP 62 HZ2 TRP 62 3.800 3.738 4.618 508 HZ3 TRP 62 HZ3 TRP 62 5.717 3.536 8.456 509 HH2 TRP 62 HH2 TRP 62 3.647 3.580 7.092 510 H GLU 63 HN GLU 63 11.422 4.557 2.449 511 HA GLU 63 HA GLU 63 9.689 6.199 0.694 512 HB2 GLU 63 HB2 GLU 63 11.872 7.302 0.965 513 HB3 GLU 63 HB1 GLU 63 12.683 5.826 0.440 514 HG2 GLU 63 HG2 GLU 63 10.565 7.087 -1.295 515 HG3 GLU 63 HG1 GLU 63 12.212 7.711 -1.315 516 H THR 64 HN THR 64 9.182 5.319 -1.302 517 HA THR 64 HA THR 64 10.206 2.616 -1.911 518 HB THR 64 HB THR 64 7.272 3.289 -2.108 519 HG1 THR 64 HG1 THR 64 8.212 1.618 -0.104 520 HG21 THR 64 HG21 THR 64 7.079 0.828 -2.181 521 HG22 THR 64 HG22 THR 64 8.107 1.430 -3.481 522 HG23 THR 64 HG23 THR 64 8.834 0.690 -2.054 523 H THR 65 HN THR 65 10.318 2.106 -4.052 524 HA THR 65 HA THR 65 9.820 4.306 -5.955 525 HB THR 65 HB THR 65 11.564 1.842 -6.182 526 HG1 THR 65 HG1 THR 65 12.175 4.602 -5.963 527 HG21 THR 65 HG21 THR 65 10.816 2.342 -8.378 528 HG22 THR 65 HG22 THR 65 10.909 4.081 -8.099 529 HG23 THR 65 HG23 THR 65 12.388 3.130 -8.244 530 H PHE 66 HN PHE 66 8.578 3.973 -7.815 531 HA PHE 66 HA PHE 66 7.102 1.393 -7.894 532 HB2 PHE 66 HB2 PHE 66 5.264 2.675 -7.519 533 HB3 PHE 66 HB1 PHE 66 6.139 4.170 -7.852 534 HD1 PHE 66 HD1 PHE 66 5.141 1.107 -9.773 535 HD2 PHE 66 HD2 PHE 66 5.317 5.380 -9.671 536 HE1 PHE 66 HE1 PHE 66 4.154 1.202 -12.032 537 HE2 PHE 66 HE2 PHE 66 4.320 5.465 -11.951 538 HZ PHE 66 HZ PHE 66 3.756 3.376 -13.132 539 H LYS 67 HN LYS 67 7.133 0.298 -9.756 540 HA LYS 67 HA LYS 67 8.150 1.673 -12.173 541 HB2 LYS 67 HB2 LYS 67 8.552 -1.204 -11.312 542 HB3 LYS 67 HB1 LYS 67 9.075 -0.517 -12.850 543 HG2 LYS 67 HG2 LYS 67 10.284 1.261 -11.328 544 HG3 LYS 67 HG1 LYS 67 10.122 0.023 -10.081 545 HD2 LYS 67 HD2 LYS 67 11.161 -1.604 -11.748 546 HD3 LYS 67 HD1 LYS 67 11.558 -0.196 -12.733 547 HE2 LYS 67 HE2 LYS 67 12.389 -0.536 -9.838 548 HE3 LYS 67 HE1 LYS 67 13.429 -0.891 -11.216 549 HZ1 LYS 67 HZ1 LYS 67 13.472 1.441 -10.081 550 HZ2 LYS 67 HZ2 LYS 67 13.607 1.302 -11.769 551 HZ3 LYS 67 HZ3 LYS 67 12.122 1.730 -11.072 552 H LYS 68 HN LYS 68 7.197 1.165 -14.122 553 HA LYS 68 HA LYS 68 4.424 0.464 -14.049 554 HB2 LYS 68 HB2 LYS 68 5.394 2.150 -15.595 555 HB3 LYS 68 HB1 LYS 68 6.215 0.842 -16.449 556 HG2 LYS 68 HG2 LYS 68 4.137 -0.159 -17.099 557 HG3 LYS 68 HG1 LYS 68 3.221 0.886 -16.014 558 HD2 LYS 68 HD2 LYS 68 3.077 1.640 -18.380 559 HD3 LYS 68 HD1 LYS 68 3.826 2.850 -17.340 560 HE2 LYS 68 HE2 LYS 68 4.973 2.315 -19.607 561 HE3 LYS 68 HE1 LYS 68 5.985 2.404 -18.166 562 HZ1 LYS 68 HZ1 LYS 68 4.917 -0.052 -19.446 563 HZ2 LYS 68 HZ2 LYS 68 6.543 0.441 -19.380 564 HZ3 LYS 68 HZ3 LYS 68 5.742 -0.031 -17.961 565 H THR 69 HN THR 69 3.543 -1.469 -14.155 566 HA THR 69 HA THR 69 4.964 -3.645 -15.575 567 HB THR 69 HB THR 69 5.171 -3.931 -13.117 568 HG1 THR 69 HG1 THR 69 4.753 -6.007 -13.300 569 HG21 THR 69 HG21 THR 69 3.231 -4.214 -11.735 570 HG22 THR 69 HG22 THR 69 2.989 -2.722 -12.645 571 HG23 THR 69 HG23 THR 69 2.157 -4.198 -13.134 572 H SER 70 HN SER 70 3.358 -5.527 -15.947 573 HA SER 70 HA SER 70 1.124 -4.454 -17.419 574 HB2 SER 70 HB2 SER 70 0.784 -6.701 -18.187 575 HB3 SER 70 HB1 SER 70 2.523 -6.425 -18.145 576 HG SER 70 HG SER 70 2.502 -8.162 -16.950 577 H ASP 71 HN ASP 71 0.561 -3.619 -14.991 578 HA ASP 71 HA ASP 71 -0.837 -5.411 -13.296 579 HB2 ASP 71 HB2 ASP 71 -0.001 -3.274 -12.482 580 HB3 ASP 71 HB1 ASP 71 -1.071 -2.412 -13.586 581 H ASP 72 HN ASP 72 -2.608 -2.636 -14.507 582 HA ASP 72 HA ASP 72 -4.365 -4.115 -16.214 583 HB2 ASP 72 HB2 ASP 72 -5.174 -4.998 -14.094 584 HB3 ASP 72 HB1 ASP 72 -5.367 -3.363 -13.462 585 H GLY 73 HN GLY 73 -4.047 -2.462 -17.644 586 HA2 GLY 73 HA2 GLY 73 -4.779 -0.543 -18.717 587 HA3 GLY 73 HA1 GLY 73 -5.747 -0.160 -17.295 588 H GLU 74 HN GLU 74 -5.038 1.367 -15.923 589 HA GLU 74 HA GLU 74 -2.252 2.351 -16.241 590 HB2 GLU 74 HB2 GLU 74 -4.857 3.833 -16.021 591 HB3 GLU 74 HB1 GLU 74 -3.381 4.578 -15.410 592 HG2 GLU 74 HG2 GLU 74 -3.768 5.240 -17.737 593 HG3 GLU 74 HG1 GLU 74 -2.315 4.250 -17.617 594 H VAL 75 HN VAL 75 -1.543 1.032 -14.479 595 HA VAL 75 HA VAL 75 -2.242 2.189 -11.879 596 HB VAL 75 HB VAL 75 -1.892 -0.788 -12.170 597 HG11 VAL 75 HG11 VAL 75 -3.320 -0.337 -9.881 598 HG12 VAL 75 HG12 VAL 75 -1.563 -0.401 -9.926 599 HG13 VAL 75 HG13 VAL 75 -2.385 1.154 -9.949 600 HG21 VAL 75 HG21 VAL 75 -4.474 -0.683 -11.663 601 HG22 VAL 75 HG22 VAL 75 -4.361 0.918 -12.391 602 HG23 VAL 75 HG23 VAL 75 -3.906 -0.506 -13.322 603 H TYR 76 HN TYR 76 -0.643 1.989 -10.297 604 HA TYR 76 HA TYR 76 2.054 1.638 -11.445 605 HB2 TYR 76 HB2 TYR 76 1.377 3.113 -8.908 606 HB3 TYR 76 HB1 TYR 76 2.769 3.331 -9.954 607 HD1 TYR 76 HD2 TYR 76 1.495 3.404 -12.652 608 HD2 TYR 76 HD1 TYR 76 0.276 5.215 -8.955 609 HE1 TYR 76 HE2 TYR 76 0.264 5.141 -13.907 610 HE2 TYR 76 HE1 TYR 76 -0.961 6.948 -10.211 611 HH TYR 76 HH TYR 76 -0.491 7.809 -13.094 612 H TYR 77 HN TYR 77 3.628 0.375 -10.409 613 HA TYR 77 HA TYR 77 2.757 -1.081 -7.971 614 HB2 TYR 77 HB2 TYR 77 2.410 -2.187 -10.447 615 HB3 TYR 77 HB1 TYR 77 3.999 -2.808 -10.028 616 HD1 TYR 77 HD2 TYR 77 3.657 -3.015 -7.020 617 HD2 TYR 77 HD1 TYR 77 1.061 -4.116 -10.258 618 HE1 TYR 77 HE2 TYR 77 2.590 -4.725 -5.583 619 HE2 TYR 77 HE1 TYR 77 -0.002 -5.831 -8.821 620 HH TYR 77 HH TYR 77 -0.126 -6.695 -6.776 621 H SER 78 HN SER 78 4.288 -1.230 -6.497 622 HA SER 78 HA SER 78 7.111 -0.857 -7.278 623 HB2 SER 78 HB2 SER 78 6.415 0.683 -5.560 624 HB3 SER 78 HB1 SER 78 5.672 -0.612 -4.625 625 HG SER 78 HG SER 78 8.431 -0.315 -5.242 626 H GLU 79 HN GLU 79 7.849 -2.802 -7.847 627 HA GLU 79 HA GLU 79 7.046 -5.311 -6.994 628 HB2 GLU 79 HB2 GLU 79 8.572 -4.782 -8.923 629 HB3 GLU 79 HB1 GLU 79 9.883 -4.615 -7.755 630 HG2 GLU 79 HG2 GLU 79 9.418 -6.931 -6.955 631 HG3 GLU 79 HG1 GLU 79 8.193 -7.091 -8.212 632 H GLU 80 HN GLU 80 9.538 -3.237 -5.548 633 HA GLU 80 HA GLU 80 10.522 -5.160 -3.724 634 HB2 GLU 80 HB2 GLU 80 10.577 -2.141 -3.643 635 HB3 GLU 80 HB1 GLU 80 11.474 -3.182 -2.536 636 HG2 GLU 80 HG2 GLU 80 12.589 -4.249 -4.489 637 HG3 GLU 80 HG1 GLU 80 11.748 -3.124 -5.555 638 H ALA 81 HN ALA 81 7.936 -2.745 -3.398 639 HA ALA 81 HA ALA 81 7.459 -3.665 -0.633 640 HB1 ALA 81 HB1 ALA 81 6.163 -1.306 -1.979 641 HB2 ALA 81 HB2 ALA 81 7.746 -1.199 -1.210 642 HB3 ALA 81 HB3 ALA 81 6.329 -1.629 -0.254 643 H LYS 82 HN LYS 82 6.480 -4.784 -3.451 644 HA LYS 82 HA LYS 82 4.437 -5.500 -4.374 645 HB2 LYS 82 HB2 LYS 82 4.439 -6.547 -1.534 646 HB3 LYS 82 HB1 LYS 82 3.354 -7.127 -2.798 647 HG2 LYS 82 HG2 LYS 82 5.248 -7.832 -4.163 648 HG3 LYS 82 HG1 LYS 82 6.379 -7.145 -3.000 649 HD2 LYS 82 HD2 LYS 82 6.356 -9.437 -2.447 650 HD3 LYS 82 HD1 LYS 82 5.253 -8.722 -1.274 651 HE2 LYS 82 HE2 LYS 82 3.326 -9.427 -2.546 652 HE3 LYS 82 HE1 LYS 82 4.339 -9.934 -3.898 653 HZ1 LYS 82 HZ1 LYS 82 4.214 -11.138 -1.191 654 HZ2 LYS 82 HZ2 LYS 82 3.765 -11.856 -2.664 655 HZ3 LYS 82 HZ3 LYS 82 5.399 -11.537 -2.343 656 H LYS 83 HN LYS 83 3.960 -3.040 -4.110 657 HA LYS 83 HA LYS 83 1.226 -2.852 -3.080 658 HB2 LYS 83 HB2 LYS 83 2.538 -2.042 -1.194 659 HB3 LYS 83 HB1 LYS 83 3.415 -0.932 -2.250 660 HG2 LYS 83 HG2 LYS 83 1.420 0.336 -2.706 661 HG3 LYS 83 HG1 LYS 83 0.407 -0.868 -1.908 662 HD2 LYS 83 HD2 LYS 83 0.798 1.095 -0.453 663 HD3 LYS 83 HD1 LYS 83 1.485 -0.372 0.244 664 HE2 LYS 83 HE2 LYS 83 3.198 1.375 -1.507 665 HE3 LYS 83 HE1 LYS 83 2.925 1.827 0.175 666 HZ1 LYS 83 HZ1 LYS 83 4.901 0.304 -0.425 667 HZ2 LYS 83 HZ2 LYS 83 3.969 -0.053 0.949 668 HZ3 LYS 83 HZ3 LYS 83 3.729 -0.923 -0.486 669 H LYS 84 HN LYS 84 -0.033 -1.763 -4.419 670 HA LYS 84 HA LYS 84 1.201 0.007 -6.453 671 HB2 LYS 84 HB2 LYS 84 -0.856 -0.935 -7.843 672 HB3 LYS 84 HB1 LYS 84 0.652 -1.836 -7.768 673 HG2 LYS 84 HG2 LYS 84 -0.183 -3.341 -6.148 674 HG3 LYS 84 HG1 LYS 84 -1.539 -2.288 -5.753 675 HD2 LYS 84 HD2 LYS 84 -2.629 -2.745 -7.832 676 HD3 LYS 84 HD1 LYS 84 -1.185 -3.515 -8.495 677 HE2 LYS 84 HE2 LYS 84 -1.395 -5.386 -7.009 678 HE3 LYS 84 HE1 LYS 84 -2.633 -4.573 -6.057 679 HZ1 LYS 84 HZ1 LYS 84 -3.887 -5.923 -7.396 680 HZ2 LYS 84 HZ2 LYS 84 -3.868 -4.497 -8.321 681 HZ3 LYS 84 HZ3 LYS 84 -2.839 -5.784 -8.726 682 H VAL 85 HN VAL 85 0.107 1.815 -7.036 683 HA VAL 85 HA VAL 85 -2.462 2.290 -5.679 684 HB VAL 85 HB VAL 85 -1.875 4.385 -4.934 685 HG11 VAL 85 HG11 VAL 85 -0.806 2.449 -3.742 686 HG12 VAL 85 HG12 VAL 85 0.692 2.854 -4.580 687 HG13 VAL 85 HG13 VAL 85 -0.031 4.006 -3.457 688 HG21 VAL 85 HG21 VAL 85 -0.736 5.668 -6.522 689 HG22 VAL 85 HG22 VAL 85 0.610 5.269 -5.459 690 HG23 VAL 85 HG23 VAL 85 0.355 4.346 -6.932 691 H GLU 86 HN GLU 86 -4.015 2.972 -6.896 692 HA GLU 86 HA GLU 86 -3.387 3.819 -9.670 693 HB2 GLU 86 HB2 GLU 86 -4.530 1.603 -9.398 694 HB3 GLU 86 HB1 GLU 86 -5.890 2.451 -8.675 695 HG2 GLU 86 HG2 GLU 86 -6.160 3.793 -10.718 696 HG3 GLU 86 HG1 GLU 86 -4.787 2.970 -11.444 697 H VAL 87 HN VAL 87 -4.042 5.661 -10.326 698 HA VAL 87 HA VAL 87 -5.548 7.417 -8.569 699 HB VAL 87 HB VAL 87 -3.437 8.088 -9.653 700 HG11 VAL 87 HG11 VAL 87 -4.817 8.486 -12.275 701 HG12 VAL 87 HG12 VAL 87 -3.125 8.138 -11.936 702 HG13 VAL 87 HG13 VAL 87 -4.316 6.841 -11.888 703 HG21 VAL 87 HG21 VAL 87 -5.843 9.667 -10.579 704 HG22 VAL 87 HG22 VAL 87 -5.176 9.710 -8.945 705 HG23 VAL 87 HG23 VAL 87 -4.216 10.293 -10.306 706 H LEU 88 HN LEU 88 -7.738 6.940 -8.675 707 HA LEU 88 HA LEU 88 -9.057 6.623 -11.244 708 HB2 LEU 88 HB2 LEU 88 -10.622 7.268 -8.759 709 HB3 LEU 88 HB1 LEU 88 -11.039 6.207 -10.096 710 HG LEU 88 HG LEU 88 -10.591 4.735 -8.323 711 HD11 LEU 88 HD11 LEU 88 -8.877 3.414 -9.154 712 HD12 LEU 88 HD12 LEU 88 -9.221 4.439 -10.544 713 HD13 LEU 88 HD13 LEU 88 -7.837 4.787 -9.508 714 HD21 LEU 88 HD21 LEU 88 -7.950 5.382 -7.436 715 HD22 LEU 88 HD22 LEU 88 -8.905 6.856 -7.366 716 HD23 LEU 88 HD23 LEU 88 -9.445 5.414 -6.513 717 H ASP 89 HN ASP 89 -9.275 9.075 -8.615 718 HA ASP 89 HA ASP 89 -9.788 11.118 -10.686 719 HB2 ASP 89 HB2 ASP 89 -11.845 10.401 -9.307 720 HB3 ASP 89 HB1 ASP 89 -11.033 11.144 -7.933 721 H THR 90 HN THR 90 -8.431 12.806 -10.533 722 HA THR 90 HA THR 90 -7.149 13.427 -7.968 723 HB THR 90 HB THR 90 -5.899 11.741 -9.551 724 HG1 THR 90 HG1 THR 90 -4.070 13.610 -8.811 725 HG21 THR 90 HG21 THR 90 -4.968 14.368 -10.665 726 HG22 THR 90 HG22 THR 90 -4.404 12.766 -11.128 727 HG23 THR 90 HG23 THR 90 -6.053 13.263 -11.506 728 H ASP 91 HN ASP 91 -7.271 15.542 -7.644 729 HA ASP 91 HA ASP 91 -8.073 17.335 -9.763 730 HB2 ASP 91 HB2 ASP 91 -8.806 17.515 -7.342 731 HB3 ASP 91 HB1 ASP 91 -7.176 18.084 -6.984 732 H TYR 92 HN TYR 92 -5.157 16.449 -8.123 733 HA TYR 92 HA TYR 92 -2.949 16.951 -8.490 734 HB2 TYR 92 HB2 TYR 92 -4.259 17.407 -11.084 735 HB3 TYR 92 HB1 TYR 92 -2.819 18.387 -10.880 736 HD1 TYR 92 HD1 TYR 92 -0.896 16.866 -9.520 737 HD2 TYR 92 HD2 TYR 92 -3.851 15.469 -12.299 738 HE1 TYR 92 HE1 TYR 92 0.523 14.894 -10.043 739 HE2 TYR 92 HE2 TYR 92 -2.441 13.499 -12.812 740 HH TYR 92 HH TYR 92 0.793 13.143 -11.395 741 H LYS 93 HN LYS 93 -5.074 19.098 -7.436 742 HA LYS 93 HA LYS 93 -3.066 21.163 -7.134 743 HB2 LYS 93 HB2 LYS 93 -4.321 21.513 -9.369 744 HB3 LYS 93 HB1 LYS 93 -5.690 21.978 -8.360 745 HG2 LYS 93 HG2 LYS 93 -4.034 23.574 -7.177 746 HG3 LYS 93 HG1 LYS 93 -2.979 23.297 -8.563 747 HD2 LYS 93 HD2 LYS 93 -5.840 24.287 -8.743 748 HD3 LYS 93 HD1 LYS 93 -4.411 25.315 -8.856 749 HE2 LYS 93 HE2 LYS 93 -3.647 23.786 -10.767 750 HE3 LYS 93 HE1 LYS 93 -5.287 23.136 -10.758 751 HZ1 LYS 93 HZ1 LYS 93 -4.345 25.556 -11.868 752 HZ2 LYS 93 HZ2 LYS 93 -5.888 24.856 -11.990 753 HZ3 LYS 93 HZ3 LYS 93 -5.529 25.892 -10.696 754 H SER 94 HN SER 94 -6.100 19.689 -6.311 755 HA SER 94 HA SER 94 -6.255 21.417 -3.903 756 HB2 SER 94 HB2 SER 94 -8.643 20.330 -5.398 757 HB3 SER 94 HB1 SER 94 -8.646 21.457 -4.044 758 HG SER 94 HG SER 94 -7.084 22.210 -6.184 759 H TYR 95 HN TYR 95 -7.525 18.374 -5.283 760 HA TYR 95 HA TYR 95 -6.638 16.881 -2.969 761 HB2 TYR 95 HB2 TYR 95 -8.963 16.062 -2.444 762 HB3 TYR 95 HB1 TYR 95 -8.666 17.745 -2.008 763 HD1 TYR 95 HD2 TYR 95 -10.213 15.524 -4.552 764 HD2 TYR 95 HD1 TYR 95 -9.841 19.539 -3.073 765 HE1 TYR 95 HE2 TYR 95 -12.085 16.237 -6.015 766 HE2 TYR 95 HE1 TYR 95 -11.712 20.252 -4.535 767 HH TYR 95 HH TYR 95 -13.316 17.937 -6.725 768 H ALA 96 HN ALA 96 -7.197 14.530 -3.202 769 HA ALA 96 HA ALA 96 -8.067 13.687 -5.849 770 HB1 ALA 96 HB1 ALA 96 -5.727 14.152 -6.285 771 HB2 ALA 96 HB2 ALA 96 -5.969 12.404 -6.261 772 HB3 ALA 96 HB3 ALA 96 -5.243 13.213 -4.875 773 H VAL 97 HN VAL 97 -8.664 11.564 -5.976 774 HA VAL 97 HA VAL 97 -8.675 10.029 -3.426 775 HB VAL 97 HB VAL 97 -10.629 9.768 -5.730 776 HG11 VAL 97 HG11 VAL 97 -10.709 7.790 -4.467 777 HG12 VAL 97 HG12 VAL 97 -10.421 8.629 -2.945 778 HG13 VAL 97 HG13 VAL 97 -11.987 8.764 -3.743 779 HG21 VAL 97 HG21 VAL 97 -12.186 10.944 -4.008 780 HG22 VAL 97 HG22 VAL 97 -10.690 11.510 -3.269 781 HG23 VAL 97 HG23 VAL 97 -11.066 11.944 -4.934 782 H ILE 98 HN ILE 98 -7.375 8.173 -3.519 783 HA ILE 98 HA ILE 98 -6.907 7.023 -6.194 784 HB ILE 98 HB ILE 98 -4.952 7.284 -3.908 785 HG12 ILE 98 HG12 ILE 98 -5.080 8.877 -6.485 786 HG13 ILE 98 HG11 ILE 98 -5.642 9.481 -4.928 787 HG21 ILE 98 HG21 ILE 98 -4.708 5.405 -5.674 788 HG22 ILE 98 HG22 ILE 98 -4.337 6.703 -6.803 789 HG23 ILE 98 HG23 ILE 98 -3.318 6.447 -5.392 790 HD11 ILE 98 HD11 ILE 98 -3.034 9.616 -5.931 791 HD12 ILE 98 HD12 ILE 98 -3.544 9.984 -4.288 792 HD13 ILE 98 HD13 ILE 98 -2.981 8.363 -4.690 793 H TYR 99 HN TYR 99 -6.751 4.846 -6.322 794 HA TYR 99 HA TYR 99 -7.787 3.299 -4.046 795 HB2 TYR 99 HB2 TYR 99 -8.748 3.177 -6.436 796 HB3 TYR 99 HB1 TYR 99 -7.304 2.246 -6.831 797 HD1 TYR 99 HD1 TYR 99 -6.901 0.043 -5.815 798 HD2 TYR 99 HD2 TYR 99 -10.460 2.288 -4.954 799 HE1 TYR 99 HE1 TYR 99 -7.949 -1.987 -4.847 800 HE2 TYR 99 HE2 TYR 99 -11.507 0.260 -3.985 801 HH TYR 99 HH TYR 99 -10.131 -2.874 -4.360 802 H ALA 100 HN ALA 100 -6.315 2.546 -2.737 803 HA ALA 100 HA ALA 100 -3.677 1.689 -3.762 804 HB1 ALA 100 HB1 ALA 100 -4.682 2.526 -1.054 805 HB2 ALA 100 HB2 ALA 100 -3.332 3.171 -1.984 806 HB3 ALA 100 HB3 ALA 100 -3.191 1.595 -1.206 807 H THR 101 HN THR 101 -3.028 -0.381 -3.738 808 HA THR 101 HA THR 101 -4.606 -2.377 -2.248 809 HB THR 101 HB THR 101 -3.696 -2.725 -5.112 810 HG1 THR 101 HG1 THR 101 -5.342 -1.469 -5.459 811 HG21 THR 101 HG21 THR 101 -4.150 -4.704 -3.401 812 HG22 THR 101 HG22 THR 101 -5.835 -4.328 -3.766 813 HG23 THR 101 HG23 THR 101 -4.737 -4.799 -5.060 814 H ARG 102 HN ARG 102 -3.317 -3.640 -1.052 815 HA ARG 102 HA ARG 102 -0.493 -3.991 -1.882 816 HB2 ARG 102 HB2 ARG 102 -0.583 -2.514 0.051 817 HB3 ARG 102 HB1 ARG 102 -1.605 -3.665 0.912 818 HG2 ARG 102 HG2 ARG 102 0.171 -5.305 0.964 819 HG3 ARG 102 HG1 ARG 102 1.177 -4.318 -0.098 820 HD2 ARG 102 HD2 ARG 102 1.264 -2.552 1.621 821 HD3 ARG 102 HD1 ARG 102 0.255 -3.532 2.681 822 HE ARG 102 HE ARG 102 2.105 -4.895 3.126 823 HH11 ARG 102 HH21 ARG 102 2.718 -2.674 0.545 824 HH12 ARG 102 HH22 ARG 102 4.423 -2.977 0.504 825 HH21 ARG 102 HH11 ARG 102 4.341 -5.296 3.081 826 HH22 ARG 102 HH12 ARG 102 5.342 -4.461 1.941 827 H VAL 103 HN VAL 103 0.103 -6.120 -2.161 828 HA VAL 103 HA VAL 103 -1.694 -8.141 -0.963 829 HB VAL 103 HB VAL 103 -1.881 -8.046 -3.401 830 HG11 VAL 103 HG11 VAL 103 1.025 -8.827 -3.602 831 HG12 VAL 103 HG12 VAL 103 -0.044 -8.212 -4.861 832 HG13 VAL 103 HG13 VAL 103 0.545 -7.130 -3.601 833 HG21 VAL 103 HG21 VAL 103 -0.256 -10.454 -2.511 834 HG22 VAL 103 HG22 VAL 103 -1.987 -10.255 -2.246 835 HG23 VAL 103 HG23 VAL 103 -1.358 -10.386 -3.885 836 H LYS 104 HN LYS 104 -0.794 -9.309 0.581 837 HA LYS 104 HA LYS 104 2.129 -9.520 0.730 838 HB2 LYS 104 HB2 LYS 104 0.777 -8.770 2.728 839 HB3 LYS 104 HB1 LYS 104 0.044 -10.372 2.757 840 HG2 LYS 104 HG2 LYS 104 2.112 -11.431 3.250 841 HG3 LYS 104 HG1 LYS 104 3.044 -10.003 2.803 842 HD2 LYS 104 HD2 LYS 104 2.958 -10.176 5.234 843 HD3 LYS 104 HD1 LYS 104 2.014 -8.780 4.718 844 HE2 LYS 104 HE2 LYS 104 -0.048 -9.915 5.054 845 HE3 LYS 104 HE1 LYS 104 0.746 -11.487 5.158 846 HZ1 LYS 104 HZ1 LYS 104 1.664 -10.952 7.235 847 HZ2 LYS 104 HZ2 LYS 104 1.274 -9.305 7.088 848 HZ3 LYS 104 HZ3 LYS 104 0.044 -10.449 7.324 849 H ASP 105 HN ASP 105 2.908 -11.735 1.500 850 HA ASP 105 HA ASP 105 2.299 -13.654 -0.442 851 HB2 ASP 105 HB2 ASP 105 3.573 -13.975 2.282 852 HB3 ASP 105 HB1 ASP 105 3.537 -15.236 1.051 853 H GLY 106 HN GLY 106 0.371 -14.546 -0.707 854 HA2 GLY 106 HA2 GLY 106 -1.279 -16.124 -0.241 855 HA3 GLY 106 HA1 GLY 106 -0.780 -16.123 1.442 856 H ARG 107 HN ARG 107 -1.125 -12.922 0.819 857 HA ARG 107 HA ARG 107 -4.055 -12.922 1.249 858 HB2 ARG 107 HB2 ARG 107 -2.025 -11.452 2.943 859 HB3 ARG 107 HB1 ARG 107 -3.776 -11.270 3.061 860 HG2 ARG 107 HG2 ARG 107 -3.962 -13.713 3.534 861 HG3 ARG 107 HG1 ARG 107 -2.202 -13.819 3.525 862 HD2 ARG 107 HD2 ARG 107 -2.213 -12.010 5.319 863 HD3 ARG 107 HD1 ARG 107 -3.952 -12.263 5.439 864 HE ARG 107 HE ARG 107 -2.360 -14.679 5.693 865 HH11 ARG 107 HH21 ARG 107 -3.849 -11.975 7.257 866 HH12 ARG 107 HH22 ARG 107 -3.941 -12.745 8.805 867 HH21 ARG 107 HH11 ARG 107 -2.476 -15.695 7.721 868 HH22 ARG 107 HH12 ARG 107 -3.163 -14.851 9.069 869 H THR 108 HN THR 108 -5.163 -11.146 0.561 870 HA THR 108 HA THR 108 -3.663 -9.159 -1.055 871 HB THR 108 HB THR 108 -6.521 -10.089 -1.415 872 HG1 THR 108 HG1 THR 108 -5.512 -11.003 -3.364 873 HG21 THR 108 HG21 THR 108 -4.695 -8.236 -2.953 874 HG22 THR 108 HG22 THR 108 -6.162 -8.925 -3.650 875 HG23 THR 108 HG23 THR 108 -6.266 -7.863 -2.246 876 H LEU 109 HN LEU 109 -4.622 -6.984 -1.113 877 HA LEU 109 HA LEU 109 -6.486 -6.355 1.049 878 HB2 LEU 109 HB2 LEU 109 -3.912 -6.316 1.736 879 HB3 LEU 109 HB1 LEU 109 -3.987 -4.723 1.013 880 HG LEU 109 HG LEU 109 -6.168 -4.482 2.489 881 HD11 LEU 109 HD11 LEU 109 -4.599 -6.382 4.237 882 HD12 LEU 109 HD12 LEU 109 -6.246 -5.794 4.457 883 HD13 LEU 109 HD13 LEU 109 -5.890 -6.966 3.189 884 HD21 LEU 109 HD21 LEU 109 -4.661 -3.731 4.412 885 HD22 LEU 109 HD22 LEU 109 -3.308 -4.352 3.467 886 HD23 LEU 109 HD23 LEU 109 -4.295 -3.036 2.833 887 H HIS 110 HN HIS 110 -7.285 -4.261 1.002 888 HA HIS 110 HA HIS 110 -6.668 -2.583 -1.304 889 HB2 HIS 110 HB2 HIS 110 -9.350 -2.417 -1.513 890 HB3 HIS 110 HB1 HIS 110 -8.403 -3.581 -2.438 891 HD1 HIS 110 HD1 HIS 110 -11.177 -3.401 -0.125 892 HD2 HIS 110 HD2 HIS 110 -8.207 -6.206 -0.959 893 HE1 HIS 110 HE1 HIS 110 -11.983 -5.606 0.827 894 H MET 111 HN MET 111 -7.138 -0.374 -0.967 895 HA MET 111 HA MET 111 -8.670 0.428 1.337 896 HB2 MET 111 HB2 MET 111 -6.558 1.821 2.116 897 HB3 MET 111 HB1 MET 111 -6.780 0.159 2.660 898 HG2 MET 111 HG2 MET 111 -5.089 -0.656 1.306 899 HG3 MET 111 HG1 MET 111 -5.314 0.597 0.087 900 HE1 MET 111 HE1 MET 111 -4.953 1.186 4.051 901 HE2 MET 111 HE2 MET 111 -4.245 -0.345 3.542 902 HE3 MET 111 HE3 MET 111 -3.208 0.960 4.135 903 H MET 112 HN MET 112 -9.155 2.658 1.333 904 HA MET 112 HA MET 112 -8.428 4.087 -1.168 905 HB2 MET 112 HB2 MET 112 -10.918 3.374 -0.649 906 HB3 MET 112 HB1 MET 112 -10.885 4.770 0.425 907 HG2 MET 112 HG2 MET 112 -11.643 5.671 -1.614 908 HG3 MET 112 HG1 MET 112 -9.923 6.054 -1.614 909 HE1 MET 112 HE1 MET 112 -12.132 4.177 -4.873 910 HE2 MET 112 HE2 MET 112 -12.824 4.468 -3.278 911 HE3 MET 112 HE3 MET 112 -12.051 5.789 -4.164 912 H ARG 113 HN ARG 113 -7.851 6.286 -0.998 913 HA ARG 113 HA ARG 113 -7.668 7.405 1.731 914 HB2 ARG 113 HB2 ARG 113 -5.299 7.712 -0.074 915 HB3 ARG 113 HB1 ARG 113 -5.378 7.727 1.687 916 HG2 ARG 113 HG2 ARG 113 -5.937 5.277 1.616 917 HG3 ARG 113 HG1 ARG 113 -5.651 5.312 -0.123 918 HD2 ARG 113 HD2 ARG 113 -3.571 4.632 0.693 919 HD3 ARG 113 HD1 ARG 113 -3.348 6.372 0.538 920 HE ARG 113 HE ARG 113 -4.202 6.181 3.077 921 HH11 ARG 113 HH21 ARG 113 -1.877 4.370 1.260 922 HH12 ARG 113 HH22 ARG 113 -0.896 3.989 2.635 923 HH21 ARG 113 HH11 ARG 113 -2.921 5.683 4.882 924 HH22 ARG 113 HH12 ARG 113 -1.488 4.729 4.686 925 H LEU 114 HN LEU 114 -7.482 9.682 1.834 926 HA LEU 114 HA LEU 114 -8.262 11.073 -0.678 927 HB2 LEU 114 HB2 LEU 114 -10.050 11.030 1.042 928 HB3 LEU 114 HB1 LEU 114 -8.947 11.816 2.166 929 HG LEU 114 HG LEU 114 -8.759 13.754 0.645 930 HD11 LEU 114 HD11 LEU 114 -10.511 12.007 -1.050 931 HD12 LEU 114 HD12 LEU 114 -10.710 13.755 -1.148 932 HD13 LEU 114 HD13 LEU 114 -9.154 13.022 -1.530 933 HD21 LEU 114 HD21 LEU 114 -10.424 13.838 2.404 934 HD22 LEU 114 HD22 LEU 114 -11.122 14.547 0.949 935 HD23 LEU 114 HD23 LEU 114 -11.560 12.908 1.428 936 H TYR 115 HN TYR 115 -6.893 12.558 -1.402 937 HA TYR 115 HA TYR 115 -4.777 13.521 0.403 938 HB2 TYR 115 HB2 TYR 115 -4.943 13.490 -2.611 939 HB3 TYR 115 HB1 TYR 115 -3.592 14.144 -1.685 940 HD1 TYR 115 HD1 TYR 115 -5.592 11.041 -2.239 941 HD2 TYR 115 HD2 TYR 115 -1.893 12.725 -0.857 942 HE1 TYR 115 HE1 TYR 115 -4.643 8.765 -2.017 943 HE2 TYR 115 HE2 TYR 115 -0.944 10.450 -0.633 944 HH TYR 115 HH TYR 115 -2.841 7.567 -1.543 945 H SER 116 HN SER 116 -4.084 15.748 0.227 946 HA SER 116 HA SER 116 -6.097 17.647 -0.785 947 HB2 SER 116 HB2 SER 116 -6.660 17.382 1.570 948 HB3 SER 116 HB1 SER 116 -4.974 17.611 2.034 949 HG SER 116 HG SER 116 -5.344 19.686 0.708 950 H ARG 117 HN ARG 117 -5.224 19.665 -1.381 951 HA ARG 117 HA ARG 117 -2.382 19.640 -1.922 952 HB2 ARG 117 HB2 ARG 117 -4.142 20.514 -3.506 953 HB3 ARG 117 HB1 ARG 117 -4.376 21.862 -2.407 954 HG2 ARG 117 HG2 ARG 117 -2.819 22.729 -3.937 955 HG3 ARG 117 HG1 ARG 117 -1.791 22.187 -2.621 956 HD2 ARG 117 HD2 ARG 117 -1.169 20.198 -3.795 957 HD3 ARG 117 HD1 ARG 117 -2.428 20.436 -5.003 958 HE ARG 117 HE ARG 117 -0.955 21.808 -6.133 959 HH11 ARG 117 HH21 ARG 117 -0.092 21.610 -2.787 960 HH12 ARG 117 HH22 ARG 117 1.332 22.580 -2.955 961 HH21 ARG 117 HH11 ARG 117 0.911 23.081 -6.359 962 HH22 ARG 117 HH12 ARG 117 1.901 23.413 -4.978 963 H SER 118 HN SER 118 -4.505 20.897 0.474 964 HA SER 118 HA SER 118 -2.281 22.460 1.651 965 HB2 SER 118 HB2 SER 118 -4.039 23.949 0.798 966 HB3 SER 118 HB1 SER 118 -5.243 23.082 1.745 967 HG SER 118 HG SER 118 -4.187 23.745 3.613 968 HA PRO 119 HA PRO 119 -2.356 19.877 5.248 969 HB2 PRO 119 HB2 PRO 119 -2.850 22.470 6.686 970 HB3 PRO 119 HB1 PRO 119 -1.704 21.171 7.075 971 HG2 PRO 119 HG2 PRO 119 -0.943 23.441 5.846 972 HG3 PRO 119 HG1 PRO 119 -0.166 21.881 5.535 973 HD2 PRO 119 HD2 PRO 119 -1.893 23.473 3.754 974 HD3 PRO 119 HD1 PRO 119 -0.808 22.126 3.353 975 H GLU 120 HN GLU 120 -4.890 22.172 4.557 976 HA GLU 120 HA GLU 120 -6.760 20.925 6.434 977 HB2 GLU 120 HB2 GLU 120 -7.304 23.164 4.485 978 HB3 GLU 120 HB1 GLU 120 -8.228 22.736 5.926 979 HG2 GLU 120 HG2 GLU 120 -6.232 23.278 7.322 980 HG3 GLU 120 HG1 GLU 120 -5.394 23.812 5.865 981 H VAL 121 HN VAL 121 -9.040 20.652 5.480 982 HA VAL 121 HA VAL 121 -8.848 19.167 2.919 983 HB VAL 121 HB VAL 121 -10.829 18.613 5.130 984 HG11 VAL 121 HG11 VAL 121 -11.105 16.505 3.961 985 HG12 VAL 121 HG12 VAL 121 -11.282 17.813 2.790 986 HG13 VAL 121 HG13 VAL 121 -9.779 16.891 2.865 987 HG21 VAL 121 HG21 VAL 121 -9.282 16.661 5.642 988 HG22 VAL 121 HG22 VAL 121 -8.061 17.471 4.661 989 HG23 VAL 121 HG23 VAL 121 -8.670 18.242 6.125 990 H SER 122 HN SER 122 -10.111 19.871 1.317 991 HA SER 122 HA SER 122 -11.874 22.110 1.760 992 HB2 SER 122 HB2 SER 122 -10.843 20.632 -0.619 993 HB3 SER 122 HB1 SER 122 -12.281 21.627 -0.808 994 HG SER 122 HG SER 122 -11.022 23.294 -0.774 995 HA PRO 123 HA PRO 123 -15.612 19.812 2.672 996 HB2 PRO 123 HB2 PRO 123 -16.775 21.841 0.783 997 HB3 PRO 123 HB1 PRO 123 -17.380 21.298 2.361 998 HG2 PRO 123 HG2 PRO 123 -16.084 23.619 2.077 999 HG3 PRO 123 HG1 PRO 123 -15.914 22.623 3.532 1000 HD2 PRO 123 HD2 PRO 123 -13.938 23.122 1.377 1001 HD3 PRO 123 HD1 PRO 123 -13.674 22.578 3.050 1002 H ALA 124 HN ALA 124 -14.837 20.775 -0.650 1003 HA ALA 124 HA ALA 124 -16.521 18.804 -1.883 1004 HB1 ALA 124 HB1 ALA 124 -14.157 20.181 -3.159 1005 HB2 ALA 124 HB2 ALA 124 -15.710 20.988 -2.927 1006 HB3 ALA 124 HB3 ALA 124 -15.605 19.550 -3.944 1007 H ALA 125 HN ALA 125 -13.189 18.947 -0.809 1008 HA ALA 125 HA ALA 125 -12.253 16.650 -2.200 1009 HB1 ALA 125 HB1 ALA 125 -11.243 17.796 0.413 1010 HB2 ALA 125 HB2 ALA 125 -10.766 18.371 -1.184 1011 HB3 ALA 125 HB3 ALA 125 -10.360 16.731 -0.679 1012 H THR 126 HN THR 126 -13.569 17.141 1.052 1013 HA THR 126 HA THR 126 -13.298 14.386 1.801 1014 HB THR 126 HB THR 126 -15.277 16.153 3.184 1015 HG1 THR 126 HG1 THR 126 -12.994 17.099 2.489 1016 HG21 THR 126 HG21 THR 126 -13.010 14.493 4.319 1017 HG22 THR 126 HG22 THR 126 -14.478 15.027 5.135 1018 HG23 THR 126 HG23 THR 126 -14.565 13.780 3.891 1019 H ALA 127 HN ALA 127 -15.842 16.325 0.304 1020 HA ALA 127 HA ALA 127 -17.909 14.395 0.672 1021 HB1 ALA 127 HB1 ALA 127 -18.329 16.787 0.392 1022 HB2 ALA 127 HB2 ALA 127 -19.168 15.832 -0.832 1023 HB3 ALA 127 HB3 ALA 127 -17.692 16.702 -1.250 1024 H ILE 128 HN ILE 128 -15.921 15.299 -2.199 1025 HA ILE 128 HA ILE 128 -17.173 13.510 -3.976 1026 HB ILE 128 HB ILE 128 -15.349 15.418 -4.313 1027 HG12 ILE 128 HG12 ILE 128 -16.515 14.375 -6.147 1028 HG13 ILE 128 HG11 ILE 128 -14.794 14.395 -6.511 1029 HG21 ILE 128 HG21 ILE 128 -13.602 12.944 -4.380 1030 HG22 ILE 128 HG22 ILE 128 -13.113 14.609 -4.679 1031 HG23 ILE 128 HG23 ILE 128 -13.589 14.111 -3.057 1032 HD11 ILE 128 HD11 ILE 128 -14.765 12.013 -5.455 1033 HD12 ILE 128 HD12 ILE 128 -16.512 12.062 -5.691 1034 HD13 ILE 128 HD13 ILE 128 -15.430 12.198 -7.077 1035 H PHE 129 HN PHE 129 -14.633 13.271 -1.692 1036 HA PHE 129 HA PHE 129 -13.626 10.714 -2.141 1037 HB2 PHE 129 HB2 PHE 129 -12.737 12.426 -0.539 1038 HB3 PHE 129 HB1 PHE 129 -14.059 12.024 0.546 1039 HD1 PHE 129 HD1 PHE 129 -11.623 10.044 -1.556 1040 HD2 PHE 129 HD2 PHE 129 -13.413 10.645 2.305 1041 HE1 PHE 129 HE1 PHE 129 -10.329 8.137 -0.657 1042 HE2 PHE 129 HE2 PHE 129 -12.108 8.743 3.199 1043 HZ PHE 129 HZ PHE 129 -10.568 7.485 1.722 1044 H ARG 130 HN ARG 130 -16.404 11.753 -0.201 1045 HA ARG 130 HA ARG 130 -17.076 9.147 0.740 1046 HB2 ARG 130 HB2 ARG 130 -18.575 11.759 0.605 1047 HB3 ARG 130 HB1 ARG 130 -19.323 10.286 1.222 1048 HG2 ARG 130 HG2 ARG 130 -17.480 10.060 2.869 1049 HG3 ARG 130 HG1 ARG 130 -16.787 11.571 2.279 1050 HD2 ARG 130 HD2 ARG 130 -18.095 12.091 4.238 1051 HD3 ARG 130 HD1 ARG 130 -18.968 12.700 2.834 1052 HE ARG 130 HE ARG 130 -20.021 10.217 3.170 1053 HH11 ARG 130 HH21 ARG 130 -19.431 12.897 5.278 1054 HH12 ARG 130 HH22 ARG 130 -20.773 12.552 6.318 1055 HH21 ARG 130 HH11 ARG 130 -21.783 9.759 4.528 1056 HH22 ARG 130 HH12 ARG 130 -22.104 10.776 5.893 1057 H LYS 131 HN LYS 131 -18.200 11.122 -2.005 1058 HA LYS 131 HA LYS 131 -20.357 9.625 -2.846 1059 HB2 LYS 131 HB2 LYS 131 -18.255 11.040 -4.497 1060 HB3 LYS 131 HB1 LYS 131 -19.763 10.406 -5.158 1061 HG2 LYS 131 HG2 LYS 131 -21.024 11.806 -3.516 1062 HG3 LYS 131 HG1 LYS 131 -19.494 12.506 -2.987 1063 HD2 LYS 131 HD2 LYS 131 -19.075 13.244 -5.344 1064 HD3 LYS 131 HD1 LYS 131 -20.685 12.664 -5.769 1065 HE2 LYS 131 HE2 LYS 131 -21.691 14.204 -4.140 1066 HE3 LYS 131 HE1 LYS 131 -20.087 14.768 -3.668 1067 HZ1 LYS 131 HZ1 LYS 131 -21.346 15.034 -6.344 1068 HZ2 LYS 131 HZ2 LYS 131 -21.028 16.288 -5.243 1069 HZ3 LYS 131 HZ3 LYS 131 -19.743 15.468 -5.988 1070 H LEU 132 HN LEU 132 -17.004 9.217 -4.041 1071 HA LEU 132 HA LEU 132 -17.516 6.834 -5.457 1072 HB2 LEU 132 HB2 LEU 132 -14.877 7.519 -4.157 1073 HB3 LEU 132 HB1 LEU 132 -15.155 6.598 -5.634 1074 HG LEU 132 HG LEU 132 -15.631 9.561 -5.218 1075 HD11 LEU 132 HD11 LEU 132 -13.284 8.639 -5.682 1076 HD12 LEU 132 HD12 LEU 132 -13.898 8.166 -7.265 1077 HD13 LEU 132 HD13 LEU 132 -13.876 9.866 -6.801 1078 HD21 LEU 132 HD21 LEU 132 -16.200 9.408 -7.738 1079 HD22 LEU 132 HD22 LEU 132 -16.438 7.684 -7.448 1080 HD23 LEU 132 HD23 LEU 132 -17.433 8.868 -6.600 1081 H ALA 133 HN ALA 133 -16.237 7.382 -2.183 1082 HA ALA 133 HA ALA 133 -15.839 4.733 -1.442 1083 HB1 ALA 133 HB1 ALA 133 -15.343 6.937 -0.152 1084 HB2 ALA 133 HB2 ALA 133 -15.728 5.481 0.757 1085 HB3 ALA 133 HB3 ALA 133 -16.962 6.719 0.510 1086 H GLY 134 HN GLY 134 -18.827 6.616 -1.678 1087 HA2 GLY 134 HA2 GLY 134 -20.506 4.822 -0.264 1088 HA3 GLY 134 HA1 GLY 134 -21.023 6.021 -1.443 1089 H GLU 135 HN GLU 135 -19.503 5.134 -3.625 1090 HA GLU 135 HA GLU 135 -21.194 3.140 -4.703 1091 HB2 GLU 135 HB2 GLU 135 -18.467 4.055 -5.660 1092 HB3 GLU 135 HB1 GLU 135 -19.645 3.148 -6.609 1093 HG2 GLU 135 HG2 GLU 135 -21.273 5.011 -6.305 1094 HG3 GLU 135 HG1 GLU 135 -20.026 5.926 -5.460 1095 H ARG 136 HN ARG 136 -18.482 2.982 -2.627 1096 HA ARG 136 HA ARG 136 -17.927 0.174 -3.344 1097 HB2 ARG 136 HB2 ARG 136 -16.097 2.013 -3.064 1098 HB3 ARG 136 HB1 ARG 136 -16.369 1.790 -1.337 1099 HG2 ARG 136 HG2 ARG 136 -15.881 -0.611 -1.554 1100 HG3 ARG 136 HG1 ARG 136 -15.656 -0.418 -3.292 1101 HD2 ARG 136 HD2 ARG 136 -13.704 0.897 -3.005 1102 HD3 ARG 136 HD1 ARG 136 -14.051 1.184 -1.301 1103 HE ARG 136 HE ARG 136 -13.621 -1.603 -2.027 1104 HH11 ARG 136 HH21 ARG 136 -12.292 1.391 -0.912 1105 HH12 ARG 136 HH22 ARG 136 -10.918 0.658 -0.153 1106 HH21 ARG 136 HH11 ARG 136 -11.825 -2.572 -1.033 1107 HH22 ARG 136 HH12 ARG 136 -10.654 -1.586 -0.222 1108 H ASN 137 HN ASN 137 -20.197 1.521 -1.641 1109 HA ASN 137 HA ASN 137 -21.435 0.982 0.233 1110 HB2 ASN 137 HB2 ASN 137 -19.881 -1.571 0.007 1111 HB3 ASN 137 HB1 ASN 137 -21.407 -1.368 0.861 1112 HD21 ASN 137 HD21 ASN 137 -22.760 0.273 -1.077 1113 HD22 ASN 137 HD22 ASN 137 -23.025 -0.662 -2.468 1114 H TYR 138 HN TYR 138 -18.971 2.338 0.684 1115 HA TYR 138 HA TYR 138 -17.531 1.198 2.868 1116 HB2 TYR 138 HB2 TYR 138 -16.291 3.178 2.884 1117 HB3 TYR 138 HB1 TYR 138 -16.819 3.069 1.208 1118 HD1 TYR 138 HD1 TYR 138 -19.724 3.878 1.587 1119 HD2 TYR 138 HD2 TYR 138 -16.091 5.529 3.150 1120 HE1 TYR 138 HE1 TYR 138 -20.826 6.083 1.804 1121 HE2 TYR 138 HE2 TYR 138 -17.193 7.741 3.375 1122 HH TYR 138 HH TYR 138 -20.380 8.208 3.397 1123 H THR 139 HN THR 139 -17.519 1.840 5.060 1124 HA THR 139 HA THR 139 -20.007 3.142 6.025 1125 HB THR 139 HB THR 139 -20.262 1.560 7.702 1126 HG1 THR 139 HG1 THR 139 -18.593 1.011 8.820 1127 HG21 THR 139 HG21 THR 139 -18.745 -0.147 5.723 1128 HG22 THR 139 HG22 THR 139 -20.133 -0.600 6.713 1129 HG23 THR 139 HG23 THR 139 -20.339 0.517 5.363 1130 H ASP 140 HN ASP 140 -19.758 4.465 7.922 1131 HA ASP 140 HA ASP 140 -17.655 6.170 7.981 1132 HB2 ASP 140 HB2 ASP 140 -19.283 5.209 10.339 1133 HB3 ASP 140 HB1 ASP 140 -18.195 6.595 10.401 1134 H GLU 141 HN GLU 141 -17.846 3.319 10.196 1135 HA GLU 141 HA GLU 141 -15.302 3.653 11.291 1136 HB2 GLU 141 HB2 GLU 141 -16.925 1.135 10.886 1137 HB3 GLU 141 HB1 GLU 141 -15.492 1.249 11.908 1138 HG2 GLU 141 HG2 GLU 141 -16.604 3.050 13.218 1139 HG3 GLU 141 HG1 GLU 141 -18.052 2.839 12.234 1140 H MET 142 HN MET 142 -16.221 2.389 8.191 1141 HA MET 142 HA MET 142 -13.775 0.924 7.747 1142 HB2 MET 142 HB2 MET 142 -15.703 0.152 6.577 1143 HB3 MET 142 HB1 MET 142 -16.052 1.754 5.954 1144 HG2 MET 142 HG2 MET 142 -14.432 1.640 4.320 1145 HG3 MET 142 HG1 MET 142 -13.383 0.607 5.282 1146 HE1 MET 142 HE1 MET 142 -13.963 -1.493 6.095 1147 HE2 MET 142 HE2 MET 142 -15.617 -2.087 5.959 1148 HE3 MET 142 HE3 MET 142 -14.336 -2.793 4.967 1149 H VAL 143 HN VAL 143 -14.839 4.166 7.409 1150 HA VAL 143 HA VAL 143 -12.307 4.885 6.035 1151 HB VAL 143 HB VAL 143 -14.390 5.053 4.611 1152 HG11 VAL 143 HG11 VAL 143 -15.024 7.465 6.315 1153 HG12 VAL 143 HG12 VAL 143 -16.032 6.698 5.093 1154 HG13 VAL 143 HG13 VAL 143 -15.756 5.892 6.634 1155 HG21 VAL 143 HG21 VAL 143 -12.973 7.666 5.208 1156 HG22 VAL 143 HG22 VAL 143 -12.310 6.375 4.207 1157 HG23 VAL 143 HG23 VAL 143 -13.769 7.224 3.698 1158 H ALA 144 HN ALA 144 -11.063 6.274 7.164 1159 HA ALA 144 HA ALA 144 -12.391 7.961 9.229 1160 HB1 ALA 144 HB1 ALA 144 -10.704 7.500 10.785 1161 HB2 ALA 144 HB2 ALA 144 -9.619 6.846 9.557 1162 HB3 ALA 144 HB3 ALA 144 -11.045 5.933 10.051 1163 H MET 145 HN MET 145 -12.127 10.053 8.968 1164 HA MET 145 HA MET 145 -10.114 11.139 7.183 1165 HB2 MET 145 HB2 MET 145 -11.839 12.939 8.822 1166 HB3 MET 145 HB1 MET 145 -11.432 13.023 7.110 1167 HG2 MET 145 HG2 MET 145 -12.952 10.670 7.303 1168 HG3 MET 145 HG1 MET 145 -13.759 11.786 8.401 1169 HE1 MET 145 HE1 MET 145 -12.862 12.200 3.969 1170 HE2 MET 145 HE2 MET 145 -11.967 11.345 5.221 1171 HE3 MET 145 HE3 MET 145 -13.512 10.707 4.641 1172 H LEU 146 HN LEU 146 -8.551 12.754 7.870 1173 HA LEU 146 HA LEU 146 -7.875 12.580 10.754 1174 HB2 LEU 146 HB2 LEU 146 -5.927 12.869 8.469 1175 HB3 LEU 146 HB1 LEU 146 -5.529 12.694 10.165 1176 HG LEU 146 HG LEU 146 -7.242 10.584 8.888 1177 HD11 LEU 146 HD11 LEU 146 -4.293 10.125 8.848 1178 HD12 LEU 146 HD12 LEU 146 -5.547 9.494 7.787 1179 HD13 LEU 146 HD13 LEU 146 -4.952 11.133 7.570 1180 HD21 LEU 146 HD21 LEU 146 -5.065 10.469 10.989 1181 HD22 LEU 146 HD22 LEU 146 -6.787 10.615 11.336 1182 HD23 LEU 146 HD23 LEU 146 -6.164 9.164 10.551 1183 HA PRO 147 HA PRO 147 -8.146 17.050 10.507 1184 HB2 PRO 147 HB2 PRO 147 -7.313 17.700 12.986 1185 HB3 PRO 147 HB1 PRO 147 -8.848 16.846 12.720 1186 HG2 PRO 147 HG2 PRO 147 -6.197 15.743 13.551 1187 HG3 PRO 147 HG1 PRO 147 -7.811 15.390 14.193 1188 HD2 PRO 147 HD2 PRO 147 -6.532 13.772 12.365 1189 HD3 PRO 147 HD1 PRO 147 -8.301 13.887 12.509 1190 H ARG 148 HN ARG 148 -6.744 19.023 10.935 1191 HA ARG 148 HA ARG 148 -4.308 18.865 9.545 1192 HB2 ARG 148 HB2 ARG 148 -3.970 21.200 10.329 1193 HB3 ARG 148 HB1 ARG 148 -5.567 20.926 9.632 1194 HG2 ARG 148 HG2 ARG 148 -6.418 20.524 11.983 1195 HG3 ARG 148 HG1 ARG 148 -4.849 21.077 12.571 1196 HD2 ARG 148 HD2 ARG 148 -5.169 23.226 11.398 1197 HD3 ARG 148 HD1 ARG 148 -6.738 22.676 10.818 1198 HE ARG 148 HE ARG 148 -6.619 22.484 13.653 1199 HH11 ARG 148 HH21 ARG 148 -6.831 24.739 11.038 1200 HH12 ARG 148 HH22 ARG 148 -7.688 25.933 11.954 1201 HH21 ARG 148 HH11 ARG 148 -7.744 24.044 14.862 1202 HH22 ARG 148 HH12 ARG 148 -8.205 25.539 14.119 1203 H GLN 149 HN GLN 149 -4.986 18.122 12.809 1204 HA GLN 149 HA GLN 149 -2.778 18.897 14.240 1205 HB2 GLN 149 HB2 GLN 149 -4.025 16.139 14.335 1206 HB3 GLN 149 HB1 GLN 149 -3.080 16.906 15.611 1207 HG2 GLN 149 HG2 GLN 149 -5.590 18.171 14.504 1208 HG3 GLN 149 HG1 GLN 149 -5.631 17.031 15.846 1209 HE21 GLN 149 HE21 GLN 149 -5.278 17.902 17.903 1210 HE22 GLN 149 HE22 GLN 149 -4.632 19.444 18.196 1211 H GLU 150 HN GLU 150 -0.647 18.624 14.039 1212 HA GLU 150 HA GLU 150 0.379 16.246 12.598 1213 HB2 GLU 150 HB2 GLU 150 2.016 17.653 11.453 1214 HB3 GLU 150 HB1 GLU 150 0.378 18.177 11.061 1215 HG2 GLU 150 HG2 GLU 150 0.572 19.890 12.902 1216 HG3 GLU 150 HG1 GLU 150 2.272 19.447 13.054 1217 H GLU 151 HN GLU 151 2.315 15.431 13.327 1218 HA GLU 151 HA GLU 151 3.451 16.692 15.762 1219 HB2 GLU 151 HB2 GLU 151 3.471 13.747 15.037 1220 HB3 GLU 151 HB1 GLU 151 4.035 14.473 16.541 1221 HG2 GLU 151 HG2 GLU 151 1.179 14.620 15.538 1222 HG3 GLU 151 HG1 GLU 151 1.754 13.464 16.738 1223 H CYS 152 HN CYS 152 4.554 14.048 13.673 1224 HA CYS 152 HA CYS 152 7.108 15.400 13.315 1225 HB2 CYS 152 HB2 CYS 152 6.161 12.672 13.416 1226 HB3 CYS 152 HB1 CYS 152 7.045 12.933 11.922 1227 H THR 153 HN THR 153 8.054 15.397 11.148 1228 HA THR 153 HA THR 153 6.267 15.336 8.861 1229 HB THR 153 HB THR 153 6.794 17.716 8.240 1230 HG1 THR 153 HG1 THR 153 7.366 19.007 10.139 1231 HG21 THR 153 HG21 THR 153 5.336 17.563 10.886 1232 HG22 THR 153 HG22 THR 153 5.002 18.622 9.517 1233 HG23 THR 153 HG23 THR 153 4.648 16.899 9.403 1234 H VAL 154 HN VAL 154 7.468 15.805 6.809 1235 HA VAL 154 HA VAL 154 9.954 14.445 6.779 1236 HB VAL 154 HB VAL 154 9.955 15.102 4.385 1237 HG11 VAL 154 HG11 VAL 154 7.777 13.959 3.807 1238 HG12 VAL 154 HG12 VAL 154 8.790 13.077 4.949 1239 HG13 VAL 154 HG13 VAL 154 7.392 13.982 5.527 1240 HG21 VAL 154 HG21 VAL 154 8.966 17.303 4.542 1241 HG22 VAL 154 HG22 VAL 154 7.913 16.300 3.545 1242 HG23 VAL 154 HG23 VAL 154 7.484 16.632 5.222 1243 H ASP 155 HN ASP 155 11.975 15.241 6.634 1244 HA ASP 155 HA ASP 155 12.500 17.853 7.612 1245 HB2 ASP 155 HB2 ASP 155 14.809 16.816 6.238 1246 HB3 ASP 155 HB1 ASP 155 14.537 16.960 7.970 1247 H GLU 156 HN GLU 156 12.874 19.725 6.597 1248 HA GLU 156 HA GLU 156 12.074 20.093 3.917 1249 HB2 GLU 156 HB2 GLU 156 13.653 21.920 5.741 1250 HB3 GLU 156 HB1 GLU 156 12.821 22.396 4.269 1251 HG2 GLU 156 HG2 GLU 156 11.466 21.143 6.666 1252 HG3 GLU 156 HG1 GLU 156 11.483 22.871 6.319 1253 H VAL 157 HN VAL 157 15.221 19.759 5.477 1254 HA VAL 157 HA VAL 157 16.773 20.475 3.192 1255 HB VAL 157 HB VAL 157 17.669 18.679 5.446 1256 HG11 VAL 157 HG11 VAL 157 19.166 19.056 3.466 1257 HG12 VAL 157 HG12 VAL 157 19.126 20.783 3.819 1258 HG13 VAL 157 HG13 VAL 157 19.841 19.662 4.979 1259 HG21 VAL 157 HG21 VAL 157 16.585 20.572 6.496 1260 HG22 VAL 157 HG22 VAL 157 18.326 20.839 6.577 1261 HG23 VAL 157 HG23 VAL 157 17.357 21.695 5.377 1262 HN1 EB4 200 H17 EB4 200 0.747 -0.842 5.634 1263 H8 EB4 200 H8 EB4 200 4.913 1.910 0.904 1264 HN2 EB4 200 H25 EB4 200 3.789 0.284 6.192 1265 H9 EB4 200 H9 EB4 200 0.337 6.247 3.507 1266 H10 EB4 200 H10 EB4 200 -2.407 -0.847 0.619 1267 HN3 EB4 200 H32 EB4 200 1.041 1.921 7.313 1268 H7 EB4 200 H7 EB4 200 -1.093 1.254 0.565 1269 H11 EB4 200 H11 EB4 200 6.973 0.609 1.367 1270 H12 EB4 200 H12 EB4 200 -0.673 7.295 5.515 1271 H15 EB4 200 H15 EB4 200 -0.620 6.112 7.692 1272 H14 EB4 200 H14 EB4 200 7.340 -0.376 3.613 1273 H13 EB4 200 H13 EB4 200 -2.189 -2.395 2.545 1274 H22 EB4 200 H22 EB4 200 -0.197 -3.369 6.834 1275 H30 EB4 200 H30 EB4 200 0.046 -0.270 10.117 1276 H30A EB4 200 H9N EB4 200 -1.091 0.741 9.097 1277 H24 EB4 200 H24 EB4 200 0.549 2.160 10.228 1278 H28 EB4 200 H28 EB4 200 2.039 -3.624 7.801 1279 H28A EB4 200 H9L EB4 200 2.036 -3.678 6.031 1280 H23 EB4 200 H23 EB4 200 5.653 -1.112 8.055 1281 H29 EB4 200 H29 EB4 200 4.428 0.011 9.876 1282 H29A EB4 200 H9M EB4 200 5.172 1.222 8.722 1283 H21 ACD 300 HA3 ACD 300 0.520 10.421 -11.944 1284 H22 ACD 300 HA4 ACD 300 0.757 11.504 -10.554 1285 H31 ACD 300 HA1 ACD 300 0.478 8.470 -10.415 1286 H32 ACD 300 HA2 ACD 300 1.994 9.382 -10.245 1287 H41 ACD 300 HA0 ACD 300 -0.449 9.629 -8.429 1288 H42 ACD 300 HAZ ACD 300 1.054 10.569 -8.278 1289 H5 ACD 300 HAY ACD 300 2.213 8.057 -8.100 1290 H6 ACD 300 HAX ACD 300 1.046 7.171 -5.936 1291 H71 ACD 300 HAV ACD 300 -1.024 9.400 -6.700 1292 H72 ACD 300 HAW ACD 300 -1.527 7.801 -6.111 1293 H8 ACD 300 HAU ACD 300 -0.535 10.129 -4.417 1294 H9 ACD 300 HAT ACD 300 -0.584 8.456 -2.418 1295 H101 ACD 300 HAR ACD 300 -1.331 6.413 -4.631 1296 H102 ACD 300 HAS ACD 300 0.157 6.112 -3.703 1297 H11 ACD 300 HAQ ACD 300 -2.728 5.848 -2.653 1298 H12 ACD 300 HAP ACD 300 -1.542 5.109 -0.432 1299 H131 ACD 300 HAN ACD 300 0.948 6.584 -1.628 1300 H132 ACD 300 HAO ACD 300 1.051 4.777 -1.335 1301 H14 ACD 300 HAM ACD 300 0.945 5.128 1.062 1302 H15 ACD 300 HAL ACD 300 1.161 7.564 1.979 1303 H161 ACD 300 HAJ ACD 300 -0.136 8.510 -0.559 1304 H162 ACD 300 HAK ACD 300 0.800 9.517 0.567 1305 H171 ACD 300 HAH ACD 300 2.890 8.851 -0.486 1306 H172 ACD 300 HAI ACD 300 2.053 7.682 -1.528 1307 H181 ACD 300 HAF ACD 300 0.662 9.706 -2.372 1308 H182 ACD 300 HAG ACD 300 1.897 10.717 -1.590 1309 H191 ACD 300 HAD ACD 300 3.656 9.762 -2.935 1310 H192 ACD 300 HAE ACD 300 2.566 8.514 -3.580 1311 H201 ACD 300 HAA ACD 300 2.884 10.299 -5.234 1312 H202 ACD 300 HAB ACD 300 2.345 11.523 -4.063 1313 H203 ACD 300 HAC ACD 300 1.200 10.305 -4.671 Start of MODEL 13 1 H1 MET 1 HT1 MET 1 10.480 16.783 -18.859 2 H2 MET 1 HT2 MET 1 8.864 17.226 -19.133 3 H3 MET 1 HT3 MET 1 9.575 17.492 -17.613 4 HA MET 1 HA MET 1 10.454 19.425 -18.221 5 HB2 MET 1 HB2 MET 1 11.191 17.976 -20.779 6 HB3 MET 1 HB1 MET 1 11.642 19.646 -20.438 7 HG2 MET 1 HG2 MET 1 12.767 18.868 -18.345 8 HG3 MET 1 HG1 MET 1 12.407 17.205 -18.809 9 HE1 MET 1 HE1 MET 1 16.200 17.402 -19.416 10 HE2 MET 1 HE2 MET 1 15.376 18.401 -18.222 11 HE3 MET 1 HE3 MET 1 14.866 16.727 -18.484 12 H THR 2 HN THR 2 7.946 17.851 -19.754 13 HA THR 2 HA THR 2 7.168 19.988 -21.558 14 HB THR 2 HB THR 2 5.173 18.601 -21.954 15 HG1 THR 2 HG1 THR 2 5.860 17.640 -19.565 16 HG21 THR 2 HG21 THR 2 7.281 18.108 -23.157 17 HG22 THR 2 HG22 THR 2 7.738 16.987 -21.874 18 HG23 THR 2 HG23 THR 2 6.332 16.647 -22.883 19 H VAL 3 HN VAL 3 7.522 20.846 -18.882 20 HA VAL 3 HA VAL 3 6.414 21.746 -17.043 21 HB VAL 3 HB VAL 3 6.473 23.569 -18.596 22 HG11 VAL 3 HG11 VAL 3 4.029 22.270 -19.823 23 HG12 VAL 3 HG12 VAL 3 4.537 23.916 -20.188 24 HG13 VAL 3 HG13 VAL 3 5.591 22.563 -20.587 25 HG21 VAL 3 HG21 VAL 3 4.679 23.422 -16.539 26 HG22 VAL 3 HG22 VAL 3 4.926 24.871 -17.510 27 HG23 VAL 3 HG23 VAL 3 3.589 23.784 -17.878 28 HA PRO 4 HA PRO 4 2.645 18.982 -17.335 29 HB2 PRO 4 HB2 PRO 4 3.396 17.109 -15.504 30 HB3 PRO 4 HB1 PRO 4 3.857 17.011 -17.214 31 HG2 PRO 4 HG2 PRO 4 5.458 17.943 -14.876 32 HG3 PRO 4 HG1 PRO 4 5.953 16.950 -16.258 33 HD2 PRO 4 HD2 PRO 4 6.482 19.646 -16.067 34 HD3 PRO 4 HD1 PRO 4 6.320 18.789 -17.616 35 H ASP 5 HN ASP 5 0.924 19.067 -15.893 36 HA ASP 5 HA ASP 5 1.029 21.020 -13.830 37 HB2 ASP 5 HB2 ASP 5 -1.292 20.373 -13.384 38 HB3 ASP 5 HB1 ASP 5 -1.018 20.546 -15.117 39 H ARG 6 HN ARG 6 1.856 17.726 -13.901 40 HA ARG 6 HA ARG 6 1.145 16.861 -11.329 41 HB2 ARG 6 HB2 ARG 6 3.666 16.087 -12.806 42 HB3 ARG 6 HB1 ARG 6 2.782 15.133 -11.615 43 HG2 ARG 6 HG2 ARG 6 0.845 15.013 -13.129 44 HG3 ARG 6 HG1 ARG 6 1.712 15.982 -14.322 45 HD2 ARG 6 HD2 ARG 6 3.511 14.214 -14.325 46 HD3 ARG 6 HD1 ARG 6 2.457 13.223 -13.320 47 HE ARG 6 HE ARG 6 2.111 13.813 -16.154 48 HH11 ARG 6 HH21 ARG 6 0.735 12.683 -13.186 49 HH12 ARG 6 HH22 ARG 6 -0.532 11.787 -13.954 50 HH21 ARG 6 HH11 ARG 6 0.450 12.641 -17.168 51 HH22 ARG 6 HH12 ARG 6 -0.694 11.763 -16.208 52 H SER 7 HN SER 7 3.744 18.898 -12.455 53 HA SER 7 HA SER 7 5.509 18.807 -10.308 54 HB2 SER 7 HB2 SER 7 6.264 20.995 -11.021 55 HB3 SER 7 HB1 SER 7 5.886 20.034 -12.449 56 HG SER 7 HG SER 7 4.244 21.305 -12.871 57 H GLU 8 HN GLU 8 2.393 20.362 -10.594 58 HA GLU 8 HA GLU 8 2.549 22.189 -8.481 59 HB2 GLU 8 HB2 GLU 8 0.185 20.632 -9.544 60 HB3 GLU 8 HB1 GLU 8 0.058 21.976 -8.410 61 HG2 GLU 8 HG2 GLU 8 1.254 23.424 -10.055 62 HG3 GLU 8 HG1 GLU 8 1.238 22.084 -11.199 63 H ILE 9 HN ILE 9 1.388 18.795 -8.425 64 HA ILE 9 HA ILE 9 1.208 18.898 -5.513 65 HB ILE 9 HB ILE 9 -0.498 17.683 -6.917 66 HG12 ILE 9 HG12 ILE 9 1.081 16.079 -4.875 67 HG13 ILE 9 HG11 ILE 9 -0.211 17.220 -4.514 68 HG21 ILE 9 HG21 ILE 9 0.102 15.511 -7.826 69 HG22 ILE 9 HG22 ILE 9 1.194 16.718 -8.510 70 HG23 ILE 9 HG23 ILE 9 1.744 15.658 -7.214 71 HD11 ILE 9 HD11 ILE 9 -0.545 14.702 -6.173 72 HD12 ILE 9 HD12 ILE 9 -1.007 14.865 -4.485 73 HD13 ILE 9 HD13 ILE 9 -1.821 15.819 -5.720 74 H ALA 10 HN ALA 10 3.212 17.444 -8.010 75 HA ALA 10 HA ALA 10 4.630 15.665 -6.414 76 HB1 ALA 10 HB1 ALA 10 6.298 15.568 -8.081 77 HB2 ALA 10 HB2 ALA 10 5.930 17.198 -8.645 78 HB3 ALA 10 HB3 ALA 10 4.790 15.883 -8.938 79 H GLY 11 HN GLY 11 6.248 15.799 -4.967 80 HA2 GLY 11 HA2 GLY 11 8.194 16.995 -4.117 81 HA3 GLY 11 HA1 GLY 11 7.298 18.495 -4.363 82 H LYS 12 HN LYS 12 4.759 17.362 -3.460 83 HA LYS 12 HA LYS 12 5.102 16.449 -0.746 84 HB2 LYS 12 HB2 LYS 12 4.241 19.298 -1.287 85 HB3 LYS 12 HB1 LYS 12 3.911 18.464 0.230 86 HG2 LYS 12 HG2 LYS 12 6.462 17.992 0.293 87 HG3 LYS 12 HG1 LYS 12 6.579 19.249 -0.941 88 HD2 LYS 12 HD2 LYS 12 5.479 20.852 0.541 89 HD3 LYS 12 HD1 LYS 12 5.266 19.602 1.768 90 HE2 LYS 12 HE2 LYS 12 7.280 21.181 2.056 91 HE3 LYS 12 HE1 LYS 12 7.598 19.450 2.178 92 HZ1 LYS 12 HZ1 LYS 12 8.716 19.420 0.235 93 HZ2 LYS 12 HZ2 LYS 12 7.761 20.629 -0.480 94 HZ3 LYS 12 HZ3 LYS 12 8.990 21.054 0.610 95 H TRP 13 HN TRP 13 3.511 14.915 -0.758 96 HA TRP 13 HA TRP 13 0.817 15.670 -1.766 97 HB2 TRP 13 HB2 TRP 13 2.207 12.978 -1.510 98 HB3 TRP 13 HB1 TRP 13 0.505 13.117 -1.882 99 HD1 TRP 13 HD1 TRP 13 3.578 14.943 -3.334 100 HE1 TRP 13 HE1 TRP 13 3.461 14.643 -5.881 101 HE3 TRP 13 HE3 TRP 13 -0.704 12.195 -3.746 102 HZ2 TRP 13 HZ2 TRP 13 1.875 13.382 -7.810 103 HZ3 TRP 13 HZ3 TRP 13 -1.513 11.474 -5.977 104 HH2 TRP 13 HH2 TRP 13 -0.251 12.087 -8.022 105 H TYR 14 HN TYR 14 -0.695 15.891 -0.120 106 HA TYR 14 HA TYR 14 0.085 14.994 2.561 107 HB2 TYR 14 HB2 TYR 14 -1.163 17.309 1.464 108 HB3 TYR 14 HB1 TYR 14 -2.360 16.528 2.485 109 HD1 TYR 14 HD1 TYR 14 1.386 16.841 2.784 110 HD2 TYR 14 HD2 TYR 14 -2.460 17.677 4.507 111 HE1 TYR 14 HE1 TYR 14 2.482 17.782 4.793 112 HE2 TYR 14 HE2 TYR 14 -1.354 18.620 6.518 113 HH TYR 14 HH TYR 14 0.600 18.842 7.601 114 H VAL 15 HN VAL 15 -0.830 13.337 3.555 115 HA VAL 15 HA VAL 15 -3.256 12.102 2.397 116 HB VAL 15 HB VAL 15 -1.033 11.049 4.158 117 HG11 VAL 15 HG11 VAL 15 -2.346 8.852 3.962 118 HG12 VAL 15 HG12 VAL 15 -2.984 10.048 5.089 119 HG13 VAL 15 HG13 VAL 15 -3.728 9.845 3.502 120 HG21 VAL 15 HG21 VAL 15 -0.835 11.203 1.601 121 HG22 VAL 15 HG22 VAL 15 -0.538 9.624 2.326 122 HG23 VAL 15 HG23 VAL 15 -2.084 9.958 1.547 123 H VAL 16 HN VAL 16 -5.152 12.285 3.528 124 HA VAL 16 HA VAL 16 -4.959 12.954 6.408 125 HB VAL 16 HB VAL 16 -6.653 14.554 6.264 126 HG11 VAL 16 HG11 VAL 16 -5.022 14.868 3.724 127 HG12 VAL 16 HG12 VAL 16 -5.746 16.164 4.669 128 HG13 VAL 16 HG13 VAL 16 -4.418 15.224 5.329 129 HG21 VAL 16 HG21 VAL 16 -7.166 13.389 3.517 130 HG22 VAL 16 HG22 VAL 16 -8.296 13.555 4.860 131 HG23 VAL 16 HG23 VAL 16 -7.774 14.982 3.964 132 H ALA 17 HN ALA 17 -6.644 11.177 3.909 133 HA ALA 17 HA ALA 17 -8.301 9.971 6.061 134 HB1 ALA 17 HB1 ALA 17 -9.163 10.017 3.190 135 HB2 ALA 17 HB2 ALA 17 -9.490 11.381 4.263 136 HB3 ALA 17 HB3 ALA 17 -10.129 9.784 4.642 137 H LEU 18 HN LEU 18 -9.050 7.841 5.613 138 HA LEU 18 HA LEU 18 -7.539 6.225 3.750 139 HB2 LEU 18 HB2 LEU 18 -5.984 6.315 5.631 140 HB3 LEU 18 HB1 LEU 18 -7.249 5.758 6.725 141 HG LEU 18 HG LEU 18 -6.875 4.054 4.329 142 HD11 LEU 18 HD11 LEU 18 -4.523 4.694 4.796 143 HD12 LEU 18 HD12 LEU 18 -4.715 4.115 6.448 144 HD13 LEU 18 HD13 LEU 18 -4.829 2.985 5.101 145 HD21 LEU 18 HD21 LEU 18 -7.057 3.534 7.310 146 HD22 LEU 18 HD22 LEU 18 -8.346 3.349 6.125 147 HD23 LEU 18 HD23 LEU 18 -6.955 2.270 6.087 148 H ALA 19 HN ALA 19 -8.383 4.177 3.454 149 HA ALA 19 HA ALA 19 -10.800 3.413 4.907 150 HB1 ALA 19 HB1 ALA 19 -10.997 3.183 1.944 151 HB2 ALA 19 HB2 ALA 19 -11.164 4.807 2.611 152 HB3 ALA 19 HB3 ALA 19 -12.255 3.525 3.132 153 H SER 20 HN SER 20 -11.063 1.188 4.949 154 HA SER 20 HA SER 20 -9.614 -0.561 3.186 155 HB2 SER 20 HB2 SER 20 -7.910 -1.346 4.591 156 HB3 SER 20 HB1 SER 20 -7.853 0.402 4.805 157 HG SER 20 HG SER 20 -7.995 -0.213 6.839 158 H ASN 21 HN ASN 21 -9.513 -2.843 4.273 159 HA ASN 21 HA ASN 21 -12.161 -3.345 5.479 160 HB2 ASN 21 HB2 ASN 21 -11.637 -4.331 3.168 161 HB3 ASN 21 HB1 ASN 21 -10.481 -5.362 4.005 162 HD21 ASN 21 HD21 ASN 21 -12.099 -7.086 3.114 163 HD22 ASN 21 HD22 ASN 21 -13.419 -7.468 4.111 164 H THR 22 HN THR 22 -8.876 -3.271 5.937 165 HA THR 22 HA THR 22 -8.656 -5.417 7.827 166 HB THR 22 HB THR 22 -6.691 -3.186 7.868 167 HG1 THR 22 HG1 THR 22 -6.051 -3.460 5.847 168 HG21 THR 22 HG21 THR 22 -5.142 -4.958 8.036 169 HG22 THR 22 HG22 THR 22 -6.536 -5.497 8.972 170 HG23 THR 22 HG23 THR 22 -6.275 -6.119 7.343 171 H GLU 23 HN GLU 23 -10.118 -5.126 9.489 172 HA GLU 23 HA GLU 23 -11.001 -2.877 10.725 173 HB2 GLU 23 HB2 GLU 23 -10.186 -5.462 12.071 174 HB3 GLU 23 HB1 GLU 23 -11.167 -4.208 12.831 175 HG2 GLU 23 HG2 GLU 23 -12.828 -4.428 10.992 176 HG3 GLU 23 HG1 GLU 23 -11.869 -5.742 10.313 177 H PHE 24 HN PHE 24 -7.852 -4.312 10.977 178 HA PHE 24 HA PHE 24 -6.855 -2.979 13.227 179 HB2 PHE 24 HB2 PHE 24 -5.465 -4.684 12.564 180 HB3 PHE 24 HB1 PHE 24 -5.719 -4.369 10.853 181 HD1 PHE 24 HD1 PHE 24 -4.515 -2.509 9.726 182 HD2 PHE 24 HD2 PHE 24 -3.687 -3.624 13.789 183 HE1 PHE 24 HE1 PHE 24 -2.377 -1.261 9.629 184 HE2 PHE 24 HE2 PHE 24 -1.549 -2.377 13.694 185 HZ PHE 24 HZ PHE 24 -0.892 -1.193 11.617 186 H PHE 25 HN PHE 25 -6.693 -1.989 9.749 187 HA PHE 25 HA PHE 25 -5.195 0.344 10.196 188 HB2 PHE 25 HB2 PHE 25 -6.731 -0.866 7.997 189 HB3 PHE 25 HB1 PHE 25 -6.670 0.889 7.928 190 HD1 PHE 25 HD2 PHE 25 -4.186 1.820 8.647 191 HD2 PHE 25 HD1 PHE 25 -5.049 -1.956 6.796 192 HE1 PHE 25 HE2 PHE 25 -1.878 1.733 7.753 193 HE2 PHE 25 HE1 PHE 25 -2.739 -2.046 5.904 194 HZ PHE 25 HZ PHE 25 -1.153 -0.200 6.382 195 H LEU 26 HN LEU 26 -8.733 -0.068 9.917 196 HA LEU 26 HA LEU 26 -9.300 2.714 10.197 197 HB2 LEU 26 HB2 LEU 26 -11.567 1.371 11.163 198 HB3 LEU 26 HB1 LEU 26 -11.302 1.911 9.510 199 HG LEU 26 HG LEU 26 -10.211 -0.741 10.446 200 HD11 LEU 26 HD11 LEU 26 -12.375 -1.642 9.303 201 HD12 LEU 26 HD12 LEU 26 -12.478 -1.072 10.968 202 HD13 LEU 26 HD13 LEU 26 -13.030 -0.045 9.650 203 HD21 LEU 26 HD21 LEU 26 -10.129 -1.241 8.124 204 HD22 LEU 26 HD22 LEU 26 -11.251 0.058 7.721 205 HD23 LEU 26 HD23 LEU 26 -9.603 0.439 8.216 206 H ARG 27 HN ARG 27 -8.759 0.109 12.381 207 HA ARG 27 HA ARG 27 -9.751 1.337 14.755 208 HB2 ARG 27 HB2 ARG 27 -9.328 -1.093 14.572 209 HB3 ARG 27 HB1 ARG 27 -7.596 -0.772 14.486 210 HG2 ARG 27 HG2 ARG 27 -7.650 0.262 16.708 211 HG3 ARG 27 HG1 ARG 27 -9.396 0.033 16.792 212 HD2 ARG 27 HD2 ARG 27 -7.361 -2.197 16.534 213 HD3 ARG 27 HD1 ARG 27 -8.169 -1.733 18.029 214 HE ARG 27 HE ARG 27 -10.097 -2.282 16.015 215 HH11 ARG 27 HH21 ARG 27 -7.775 -3.783 18.095 216 HH12 ARG 27 HH22 ARG 27 -8.628 -5.287 18.190 217 HH21 ARG 27 HH11 ARG 27 -11.221 -4.252 16.134 218 HH22 ARG 27 HH12 ARG 27 -10.578 -5.553 17.080 219 H GLU 28 HN GLU 28 -6.450 1.057 13.420 220 HA GLU 28 HA GLU 28 -5.379 2.766 15.491 221 HB2 GLU 28 HB2 GLU 28 -4.106 1.571 13.028 222 HB3 GLU 28 HB1 GLU 28 -3.239 2.448 14.290 223 HG2 GLU 28 HG2 GLU 28 -4.107 0.805 15.964 224 HG3 GLU 28 HG1 GLU 28 -4.828 -0.108 14.641 225 H LYS 29 HN LYS 29 -5.988 3.205 11.943 226 HA LYS 29 HA LYS 29 -4.682 5.683 11.813 227 HB2 LYS 29 HB2 LYS 29 -6.919 4.524 10.164 228 HB3 LYS 29 HB1 LYS 29 -6.123 6.045 9.780 229 HG2 LYS 29 HG2 LYS 29 -4.504 3.538 10.231 230 HG3 LYS 29 HG1 LYS 29 -5.243 3.852 8.668 231 HD2 LYS 29 HD2 LYS 29 -3.294 5.695 10.093 232 HD3 LYS 29 HD1 LYS 29 -2.919 4.666 8.720 233 HE2 LYS 29 HE2 LYS 29 -5.051 6.024 7.714 234 HE3 LYS 29 HE1 LYS 29 -4.381 7.246 8.792 235 HZ1 LYS 29 HZ1 LYS 29 -2.361 7.236 7.686 236 HZ2 LYS 29 HZ2 LYS 29 -2.651 5.736 6.941 237 HZ3 LYS 29 HZ3 LYS 29 -3.490 7.116 6.421 238 H ASP 30 HN ASP 30 -7.939 4.843 12.783 239 HA ASP 30 HA ASP 30 -9.108 7.393 12.686 240 HB2 ASP 30 HB2 ASP 30 -10.355 5.277 13.120 241 HB3 ASP 30 HB1 ASP 30 -9.631 5.215 14.726 242 H LYS 31 HN LYS 31 -6.649 6.096 14.627 243 HA LYS 31 HA LYS 31 -6.955 8.095 16.747 244 HB2 LYS 31 HB2 LYS 31 -6.564 5.866 17.517 245 HB3 LYS 31 HB1 LYS 31 -5.211 5.654 16.423 246 HG2 LYS 31 HG2 LYS 31 -4.762 7.971 18.139 247 HG3 LYS 31 HG1 LYS 31 -5.109 6.547 19.101 248 HD2 LYS 31 HD2 LYS 31 -2.737 6.600 18.765 249 HD3 LYS 31 HD1 LYS 31 -3.370 5.305 17.753 250 HE2 LYS 31 HE2 LYS 31 -3.230 6.690 15.769 251 HE3 LYS 31 HE1 LYS 31 -2.844 8.113 16.739 252 HZ1 LYS 31 HZ1 LYS 31 -1.049 6.341 15.659 253 HZ2 LYS 31 HZ2 LYS 31 -0.718 7.551 16.803 254 HZ3 LYS 31 HZ3 LYS 31 -1.068 5.973 17.317 255 H MET 32 HN MET 32 -4.956 7.447 13.891 256 HA MET 32 HA MET 32 -2.837 9.215 14.765 257 HB2 MET 32 HB2 MET 32 -3.334 7.369 12.550 258 HB3 MET 32 HB1 MET 32 -2.588 8.859 11.998 259 HG2 MET 32 HG2 MET 32 -0.622 8.465 13.153 260 HG3 MET 32 HG1 MET 32 -1.426 7.567 14.435 261 HE1 MET 32 HE1 MET 32 -2.854 5.517 13.853 262 HE2 MET 32 HE2 MET 32 -2.015 4.118 13.201 263 HE3 MET 32 HE3 MET 32 -1.358 4.975 14.600 264 H LYS 33 HN LYS 33 -2.199 10.733 12.707 265 HA LYS 33 HA LYS 33 -4.528 12.484 12.207 266 HB2 LYS 33 HB2 LYS 33 -1.732 13.420 12.884 267 HB3 LYS 33 HB1 LYS 33 -3.159 14.425 12.633 268 HG2 LYS 33 HG2 LYS 33 -4.197 13.642 14.624 269 HG3 LYS 33 HG1 LYS 33 -3.064 12.299 14.780 270 HD2 LYS 33 HD2 LYS 33 -1.271 13.739 15.383 271 HD3 LYS 33 HD1 LYS 33 -2.147 15.176 14.858 272 HE2 LYS 33 HE2 LYS 33 -2.126 14.902 17.346 273 HE3 LYS 33 HE1 LYS 33 -3.754 14.914 16.670 274 HZ1 LYS 33 HZ1 LYS 33 -2.730 12.285 16.661 275 HZ2 LYS 33 HZ2 LYS 33 -2.586 12.938 18.223 276 HZ3 LYS 33 HZ3 LYS 33 -4.100 12.891 17.462 277 H MET 34 HN MET 34 -3.082 14.432 10.757 278 HA MET 34 HA MET 34 -3.151 13.447 8.182 279 HB2 MET 34 HB2 MET 34 -3.311 15.819 9.136 280 HB3 MET 34 HB1 MET 34 -1.560 15.824 9.145 281 HG2 MET 34 HG2 MET 34 -1.415 16.053 6.886 282 HG3 MET 34 HG1 MET 34 -2.737 14.941 6.583 283 HE1 MET 34 HE1 MET 34 -5.873 16.687 6.841 284 HE2 MET 34 HE2 MET 34 -4.944 15.370 7.550 285 HE3 MET 34 HE3 MET 34 -5.278 16.828 8.484 286 H ALA 35 HN ALA 35 -1.700 12.524 6.844 287 HA ALA 35 HA ALA 35 1.112 12.273 7.740 288 HB1 ALA 35 HB1 ALA 35 0.449 10.064 7.590 289 HB2 ALA 35 HB2 ALA 35 0.930 10.326 5.915 290 HB3 ALA 35 HB3 ALA 35 -0.773 10.403 6.367 291 H MET 36 HN MET 36 2.700 12.196 5.897 292 HA MET 36 HA MET 36 1.787 13.815 3.590 293 HB2 MET 36 HB2 MET 36 4.460 14.567 4.069 294 HB3 MET 36 HB1 MET 36 3.022 15.547 4.337 295 HG2 MET 36 HG2 MET 36 4.042 13.584 6.399 296 HG3 MET 36 HG1 MET 36 4.574 15.262 6.342 297 HE1 MET 36 HE1 MET 36 3.676 15.004 8.923 298 HE2 MET 36 HE2 MET 36 1.989 14.707 9.332 299 HE3 MET 36 HE3 MET 36 2.957 13.435 8.576 300 H ALA 37 HN ALA 37 3.268 13.766 1.759 301 HA ALA 37 HA ALA 37 5.130 11.545 1.574 302 HB1 ALA 37 HB1 ALA 37 3.779 10.706 -0.502 303 HB2 ALA 37 HB2 ALA 37 2.420 11.506 0.289 304 HB3 ALA 37 HB3 ALA 37 3.276 10.205 1.114 305 H ARG 38 HN ARG 38 6.230 11.459 -0.517 306 HA ARG 38 HA ARG 38 6.005 13.924 -2.144 307 HB2 ARG 38 HB2 ARG 38 8.607 12.766 -1.107 308 HB3 ARG 38 HB1 ARG 38 8.431 14.185 -2.140 309 HG2 ARG 38 HG2 ARG 38 7.150 15.325 -0.371 310 HG3 ARG 38 HG1 ARG 38 7.309 13.906 0.663 311 HD2 ARG 38 HD2 ARG 38 9.015 15.485 1.318 312 HD3 ARG 38 HD1 ARG 38 9.805 14.144 0.492 313 HE ARG 38 HE ARG 38 9.268 16.043 -1.463 314 HH11 ARG 38 HH21 ARG 38 11.025 15.817 1.508 315 HH12 ARG 38 HH22 ARG 38 12.231 16.970 1.043 316 HH21 ARG 38 HH11 ARG 38 10.846 17.556 -2.081 317 HH22 ARG 38 HH12 ARG 38 12.130 17.954 -0.988 318 H ILE 39 HN ILE 39 6.050 13.480 -4.347 319 HA ILE 39 HA ILE 39 6.815 10.787 -5.182 320 HB ILE 39 HB ILE 39 4.474 11.442 -5.226 321 HG12 ILE 39 HG12 ILE 39 5.316 11.282 -8.103 322 HG13 ILE 39 HG11 ILE 39 5.610 9.912 -7.035 323 HG21 ILE 39 HG21 ILE 39 3.784 13.080 -6.827 324 HG22 ILE 39 HG22 ILE 39 4.847 13.762 -5.604 325 HG23 ILE 39 HG23 ILE 39 5.437 13.435 -7.226 326 HD11 ILE 39 HD11 ILE 39 2.901 11.194 -6.906 327 HD12 ILE 39 HD12 ILE 39 3.259 10.198 -8.308 328 HD13 ILE 39 HD13 ILE 39 3.359 9.502 -6.696 329 H SER 40 HN SER 40 8.245 10.635 -6.969 330 HA SER 40 HA SER 40 8.933 13.141 -8.338 331 HB2 SER 40 HB2 SER 40 11.118 13.212 -7.715 332 HB3 SER 40 HB1 SER 40 10.476 12.435 -6.276 333 HG SER 40 HG SER 40 12.251 11.496 -8.024 334 H PHE 41 HN PHE 41 9.814 12.901 -10.385 335 HA PHE 41 HA PHE 41 9.087 10.407 -11.650 336 HB2 PHE 41 HB2 PHE 41 10.207 12.834 -13.016 337 HB3 PHE 41 HB1 PHE 41 9.146 11.590 -13.680 338 HD1 PHE 41 HD2 PHE 41 6.797 11.346 -12.701 339 HD2 PHE 41 HD1 PHE 41 9.309 14.748 -11.950 340 HE1 PHE 41 HE2 PHE 41 4.813 12.655 -11.992 341 HE2 PHE 41 HE1 PHE 41 7.325 16.056 -11.239 342 HZ PHE 41 HZ PHE 41 5.080 15.010 -11.260 343 H LEU 42 HN LEU 42 10.715 8.942 -11.031 344 HA LEU 42 HA LEU 42 13.509 9.371 -11.447 345 HB2 LEU 42 HB2 LEU 42 11.972 6.759 -11.585 346 HB3 LEU 42 HB1 LEU 42 13.710 6.922 -11.399 347 HG LEU 42 HG LEU 42 11.798 8.166 -9.422 348 HD11 LEU 42 HD11 LEU 42 12.235 6.080 -8.040 349 HD12 LEU 42 HD12 LEU 42 11.194 5.832 -9.441 350 HD13 LEU 42 HD13 LEU 42 12.885 5.336 -9.499 351 HD21 LEU 42 HD21 LEU 42 14.713 7.318 -9.386 352 HD22 LEU 42 HD22 LEU 42 14.070 8.952 -9.228 353 HD23 LEU 42 HD23 LEU 42 13.829 7.780 -7.936 354 H GLY 43 HN GLY 43 10.934 7.912 -13.310 355 HA2 GLY 43 HA2 GLY 43 12.000 8.739 -15.846 356 HA3 GLY 43 HA1 GLY 43 12.101 6.995 -15.587 357 H GLU 44 HN GLU 44 10.463 8.142 -17.602 358 HA GLU 44 HA GLU 44 7.818 8.642 -16.954 359 HB2 GLU 44 HB2 GLU 44 8.892 7.089 -19.324 360 HB3 GLU 44 HB1 GLU 44 7.263 7.758 -19.205 361 HG2 GLU 44 HG2 GLU 44 9.795 9.408 -18.979 362 HG3 GLU 44 HG1 GLU 44 8.860 9.232 -20.463 363 H ASP 45 HN ASP 45 9.560 5.634 -16.814 364 HA ASP 45 HA ASP 45 7.047 4.198 -16.163 365 HB2 ASP 45 HB2 ASP 45 8.420 2.133 -16.665 366 HB3 ASP 45 HB1 ASP 45 8.072 3.162 -18.053 367 H GLU 46 HN GLU 46 9.148 5.844 -14.522 368 HA GLU 46 HA GLU 46 9.118 4.010 -12.247 369 HB2 GLU 46 HB2 GLU 46 11.678 5.225 -13.311 370 HB3 GLU 46 HB1 GLU 46 11.521 4.350 -11.788 371 HG2 GLU 46 HG2 GLU 46 10.608 2.400 -13.160 372 HG3 GLU 46 HG1 GLU 46 11.154 3.275 -14.590 373 H LEU 47 HN LEU 47 8.599 5.082 -10.446 374 HA LEU 47 HA LEU 47 9.329 7.920 -10.167 375 HB2 LEU 47 HB2 LEU 47 6.627 7.202 -9.145 376 HB3 LEU 47 HB1 LEU 47 7.218 8.725 -9.788 377 HG LEU 47 HG LEU 47 6.539 6.270 -11.436 378 HD11 LEU 47 HD11 LEU 47 5.130 8.907 -10.953 379 HD12 LEU 47 HD12 LEU 47 4.665 7.763 -12.209 380 HD13 LEU 47 HD13 LEU 47 4.548 7.306 -10.509 381 HD21 LEU 47 HD21 LEU 47 8.183 8.503 -12.071 382 HD22 LEU 47 HD22 LEU 47 7.569 7.287 -13.178 383 HD23 LEU 47 HD23 LEU 47 6.664 8.771 -12.902 384 H LYS 48 HN LYS 48 9.527 8.636 -8.040 385 HA LYS 48 HA LYS 48 9.832 6.468 -6.042 386 HB2 LYS 48 HB2 LYS 48 11.821 7.971 -6.777 387 HB3 LYS 48 HB1 LYS 48 11.043 9.217 -5.807 388 HG2 LYS 48 HG2 LYS 48 10.984 7.483 -3.914 389 HG3 LYS 48 HG1 LYS 48 12.105 6.538 -4.894 390 HD2 LYS 48 HD2 LYS 48 12.557 9.393 -3.969 391 HD3 LYS 48 HD1 LYS 48 13.319 7.961 -3.278 392 HE2 LYS 48 HE2 LYS 48 14.161 7.466 -5.657 393 HE3 LYS 48 HE1 LYS 48 13.705 9.129 -6.033 394 HZ1 LYS 48 HZ1 LYS 48 16.064 8.760 -5.283 395 HZ2 LYS 48 HZ2 LYS 48 15.200 9.958 -4.446 396 HZ3 LYS 48 HZ3 LYS 48 15.439 8.437 -3.736 397 H VAL 49 HN VAL 49 8.302 6.414 -4.449 398 HA VAL 49 HA VAL 49 7.013 8.974 -3.735 399 HB VAL 49 HB VAL 49 5.770 6.328 -4.305 400 HG11 VAL 49 HG11 VAL 49 5.186 6.481 -1.941 401 HG12 VAL 49 HG12 VAL 49 4.766 8.182 -2.118 402 HG13 VAL 49 HG13 VAL 49 3.780 6.944 -2.896 403 HG21 VAL 49 HG21 VAL 49 5.444 8.176 -5.792 404 HG22 VAL 49 HG22 VAL 49 3.924 7.900 -4.957 405 HG23 VAL 49 HG23 VAL 49 4.965 9.239 -4.473 406 H SER 50 HN SER 50 6.825 9.528 -1.746 407 HA SER 50 HA SER 50 8.231 7.897 0.284 408 HB2 SER 50 HB2 SER 50 9.204 10.075 -0.531 409 HB3 SER 50 HB1 SER 50 7.817 10.875 0.188 410 HG SER 50 HG SER 50 8.901 10.773 1.986 411 H TYR 51 HN TYR 51 7.331 7.663 2.347 412 HA TYR 51 HA TYR 51 4.608 8.769 2.717 413 HB2 TYR 51 HB2 TYR 51 5.532 6.228 4.036 414 HB3 TYR 51 HB1 TYR 51 3.895 6.756 3.665 415 HD1 TYR 51 HD2 TYR 51 7.105 5.977 1.839 416 HD2 TYR 51 HD1 TYR 51 2.826 5.686 1.919 417 HE1 TYR 51 HE2 TYR 51 7.158 4.672 -0.258 418 HE2 TYR 51 HE1 TYR 51 2.876 4.367 -0.183 419 HH TYR 51 HH TYR 51 4.156 3.674 -1.880 420 H ALA 52 HN ALA 52 4.351 9.959 4.533 421 HA ALA 52 HA ALA 52 6.302 9.630 6.733 422 HB1 ALA 52 HB1 ALA 52 5.818 12.208 7.018 423 HB2 ALA 52 HB2 ALA 52 5.431 12.110 5.298 424 HB3 ALA 52 HB3 ALA 52 7.034 11.653 5.867 425 H VAL 53 HN VAL 53 5.171 8.756 8.334 426 HA VAL 53 HA VAL 53 2.421 9.720 8.834 427 HB VAL 53 HB VAL 53 3.612 7.121 9.789 428 HG11 VAL 53 HG11 VAL 53 1.593 8.031 10.953 429 HG12 VAL 53 HG12 VAL 53 0.744 8.033 9.407 430 HG13 VAL 53 HG13 VAL 53 1.276 6.509 10.118 431 HG21 VAL 53 HG21 VAL 53 2.020 7.728 7.277 432 HG22 VAL 53 HG22 VAL 53 3.676 7.127 7.348 433 HG23 VAL 53 HG23 VAL 53 2.344 6.104 7.886 434 HA PRO 54 HA PRO 54 4.247 11.264 12.646 435 HB2 PRO 54 HB2 PRO 54 2.033 12.365 13.748 436 HB3 PRO 54 HB1 PRO 54 2.832 13.090 12.338 437 HG2 PRO 54 HG2 PRO 54 0.393 11.371 12.453 438 HG3 PRO 54 HG1 PRO 54 0.697 12.831 11.492 439 HD2 PRO 54 HD2 PRO 54 0.917 10.280 10.476 440 HD3 PRO 54 HD1 PRO 54 1.825 11.671 9.844 441 H LYS 55 HN LYS 55 4.718 10.070 14.406 442 HA LYS 55 HA LYS 55 2.588 8.498 15.705 443 HB2 LYS 55 HB2 LYS 55 3.985 7.075 14.140 444 HB3 LYS 55 HB1 LYS 55 5.352 7.410 15.198 445 HG2 LYS 55 HG2 LYS 55 4.579 5.436 16.152 446 HG3 LYS 55 HG1 LYS 55 3.676 6.617 17.098 447 HD2 LYS 55 HD2 LYS 55 1.958 5.180 16.458 448 HD3 LYS 55 HD1 LYS 55 1.894 6.357 15.148 449 HE2 LYS 55 HE2 LYS 55 1.887 4.276 14.032 450 HE3 LYS 55 HE1 LYS 55 3.570 4.792 13.935 451 HZ1 LYS 55 HZ1 LYS 55 3.062 2.419 14.708 452 HZ2 LYS 55 HZ2 LYS 55 4.203 3.321 15.587 453 HZ3 LYS 55 HZ3 LYS 55 2.627 3.136 16.186 454 HA PRO 56 HA PRO 56 4.649 11.323 18.771 455 HB2 PRO 56 HB2 PRO 56 2.489 9.890 20.295 456 HB3 PRO 56 HB1 PRO 56 2.995 11.589 20.394 457 HG2 PRO 56 HG2 PRO 56 0.812 10.868 19.038 458 HG3 PRO 56 HG1 PRO 56 1.866 12.176 18.472 459 HD2 PRO 56 HD2 PRO 56 1.503 9.455 17.355 460 HD3 PRO 56 HD1 PRO 56 2.090 10.929 16.552 461 H ASN 57 HN ASN 57 4.185 7.902 18.597 462 HA ASN 57 HA ASN 57 5.909 7.383 20.925 463 HB2 ASN 57 HB2 ASN 57 4.407 5.469 19.124 464 HB3 ASN 57 HB1 ASN 57 5.293 5.032 20.583 465 HD21 ASN 57 HD21 ASN 57 4.205 7.868 21.585 466 HD22 ASN 57 HD22 ASN 57 2.663 7.458 22.165 467 H GLY 58 HN GLY 58 6.686 8.455 18.123 468 HA2 GLY 58 HA2 GLY 58 9.114 8.163 17.577 469 HA3 GLY 58 HA1 GLY 58 8.780 6.434 17.528 470 H CYS 59 HN CYS 59 8.569 9.441 15.835 471 HA CYS 59 HA CYS 59 6.766 8.977 13.810 472 HB2 CYS 59 HB2 CYS 59 9.469 10.176 13.235 473 HB3 CYS 59 HB1 CYS 59 7.902 10.612 12.553 474 H ARG 60 HN ARG 60 6.904 8.121 11.698 475 HA ARG 60 HA ARG 60 9.115 6.203 11.225 476 HB2 ARG 60 HB2 ARG 60 6.205 5.647 10.613 477 HB3 ARG 60 HB1 ARG 60 7.562 4.527 10.487 478 HG2 ARG 60 HG2 ARG 60 7.914 4.673 12.925 479 HG3 ARG 60 HG1 ARG 60 6.556 5.791 13.055 480 HD2 ARG 60 HD2 ARG 60 5.636 3.677 13.597 481 HD3 ARG 60 HD1 ARG 60 5.154 3.954 11.926 482 HE ARG 60 HE ARG 60 7.468 2.591 11.627 483 HH11 ARG 60 HH21 ARG 60 4.672 2.111 13.609 484 HH12 ARG 60 HH22 ARG 60 4.809 0.384 13.623 485 HH21 ARG 60 HH11 ARG 60 7.653 0.328 11.640 486 HH22 ARG 60 HH12 ARG 60 6.496 -0.625 12.507 487 H LYS 61 HN LYS 61 10.111 6.707 9.387 488 HA LYS 61 HA LYS 61 8.498 7.681 7.109 489 HB2 LYS 61 HB2 LYS 61 9.477 9.666 7.960 490 HB3 LYS 61 HB1 LYS 61 11.045 8.894 8.183 491 HG2 LYS 61 HG2 LYS 61 11.412 8.759 5.823 492 HG3 LYS 61 HG1 LYS 61 9.732 9.162 5.470 493 HD2 LYS 61 HD2 LYS 61 10.077 11.409 6.455 494 HD3 LYS 61 HD1 LYS 61 11.766 11.004 6.761 495 HE2 LYS 61 HE2 LYS 61 11.689 12.241 4.692 496 HE3 LYS 61 HE1 LYS 61 12.014 10.556 4.286 497 HZ1 LYS 61 HZ1 LYS 61 10.058 10.346 3.257 498 HZ2 LYS 61 HZ2 LYS 61 9.213 11.221 4.442 499 HZ3 LYS 61 HZ3 LYS 61 10.045 12.045 3.214 500 H TRP 62 HN TRP 62 8.897 6.727 5.267 501 HA TRP 62 HA TRP 62 11.473 5.424 4.737 502 HB2 TRP 62 HB2 TRP 62 10.381 3.306 4.088 503 HB3 TRP 62 HB1 TRP 62 10.130 3.657 5.800 504 HD1 TRP 62 HD1 TRP 62 8.310 4.077 2.424 505 HE1 TRP 62 HE1 TRP 62 5.769 4.010 2.863 506 HE3 TRP 62 HE3 TRP 62 8.301 3.737 7.520 507 HZ2 TRP 62 HZ2 TRP 62 3.978 3.817 5.073 508 HZ3 TRP 62 HZ3 TRP 62 6.164 3.609 8.766 509 HH2 TRP 62 HH2 TRP 62 4.002 3.649 7.551 510 H GLU 63 HN GLU 63 11.495 4.573 2.419 511 HA GLU 63 HA GLU 63 9.721 6.174 0.673 512 HB2 GLU 63 HB2 GLU 63 11.904 7.304 0.902 513 HB3 GLU 63 HB1 GLU 63 12.711 5.842 0.340 514 HG2 GLU 63 HG2 GLU 63 10.514 6.981 -1.358 515 HG3 GLU 63 HG1 GLU 63 12.071 7.803 -1.352 516 H THR 64 HN THR 64 9.181 5.266 -1.287 517 HA THR 64 HA THR 64 10.213 2.561 -1.885 518 HB THR 64 HB THR 64 7.279 3.242 -2.052 519 HG1 THR 64 HG1 THR 64 8.387 1.637 -0.037 520 HG21 THR 64 HG21 THR 64 8.083 1.377 -3.432 521 HG22 THR 64 HG22 THR 64 8.830 0.640 -2.016 522 HG23 THR 64 HG23 THR 64 7.075 0.783 -2.114 523 H THR 65 HN THR 65 10.307 2.030 -4.026 524 HA THR 65 HA THR 65 9.811 4.221 -5.940 525 HB THR 65 HB THR 65 11.536 1.742 -6.144 526 HG1 THR 65 HG1 THR 65 12.217 3.575 -4.819 527 HG21 THR 65 HG21 THR 65 12.346 2.985 -8.241 528 HG22 THR 65 HG22 THR 65 10.775 2.191 -8.346 529 HG23 THR 65 HG23 THR 65 10.867 3.936 -8.107 530 H PHE 66 HN PHE 66 8.573 3.898 -7.795 531 HA PHE 66 HA PHE 66 7.053 1.345 -7.878 532 HB2 PHE 66 HB2 PHE 66 5.226 2.655 -7.537 533 HB3 PHE 66 HB1 PHE 66 6.137 4.135 -7.838 534 HD1 PHE 66 HD1 PHE 66 5.120 1.113 -9.820 535 HD2 PHE 66 HD2 PHE 66 5.354 5.384 -9.650 536 HE1 PHE 66 HE1 PHE 66 4.172 1.258 -12.094 537 HE2 PHE 66 HE2 PHE 66 4.396 5.517 -11.942 538 HZ PHE 66 HZ PHE 66 3.823 3.454 -13.164 539 H LYS 67 HN LYS 67 7.097 0.243 -9.748 540 HA LYS 67 HA LYS 67 8.182 1.607 -12.142 541 HB2 LYS 67 HB2 LYS 67 8.486 -1.288 -11.302 542 HB3 LYS 67 HB1 LYS 67 9.073 -0.594 -12.813 543 HG2 LYS 67 HG2 LYS 67 10.283 1.130 -11.231 544 HG3 LYS 67 HG1 LYS 67 10.048 -0.118 -10.007 545 HD2 LYS 67 HD2 LYS 67 11.083 -1.749 -11.694 546 HD3 LYS 67 HD1 LYS 67 11.582 -0.321 -12.602 547 HE2 LYS 67 HE2 LYS 67 13.418 -0.934 -11.160 548 HE3 LYS 67 HE1 LYS 67 12.687 0.528 -10.496 549 HZ1 LYS 67 HZ1 LYS 67 13.173 -1.349 -8.889 550 HZ2 LYS 67 HZ2 LYS 67 11.612 -0.681 -8.831 551 HZ3 LYS 67 HZ3 LYS 67 11.868 -2.169 -9.604 552 H LYS 68 HN LYS 68 7.265 1.134 -14.113 553 HA LYS 68 HA LYS 68 4.472 0.508 -14.118 554 HB2 LYS 68 HB2 LYS 68 5.591 2.166 -15.631 555 HB3 LYS 68 HB1 LYS 68 6.309 0.805 -16.493 556 HG2 LYS 68 HG2 LYS 68 4.041 -0.091 -16.943 557 HG3 LYS 68 HG1 LYS 68 3.341 1.308 -16.126 558 HD2 LYS 68 HD2 LYS 68 4.418 2.809 -17.762 559 HD3 LYS 68 HD1 LYS 68 5.119 1.412 -18.581 560 HE2 LYS 68 HE2 LYS 68 3.131 2.007 -19.798 561 HE3 LYS 68 HE1 LYS 68 2.759 0.539 -18.894 562 HZ1 LYS 68 HZ1 LYS 68 1.403 2.932 -18.801 563 HZ2 LYS 68 HZ2 LYS 68 1.192 1.600 -17.768 564 HZ3 LYS 68 HZ3 LYS 68 2.250 2.851 -17.331 565 H THR 69 HN THR 69 3.572 -1.423 -14.190 566 HA THR 69 HA THR 69 4.956 -3.615 -15.622 567 HB THR 69 HB THR 69 5.146 -3.916 -13.165 568 HG1 THR 69 HG1 THR 69 4.309 -5.605 -14.940 569 HG21 THR 69 HG21 THR 69 3.178 -4.214 -11.804 570 HG22 THR 69 HG22 THR 69 3.004 -2.682 -12.661 571 HG23 THR 69 HG23 THR 69 2.125 -4.108 -13.214 572 H SER 70 HN SER 70 3.324 -5.464 -16.028 573 HA SER 70 HA SER 70 1.109 -4.339 -17.490 574 HB2 SER 70 HB2 SER 70 2.508 -6.347 -18.199 575 HB3 SER 70 HB1 SER 70 1.636 -7.269 -16.978 576 HG SER 70 HG SER 70 0.024 -7.364 -18.308 577 H ASP 71 HN ASP 71 0.550 -3.532 -15.053 578 HA ASP 71 HA ASP 71 -0.867 -5.322 -13.378 579 HB2 ASP 71 HB2 ASP 71 -0.025 -3.191 -12.552 580 HB3 ASP 71 HB1 ASP 71 -1.089 -2.321 -13.655 581 H ASP 72 HN ASP 72 -2.628 -2.535 -14.577 582 HA ASP 72 HA ASP 72 -4.383 -3.993 -16.301 583 HB2 ASP 72 HB2 ASP 72 -5.191 -4.907 -14.192 584 HB3 ASP 72 HB1 ASP 72 -5.394 -3.281 -13.543 585 H GLY 73 HN GLY 73 -4.082 -2.324 -17.712 586 HA2 GLY 73 HA2 GLY 73 -4.829 -0.396 -18.759 587 HA3 GLY 73 HA1 GLY 73 -5.777 -0.026 -17.321 588 H GLU 74 HN GLU 74 -5.053 1.487 -15.946 589 HA GLU 74 HA GLU 74 -2.266 2.466 -16.281 590 HB2 GLU 74 HB2 GLU 74 -4.867 3.952 -16.056 591 HB3 GLU 74 HB1 GLU 74 -3.398 4.691 -15.420 592 HG2 GLU 74 HG2 GLU 74 -3.764 5.378 -17.745 593 HG3 GLU 74 HG1 GLU 74 -2.305 4.399 -17.614 594 H VAL 75 HN VAL 75 -1.553 1.131 -14.528 595 HA VAL 75 HA VAL 75 -2.238 2.276 -11.918 596 HB VAL 75 HB VAL 75 -1.904 -0.701 -12.233 597 HG11 VAL 75 HG11 VAL 75 -3.314 -0.270 -9.935 598 HG12 VAL 75 HG12 VAL 75 -1.557 -0.320 -9.990 599 HG13 VAL 75 HG13 VAL 75 -2.391 1.228 -9.997 600 HG21 VAL 75 HG21 VAL 75 -3.922 -0.404 -13.373 601 HG22 VAL 75 HG22 VAL 75 -4.485 -0.583 -11.714 602 HG23 VAL 75 HG23 VAL 75 -4.365 1.019 -12.438 603 H TYR 76 HN TYR 76 -0.641 2.051 -10.338 604 HA TYR 76 HA TYR 76 2.059 1.683 -11.488 605 HB2 TYR 76 HB2 TYR 76 1.390 3.165 -8.952 606 HB3 TYR 76 HB1 TYR 76 2.787 3.370 -9.996 607 HD1 TYR 76 HD2 TYR 76 1.571 3.482 -12.693 608 HD2 TYR 76 HD1 TYR 76 0.257 5.246 -9.005 609 HE1 TYR 76 HE2 TYR 76 0.358 5.228 -13.956 610 HE2 TYR 76 HE1 TYR 76 -0.959 6.987 -10.270 611 HH TYR 76 HH TYR 76 -0.561 8.013 -12.826 612 H TYR 77 HN TYR 77 3.603 0.383 -10.468 613 HA TYR 77 HA TYR 77 2.729 -1.053 -8.019 614 HB2 TYR 77 HB2 TYR 77 2.323 -2.156 -10.485 615 HB3 TYR 77 HB1 TYR 77 3.914 -2.798 -10.101 616 HD1 TYR 77 HD2 TYR 77 3.666 -3.036 -7.105 617 HD2 TYR 77 HD1 TYR 77 0.919 -4.034 -10.250 618 HE1 TYR 77 HE2 TYR 77 2.610 -4.730 -5.642 619 HE2 TYR 77 HE1 TYR 77 -0.136 -5.733 -8.785 620 HH TYR 77 HH TYR 77 -0.038 -5.835 -5.726 621 H SER 78 HN SER 78 4.282 -1.237 -6.566 622 HA SER 78 HA SER 78 7.099 -0.921 -7.391 623 HB2 SER 78 HB2 SER 78 7.504 -0.504 -4.979 624 HB3 SER 78 HB1 SER 78 6.343 0.633 -5.657 625 HG SER 78 HG SER 78 4.690 -0.783 -4.842 626 H GLU 79 HN GLU 79 7.785 -2.884 -7.968 627 HA GLU 79 HA GLU 79 6.943 -5.371 -7.089 628 HB2 GLU 79 HB2 GLU 79 8.461 -4.855 -9.045 629 HB3 GLU 79 HB1 GLU 79 9.788 -4.760 -7.886 630 HG2 GLU 79 HG2 GLU 79 9.773 -7.006 -8.736 631 HG3 GLU 79 HG1 GLU 79 9.129 -7.079 -7.098 632 H GLU 80 HN GLU 80 9.502 -3.341 -5.703 633 HA GLU 80 HA GLU 80 10.490 -5.260 -3.884 634 HB2 GLU 80 HB2 GLU 80 10.556 -2.242 -3.781 635 HB3 GLU 80 HB1 GLU 80 11.488 -3.302 -2.723 636 HG2 GLU 80 HG2 GLU 80 12.552 -4.327 -4.716 637 HG3 GLU 80 HG1 GLU 80 11.655 -3.214 -5.750 638 H ALA 81 HN ALA 81 7.910 -2.843 -3.536 639 HA ALA 81 HA ALA 81 7.472 -3.743 -0.757 640 HB1 ALA 81 HB1 ALA 81 6.276 -1.710 -0.412 641 HB2 ALA 81 HB2 ALA 81 6.216 -1.378 -2.143 642 HB3 ALA 81 HB3 ALA 81 7.754 -1.295 -1.281 643 H LYS 82 HN LYS 82 6.459 -4.878 -3.557 644 HA LYS 82 HA LYS 82 4.410 -5.618 -4.446 645 HB2 LYS 82 HB2 LYS 82 4.513 -6.624 -1.597 646 HB3 LYS 82 HB1 LYS 82 3.317 -7.179 -2.768 647 HG2 LYS 82 HG2 LYS 82 5.100 -7.940 -4.271 648 HG3 LYS 82 HG1 LYS 82 6.321 -7.323 -3.160 649 HD2 LYS 82 HD2 LYS 82 6.267 -9.562 -2.526 650 HD3 LYS 82 HD1 LYS 82 5.081 -8.884 -1.413 651 HE2 LYS 82 HE2 LYS 82 4.010 -10.793 -2.325 652 HE3 LYS 82 HE1 LYS 82 3.331 -9.441 -3.230 653 HZ1 LYS 82 HZ1 LYS 82 5.518 -11.249 -4.095 654 HZ2 LYS 82 HZ2 LYS 82 3.958 -11.138 -4.760 655 HZ3 LYS 82 HZ3 LYS 82 5.049 -9.852 -4.941 656 H LYS 83 HN LYS 83 3.889 -3.166 -4.261 657 HA LYS 83 HA LYS 83 1.168 -2.986 -3.225 658 HB2 LYS 83 HB2 LYS 83 2.455 -2.212 -1.300 659 HB3 LYS 83 HB1 LYS 83 3.323 -1.062 -2.320 660 HG2 LYS 83 HG2 LYS 83 1.333 0.201 -2.748 661 HG3 LYS 83 HG1 LYS 83 0.309 -1.053 -2.050 662 HD2 LYS 83 HD2 LYS 83 0.613 0.831 -0.479 663 HD3 LYS 83 HD1 LYS 83 1.311 -0.655 0.163 664 HE2 LYS 83 HE2 LYS 83 3.019 1.247 -1.429 665 HE3 LYS 83 HE1 LYS 83 2.713 1.547 0.282 666 HZ1 LYS 83 HZ1 LYS 83 3.331 -1.094 0.200 667 HZ2 LYS 83 HZ2 LYS 83 4.387 -0.425 -0.952 668 HZ3 LYS 83 HZ3 LYS 83 4.394 0.156 0.641 669 H LYS 84 HN LYS 84 -0.091 -1.777 -4.489 670 HA LYS 84 HA LYS 84 1.180 0.007 -6.488 671 HB2 LYS 84 HB2 LYS 84 -0.876 -0.847 -7.918 672 HB3 LYS 84 HB1 LYS 84 0.604 -1.792 -7.851 673 HG2 LYS 84 HG2 LYS 84 -0.302 -3.298 -6.251 674 HG3 LYS 84 HG1 LYS 84 -1.666 -2.232 -5.916 675 HD2 LYS 84 HD2 LYS 84 -2.679 -2.674 -8.018 676 HD3 LYS 84 HD1 LYS 84 -1.200 -3.375 -8.674 677 HE2 LYS 84 HE2 LYS 84 -1.425 -5.196 -6.899 678 HE3 LYS 84 HE1 LYS 84 -3.040 -4.564 -6.587 679 HZ1 LYS 84 HZ1 LYS 84 -2.396 -6.394 -8.481 680 HZ2 LYS 84 HZ2 LYS 84 -3.823 -5.471 -8.444 681 HZ3 LYS 84 HZ3 LYS 84 -2.504 -4.953 -9.375 682 H VAL 85 HN VAL 85 0.086 1.819 -7.083 683 HA VAL 85 HA VAL 85 -2.461 2.325 -5.701 684 HB VAL 85 HB VAL 85 -1.849 4.404 -4.943 685 HG11 VAL 85 HG11 VAL 85 -0.762 2.462 -3.779 686 HG12 VAL 85 HG12 VAL 85 0.721 2.865 -4.645 687 HG13 VAL 85 HG13 VAL 85 0.025 4.017 -3.505 688 HG21 VAL 85 HG21 VAL 85 -0.741 5.694 -6.545 689 HG22 VAL 85 HG22 VAL 85 0.620 5.296 -5.502 690 HG23 VAL 85 HG23 VAL 85 0.349 4.378 -6.976 691 H GLU 86 HN GLU 86 -4.013 3.023 -6.912 692 HA GLU 86 HA GLU 86 -3.384 3.874 -9.685 693 HB2 GLU 86 HB2 GLU 86 -4.530 1.657 -9.432 694 HB3 GLU 86 HB1 GLU 86 -5.884 2.497 -8.693 695 HG2 GLU 86 HG2 GLU 86 -6.172 3.857 -10.719 696 HG3 GLU 86 HG1 GLU 86 -4.797 3.050 -11.461 697 H VAL 87 HN VAL 87 -4.044 5.723 -10.328 698 HA VAL 87 HA VAL 87 -5.543 7.461 -8.544 699 HB VAL 87 HB VAL 87 -3.435 8.140 -9.629 700 HG11 VAL 87 HG11 VAL 87 -4.830 8.575 -12.238 701 HG12 VAL 87 HG12 VAL 87 -3.135 8.224 -11.914 702 HG13 VAL 87 HG13 VAL 87 -4.324 6.925 -11.876 703 HG21 VAL 87 HG21 VAL 87 -5.168 9.753 -8.889 704 HG22 VAL 87 HG22 VAL 87 -4.211 10.354 -10.246 705 HG23 VAL 87 HG23 VAL 87 -5.842 9.736 -10.521 706 H LEU 88 HN LEU 88 -7.734 6.991 -8.647 707 HA LEU 88 HA LEU 88 -9.063 6.690 -11.211 708 HB2 LEU 88 HB2 LEU 88 -10.604 7.333 -8.707 709 HB3 LEU 88 HB1 LEU 88 -11.047 6.293 -10.051 710 HG LEU 88 HG LEU 88 -10.597 4.791 -8.305 711 HD11 LEU 88 HD11 LEU 88 -8.886 3.470 -9.155 712 HD12 LEU 88 HD12 LEU 88 -9.255 4.501 -10.535 713 HD13 LEU 88 HD13 LEU 88 -7.855 4.847 -9.522 714 HD21 LEU 88 HD21 LEU 88 -7.942 5.408 -7.430 715 HD22 LEU 88 HD22 LEU 88 -8.893 6.882 -7.326 716 HD23 LEU 88 HD23 LEU 88 -9.429 5.427 -6.494 717 H ASP 89 HN ASP 89 -9.258 9.132 -8.576 718 HA ASP 89 HA ASP 89 -9.756 11.190 -10.635 719 HB2 ASP 89 HB2 ASP 89 -11.830 10.476 -9.281 720 HB3 ASP 89 HB1 ASP 89 -11.025 11.199 -7.892 721 H THR 90 HN THR 90 -8.407 12.886 -10.447 722 HA THR 90 HA THR 90 -7.131 13.465 -7.869 723 HB THR 90 HB THR 90 -5.876 11.802 -9.470 724 HG1 THR 90 HG1 THR 90 -4.794 13.908 -7.987 725 HG21 THR 90 HG21 THR 90 -4.938 14.438 -10.551 726 HG22 THR 90 HG22 THR 90 -4.380 12.840 -11.034 727 HG23 THR 90 HG23 THR 90 -6.026 13.348 -11.408 728 H ASP 91 HN ASP 91 -7.278 15.574 -7.514 729 HA ASP 91 HA ASP 91 -8.067 17.405 -9.602 730 HB2 ASP 91 HB2 ASP 91 -8.785 17.572 -7.180 731 HB3 ASP 91 HB1 ASP 91 -7.142 18.096 -6.813 732 H TYR 92 HN TYR 92 -5.156 16.481 -7.981 733 HA TYR 92 HA TYR 92 -2.943 16.943 -8.364 734 HB2 TYR 92 HB2 TYR 92 -4.260 17.445 -10.942 735 HB3 TYR 92 HB1 TYR 92 -2.816 18.420 -10.738 736 HD1 TYR 92 HD1 TYR 92 -0.900 16.849 -9.387 737 HD2 TYR 92 HD2 TYR 92 -3.851 15.547 -12.217 738 HE1 TYR 92 HE1 TYR 92 0.509 14.883 -9.959 739 HE2 TYR 92 HE2 TYR 92 -2.450 13.583 -12.777 740 HH TYR 92 HH TYR 92 -0.594 12.471 -12.331 741 H LYS 93 HN LYS 93 -5.024 19.122 -7.267 742 HA LYS 93 HA LYS 93 -2.979 21.113 -6.888 743 HB2 LYS 93 HB2 LYS 93 -4.784 21.359 -9.095 744 HB3 LYS 93 HB1 LYS 93 -5.224 22.585 -7.912 745 HG2 LYS 93 HG2 LYS 93 -2.375 22.151 -8.858 746 HG3 LYS 93 HG1 LYS 93 -3.473 23.298 -9.618 747 HD2 LYS 93 HD2 LYS 93 -3.125 23.428 -6.637 748 HD3 LYS 93 HD1 LYS 93 -1.841 24.070 -7.659 749 HE2 LYS 93 HE2 LYS 93 -3.325 25.630 -8.705 750 HE3 LYS 93 HE1 LYS 93 -4.745 24.852 -8.007 751 HZ1 LYS 93 HZ1 LYS 93 -3.261 26.928 -6.933 752 HZ2 LYS 93 HZ2 LYS 93 -4.533 26.079 -6.193 753 HZ3 LYS 93 HZ3 LYS 93 -2.930 25.571 -5.966 754 H SER 94 HN SER 94 -5.921 19.594 -6.080 755 HA SER 94 HA SER 94 -6.205 21.379 -3.737 756 HB2 SER 94 HB2 SER 94 -7.912 21.876 -5.559 757 HB3 SER 94 HB1 SER 94 -8.573 20.275 -5.245 758 HG SER 94 HG SER 94 -8.653 22.584 -3.721 759 H TYR 95 HN TYR 95 -7.519 18.368 -5.139 760 HA TYR 95 HA TYR 95 -6.662 16.849 -2.826 761 HB2 TYR 95 HB2 TYR 95 -8.995 16.050 -2.325 762 HB3 TYR 95 HB1 TYR 95 -8.699 17.733 -1.890 763 HD1 TYR 95 HD2 TYR 95 -10.213 15.510 -4.457 764 HD2 TYR 95 HD1 TYR 95 -9.869 19.521 -2.960 765 HE1 TYR 95 HE2 TYR 95 -12.069 16.221 -5.939 766 HE2 TYR 95 HE1 TYR 95 -11.727 20.233 -4.442 767 HH TYR 95 HH TYR 95 -13.872 18.337 -5.739 768 H ALA 96 HN ALA 96 -7.189 14.506 -3.091 769 HA ALA 96 HA ALA 96 -8.052 13.688 -5.749 770 HB1 ALA 96 HB1 ALA 96 -5.712 14.168 -6.167 771 HB2 ALA 96 HB2 ALA 96 -5.951 12.420 -6.169 772 HB3 ALA 96 HB3 ALA 96 -5.233 13.209 -4.768 773 H VAL 97 HN VAL 97 -8.647 11.575 -5.905 774 HA VAL 97 HA VAL 97 -8.668 9.999 -3.382 775 HB VAL 97 HB VAL 97 -10.599 9.751 -5.705 776 HG11 VAL 97 HG11 VAL 97 -10.711 7.778 -4.445 777 HG12 VAL 97 HG12 VAL 97 -10.416 8.611 -2.921 778 HG13 VAL 97 HG13 VAL 97 -11.981 8.762 -3.719 779 HG21 VAL 97 HG21 VAL 97 -10.683 11.507 -3.256 780 HG22 VAL 97 HG22 VAL 97 -11.054 11.926 -4.926 781 HG23 VAL 97 HG23 VAL 97 -12.175 10.931 -3.996 782 H ILE 98 HN ILE 98 -7.355 8.147 -3.499 783 HA ILE 98 HA ILE 98 -6.872 7.045 -6.190 784 HB ILE 98 HB ILE 98 -4.923 7.268 -3.894 785 HG12 ILE 98 HG12 ILE 98 -4.979 8.897 -6.448 786 HG13 ILE 98 HG11 ILE 98 -5.624 9.483 -4.916 787 HG21 ILE 98 HG21 ILE 98 -4.671 5.419 -5.681 788 HG22 ILE 98 HG22 ILE 98 -4.309 6.730 -6.799 789 HG23 ILE 98 HG23 ILE 98 -3.284 6.462 -5.395 790 HD11 ILE 98 HD11 ILE 98 -2.997 9.724 -5.752 791 HD12 ILE 98 HD12 ILE 98 -3.564 9.917 -4.097 792 HD13 ILE 98 HD13 ILE 98 -2.946 8.358 -4.638 793 H TYR 99 HN TYR 99 -6.705 4.860 -6.337 794 HA TYR 99 HA TYR 99 -7.758 3.302 -4.075 795 HB2 TYR 99 HB2 TYR 99 -8.605 3.231 -6.565 796 HB3 TYR 99 HB1 TYR 99 -7.228 2.160 -6.807 797 HD1 TYR 99 HD2 TYR 99 -10.460 2.596 -5.095 798 HD2 TYR 99 HD1 TYR 99 -7.130 -0.034 -5.744 799 HE1 TYR 99 HE2 TYR 99 -11.752 0.721 -4.115 800 HE2 TYR 99 HE1 TYR 99 -8.422 -1.912 -4.764 801 HH TYR 99 HH TYR 99 -11.630 -1.947 -4.412 802 H ALA 100 HN ALA 100 -6.217 2.670 -2.732 803 HA ALA 100 HA ALA 100 -3.620 1.725 -3.781 804 HB1 ALA 100 HB1 ALA 100 -3.230 3.331 -2.113 805 HB2 ALA 100 HB2 ALA 100 -3.031 1.800 -1.261 806 HB3 ALA 100 HB3 ALA 100 -4.527 2.719 -1.088 807 H THR 101 HN THR 101 -2.936 -0.333 -3.553 808 HA THR 101 HA THR 101 -4.446 -2.186 -1.849 809 HB THR 101 HB THR 101 -4.988 -3.684 -3.564 810 HG1 THR 101 HG1 THR 101 -3.783 -2.485 -5.670 811 HG21 THR 101 HG21 THR 101 -5.177 -0.974 -4.894 812 HG22 THR 101 HG22 THR 101 -6.180 -2.383 -5.233 813 HG23 THR 101 HG23 THR 101 -6.305 -1.566 -3.674 814 H ARG 102 HN ARG 102 -3.202 -3.659 -0.883 815 HA ARG 102 HA ARG 102 -0.431 -4.044 -1.863 816 HB2 ARG 102 HB2 ARG 102 -0.422 -2.598 0.128 817 HB3 ARG 102 HB1 ARG 102 -1.351 -3.809 1.012 818 HG2 ARG 102 HG2 ARG 102 0.465 -5.425 0.786 819 HG3 ARG 102 HG1 ARG 102 1.381 -4.294 -0.210 820 HD2 ARG 102 HD2 ARG 102 1.437 -2.699 1.691 821 HD3 ARG 102 HD1 ARG 102 0.583 -3.877 2.683 822 HE ARG 102 HE ARG 102 2.760 -5.261 1.800 823 HH11 ARG 102 HH21 ARG 102 2.266 -2.194 3.324 824 HH12 ARG 102 HH22 ARG 102 3.786 -2.209 4.157 825 HH21 ARG 102 HH11 ARG 102 4.753 -5.287 2.888 826 HH22 ARG 102 HH12 ARG 102 5.193 -3.960 3.909 827 H VAL 103 HN VAL 103 0.127 -6.198 -2.150 828 HA VAL 103 HA VAL 103 -1.708 -8.176 -0.939 829 HB VAL 103 HB VAL 103 -1.995 -8.058 -3.354 830 HG11 VAL 103 HG11 VAL 103 0.906 -8.828 -3.687 831 HG12 VAL 103 HG12 VAL 103 -0.221 -8.229 -4.904 832 HG13 VAL 103 HG13 VAL 103 0.406 -7.137 -3.670 833 HG21 VAL 103 HG21 VAL 103 -0.323 -10.489 -2.644 834 HG22 VAL 103 HG22 VAL 103 -2.018 -10.293 -2.203 835 HG23 VAL 103 HG23 VAL 103 -1.555 -10.382 -3.900 836 H LYS 104 HN LYS 104 -0.809 -9.431 0.526 837 HA LYS 104 HA LYS 104 2.113 -9.763 0.567 838 HB2 LYS 104 HB2 LYS 104 -0.022 -10.291 2.651 839 HB3 LYS 104 HB1 LYS 104 1.692 -10.645 2.869 840 HG2 LYS 104 HG2 LYS 104 2.292 -8.347 2.746 841 HG3 LYS 104 HG1 LYS 104 0.716 -7.891 2.099 842 HD2 LYS 104 HD2 LYS 104 0.967 -7.323 4.520 843 HD3 LYS 104 HD1 LYS 104 -0.362 -8.442 4.215 844 HE2 LYS 104 HE2 LYS 104 0.862 -10.299 5.028 845 HE3 LYS 104 HE1 LYS 104 2.397 -9.436 4.930 846 HZ1 LYS 104 HZ1 LYS 104 0.437 -8.146 6.595 847 HZ2 LYS 104 HZ2 LYS 104 0.895 -9.683 7.156 848 HZ3 LYS 104 HZ3 LYS 104 2.071 -8.487 6.907 849 H ASP 105 HN ASP 105 2.809 -12.010 1.319 850 HA ASP 105 HA ASP 105 2.037 -13.903 -0.593 851 HB2 ASP 105 HB2 ASP 105 3.399 -14.277 2.082 852 HB3 ASP 105 HB1 ASP 105 3.255 -15.538 0.858 853 H GLY 106 HN GLY 106 0.066 -14.718 -0.779 854 HA2 GLY 106 HA2 GLY 106 -1.639 -16.212 -0.236 855 HA3 GLY 106 HA1 GLY 106 -1.078 -16.220 1.429 856 H ARG 107 HN ARG 107 -1.269 -13.022 0.838 857 HA ARG 107 HA ARG 107 -4.182 -12.857 1.357 858 HB2 ARG 107 HB2 ARG 107 -2.830 -12.787 3.486 859 HB3 ARG 107 HB1 ARG 107 -2.124 -11.280 2.903 860 HG2 ARG 107 HG2 ARG 107 -4.377 -10.290 2.721 861 HG3 ARG 107 HG1 ARG 107 -5.085 -11.796 3.309 862 HD2 ARG 107 HD2 ARG 107 -3.708 -11.549 5.395 863 HD3 ARG 107 HD1 ARG 107 -3.199 -9.966 4.817 864 HE ARG 107 HE ARG 107 -6.063 -10.261 4.874 865 HH11 ARG 107 HH21 ARG 107 -3.214 -9.574 6.713 866 HH12 ARG 107 HH22 ARG 107 -4.043 -8.631 7.905 867 HH21 ARG 107 HH11 ARG 107 -7.158 -9.026 6.434 868 HH22 ARG 107 HH12 ARG 107 -6.277 -8.321 7.747 869 H THR 108 HN THR 108 -5.228 -11.094 0.600 870 HA THR 108 HA THR 108 -3.677 -9.162 -1.031 871 HB THR 108 HB THR 108 -6.567 -9.971 -1.408 872 HG1 THR 108 HG1 THR 108 -4.508 -10.728 -3.138 873 HG21 THR 108 HG21 THR 108 -4.579 -8.379 -3.045 874 HG22 THR 108 HG22 THR 108 -6.124 -8.949 -3.675 875 HG23 THR 108 HG23 THR 108 -6.087 -7.801 -2.337 876 H LEU 109 HN LEU 109 -4.591 -6.956 -1.113 877 HA LEU 109 HA LEU 109 -6.465 -6.287 1.026 878 HB2 LEU 109 HB2 LEU 109 -3.907 -6.276 1.744 879 HB3 LEU 109 HB1 LEU 109 -3.943 -4.693 1.005 880 HG LEU 109 HG LEU 109 -6.139 -4.400 2.450 881 HD11 LEU 109 HD11 LEU 109 -5.909 -6.882 3.180 882 HD12 LEU 109 HD12 LEU 109 -4.623 -6.306 4.238 883 HD13 LEU 109 HD13 LEU 109 -6.264 -5.691 4.429 884 HD21 LEU 109 HD21 LEU 109 -4.141 -3.036 2.740 885 HD22 LEU 109 HD22 LEU 109 -4.712 -3.552 4.327 886 HD23 LEU 109 HD23 LEU 109 -3.326 -4.352 3.585 887 H HIS 110 HN HIS 110 -7.289 -4.247 0.927 888 HA HIS 110 HA HIS 110 -6.627 -2.566 -1.373 889 HB2 HIS 110 HB2 HIS 110 -9.043 -2.345 -1.968 890 HB3 HIS 110 HB1 HIS 110 -8.410 -3.967 -2.245 891 HD1 HIS 110 HD1 HIS 110 -11.232 -2.358 -0.791 892 HD2 HIS 110 HD2 HIS 110 -8.897 -5.631 0.311 893 HE1 HIS 110 HE1 HIS 110 -12.612 -3.701 0.854 894 H MET 111 HN MET 111 -7.049 -0.340 -1.021 895 HA MET 111 HA MET 111 -8.631 0.469 1.237 896 HB2 MET 111 HB2 MET 111 -6.564 1.802 2.150 897 HB3 MET 111 HB1 MET 111 -6.776 0.112 2.606 898 HG2 MET 111 HG2 MET 111 -5.117 -0.629 1.106 899 HG3 MET 111 HG1 MET 111 -5.172 0.864 0.168 900 HE1 MET 111 HE1 MET 111 -3.408 0.209 4.336 901 HE2 MET 111 HE2 MET 111 -5.109 0.648 4.201 902 HE3 MET 111 HE3 MET 111 -4.505 -0.823 3.425 903 H MET 112 HN MET 112 -9.070 2.702 1.241 904 HA MET 112 HA MET 112 -8.230 4.142 -1.220 905 HB2 MET 112 HB2 MET 112 -10.727 3.475 -0.893 906 HB3 MET 112 HB1 MET 112 -10.754 4.770 0.302 907 HG2 MET 112 HG2 MET 112 -11.352 5.950 -1.608 908 HG3 MET 112 HG1 MET 112 -9.601 6.157 -1.641 909 HE1 MET 112 HE1 MET 112 -12.336 5.706 -4.026 910 HE2 MET 112 HE2 MET 112 -12.314 4.017 -4.527 911 HE3 MET 112 HE3 MET 112 -12.677 4.440 -2.849 912 H ARG 113 HN ARG 113 -7.725 6.367 -1.024 913 HA ARG 113 HA ARG 113 -7.563 7.458 1.718 914 HB2 ARG 113 HB2 ARG 113 -5.269 7.133 -0.217 915 HB3 ARG 113 HB1 ARG 113 -5.229 8.296 1.107 916 HG2 ARG 113 HG2 ARG 113 -5.472 6.556 2.750 917 HG3 ARG 113 HG1 ARG 113 -5.810 5.351 1.507 918 HD2 ARG 113 HD2 ARG 113 -3.526 5.723 0.581 919 HD3 ARG 113 HD1 ARG 113 -3.198 6.834 1.907 920 HE ARG 113 HE ARG 113 -4.085 4.345 2.942 921 HH11 ARG 113 HH21 ARG 113 -1.414 5.867 1.353 922 HH12 ARG 113 HH22 ARG 113 -0.227 4.808 2.036 923 HH21 ARG 113 HH11 ARG 113 -2.533 2.952 3.840 924 HH22 ARG 113 HH12 ARG 113 -0.860 3.157 3.443 925 H LEU 114 HN LEU 114 -7.398 9.744 1.836 926 HA LEU 114 HA LEU 114 -8.172 11.149 -0.670 927 HB2 LEU 114 HB2 LEU 114 -9.974 11.067 1.076 928 HB3 LEU 114 HB1 LEU 114 -8.890 11.943 2.153 929 HG LEU 114 HG LEU 114 -8.753 13.792 0.499 930 HD11 LEU 114 HD11 LEU 114 -10.540 11.929 -1.022 931 HD12 LEU 114 HD12 LEU 114 -10.791 13.662 -1.199 932 HD13 LEU 114 HD13 LEU 114 -9.233 12.949 -1.614 933 HD21 LEU 114 HD21 LEU 114 -10.386 13.834 2.358 934 HD22 LEU 114 HD22 LEU 114 -11.014 14.655 0.930 935 HD23 LEU 114 HD23 LEU 114 -11.569 13.030 1.328 936 H TYR 115 HN TYR 115 -6.827 12.680 -1.347 937 HA TYR 115 HA TYR 115 -4.721 13.601 0.493 938 HB2 TYR 115 HB2 TYR 115 -4.837 13.577 -2.523 939 HB3 TYR 115 HB1 TYR 115 -3.497 14.221 -1.574 940 HD1 TYR 115 HD1 TYR 115 -5.573 11.123 -1.965 941 HD2 TYR 115 HD2 TYR 115 -1.759 12.793 -0.912 942 HE1 TYR 115 HE1 TYR 115 -4.644 8.839 -1.718 943 HE2 TYR 115 HE2 TYR 115 -0.830 10.512 -0.669 944 HH TYR 115 HH TYR 115 -2.095 8.064 -0.097 945 H SER 116 HN SER 116 -4.000 15.824 0.327 946 HA SER 116 HA SER 116 -5.985 17.740 -0.701 947 HB2 SER 116 HB2 SER 116 -6.562 17.458 1.657 948 HB3 SER 116 HB1 SER 116 -4.883 17.720 2.125 949 HG SER 116 HG SER 116 -5.928 19.671 0.498 950 H ARG 117 HN ARG 117 -5.073 19.614 -1.488 951 HA ARG 117 HA ARG 117 -2.240 19.604 -1.937 952 HB2 ARG 117 HB2 ARG 117 -3.967 20.482 -3.547 953 HB3 ARG 117 HB1 ARG 117 -4.200 21.845 -2.460 954 HG2 ARG 117 HG2 ARG 117 -2.615 22.517 -4.168 955 HG3 ARG 117 HG1 ARG 117 -1.745 22.347 -2.651 956 HD2 ARG 117 HD2 ARG 117 -0.630 20.430 -3.347 957 HD3 ARG 117 HD1 ARG 117 -1.909 19.963 -4.464 958 HE ARG 117 HE ARG 117 -0.774 21.138 -6.093 959 HH11 ARG 117 HH21 ARG 117 0.040 22.342 -2.952 960 HH12 ARG 117 HH22 ARG 117 1.201 23.485 -3.539 961 HH21 ARG 117 HH11 ARG 117 0.748 22.636 -6.870 962 HH22 ARG 117 HH12 ARG 117 1.602 23.652 -5.758 963 H SER 118 HN SER 118 -4.348 20.932 0.431 964 HA SER 118 HA SER 118 -2.075 22.366 1.655 965 HB2 SER 118 HB2 SER 118 -3.522 24.043 0.624 966 HB3 SER 118 HB1 SER 118 -4.926 23.361 1.439 967 HG SER 118 HG SER 118 -3.814 23.832 3.432 968 HA PRO 119 HA PRO 119 -2.781 20.004 5.335 969 HB2 PRO 119 HB2 PRO 119 -2.961 22.705 6.639 970 HB3 PRO 119 HB1 PRO 119 -2.047 21.271 7.148 971 HG2 PRO 119 HG2 PRO 119 -0.882 23.344 5.896 972 HG3 PRO 119 HG1 PRO 119 -0.333 21.675 5.685 973 HD2 PRO 119 HD2 PRO 119 -1.707 23.429 3.750 974 HD3 PRO 119 HD1 PRO 119 -0.792 21.935 3.462 975 H GLU 120 HN GLU 120 -4.910 22.538 4.296 976 HA GLU 120 HA GLU 120 -7.011 21.925 6.182 977 HB2 GLU 120 HB2 GLU 120 -7.154 23.613 3.680 978 HB3 GLU 120 HB1 GLU 120 -8.257 23.644 5.057 979 HG2 GLU 120 HG2 GLU 120 -6.358 24.356 6.514 980 HG3 GLU 120 HG1 GLU 120 -5.329 24.432 5.083 981 H VAL 121 HN VAL 121 -9.138 21.329 5.444 982 HA VAL 121 HA VAL 121 -9.089 19.437 3.160 983 HB VAL 121 HB VAL 121 -10.825 19.244 5.630 984 HG11 VAL 121 HG11 VAL 121 -11.628 18.143 3.532 985 HG12 VAL 121 HG12 VAL 121 -10.124 17.223 3.479 986 HG13 VAL 121 HG13 VAL 121 -11.256 16.988 4.811 987 HG21 VAL 121 HG21 VAL 121 -9.233 17.303 6.152 988 HG22 VAL 121 HG22 VAL 121 -8.141 18.013 4.963 989 HG23 VAL 121 HG23 VAL 121 -8.587 18.924 6.404 990 H SER 122 HN SER 122 -10.256 20.178 1.509 991 HA SER 122 HA SER 122 -12.206 22.256 1.835 992 HB2 SER 122 HB2 SER 122 -12.313 22.310 -0.509 993 HB3 SER 122 HB1 SER 122 -10.654 21.817 -0.182 994 HG SER 122 HG SER 122 -12.285 19.677 -0.224 995 HA PRO 123 HA PRO 123 -15.681 19.622 2.960 996 HB2 PRO 123 HB2 PRO 123 -17.102 21.629 1.230 997 HB3 PRO 123 HB1 PRO 123 -17.569 20.984 2.817 998 HG2 PRO 123 HG2 PRO 123 -16.470 23.402 2.567 999 HG3 PRO 123 HG1 PRO 123 -16.115 22.356 3.953 1000 HD2 PRO 123 HD2 PRO 123 -14.360 23.090 1.671 1001 HD3 PRO 123 HD1 PRO 123 -13.919 22.537 3.303 1002 H ALA 124 HN ALA 124 -14.994 20.678 -0.328 1003 HA ALA 124 HA ALA 124 -16.678 18.731 -1.607 1004 HB1 ALA 124 HB1 ALA 124 -16.162 20.754 -2.807 1005 HB2 ALA 124 HB2 ALA 124 -15.397 19.413 -3.661 1006 HB3 ALA 124 HB3 ALA 124 -14.429 20.473 -2.635 1007 H ALA 125 HN ALA 125 -13.325 18.897 -0.580 1008 HA ALA 125 HA ALA 125 -12.380 16.636 -2.009 1009 HB1 ALA 125 HB1 ALA 125 -11.407 17.867 0.581 1010 HB2 ALA 125 HB2 ALA 125 -10.828 18.247 -1.042 1011 HB3 ALA 125 HB3 ALA 125 -10.530 16.652 -0.349 1012 H THR 126 HN THR 126 -13.746 17.043 1.227 1013 HA THR 126 HA THR 126 -13.445 14.283 1.955 1014 HB THR 126 HB THR 126 -15.503 16.009 3.283 1015 HG1 THR 126 HG1 THR 126 -13.241 17.020 2.665 1016 HG21 THR 126 HG21 THR 126 -13.248 14.358 4.458 1017 HG22 THR 126 HG22 THR 126 -14.706 14.918 5.273 1018 HG23 THR 126 HG23 THR 126 -14.814 13.663 4.038 1019 H ALA 127 HN ALA 127 -15.963 16.210 0.414 1020 HA ALA 127 HA ALA 127 -18.029 14.259 0.677 1021 HB1 ALA 127 HB1 ALA 127 -17.746 16.643 -1.138 1022 HB2 ALA 127 HB2 ALA 127 -18.508 16.620 0.453 1023 HB3 ALA 127 HB3 ALA 127 -19.229 15.722 -0.883 1024 H ILE 128 HN ILE 128 -15.984 15.248 -2.124 1025 HA ILE 128 HA ILE 128 -17.178 13.490 -3.973 1026 HB ILE 128 HB ILE 128 -15.350 15.419 -4.212 1027 HG12 ILE 128 HG12 ILE 128 -16.502 14.426 -6.092 1028 HG13 ILE 128 HG11 ILE 128 -14.780 14.496 -6.441 1029 HG21 ILE 128 HG21 ILE 128 -13.609 12.938 -4.318 1030 HG22 ILE 128 HG22 ILE 128 -13.110 14.605 -4.597 1031 HG23 ILE 128 HG23 ILE 128 -13.600 14.093 -2.984 1032 HD11 ILE 128 HD11 ILE 128 -14.686 12.078 -5.518 1033 HD12 ILE 128 HD12 ILE 128 -16.440 12.092 -5.695 1034 HD13 ILE 128 HD13 ILE 128 -15.410 12.313 -7.108 1035 H PHE 129 HN PHE 129 -14.648 13.227 -1.683 1036 HA PHE 129 HA PHE 129 -13.618 10.694 -2.150 1037 HB2 PHE 129 HB2 PHE 129 -12.779 12.376 -0.513 1038 HB3 PHE 129 HB1 PHE 129 -14.119 11.955 0.546 1039 HD1 PHE 129 HD1 PHE 129 -11.661 9.984 -1.542 1040 HD2 PHE 129 HD2 PHE 129 -13.460 10.591 2.311 1041 HE1 PHE 129 HE1 PHE 129 -10.362 8.089 -0.636 1042 HE2 PHE 129 HE2 PHE 129 -12.145 8.703 3.214 1043 HZ PHE 129 HZ PHE 129 -10.600 7.445 1.744 1044 H ARG 130 HN ARG 130 -16.449 11.652 -0.246 1045 HA ARG 130 HA ARG 130 -17.100 9.023 0.642 1046 HB2 ARG 130 HB2 ARG 130 -18.639 11.613 0.513 1047 HB3 ARG 130 HB1 ARG 130 -19.369 10.121 1.105 1048 HG2 ARG 130 HG2 ARG 130 -17.663 9.916 2.831 1049 HG3 ARG 130 HG1 ARG 130 -16.810 11.323 2.198 1050 HD2 ARG 130 HD2 ARG 130 -18.917 12.664 2.618 1051 HD3 ARG 130 HD1 ARG 130 -19.554 11.261 3.471 1052 HE ARG 130 HE ARG 130 -16.954 12.131 4.410 1053 HH11 ARG 130 HH21 ARG 130 -20.392 12.466 4.630 1054 HH12 ARG 130 HH22 ARG 130 -20.366 13.086 6.247 1055 HH21 ARG 130 HH11 ARG 130 -16.914 12.944 6.530 1056 HH22 ARG 130 HH12 ARG 130 -18.398 13.356 7.323 1057 H LYS 131 HN LYS 131 -18.148 10.992 -2.129 1058 HA LYS 131 HA LYS 131 -20.301 9.513 -3.018 1059 HB2 LYS 131 HB2 LYS 131 -18.140 10.872 -4.641 1060 HB3 LYS 131 HB1 LYS 131 -19.654 10.270 -5.315 1061 HG2 LYS 131 HG2 LYS 131 -20.901 11.720 -3.710 1062 HG3 LYS 131 HG1 LYS 131 -19.362 12.383 -3.160 1063 HD2 LYS 131 HD2 LYS 131 -18.888 13.053 -5.545 1064 HD3 LYS 131 HD1 LYS 131 -20.536 12.570 -5.946 1065 HE2 LYS 131 HE2 LYS 131 -21.399 14.173 -4.259 1066 HE3 LYS 131 HE1 LYS 131 -19.745 14.684 -3.921 1067 HZ1 LYS 131 HZ1 LYS 131 -20.053 16.155 -5.540 1068 HZ2 LYS 131 HZ2 LYS 131 -19.934 14.852 -6.625 1069 HZ3 LYS 131 HZ3 LYS 131 -21.458 15.386 -6.107 1070 H LEU 132 HN LEU 132 -16.921 9.055 -4.108 1071 HA LEU 132 HA LEU 132 -17.429 6.656 -5.509 1072 HB2 LEU 132 HB2 LEU 132 -14.804 7.352 -4.187 1073 HB3 LEU 132 HB1 LEU 132 -15.068 6.411 -5.655 1074 HG LEU 132 HG LEU 132 -15.543 9.381 -5.284 1075 HD11 LEU 132 HD11 LEU 132 -13.781 7.949 -7.283 1076 HD12 LEU 132 HD12 LEU 132 -13.771 9.660 -6.858 1077 HD13 LEU 132 HD13 LEU 132 -13.191 8.462 -5.702 1078 HD21 LEU 132 HD21 LEU 132 -16.077 9.194 -7.810 1079 HD22 LEU 132 HD22 LEU 132 -16.320 7.475 -7.500 1080 HD23 LEU 132 HD23 LEU 132 -17.326 8.670 -6.682 1081 H ALA 133 HN ALA 133 -16.227 7.263 -2.219 1082 HA ALA 133 HA ALA 133 -15.832 4.631 -1.417 1083 HB1 ALA 133 HB1 ALA 133 -15.415 6.890 -0.162 1084 HB2 ALA 133 HB2 ALA 133 -15.757 5.429 0.759 1085 HB3 ALA 133 HB3 ALA 133 -17.033 6.617 0.483 1086 H GLY 134 HN GLY 134 -18.816 6.518 -1.703 1087 HA2 GLY 134 HA2 GLY 134 -20.527 4.719 -0.337 1088 HA3 GLY 134 HA1 GLY 134 -21.018 5.924 -1.519 1089 H GLU 135 HN GLU 135 -19.441 5.035 -3.669 1090 HA GLU 135 HA GLU 135 -21.123 3.076 -4.813 1091 HB2 GLU 135 HB2 GLU 135 -19.712 4.794 -6.045 1092 HB3 GLU 135 HB1 GLU 135 -18.322 3.757 -5.725 1093 HG2 GLU 135 HG2 GLU 135 -19.437 1.890 -6.879 1094 HG3 GLU 135 HG1 GLU 135 -20.841 2.911 -7.187 1095 H ARG 136 HN ARG 136 -18.466 2.857 -2.658 1096 HA ARG 136 HA ARG 136 -17.976 0.030 -3.351 1097 HB2 ARG 136 HB2 ARG 136 -16.433 1.998 -1.649 1098 HB3 ARG 136 HB1 ARG 136 -16.027 0.288 -1.795 1099 HG2 ARG 136 HG2 ARG 136 -15.669 0.509 -4.178 1100 HG3 ARG 136 HG1 ARG 136 -16.263 2.169 -4.156 1101 HD2 ARG 136 HD2 ARG 136 -13.802 2.123 -4.199 1102 HD3 ARG 136 HD1 ARG 136 -14.390 2.830 -2.700 1103 HE ARG 136 HE ARG 136 -13.075 0.227 -3.004 1104 HH11 ARG 136 HH21 ARG 136 -14.783 2.494 -1.014 1105 HH12 ARG 136 HH22 ARG 136 -14.250 1.790 0.476 1106 HH21 ARG 136 HH11 ARG 136 -12.379 -0.694 -1.053 1107 HH22 ARG 136 HH12 ARG 136 -12.892 -0.012 0.454 1108 H ASN 137 HN ASN 137 -20.223 1.467 -1.663 1109 HA ASN 137 HA ASN 137 -21.496 0.958 0.194 1110 HB2 ASN 137 HB2 ASN 137 -20.005 -1.631 -0.004 1111 HB3 ASN 137 HB1 ASN 137 -21.531 -1.387 0.838 1112 HD21 ASN 137 HD21 ASN 137 -22.357 0.526 -1.445 1113 HD22 ASN 137 HD22 ASN 137 -22.834 -0.519 -2.695 1114 H TYR 138 HN TYR 138 -19.036 2.273 0.665 1115 HA TYR 138 HA TYR 138 -17.609 1.121 2.851 1116 HB2 TYR 138 HB2 TYR 138 -16.361 3.098 2.877 1117 HB3 TYR 138 HB1 TYR 138 -16.878 2.987 1.197 1118 HD1 TYR 138 HD1 TYR 138 -19.780 3.805 1.544 1119 HD2 TYR 138 HD2 TYR 138 -16.161 5.450 3.149 1120 HE1 TYR 138 HE1 TYR 138 -20.879 6.012 1.744 1121 HE2 TYR 138 HE2 TYR 138 -17.262 7.665 3.355 1122 HH TYR 138 HH TYR 138 -19.658 8.508 3.586 1123 H THR 139 HN THR 139 -17.598 1.772 5.042 1124 HA THR 139 HA THR 139 -20.083 3.086 5.997 1125 HB THR 139 HB THR 139 -20.355 1.508 7.669 1126 HG1 THR 139 HG1 THR 139 -18.283 1.787 8.544 1127 HG21 THR 139 HG21 THR 139 -18.792 -0.135 5.661 1128 HG22 THR 139 HG22 THR 139 -20.070 -0.702 6.736 1129 HG23 THR 139 HG23 THR 139 -20.454 0.396 5.411 1130 H ASP 140 HN ASP 140 -19.819 4.430 7.885 1131 HA ASP 140 HA ASP 140 -17.702 6.118 7.914 1132 HB2 ASP 140 HB2 ASP 140 -19.803 6.326 9.289 1133 HB3 ASP 140 HB1 ASP 140 -19.063 5.242 10.466 1134 H GLU 141 HN GLU 141 -17.907 3.299 10.168 1135 HA GLU 141 HA GLU 141 -15.360 3.620 11.249 1136 HB2 GLU 141 HB2 GLU 141 -16.967 1.090 10.845 1137 HB3 GLU 141 HB1 GLU 141 -15.558 1.236 11.895 1138 HG2 GLU 141 HG2 GLU 141 -16.713 3.024 13.170 1139 HG3 GLU 141 HG1 GLU 141 -18.134 2.814 12.149 1140 H MET 142 HN MET 142 -16.282 2.360 8.145 1141 HA MET 142 HA MET 142 -13.841 0.878 7.711 1142 HB2 MET 142 HB2 MET 142 -15.758 0.108 6.532 1143 HB3 MET 142 HB1 MET 142 -16.116 1.710 5.918 1144 HG2 MET 142 HG2 MET 142 -14.504 1.608 4.277 1145 HG3 MET 142 HG1 MET 142 -13.445 0.584 5.233 1146 HE1 MET 142 HE1 MET 142 -13.988 -1.522 6.038 1147 HE2 MET 142 HE2 MET 142 -15.635 -2.133 5.918 1148 HE3 MET 142 HE3 MET 142 -14.358 -2.823 4.910 1149 H VAL 143 HN VAL 143 -14.867 4.126 7.390 1150 HA VAL 143 HA VAL 143 -12.323 4.828 6.029 1151 HB VAL 143 HB VAL 143 -14.421 4.995 4.596 1152 HG11 VAL 143 HG11 VAL 143 -14.973 7.451 6.266 1153 HG12 VAL 143 HG12 VAL 143 -15.998 6.718 5.039 1154 HG13 VAL 143 HG13 VAL 143 -15.766 5.909 6.585 1155 HG21 VAL 143 HG21 VAL 143 -12.962 7.600 5.114 1156 HG22 VAL 143 HG22 VAL 143 -12.285 6.258 4.190 1157 HG23 VAL 143 HG23 VAL 143 -13.726 7.091 3.608 1158 H ALA 144 HN ALA 144 -11.087 6.255 7.161 1159 HA ALA 144 HA ALA 144 -12.473 7.902 9.230 1160 HB1 ALA 144 HB1 ALA 144 -10.455 7.601 10.648 1161 HB2 ALA 144 HB2 ALA 144 -9.835 6.452 9.462 1162 HB3 ALA 144 HB3 ALA 144 -11.322 6.097 10.340 1163 H MET 145 HN MET 145 -12.193 10.005 9.083 1164 HA MET 145 HA MET 145 -10.224 11.166 7.297 1165 HB2 MET 145 HB2 MET 145 -12.487 12.232 8.983 1166 HB3 MET 145 HB1 MET 145 -11.311 13.329 8.260 1167 HG2 MET 145 HG2 MET 145 -12.847 11.260 6.679 1168 HG3 MET 145 HG1 MET 145 -13.371 12.935 6.858 1169 HE1 MET 145 HE1 MET 145 -12.161 10.727 4.542 1170 HE2 MET 145 HE2 MET 145 -13.128 12.096 4.023 1171 HE3 MET 145 HE3 MET 145 -11.530 11.829 3.323 1172 H LEU 146 HN LEU 146 -8.590 12.634 7.954 1173 HA LEU 146 HA LEU 146 -7.815 12.407 10.815 1174 HB2 LEU 146 HB2 LEU 146 -5.976 12.808 8.454 1175 HB3 LEU 146 HB1 LEU 146 -5.489 12.635 10.129 1176 HG LEU 146 HG LEU 146 -7.163 10.472 8.865 1177 HD11 LEU 146 HD11 LEU 146 -4.506 9.574 8.696 1178 HD12 LEU 146 HD12 LEU 146 -5.549 10.001 7.346 1179 HD13 LEU 146 HD13 LEU 146 -4.451 11.200 8.024 1180 HD21 LEU 146 HD21 LEU 146 -5.020 10.523 11.009 1181 HD22 LEU 146 HD22 LEU 146 -6.759 10.400 11.279 1182 HD23 LEU 146 HD23 LEU 146 -5.894 9.083 10.488 1183 HA PRO 147 HA PRO 147 -8.288 16.862 10.738 1184 HB2 PRO 147 HB2 PRO 147 -7.275 17.467 13.179 1185 HB3 PRO 147 HB1 PRO 147 -8.830 16.632 12.983 1186 HG2 PRO 147 HG2 PRO 147 -6.144 15.491 13.627 1187 HG3 PRO 147 HG1 PRO 147 -7.723 15.124 14.346 1188 HD2 PRO 147 HD2 PRO 147 -6.569 13.544 12.429 1189 HD3 PRO 147 HD1 PRO 147 -8.329 13.697 12.626 1190 H ARG 148 HN ARG 148 -7.001 18.854 10.864 1191 HA ARG 148 HA ARG 148 -4.608 18.759 9.413 1192 HB2 ARG 148 HB2 ARG 148 -4.421 21.136 9.897 1193 HB3 ARG 148 HB1 ARG 148 -6.101 20.727 9.541 1194 HG2 ARG 148 HG2 ARG 148 -6.404 20.451 12.077 1195 HG3 ARG 148 HG1 ARG 148 -4.846 21.263 12.238 1196 HD2 ARG 148 HD2 ARG 148 -7.388 22.349 11.019 1197 HD3 ARG 148 HD1 ARG 148 -6.488 22.987 12.391 1198 HE ARG 148 HE ARG 148 -5.885 23.397 9.581 1199 HH11 ARG 148 HH21 ARG 148 -4.742 23.394 12.848 1200 HH12 ARG 148 HH22 ARG 148 -3.437 24.488 12.538 1201 HH21 ARG 148 HH11 ARG 148 -4.174 24.833 9.167 1202 HH22 ARG 148 HH12 ARG 148 -3.115 25.304 10.454 1203 H GLN 149 HN GLN 149 -5.103 18.099 12.703 1204 HA GLN 149 HA GLN 149 -2.874 19.124 13.983 1205 HB2 GLN 149 HB2 GLN 149 -4.099 16.381 14.369 1206 HB3 GLN 149 HB1 GLN 149 -3.049 17.212 15.518 1207 HG2 GLN 149 HG2 GLN 149 -5.617 18.438 14.504 1208 HG3 GLN 149 HG1 GLN 149 -5.564 17.417 15.939 1209 HE21 GLN 149 HE21 GLN 149 -5.906 20.511 15.420 1210 HE22 GLN 149 HE22 GLN 149 -4.855 21.193 16.565 1211 H GLU 150 HN GLU 150 -0.737 18.772 13.902 1212 HA GLU 150 HA GLU 150 0.280 16.380 12.483 1213 HB2 GLU 150 HB2 GLU 150 1.924 17.752 11.327 1214 HB3 GLU 150 HB1 GLU 150 0.300 18.328 10.948 1215 HG2 GLU 150 HG2 GLU 150 0.568 20.014 12.818 1216 HG3 GLU 150 HG1 GLU 150 2.261 19.533 12.914 1217 H GLU 151 HN GLU 151 2.178 15.538 13.252 1218 HA GLU 151 HA GLU 151 3.306 16.802 15.689 1219 HB2 GLU 151 HB2 GLU 151 3.339 13.857 14.975 1220 HB3 GLU 151 HB1 GLU 151 3.849 14.591 16.494 1221 HG2 GLU 151 HG2 GLU 151 1.028 14.721 15.396 1222 HG3 GLU 151 HG1 GLU 151 1.567 13.570 16.616 1223 H CYS 152 HN CYS 152 4.405 14.157 13.598 1224 HA CYS 152 HA CYS 152 6.977 15.485 13.267 1225 HB2 CYS 152 HB2 CYS 152 6.009 12.765 13.348 1226 HB3 CYS 152 HB1 CYS 152 6.896 13.027 11.854 1227 H THR 153 HN THR 153 7.929 15.474 11.088 1228 HA THR 153 HA THR 153 6.111 15.476 8.818 1229 HB THR 153 HB THR 153 6.700 17.835 8.202 1230 HG1 THR 153 HG1 THR 153 7.881 17.647 10.743 1231 HG21 THR 153 HG21 THR 153 5.322 17.721 10.894 1232 HG22 THR 153 HG22 THR 153 4.991 18.808 9.548 1233 HG23 THR 153 HG23 THR 153 4.563 17.104 9.427 1234 H VAL 154 HN VAL 154 7.283 15.886 6.757 1235 HA VAL 154 HA VAL 154 9.717 14.447 6.680 1236 HB VAL 154 HB VAL 154 9.682 15.138 4.271 1237 HG11 VAL 154 HG11 VAL 154 7.506 13.949 3.767 1238 HG12 VAL 154 HG12 VAL 154 8.583 13.085 4.863 1239 HG13 VAL 154 HG13 VAL 154 7.187 13.954 5.502 1240 HG21 VAL 154 HG21 VAL 154 8.582 17.340 4.666 1241 HG22 VAL 154 HG22 VAL 154 7.751 16.381 3.443 1242 HG23 VAL 154 HG23 VAL 154 7.094 16.489 5.075 1243 H ASP 155 HN ASP 155 11.683 15.259 5.760 1244 HA ASP 155 HA ASP 155 12.469 17.775 6.965 1245 HB2 ASP 155 HB2 ASP 155 14.548 16.673 5.301 1246 HB3 ASP 155 HB1 ASP 155 14.489 16.781 7.056 1247 H GLU 156 HN GLU 156 12.824 19.660 5.956 1248 HA GLU 156 HA GLU 156 11.710 20.175 3.426 1249 HB2 GLU 156 HB2 GLU 156 13.561 21.742 5.222 1250 HB3 GLU 156 HB1 GLU 156 12.947 22.380 3.703 1251 HG2 GLU 156 HG2 GLU 156 10.624 21.960 4.495 1252 HG3 GLU 156 HG1 GLU 156 11.279 21.425 6.041 1253 H VAL 157 HN VAL 157 14.889 19.190 4.435 1254 HA VAL 157 HA VAL 157 16.572 20.045 2.462 1255 HB VAL 157 HB VAL 157 16.521 17.166 3.369 1256 HG11 VAL 157 HG11 VAL 157 18.890 17.278 3.044 1257 HG12 VAL 157 HG12 VAL 157 18.166 18.005 1.610 1258 HG13 VAL 157 HG13 VAL 157 18.851 19.032 2.870 1259 HG21 VAL 157 HG21 VAL 157 17.379 19.671 4.839 1260 HG22 VAL 157 HG22 VAL 157 16.245 18.435 5.384 1261 HG23 VAL 157 HG23 VAL 157 17.966 18.066 5.273 1262 HN1 EB4 200 H17 EB4 200 0.946 -0.823 5.651 1263 H8 EB4 200 H8 EB4 200 4.643 2.307 0.772 1264 HN2 EB4 200 H25 EB4 200 3.891 0.576 6.092 1265 H9 EB4 200 H9 EB4 200 -0.224 6.191 3.585 1266 H10 EB4 200 H10 EB4 200 -2.395 -1.102 0.767 1267 HN3 EB4 200 H32 EB4 200 1.048 1.949 7.336 1268 H7 EB4 200 H7 EB4 200 -1.279 1.110 0.671 1269 H11 EB4 200 H11 EB4 200 6.830 1.198 1.143 1270 H12 EB4 200 H12 EB4 200 -1.240 7.138 5.640 1271 H15 EB4 200 H15 EB4 200 -0.980 5.964 7.807 1272 H14 EB4 200 H14 EB4 200 7.377 0.247 3.367 1273 H13 EB4 200 H13 EB4 200 -1.960 -2.628 2.674 1274 H22 EB4 200 H22 EB4 200 0.284 -3.427 6.873 1275 H30 EB4 200 H30 EB4 200 0.381 -0.330 10.164 1276 H30A EB4 200 H9N EB4 200 -0.887 0.574 9.201 1277 H24 EB4 200 H24 EB4 200 0.661 2.136 10.270 1278 H28 EB4 200 H28 EB4 200 2.572 -3.481 7.748 1279 H28A EB4 200 H9L EB4 200 2.502 -3.530 5.978 1280 H23 EB4 200 H23 EB4 200 5.948 -0.647 7.869 1281 H29 EB4 200 H29 EB4 200 4.701 0.354 9.745 1282 H29A EB4 200 H9M EB4 200 5.284 1.632 8.569 1283 H21 ACD 300 HA3 ACD 300 0.526 10.453 -11.924 1284 H22 ACD 300 HA4 ACD 300 0.760 11.539 -10.537 1285 H31 ACD 300 HA1 ACD 300 0.492 8.505 -10.390 1286 H32 ACD 300 HA2 ACD 300 2.005 9.421 -10.226 1287 H41 ACD 300 HA0 ACD 300 -0.433 9.675 -8.407 1288 H42 ACD 300 HAZ ACD 300 1.076 10.608 -8.260 1289 H5 ACD 300 HAY ACD 300 2.216 8.084 -8.081 1290 H6 ACD 300 HAX ACD 300 1.052 7.222 -5.904 1291 H71 ACD 300 HAV ACD 300 -0.984 9.486 -6.653 1292 H72 ACD 300 HAW ACD 300 -1.521 7.886 -6.097 1293 H8 ACD 300 HAU ACD 300 -0.516 10.164 -4.350 1294 H9 ACD 300 HAT ACD 300 -0.564 8.446 -2.389 1295 H101 ACD 300 HAR ACD 300 -1.305 6.451 -4.646 1296 H102 ACD 300 HAS ACD 300 0.187 6.134 -3.728 1297 H11 ACD 300 HAQ ACD 300 -2.694 5.822 -2.684 1298 H12 ACD 300 HAP ACD 300 -1.503 5.075 -0.467 1299 H131 ACD 300 HAN ACD 300 0.965 6.606 -1.637 1300 H132 ACD 300 HAO ACD 300 1.098 4.798 -1.365 1301 H14 ACD 300 HAM ACD 300 0.959 5.120 1.040 1302 H15 ACD 300 HAL ACD 300 1.183 7.546 1.978 1303 H161 ACD 300 HAJ ACD 300 -0.100 8.532 -0.547 1304 H162 ACD 300 HAK ACD 300 0.861 9.515 0.581 1305 H171 ACD 300 HAH ACD 300 2.932 8.829 -0.493 1306 H172 ACD 300 HAI ACD 300 2.075 7.671 -1.530 1307 H181 ACD 300 HAF ACD 300 0.701 9.707 -2.367 1308 H182 ACD 300 HAG ACD 300 1.947 10.707 -1.589 1309 H191 ACD 300 HAD ACD 300 3.694 9.738 -2.940 1310 H192 ACD 300 HAE ACD 300 2.589 8.501 -3.585 1311 H201 ACD 300 HAA ACD 300 2.918 10.288 -5.235 1312 H202 ACD 300 HAB ACD 300 2.395 11.514 -4.058 1313 H203 ACD 300 HAC ACD 300 1.238 10.307 -4.666 Start of MODEL 14 1 H1 MET 1 HT1 MET 1 6.256 21.289 -27.465 2 H2 MET 1 HT2 MET 1 6.801 22.378 -26.279 3 H3 MET 1 HT3 MET 1 5.136 22.172 -26.549 4 HA MET 1 HA MET 1 6.123 19.648 -26.009 5 HB2 MET 1 HB2 MET 1 7.134 21.768 -24.087 6 HB3 MET 1 HB1 MET 1 7.140 20.033 -23.766 7 HG2 MET 1 HG2 MET 1 8.540 19.703 -25.810 8 HG3 MET 1 HG1 MET 1 8.611 21.454 -26.004 9 HE1 MET 1 HE1 MET 1 11.342 21.672 -25.769 10 HE2 MET 1 HE2 MET 1 12.155 20.417 -24.837 11 HE3 MET 1 HE3 MET 1 10.999 19.976 -26.102 12 H THR 2 HN THR 2 4.816 18.692 -24.364 13 HA THR 2 HA THR 2 2.238 19.860 -24.094 14 HB THR 2 HB THR 2 3.443 17.539 -22.568 15 HG1 THR 2 HG1 THR 2 1.809 16.719 -24.409 16 HG21 THR 2 HG21 THR 2 0.982 16.874 -22.478 17 HG22 THR 2 HG22 THR 2 1.444 18.246 -21.469 18 HG23 THR 2 HG23 THR 2 0.617 18.518 -23.003 19 H VAL 3 HN VAL 3 1.338 21.028 -22.482 20 HA VAL 3 HA VAL 3 2.989 22.384 -20.637 21 HB VAL 3 HB VAL 3 0.823 23.237 -21.560 22 HG11 VAL 3 HG11 VAL 3 -0.472 21.497 -19.454 23 HG12 VAL 3 HG12 VAL 3 -1.257 22.437 -20.724 24 HG13 VAL 3 HG13 VAL 3 -0.340 20.988 -21.137 25 HG21 VAL 3 HG21 VAL 3 1.813 24.332 -19.623 26 HG22 VAL 3 HG22 VAL 3 0.068 24.238 -19.388 27 HG23 VAL 3 HG23 VAL 3 1.132 23.115 -18.544 28 HA PRO 4 HA PRO 4 2.976 19.191 -17.481 29 HB2 PRO 4 HB2 PRO 4 4.237 20.541 -15.488 30 HB3 PRO 4 HB1 PRO 4 5.094 19.969 -16.935 31 HG2 PRO 4 HG2 PRO 4 4.075 22.703 -16.300 32 HG3 PRO 4 HG1 PRO 4 5.614 22.217 -17.036 33 HD2 PRO 4 HD2 PRO 4 3.475 23.130 -18.499 34 HD3 PRO 4 HD1 PRO 4 4.691 22.006 -19.147 35 H ASP 5 HN ASP 5 2.420 19.124 -14.999 36 HA ASP 5 HA ASP 5 0.603 21.049 -13.949 37 HB2 ASP 5 HB2 ASP 5 -1.455 19.697 -14.064 38 HB3 ASP 5 HB1 ASP 5 -0.887 20.146 -15.671 39 H ARG 6 HN ARG 6 1.834 17.761 -13.987 40 HA ARG 6 HA ARG 6 0.997 16.972 -11.408 41 HB2 ARG 6 HB2 ARG 6 3.536 16.085 -12.782 42 HB3 ARG 6 HB1 ARG 6 2.562 15.182 -11.619 43 HG2 ARG 6 HG2 ARG 6 0.682 15.154 -13.231 44 HG3 ARG 6 HG1 ARG 6 1.685 16.013 -14.401 45 HD2 ARG 6 HD2 ARG 6 2.264 13.281 -13.225 46 HD3 ARG 6 HD1 ARG 6 1.725 13.608 -14.869 47 HE ARG 6 HE ARG 6 4.183 14.958 -14.107 48 HH11 ARG 6 HH21 ARG 6 2.677 12.156 -15.470 49 HH12 ARG 6 HH22 ARG 6 4.080 11.663 -16.357 50 HH21 ARG 6 HH11 ARG 6 6.027 14.319 -15.269 51 HH22 ARG 6 HH12 ARG 6 5.978 12.888 -16.243 52 H SER 7 HN SER 7 3.708 18.865 -12.550 53 HA SER 7 HA SER 7 5.441 18.812 -10.403 54 HB2 SER 7 HB2 SER 7 5.803 20.052 -12.544 55 HB3 SER 7 HB1 SER 7 4.682 21.285 -11.973 56 HG SER 7 HG SER 7 6.145 21.293 -10.041 57 H GLU 8 HN GLU 8 2.324 20.355 -10.671 58 HA GLU 8 HA GLU 8 2.481 22.188 -8.562 59 HB2 GLU 8 HB2 GLU 8 0.112 20.616 -9.593 60 HB3 GLU 8 HB1 GLU 8 -0.002 21.982 -8.485 61 HG2 GLU 8 HG2 GLU 8 1.182 23.395 -10.169 62 HG3 GLU 8 HG1 GLU 8 1.157 22.031 -11.286 63 H ILE 9 HN ILE 9 1.333 18.786 -8.486 64 HA ILE 9 HA ILE 9 1.158 18.910 -5.574 65 HB ILE 9 HB ILE 9 -0.545 17.676 -6.962 66 HG12 ILE 9 HG12 ILE 9 1.048 16.092 -4.914 67 HG13 ILE 9 HG11 ILE 9 -0.246 17.233 -4.556 68 HG21 ILE 9 HG21 ILE 9 0.061 15.500 -7.858 69 HG22 ILE 9 HG22 ILE 9 1.146 16.706 -8.552 70 HG23 ILE 9 HG23 ILE 9 1.704 15.659 -7.251 71 HD11 ILE 9 HD11 ILE 9 -0.580 14.701 -6.194 72 HD12 ILE 9 HD12 ILE 9 -1.035 14.876 -4.505 73 HD13 ILE 9 HD13 ILE 9 -1.857 15.817 -5.745 74 H ALA 10 HN ALA 10 3.197 17.479 -8.053 75 HA ALA 10 HA ALA 10 4.605 15.706 -6.435 76 HB1 ALA 10 HB1 ALA 10 6.298 15.613 -8.082 77 HB2 ALA 10 HB2 ALA 10 5.913 17.231 -8.668 78 HB3 ALA 10 HB3 ALA 10 4.793 15.898 -8.955 79 H GLY 11 HN GLY 11 6.207 15.858 -4.975 80 HA2 GLY 11 HA2 GLY 11 8.143 17.084 -4.122 81 HA3 GLY 11 HA1 GLY 11 7.218 18.569 -4.359 82 H LYS 12 HN LYS 12 4.698 17.357 -3.476 83 HA LYS 12 HA LYS 12 5.048 16.405 -0.791 84 HB2 LYS 12 HB2 LYS 12 5.581 18.876 -0.627 85 HB3 LYS 12 HB1 LYS 12 3.895 19.181 -1.048 86 HG2 LYS 12 HG2 LYS 12 3.292 17.599 0.883 87 HG3 LYS 12 HG1 LYS 12 4.977 17.746 1.382 88 HD2 LYS 12 HD2 LYS 12 3.102 20.093 0.961 89 HD3 LYS 12 HD1 LYS 12 3.477 19.385 2.532 90 HE2 LYS 12 HE2 LYS 12 4.992 21.180 2.380 91 HE3 LYS 12 HE1 LYS 12 5.963 19.797 1.878 92 HZ1 LYS 12 HZ1 LYS 12 5.672 22.061 0.461 93 HZ2 LYS 12 HZ2 LYS 12 6.111 20.561 -0.204 94 HZ3 LYS 12 HZ3 LYS 12 4.493 21.069 -0.256 95 H TRP 13 HN TRP 13 3.454 14.909 -0.783 96 HA TRP 13 HA TRP 13 0.758 15.676 -1.773 97 HB2 TRP 13 HB2 TRP 13 2.132 12.974 -1.529 98 HB3 TRP 13 HB1 TRP 13 0.434 13.131 -1.912 99 HD1 TRP 13 HD1 TRP 13 3.525 14.950 -3.340 100 HE1 TRP 13 HE1 TRP 13 3.428 14.652 -5.886 101 HE3 TRP 13 HE3 TRP 13 -0.755 12.205 -3.788 102 HZ2 TRP 13 HZ2 TRP 13 1.859 13.390 -7.830 103 HZ3 TRP 13 HZ3 TRP 13 -1.544 11.482 -6.026 104 HH2 TRP 13 HH2 TRP 13 -0.264 12.094 -8.060 105 H TYR 14 HN TYR 14 -0.749 15.883 -0.125 106 HA TYR 14 HA TYR 14 0.043 14.991 2.553 107 HB2 TYR 14 HB2 TYR 14 -1.221 17.299 1.459 108 HB3 TYR 14 HB1 TYR 14 -2.409 16.514 2.488 109 HD1 TYR 14 HD1 TYR 14 1.337 16.859 2.755 110 HD2 TYR 14 HD2 TYR 14 -2.501 17.650 4.516 111 HE1 TYR 14 HE1 TYR 14 2.441 17.811 4.755 112 HE2 TYR 14 HE2 TYR 14 -1.387 18.599 6.518 113 HH TYR 14 HH TYR 14 0.794 19.628 7.086 114 H VAL 15 HN VAL 15 -0.877 13.336 3.563 115 HA VAL 15 HA VAL 15 -3.298 12.092 2.400 116 HB VAL 15 HB VAL 15 -1.068 11.047 4.157 117 HG11 VAL 15 HG11 VAL 15 -2.373 8.845 3.969 118 HG12 VAL 15 HG12 VAL 15 -3.010 10.039 5.098 119 HG13 VAL 15 HG13 VAL 15 -3.762 9.833 3.517 120 HG21 VAL 15 HG21 VAL 15 -0.880 11.200 1.602 121 HG22 VAL 15 HG22 VAL 15 -0.577 9.621 2.325 122 HG23 VAL 15 HG23 VAL 15 -2.127 9.953 1.551 123 H VAL 16 HN VAL 16 -5.197 12.257 3.538 124 HA VAL 16 HA VAL 16 -4.997 12.914 6.419 125 HB VAL 16 HB VAL 16 -6.674 14.529 6.298 126 HG11 VAL 16 HG11 VAL 16 -5.061 14.841 3.747 127 HG12 VAL 16 HG12 VAL 16 -5.788 16.140 4.686 128 HG13 VAL 16 HG13 VAL 16 -4.457 15.205 5.350 129 HG21 VAL 16 HG21 VAL 16 -7.820 14.976 4.013 130 HG22 VAL 16 HG22 VAL 16 -7.231 13.380 3.553 131 HG23 VAL 16 HG23 VAL 16 -8.342 13.551 4.911 132 H ALA 17 HN ALA 17 -6.693 11.157 3.914 133 HA ALA 17 HA ALA 17 -8.364 9.958 6.060 134 HB1 ALA 17 HB1 ALA 17 -9.194 10.021 3.178 135 HB2 ALA 17 HB2 ALA 17 -9.548 11.363 4.270 136 HB3 ALA 17 HB3 ALA 17 -10.176 9.753 4.614 137 H LEU 18 HN LEU 18 -9.112 7.826 5.623 138 HA LEU 18 HA LEU 18 -7.586 6.206 3.770 139 HB2 LEU 18 HB2 LEU 18 -6.074 6.285 5.703 140 HB3 LEU 18 HB1 LEU 18 -7.370 5.698 6.746 141 HG LEU 18 HG LEU 18 -6.929 4.048 4.325 142 HD11 LEU 18 HD11 LEU 18 -4.824 4.030 6.497 143 HD12 LEU 18 HD12 LEU 18 -4.894 2.979 5.086 144 HD13 LEU 18 HD13 LEU 18 -4.585 4.703 4.886 145 HD21 LEU 18 HD21 LEU 18 -7.152 3.447 7.286 146 HD22 LEU 18 HD22 LEU 18 -8.438 3.320 6.090 147 HD23 LEU 18 HD23 LEU 18 -7.061 2.224 6.021 148 H ALA 19 HN ALA 19 -8.446 4.185 3.426 149 HA ALA 19 HA ALA 19 -10.893 3.424 4.835 150 HB1 ALA 19 HB1 ALA 19 -11.001 3.187 1.867 151 HB2 ALA 19 HB2 ALA 19 -11.203 4.807 2.532 152 HB3 ALA 19 HB3 ALA 19 -12.297 3.514 3.016 153 H SER 20 HN SER 20 -11.117 1.207 4.939 154 HA SER 20 HA SER 20 -9.654 -0.561 3.201 155 HB2 SER 20 HB2 SER 20 -7.851 0.364 4.703 156 HB3 SER 20 HB1 SER 20 -8.676 -0.410 6.052 157 HG SER 20 HG SER 20 -7.030 -1.726 5.110 158 H ASN 21 HN ASN 21 -9.539 -2.825 4.315 159 HA ASN 21 HA ASN 21 -12.180 -3.335 5.535 160 HB2 ASN 21 HB2 ASN 21 -11.633 -4.347 3.231 161 HB3 ASN 21 HB1 ASN 21 -10.485 -5.366 4.095 162 HD21 ASN 21 HD21 ASN 21 -12.997 -6.223 2.720 163 HD22 ASN 21 HD22 ASN 21 -13.945 -6.961 3.919 164 H THR 22 HN THR 22 -8.891 -3.221 5.968 165 HA THR 22 HA THR 22 -8.620 -5.330 7.885 166 HB THR 22 HB THR 22 -6.695 -3.077 7.936 167 HG1 THR 22 HG1 THR 22 -7.336 -3.125 5.746 168 HG21 THR 22 HG21 THR 22 -5.112 -4.837 8.006 169 HG22 THR 22 HG22 THR 22 -6.474 -5.401 8.976 170 HG23 THR 22 HG23 THR 22 -6.258 -5.995 7.330 171 H GLU 23 HN GLU 23 -10.112 -5.041 9.534 172 HA GLU 23 HA GLU 23 -11.011 -2.792 10.758 173 HB2 GLU 23 HB2 GLU 23 -10.204 -5.390 12.076 174 HB3 GLU 23 HB1 GLU 23 -11.119 -4.123 12.893 175 HG2 GLU 23 HG2 GLU 23 -12.841 -4.264 11.086 176 HG3 GLU 23 HG1 GLU 23 -11.953 -5.620 10.393 177 H PHE 24 HN PHE 24 -7.854 -4.203 11.010 178 HA PHE 24 HA PHE 24 -6.856 -2.859 13.250 179 HB2 PHE 24 HB2 PHE 24 -5.456 -4.556 12.585 180 HB3 PHE 24 HB1 PHE 24 -5.720 -4.244 10.873 181 HD1 PHE 24 HD2 PHE 24 -3.884 -3.131 13.894 182 HD2 PHE 24 HD1 PHE 24 -4.333 -2.724 9.643 183 HE1 PHE 24 HE2 PHE 24 -1.756 -1.865 13.789 184 HE2 PHE 24 HE1 PHE 24 -2.206 -1.460 9.536 185 HZ PHE 24 HZ PHE 24 -0.915 -1.029 11.612 186 H PHE 25 HN PHE 25 -6.710 -1.875 9.772 187 HA PHE 25 HA PHE 25 -5.232 0.474 10.222 188 HB2 PHE 25 HB2 PHE 25 -6.769 -0.741 8.013 189 HB3 PHE 25 HB1 PHE 25 -6.664 1.014 7.942 190 HD1 PHE 25 HD2 PHE 25 -4.156 1.880 8.685 191 HD2 PHE 25 HD1 PHE 25 -5.107 -1.866 6.819 192 HE1 PHE 25 HE2 PHE 25 -1.845 1.730 7.811 193 HE2 PHE 25 HE1 PHE 25 -2.797 -2.021 5.949 194 HZ PHE 25 HZ PHE 25 -1.163 -0.221 6.444 195 H LEU 26 HN LEU 26 -8.766 0.028 9.913 196 HA LEU 26 HA LEU 26 -9.361 2.805 10.185 197 HB2 LEU 26 HB2 LEU 26 -11.625 1.444 11.132 198 HB3 LEU 26 HB1 LEU 26 -11.348 1.980 9.478 199 HG LEU 26 HG LEU 26 -10.236 -0.657 10.433 200 HD11 LEU 26 HD11 LEU 26 -12.382 -1.595 9.297 201 HD12 LEU 26 HD12 LEU 26 -12.505 -1.001 10.952 202 HD13 LEU 26 HD13 LEU 26 -13.060 -0.001 9.614 203 HD21 LEU 26 HD21 LEU 26 -10.134 -1.162 8.116 204 HD22 LEU 26 HD22 LEU 26 -11.279 0.113 7.701 205 HD23 LEU 26 HD23 LEU 26 -9.639 0.528 8.199 206 H ARG 27 HN ARG 27 -8.825 0.207 12.380 207 HA ARG 27 HA ARG 27 -9.836 1.479 14.733 208 HB2 ARG 27 HB2 ARG 27 -9.493 -0.965 14.598 209 HB3 ARG 27 HB1 ARG 27 -7.750 -0.706 14.526 210 HG2 ARG 27 HG2 ARG 27 -7.668 0.156 16.730 211 HG3 ARG 27 HG1 ARG 27 -9.409 0.427 16.782 212 HD2 ARG 27 HD2 ARG 27 -8.944 -1.529 18.105 213 HD3 ARG 27 HD1 ARG 27 -9.724 -2.070 16.623 214 HE ARG 27 HE ARG 27 -6.912 -2.461 17.364 215 HH11 ARG 27 HH21 ARG 27 -9.450 -2.721 15.016 216 HH12 ARG 27 HH22 ARG 27 -8.621 -3.899 14.056 217 HH21 ARG 27 HH11 ARG 27 -5.828 -4.002 16.105 218 HH22 ARG 27 HH12 ARG 27 -6.574 -4.624 14.670 219 H GLU 28 HN GLU 28 -6.537 1.102 13.427 220 HA GLU 28 HA GLU 28 -5.418 2.775 15.496 221 HB2 GLU 28 HB2 GLU 28 -4.175 1.634 12.990 222 HB3 GLU 28 HB1 GLU 28 -3.297 2.425 14.299 223 HG2 GLU 28 HG2 GLU 28 -5.057 -0.011 14.679 224 HG3 GLU 28 HG1 GLU 28 -3.309 -0.086 14.460 225 H LYS 29 HN LYS 29 -6.062 3.250 11.967 226 HA LYS 29 HA LYS 29 -4.737 5.723 11.830 227 HB2 LYS 29 HB2 LYS 29 -7.030 4.643 10.193 228 HB3 LYS 29 HB1 LYS 29 -6.111 6.088 9.788 229 HG2 LYS 29 HG2 LYS 29 -4.709 3.464 10.292 230 HG3 LYS 29 HG1 LYS 29 -5.404 3.817 8.717 231 HD2 LYS 29 HD2 LYS 29 -3.312 5.497 10.141 232 HD3 LYS 29 HD1 LYS 29 -3.023 4.433 8.774 233 HE2 LYS 29 HE2 LYS 29 -5.015 5.968 7.743 234 HE3 LYS 29 HE1 LYS 29 -4.261 7.131 8.830 235 HZ1 LYS 29 HZ1 LYS 29 -2.234 6.951 7.750 236 HZ2 LYS 29 HZ2 LYS 29 -2.637 5.479 7.002 237 HZ3 LYS 29 HZ3 LYS 29 -3.351 6.923 6.470 238 H ASP 30 HN ASP 30 -7.989 4.900 12.833 239 HA ASP 30 HA ASP 30 -9.142 7.459 12.733 240 HB2 ASP 30 HB2 ASP 30 -10.408 5.359 13.176 241 HB3 ASP 30 HB1 ASP 30 -9.670 5.285 14.776 242 H LYS 31 HN LYS 31 -6.687 6.139 14.664 243 HA LYS 31 HA LYS 31 -6.960 8.144 16.781 244 HB2 LYS 31 HB2 LYS 31 -6.587 5.907 17.545 245 HB3 LYS 31 HB1 LYS 31 -5.233 5.692 16.452 246 HG2 LYS 31 HG2 LYS 31 -4.776 8.006 18.166 247 HG3 LYS 31 HG1 LYS 31 -5.133 6.587 19.132 248 HD2 LYS 31 HD2 LYS 31 -2.761 6.624 18.799 249 HD3 LYS 31 HD1 LYS 31 -3.401 5.331 17.788 250 HE2 LYS 31 HE2 LYS 31 -3.243 6.706 15.802 251 HE3 LYS 31 HE1 LYS 31 -2.862 8.133 16.766 252 HZ1 LYS 31 HZ1 LYS 31 -0.790 7.451 16.111 253 HZ2 LYS 31 HZ2 LYS 31 -0.922 6.676 17.616 254 HZ3 LYS 31 HZ3 LYS 31 -1.176 5.799 16.188 255 H MET 32 HN MET 32 -4.969 7.466 13.922 256 HA MET 32 HA MET 32 -2.842 9.231 14.785 257 HB2 MET 32 HB2 MET 32 -3.353 7.381 12.572 258 HB3 MET 32 HB1 MET 32 -2.588 8.864 12.025 259 HG2 MET 32 HG2 MET 32 -0.632 8.447 13.188 260 HG3 MET 32 HG1 MET 32 -1.452 7.554 14.464 261 HE1 MET 32 HE1 MET 32 -2.889 5.518 13.882 262 HE2 MET 32 HE2 MET 32 -2.047 4.111 13.250 263 HE3 MET 32 HE3 MET 32 -1.393 4.987 14.639 264 H LYS 33 HN LYS 33 -2.201 10.758 12.735 265 HA LYS 33 HA LYS 33 -4.547 12.473 12.204 266 HB2 LYS 33 HB2 LYS 33 -1.831 13.661 12.690 267 HB3 LYS 33 HB1 LYS 33 -3.420 14.406 12.832 268 HG2 LYS 33 HG2 LYS 33 -2.990 14.087 15.078 269 HG3 LYS 33 HG1 LYS 33 -3.718 12.523 14.726 270 HD2 LYS 33 HD2 LYS 33 -1.335 11.711 14.204 271 HD3 LYS 33 HD1 LYS 33 -0.782 13.203 14.962 272 HE2 LYS 33 HE2 LYS 33 -2.439 11.013 16.238 273 HE3 LYS 33 HE1 LYS 33 -0.797 11.495 16.665 274 HZ1 LYS 33 HZ1 LYS 33 -3.314 12.687 17.397 275 HZ2 LYS 33 HZ2 LYS 33 -1.800 12.788 18.162 276 HZ3 LYS 33 HZ3 LYS 33 -2.160 13.811 16.858 277 H MET 34 HN MET 34 -3.083 14.435 10.763 278 HA MET 34 HA MET 34 -3.144 13.440 8.189 279 HB2 MET 34 HB2 MET 34 -3.299 15.819 9.147 280 HB3 MET 34 HB1 MET 34 -1.547 15.821 9.125 281 HG2 MET 34 HG2 MET 34 -1.441 16.039 6.864 282 HG3 MET 34 HG1 MET 34 -2.767 14.927 6.588 283 HE1 MET 34 HE1 MET 34 -5.898 16.667 6.878 284 HE2 MET 34 HE2 MET 34 -4.957 15.358 7.588 285 HE3 MET 34 HE3 MET 34 -5.284 16.824 8.514 286 H ALA 35 HN ALA 35 -1.688 12.525 6.848 287 HA ALA 35 HA ALA 35 1.126 12.288 7.738 288 HB1 ALA 35 HB1 ALA 35 0.456 10.075 7.599 289 HB2 ALA 35 HB2 ALA 35 0.963 10.334 5.931 290 HB3 ALA 35 HB3 ALA 35 -0.746 10.409 6.357 291 H MET 36 HN MET 36 2.708 12.219 5.883 292 HA MET 36 HA MET 36 1.769 13.825 3.577 293 HB2 MET 36 HB2 MET 36 4.435 14.610 4.043 294 HB3 MET 36 HB1 MET 36 2.987 15.574 4.313 295 HG2 MET 36 HG2 MET 36 4.032 13.628 6.379 296 HG3 MET 36 HG1 MET 36 4.554 15.309 6.312 297 HE1 MET 36 HE1 MET 36 3.919 14.822 8.662 298 HE2 MET 36 HE2 MET 36 2.414 15.441 9.333 299 HE3 MET 36 HE3 MET 36 2.554 13.734 8.892 300 H ALA 37 HN ALA 37 3.260 13.796 1.745 301 HA ALA 37 HA ALA 37 5.138 11.587 1.559 302 HB1 ALA 37 HB1 ALA 37 3.789 10.748 -0.522 303 HB2 ALA 37 HB2 ALA 37 2.427 11.532 0.280 304 HB3 ALA 37 HB3 ALA 37 3.298 10.234 1.093 305 H ARG 38 HN ARG 38 6.244 11.511 -0.526 306 HA ARG 38 HA ARG 38 6.020 13.980 -2.150 307 HB2 ARG 38 HB2 ARG 38 8.606 12.797 -1.097 308 HB3 ARG 38 HB1 ARG 38 8.465 14.191 -2.168 309 HG2 ARG 38 HG2 ARG 38 7.074 15.313 -0.387 310 HG3 ARG 38 HG1 ARG 38 7.470 13.972 0.685 311 HD2 ARG 38 HD2 ARG 38 9.486 15.792 -0.662 312 HD3 ARG 38 HD1 ARG 38 8.995 15.891 1.025 313 HE ARG 38 HE ARG 38 10.221 13.927 1.471 314 HH11 ARG 38 HH21 ARG 38 10.168 14.732 -1.900 315 HH12 ARG 38 HH22 ARG 38 11.452 13.648 -2.316 316 HH21 ARG 38 HH11 ARG 38 11.902 12.506 0.925 317 HH22 ARG 38 HH12 ARG 38 12.432 12.389 -0.720 318 H ILE 39 HN ILE 39 6.052 13.535 -4.361 319 HA ILE 39 HA ILE 39 6.817 10.842 -5.197 320 HB ILE 39 HB ILE 39 4.470 11.478 -5.232 321 HG12 ILE 39 HG12 ILE 39 5.294 11.352 -8.116 322 HG13 ILE 39 HG11 ILE 39 5.616 9.976 -7.066 323 HG21 ILE 39 HG21 ILE 39 3.766 13.122 -6.825 324 HG22 ILE 39 HG22 ILE 39 4.820 13.803 -5.592 325 HG23 ILE 39 HG23 ILE 39 5.417 13.496 -7.215 326 HD11 ILE 39 HD11 ILE 39 2.891 11.222 -6.906 327 HD12 ILE 39 HD12 ILE 39 3.252 10.233 -8.314 328 HD13 ILE 39 HD13 ILE 39 3.372 9.534 -6.705 329 H SER 40 HN SER 40 8.229 10.697 -6.992 330 HA SER 40 HA SER 40 8.908 13.213 -8.354 331 HB2 SER 40 HB2 SER 40 11.092 13.269 -7.745 332 HB3 SER 40 HB1 SER 40 10.474 12.450 -6.319 333 HG SER 40 HG SER 40 12.264 11.354 -7.262 334 H PHE 41 HN PHE 41 9.698 12.990 -10.423 335 HA PHE 41 HA PHE 41 8.950 10.506 -11.687 336 HB2 PHE 41 HB2 PHE 41 10.023 12.969 -13.034 337 HB3 PHE 41 HB1 PHE 41 8.995 11.708 -13.720 338 HD1 PHE 41 HD1 PHE 41 9.118 14.594 -11.420 339 HD2 PHE 41 HD2 PHE 41 6.616 11.618 -13.246 340 HE1 PHE 41 HE1 PHE 41 7.102 15.828 -10.671 341 HE2 PHE 41 HE2 PHE 41 4.601 12.852 -12.498 342 HZ PHE 41 HZ PHE 41 4.845 14.958 -11.210 343 H LEU 42 HN LEU 42 10.589 9.042 -11.106 344 HA LEU 42 HA LEU 42 13.373 9.464 -11.583 345 HB2 LEU 42 HB2 LEU 42 11.820 6.864 -11.711 346 HB3 LEU 42 HB1 LEU 42 13.563 7.011 -11.575 347 HG LEU 42 HG LEU 42 11.708 8.230 -9.527 348 HD11 LEU 42 HD11 LEU 42 12.174 6.134 -8.186 349 HD12 LEU 42 HD12 LEU 42 11.129 5.881 -9.583 350 HD13 LEU 42 HD13 LEU 42 12.827 5.413 -9.656 351 HD21 LEU 42 HD21 LEU 42 13.977 9.030 -9.382 352 HD22 LEU 42 HD22 LEU 42 13.785 7.832 -8.105 353 HD23 LEU 42 HD23 LEU 42 14.630 7.406 -9.590 354 H GLY 43 HN GLY 43 10.745 8.048 -13.400 355 HA2 GLY 43 HA2 GLY 43 11.809 8.875 -15.952 356 HA3 GLY 43 HA1 GLY 43 11.795 7.126 -15.711 357 H GLU 44 HN GLU 44 10.225 7.860 -17.716 358 HA GLU 44 HA GLU 44 7.603 8.711 -17.003 359 HB2 GLU 44 HB2 GLU 44 8.606 7.170 -19.411 360 HB3 GLU 44 HB1 GLU 44 6.976 7.827 -19.256 361 HG2 GLU 44 HG2 GLU 44 9.494 9.497 -19.031 362 HG3 GLU 44 HG1 GLU 44 8.564 9.321 -20.517 363 H ASP 45 HN ASP 45 9.231 5.669 -16.827 364 HA ASP 45 HA ASP 45 6.673 4.314 -16.174 365 HB2 ASP 45 HB2 ASP 45 8.050 2.204 -16.683 366 HB3 ASP 45 HB1 ASP 45 7.554 3.194 -18.053 367 H GLU 46 HN GLU 46 8.991 5.842 -14.635 368 HA GLU 46 HA GLU 46 8.922 4.012 -12.341 369 HB2 GLU 46 HB2 GLU 46 11.502 5.251 -13.315 370 HB3 GLU 46 HB1 GLU 46 11.299 4.122 -11.974 371 HG2 GLU 46 HG2 GLU 46 10.355 2.477 -13.675 372 HG3 GLU 46 HG1 GLU 46 10.922 3.581 -14.925 373 H LEU 47 HN LEU 47 8.501 5.081 -10.504 374 HA LEU 47 HA LEU 47 9.266 7.911 -10.246 375 HB2 LEU 47 HB2 LEU 47 6.573 7.221 -9.180 376 HB3 LEU 47 HB1 LEU 47 7.172 8.741 -9.831 377 HG LEU 47 HG LEU 47 6.499 6.294 -11.491 378 HD11 LEU 47 HD11 LEU 47 5.015 8.872 -10.937 379 HD12 LEU 47 HD12 LEU 47 4.567 7.736 -12.206 380 HD13 LEU 47 HD13 LEU 47 4.492 7.246 -10.514 381 HD21 LEU 47 HD21 LEU 47 8.077 8.571 -12.110 382 HD22 LEU 47 HD22 LEU 47 7.453 7.378 -13.238 383 HD23 LEU 47 HD23 LEU 47 6.532 8.839 -12.896 384 H LYS 48 HN LYS 48 9.494 8.642 -8.127 385 HA LYS 48 HA LYS 48 9.827 6.494 -6.114 386 HB2 LYS 48 HB2 LYS 48 11.798 8.001 -6.893 387 HB3 LYS 48 HB1 LYS 48 11.029 9.250 -5.917 388 HG2 LYS 48 HG2 LYS 48 11.011 7.533 -4.012 389 HG3 LYS 48 HG1 LYS 48 12.117 6.582 -5.004 390 HD2 LYS 48 HD2 LYS 48 12.578 9.445 -4.110 391 HD3 LYS 48 HD1 LYS 48 13.360 8.021 -3.427 392 HE2 LYS 48 HE2 LYS 48 14.148 7.517 -5.826 393 HE3 LYS 48 HE1 LYS 48 13.684 9.180 -6.192 394 HZ1 LYS 48 HZ1 LYS 48 15.115 9.885 -4.321 395 HZ2 LYS 48 HZ2 LYS 48 15.651 8.281 -4.162 396 HZ3 LYS 48 HZ3 LYS 48 15.976 9.144 -5.585 397 H VAL 49 HN VAL 49 8.316 6.451 -4.497 398 HA VAL 49 HA VAL 49 7.037 9.016 -3.779 399 HB VAL 49 HB VAL 49 5.780 6.386 -4.371 400 HG11 VAL 49 HG11 VAL 49 5.218 6.499 -1.998 401 HG12 VAL 49 HG12 VAL 49 4.782 8.199 -2.149 402 HG13 VAL 49 HG13 VAL 49 3.804 6.964 -2.938 403 HG21 VAL 49 HG21 VAL 49 5.444 8.261 -5.820 404 HG22 VAL 49 HG22 VAL 49 3.930 7.970 -4.979 405 HG23 VAL 49 HG23 VAL 49 4.974 9.299 -4.478 406 H SER 50 HN SER 50 6.847 9.569 -1.784 407 HA SER 50 HA SER 50 8.248 7.930 0.245 408 HB2 SER 50 HB2 SER 50 9.225 10.116 -0.557 409 HB3 SER 50 HB1 SER 50 7.841 10.910 0.173 410 HG SER 50 HG SER 50 8.852 10.741 2.004 411 H TYR 51 HN TYR 51 7.349 7.700 2.311 412 HA TYR 51 HA TYR 51 4.622 8.796 2.681 413 HB2 TYR 51 HB2 TYR 51 5.569 6.265 4.002 414 HB3 TYR 51 HB1 TYR 51 3.926 6.782 3.644 415 HD1 TYR 51 HD2 TYR 51 7.127 6.013 1.799 416 HD2 TYR 51 HD1 TYR 51 2.849 5.719 1.900 417 HE1 TYR 51 HE2 TYR 51 7.170 4.715 -0.300 418 HE2 TYR 51 HE1 TYR 51 2.888 4.406 -0.205 419 HH TYR 51 HH TYR 51 4.853 4.339 -2.286 420 H ALA 52 HN ALA 52 4.359 9.994 4.493 421 HA ALA 52 HA ALA 52 6.313 9.679 6.695 422 HB1 ALA 52 HB1 ALA 52 5.412 12.154 5.264 423 HB2 ALA 52 HB2 ALA 52 7.024 11.709 5.819 424 HB3 ALA 52 HB3 ALA 52 5.815 12.251 6.980 425 H VAL 53 HN VAL 53 5.187 8.793 8.299 426 HA VAL 53 HA VAL 53 2.439 9.758 8.810 427 HB VAL 53 HB VAL 53 3.633 7.133 9.696 428 HG11 VAL 53 HG11 VAL 53 1.670 8.018 10.959 429 HG12 VAL 53 HG12 VAL 53 0.764 8.086 9.448 430 HG13 VAL 53 HG13 VAL 53 1.298 6.532 10.086 431 HG21 VAL 53 HG21 VAL 53 2.018 7.854 7.232 432 HG22 VAL 53 HG22 VAL 53 3.619 7.115 7.282 433 HG23 VAL 53 HG23 VAL 53 2.210 6.200 7.817 434 HA PRO 54 HA PRO 54 4.290 11.241 12.633 435 HB2 PRO 54 HB2 PRO 54 2.085 12.336 13.762 436 HB3 PRO 54 HB1 PRO 54 2.883 13.077 12.358 437 HG2 PRO 54 HG2 PRO 54 0.433 11.373 12.460 438 HG3 PRO 54 HG1 PRO 54 0.744 12.841 11.516 439 HD2 PRO 54 HD2 PRO 54 0.942 10.298 10.471 440 HD3 PRO 54 HD1 PRO 54 1.854 11.694 9.848 441 H LYS 55 HN LYS 55 4.526 10.418 14.695 442 HA LYS 55 HA LYS 55 2.466 8.717 15.854 443 HB2 LYS 55 HB2 LYS 55 3.917 7.290 14.307 444 HB3 LYS 55 HB1 LYS 55 5.219 7.568 15.460 445 HG2 LYS 55 HG2 LYS 55 3.750 6.680 17.275 446 HG3 LYS 55 HG1 LYS 55 2.533 6.298 16.055 447 HD2 LYS 55 HD2 LYS 55 4.358 4.950 14.869 448 HD3 LYS 55 HD1 LYS 55 5.300 5.118 16.351 449 HE2 LYS 55 HE2 LYS 55 4.120 3.036 16.528 450 HE3 LYS 55 HE1 LYS 55 3.298 4.172 17.598 451 HZ1 LYS 55 HZ1 LYS 55 2.019 4.587 15.286 452 HZ2 LYS 55 HZ2 LYS 55 2.371 2.930 15.156 453 HZ3 LYS 55 HZ3 LYS 55 1.489 3.506 16.485 454 HA PRO 56 HA PRO 56 4.475 11.465 18.984 455 HB2 PRO 56 HB2 PRO 56 2.316 10.044 20.515 456 HB3 PRO 56 HB1 PRO 56 2.798 11.752 20.573 457 HG2 PRO 56 HG2 PRO 56 0.626 10.981 19.242 458 HG3 PRO 56 HG1 PRO 56 1.673 12.273 18.627 459 HD2 PRO 56 HD2 PRO 56 1.360 9.483 17.640 460 HD3 PRO 56 HD1 PRO 56 1.846 10.945 16.750 461 H ASN 57 HN ASN 57 4.163 8.070 18.681 462 HA ASN 57 HA ASN 57 5.704 7.498 21.119 463 HB2 ASN 57 HB2 ASN 57 4.687 5.517 19.081 464 HB3 ASN 57 HB1 ASN 57 5.173 5.208 20.747 465 HD21 ASN 57 HD21 ASN 57 3.804 7.573 21.864 466 HD22 ASN 57 HD22 ASN 57 2.140 7.245 21.781 467 H GLY 58 HN GLY 58 6.064 7.724 17.667 468 HA2 GLY 58 HA2 GLY 58 8.811 7.933 17.607 469 HA3 GLY 58 HA1 GLY 58 8.484 6.210 17.449 470 H CYS 59 HN CYS 59 8.557 9.233 15.853 471 HA CYS 59 HA CYS 59 6.832 8.991 13.723 472 HB2 CYS 59 HB2 CYS 59 9.673 9.967 13.424 473 HB3 CYS 59 HB1 CYS 59 8.247 10.489 12.527 474 H ARG 60 HN ARG 60 6.909 8.087 11.669 475 HA ARG 60 HA ARG 60 9.040 6.091 11.162 476 HB2 ARG 60 HB2 ARG 60 6.056 5.689 10.837 477 HB3 ARG 60 HB1 ARG 60 7.290 4.573 10.249 478 HG2 ARG 60 HG2 ARG 60 8.155 4.365 12.584 479 HG3 ARG 60 HG1 ARG 60 6.820 5.379 13.134 480 HD2 ARG 60 HD2 ARG 60 5.228 3.724 12.123 481 HD3 ARG 60 HD1 ARG 60 6.604 2.684 11.768 482 HE ARG 60 HE ARG 60 6.519 3.444 14.535 483 HH11 ARG 60 HH21 ARG 60 5.198 1.341 12.126 484 HH12 ARG 60 HH22 ARG 60 4.774 0.094 13.250 485 HH21 ARG 60 HH11 ARG 60 5.967 1.812 16.015 486 HH22 ARG 60 HH12 ARG 60 5.210 0.359 15.452 487 H LYS 61 HN LYS 61 10.040 6.641 9.340 488 HA LYS 61 HA LYS 61 8.421 7.613 7.067 489 HB2 LYS 61 HB2 LYS 61 9.394 9.599 7.931 490 HB3 LYS 61 HB1 LYS 61 10.969 8.835 8.130 491 HG2 LYS 61 HG2 LYS 61 11.301 8.709 5.759 492 HG3 LYS 61 HG1 LYS 61 9.617 9.126 5.436 493 HD2 LYS 61 HD2 LYS 61 10.008 11.357 6.481 494 HD3 LYS 61 HD1 LYS 61 11.709 10.936 6.676 495 HE2 LYS 61 HE2 LYS 61 11.805 10.537 4.182 496 HE3 LYS 61 HE1 LYS 61 10.179 11.213 4.077 497 HZ1 LYS 61 HZ1 LYS 61 11.991 12.839 3.680 498 HZ2 LYS 61 HZ2 LYS 61 10.950 13.271 4.951 499 HZ3 LYS 61 HZ3 LYS 61 12.484 12.632 5.293 500 H TRP 62 HN TRP 62 8.827 6.673 5.218 501 HA TRP 62 HA TRP 62 11.406 5.370 4.698 502 HB2 TRP 62 HB2 TRP 62 10.324 3.265 4.023 503 HB3 TRP 62 HB1 TRP 62 10.021 3.606 5.728 504 HD1 TRP 62 HD1 TRP 62 8.304 4.032 2.298 505 HE1 TRP 62 HE1 TRP 62 5.750 3.973 2.663 506 HE3 TRP 62 HE3 TRP 62 8.143 3.709 7.392 507 HZ2 TRP 62 HZ2 TRP 62 3.895 3.778 4.817 508 HZ3 TRP 62 HZ3 TRP 62 5.968 3.589 8.575 509 HH2 TRP 62 HH2 TRP 62 3.844 3.622 7.295 510 H GLU 63 HN GLU 63 11.503 4.595 2.389 511 HA GLU 63 HA GLU 63 9.762 6.216 0.621 512 HB2 GLU 63 HB2 GLU 63 11.947 7.314 0.859 513 HB3 GLU 63 HB1 GLU 63 12.754 5.826 0.363 514 HG2 GLU 63 HG2 GLU 63 10.635 7.044 -1.399 515 HG3 GLU 63 HG1 GLU 63 12.275 7.683 -1.425 516 H THR 64 HN THR 64 9.223 5.317 -1.343 517 HA THR 64 HA THR 64 10.223 2.602 -1.937 518 HB THR 64 HB THR 64 7.292 3.304 -2.093 519 HG1 THR 64 HG1 THR 64 8.752 2.023 -0.024 520 HG21 THR 64 HG21 THR 64 7.983 1.444 -3.485 521 HG22 THR 64 HG22 THR 64 8.870 0.719 -2.144 522 HG23 THR 64 HG23 THR 64 7.110 0.810 -2.091 523 H THR 65 HN THR 65 10.306 2.059 -4.066 524 HA THR 65 HA THR 65 9.811 4.233 -6.000 525 HB THR 65 HB THR 65 11.509 1.738 -6.247 526 HG1 THR 65 HG1 THR 65 11.956 4.015 -5.029 527 HG21 THR 65 HG21 THR 65 12.365 2.971 -8.283 528 HG22 THR 65 HG22 THR 65 10.707 2.386 -8.418 529 HG23 THR 65 HG23 THR 65 11.017 4.090 -8.085 530 H PHE 66 HN PHE 66 8.573 3.875 -7.857 531 HA PHE 66 HA PHE 66 7.056 1.316 -7.881 532 HB2 PHE 66 HB2 PHE 66 5.226 2.620 -7.563 533 HB3 PHE 66 HB1 PHE 66 6.138 4.101 -7.865 534 HD1 PHE 66 HD1 PHE 66 5.119 1.077 -9.832 535 HD2 PHE 66 HD2 PHE 66 5.364 5.346 -9.688 536 HE1 PHE 66 HE1 PHE 66 4.166 1.208 -12.104 537 HE2 PHE 66 HE2 PHE 66 4.396 5.469 -11.978 538 HZ PHE 66 HZ PHE 66 3.815 3.399 -13.186 539 H LYS 67 HN LYS 67 7.102 0.173 -9.730 540 HA LYS 67 HA LYS 67 8.211 1.479 -12.146 541 HB2 LYS 67 HB2 LYS 67 8.356 -1.455 -11.414 542 HB3 LYS 67 HB1 LYS 67 9.160 -0.653 -12.761 543 HG2 LYS 67 HG2 LYS 67 9.656 0.143 -9.885 544 HG3 LYS 67 HG1 LYS 67 10.595 -1.111 -10.688 545 HD2 LYS 67 HD2 LYS 67 11.080 0.595 -12.519 546 HD3 LYS 67 HD1 LYS 67 10.396 1.812 -11.439 547 HE2 LYS 67 HE2 LYS 67 12.729 1.860 -11.004 548 HE3 LYS 67 HE1 LYS 67 12.042 0.929 -9.673 549 HZ1 LYS 67 HZ1 LYS 67 12.477 -1.021 -11.384 550 HZ2 LYS 67 HZ2 LYS 67 13.695 0.043 -11.906 551 HZ3 LYS 67 HZ3 LYS 67 13.671 -0.490 -10.296 552 H LYS 68 HN LYS 68 7.254 1.061 -14.099 553 HA LYS 68 HA LYS 68 4.455 0.441 -14.095 554 HB2 LYS 68 HB2 LYS 68 5.620 2.119 -15.591 555 HB3 LYS 68 HB1 LYS 68 6.235 0.743 -16.508 556 HG2 LYS 68 HG2 LYS 68 3.905 -0.038 -16.865 557 HG3 LYS 68 HG1 LYS 68 3.315 1.387 -16.007 558 HD2 LYS 68 HD2 LYS 68 4.493 2.824 -17.682 559 HD3 LYS 68 HD1 LYS 68 4.922 1.366 -18.577 560 HE2 LYS 68 HE2 LYS 68 2.181 2.535 -18.102 561 HE3 LYS 68 HE1 LYS 68 2.947 2.119 -19.636 562 HZ1 LYS 68 HZ1 LYS 68 2.939 -0.243 -18.782 563 HZ2 LYS 68 HZ2 LYS 68 1.875 0.291 -17.571 564 HZ3 LYS 68 HZ3 LYS 68 1.428 0.409 -19.204 565 H THR 69 HN THR 69 3.538 -1.475 -14.235 566 HA THR 69 HA THR 69 4.905 -3.642 -15.719 567 HB THR 69 HB THR 69 5.185 -4.012 -13.293 568 HG1 THR 69 HG1 THR 69 3.321 -5.685 -14.618 569 HG21 THR 69 HG21 THR 69 3.244 -4.340 -11.864 570 HG22 THR 69 HG22 THR 69 3.138 -2.747 -12.615 571 HG23 THR 69 HG23 THR 69 2.156 -4.078 -13.225 572 H SER 70 HN SER 70 3.258 -5.510 -16.035 573 HA SER 70 HA SER 70 0.994 -4.391 -17.441 574 HB2 SER 70 HB2 SER 70 2.351 -6.354 -18.260 575 HB3 SER 70 HB1 SER 70 1.637 -7.307 -16.963 576 HG SER 70 HG SER 70 -0.003 -5.811 -18.689 577 H ASP 71 HN ASP 71 0.547 -3.618 -14.960 578 HA ASP 71 HA ASP 71 -0.802 -5.431 -13.256 579 HB2 ASP 71 HB2 ASP 71 0.079 -3.327 -12.421 580 HB3 ASP 71 HB1 ASP 71 -1.001 -2.424 -13.482 581 H ASP 72 HN ASP 72 -2.583 -2.617 -14.364 582 HA ASP 72 HA ASP 72 -4.442 -4.072 -15.989 583 HB2 ASP 72 HB2 ASP 72 -5.122 -4.869 -13.750 584 HB3 ASP 72 HB1 ASP 72 -5.373 -3.199 -13.248 585 H GLY 73 HN GLY 73 -4.309 -2.494 -17.487 586 HA2 GLY 73 HA2 GLY 73 -4.966 -0.551 -18.544 587 HA3 GLY 73 HA1 GLY 73 -5.880 -0.136 -17.096 588 H GLU 74 HN GLU 74 -5.112 1.412 -15.790 589 HA GLU 74 HA GLU 74 -2.310 2.322 -16.182 590 HB2 GLU 74 HB2 GLU 74 -4.880 3.859 -15.977 591 HB3 GLU 74 HB1 GLU 74 -3.406 4.585 -15.337 592 HG2 GLU 74 HG2 GLU 74 -3.744 5.250 -17.673 593 HG3 GLU 74 HG1 GLU 74 -2.300 4.252 -17.519 594 H VAL 75 HN VAL 75 -1.610 1.004 -14.423 595 HA VAL 75 HA VAL 75 -2.254 2.178 -11.809 596 HB VAL 75 HB VAL 75 -1.907 -0.803 -12.125 597 HG11 VAL 75 HG11 VAL 75 -3.223 -0.404 -9.778 598 HG12 VAL 75 HG12 VAL 75 -1.467 -0.398 -9.896 599 HG13 VAL 75 HG13 VAL 75 -2.350 1.123 -9.872 600 HG21 VAL 75 HG21 VAL 75 -4.260 -1.098 -12.044 601 HG22 VAL 75 HG22 VAL 75 -4.538 0.584 -11.606 602 HG23 VAL 75 HG23 VAL 75 -4.026 0.172 -13.239 603 H TYR 76 HN TYR 76 -0.624 1.994 -10.267 604 HA TYR 76 HA TYR 76 2.054 1.614 -11.456 605 HB2 TYR 76 HB2 TYR 76 1.418 3.121 -8.926 606 HB3 TYR 76 HB1 TYR 76 2.802 3.315 -9.989 607 HD1 TYR 76 HD2 TYR 76 1.563 3.398 -12.674 608 HD2 TYR 76 HD1 TYR 76 0.281 5.198 -8.993 609 HE1 TYR 76 HE2 TYR 76 0.341 5.131 -13.944 610 HE2 TYR 76 HE1 TYR 76 -0.945 6.927 -10.265 611 HH TYR 76 HH TYR 76 -0.417 7.653 -13.353 612 H TYR 77 HN TYR 77 3.610 0.322 -10.468 613 HA TYR 77 HA TYR 77 2.798 -1.105 -7.995 614 HB2 TYR 77 HB2 TYR 77 2.081 -2.305 -10.166 615 HB3 TYR 77 HB1 TYR 77 3.794 -2.651 -10.374 616 HD1 TYR 77 HD2 TYR 77 5.021 -3.710 -8.291 617 HD2 TYR 77 HD1 TYR 77 0.763 -3.754 -8.878 618 HE1 TYR 77 HE2 TYR 77 4.820 -5.616 -6.725 619 HE2 TYR 77 HE1 TYR 77 0.571 -5.662 -7.309 620 HH TYR 77 HH TYR 77 1.794 -6.684 -5.501 621 H SER 78 HN SER 78 4.371 -1.431 -6.605 622 HA SER 78 HA SER 78 7.175 -1.077 -7.468 623 HB2 SER 78 HB2 SER 78 7.631 -0.707 -5.068 624 HB3 SER 78 HB1 SER 78 6.422 0.423 -5.671 625 HG SER 78 HG SER 78 5.620 -0.419 -3.795 626 H GLU 79 HN GLU 79 7.895 -3.034 -8.084 627 HA GLU 79 HA GLU 79 7.047 -5.532 -7.306 628 HB2 GLU 79 HB2 GLU 79 9.758 -4.603 -8.243 629 HB3 GLU 79 HB1 GLU 79 9.288 -6.290 -8.111 630 HG2 GLU 79 HG2 GLU 79 8.874 -5.678 -10.382 631 HG3 GLU 79 HG1 GLU 79 7.297 -5.729 -9.599 632 H GLU 80 HN GLU 80 9.605 -3.567 -5.809 633 HA GLU 80 HA GLU 80 10.473 -5.619 -4.035 634 HB2 GLU 80 HB2 GLU 80 10.864 -2.628 -4.015 635 HB3 GLU 80 HB1 GLU 80 11.632 -3.722 -2.865 636 HG2 GLU 80 HG2 GLU 80 12.635 -4.977 -4.761 637 HG3 GLU 80 HG1 GLU 80 11.921 -3.819 -5.881 638 H ALA 81 HN ALA 81 8.100 -3.006 -3.690 639 HA ALA 81 HA ALA 81 7.658 -3.803 -0.880 640 HB1 ALA 81 HB1 ALA 81 8.089 -1.384 -1.551 641 HB2 ALA 81 HB2 ALA 81 6.680 -1.685 -0.534 642 HB3 ALA 81 HB3 ALA 81 6.477 -1.407 -2.265 643 H LYS 82 HN LYS 82 6.502 -4.930 -3.634 644 HA LYS 82 HA LYS 82 4.371 -5.500 -4.464 645 HB2 LYS 82 HB2 LYS 82 4.275 -6.528 -1.618 646 HB3 LYS 82 HB1 LYS 82 3.348 -7.152 -2.983 647 HG2 LYS 82 HG2 LYS 82 5.378 -7.845 -4.120 648 HG3 LYS 82 HG1 LYS 82 6.377 -7.078 -2.887 649 HD2 LYS 82 HD2 LYS 82 6.383 -9.353 -2.259 650 HD3 LYS 82 HD1 LYS 82 5.157 -8.640 -1.212 651 HE2 LYS 82 HE2 LYS 82 3.376 -9.442 -2.643 652 HE3 LYS 82 HE1 LYS 82 4.533 -9.984 -3.858 653 HZ1 LYS 82 HZ1 LYS 82 3.555 -11.645 -2.130 654 HZ2 LYS 82 HZ2 LYS 82 5.189 -11.747 -2.587 655 HZ3 LYS 82 HZ3 LYS 82 4.764 -11.010 -1.120 656 H LYS 83 HN LYS 83 4.081 -3.005 -4.143 657 HA LYS 83 HA LYS 83 1.418 -2.654 -2.946 658 HB2 LYS 83 HB2 LYS 83 3.090 -1.876 -1.264 659 HB3 LYS 83 HB1 LYS 83 3.700 -0.723 -2.451 660 HG2 LYS 83 HG2 LYS 83 1.428 0.285 -2.601 661 HG3 LYS 83 HG1 LYS 83 0.877 -0.825 -1.346 662 HD2 LYS 83 HD2 LYS 83 2.300 0.149 0.291 663 HD3 LYS 83 HD1 LYS 83 3.237 1.014 -0.927 664 HE2 LYS 83 HE2 LYS 83 0.296 1.519 -0.416 665 HE3 LYS 83 HE1 LYS 83 1.589 2.456 0.332 666 HZ1 LYS 83 HZ1 LYS 83 2.305 3.241 -1.740 667 HZ2 LYS 83 HZ2 LYS 83 1.388 2.098 -2.599 668 HZ3 LYS 83 HZ3 LYS 83 0.611 3.371 -1.791 669 H LYS 84 HN LYS 84 0.109 -1.650 -4.313 670 HA LYS 84 HA LYS 84 1.269 0.074 -6.431 671 HB2 LYS 84 HB2 LYS 84 -0.786 -0.895 -7.770 672 HB3 LYS 84 HB1 LYS 84 0.709 -1.818 -7.673 673 HG2 LYS 84 HG2 LYS 84 -0.163 -3.349 -6.150 674 HG3 LYS 84 HG1 LYS 84 -1.372 -2.215 -5.550 675 HD2 LYS 84 HD2 LYS 84 -2.766 -2.514 -7.436 676 HD3 LYS 84 HD1 LYS 84 -1.470 -3.233 -8.390 677 HE2 LYS 84 HE2 LYS 84 -1.727 -5.310 -7.422 678 HE3 LYS 84 HE1 LYS 84 -2.218 -4.644 -5.865 679 HZ1 LYS 84 HZ1 LYS 84 -4.368 -4.522 -6.487 680 HZ2 LYS 84 HZ2 LYS 84 -4.011 -4.190 -8.115 681 HZ3 LYS 84 HZ3 LYS 84 -3.913 -5.781 -7.535 682 H VAL 85 HN VAL 85 0.143 1.847 -7.037 683 HA VAL 85 HA VAL 85 -2.405 2.330 -5.653 684 HB VAL 85 HB VAL 85 -1.824 4.444 -4.943 685 HG11 VAL 85 HG11 VAL 85 -0.754 2.518 -3.728 686 HG12 VAL 85 HG12 VAL 85 0.742 2.912 -4.575 687 HG13 VAL 85 HG13 VAL 85 0.023 4.078 -3.463 688 HG21 VAL 85 HG21 VAL 85 -0.687 5.700 -6.550 689 HG22 VAL 85 HG22 VAL 85 0.664 5.310 -5.490 690 HG23 VAL 85 HG23 VAL 85 0.396 4.368 -6.949 691 H GLU 86 HN GLU 86 -3.975 3.002 -6.862 692 HA GLU 86 HA GLU 86 -3.375 3.821 -9.652 693 HB2 GLU 86 HB2 GLU 86 -4.513 1.609 -9.377 694 HB3 GLU 86 HB1 GLU 86 -5.854 2.441 -8.602 695 HG2 GLU 86 HG2 GLU 86 -6.090 3.854 -10.670 696 HG3 GLU 86 HG1 GLU 86 -4.869 2.847 -11.433 697 H VAL 87 HN VAL 87 -4.029 5.672 -10.297 698 HA VAL 87 HA VAL 87 -5.532 7.415 -8.516 699 HB VAL 87 HB VAL 87 -3.419 8.100 -9.589 700 HG11 VAL 87 HG11 VAL 87 -4.800 8.531 -12.207 701 HG12 VAL 87 HG12 VAL 87 -3.106 8.181 -11.872 702 HG13 VAL 87 HG13 VAL 87 -4.296 6.881 -11.841 703 HG21 VAL 87 HG21 VAL 87 -5.170 9.708 -8.864 704 HG22 VAL 87 HG22 VAL 87 -4.196 10.312 -10.206 705 HG23 VAL 87 HG23 VAL 87 -5.821 9.694 -10.505 706 H LEU 88 HN LEU 88 -7.722 6.938 -8.632 707 HA LEU 88 HA LEU 88 -9.037 6.637 -11.203 708 HB2 LEU 88 HB2 LEU 88 -10.604 7.273 -8.715 709 HB3 LEU 88 HB1 LEU 88 -11.020 6.217 -10.057 710 HG LEU 88 HG LEU 88 -10.570 4.742 -8.285 711 HD11 LEU 88 HD11 LEU 88 -8.864 3.418 -9.127 712 HD12 LEU 88 HD12 LEU 88 -9.214 4.447 -10.513 713 HD13 LEU 88 HD13 LEU 88 -7.823 4.790 -9.486 714 HD21 LEU 88 HD21 LEU 88 -7.918 5.393 -7.417 715 HD22 LEU 88 HD22 LEU 88 -8.887 6.857 -7.325 716 HD23 LEU 88 HD23 LEU 88 -9.405 5.403 -6.480 717 H ASP 89 HN ASP 89 -9.253 9.076 -8.564 718 HA ASP 89 HA ASP 89 -9.753 11.132 -10.624 719 HB2 ASP 89 HB2 ASP 89 -11.828 10.417 -9.282 720 HB3 ASP 89 HB1 ASP 89 -11.028 11.128 -7.883 721 H THR 90 HN THR 90 -8.412 12.832 -10.437 722 HA THR 90 HA THR 90 -7.140 13.421 -7.857 723 HB THR 90 HB THR 90 -5.874 11.762 -9.450 724 HG1 THR 90 HG1 THR 90 -4.065 12.288 -8.422 725 HG21 THR 90 HG21 THR 90 -4.955 14.399 -10.552 726 HG22 THR 90 HG22 THR 90 -4.391 12.801 -11.028 727 HG23 THR 90 HG23 THR 90 -6.041 13.300 -11.400 728 H ASP 91 HN ASP 91 -7.297 15.533 -7.509 729 HA ASP 91 HA ASP 91 -8.103 17.352 -9.598 730 HB2 ASP 91 HB2 ASP 91 -8.790 17.527 -7.163 731 HB3 ASP 91 HB1 ASP 91 -7.147 18.074 -6.828 732 H TYR 92 HN TYR 92 -5.179 16.442 -7.998 733 HA TYR 92 HA TYR 92 -2.969 16.895 -8.409 734 HB2 TYR 92 HB2 TYR 92 -4.312 17.362 -10.973 735 HB3 TYR 92 HB1 TYR 92 -2.885 18.367 -10.798 736 HD1 TYR 92 HD1 TYR 92 -0.929 16.840 -9.442 737 HD2 TYR 92 HD2 TYR 92 -3.874 15.466 -12.244 738 HE1 TYR 92 HE1 TYR 92 0.508 14.894 -10.004 739 HE2 TYR 92 HE2 TYR 92 -2.444 13.521 -12.795 740 HH TYR 92 HH TYR 92 -0.521 12.499 -12.430 741 H LYS 93 HN LYS 93 -5.035 19.084 -7.307 742 HA LYS 93 HA LYS 93 -2.982 21.075 -6.953 743 HB2 LYS 93 HB2 LYS 93 -4.911 21.324 -9.096 744 HB3 LYS 93 HB1 LYS 93 -5.153 22.617 -7.930 745 HG2 LYS 93 HG2 LYS 93 -2.412 21.931 -9.018 746 HG3 LYS 93 HG1 LYS 93 -3.478 23.079 -9.822 747 HD2 LYS 93 HD2 LYS 93 -2.940 23.409 -6.879 748 HD3 LYS 93 HD1 LYS 93 -1.714 23.925 -8.034 749 HE2 LYS 93 HE2 LYS 93 -3.450 25.309 -9.192 750 HE3 LYS 93 HE1 LYS 93 -4.596 24.868 -7.928 751 HZ1 LYS 93 HZ1 LYS 93 -2.082 25.833 -6.922 752 HZ2 LYS 93 HZ2 LYS 93 -2.921 26.985 -7.848 753 HZ3 LYS 93 HZ3 LYS 93 -3.666 26.280 -6.498 754 H SER 94 HN SER 94 -5.921 19.564 -6.113 755 HA SER 94 HA SER 94 -6.180 21.361 -3.774 756 HB2 SER 94 HB2 SER 94 -7.905 21.821 -5.609 757 HB3 SER 94 HB1 SER 94 -8.579 20.242 -5.217 758 HG SER 94 HG SER 94 -9.211 22.393 -4.045 759 H TYR 95 HN TYR 95 -7.503 18.339 -5.147 760 HA TYR 95 HA TYR 95 -6.624 16.836 -2.832 761 HB2 TYR 95 HB2 TYR 95 -8.973 16.027 -2.338 762 HB3 TYR 95 HB1 TYR 95 -8.638 17.691 -1.856 763 HD1 TYR 95 HD2 TYR 95 -10.274 15.562 -4.413 764 HD2 TYR 95 HD1 TYR 95 -9.729 19.551 -2.917 765 HE1 TYR 95 HE2 TYR 95 -12.132 16.356 -5.852 766 HE2 TYR 95 HE1 TYR 95 -11.587 20.345 -4.356 767 HH TYR 95 HH TYR 95 -12.648 19.066 -6.858 768 H ALA 96 HN ALA 96 -7.181 14.485 -3.077 769 HA ALA 96 HA ALA 96 -8.050 13.667 -5.734 770 HB1 ALA 96 HB1 ALA 96 -5.711 14.131 -6.161 771 HB2 ALA 96 HB2 ALA 96 -5.954 12.384 -6.148 772 HB3 ALA 96 HB3 ALA 96 -5.230 13.184 -4.754 773 H VAL 97 HN VAL 97 -8.650 11.554 -5.887 774 HA VAL 97 HA VAL 97 -8.681 9.983 -3.362 775 HB VAL 97 HB VAL 97 -10.603 9.734 -5.691 776 HG11 VAL 97 HG11 VAL 97 -10.726 7.768 -4.420 777 HG12 VAL 97 HG12 VAL 97 -10.442 8.610 -2.899 778 HG13 VAL 97 HG13 VAL 97 -11.999 8.759 -3.713 779 HG21 VAL 97 HG21 VAL 97 -10.693 11.500 -3.250 780 HG22 VAL 97 HG22 VAL 97 -11.048 11.916 -4.924 781 HG23 VAL 97 HG23 VAL 97 -12.182 10.931 -4.001 782 H ILE 98 HN ILE 98 -7.358 8.135 -3.475 783 HA ILE 98 HA ILE 98 -6.874 7.027 -6.165 784 HB ILE 98 HB ILE 98 -4.931 7.262 -3.864 785 HG12 ILE 98 HG12 ILE 98 -4.976 8.870 -6.431 786 HG13 ILE 98 HG11 ILE 98 -5.628 9.469 -4.906 787 HG21 ILE 98 HG21 ILE 98 -4.672 5.397 -5.636 788 HG22 ILE 98 HG22 ILE 98 -4.301 6.701 -6.759 789 HG23 ILE 98 HG23 ILE 98 -3.286 6.442 -5.346 790 HD11 ILE 98 HD11 ILE 98 -3.007 9.728 -5.727 791 HD12 ILE 98 HD12 ILE 98 -3.568 9.889 -4.066 792 HD13 ILE 98 HD13 ILE 98 -2.939 8.345 -4.635 793 H TYR 99 HN TYR 99 -6.717 4.838 -6.310 794 HA TYR 99 HA TYR 99 -7.753 3.289 -4.031 795 HB2 TYR 99 HB2 TYR 99 -8.643 3.189 -6.496 796 HB3 TYR 99 HB1 TYR 99 -7.249 2.149 -6.772 797 HD1 TYR 99 HD2 TYR 99 -10.394 2.537 -4.858 798 HD2 TYR 99 HD1 TYR 99 -7.135 -0.080 -5.849 799 HE1 TYR 99 HE2 TYR 99 -11.622 0.631 -3.856 800 HE2 TYR 99 HE1 TYR 99 -8.367 -1.987 -4.849 801 HH TYR 99 HH TYR 99 -11.335 -1.517 -3.048 802 H ALA 100 HN ALA 100 -6.201 2.676 -2.703 803 HA ALA 100 HA ALA 100 -3.602 1.754 -3.762 804 HB1 ALA 100 HB1 ALA 100 -4.510 2.703 -1.052 805 HB2 ALA 100 HB2 ALA 100 -3.258 3.380 -2.091 806 HB3 ALA 100 HB3 ALA 100 -2.984 1.847 -1.266 807 H THR 101 HN THR 101 -2.892 -0.298 -3.543 808 HA THR 101 HA THR 101 -4.388 -2.172 -1.849 809 HB THR 101 HB THR 101 -4.821 -3.707 -3.595 810 HG1 THR 101 HG1 THR 101 -3.340 -2.060 -5.347 811 HG21 THR 101 HG21 THR 101 -5.251 -0.951 -4.776 812 HG22 THR 101 HG22 THR 101 -6.116 -2.420 -5.222 813 HG23 THR 101 HG23 THR 101 -6.322 -1.733 -3.612 814 H ARG 102 HN ARG 102 -3.116 -3.585 -0.838 815 HA ARG 102 HA ARG 102 -0.341 -3.955 -1.807 816 HB2 ARG 102 HB2 ARG 102 -0.372 -2.523 0.197 817 HB3 ARG 102 HB1 ARG 102 -1.284 -3.761 1.062 818 HG2 ARG 102 HG2 ARG 102 0.561 -5.343 0.819 819 HG3 ARG 102 HG1 ARG 102 1.465 -4.175 -0.148 820 HD2 ARG 102 HD2 ARG 102 1.538 -2.630 1.761 821 HD3 ARG 102 HD1 ARG 102 0.601 -3.765 2.729 822 HE ARG 102 HE ARG 102 2.528 -5.044 3.018 823 HH11 ARG 102 HH21 ARG 102 2.933 -2.678 0.524 824 HH12 ARG 102 HH22 ARG 102 4.638 -2.940 0.364 825 HH21 ARG 102 HH11 ARG 102 4.762 -5.392 2.813 826 HH22 ARG 102 HH12 ARG 102 5.674 -4.476 1.660 827 H VAL 103 HN VAL 103 0.233 -6.107 -2.114 828 HA VAL 103 HA VAL 103 -1.601 -8.104 -0.934 829 HB VAL 103 HB VAL 103 -1.833 -7.961 -3.361 830 HG11 VAL 103 HG11 VAL 103 0.601 -7.070 -3.595 831 HG12 VAL 103 HG12 VAL 103 1.058 -8.772 -3.646 832 HG13 VAL 103 HG13 VAL 103 -0.031 -8.115 -4.866 833 HG21 VAL 103 HG21 VAL 103 -0.217 -10.409 -2.571 834 HG22 VAL 103 HG22 VAL 103 -1.938 -10.196 -2.255 835 HG23 VAL 103 HG23 VAL 103 -1.353 -10.293 -3.914 836 H LYS 104 HN LYS 104 -0.695 -9.299 0.586 837 HA LYS 104 HA LYS 104 2.225 -9.606 0.652 838 HB2 LYS 104 HB2 LYS 104 0.058 -10.105 2.708 839 HB3 LYS 104 HB1 LYS 104 1.756 -10.518 2.952 840 HG2 LYS 104 HG2 LYS 104 2.410 -8.188 2.668 841 HG3 LYS 104 HG1 LYS 104 0.748 -7.739 2.279 842 HD2 LYS 104 HD2 LYS 104 1.235 -7.197 4.621 843 HD3 LYS 104 HD1 LYS 104 0.035 -8.486 4.536 844 HE2 LYS 104 HE2 LYS 104 1.547 -10.123 5.241 845 HE3 LYS 104 HE1 LYS 104 2.953 -9.197 4.713 846 HZ1 LYS 104 HZ1 LYS 104 1.667 -9.206 7.235 847 HZ2 LYS 104 HZ2 LYS 104 3.130 -8.472 6.782 848 HZ3 LYS 104 HZ3 LYS 104 1.668 -7.636 6.587 849 H ASP 105 HN ASP 105 2.947 -11.834 1.429 850 HA ASP 105 HA ASP 105 2.241 -13.748 -0.485 851 HB2 ASP 105 HB2 ASP 105 3.533 -14.126 2.226 852 HB3 ASP 105 HB1 ASP 105 3.478 -15.351 0.958 853 H GLY 106 HN GLY 106 0.275 -14.574 -0.705 854 HA2 GLY 106 HA2 GLY 106 -1.413 -16.099 -0.191 855 HA3 GLY 106 HA1 GLY 106 -0.885 -16.092 1.485 856 H ARG 107 HN ARG 107 -1.128 -12.893 0.830 857 HA ARG 107 HA ARG 107 -4.047 -12.784 1.322 858 HB2 ARG 107 HB2 ARG 107 -2.853 -12.660 3.485 859 HB3 ARG 107 HB1 ARG 107 -1.969 -11.252 2.897 860 HG2 ARG 107 HG2 ARG 107 -4.037 -9.997 2.638 861 HG3 ARG 107 HG1 ARG 107 -4.991 -11.418 3.065 862 HD2 ARG 107 HD2 ARG 107 -4.025 -11.437 5.307 863 HD3 ARG 107 HD1 ARG 107 -2.969 -10.090 4.890 864 HE ARG 107 HE ARG 107 -5.491 -9.137 4.394 865 HH11 ARG 107 HH21 ARG 107 -3.878 -10.631 7.067 866 HH12 ARG 107 HH22 ARG 107 -4.813 -9.807 8.270 867 HH21 ARG 107 HH11 ARG 107 -6.721 -8.053 5.966 868 HH22 ARG 107 HH12 ARG 107 -6.423 -8.347 7.646 869 H THR 108 HN THR 108 -5.119 -11.032 0.566 870 HA THR 108 HA THR 108 -3.593 -9.080 -1.067 871 HB THR 108 HB THR 108 -6.441 -10.008 -1.499 872 HG1 THR 108 HG1 THR 108 -3.971 -10.839 -2.571 873 HG21 THR 108 HG21 THR 108 -6.024 -7.784 -2.371 874 HG22 THR 108 HG22 THR 108 -4.517 -8.317 -3.117 875 HG23 THR 108 HG23 THR 108 -6.062 -8.913 -3.726 876 H LEU 109 HN LEU 109 -4.488 -6.888 -1.117 877 HA LEU 109 HA LEU 109 -6.479 -6.275 0.939 878 HB2 LEU 109 HB2 LEU 109 -4.026 -6.271 1.843 879 HB3 LEU 109 HB1 LEU 109 -3.909 -4.733 1.019 880 HG LEU 109 HG LEU 109 -6.195 -4.244 2.268 881 HD11 LEU 109 HD11 LEU 109 -6.542 -5.402 4.295 882 HD12 LEU 109 HD12 LEU 109 -6.129 -6.689 3.165 883 HD13 LEU 109 HD13 LEU 109 -4.916 -6.084 4.293 884 HD21 LEU 109 HD21 LEU 109 -4.220 -2.918 2.653 885 HD22 LEU 109 HD22 LEU 109 -4.831 -3.404 4.235 886 HD23 LEU 109 HD23 LEU 109 -3.440 -4.233 3.534 887 H HIS 110 HN HIS 110 -7.346 -4.257 0.825 888 HA HIS 110 HA HIS 110 -6.574 -2.531 -1.406 889 HB2 HIS 110 HB2 HIS 110 -9.068 -2.275 -1.952 890 HB3 HIS 110 HB1 HIS 110 -8.293 -3.772 -2.471 891 HD1 HIS 110 HD1 HIS 110 -10.963 -2.463 -0.283 892 HD2 HIS 110 HD2 HIS 110 -8.886 -6.049 -0.728 893 HE1 HIS 110 HE1 HIS 110 -12.281 -4.214 0.985 894 H MET 111 HN MET 111 -7.016 -0.305 -1.045 895 HA MET 111 HA MET 111 -8.666 0.474 1.173 896 HB2 MET 111 HB2 MET 111 -6.623 1.794 2.163 897 HB3 MET 111 HB1 MET 111 -6.857 0.100 2.594 898 HG2 MET 111 HG2 MET 111 -5.143 -0.629 1.161 899 HG3 MET 111 HG1 MET 111 -5.182 0.854 0.207 900 HE1 MET 111 HE1 MET 111 -3.589 0.326 4.468 901 HE2 MET 111 HE2 MET 111 -5.284 0.731 4.218 902 HE3 MET 111 HE3 MET 111 -4.619 -0.761 3.540 903 H MET 112 HN MET 112 -9.107 2.708 1.187 904 HA MET 112 HA MET 112 -8.194 4.171 -1.235 905 HB2 MET 112 HB2 MET 112 -10.692 3.525 -1.009 906 HB3 MET 112 HB1 MET 112 -10.756 4.770 0.238 907 HG2 MET 112 HG2 MET 112 -11.291 6.037 -1.633 908 HG3 MET 112 HG1 MET 112 -9.539 6.229 -1.615 909 HE1 MET 112 HE1 MET 112 -12.427 5.660 -3.747 910 HE2 MET 112 HE2 MET 112 -12.182 4.163 -4.644 911 HE3 MET 112 HE3 MET 112 -12.505 4.115 -2.905 912 H ARG 113 HN ARG 113 -7.710 6.397 -1.015 913 HA ARG 113 HA ARG 113 -7.588 7.470 1.733 914 HB2 ARG 113 HB2 ARG 113 -5.267 7.172 -0.177 915 HB3 ARG 113 HB1 ARG 113 -5.251 8.322 1.161 916 HG2 ARG 113 HG2 ARG 113 -5.519 6.558 2.780 917 HG3 ARG 113 HG1 ARG 113 -5.811 5.366 1.513 918 HD2 ARG 113 HD2 ARG 113 -3.504 5.824 0.640 919 HD3 ARG 113 HD1 ARG 113 -3.230 6.865 2.034 920 HE ARG 113 HE ARG 113 -4.104 4.374 2.986 921 HH11 ARG 113 HH21 ARG 113 -1.455 5.789 1.267 922 HH12 ARG 113 HH22 ARG 113 -0.289 4.647 1.846 923 HH21 ARG 113 HH11 ARG 113 -2.580 2.872 3.749 924 HH22 ARG 113 HH12 ARG 113 -0.925 2.996 3.250 925 H LEU 114 HN LEU 114 -7.429 9.758 1.859 926 HA LEU 114 HA LEU 114 -8.192 11.165 -0.651 927 HB2 LEU 114 HB2 LEU 114 -10.000 11.074 1.091 928 HB3 LEU 114 HB1 LEU 114 -8.926 11.963 2.168 929 HG LEU 114 HG LEU 114 -8.794 13.801 0.499 930 HD11 LEU 114 HD11 LEU 114 -10.562 11.914 -1.013 931 HD12 LEU 114 HD12 LEU 114 -10.833 13.644 -1.199 932 HD13 LEU 114 HD13 LEU 114 -9.266 12.949 -1.608 933 HD21 LEU 114 HD21 LEU 114 -10.441 13.818 2.363 934 HD22 LEU 114 HD22 LEU 114 -11.037 14.671 0.940 935 HD23 LEU 114 HD23 LEU 114 -11.619 13.048 1.303 936 H TYR 115 HN TYR 115 -6.853 12.701 -1.322 937 HA TYR 115 HA TYR 115 -4.758 13.631 0.526 938 HB2 TYR 115 HB2 TYR 115 -4.862 13.606 -2.493 939 HB3 TYR 115 HB1 TYR 115 -3.530 14.259 -1.539 940 HD1 TYR 115 HD1 TYR 115 -5.587 11.145 -1.916 941 HD2 TYR 115 HD2 TYR 115 -1.775 12.840 -0.896 942 HE1 TYR 115 HE1 TYR 115 -4.642 8.868 -1.674 943 HE2 TYR 115 HE2 TYR 115 -0.830 10.563 -0.655 944 HH TYR 115 HH TYR 115 -1.648 8.274 -0.194 945 H SER 116 HN SER 116 -4.050 15.861 0.371 946 HA SER 116 HA SER 116 -6.042 17.765 -0.667 947 HB2 SER 116 HB2 SER 116 -6.639 17.493 1.681 948 HB3 SER 116 HB1 SER 116 -4.962 17.740 2.168 949 HG SER 116 HG SER 116 -5.107 19.834 1.638 950 H ARG 117 HN ARG 117 -5.148 19.684 -1.396 951 HA ARG 117 HA ARG 117 -2.291 19.688 -1.807 952 HB2 ARG 117 HB2 ARG 117 -4.002 20.479 -3.494 953 HB3 ARG 117 HB1 ARG 117 -4.266 21.879 -2.463 954 HG2 ARG 117 HG2 ARG 117 -2.650 22.517 -4.140 955 HG3 ARG 117 HG1 ARG 117 -1.797 22.368 -2.609 956 HD2 ARG 117 HD2 ARG 117 -0.680 20.439 -3.263 957 HD3 ARG 117 HD1 ARG 117 -1.947 19.957 -4.388 958 HE ARG 117 HE ARG 117 -0.788 21.102 -6.022 959 HH11 ARG 117 HH21 ARG 117 -0.015 22.362 -2.892 960 HH12 ARG 117 HH22 ARG 117 1.146 23.502 -3.485 961 HH21 ARG 117 HH11 ARG 117 0.732 22.598 -6.806 962 HH22 ARG 117 HH12 ARG 117 1.568 23.635 -5.700 963 H SER 118 HN SER 118 -4.512 21.047 0.447 964 HA SER 118 HA SER 118 -2.362 22.744 1.576 965 HB2 SER 118 HB2 SER 118 -4.214 24.084 0.662 966 HB3 SER 118 HB1 SER 118 -5.352 23.201 1.675 967 HG SER 118 HG SER 118 -4.805 24.456 3.258 968 HA PRO 119 HA PRO 119 -2.288 20.302 5.263 969 HB2 PRO 119 HB2 PRO 119 -2.866 22.929 6.602 970 HB3 PRO 119 HB1 PRO 119 -1.671 21.690 7.032 971 HG2 PRO 119 HG2 PRO 119 -0.995 23.926 5.707 972 HG3 PRO 119 HG1 PRO 119 -0.180 22.377 5.431 973 HD2 PRO 119 HD2 PRO 119 -2.005 23.853 3.641 974 HD3 PRO 119 HD1 PRO 119 -0.865 22.548 3.255 975 H GLU 120 HN GLU 120 -4.933 22.435 4.504 976 HA GLU 120 HA GLU 120 -6.716 21.180 6.466 977 HB2 GLU 120 HB2 GLU 120 -7.371 23.334 4.455 978 HB3 GLU 120 HB1 GLU 120 -8.277 22.905 5.908 979 HG2 GLU 120 HG2 GLU 120 -6.268 23.550 7.273 980 HG3 GLU 120 HG1 GLU 120 -5.509 24.133 5.793 981 H VAL 121 HN VAL 121 -9.012 20.817 5.539 982 HA VAL 121 HA VAL 121 -8.792 19.234 3.039 983 HB VAL 121 HB VAL 121 -10.608 18.741 5.413 984 HG11 VAL 121 HG11 VAL 121 -10.104 17.229 2.834 985 HG12 VAL 121 HG12 VAL 121 -11.006 16.575 4.201 986 HG13 VAL 121 HG13 VAL 121 -11.614 17.987 3.338 987 HG21 VAL 121 HG21 VAL 121 -9.159 16.724 5.723 988 HG22 VAL 121 HG22 VAL 121 -8.083 17.345 4.470 989 HG23 VAL 121 HG23 VAL 121 -8.287 18.235 5.979 990 H SER 122 HN SER 122 -10.014 19.938 1.410 991 HA SER 122 HA SER 122 -11.815 22.134 1.755 992 HB2 SER 122 HB2 SER 122 -10.384 21.667 -0.290 993 HB3 SER 122 HB1 SER 122 -11.544 20.407 -0.702 994 HG SER 122 HG SER 122 -13.024 22.431 -0.157 995 HA PRO 123 HA PRO 123 -15.470 19.818 2.981 996 HB2 PRO 123 HB2 PRO 123 -16.758 21.856 1.186 997 HB3 PRO 123 HB1 PRO 123 -17.253 21.309 2.801 998 HG2 PRO 123 HG2 PRO 123 -15.980 23.629 2.444 999 HG3 PRO 123 HG1 PRO 123 -15.695 22.618 3.872 1000 HD2 PRO 123 HD2 PRO 123 -13.903 23.128 1.559 1001 HD3 PRO 123 HD1 PRO 123 -13.497 22.601 3.208 1002 H ALA 124 HN ALA 124 -14.855 20.767 -0.368 1003 HA ALA 124 HA ALA 124 -16.636 18.829 -1.520 1004 HB1 ALA 124 HB1 ALA 124 -15.783 19.550 -3.627 1005 HB2 ALA 124 HB2 ALA 124 -14.317 20.196 -2.890 1006 HB3 ALA 124 HB3 ALA 124 -15.866 20.991 -2.613 1007 H ALA 125 HN ALA 125 -13.250 18.922 -0.611 1008 HA ALA 125 HA ALA 125 -12.386 16.640 -2.049 1009 HB1 ALA 125 HB1 ALA 125 -11.349 17.814 0.544 1010 HB2 ALA 125 HB2 ALA 125 -10.790 18.217 -1.080 1011 HB3 ALA 125 HB3 ALA 125 -10.513 16.602 -0.427 1012 H THR 126 HN THR 126 -13.753 17.066 1.180 1013 HA THR 126 HA THR 126 -13.484 14.308 1.917 1014 HB THR 126 HB THR 126 -15.538 16.041 3.235 1015 HG1 THR 126 HG1 THR 126 -14.089 17.397 4.014 1016 HG21 THR 126 HG21 THR 126 -14.840 13.701 4.000 1017 HG22 THR 126 HG22 THR 126 -13.276 14.402 4.416 1018 HG23 THR 126 HG23 THR 126 -14.738 14.960 5.228 1019 H ALA 127 HN ALA 127 -15.985 16.248 0.348 1020 HA ALA 127 HA ALA 127 -18.057 14.306 0.611 1021 HB1 ALA 127 HB1 ALA 127 -17.729 16.712 -1.163 1022 HB2 ALA 127 HB2 ALA 127 -18.586 16.630 0.378 1023 HB3 ALA 127 HB3 ALA 127 -19.211 15.766 -1.027 1024 H ILE 128 HN ILE 128 -16.000 15.273 -2.191 1025 HA ILE 128 HA ILE 128 -17.189 13.507 -4.033 1026 HB ILE 128 HB ILE 128 -15.351 15.425 -4.276 1027 HG12 ILE 128 HG12 ILE 128 -16.496 14.422 -6.156 1028 HG13 ILE 128 HG11 ILE 128 -14.771 14.481 -6.495 1029 HG21 ILE 128 HG21 ILE 128 -13.621 12.935 -4.353 1030 HG22 ILE 128 HG22 ILE 128 -13.112 14.597 -4.644 1031 HG23 ILE 128 HG23 ILE 128 -13.613 14.101 -3.029 1032 HD11 ILE 128 HD11 ILE 128 -14.699 12.070 -5.546 1033 HD12 ILE 128 HD12 ILE 128 -16.450 12.092 -5.745 1034 HD13 ILE 128 HD13 ILE 128 -15.402 12.295 -7.146 1035 H PHE 129 HN PHE 129 -14.668 13.248 -1.731 1036 HA PHE 129 HA PHE 129 -13.642 10.713 -2.176 1037 HB2 PHE 129 HB2 PHE 129 -12.801 12.395 -0.550 1038 HB3 PHE 129 HB1 PHE 129 -14.155 12.005 0.503 1039 HD1 PHE 129 HD1 PHE 129 -11.709 9.973 -1.537 1040 HD2 PHE 129 HD2 PHE 129 -13.517 10.667 2.295 1041 HE1 PHE 129 HE1 PHE 129 -10.438 8.077 -0.593 1042 HE2 PHE 129 HE2 PHE 129 -12.230 8.780 3.238 1043 HZ PHE 129 HZ PHE 129 -10.693 7.477 1.798 1044 H ARG 130 HN ARG 130 -16.485 11.679 -0.290 1045 HA ARG 130 HA ARG 130 -17.138 9.048 0.597 1046 HB2 ARG 130 HB2 ARG 130 -18.667 11.644 0.472 1047 HB3 ARG 130 HB1 ARG 130 -19.419 10.151 1.035 1048 HG2 ARG 130 HG2 ARG 130 -17.615 9.905 2.726 1049 HG3 ARG 130 HG1 ARG 130 -16.932 11.442 2.196 1050 HD2 ARG 130 HD2 ARG 130 -19.680 11.006 3.393 1051 HD3 ARG 130 HD1 ARG 130 -18.322 11.828 4.156 1052 HE ARG 130 HE ARG 130 -18.932 13.080 1.683 1053 HH11 ARG 130 HH21 ARG 130 -20.113 12.622 4.903 1054 HH12 ARG 130 HH22 ARG 130 -20.967 14.128 4.953 1055 HH21 ARG 130 HH11 ARG 130 -20.050 15.058 1.741 1056 HH22 ARG 130 HH12 ARG 130 -20.931 15.507 3.162 1057 H LYS 131 HN LYS 131 -18.185 11.025 -2.172 1058 HA LYS 131 HA LYS 131 -20.322 9.536 -3.079 1059 HB2 LYS 131 HB2 LYS 131 -18.159 10.847 -4.742 1060 HB3 LYS 131 HB1 LYS 131 -19.738 10.348 -5.342 1061 HG2 LYS 131 HG2 LYS 131 -19.554 12.189 -2.962 1062 HG3 LYS 131 HG1 LYS 131 -19.376 12.841 -4.589 1063 HD2 LYS 131 HD2 LYS 131 -21.562 11.767 -5.199 1064 HD3 LYS 131 HD1 LYS 131 -21.753 11.297 -3.510 1065 HE2 LYS 131 HE2 LYS 131 -21.813 13.583 -2.789 1066 HE3 LYS 131 HE1 LYS 131 -21.304 14.161 -4.375 1067 HZ1 LYS 131 HZ1 LYS 131 -23.562 14.477 -4.449 1068 HZ2 LYS 131 HZ2 LYS 131 -23.428 12.940 -5.161 1069 HZ3 LYS 131 HZ3 LYS 131 -23.910 13.084 -3.541 1070 H LEU 132 HN LEU 132 -16.934 9.110 -4.157 1071 HA LEU 132 HA LEU 132 -17.415 6.718 -5.577 1072 HB2 LEU 132 HB2 LEU 132 -14.805 7.418 -4.227 1073 HB3 LEU 132 HB1 LEU 132 -15.053 6.490 -5.707 1074 HG LEU 132 HG LEU 132 -15.559 9.453 -5.312 1075 HD11 LEU 132 HD11 LEU 132 -13.233 9.024 -5.689 1076 HD12 LEU 132 HD12 LEU 132 -13.587 7.833 -6.941 1077 HD13 LEU 132 HD13 LEU 132 -13.893 9.545 -7.239 1078 HD21 LEU 132 HD21 LEU 132 -16.056 9.283 -7.846 1079 HD22 LEU 132 HD22 LEU 132 -16.287 7.560 -7.554 1080 HD23 LEU 132 HD23 LEU 132 -17.315 8.739 -6.739 1081 H ALA 133 HN ALA 133 -16.230 7.299 -2.275 1082 HA ALA 133 HA ALA 133 -15.836 4.657 -1.499 1083 HB1 ALA 133 HB1 ALA 133 -15.412 6.898 -0.221 1084 HB2 ALA 133 HB2 ALA 133 -15.769 5.431 0.686 1085 HB3 ALA 133 HB3 ALA 133 -17.034 6.632 0.414 1086 H GLY 134 HN GLY 134 -18.821 6.537 -1.805 1087 HA2 GLY 134 HA2 GLY 134 -20.535 4.745 -0.436 1088 HA3 GLY 134 HA1 GLY 134 -21.023 5.941 -1.628 1089 H GLU 135 HN GLU 135 -19.445 5.038 -3.771 1090 HA GLU 135 HA GLU 135 -21.125 3.046 -4.879 1091 HB2 GLU 135 HB2 GLU 135 -18.390 3.990 -5.781 1092 HB3 GLU 135 HB1 GLU 135 -19.513 3.034 -6.747 1093 HG2 GLU 135 HG2 GLU 135 -21.206 4.862 -6.495 1094 HG3 GLU 135 HG1 GLU 135 -19.982 5.829 -5.675 1095 H ARG 136 HN ARG 136 -18.444 2.887 -2.760 1096 HA ARG 136 HA ARG 136 -17.883 0.080 -3.472 1097 HB2 ARG 136 HB2 ARG 136 -16.058 1.927 -3.153 1098 HB3 ARG 136 HB1 ARG 136 -16.346 1.672 -1.433 1099 HG2 ARG 136 HG2 ARG 136 -15.859 -0.727 -1.692 1100 HG3 ARG 136 HG1 ARG 136 -15.612 -0.499 -3.423 1101 HD2 ARG 136 HD2 ARG 136 -13.802 1.170 -2.848 1102 HD3 ARG 136 HD1 ARG 136 -13.965 0.666 -1.168 1103 HE ARG 136 HE ARG 136 -12.597 -0.760 -3.229 1104 HH11 ARG 136 HH21 ARG 136 -14.604 -1.119 -0.434 1105 HH12 ARG 136 HH22 ARG 136 -14.003 -2.694 -0.034 1106 HH21 ARG 136 HH11 ARG 136 -11.804 -2.824 -2.712 1107 HH22 ARG 136 HH12 ARG 136 -12.418 -3.659 -1.324 1108 H ASN 137 HN ASN 137 -20.173 1.430 -1.785 1109 HA ASN 137 HA ASN 137 -21.436 0.873 0.064 1110 HB2 ASN 137 HB2 ASN 137 -19.868 -1.671 -0.167 1111 HB3 ASN 137 HB1 ASN 137 -21.380 -1.479 0.712 1112 HD21 ASN 137 HD21 ASN 137 -20.076 -2.329 -2.319 1113 HD22 ASN 137 HD22 ASN 137 -21.502 -2.202 -3.229 1114 H TYR 138 HN TYR 138 -18.994 2.245 0.551 1115 HA TYR 138 HA TYR 138 -17.577 1.117 2.758 1116 HB2 TYR 138 HB2 TYR 138 -16.348 3.104 2.784 1117 HB3 TYR 138 HB1 TYR 138 -16.856 2.991 1.100 1118 HD1 TYR 138 HD1 TYR 138 -19.758 3.780 1.409 1119 HD2 TYR 138 HD2 TYR 138 -16.184 5.452 3.086 1120 HE1 TYR 138 HE1 TYR 138 -20.885 5.974 1.607 1121 HE2 TYR 138 HE2 TYR 138 -17.312 7.653 3.290 1122 HH TYR 138 HH TYR 138 -19.157 8.813 2.901 1123 H THR 139 HN THR 139 -17.602 1.772 4.944 1124 HA THR 139 HA THR 139 -20.110 3.065 5.869 1125 HB THR 139 HB THR 139 -20.376 1.493 7.553 1126 HG1 THR 139 HG1 THR 139 -18.282 0.076 7.830 1127 HG21 THR 139 HG21 THR 139 -18.814 -0.209 5.604 1128 HG22 THR 139 HG22 THR 139 -20.200 -0.680 6.588 1129 HG23 THR 139 HG23 THR 139 -20.418 0.424 5.230 1130 H ASP 140 HN ASP 140 -19.881 4.406 7.768 1131 HA ASP 140 HA ASP 140 -17.777 6.114 7.816 1132 HB2 ASP 140 HB2 ASP 140 -19.875 6.350 9.156 1133 HB3 ASP 140 HB1 ASP 140 -19.201 5.220 10.329 1134 H GLU 141 HN GLU 141 -17.987 3.305 10.087 1135 HA GLU 141 HA GLU 141 -15.450 3.651 11.184 1136 HB2 GLU 141 HB2 GLU 141 -17.091 1.141 10.802 1137 HB3 GLU 141 HB1 GLU 141 -15.635 1.231 11.796 1138 HG2 GLU 141 HG2 GLU 141 -16.679 3.012 13.155 1139 HG3 GLU 141 HG1 GLU 141 -18.139 2.900 12.175 1140 H MET 142 HN MET 142 -16.341 2.362 8.087 1141 HA MET 142 HA MET 142 -13.894 0.890 7.675 1142 HB2 MET 142 HB2 MET 142 -15.811 0.114 6.495 1143 HB3 MET 142 HB1 MET 142 -16.156 1.711 5.860 1144 HG2 MET 142 HG2 MET 142 -14.542 1.579 4.227 1145 HG3 MET 142 HG1 MET 142 -13.482 0.579 5.207 1146 HE1 MET 142 HE1 MET 142 -14.028 -1.515 6.053 1147 HE2 MET 142 HE2 MET 142 -15.669 -2.139 5.925 1148 HE3 MET 142 HE3 MET 142 -14.376 -2.838 4.944 1149 H VAL 143 HN VAL 143 -14.919 4.136 7.349 1150 HA VAL 143 HA VAL 143 -12.372 4.838 5.993 1151 HB VAL 143 HB VAL 143 -14.455 4.997 4.543 1152 HG11 VAL 143 HG11 VAL 143 -15.039 7.446 6.213 1153 HG12 VAL 143 HG12 VAL 143 -16.048 6.709 4.975 1154 HG13 VAL 143 HG13 VAL 143 -15.826 5.898 6.522 1155 HG21 VAL 143 HG21 VAL 143 -13.006 7.602 5.088 1156 HG22 VAL 143 HG22 VAL 143 -12.330 6.271 4.148 1157 HG23 VAL 143 HG23 VAL 143 -13.771 7.112 3.575 1158 H ALA 144 HN ALA 144 -11.149 6.287 7.117 1159 HA ALA 144 HA ALA 144 -12.554 7.944 9.163 1160 HB1 ALA 144 HB1 ALA 144 -10.821 7.544 10.739 1161 HB2 ALA 144 HB2 ALA 144 -9.816 6.743 9.532 1162 HB3 ALA 144 HB3 ALA 144 -11.296 5.970 10.100 1163 H MET 145 HN MET 145 -12.236 10.046 9.049 1164 HA MET 145 HA MET 145 -10.251 11.193 7.268 1165 HB2 MET 145 HB2 MET 145 -12.492 12.280 8.971 1166 HB3 MET 145 HB1 MET 145 -11.304 13.362 8.245 1167 HG2 MET 145 HG2 MET 145 -12.878 11.323 6.663 1168 HG3 MET 145 HG1 MET 145 -13.381 13.002 6.857 1169 HE1 MET 145 HE1 MET 145 -12.168 10.774 4.536 1170 HE2 MET 145 HE2 MET 145 -13.156 12.133 4.024 1171 HE3 MET 145 HE3 MET 145 -11.561 11.882 3.310 1172 H LEU 146 HN LEU 146 -8.587 12.625 7.942 1173 HA LEU 146 HA LEU 146 -7.831 12.364 10.805 1174 HB2 LEU 146 HB2 LEU 146 -5.978 12.742 8.453 1175 HB3 LEU 146 HB1 LEU 146 -5.496 12.576 10.128 1176 HG LEU 146 HG LEU 146 -7.181 10.422 8.860 1177 HD11 LEU 146 HD11 LEU 146 -5.532 10.026 7.341 1178 HD12 LEU 146 HD12 LEU 146 -4.394 11.100 8.150 1179 HD13 LEU 146 HD13 LEU 146 -4.592 9.438 8.704 1180 HD21 LEU 146 HD21 LEU 146 -6.833 10.337 11.274 1181 HD22 LEU 146 HD22 LEU 146 -5.926 9.033 10.510 1182 HD23 LEU 146 HD23 LEU 146 -5.090 10.486 11.054 1183 HA PRO 147 HA PRO 147 -8.237 16.827 10.748 1184 HB2 PRO 147 HB2 PRO 147 -7.265 17.397 13.216 1185 HB3 PRO 147 HB1 PRO 147 -8.835 16.603 12.978 1186 HG2 PRO 147 HG2 PRO 147 -6.198 15.394 13.688 1187 HG3 PRO 147 HG1 PRO 147 -7.806 15.057 14.355 1188 HD2 PRO 147 HD2 PRO 147 -6.622 13.468 12.458 1189 HD3 PRO 147 HD1 PRO 147 -8.384 13.648 12.610 1190 H ARG 148 HN ARG 148 -6.890 18.801 10.995 1191 HA ARG 148 HA ARG 148 -4.490 18.675 9.556 1192 HB2 ARG 148 HB2 ARG 148 -4.205 21.030 10.197 1193 HB3 ARG 148 HB1 ARG 148 -5.868 20.699 9.707 1194 HG2 ARG 148 HG2 ARG 148 -6.388 20.326 12.174 1195 HG3 ARG 148 HG1 ARG 148 -4.797 21.003 12.520 1196 HD2 ARG 148 HD2 ARG 148 -5.416 23.064 11.302 1197 HD3 ARG 148 HD1 ARG 148 -7.012 22.389 10.983 1198 HE ARG 148 HE ARG 148 -6.122 23.573 13.445 1199 HH11 ARG 148 HH21 ARG 148 -8.168 21.178 12.013 1200 HH12 ARG 148 HH22 ARG 148 -9.311 21.177 13.315 1201 HH21 ARG 148 HH11 ARG 148 -7.616 23.577 15.157 1202 HH22 ARG 148 HH12 ARG 148 -8.999 22.535 15.094 1203 H GLN 149 HN GLN 149 -5.045 17.923 12.821 1204 HA GLN 149 HA GLN 149 -2.826 18.803 14.188 1205 HB2 GLN 149 HB2 GLN 149 -4.628 17.472 15.214 1206 HB3 GLN 149 HB1 GLN 149 -4.052 16.042 14.361 1207 HG2 GLN 149 HG2 GLN 149 -1.926 16.132 15.528 1208 HG3 GLN 149 HG1 GLN 149 -2.361 17.666 16.279 1209 HE21 GLN 149 HE21 GLN 149 -1.702 15.636 18.026 1210 HE22 GLN 149 HE22 GLN 149 -3.094 15.022 18.780 1211 H GLU 150 HN GLU 150 -0.698 18.555 13.977 1212 HA GLU 150 HA GLU 150 0.353 16.200 12.518 1213 HB2 GLU 150 HB2 GLU 150 2.035 17.721 11.478 1214 HB3 GLU 150 HB1 GLU 150 0.383 18.037 10.945 1215 HG2 GLU 150 HG2 GLU 150 0.220 19.841 12.667 1216 HG3 GLU 150 HG1 GLU 150 1.917 19.573 13.061 1217 H GLU 151 HN GLU 151 2.255 15.368 13.270 1218 HA GLU 151 HA GLU 151 3.411 16.638 15.690 1219 HB2 GLU 151 HB2 GLU 151 2.240 14.388 16.006 1220 HB3 GLU 151 HB1 GLU 151 3.512 13.690 15.007 1221 HG2 GLU 151 HG2 GLU 151 4.088 15.342 17.477 1222 HG3 GLU 151 HG1 GLU 151 3.923 13.588 17.512 1223 H CYS 152 HN CYS 152 4.493 14.001 13.572 1224 HA CYS 152 HA CYS 152 7.056 15.342 13.227 1225 HB2 CYS 152 HB2 CYS 152 6.109 12.618 13.309 1226 HB3 CYS 152 HB1 CYS 152 6.968 12.888 11.801 1227 H THR 153 HN THR 153 7.996 15.355 11.053 1228 HA THR 153 HA THR 153 6.188 15.351 8.780 1229 HB THR 153 HB THR 153 6.744 17.727 8.185 1230 HG1 THR 153 HG1 THR 153 7.397 18.990 10.059 1231 HG21 THR 153 HG21 THR 153 5.339 17.569 10.858 1232 HG22 THR 153 HG22 THR 153 5.000 18.656 9.514 1233 HG23 THR 153 HG23 THR 153 4.607 16.943 9.380 1234 H VAL 154 HN VAL 154 7.368 15.814 6.725 1235 HA VAL 154 HA VAL 154 9.824 14.408 6.642 1236 HB VAL 154 HB VAL 154 9.795 15.061 4.257 1237 HG11 VAL 154 HG11 VAL 154 7.470 14.087 3.760 1238 HG12 VAL 154 HG12 VAL 154 8.555 13.096 4.734 1239 HG13 VAL 154 HG13 VAL 154 7.261 14.011 5.509 1240 HG21 VAL 154 HG21 VAL 154 8.927 17.303 4.409 1241 HG22 VAL 154 HG22 VAL 154 7.773 16.355 3.472 1242 HG23 VAL 154 HG23 VAL 154 7.441 16.728 5.164 1243 H ASP 155 HN ASP 155 11.858 15.157 6.476 1244 HA ASP 155 HA ASP 155 12.497 17.702 7.515 1245 HB2 ASP 155 HB2 ASP 155 14.709 16.701 5.970 1246 HB3 ASP 155 HB1 ASP 155 14.524 16.743 7.719 1247 H GLU 156 HN GLU 156 12.857 19.617 6.597 1248 HA GLU 156 HA GLU 156 11.961 20.136 3.959 1249 HB2 GLU 156 HB2 GLU 156 13.418 21.799 6.016 1250 HB3 GLU 156 HB1 GLU 156 12.893 22.434 4.462 1251 HG2 GLU 156 HG2 GLU 156 10.562 21.713 4.995 1252 HG3 GLU 156 HG1 GLU 156 11.119 21.213 6.590 1253 H VAL 157 HN VAL 157 15.135 19.726 5.434 1254 HA VAL 157 HA VAL 157 16.804 20.723 3.469 1255 HB VAL 157 HB VAL 157 17.336 18.118 4.897 1256 HG11 VAL 157 HG11 VAL 157 19.003 18.858 3.243 1257 HG12 VAL 157 HG12 VAL 157 19.093 20.435 4.028 1258 HG13 VAL 157 HG13 VAL 157 19.652 18.994 4.878 1259 HG21 VAL 157 HG21 VAL 157 16.513 19.566 6.617 1260 HG22 VAL 157 HG22 VAL 157 18.271 19.661 6.711 1261 HG23 VAL 157 HG23 VAL 157 17.358 20.959 5.943 1262 HN1 EB4 200 H17 EB4 200 0.917 -0.887 5.673 1263 H8 EB4 200 H8 EB4 200 4.516 2.115 0.645 1264 HN2 EB4 200 H25 EB4 200 3.885 0.487 6.013 1265 H9 EB4 200 H9 EB4 200 -0.227 6.104 3.507 1266 H10 EB4 200 H10 EB4 200 -2.550 -1.207 0.880 1267 HN3 EB4 200 H32 EB4 200 1.092 1.915 7.303 1268 H7 EB4 200 H7 EB4 200 -1.407 0.987 0.716 1269 H11 EB4 200 H11 EB4 200 6.698 0.983 0.978 1270 H12 EB4 200 H12 EB4 200 -1.180 7.101 5.570 1271 H15 EB4 200 H15 EB4 200 -0.879 5.962 7.751 1272 H14 EB4 200 H14 EB4 200 7.293 0.064 3.203 1273 H13 EB4 200 H13 EB4 200 -2.087 -2.705 2.803 1274 H22 EB4 200 H22 EB4 200 0.254 -3.460 6.958 1275 H30 EB4 200 H30 EB4 200 0.470 -0.304 10.188 1276 H30A EB4 200 H9N EB4 200 -0.810 0.597 9.241 1277 H24 EB4 200 H24 EB4 200 0.782 2.160 10.242 1278 H28 EB4 200 H28 EB4 200 2.563 -3.525 7.776 1279 H28A EB4 200 H9L EB4 200 2.447 -3.607 6.010 1280 H23 EB4 200 H23 EB4 200 5.973 -0.731 7.758 1281 H29 EB4 200 H29 EB4 200 4.787 0.319 9.648 1282 H29A EB4 200 H9M EB4 200 5.355 1.568 8.434 1283 H21 ACD 300 HA3 ACD 300 0.508 10.409 -11.942 1284 H22 ACD 300 HA4 ACD 300 0.761 11.515 -10.573 1285 H31 ACD 300 HA1 ACD 300 0.476 8.484 -10.377 1286 H32 ACD 300 HA2 ACD 300 1.997 9.395 -10.240 1287 H41 ACD 300 HA0 ACD 300 -0.426 9.688 -8.405 1288 H42 ACD 300 HAZ ACD 300 1.088 10.617 -8.285 1289 H5 ACD 300 HAY ACD 300 2.226 8.099 -8.072 1290 H6 ACD 300 HAX ACD 300 1.062 7.253 -5.889 1291 H71 ACD 300 HAV ACD 300 -0.973 9.511 -6.653 1292 H72 ACD 300 HAW ACD 300 -1.515 7.911 -6.103 1293 H8 ACD 300 HAU ACD 300 -0.526 10.189 -4.347 1294 H9 ACD 300 HAT ACD 300 -0.565 8.466 -2.388 1295 H101 ACD 300 HAR ACD 300 -1.280 6.471 -4.654 1296 H102 ACD 300 HAS ACD 300 0.211 6.165 -3.732 1297 H11 ACD 300 HAQ ACD 300 -2.669 5.818 -2.699 1298 H12 ACD 300 HAP ACD 300 -1.478 5.087 -0.476 1299 H131 ACD 300 HAN ACD 300 0.973 6.652 -1.636 1300 H132 ACD 300 HAO ACD 300 1.129 4.846 -1.365 1301 H14 ACD 300 HAM ACD 300 0.968 5.161 1.042 1302 H15 ACD 300 HAL ACD 300 1.180 7.588 1.980 1303 H161 ACD 300 HAJ ACD 300 -0.096 8.576 -0.546 1304 H162 ACD 300 HAK ACD 300 0.870 9.556 0.580 1305 H171 ACD 300 HAH ACD 300 2.936 8.869 -0.498 1306 H172 ACD 300 HAI ACD 300 2.076 7.706 -1.529 1307 H181 ACD 300 HAF ACD 300 0.701 9.737 -2.372 1308 H182 ACD 300 HAG ACD 300 1.945 10.743 -1.597 1309 H191 ACD 300 HAD ACD 300 3.693 9.772 -2.948 1310 H192 ACD 300 HAE ACD 300 2.590 8.531 -3.587 1311 H201 ACD 300 HAA ACD 300 2.913 10.315 -5.243 1312 H202 ACD 300 HAB ACD 300 2.386 11.542 -4.069 1313 H203 ACD 300 HAC ACD 300 1.232 10.330 -4.672 Start of MODEL 15 1 H1 MET 1 HT1 MET 1 4.703 12.896 -19.927 2 H2 MET 1 HT2 MET 1 6.263 12.417 -20.397 3 H3 MET 1 HT3 MET 1 5.094 12.787 -21.573 4 HA MET 1 HA MET 1 6.016 14.785 -19.598 5 HB2 MET 1 HB2 MET 1 7.145 14.147 -22.339 6 HB3 MET 1 HB1 MET 1 7.507 15.618 -21.435 7 HG2 MET 1 HG2 MET 1 8.318 14.172 -19.542 8 HG3 MET 1 HG1 MET 1 8.113 12.771 -20.592 9 HE1 MET 1 HE1 MET 1 10.497 13.049 -23.365 10 HE2 MET 1 HE2 MET 1 8.875 12.624 -22.824 11 HE3 MET 1 HE3 MET 1 9.174 14.192 -23.586 12 H THR 2 HN THR 2 3.551 14.995 -19.818 13 HA THR 2 HA THR 2 3.019 17.138 -21.684 14 HB THR 2 HB THR 2 2.468 15.454 -23.236 15 HG1 THR 2 HG1 THR 2 -0.038 15.607 -22.035 16 HG21 THR 2 HG21 THR 2 1.212 14.002 -20.894 17 HG22 THR 2 HG22 THR 2 1.050 13.484 -22.572 18 HG23 THR 2 HG23 THR 2 2.640 13.512 -21.808 19 H VAL 3 HN VAL 3 2.943 16.207 -18.730 20 HA VAL 3 HA VAL 3 0.445 17.615 -18.098 21 HB VAL 3 HB VAL 3 0.028 15.845 -16.287 22 HG11 VAL 3 HG11 VAL 3 -1.182 14.388 -17.879 23 HG12 VAL 3 HG12 VAL 3 -1.382 16.091 -18.293 24 HG13 VAL 3 HG13 VAL 3 -0.261 15.086 -19.211 25 HG21 VAL 3 HG21 VAL 3 0.944 13.627 -16.717 26 HG22 VAL 3 HG22 VAL 3 1.779 14.216 -18.155 27 HG23 VAL 3 HG23 VAL 3 2.277 14.770 -16.556 28 HA PRO 4 HA PRO 4 4.337 18.893 -15.748 29 HB2 PRO 4 HB2 PRO 4 2.806 21.450 -16.063 30 HB3 PRO 4 HB1 PRO 4 4.550 21.156 -16.211 31 HG2 PRO 4 HG2 PRO 4 3.027 21.502 -18.365 32 HG3 PRO 4 HG1 PRO 4 4.364 20.336 -18.359 33 HD2 PRO 4 HD2 PRO 4 1.420 19.821 -18.226 34 HD3 PRO 4 HD1 PRO 4 2.707 18.835 -18.954 35 H ASP 5 HN ASP 5 0.954 18.855 -15.296 36 HA ASP 5 HA ASP 5 0.533 20.170 -12.894 37 HB2 ASP 5 HB2 ASP 5 -0.676 17.585 -13.896 38 HB3 ASP 5 HB1 ASP 5 -1.286 18.493 -12.514 39 H ARG 6 HN ARG 6 1.907 16.966 -13.469 40 HA ARG 6 HA ARG 6 1.941 16.006 -10.844 41 HB2 ARG 6 HB2 ARG 6 2.490 14.593 -12.752 42 HB3 ARG 6 HB1 ARG 6 3.935 15.548 -13.075 43 HG2 ARG 6 HG2 ARG 6 3.759 14.531 -10.295 44 HG3 ARG 6 HG1 ARG 6 3.886 13.270 -11.515 45 HD2 ARG 6 HD2 ARG 6 5.777 15.614 -11.168 46 HD3 ARG 6 HD1 ARG 6 6.119 13.931 -10.780 47 HE ARG 6 HE ARG 6 5.471 13.790 -13.402 48 HH11 ARG 6 HH21 ARG 6 7.560 15.855 -11.574 49 HH12 ARG 6 HH22 ARG 6 8.676 16.109 -12.875 50 HH21 ARG 6 HH11 ARG 6 6.929 14.119 -15.112 51 HH22 ARG 6 HH12 ARG 6 8.318 15.127 -14.879 52 H SER 7 HN SER 7 4.336 17.973 -12.579 53 HA SER 7 HA SER 7 6.274 18.099 -10.549 54 HB2 SER 7 HB2 SER 7 5.611 20.194 -12.628 55 HB3 SER 7 HB1 SER 7 7.119 20.069 -11.725 56 HG SER 7 HG SER 7 6.040 18.311 -13.661 57 H GLU 8 HN GLU 8 3.312 19.880 -11.057 58 HA GLU 8 HA GLU 8 3.814 21.999 -9.235 59 HB2 GLU 8 HB2 GLU 8 2.037 21.937 -11.037 60 HB3 GLU 8 HB1 GLU 8 1.105 20.889 -9.968 61 HG2 GLU 8 HG2 GLU 8 0.348 23.131 -9.565 62 HG3 GLU 8 HG1 GLU 8 1.342 22.674 -8.182 63 H ILE 9 HN ILE 9 2.110 18.886 -8.856 64 HA ILE 9 HA ILE 9 1.672 19.419 -6.023 65 HB ILE 9 HB ILE 9 0.044 18.247 -7.623 66 HG12 ILE 9 HG12 ILE 9 0.315 18.158 -4.891 67 HG13 ILE 9 HG11 ILE 9 -1.044 17.485 -5.757 68 HG21 ILE 9 HG21 ILE 9 1.937 15.951 -7.102 69 HG22 ILE 9 HG22 ILE 9 0.339 15.798 -7.814 70 HG23 ILE 9 HG23 ILE 9 1.591 16.702 -8.654 71 HD11 ILE 9 HD11 ILE 9 0.032 15.290 -5.765 72 HD12 ILE 9 HD12 ILE 9 1.454 15.991 -4.982 73 HD13 ILE 9 HD13 ILE 9 -0.075 15.907 -4.118 74 H ALA 10 HN ALA 10 3.810 17.602 -8.051 75 HA ALA 10 HA ALA 10 4.752 15.781 -6.112 76 HB1 ALA 10 HB1 ALA 10 5.995 16.867 -8.616 77 HB2 ALA 10 HB2 ALA 10 5.416 15.234 -8.291 78 HB3 ALA 10 HB3 ALA 10 6.904 15.808 -7.539 79 H GLY 11 HN GLY 11 6.384 15.906 -4.563 80 HA2 GLY 11 HA2 GLY 11 8.289 17.177 -3.675 81 HA3 GLY 11 HA1 GLY 11 7.372 18.641 -4.028 82 H LYS 12 HN LYS 12 4.817 17.384 -3.264 83 HA LYS 12 HA LYS 12 5.010 16.644 -0.484 84 HB2 LYS 12 HB2 LYS 12 5.396 19.028 -0.249 85 HB3 LYS 12 HB1 LYS 12 3.978 19.384 -1.234 86 HG2 LYS 12 HG2 LYS 12 2.492 18.499 0.425 87 HG3 LYS 12 HG1 LYS 12 3.828 17.794 1.334 88 HD2 LYS 12 HD2 LYS 12 2.992 19.911 2.359 89 HD3 LYS 12 HD1 LYS 12 4.685 20.016 1.876 90 HE2 LYS 12 HE2 LYS 12 3.109 21.979 1.239 91 HE3 LYS 12 HE1 LYS 12 4.192 21.351 -0.002 92 HZ1 LYS 12 HZ1 LYS 12 2.329 19.888 -0.714 93 HZ2 LYS 12 HZ2 LYS 12 1.314 20.729 0.357 94 HZ3 LYS 12 HZ3 LYS 12 2.035 21.546 -0.943 95 H TRP 13 HN TRP 13 3.457 15.032 -0.467 96 HA TRP 13 HA TRP 13 0.821 15.613 -1.701 97 HB2 TRP 13 HB2 TRP 13 2.359 13.020 -1.350 98 HB3 TRP 13 HB1 TRP 13 0.667 13.045 -1.806 99 HD1 TRP 13 HD1 TRP 13 3.851 14.822 -3.057 100 HE1 TRP 13 HE1 TRP 13 3.790 14.674 -5.628 101 HE3 TRP 13 HE3 TRP 13 -0.612 12.436 -3.762 102 HZ2 TRP 13 HZ2 TRP 13 2.180 13.710 -7.650 103 HZ3 TRP 13 HZ3 TRP 13 -1.398 11.930 -6.061 104 HH2 TRP 13 HH2 TRP 13 -0.014 12.574 -8.019 105 H TYR 14 HN TYR 14 -0.820 15.729 -0.199 106 HA TYR 14 HA TYR 14 -0.231 14.811 2.546 107 HB2 TYR 14 HB2 TYR 14 -1.752 17.026 1.301 108 HB3 TYR 14 HB1 TYR 14 -2.458 16.348 2.760 109 HD1 TYR 14 HD2 TYR 14 1.192 16.547 2.021 110 HD2 TYR 14 HD1 TYR 14 -2.113 18.175 4.214 111 HE1 TYR 14 HE2 TYR 14 2.760 17.854 3.411 112 HE2 TYR 14 HE1 TYR 14 -0.547 19.473 5.617 113 HH TYR 14 HH TYR 14 2.767 19.842 4.806 114 H VAL 15 HN VAL 15 -1.473 13.361 3.593 115 HA VAL 15 HA VAL 15 -3.868 12.277 2.215 116 HB VAL 15 HB VAL 15 -1.715 10.943 3.870 117 HG11 VAL 15 HG11 VAL 15 -4.573 10.074 3.439 118 HG12 VAL 15 HG12 VAL 15 -3.292 8.889 3.689 119 HG13 VAL 15 HG13 VAL 15 -3.643 10.084 4.938 120 HG21 VAL 15 HG21 VAL 15 -1.835 9.309 1.967 121 HG22 VAL 15 HG22 VAL 15 -3.029 10.360 1.210 122 HG23 VAL 15 HG23 VAL 15 -1.383 10.936 1.461 123 H VAL 16 HN VAL 16 -5.501 13.453 3.253 124 HA VAL 16 HA VAL 16 -5.407 13.506 6.211 125 HB VAL 16 HB VAL 16 -6.804 15.367 6.234 126 HG11 VAL 16 HG11 VAL 16 -4.506 15.448 4.347 127 HG12 VAL 16 HG12 VAL 16 -5.625 16.796 4.203 128 HG13 VAL 16 HG13 VAL 16 -4.853 16.461 5.741 129 HG21 VAL 16 HG21 VAL 16 -7.357 14.673 3.344 130 HG22 VAL 16 HG22 VAL 16 -8.507 14.883 4.665 131 HG23 VAL 16 HG23 VAL 16 -7.698 16.286 3.968 132 H ALA 17 HN ALA 17 -6.503 11.351 4.246 133 HA ALA 17 HA ALA 17 -8.515 10.510 6.029 134 HB1 ALA 17 HB1 ALA 17 -9.438 12.069 3.654 135 HB2 ALA 17 HB2 ALA 17 -10.084 12.050 5.286 136 HB3 ALA 17 HB3 ALA 17 -10.416 10.706 4.195 137 H LEU 18 HN LEU 18 -8.782 8.332 5.795 138 HA LEU 18 HA LEU 18 -8.088 7.156 3.204 139 HB2 LEU 18 HB2 LEU 18 -7.161 5.253 4.716 140 HB3 LEU 18 HB1 LEU 18 -6.177 6.684 4.433 141 HG LEU 18 HG LEU 18 -6.284 5.959 6.829 142 HD11 LEU 18 HD11 LEU 18 -6.297 8.531 5.800 143 HD12 LEU 18 HD12 LEU 18 -7.551 8.593 7.038 144 HD13 LEU 18 HD13 LEU 18 -5.918 8.089 7.460 145 HD21 LEU 18 HD21 LEU 18 -9.111 7.012 6.806 146 HD22 LEU 18 HD22 LEU 18 -8.747 5.295 6.640 147 HD23 LEU 18 HD23 LEU 18 -8.286 6.161 8.100 148 H ALA 19 HN ALA 19 -8.688 4.792 3.176 149 HA ALA 19 HA ALA 19 -11.165 4.208 4.629 150 HB1 ALA 19 HB1 ALA 19 -12.553 4.169 2.819 151 HB2 ALA 19 HB2 ALA 19 -11.291 3.583 1.736 152 HB3 ALA 19 HB3 ALA 19 -11.378 5.296 2.147 153 H SER 20 HN SER 20 -11.445 2.075 5.037 154 HA SER 20 HA SER 20 -10.144 -0.021 3.591 155 HB2 SER 20 HB2 SER 20 -8.229 1.013 4.875 156 HB3 SER 20 HB1 SER 20 -9.045 0.507 6.352 157 HG SER 20 HG SER 20 -8.699 -1.360 4.297 158 H ASN 21 HN ASN 21 -10.160 -2.076 5.080 159 HA ASN 21 HA ASN 21 -12.602 -2.082 6.739 160 HB2 ASN 21 HB2 ASN 21 -11.975 -4.232 4.724 161 HB3 ASN 21 HB1 ASN 21 -13.449 -4.036 5.665 162 HD21 ASN 21 HD21 ASN 21 -12.879 -3.960 2.613 163 HD22 ASN 21 HD22 ASN 21 -13.629 -2.523 2.109 164 H THR 22 HN THR 22 -9.373 -3.031 6.182 165 HA THR 22 HA THR 22 -9.360 -5.340 7.905 166 HB THR 22 HB THR 22 -7.639 -5.047 6.169 167 HG1 THR 22 HG1 THR 22 -5.881 -4.904 8.094 168 HG21 THR 22 HG21 THR 22 -6.265 -3.220 6.018 169 HG22 THR 22 HG22 THR 22 -7.615 -2.424 6.823 170 HG23 THR 22 HG23 THR 22 -6.229 -2.975 7.762 171 H GLU 23 HN GLU 23 -9.834 -5.125 9.981 172 HA GLU 23 HA GLU 23 -9.978 -2.801 11.417 173 HB2 GLU 23 HB2 GLU 23 -9.409 -5.570 12.470 174 HB3 GLU 23 HB1 GLU 23 -9.961 -4.210 13.449 175 HG2 GLU 23 HG2 GLU 23 -11.462 -5.286 11.045 176 HG3 GLU 23 HG1 GLU 23 -11.816 -5.737 12.712 177 H PHE 24 HN PHE 24 -7.151 -4.911 11.165 178 HA PHE 24 HA PHE 24 -5.604 -3.843 13.166 179 HB2 PHE 24 HB2 PHE 24 -4.209 -4.275 10.571 180 HB3 PHE 24 HB1 PHE 24 -3.833 -4.910 12.171 181 HD1 PHE 24 HD1 PHE 24 -6.357 -6.161 12.989 182 HD2 PHE 24 HD2 PHE 24 -4.417 -6.139 9.155 183 HE1 PHE 24 HE1 PHE 24 -7.490 -8.287 12.402 184 HE2 PHE 24 HE2 PHE 24 -5.549 -8.265 8.570 185 HZ PHE 24 HZ PHE 24 -7.086 -9.340 10.193 186 H PHE 25 HN PHE 25 -5.701 -2.644 9.790 187 HA PHE 25 HA PHE 25 -4.146 -0.310 10.462 188 HB2 PHE 25 HB2 PHE 25 -5.738 -0.702 7.936 189 HB3 PHE 25 HB1 PHE 25 -4.291 0.269 8.173 190 HD1 PHE 25 HD2 PHE 25 -3.093 -2.206 10.017 191 HD2 PHE 25 HD1 PHE 25 -4.557 -1.727 5.997 192 HE1 PHE 25 HE2 PHE 25 -1.737 -4.132 9.291 193 HE2 PHE 25 HE1 PHE 25 -3.189 -3.662 5.282 194 HZ PHE 25 HZ PHE 25 -1.782 -4.866 6.926 195 H LEU 26 HN LEU 26 -7.538 -0.911 9.716 196 HA LEU 26 HA LEU 26 -8.420 1.771 9.720 197 HB2 LEU 26 HB2 LEU 26 -9.776 -0.043 8.842 198 HB3 LEU 26 HB1 LEU 26 -9.839 -0.805 10.424 199 HG LEU 26 HG LEU 26 -11.087 1.113 11.316 200 HD11 LEU 26 HD11 LEU 26 -10.582 2.178 8.537 201 HD12 LEU 26 HD12 LEU 26 -11.984 2.718 9.458 202 HD13 LEU 26 HD13 LEU 26 -10.362 2.990 10.087 203 HD21 LEU 26 HD21 LEU 26 -12.271 0.107 8.708 204 HD22 LEU 26 HD22 LEU 26 -12.233 -0.829 10.201 205 HD23 LEU 26 HD23 LEU 26 -13.164 0.667 10.126 206 H ARG 27 HN ARG 27 -7.758 -0.527 12.170 207 HA ARG 27 HA ARG 27 -8.975 0.780 14.397 208 HB2 ARG 27 HB2 ARG 27 -8.352 -1.530 14.653 209 HB3 ARG 27 HB1 ARG 27 -6.666 -1.174 14.269 210 HG2 ARG 27 HG2 ARG 27 -6.367 0.042 16.311 211 HG3 ARG 27 HG1 ARG 27 -8.102 0.057 16.631 212 HD2 ARG 27 HD2 ARG 27 -8.090 -2.385 16.891 213 HD3 ARG 27 HD1 ARG 27 -6.367 -2.426 16.529 214 HE ARG 27 HE ARG 27 -5.943 -1.691 18.696 215 HH11 ARG 27 HH21 ARG 27 -9.273 -1.275 17.852 216 HH12 ARG 27 HH22 ARG 27 -9.769 -0.847 19.454 217 HH21 ARG 27 HH11 ARG 27 -6.586 -1.128 20.801 218 HH22 ARG 27 HH12 ARG 27 -8.248 -0.763 21.124 219 H GLU 28 HN GLU 28 -5.640 0.813 13.129 220 HA GLU 28 HA GLU 28 -4.820 2.799 15.056 221 HB2 GLU 28 HB2 GLU 28 -3.413 1.619 12.659 222 HB3 GLU 28 HB1 GLU 28 -2.666 2.722 13.815 223 HG2 GLU 28 HG2 GLU 28 -3.192 1.132 15.646 224 HG3 GLU 28 HG1 GLU 28 -3.880 0.020 14.464 225 H LYS 29 HN LYS 29 -5.438 2.927 11.456 226 HA LYS 29 HA LYS 29 -4.515 5.476 11.047 227 HB2 LYS 29 HB2 LYS 29 -6.703 3.835 9.823 228 HB3 LYS 29 HB1 LYS 29 -6.510 5.517 9.336 229 HG2 LYS 29 HG2 LYS 29 -4.611 5.081 8.140 230 HG3 LYS 29 HG1 LYS 29 -3.952 4.040 9.394 231 HD2 LYS 29 HD2 LYS 29 -4.333 2.721 7.389 232 HD3 LYS 29 HD1 LYS 29 -5.463 2.216 8.634 233 HE2 LYS 29 HE2 LYS 29 -7.080 3.944 7.529 234 HE3 LYS 29 HE1 LYS 29 -5.997 3.803 6.145 235 HZ1 LYS 29 HZ1 LYS 29 -6.410 1.517 5.981 236 HZ2 LYS 29 HZ2 LYS 29 -7.162 1.448 7.502 237 HZ3 LYS 29 HZ3 LYS 29 -7.937 2.227 6.209 238 H ASP 30 HN ASP 30 -7.529 4.424 12.495 239 HA ASP 30 HA ASP 30 -8.870 6.868 12.521 240 HB2 ASP 30 HB2 ASP 30 -9.833 4.644 13.123 241 HB3 ASP 30 HB1 ASP 30 -8.990 4.749 14.668 242 H LYS 31 HN LYS 31 -6.082 5.913 14.468 243 HA LYS 31 HA LYS 31 -6.630 8.211 16.222 244 HB2 LYS 31 HB2 LYS 31 -5.306 7.243 17.940 245 HB3 LYS 31 HB1 LYS 31 -6.432 6.031 17.354 246 HG2 LYS 31 HG2 LYS 31 -4.424 4.845 17.513 247 HG3 LYS 31 HG1 LYS 31 -4.499 5.265 15.818 248 HD2 LYS 31 HD2 LYS 31 -3.163 7.399 17.277 249 HD3 LYS 31 HD1 LYS 31 -2.409 5.859 17.658 250 HE2 LYS 31 HE2 LYS 31 -2.994 6.490 14.782 251 HE3 LYS 31 HE1 LYS 31 -1.605 7.242 15.553 252 HZ1 LYS 31 HZ1 LYS 31 -1.863 4.619 14.597 253 HZ2 LYS 31 HZ2 LYS 31 -0.504 5.361 15.296 254 HZ3 LYS 31 HZ3 LYS 31 -1.625 4.553 16.278 255 H MET 32 HN MET 32 -4.444 7.453 13.673 256 HA MET 32 HA MET 32 -2.330 9.110 14.812 257 HB2 MET 32 HB2 MET 32 -1.284 8.959 12.536 258 HB3 MET 32 HB1 MET 32 -1.557 7.409 13.304 259 HG2 MET 32 HG2 MET 32 -3.859 7.522 11.981 260 HG3 MET 32 HG1 MET 32 -2.951 8.633 10.957 261 HE1 MET 32 HE1 MET 32 -3.041 5.558 12.849 262 HE2 MET 32 HE2 MET 32 -2.517 4.261 11.797 263 HE3 MET 32 HE3 MET 32 -1.340 5.151 12.770 264 H LYS 33 HN LYS 33 -1.437 10.706 12.917 265 HA LYS 33 HA LYS 33 -3.601 12.689 12.575 266 HB2 LYS 33 HB2 LYS 33 -0.634 13.250 12.601 267 HB3 LYS 33 HB1 LYS 33 -1.958 14.402 12.762 268 HG2 LYS 33 HG2 LYS 33 -1.314 12.209 14.757 269 HG3 LYS 33 HG1 LYS 33 -0.892 13.909 14.949 270 HD2 LYS 33 HD2 LYS 33 -3.404 14.389 14.624 271 HD3 LYS 33 HD1 LYS 33 -3.641 12.662 14.903 272 HE2 LYS 33 HE2 LYS 33 -2.507 14.723 16.793 273 HE3 LYS 33 HE1 LYS 33 -3.865 13.628 17.051 274 HZ1 LYS 33 HZ1 LYS 33 -1.874 12.888 18.215 275 HZ2 LYS 33 HZ2 LYS 33 -2.340 11.766 17.027 276 HZ3 LYS 33 HZ3 LYS 33 -1.029 12.804 16.744 277 H MET 34 HN MET 34 -2.940 14.232 10.636 278 HA MET 34 HA MET 34 -3.164 12.789 8.265 279 HB2 MET 34 HB2 MET 34 -3.800 15.104 8.562 280 HB3 MET 34 HB1 MET 34 -2.122 15.570 8.814 281 HG2 MET 34 HG2 MET 34 -1.801 14.424 6.429 282 HG3 MET 34 HG1 MET 34 -3.506 14.779 6.283 283 HE1 MET 34 HE1 MET 34 -4.154 17.025 7.761 284 HE2 MET 34 HE2 MET 34 -2.728 17.688 8.551 285 HE3 MET 34 HE3 MET 34 -3.514 18.575 7.245 286 H ALA 35 HN ALA 35 -1.634 12.338 6.603 287 HA ALA 35 HA ALA 35 1.200 12.273 7.468 288 HB1 ALA 35 HB1 ALA 35 0.088 10.543 5.281 289 HB2 ALA 35 HB2 ALA 35 -0.162 10.102 6.968 290 HB3 ALA 35 HB3 ALA 35 1.474 10.260 6.333 291 H MET 36 HN MET 36 2.813 12.468 5.756 292 HA MET 36 HA MET 36 1.961 14.112 3.457 293 HB2 MET 36 HB2 MET 36 4.552 14.970 4.216 294 HB3 MET 36 HB1 MET 36 3.050 15.867 4.364 295 HG2 MET 36 HG2 MET 36 3.976 13.900 6.462 296 HG3 MET 36 HG1 MET 36 4.379 15.613 6.511 297 HE1 MET 36 HE1 MET 36 1.257 17.509 6.896 298 HE2 MET 36 HE2 MET 36 2.632 17.305 7.976 299 HE3 MET 36 HE3 MET 36 2.882 17.387 6.228 300 H ALA 37 HN ALA 37 3.421 14.054 1.643 301 HA ALA 37 HA ALA 37 5.569 12.091 1.621 302 HB1 ALA 37 HB1 ALA 37 2.908 11.571 0.350 303 HB2 ALA 37 HB2 ALA 37 3.930 10.488 1.289 304 HB3 ALA 37 HB3 ALA 37 4.369 10.898 -0.371 305 H ARG 38 HN ARG 38 6.665 11.918 -0.474 306 HA ARG 38 HA ARG 38 6.270 14.266 -2.256 307 HB2 ARG 38 HB2 ARG 38 8.156 14.869 -0.910 308 HB3 ARG 38 HB1 ARG 38 8.838 13.248 -1.019 309 HG2 ARG 38 HG2 ARG 38 9.495 13.532 -3.258 310 HG3 ARG 38 HG1 ARG 38 8.384 14.877 -3.514 311 HD2 ARG 38 HD2 ARG 38 10.739 15.642 -3.321 312 HD3 ARG 38 HD1 ARG 38 9.724 16.302 -2.042 313 HE ARG 38 HE ARG 38 11.022 15.142 -0.518 314 HH11 ARG 38 HH21 ARG 38 11.349 13.780 -3.682 315 HH12 ARG 38 HH22 ARG 38 12.584 12.657 -3.221 316 HH21 ARG 38 HH11 ARG 38 12.642 13.674 0.094 317 HH22 ARG 38 HH12 ARG 38 13.317 12.597 -1.084 318 H ILE 39 HN ILE 39 6.321 13.710 -4.522 319 HA ILE 39 HA ILE 39 7.164 10.999 -5.170 320 HB ILE 39 HB ILE 39 4.736 11.405 -5.051 321 HG12 ILE 39 HG12 ILE 39 5.619 10.838 -7.881 322 HG13 ILE 39 HG11 ILE 39 5.750 9.648 -6.588 323 HG21 ILE 39 HG21 ILE 39 4.899 13.671 -5.855 324 HG22 ILE 39 HG22 ILE 39 5.221 13.049 -7.464 325 HG23 ILE 39 HG23 ILE 39 3.714 12.679 -6.672 326 HD11 ILE 39 HD11 ILE 39 3.497 9.261 -6.571 327 HD12 ILE 39 HD12 ILE 39 3.114 10.981 -6.679 328 HD13 ILE 39 HD13 ILE 39 3.483 10.063 -8.130 329 H SER 40 HN SER 40 8.250 10.667 -7.075 330 HA SER 40 HA SER 40 8.943 13.050 -8.672 331 HB2 SER 40 HB2 SER 40 11.023 13.067 -7.781 332 HB3 SER 40 HB1 SER 40 10.727 11.567 -6.914 333 HG SER 40 HG SER 40 11.400 11.803 -9.666 334 H PHE 41 HN PHE 41 9.344 12.629 -10.843 335 HA PHE 41 HA PHE 41 8.375 10.040 -11.770 336 HB2 PHE 41 HB2 PHE 41 8.520 12.771 -12.827 337 HB3 PHE 41 HB1 PHE 41 8.930 11.551 -14.028 338 HD1 PHE 41 HD2 PHE 41 6.543 11.389 -11.140 339 HD2 PHE 41 HD1 PHE 41 7.037 11.346 -15.408 340 HE1 PHE 41 HE2 PHE 41 4.139 10.845 -11.414 341 HE2 PHE 41 HE1 PHE 41 4.633 10.801 -15.681 342 HZ PHE 41 HZ PHE 41 3.185 10.551 -13.684 343 H LEU 42 HN LEU 42 9.711 8.498 -11.976 344 HA LEU 42 HA LEU 42 12.531 8.913 -12.752 345 HB2 LEU 42 HB2 LEU 42 10.993 6.480 -11.830 346 HB3 LEU 42 HB1 LEU 42 12.615 6.371 -12.473 347 HG LEU 42 HG LEU 42 11.787 8.041 -10.084 348 HD11 LEU 42 HD11 LEU 42 12.964 5.277 -10.378 349 HD12 LEU 42 HD12 LEU 42 13.287 6.235 -8.934 350 HD13 LEU 42 HD13 LEU 42 11.629 5.808 -9.356 351 HD21 LEU 42 HD21 LEU 42 14.357 7.666 -11.589 352 HD22 LEU 42 HD22 LEU 42 13.721 9.108 -10.798 353 HD23 LEU 42 HD23 LEU 42 14.446 7.824 -9.834 354 H GLY 43 HN GLY 43 9.540 7.532 -13.781 355 HA2 GLY 43 HA2 GLY 43 9.851 7.902 -16.529 356 HA3 GLY 43 HA1 GLY 43 10.320 6.241 -16.163 357 H GLU 44 HN GLU 44 7.941 7.169 -17.667 358 HA GLU 44 HA GLU 44 5.589 7.136 -16.183 359 HB2 GLU 44 HB2 GLU 44 6.165 6.006 -18.935 360 HB3 GLU 44 HB1 GLU 44 4.543 6.125 -18.254 361 HG2 GLU 44 HG2 GLU 44 6.421 8.487 -18.508 362 HG3 GLU 44 HG1 GLU 44 5.207 8.076 -19.719 363 H ASP 45 HN ASP 45 7.759 4.524 -16.985 364 HA ASP 45 HA ASP 45 5.901 2.532 -15.861 365 HB2 ASP 45 HB2 ASP 45 8.610 1.852 -16.961 366 HB3 ASP 45 HB1 ASP 45 7.132 0.893 -16.959 367 H GLU 46 HN GLU 46 7.763 4.687 -14.533 368 HA GLU 46 HA GLU 46 8.333 3.143 -12.190 369 HB2 GLU 46 HB2 GLU 46 10.213 2.472 -13.703 370 HB3 GLU 46 HB1 GLU 46 10.715 4.161 -13.754 371 HG2 GLU 46 HG2 GLU 46 10.864 4.101 -11.230 372 HG3 GLU 46 HG1 GLU 46 10.594 2.363 -11.325 373 H LEU 47 HN LEU 47 8.101 4.502 -10.512 374 HA LEU 47 HA LEU 47 9.062 7.266 -10.751 375 HB2 LEU 47 HB2 LEU 47 6.841 7.809 -9.362 376 HB3 LEU 47 HB1 LEU 47 6.889 7.898 -11.117 377 HG LEU 47 HG LEU 47 6.121 5.354 -9.688 378 HD11 LEU 47 HD11 LEU 47 4.599 7.015 -8.847 379 HD12 LEU 47 HD12 LEU 47 4.376 7.699 -10.457 380 HD13 LEU 47 HD13 LEU 47 3.744 6.095 -10.084 381 HD21 LEU 47 HD21 LEU 47 4.692 5.446 -12.015 382 HD22 LEU 47 HD22 LEU 47 6.130 6.341 -12.499 383 HD23 LEU 47 HD23 LEU 47 6.278 4.698 -11.880 384 H LYS 48 HN LYS 48 9.594 8.235 -8.765 385 HA LYS 48 HA LYS 48 10.023 6.276 -6.587 386 HB2 LYS 48 HB2 LYS 48 11.917 7.700 -7.774 387 HB3 LYS 48 HB1 LYS 48 11.368 8.959 -6.673 388 HG2 LYS 48 HG2 LYS 48 11.717 7.453 -4.758 389 HG3 LYS 48 HG1 LYS 48 12.233 6.170 -5.853 390 HD2 LYS 48 HD2 LYS 48 13.972 7.972 -6.685 391 HD3 LYS 48 HD1 LYS 48 13.652 8.719 -5.120 392 HE2 LYS 48 HE2 LYS 48 14.082 6.384 -4.120 393 HE3 LYS 48 HE1 LYS 48 14.774 5.977 -5.691 394 HZ1 LYS 48 HZ1 LYS 48 15.869 8.403 -5.042 395 HZ2 LYS 48 HZ2 LYS 48 15.885 7.536 -3.580 396 HZ3 LYS 48 HZ3 LYS 48 16.642 6.892 -4.954 397 H VAL 49 HN VAL 49 8.737 6.468 -4.804 398 HA VAL 49 HA VAL 49 7.895 9.162 -4.074 399 HB VAL 49 HB VAL 49 6.074 7.771 -5.389 400 HG11 VAL 49 HG11 VAL 49 5.617 6.841 -2.554 401 HG12 VAL 49 HG12 VAL 49 4.435 6.735 -3.857 402 HG13 VAL 49 HG13 VAL 49 5.939 5.825 -3.951 403 HG21 VAL 49 HG21 VAL 49 4.624 9.359 -4.674 404 HG22 VAL 49 HG22 VAL 49 4.906 9.011 -2.985 405 HG23 VAL 49 HG23 VAL 49 6.009 10.014 -3.864 406 H SER 50 HN SER 50 7.640 9.636 -2.087 407 HA SER 50 HA SER 50 8.758 7.735 -0.090 408 HB2 SER 50 HB2 SER 50 8.968 10.727 -0.357 409 HB3 SER 50 HB1 SER 50 9.332 9.906 1.156 410 HG SER 50 HG SER 50 10.739 10.005 -1.196 411 H TYR 51 HN TYR 51 7.804 7.480 1.925 412 HA TYR 51 HA TYR 51 5.104 8.664 2.221 413 HB2 TYR 51 HB2 TYR 51 6.325 6.148 3.398 414 HB3 TYR 51 HB1 TYR 51 4.717 6.750 3.768 415 HD1 TYR 51 HD1 TYR 51 6.708 6.164 0.598 416 HD2 TYR 51 HD2 TYR 51 3.036 5.529 2.748 417 HE1 TYR 51 HE1 TYR 51 5.802 4.884 -1.313 418 HE2 TYR 51 HE2 TYR 51 2.146 4.248 0.826 419 HH TYR 51 HH TYR 51 2.474 3.953 -1.493 420 H ALA 52 HN ALA 52 4.835 10.066 3.907 421 HA ALA 52 HA ALA 52 6.728 9.906 6.179 422 HB1 ALA 52 HB1 ALA 52 6.843 11.934 4.427 423 HB2 ALA 52 HB2 ALA 52 7.123 12.172 6.150 424 HB3 ALA 52 HB3 ALA 52 5.551 12.549 5.455 425 H VAL 53 HN VAL 53 5.548 9.100 7.819 426 HA VAL 53 HA VAL 53 2.840 10.210 8.250 427 HB VAL 53 HB VAL 53 3.677 7.466 9.156 428 HG11 VAL 53 HG11 VAL 53 1.026 8.761 8.456 429 HG12 VAL 53 HG12 VAL 53 1.225 7.077 8.937 430 HG13 VAL 53 HG13 VAL 53 1.604 8.370 10.074 431 HG21 VAL 53 HG21 VAL 53 4.129 7.313 6.831 432 HG22 VAL 53 HG22 VAL 53 2.486 6.697 7.003 433 HG23 VAL 53 HG23 VAL 53 2.757 8.335 6.412 434 HA PRO 54 HA PRO 54 4.720 11.295 12.187 435 HB2 PRO 54 HB2 PRO 54 2.561 12.390 13.405 436 HB3 PRO 54 HB1 PRO 54 3.390 13.203 12.062 437 HG2 PRO 54 HG2 PRO 54 0.881 11.583 12.027 438 HG3 PRO 54 HG1 PRO 54 1.238 13.120 11.217 439 HD2 PRO 54 HD2 PRO 54 1.348 10.693 9.936 440 HD3 PRO 54 HD1 PRO 54 2.340 12.092 9.462 441 H LYS 55 HN LYS 55 4.493 10.727 14.486 442 HA LYS 55 HA LYS 55 2.523 8.813 15.315 443 HB2 LYS 55 HB2 LYS 55 4.192 7.503 13.866 444 HB3 LYS 55 HB1 LYS 55 5.340 7.760 15.179 445 HG2 LYS 55 HG2 LYS 55 3.636 6.772 16.757 446 HG3 LYS 55 HG1 LYS 55 2.663 6.352 15.346 447 HD2 LYS 55 HD2 LYS 55 4.795 5.180 14.464 448 HD3 LYS 55 HD1 LYS 55 5.387 5.306 16.121 449 HE2 LYS 55 HE2 LYS 55 2.867 3.903 15.193 450 HE3 LYS 55 HE1 LYS 55 4.310 3.151 15.871 451 HZ1 LYS 55 HZ1 LYS 55 2.197 3.752 17.329 452 HZ2 LYS 55 HZ2 LYS 55 3.776 3.784 17.958 453 HZ3 LYS 55 HZ3 LYS 55 3.031 5.226 17.466 454 HA PRO 56 HA PRO 56 4.118 11.560 18.688 455 HB2 PRO 56 HB2 PRO 56 1.904 9.970 19.958 456 HB3 PRO 56 HB1 PRO 56 2.304 11.690 20.148 457 HG2 PRO 56 HG2 PRO 56 0.301 10.923 18.582 458 HG3 PRO 56 HG1 PRO 56 1.357 12.272 18.124 459 HD2 PRO 56 HD2 PRO 56 1.227 9.523 16.990 460 HD3 PRO 56 HD1 PRO 56 1.754 11.036 16.215 461 H ASN 57 HN ASN 57 3.898 8.143 18.329 462 HA ASN 57 HA ASN 57 5.445 7.634 20.789 463 HB2 ASN 57 HB2 ASN 57 4.051 5.757 18.869 464 HB3 ASN 57 HB1 ASN 57 4.984 5.240 20.273 465 HD21 ASN 57 HD21 ASN 57 4.174 7.197 22.167 466 HD22 ASN 57 HD22 ASN 57 2.513 7.013 22.467 467 H GLY 58 HN GLY 58 6.372 8.822 18.110 468 HA2 GLY 58 HA2 GLY 58 8.820 8.649 17.680 469 HA3 GLY 58 HA1 GLY 58 8.584 6.905 17.602 470 H CYS 59 HN CYS 59 8.069 9.957 15.972 471 HA CYS 59 HA CYS 59 6.519 9.251 13.804 472 HB2 CYS 59 HB2 CYS 59 8.967 10.983 13.504 473 HB3 CYS 59 HB1 CYS 59 7.411 11.129 12.687 474 H ARG 60 HN ARG 60 6.983 8.546 11.673 475 HA ARG 60 HA ARG 60 9.534 7.076 11.341 476 HB2 ARG 60 HB2 ARG 60 7.664 5.532 11.943 477 HB3 ARG 60 HB1 ARG 60 6.809 6.066 10.497 478 HG2 ARG 60 HG2 ARG 60 8.687 5.306 9.093 479 HG3 ARG 60 HG1 ARG 60 9.555 4.779 10.536 480 HD2 ARG 60 HD2 ARG 60 7.671 3.238 11.064 481 HD3 ARG 60 HD1 ARG 60 6.889 3.716 9.560 482 HE ARG 60 HE ARG 60 9.178 1.954 9.838 483 HH11 ARG 60 HH21 ARG 60 7.347 4.070 7.802 484 HH12 ARG 60 HH22 ARG 60 7.888 3.344 6.325 485 HH21 ARG 60 HH11 ARG 60 9.892 0.995 7.906 486 HH22 ARG 60 HH12 ARG 60 9.329 1.603 6.384 487 H LYS 61 HN LYS 61 10.562 7.565 9.531 488 HA LYS 61 HA LYS 61 9.036 8.547 7.196 489 HB2 LYS 61 HB2 LYS 61 10.729 10.263 6.791 490 HB3 LYS 61 HB1 LYS 61 10.005 10.492 8.382 491 HG2 LYS 61 HG2 LYS 61 11.941 9.143 9.330 492 HG3 LYS 61 HG1 LYS 61 12.696 9.266 7.742 493 HD2 LYS 61 HD2 LYS 61 12.437 11.777 7.916 494 HD3 LYS 61 HD1 LYS 61 11.942 11.540 9.592 495 HE2 LYS 61 HE2 LYS 61 14.618 10.973 8.326 496 HE3 LYS 61 HE1 LYS 61 14.260 11.934 9.760 497 HZ1 LYS 61 HZ1 LYS 61 13.633 9.943 10.932 498 HZ2 LYS 61 HZ2 LYS 61 13.884 8.997 9.543 499 HZ3 LYS 61 HZ3 LYS 61 15.199 9.753 10.301 500 H TRP 62 HN TRP 62 9.644 7.629 5.303 501 HA TRP 62 HA TRP 62 12.320 6.606 4.925 502 HB2 TRP 62 HB2 TRP 62 11.994 4.381 5.199 503 HB3 TRP 62 HB1 TRP 62 10.615 4.871 6.175 504 HD1 TRP 62 HD1 TRP 62 8.363 5.456 4.338 505 HE1 TRP 62 HE1 TRP 62 7.428 3.755 2.639 506 HE3 TRP 62 HE3 TRP 62 12.388 2.348 3.904 507 HZ2 TRP 62 HZ2 TRP 62 8.286 1.383 1.277 508 HZ3 TRP 62 HZ3 TRP 62 12.303 0.378 2.403 509 HH2 TRP 62 HH2 TRP 62 10.258 -0.107 1.088 510 H GLU 63 HN GLU 63 12.345 5.297 2.770 511 HA GLU 63 HA GLU 63 10.700 6.790 0.801 512 HB2 GLU 63 HB2 GLU 63 13.126 7.419 0.863 513 HB3 GLU 63 HB1 GLU 63 13.516 5.761 0.406 514 HG2 GLU 63 HG2 GLU 63 12.359 5.976 -1.686 515 HG3 GLU 63 HG1 GLU 63 11.653 7.517 -1.206 516 H THR 64 HN THR 64 10.301 5.706 -1.224 517 HA THR 64 HA THR 64 10.634 2.801 -1.294 518 HB THR 64 HB THR 64 7.869 3.931 -1.701 519 HG1 THR 64 HG1 THR 64 7.655 2.930 0.527 520 HG21 THR 64 HG21 THR 64 8.922 1.185 -0.966 521 HG22 THR 64 HG22 THR 64 7.233 1.599 -1.257 522 HG23 THR 64 HG23 THR 64 8.402 1.682 -2.575 523 H THR 65 HN THR 65 10.636 1.972 -3.358 524 HA THR 65 HA THR 65 10.464 3.954 -5.553 525 HB THR 65 HB THR 65 11.908 1.298 -5.591 526 HG1 THR 65 HG1 THR 65 12.612 3.023 -4.028 527 HG21 THR 65 HG21 THR 65 11.350 2.231 -7.785 528 HG22 THR 65 HG22 THR 65 12.049 3.782 -7.322 529 HG23 THR 65 HG23 THR 65 13.085 2.366 -7.498 530 H PHE 66 HN PHE 66 9.211 3.531 -7.341 531 HA PHE 66 HA PHE 66 7.413 1.171 -7.209 532 HB2 PHE 66 HB2 PHE 66 7.110 3.962 -8.297 533 HB3 PHE 66 HB1 PHE 66 6.004 2.701 -8.718 534 HD1 PHE 66 HD2 PHE 66 6.992 2.139 -5.325 535 HD2 PHE 66 HD1 PHE 66 4.537 4.667 -7.788 536 HE1 PHE 66 HE2 PHE 66 5.615 2.716 -3.364 537 HE2 PHE 66 HE1 PHE 66 3.168 5.243 -5.817 538 HZ PHE 66 HZ PHE 66 3.698 4.269 -3.611 539 H LYS 67 HN LYS 67 7.860 -0.356 -8.764 540 HA LYS 67 HA LYS 67 9.063 0.597 -11.305 541 HB2 LYS 67 HB2 LYS 67 9.575 -2.043 -9.928 542 HB3 LYS 67 HB1 LYS 67 10.369 -1.427 -11.378 543 HG2 LYS 67 HG2 LYS 67 11.069 0.583 -9.917 544 HG3 LYS 67 HG1 LYS 67 10.608 -0.419 -8.542 545 HD2 LYS 67 HD2 LYS 67 12.138 -2.208 -9.408 546 HD3 LYS 67 HD1 LYS 67 12.676 -1.083 -10.655 547 HE2 LYS 67 HE2 LYS 67 12.797 -0.404 -7.711 548 HE3 LYS 67 HE1 LYS 67 14.128 -1.199 -8.551 549 HZ1 LYS 67 HZ1 LYS 67 14.527 1.121 -8.610 550 HZ2 LYS 67 HZ2 LYS 67 14.047 0.669 -10.176 551 HZ3 LYS 67 HZ3 LYS 67 12.951 1.455 -9.148 552 H LYS 68 HN LYS 68 8.654 -0.607 -13.182 553 HA LYS 68 HA LYS 68 7.264 -1.619 -14.723 554 HB2 LYS 68 HB2 LYS 68 7.958 -3.637 -13.349 555 HB3 LYS 68 HB1 LYS 68 6.456 -3.442 -12.446 556 HG2 LYS 68 HG2 LYS 68 5.179 -3.617 -14.569 557 HG3 LYS 68 HG1 LYS 68 6.692 -3.880 -15.438 558 HD2 LYS 68 HD2 LYS 68 7.118 -5.872 -13.970 559 HD3 LYS 68 HD1 LYS 68 5.510 -5.648 -13.279 560 HE2 LYS 68 HE2 LYS 68 5.285 -7.280 -15.029 561 HE3 LYS 68 HE1 LYS 68 4.593 -5.779 -15.643 562 HZ1 LYS 68 HZ1 LYS 68 6.091 -5.717 -17.254 563 HZ2 LYS 68 HZ2 LYS 68 7.379 -5.897 -16.161 564 HZ3 LYS 68 HZ3 LYS 68 6.606 -7.268 -16.790 565 H THR 69 HN THR 69 6.256 0.576 -14.083 566 HA THR 69 HA THR 69 3.572 0.205 -13.009 567 HB THR 69 HB THR 69 3.742 2.522 -12.441 568 HG1 THR 69 HG1 THR 69 6.028 3.351 -13.070 569 HG21 THR 69 HG21 THR 69 5.234 0.590 -11.293 570 HG22 THR 69 HG22 THR 69 6.529 1.634 -11.867 571 HG23 THR 69 HG23 THR 69 5.319 2.267 -10.763 572 H SER 70 HN SER 70 2.876 -0.675 -15.122 573 HA SER 70 HA SER 70 1.707 1.409 -16.738 574 HB2 SER 70 HB2 SER 70 3.994 1.199 -17.724 575 HB3 SER 70 HB1 SER 70 3.652 -0.495 -18.065 576 HG SER 70 HG SER 70 1.634 1.070 -18.914 577 H ASP 71 HN ASP 71 1.439 -1.349 -15.191 578 HA ASP 71 HA ASP 71 0.387 -3.306 -16.817 579 HB2 ASP 71 HB2 ASP 71 -0.111 -2.447 -13.993 580 HB3 ASP 71 HB1 ASP 71 -1.142 -3.687 -14.693 581 H ASP 72 HN ASP 72 -1.872 -1.475 -14.821 582 HA ASP 72 HA ASP 72 -3.856 -1.607 -16.985 583 HB2 ASP 72 HB2 ASP 72 -4.051 -0.926 -14.049 584 HB3 ASP 72 HB1 ASP 72 -5.407 -0.769 -15.164 585 H GLY 73 HN GLY 73 -2.582 0.005 -18.204 586 HA2 GLY 73 HA2 GLY 73 -2.595 2.148 -19.092 587 HA3 GLY 73 HA1 GLY 73 -3.674 2.644 -17.785 588 H GLU 74 HN GLU 74 -2.815 3.407 -15.835 589 HA GLU 74 HA GLU 74 0.120 3.629 -15.687 590 HB2 GLU 74 HB2 GLU 74 -1.932 5.794 -15.193 591 HB3 GLU 74 HB1 GLU 74 -0.262 5.897 -14.636 592 HG2 GLU 74 HG2 GLU 74 -1.037 5.430 -17.527 593 HG3 GLU 74 HG1 GLU 74 -0.680 7.021 -16.858 594 H VAL 75 HN VAL 75 0.262 1.926 -14.106 595 HA VAL 75 HA VAL 75 -0.810 2.683 -11.483 596 HB VAL 75 HB VAL 75 -0.872 -0.110 -12.654 597 HG11 VAL 75 HG11 VAL 75 -1.459 1.072 -9.946 598 HG12 VAL 75 HG12 VAL 75 -2.362 -0.344 -10.487 599 HG13 VAL 75 HG13 VAL 75 -0.607 -0.415 -10.353 600 HG21 VAL 75 HG21 VAL 75 -3.435 0.378 -12.232 601 HG22 VAL 75 HG22 VAL 75 -2.934 2.062 -12.384 602 HG23 VAL 75 HG23 VAL 75 -2.663 0.939 -13.714 603 H TYR 76 HN TYR 76 0.503 1.927 -9.749 604 HA TYR 76 HA TYR 76 3.262 1.300 -10.638 605 HB2 TYR 76 HB2 TYR 76 3.782 3.005 -9.234 606 HB3 TYR 76 HB1 TYR 76 2.153 3.014 -8.577 607 HD1 TYR 76 HD1 TYR 76 5.156 0.710 -8.462 608 HD2 TYR 76 HD2 TYR 76 2.005 2.634 -6.277 609 HE1 TYR 76 HE1 TYR 76 5.946 -0.343 -6.378 610 HE2 TYR 76 HE2 TYR 76 2.818 1.584 -4.186 611 HH TYR 76 HH TYR 76 4.114 -0.343 -3.493 612 H TYR 77 HN TYR 77 4.487 -0.474 -9.894 613 HA TYR 77 HA TYR 77 3.187 -2.124 -7.859 614 HB2 TYR 77 HB2 TYR 77 2.349 -3.105 -9.876 615 HB3 TYR 77 HB1 TYR 77 3.952 -3.088 -10.607 616 HD1 TYR 77 HD1 TYR 77 1.882 -4.621 -7.926 617 HD2 TYR 77 HD2 TYR 77 5.551 -4.808 -10.151 618 HE1 TYR 77 HE1 TYR 77 2.343 -6.865 -6.977 619 HE2 TYR 77 HE2 TYR 77 6.012 -7.051 -9.202 620 HH TYR 77 HH TYR 77 3.867 -8.977 -7.915 621 H SER 78 HN SER 78 4.586 -2.815 -6.346 622 HA SER 78 HA SER 78 7.472 -2.814 -7.022 623 HB2 SER 78 HB2 SER 78 5.951 -1.940 -4.665 624 HB3 SER 78 HB1 SER 78 7.335 -2.952 -4.270 625 HG SER 78 HG SER 78 8.241 -1.375 -6.079 626 H GLU 79 HN GLU 79 7.878 -4.823 -7.680 627 HA GLU 79 HA GLU 79 6.679 -7.206 -6.957 628 HB2 GLU 79 HB2 GLU 79 8.418 -6.860 -8.760 629 HB3 GLU 79 HB1 GLU 79 9.641 -6.929 -7.490 630 HG2 GLU 79 HG2 GLU 79 8.806 -9.166 -6.826 631 HG3 GLU 79 HG1 GLU 79 7.625 -9.101 -8.131 632 H GLU 80 HN GLU 80 9.152 -5.393 -5.245 633 HA GLU 80 HA GLU 80 9.632 -7.483 -3.301 634 HB2 GLU 80 HB2 GLU 80 10.518 -4.599 -3.444 635 HB3 GLU 80 HB1 GLU 80 11.022 -5.731 -2.188 636 HG2 GLU 80 HG2 GLU 80 11.915 -7.243 -3.951 637 HG3 GLU 80 HG1 GLU 80 11.485 -6.043 -5.168 638 H ALA 81 HN ALA 81 7.934 -4.344 -3.305 639 HA ALA 81 HA ALA 81 7.109 -4.718 -0.534 640 HB1 ALA 81 HB1 ALA 81 6.152 -2.493 -2.315 641 HB2 ALA 81 HB2 ALA 81 7.797 -2.492 -1.680 642 HB3 ALA 81 HB3 ALA 81 6.425 -2.485 -0.572 643 H LYS 82 HN LYS 82 5.982 -6.089 -3.245 644 HA LYS 82 HA LYS 82 3.840 -6.555 -4.108 645 HB2 LYS 82 HB2 LYS 82 3.702 -7.450 -1.219 646 HB3 LYS 82 HB1 LYS 82 2.681 -8.051 -2.525 647 HG2 LYS 82 HG2 LYS 82 4.821 -8.706 -3.737 648 HG3 LYS 82 HG1 LYS 82 5.678 -8.359 -2.236 649 HD2 LYS 82 HD2 LYS 82 3.379 -10.319 -2.493 650 HD3 LYS 82 HD1 LYS 82 5.082 -10.772 -2.458 651 HE2 LYS 82 HE2 LYS 82 4.452 -11.029 -0.215 652 HE3 LYS 82 HE1 LYS 82 5.140 -9.406 -0.223 653 HZ1 LYS 82 HZ1 LYS 82 3.163 -8.484 0.181 654 HZ2 LYS 82 HZ2 LYS 82 2.339 -9.509 -0.895 655 HZ3 LYS 82 HZ3 LYS 82 2.683 -10.036 0.680 656 H LYS 83 HN LYS 83 3.670 -4.027 -3.887 657 HA LYS 83 HA LYS 83 0.954 -3.528 -2.934 658 HB2 LYS 83 HB2 LYS 83 2.551 -2.933 -1.047 659 HB3 LYS 83 HB1 LYS 83 3.182 -1.666 -2.098 660 HG2 LYS 83 HG2 LYS 83 0.719 -0.922 -2.362 661 HG3 LYS 83 HG1 LYS 83 0.401 -1.939 -0.957 662 HD2 LYS 83 HD2 LYS 83 2.399 0.341 -1.071 663 HD3 LYS 83 HD1 LYS 83 0.827 0.393 -0.273 664 HE2 LYS 83 HE2 LYS 83 3.227 -1.292 0.467 665 HE3 LYS 83 HE1 LYS 83 2.409 -0.080 1.451 666 HZ1 LYS 83 HZ1 LYS 83 1.746 -2.842 1.021 667 HZ2 LYS 83 HZ2 LYS 83 1.296 -1.802 2.285 668 HZ3 LYS 83 HZ3 LYS 83 0.419 -1.798 0.833 669 H LYS 84 HN LYS 84 -0.114 -2.339 -4.379 670 HA LYS 84 HA LYS 84 1.420 -0.618 -6.231 671 HB2 LYS 84 HB2 LYS 84 -0.305 -1.337 -7.982 672 HB3 LYS 84 HB1 LYS 84 0.909 -2.537 -7.542 673 HG2 LYS 84 HG2 LYS 84 -0.744 -3.480 -5.886 674 HG3 LYS 84 HG1 LYS 84 -1.941 -2.366 -6.546 675 HD2 LYS 84 HD2 LYS 84 -1.536 -3.358 -8.811 676 HD3 LYS 84 HD1 LYS 84 -0.485 -4.554 -8.050 677 HE2 LYS 84 HE2 LYS 84 -2.420 -5.199 -6.570 678 HE3 LYS 84 HE1 LYS 84 -3.442 -4.139 -7.540 679 HZ1 LYS 84 HZ1 LYS 84 -1.881 -6.458 -8.547 680 HZ2 LYS 84 HZ2 LYS 84 -3.565 -6.408 -8.330 681 HZ3 LYS 84 HZ3 LYS 84 -2.834 -5.424 -9.502 682 H VAL 85 HN VAL 85 0.436 1.209 -6.998 683 HA VAL 85 HA VAL 85 -2.217 1.834 -5.895 684 HB VAL 85 HB VAL 85 -1.641 3.807 -4.906 685 HG11 VAL 85 HG11 VAL 85 0.655 1.923 -4.531 686 HG12 VAL 85 HG12 VAL 85 0.508 3.403 -3.594 687 HG13 VAL 85 HG13 VAL 85 -0.746 2.169 -3.499 688 HG21 VAL 85 HG21 VAL 85 -0.377 5.332 -6.066 689 HG22 VAL 85 HG22 VAL 85 1.029 4.545 -5.374 690 HG23 VAL 85 HG23 VAL 85 0.447 4.078 -6.961 691 H GLU 86 HN GLU 86 -3.556 2.719 -7.255 692 HA GLU 86 HA GLU 86 -2.499 3.598 -9.885 693 HB2 GLU 86 HB2 GLU 86 -3.668 1.564 -10.228 694 HB3 GLU 86 HB1 GLU 86 -4.965 2.030 -9.135 695 HG2 GLU 86 HG2 GLU 86 -5.888 3.553 -10.671 696 HG3 GLU 86 HG1 GLU 86 -4.398 3.664 -11.605 697 H VAL 87 HN VAL 87 -2.961 5.530 -10.549 698 HA VAL 87 HA VAL 87 -4.228 7.480 -8.984 699 HB VAL 87 HB VAL 87 -2.757 8.169 -10.756 700 HG11 VAL 87 HG11 VAL 87 -3.012 7.634 -13.028 701 HG12 VAL 87 HG12 VAL 87 -3.480 6.137 -12.230 702 HG13 VAL 87 HG13 VAL 87 -4.717 7.231 -12.848 703 HG21 VAL 87 HG21 VAL 87 -4.882 9.535 -10.182 704 HG22 VAL 87 HG22 VAL 87 -4.023 9.946 -11.666 705 HG23 VAL 87 HG23 VAL 87 -5.496 8.978 -11.738 706 H LEU 88 HN LEU 88 -6.242 7.100 -8.236 707 HA LEU 88 HA LEU 88 -8.333 6.118 -10.036 708 HB2 LEU 88 HB2 LEU 88 -7.793 5.506 -7.462 709 HB3 LEU 88 HB1 LEU 88 -8.928 6.822 -7.197 710 HG LEU 88 HG LEU 88 -10.144 4.720 -7.249 711 HD11 LEU 88 HD11 LEU 88 -11.821 5.299 -8.807 712 HD12 LEU 88 HD12 LEU 88 -11.044 6.829 -8.408 713 HD13 LEU 88 HD13 LEU 88 -10.660 6.011 -9.925 714 HD21 LEU 88 HD21 LEU 88 -8.248 3.777 -8.940 715 HD22 LEU 88 HD22 LEU 88 -9.843 3.043 -8.787 716 HD23 LEU 88 HD23 LEU 88 -9.512 4.157 -10.112 717 H ASP 89 HN ASP 89 -7.191 9.080 -8.694 718 HA ASP 89 HA ASP 89 -8.776 10.724 -10.237 719 HB2 ASP 89 HB2 ASP 89 -10.386 9.741 -8.225 720 HB3 ASP 89 HB1 ASP 89 -9.743 11.197 -7.485 721 H THR 90 HN THR 90 -7.539 12.511 -10.363 722 HA THR 90 HA THR 90 -6.255 13.587 -7.975 723 HB THR 90 HB THR 90 -4.898 11.741 -9.489 724 HG1 THR 90 HG1 THR 90 -2.985 12.869 -8.500 725 HG21 THR 90 HG21 THR 90 -3.905 14.478 -10.338 726 HG22 THR 90 HG22 THR 90 -3.168 12.930 -10.740 727 HG23 THR 90 HG23 THR 90 -4.754 13.341 -11.386 728 H ASP 91 HN ASP 91 -6.285 15.732 -8.019 729 HA ASP 91 HA ASP 91 -6.389 17.116 -10.654 730 HB2 ASP 91 HB2 ASP 91 -8.701 16.921 -9.740 731 HB3 ASP 91 HB1 ASP 91 -8.172 17.784 -8.298 732 H TYR 92 HN TYR 92 -5.387 16.889 -7.440 733 HA TYR 92 HA TYR 92 -4.004 18.092 -6.087 734 HB2 TYR 92 HB2 TYR 92 -2.934 19.345 -8.609 735 HB3 TYR 92 HB1 TYR 92 -2.078 19.036 -7.105 736 HD1 TYR 92 HD2 TYR 92 -2.828 16.241 -6.478 737 HD2 TYR 92 HD1 TYR 92 -1.876 18.065 -10.253 738 HE1 TYR 92 HE2 TYR 92 -2.085 14.052 -7.350 739 HE2 TYR 92 HE1 TYR 92 -1.140 15.867 -11.125 740 HH TYR 92 HH TYR 92 -1.765 12.929 -9.463 741 H LYS 93 HN LYS 93 -6.409 19.506 -7.790 742 HA LYS 93 HA LYS 93 -5.808 22.280 -7.367 743 HB2 LYS 93 HB2 LYS 93 -7.368 21.418 -9.139 744 HB3 LYS 93 HB1 LYS 93 -8.511 21.008 -7.858 745 HG2 LYS 93 HG2 LYS 93 -8.503 23.382 -7.120 746 HG3 LYS 93 HG1 LYS 93 -7.425 23.775 -8.459 747 HD2 LYS 93 HD2 LYS 93 -9.122 22.986 -10.065 748 HD3 LYS 93 HD1 LYS 93 -10.203 22.587 -8.730 749 HE2 LYS 93 HE2 LYS 93 -10.430 24.880 -8.101 750 HE3 LYS 93 HE1 LYS 93 -9.087 25.369 -9.136 751 HZ1 LYS 93 HZ1 LYS 93 -11.092 23.989 -10.609 752 HZ2 LYS 93 HZ2 LYS 93 -11.745 25.338 -9.810 753 HZ3 LYS 93 HZ3 LYS 93 -10.436 25.534 -10.870 754 H SER 94 HN SER 94 -7.550 19.770 -5.664 755 HA SER 94 HA SER 94 -7.471 21.334 -3.220 756 HB2 SER 94 HB2 SER 94 -9.554 22.170 -3.967 757 HB3 SER 94 HB1 SER 94 -10.047 20.606 -4.609 758 HG SER 94 HG SER 94 -9.768 19.941 -2.272 759 H TYR 95 HN TYR 95 -7.879 18.369 -4.983 760 HA TYR 95 HA TYR 95 -7.053 16.837 -2.717 761 HB2 TYR 95 HB2 TYR 95 -9.101 15.499 -2.472 762 HB3 TYR 95 HB1 TYR 95 -9.377 17.196 -2.079 763 HD1 TYR 95 HD1 TYR 95 -9.773 14.631 -4.744 764 HD2 TYR 95 HD2 TYR 95 -10.884 18.541 -3.355 765 HE1 TYR 95 HE1 TYR 95 -11.518 14.759 -6.500 766 HE2 TYR 95 HE2 TYR 95 -12.631 18.667 -5.110 767 HH TYR 95 HH TYR 95 -13.863 17.361 -6.574 768 H ALA 96 HN ALA 96 -7.109 14.498 -3.111 769 HA ALA 96 HA ALA 96 -7.236 13.677 -5.918 770 HB1 ALA 96 HB1 ALA 96 -4.812 14.417 -4.993 771 HB2 ALA 96 HB2 ALA 96 -5.017 13.076 -6.119 772 HB3 ALA 96 HB3 ALA 96 -4.834 12.757 -4.398 773 H VAL 97 HN VAL 97 -7.986 11.615 -6.124 774 HA VAL 97 HA VAL 97 -8.268 10.026 -3.613 775 HB VAL 97 HB VAL 97 -10.175 9.693 -5.914 776 HG11 VAL 97 HG11 VAL 97 -10.093 8.089 -3.998 777 HG12 VAL 97 HG12 VAL 97 -10.500 9.421 -2.916 778 HG13 VAL 97 HG13 VAL 97 -11.648 8.907 -4.152 779 HG21 VAL 97 HG21 VAL 97 -10.189 12.114 -5.400 780 HG22 VAL 97 HG22 VAL 97 -11.678 11.347 -4.851 781 HG23 VAL 97 HG23 VAL 97 -10.413 11.747 -3.691 782 H ILE 98 HN ILE 98 -7.170 8.146 -3.653 783 HA ILE 98 HA ILE 98 -6.486 7.016 -6.293 784 HB ILE 98 HB ILE 98 -4.649 8.242 -5.270 785 HG12 ILE 98 HG12 ILE 98 -4.215 5.267 -4.927 786 HG13 ILE 98 HG11 ILE 98 -4.204 6.092 -6.488 787 HG21 ILE 98 HG21 ILE 98 -4.973 6.325 -2.945 788 HG22 ILE 98 HG22 ILE 98 -3.775 7.612 -3.092 789 HG23 ILE 98 HG23 ILE 98 -5.485 8.013 -2.925 790 HD11 ILE 98 HD11 ILE 98 -2.525 7.536 -4.623 791 HD12 ILE 98 HD12 ILE 98 -2.054 5.852 -4.666 792 HD13 ILE 98 HD13 ILE 98 -2.095 6.777 -6.160 793 H TYR 99 HN TYR 99 -6.344 4.816 -6.442 794 HA TYR 99 HA TYR 99 -7.691 3.281 -4.321 795 HB2 TYR 99 HB2 TYR 99 -8.507 3.102 -6.670 796 HB3 TYR 99 HB1 TYR 99 -6.942 2.433 -7.131 797 HD1 TYR 99 HD1 TYR 99 -9.925 1.883 -4.974 798 HD2 TYR 99 HD2 TYR 99 -6.391 0.153 -6.696 799 HE1 TYR 99 HE1 TYR 99 -10.672 -0.367 -4.248 800 HE2 TYR 99 HE2 TYR 99 -7.137 -2.097 -5.969 801 HH TYR 99 HH TYR 99 -10.167 -2.848 -5.142 802 H ALA 100 HN ALA 100 -6.314 2.613 -2.820 803 HA ALA 100 HA ALA 100 -3.657 1.579 -3.608 804 HB1 ALA 100 HB1 ALA 100 -3.238 1.700 -1.099 805 HB2 ALA 100 HB2 ALA 100 -4.777 2.554 -0.979 806 HB3 ALA 100 HB3 ALA 100 -3.456 3.245 -1.922 807 H THR 101 HN THR 101 -3.178 -0.524 -3.451 808 HA THR 101 HA THR 101 -4.827 -2.279 -1.769 809 HB THR 101 HB THR 101 -5.901 -2.348 -3.969 810 HG1 THR 101 HG1 THR 101 -4.724 -4.430 -2.733 811 HG21 THR 101 HG21 THR 101 -3.343 -3.451 -5.103 812 HG22 THR 101 HG22 THR 101 -4.752 -2.837 -5.964 813 HG23 THR 101 HG23 THR 101 -3.670 -1.717 -5.135 814 H ARG 102 HN ARG 102 -3.702 -3.829 -0.798 815 HA ARG 102 HA ARG 102 -0.945 -4.412 -1.727 816 HB2 ARG 102 HB2 ARG 102 -1.106 -3.066 0.432 817 HB3 ARG 102 HB1 ARG 102 -1.871 -4.486 1.146 818 HG2 ARG 102 HG2 ARG 102 0.206 -5.771 0.195 819 HG3 ARG 102 HG1 ARG 102 0.944 -4.172 0.124 820 HD2 ARG 102 HD2 ARG 102 1.570 -4.865 2.256 821 HD3 ARG 102 HD1 ARG 102 0.090 -3.982 2.611 822 HE ARG 102 HE ARG 102 0.407 -6.914 2.580 823 HH11 ARG 102 HH21 ARG 102 -1.549 -4.099 3.115 824 HH12 ARG 102 HH22 ARG 102 -2.776 -4.956 3.984 825 HH21 ARG 102 HH11 ARG 102 -1.204 -8.028 3.711 826 HH22 ARG 102 HH12 ARG 102 -2.582 -7.175 4.320 827 H VAL 103 HN VAL 103 -0.523 -6.627 -2.056 828 HA VAL 103 HA VAL 103 -2.598 -8.470 -1.007 829 HB VAL 103 HB VAL 103 -2.826 -8.151 -3.425 830 HG11 VAL 103 HG11 VAL 103 -0.304 -7.603 -3.660 831 HG12 VAL 103 HG12 VAL 103 -0.074 -9.349 -3.752 832 HG13 VAL 103 HG13 VAL 103 -1.067 -8.525 -4.955 833 HG21 VAL 103 HG21 VAL 103 -1.550 -10.837 -2.827 834 HG22 VAL 103 HG22 VAL 103 -3.185 -10.402 -2.328 835 HG23 VAL 103 HG23 VAL 103 -2.780 -10.487 -4.041 836 H LYS 104 HN LYS 104 -1.884 -9.975 0.298 837 HA LYS 104 HA LYS 104 0.983 -10.670 0.303 838 HB2 LYS 104 HB2 LYS 104 -1.157 -10.666 2.423 839 HB3 LYS 104 HB1 LYS 104 0.259 -11.699 2.595 840 HG2 LYS 104 HG2 LYS 104 1.703 -9.667 2.256 841 HG3 LYS 104 HG1 LYS 104 0.238 -8.684 2.281 842 HD2 LYS 104 HD2 LYS 104 -0.253 -9.306 4.540 843 HD3 LYS 104 HD1 LYS 104 0.965 -10.581 4.523 844 HE2 LYS 104 HE2 LYS 104 1.563 -8.331 5.681 845 HE3 LYS 104 HE1 LYS 104 2.750 -9.051 4.594 846 HZ1 LYS 104 HZ1 LYS 104 0.937 -6.776 4.095 847 HZ2 LYS 104 HZ2 LYS 104 2.625 -6.846 3.922 848 HZ3 LYS 104 HZ3 LYS 104 1.624 -7.647 2.810 849 H ASP 105 HN ASP 105 1.318 -13.036 1.015 850 HA ASP 105 HA ASP 105 0.289 -14.712 -0.965 851 HB2 ASP 105 HB2 ASP 105 2.356 -15.146 0.359 852 HB3 ASP 105 HB1 ASP 105 1.342 -15.563 1.741 853 H GLY 106 HN GLY 106 -1.735 -15.272 -1.245 854 HA2 GLY 106 HA2 GLY 106 -3.744 -16.342 -0.853 855 HA3 GLY 106 HA1 GLY 106 -3.205 -16.671 0.786 856 H ARG 107 HN ARG 107 -2.771 -13.449 0.579 857 HA ARG 107 HA ARG 107 -5.576 -12.834 1.341 858 HB2 ARG 107 HB2 ARG 107 -3.006 -12.041 2.702 859 HB3 ARG 107 HB1 ARG 107 -4.533 -11.208 2.994 860 HG2 ARG 107 HG2 ARG 107 -5.575 -13.301 3.711 861 HG3 ARG 107 HG1 ARG 107 -4.094 -14.187 3.346 862 HD2 ARG 107 HD2 ARG 107 -4.236 -13.701 5.752 863 HD3 ARG 107 HD1 ARG 107 -2.878 -12.849 5.024 864 HE ARG 107 HE ARG 107 -4.985 -11.069 4.910 865 HH11 ARG 107 HH21 ARG 107 -3.335 -12.899 7.341 866 HH12 ARG 107 HH22 ARG 107 -3.605 -11.736 8.596 867 HH21 ARG 107 HH11 ARG 107 -5.342 -9.540 6.551 868 HH22 ARG 107 HH12 ARG 107 -4.742 -9.834 8.149 869 H THR 108 HN THR 108 -6.472 -11.085 0.492 870 HA THR 108 HA THR 108 -4.779 -9.219 -1.076 871 HB THR 108 HB THR 108 -7.676 -9.961 -1.560 872 HG1 THR 108 HG1 THR 108 -6.946 -11.419 -2.891 873 HG21 THR 108 HG21 THR 108 -7.130 -8.806 -3.777 874 HG22 THR 108 HG22 THR 108 -7.282 -7.756 -2.369 875 HG23 THR 108 HG23 THR 108 -5.685 -8.186 -2.979 876 H LEU 109 HN LEU 109 -5.476 -6.979 -1.098 877 HA LEU 109 HA LEU 109 -7.449 -6.185 0.920 878 HB2 LEU 109 HB2 LEU 109 -5.320 -6.380 2.136 879 HB3 LEU 109 HB1 LEU 109 -4.580 -5.247 1.031 880 HG LEU 109 HG LEU 109 -6.229 -3.527 1.720 881 HD11 LEU 109 HD11 LEU 109 -8.155 -4.625 2.460 882 HD12 LEU 109 HD12 LEU 109 -7.243 -5.830 3.370 883 HD13 LEU 109 HD13 LEU 109 -7.407 -4.188 3.993 884 HD21 LEU 109 HD21 LEU 109 -5.220 -3.083 3.870 885 HD22 LEU 109 HD22 LEU 109 -4.828 -4.790 4.088 886 HD23 LEU 109 HD23 LEU 109 -4.001 -3.845 2.848 887 H HIS 110 HN HIS 110 -8.212 -4.130 0.711 888 HA HIS 110 HA HIS 110 -7.114 -2.462 -1.419 889 HB2 HIS 110 HB2 HIS 110 -9.455 -2.018 -2.263 890 HB3 HIS 110 HB1 HIS 110 -8.852 -3.643 -2.592 891 HD1 HIS 110 HD1 HIS 110 -11.739 -1.984 -1.283 892 HD2 HIS 110 HD2 HIS 110 -9.724 -5.502 -0.314 893 HE1 HIS 110 HE1 HIS 110 -13.358 -3.389 0.065 894 H MET 111 HN MET 111 -7.460 -0.214 -1.119 895 HA MET 111 HA MET 111 -9.189 0.706 0.996 896 HB2 MET 111 HB2 MET 111 -7.017 1.920 1.996 897 HB3 MET 111 HB1 MET 111 -7.548 0.341 2.572 898 HG2 MET 111 HG2 MET 111 -5.991 -0.768 1.028 899 HG3 MET 111 HG1 MET 111 -5.479 0.798 0.401 900 HE1 MET 111 HE1 MET 111 -3.657 2.060 1.175 901 HE2 MET 111 HE2 MET 111 -4.811 2.781 2.294 902 HE3 MET 111 HE3 MET 111 -3.201 2.314 2.857 903 H MET 112 HN MET 112 -9.675 2.875 0.783 904 HA MET 112 HA MET 112 -8.530 4.227 -1.591 905 HB2 MET 112 HB2 MET 112 -11.022 3.844 -1.487 906 HB3 MET 112 HB1 MET 112 -11.069 4.923 -0.097 907 HG2 MET 112 HG2 MET 112 -11.574 6.285 -1.990 908 HG3 MET 112 HG1 MET 112 -9.907 6.657 -1.558 909 HE1 MET 112 HE1 MET 112 -11.493 3.952 -4.822 910 HE2 MET 112 HE2 MET 112 -12.273 4.574 -3.372 911 HE3 MET 112 HE3 MET 112 -12.082 5.611 -4.792 912 H ARG 113 HN ARG 113 -7.722 6.340 -1.429 913 HA ARG 113 HA ARG 113 -7.471 7.435 1.303 914 HB2 ARG 113 HB2 ARG 113 -5.307 7.069 -0.751 915 HB3 ARG 113 HB1 ARG 113 -5.146 8.161 0.625 916 HG2 ARG 113 HG2 ARG 113 -5.629 6.252 2.152 917 HG3 ARG 113 HG1 ARG 113 -5.668 5.178 0.755 918 HD2 ARG 113 HD2 ARG 113 -3.359 5.633 0.246 919 HD3 ARG 113 HD1 ARG 113 -3.292 6.922 1.445 920 HE ARG 113 HE ARG 113 -3.054 4.090 1.950 921 HH11 ARG 113 HH21 ARG 113 -3.984 7.175 3.209 922 HH12 ARG 113 HH22 ARG 113 -3.716 6.736 4.863 923 HH21 ARG 113 HH11 ARG 113 -2.698 3.507 4.118 924 HH22 ARG 113 HH12 ARG 113 -2.988 4.659 5.377 925 H LEU 114 HN LEU 114 -7.928 9.536 1.534 926 HA LEU 114 HA LEU 114 -8.324 11.131 -0.912 927 HB2 LEU 114 HB2 LEU 114 -10.386 11.246 0.092 928 HB3 LEU 114 HB1 LEU 114 -9.742 10.934 1.694 929 HG LEU 114 HG LEU 114 -8.872 13.291 1.758 930 HD11 LEU 114 HD11 LEU 114 -8.892 13.378 -0.865 931 HD12 LEU 114 HD12 LEU 114 -10.573 13.857 -0.664 932 HD13 LEU 114 HD13 LEU 114 -9.287 14.835 0.041 933 HD21 LEU 114 HD21 LEU 114 -11.782 13.510 1.077 934 HD22 LEU 114 HD22 LEU 114 -11.313 12.474 2.421 935 HD23 LEU 114 HD23 LEU 114 -10.895 14.186 2.441 936 H TYR 115 HN TYR 115 -6.994 12.669 -1.327 937 HA TYR 115 HA TYR 115 -5.074 13.621 0.685 938 HB2 TYR 115 HB2 TYR 115 -5.088 13.689 -2.333 939 HB3 TYR 115 HB1 TYR 115 -3.882 14.522 -1.363 940 HD1 TYR 115 HD1 TYR 115 -5.486 11.113 -1.483 941 HD2 TYR 115 HD2 TYR 115 -1.872 13.400 -1.076 942 HE1 TYR 115 HE1 TYR 115 -4.176 9.024 -1.305 943 HE2 TYR 115 HE2 TYR 115 -0.568 11.302 -0.903 944 HH TYR 115 HH TYR 115 -0.662 9.052 -1.230 945 H SER 116 HN SER 116 -4.447 15.857 0.640 946 HA SER 116 HA SER 116 -6.500 17.761 -0.327 947 HB2 SER 116 HB2 SER 116 -6.647 17.357 2.178 948 HB3 SER 116 HB1 SER 116 -5.008 18.006 2.303 949 HG SER 116 HG SER 116 -7.332 19.315 2.111 950 H ARG 117 HN ARG 117 -5.567 19.537 -1.430 951 HA ARG 117 HA ARG 117 -2.754 19.423 -1.919 952 HB2 ARG 117 HB2 ARG 117 -4.568 20.264 -3.513 953 HB3 ARG 117 HB1 ARG 117 -4.600 21.732 -2.541 954 HG2 ARG 117 HG2 ARG 117 -3.089 22.113 -4.386 955 HG3 ARG 117 HG1 ARG 117 -2.123 21.963 -2.921 956 HD2 ARG 117 HD2 ARG 117 -2.631 19.442 -4.436 957 HD3 ARG 117 HD1 ARG 117 -1.545 20.608 -5.183 958 HE ARG 117 HE ARG 117 -0.995 19.008 -2.858 959 HH11 ARG 117 HH21 ARG 117 -0.386 22.006 -4.475 960 HH12 ARG 117 HH22 ARG 117 1.167 22.243 -3.747 961 HH21 ARG 117 HH11 ARG 117 1.041 19.312 -1.899 962 HH22 ARG 117 HH12 ARG 117 1.975 20.717 -2.288 963 H SER 118 HN SER 118 -4.757 20.918 0.431 964 HA SER 118 HA SER 118 -2.427 22.377 1.508 965 HB2 SER 118 HB2 SER 118 -3.845 24.035 0.429 966 HB3 SER 118 HB1 SER 118 -5.261 23.415 1.272 967 HG SER 118 HG SER 118 -3.518 25.232 2.095 968 HA PRO 119 HA PRO 119 -3.053 20.268 5.353 969 HB2 PRO 119 HB2 PRO 119 -3.241 23.056 6.463 970 HB3 PRO 119 HB1 PRO 119 -2.317 21.666 7.068 971 HG2 PRO 119 HG2 PRO 119 -1.173 23.646 5.651 972 HG3 PRO 119 HG1 PRO 119 -0.617 21.968 5.563 973 HD2 PRO 119 HD2 PRO 119 -2.002 23.563 3.508 974 HD3 PRO 119 HD1 PRO 119 -1.106 22.039 3.333 975 H GLU 120 HN GLU 120 -5.226 22.747 4.224 976 HA GLU 120 HA GLU 120 -7.278 22.267 6.176 977 HB2 GLU 120 HB2 GLU 120 -7.498 23.671 3.507 978 HB3 GLU 120 HB1 GLU 120 -8.590 23.824 4.885 979 HG2 GLU 120 HG2 GLU 120 -6.703 24.733 6.237 980 HG3 GLU 120 HG1 GLU 120 -5.679 24.667 4.803 981 H VAL 121 HN VAL 121 -9.432 21.595 5.520 982 HA VAL 121 HA VAL 121 -9.376 19.425 3.497 983 HB VAL 121 HB VAL 121 -11.077 19.548 5.998 984 HG11 VAL 121 HG11 VAL 121 -10.488 17.325 4.018 985 HG12 VAL 121 HG12 VAL 121 -11.494 17.176 5.459 986 HG13 VAL 121 HG13 VAL 121 -12.003 18.220 4.131 987 HG21 VAL 121 HG21 VAL 121 -8.752 19.313 6.657 988 HG22 VAL 121 HG22 VAL 121 -9.521 17.732 6.788 989 HG23 VAL 121 HG23 VAL 121 -8.479 18.093 5.411 990 H SER 122 HN SER 122 -10.553 19.937 1.765 991 HA SER 122 HA SER 122 -12.560 22.000 1.852 992 HB2 SER 122 HB2 SER 122 -10.975 21.507 -0.085 993 HB3 SER 122 HB1 SER 122 -12.014 20.131 -0.446 994 HG SER 122 HG SER 122 -13.649 22.101 -0.090 995 HA PRO 123 HA PRO 123 -15.852 19.193 3.211 996 HB2 PRO 123 HB2 PRO 123 -17.435 21.233 1.671 997 HB3 PRO 123 HB1 PRO 123 -17.770 20.515 3.261 998 HG2 PRO 123 HG2 PRO 123 -16.755 22.963 3.047 999 HG3 PRO 123 HG1 PRO 123 -16.246 21.864 4.342 1000 HD2 PRO 123 HD2 PRO 123 -14.741 22.735 1.924 1001 HD3 PRO 123 HD1 PRO 123 -14.128 22.183 3.500 1002 H ALA 124 HN ALA 124 -15.406 20.377 -0.076 1003 HA ALA 124 HA ALA 124 -17.166 18.488 -1.323 1004 HB1 ALA 124 HB1 ALA 124 -14.856 20.016 -2.546 1005 HB2 ALA 124 HB2 ALA 124 -16.491 20.652 -2.366 1006 HB3 ALA 124 HB3 ALA 124 -16.196 19.261 -3.410 1007 H ALA 125 HN ALA 125 -13.706 18.625 -0.642 1008 HA ALA 125 HA ALA 125 -12.894 16.358 -2.097 1009 HB1 ALA 125 HB1 ALA 125 -11.764 17.454 0.489 1010 HB2 ALA 125 HB2 ALA 125 -11.326 17.997 -1.129 1011 HB3 ALA 125 HB3 ALA 125 -10.940 16.354 -0.613 1012 H THR 126 HN THR 126 -14.329 16.731 1.062 1013 HA THR 126 HA THR 126 -13.897 14.021 1.915 1014 HB THR 126 HB THR 126 -16.139 15.611 3.081 1015 HG1 THR 126 HG1 THR 126 -13.679 16.375 3.987 1016 HG21 THR 126 HG21 THR 126 -13.790 14.500 4.583 1017 HG22 THR 126 HG22 THR 126 -15.481 14.587 5.068 1018 HG23 THR 126 HG23 THR 126 -14.962 13.370 3.902 1019 H ALA 127 HN ALA 127 -16.383 15.755 0.180 1020 HA ALA 127 HA ALA 127 -18.414 13.766 0.371 1021 HB1 ALA 127 HB1 ALA 127 -19.502 15.133 -1.357 1022 HB2 ALA 127 HB2 ALA 127 -18.019 16.077 -1.508 1023 HB3 ALA 127 HB3 ALA 127 -18.923 16.092 0.006 1024 H ILE 128 HN ILE 128 -16.216 14.698 -2.318 1025 HA ILE 128 HA ILE 128 -17.233 12.774 -4.134 1026 HB ILE 128 HB ILE 128 -15.597 14.848 -4.432 1027 HG12 ILE 128 HG12 ILE 128 -16.526 13.642 -6.299 1028 HG13 ILE 128 HG11 ILE 128 -14.797 13.827 -6.554 1029 HG21 ILE 128 HG21 ILE 128 -13.798 13.763 -3.027 1030 HG22 ILE 128 HG22 ILE 128 -13.601 12.572 -4.314 1031 HG23 ILE 128 HG23 ILE 128 -13.272 14.276 -4.627 1032 HD11 ILE 128 HD11 ILE 128 -16.323 11.355 -5.769 1033 HD12 ILE 128 HD12 ILE 128 -15.168 11.563 -7.084 1034 HD13 ILE 128 HD13 ILE 128 -14.601 11.490 -5.417 1035 H PHE 129 HN PHE 129 -14.860 12.866 -1.686 1036 HA PHE 129 HA PHE 129 -13.590 10.394 -2.011 1037 HB2 PHE 129 HB2 PHE 129 -12.705 12.127 -0.577 1038 HB3 PHE 129 HB1 PHE 129 -14.131 12.050 0.455 1039 HD1 PHE 129 HD1 PHE 129 -12.023 9.295 -1.052 1040 HD2 PHE 129 HD2 PHE 129 -13.441 11.212 2.520 1041 HE1 PHE 129 HE1 PHE 129 -10.980 7.520 0.314 1042 HE2 PHE 129 HE2 PHE 129 -12.383 9.437 3.884 1043 HZ PHE 129 HZ PHE 129 -11.150 7.592 2.783 1044 H ARG 130 HN ARG 130 -16.397 11.304 -0.021 1045 HA ARG 130 HA ARG 130 -16.830 8.685 1.028 1046 HB2 ARG 130 HB2 ARG 130 -18.481 11.202 0.890 1047 HB3 ARG 130 HB1 ARG 130 -19.186 9.696 1.480 1048 HG2 ARG 130 HG2 ARG 130 -17.445 9.514 3.191 1049 HG3 ARG 130 HG1 ARG 130 -16.664 10.972 2.581 1050 HD2 ARG 130 HD2 ARG 130 -19.466 10.818 3.725 1051 HD3 ARG 130 HD1 ARG 130 -18.058 11.482 4.548 1052 HE ARG 130 HE ARG 130 -18.292 12.842 2.123 1053 HH11 ARG 130 HH21 ARG 130 -20.105 12.323 5.024 1054 HH12 ARG 130 HH22 ARG 130 -20.898 13.862 4.968 1055 HH21 ARG 130 HH11 ARG 130 -19.328 14.862 2.042 1056 HH22 ARG 130 HH12 ARG 130 -20.458 15.299 3.279 1057 H LYS 131 HN LYS 131 -17.948 10.425 -1.808 1058 HA LYS 131 HA LYS 131 -20.055 8.762 -2.602 1059 HB2 LYS 131 HB2 LYS 131 -19.358 10.966 -3.651 1060 HB3 LYS 131 HB1 LYS 131 -18.089 10.071 -4.489 1061 HG2 LYS 131 HG2 LYS 131 -19.772 8.609 -5.519 1062 HG3 LYS 131 HG1 LYS 131 -21.054 9.454 -4.652 1063 HD2 LYS 131 HD2 LYS 131 -20.221 11.590 -5.778 1064 HD3 LYS 131 HD1 LYS 131 -19.253 10.547 -6.820 1065 HE2 LYS 131 HE2 LYS 131 -21.387 11.049 -7.911 1066 HE3 LYS 131 HE1 LYS 131 -21.320 9.338 -7.490 1067 HZ1 LYS 131 HZ1 LYS 131 -22.354 10.556 -5.272 1068 HZ2 LYS 131 HZ2 LYS 131 -23.108 11.359 -6.565 1069 HZ3 LYS 131 HZ3 LYS 131 -23.227 9.673 -6.432 1070 H LEU 132 HN LEU 132 -16.606 8.612 -3.485 1071 HA LEU 132 HA LEU 132 -16.756 6.235 -4.998 1072 HB2 LEU 132 HB2 LEU 132 -14.593 7.791 -3.645 1073 HB3 LEU 132 HB1 LEU 132 -14.218 6.144 -4.130 1074 HG LEU 132 HG LEU 132 -13.682 7.968 -5.833 1075 HD11 LEU 132 HD11 LEU 132 -15.656 6.004 -6.980 1076 HD12 LEU 132 HD12 LEU 132 -14.118 6.550 -7.641 1077 HD13 LEU 132 HD13 LEU 132 -14.144 5.436 -6.277 1078 HD21 LEU 132 HD21 LEU 132 -16.015 9.070 -5.322 1079 HD22 LEU 132 HD22 LEU 132 -15.382 9.101 -6.965 1080 HD23 LEU 132 HD23 LEU 132 -16.614 7.924 -6.520 1081 H ALA 133 HN ALA 133 -15.849 6.761 -1.584 1082 HA ALA 133 HA ALA 133 -15.401 4.075 -0.946 1083 HB1 ALA 133 HB1 ALA 133 -14.988 6.220 0.467 1084 HB2 ALA 133 HB2 ALA 133 -15.402 4.719 1.294 1085 HB3 ALA 133 HB3 ALA 133 -16.634 5.956 1.043 1086 H GLY 134 HN GLY 134 -18.397 5.928 -1.229 1087 HA2 GLY 134 HA2 GLY 134 -20.099 4.035 0.030 1088 HA3 GLY 134 HA1 GLY 134 -20.596 5.294 -1.099 1089 H GLU 135 HN GLU 135 -18.971 4.506 -3.297 1090 HA GLU 135 HA GLU 135 -20.637 2.634 -4.564 1091 HB2 GLU 135 HB2 GLU 135 -17.796 3.474 -5.199 1092 HB3 GLU 135 HB1 GLU 135 -18.786 2.470 -6.257 1093 HG2 GLU 135 HG2 GLU 135 -19.636 5.205 -5.275 1094 HG3 GLU 135 HG1 GLU 135 -18.834 4.930 -6.820 1095 H ARG 136 HN ARG 136 -17.896 2.288 -2.469 1096 HA ARG 136 HA ARG 136 -17.645 -0.586 -3.050 1097 HB2 ARG 136 HB2 ARG 136 -15.999 1.431 -1.546 1098 HB3 ARG 136 HB1 ARG 136 -15.811 -0.285 -1.191 1099 HG2 ARG 136 HG2 ARG 136 -14.203 0.451 -2.917 1100 HG3 ARG 136 HG1 ARG 136 -15.334 -0.738 -3.563 1101 HD2 ARG 136 HD2 ARG 136 -16.622 0.957 -4.662 1102 HD3 ARG 136 HD1 ARG 136 -15.771 2.244 -3.813 1103 HE ARG 136 HE ARG 136 -13.770 1.007 -5.156 1104 HH11 ARG 136 HH21 ARG 136 -16.908 2.151 -6.056 1105 HH12 ARG 136 HH22 ARG 136 -16.456 2.527 -7.685 1106 HH21 ARG 136 HH11 ARG 136 -13.169 1.496 -7.291 1107 HH22 ARG 136 HH12 ARG 136 -14.339 2.156 -8.385 1108 H ASN 137 HN ASN 137 -19.710 1.199 -1.401 1109 HA ASN 137 HA ASN 137 -21.174 0.845 0.340 1110 HB2 ASN 137 HB2 ASN 137 -20.003 -1.900 0.274 1111 HB3 ASN 137 HB1 ASN 137 -21.535 -1.460 1.013 1112 HD21 ASN 137 HD21 ASN 137 -23.192 -0.477 -0.576 1113 HD22 ASN 137 HD22 ASN 137 -23.204 -1.076 -2.164 1114 H TYR 138 HN TYR 138 -18.663 1.901 0.977 1115 HA TYR 138 HA TYR 138 -17.689 0.612 3.398 1116 HB2 TYR 138 HB2 TYR 138 -16.872 2.986 1.772 1117 HB3 TYR 138 HB1 TYR 138 -16.397 2.951 3.463 1118 HD1 TYR 138 HD1 TYR 138 -16.789 0.072 1.128 1119 HD2 TYR 138 HD2 TYR 138 -14.080 2.536 3.359 1120 HE1 TYR 138 HE1 TYR 138 -14.935 -1.488 0.591 1121 HE2 TYR 138 HE2 TYR 138 -12.220 0.982 2.820 1122 HH TYR 138 HH TYR 138 -11.923 -0.840 0.644 1123 H THR 139 HN THR 139 -18.486 0.965 5.370 1124 HA THR 139 HA THR 139 -20.479 3.046 5.791 1125 HB THR 139 HB THR 139 -21.147 1.831 7.611 1126 HG1 THR 139 HG1 THR 139 -19.650 0.885 9.038 1127 HG21 THR 139 HG21 THR 139 -20.609 0.193 5.643 1128 HG22 THR 139 HG22 THR 139 -19.296 -0.354 6.684 1129 HG23 THR 139 HG23 THR 139 -20.964 -0.475 7.236 1130 H ASP 140 HN ASP 140 -20.268 4.641 7.520 1131 HA ASP 140 HA ASP 140 -18.113 6.263 7.348 1132 HB2 ASP 140 HB2 ASP 140 -18.753 7.225 9.527 1133 HB3 ASP 140 HB1 ASP 140 -20.153 6.914 8.502 1134 H GLU 141 HN GLU 141 -18.442 3.866 10.048 1135 HA GLU 141 HA GLU 141 -15.991 4.424 11.216 1136 HB2 GLU 141 HB2 GLU 141 -16.247 2.446 12.447 1137 HB3 GLU 141 HB1 GLU 141 -17.902 2.902 12.043 1138 HG2 GLU 141 HG2 GLU 141 -17.635 1.386 9.984 1139 HG3 GLU 141 HG1 GLU 141 -16.196 0.754 10.778 1140 H MET 142 HN MET 142 -16.598 2.829 8.227 1141 HA MET 142 HA MET 142 -14.107 1.369 8.154 1142 HB2 MET 142 HB2 MET 142 -15.801 2.045 5.765 1143 HB3 MET 142 HB1 MET 142 -14.767 0.639 6.023 1144 HG2 MET 142 HG2 MET 142 -16.504 0.461 8.164 1145 HG3 MET 142 HG1 MET 142 -17.542 1.103 6.898 1146 HE1 MET 142 HE1 MET 142 -15.858 -2.187 8.295 1147 HE2 MET 142 HE2 MET 142 -14.983 -2.652 6.838 1148 HE3 MET 142 HE3 MET 142 -14.678 -1.083 7.596 1149 H VAL 143 HN VAL 143 -15.108 4.548 7.522 1150 HA VAL 143 HA VAL 143 -12.512 5.150 6.226 1151 HB VAL 143 HB VAL 143 -14.661 5.334 4.785 1152 HG11 VAL 143 HG11 VAL 143 -15.903 6.541 6.647 1153 HG12 VAL 143 HG12 VAL 143 -14.917 7.952 6.271 1154 HG13 VAL 143 HG13 VAL 143 -16.003 7.285 5.054 1155 HG21 VAL 143 HG21 VAL 143 -12.604 7.515 5.139 1156 HG22 VAL 143 HG22 VAL 143 -12.653 6.241 3.921 1157 HG23 VAL 143 HG23 VAL 143 -13.804 7.574 3.847 1158 H ALA 144 HN ALA 144 -11.259 6.397 7.453 1159 HA ALA 144 HA ALA 144 -12.539 8.064 9.549 1160 HB1 ALA 144 HB1 ALA 144 -11.069 6.013 10.172 1161 HB2 ALA 144 HB2 ALA 144 -10.787 7.538 11.012 1162 HB3 ALA 144 HB3 ALA 144 -9.713 7.041 9.706 1163 H MET 145 HN MET 145 -12.416 10.179 9.167 1164 HA MET 145 HA MET 145 -10.410 11.286 7.391 1165 HB2 MET 145 HB2 MET 145 -12.060 13.157 8.993 1166 HB3 MET 145 HB1 MET 145 -11.780 13.113 7.256 1167 HG2 MET 145 HG2 MET 145 -13.336 10.812 7.766 1168 HG3 MET 145 HG1 MET 145 -14.039 12.061 8.788 1169 HE1 MET 145 HE1 MET 145 -12.933 12.366 4.453 1170 HE2 MET 145 HE2 MET 145 -12.430 11.203 5.672 1171 HE3 MET 145 HE3 MET 145 -13.925 10.945 4.764 1172 H LEU 146 HN LEU 146 -8.741 12.793 8.074 1173 HA LEU 146 HA LEU 146 -8.184 12.666 10.924 1174 HB2 LEU 146 HB2 LEU 146 -6.798 11.523 8.839 1175 HB3 LEU 146 HB1 LEU 146 -5.936 13.041 9.057 1176 HG LEU 146 HG LEU 146 -5.439 12.543 11.287 1177 HD11 LEU 146 HD11 LEU 146 -6.253 10.038 12.032 1178 HD12 LEU 146 HD12 LEU 146 -7.143 11.486 12.467 1179 HD13 LEU 146 HD13 LEU 146 -7.633 10.537 11.063 1180 HD21 LEU 146 HD21 LEU 146 -5.175 9.906 9.878 1181 HD22 LEU 146 HD22 LEU 146 -4.190 11.303 9.482 1182 HD23 LEU 146 HD23 LEU 146 -4.099 10.587 11.081 1183 HA PRO 147 HA PRO 147 -8.348 17.107 10.826 1184 HB2 PRO 147 HB2 PRO 147 -7.175 17.644 13.208 1185 HB3 PRO 147 HB1 PRO 147 -8.763 16.853 13.105 1186 HG2 PRO 147 HG2 PRO 147 -6.062 15.587 13.440 1187 HG3 PRO 147 HG1 PRO 147 -7.536 15.328 14.394 1188 HD2 PRO 147 HD2 PRO 147 -6.841 13.650 12.450 1189 HD3 PRO 147 HD1 PRO 147 -8.547 14.048 12.731 1190 H ARG 148 HN ARG 148 -7.029 19.001 10.670 1191 HA ARG 148 HA ARG 148 -4.674 18.756 9.241 1192 HB2 ARG 148 HB2 ARG 148 -4.429 21.153 9.539 1193 HB3 ARG 148 HB1 ARG 148 -6.124 20.756 9.256 1194 HG2 ARG 148 HG2 ARG 148 -6.423 20.708 11.776 1195 HG3 ARG 148 HG1 ARG 148 -4.799 21.386 11.904 1196 HD2 ARG 148 HD2 ARG 148 -6.315 23.241 11.960 1197 HD3 ARG 148 HD1 ARG 148 -5.574 23.247 10.362 1198 HE ARG 148 HE ARG 148 -7.673 22.850 9.469 1199 HH11 ARG 148 HH21 ARG 148 -7.584 21.979 12.817 1200 HH12 ARG 148 HH22 ARG 148 -9.278 21.630 12.913 1201 HH21 ARG 148 HH11 ARG 148 -9.895 22.395 9.587 1202 HH22 ARG 148 HH12 ARG 148 -10.586 21.866 11.084 1203 H GLN 149 HN GLN 149 -5.102 18.310 12.561 1204 HA GLN 149 HA GLN 149 -2.915 19.397 13.806 1205 HB2 GLN 149 HB2 GLN 149 -4.149 16.667 14.187 1206 HB3 GLN 149 HB1 GLN 149 -2.931 17.342 15.270 1207 HG2 GLN 149 HG2 GLN 149 -4.379 19.276 15.719 1208 HG3 GLN 149 HG1 GLN 149 -5.594 18.637 14.614 1209 HE21 GLN 149 HE21 GLN 149 -4.370 18.465 17.861 1210 HE22 GLN 149 HE22 GLN 149 -5.399 17.228 18.401 1211 H GLU 150 HN GLU 150 -0.786 19.241 13.641 1212 HA GLU 150 HA GLU 150 0.392 16.932 12.191 1213 HB2 GLU 150 HB2 GLU 150 2.229 18.658 11.615 1214 HB3 GLU 150 HB1 GLU 150 0.707 18.751 10.731 1215 HG2 GLU 150 HG2 GLU 150 1.155 20.344 13.256 1216 HG3 GLU 150 HG1 GLU 150 1.658 20.955 11.682 1217 H GLU 151 HN GLU 151 1.950 15.840 13.252 1218 HA GLU 151 HA GLU 151 2.991 16.999 15.778 1219 HB2 GLU 151 HB2 GLU 151 2.503 14.121 14.979 1220 HB3 GLU 151 HB1 GLU 151 3.362 14.606 16.441 1221 HG2 GLU 151 HG2 GLU 151 0.564 15.545 15.768 1222 HG3 GLU 151 HG1 GLU 151 0.897 14.138 16.776 1223 H CYS 152 HN CYS 152 3.754 15.277 12.815 1224 HA CYS 152 HA CYS 152 6.579 16.040 13.130 1225 HB2 CYS 152 HB2 CYS 152 5.494 13.302 13.076 1226 HB3 CYS 152 HB1 CYS 152 6.790 13.575 11.917 1227 H THR 153 HN THR 153 7.755 15.942 11.079 1228 HA THR 153 HA THR 153 6.171 15.822 8.633 1229 HB THR 153 HB THR 153 6.849 18.106 7.937 1230 HG1 THR 153 HG1 THR 153 8.359 17.888 10.101 1231 HG21 THR 153 HG21 THR 153 5.375 18.225 10.573 1232 HG22 THR 153 HG22 THR 153 5.145 19.245 9.153 1233 HG23 THR 153 HG23 THR 153 4.646 17.555 9.114 1234 H VAL 154 HN VAL 154 7.533 16.002 6.696 1235 HA VAL 154 HA VAL 154 10.274 15.039 7.239 1236 HB VAL 154 HB VAL 154 9.202 13.388 5.998 1237 HG11 VAL 154 HG11 VAL 154 7.845 13.993 3.916 1238 HG12 VAL 154 HG12 VAL 154 7.127 14.432 5.465 1239 HG13 VAL 154 HG13 VAL 154 7.919 15.662 4.481 1240 HG21 VAL 154 HG21 VAL 154 10.249 13.362 3.835 1241 HG22 VAL 154 HG22 VAL 154 10.356 15.120 3.798 1242 HG23 VAL 154 HG23 VAL 154 11.346 14.197 4.931 1243 H ASP 155 HN ASP 155 11.919 15.659 5.726 1244 HA ASP 155 HA ASP 155 11.589 18.457 4.802 1245 HB2 ASP 155 HB2 ASP 155 13.181 18.373 6.587 1246 HB3 ASP 155 HB1 ASP 155 14.049 17.048 5.827 1247 H GLU 156 HN GLU 156 13.075 19.075 3.104 1248 HA GLU 156 HA GLU 156 13.862 16.985 1.218 1249 HB2 GLU 156 HB2 GLU 156 12.611 18.295 -0.619 1250 HB3 GLU 156 HB1 GLU 156 11.672 17.247 0.441 1251 HG2 GLU 156 HG2 GLU 156 11.028 19.152 1.826 1252 HG3 GLU 156 HG1 GLU 156 12.030 20.226 0.853 1253 H VAL 157 HN VAL 157 15.936 17.836 1.816 1254 HA VAL 157 HA VAL 157 16.608 20.567 1.117 1255 HB VAL 157 HB VAL 157 19.000 19.537 1.567 1256 HG11 VAL 157 HG11 VAL 157 16.816 20.017 3.598 1257 HG12 VAL 157 HG12 VAL 157 18.485 19.703 4.075 1258 HG13 VAL 157 HG13 VAL 157 18.098 21.120 3.097 1259 HG21 VAL 157 HG21 VAL 157 19.008 17.531 2.856 1260 HG22 VAL 157 HG22 VAL 157 17.254 17.555 3.038 1261 HG23 VAL 157 HG23 VAL 157 17.972 17.188 1.470 1262 HN1 EB4 200 H17 EB4 200 0.958 -0.499 5.802 1263 H8 EB4 200 H8 EB4 200 4.041 2.221 0.342 1264 HN2 EB4 200 H25 EB4 200 3.854 1.032 5.852 1265 H9 EB4 200 H9 EB4 200 -0.699 6.241 3.198 1266 H10 EB4 200 H10 EB4 200 -2.747 -1.369 1.262 1267 HN3 EB4 200 H32 EB4 200 1.070 2.425 7.200 1268 H7 EB4 200 H7 EB4 200 -1.741 0.863 0.869 1269 H11 EB4 200 H11 EB4 200 6.298 1.232 0.611 1270 H12 EB4 200 H12 EB4 200 -1.579 7.345 5.239 1271 H15 EB4 200 H15 EB4 200 -1.085 6.393 7.474 1272 H14 EB4 200 H14 EB4 200 7.090 0.540 2.857 1273 H13 EB4 200 H13 EB4 200 -2.093 -2.686 3.260 1274 H22 EB4 200 H22 EB4 200 0.511 -2.994 7.315 1275 H30 EB4 200 H30 EB4 200 0.740 0.413 10.280 1276 H30A EB4 200 H9N EB4 200 -0.641 1.172 9.347 1277 H24 EB4 200 H24 EB4 200 0.922 2.885 10.126 1278 H28 EB4 200 H28 EB4 200 2.862 -2.880 7.995 1279 H28A EB4 200 H9L EB4 200 2.651 -3.107 6.251 1280 H23 EB4 200 H23 EB4 200 6.110 0.073 7.548 1281 H29 EB4 200 H29 EB4 200 4.983 1.213 9.421 1282 H29A EB4 200 H9M EB4 200 5.403 2.385 8.078 1283 H21 ACD 300 HA3 ACD 300 1.395 9.959 -10.489 1284 H22 ACD 300 HA4 ACD 300 1.466 11.458 -9.534 1285 H31 ACD 300 HA1 ACD 300 -1.048 11.501 -9.508 1286 H32 ACD 300 HA2 ACD 300 -1.050 9.935 -10.349 1287 H41 ACD 300 HA0 ACD 300 0.250 10.448 -7.637 1288 H42 ACD 300 HAZ ACD 300 0.125 8.882 -8.472 1289 H5 ACD 300 HAY ACD 300 -2.628 9.691 -8.361 1290 H6 ACD 300 HAX ACD 300 -2.919 9.250 -5.800 1291 H71 ACD 300 HAV ACD 300 0.015 10.082 -5.622 1292 H72 ACD 300 HAW ACD 300 -0.996 9.516 -4.274 1293 H8 ACD 300 HAU ACD 300 0.247 7.552 -6.380 1294 H9 ACD 300 HAT ACD 300 0.590 6.078 -4.257 1295 H101 ACD 300 HAR ACD 300 0.601 7.741 -2.174 1296 H102 ACD 300 HAS ACD 300 -0.844 8.495 -2.882 1297 H11 ACD 300 HAQ ACD 300 -2.115 6.225 -2.545 1298 H12 ACD 300 HAP ACD 300 -1.367 5.127 -0.299 1299 H131 ACD 300 HAN ACD 300 1.452 6.253 -0.800 1300 H132 ACD 300 HAO ACD 300 0.742 5.654 0.779 1301 H14 ACD 300 HAM ACD 300 -0.511 8.058 0.712 1302 H15 ACD 300 HAL ACD 300 1.560 9.654 0.739 1303 H161 ACD 300 HAJ ACD 300 3.798 8.877 0.131 1304 H162 ACD 300 HAK ACD 300 3.284 7.201 0.422 1305 H171 ACD 300 HAH ACD 300 3.985 7.578 -1.935 1306 H172 ACD 300 HAI ACD 300 2.286 7.084 -1.826 1307 H181 ACD 300 HAF ACD 300 1.633 9.518 -1.924 1308 H182 ACD 300 HAG ACD 300 3.342 9.925 -2.200 1309 H191 ACD 300 HAD ACD 300 3.337 8.414 -4.205 1310 H192 ACD 300 HAE ACD 300 1.622 8.100 -3.934 1311 H201 ACD 300 HAA ACD 300 1.862 9.834 -5.647 1312 H202 ACD 300 HAB ACD 300 2.882 10.808 -4.566 1313 H203 ACD 300 HAC ACD 300 1.162 10.562 -4.182 Start of MODEL 16 1 H1 MET 1 HT1 MET 1 6.858 12.959 -22.025 2 H2 MET 1 HT2 MET 1 5.558 13.988 -21.655 3 H3 MET 1 HT3 MET 1 6.220 12.984 -20.455 4 HA MET 1 HA MET 1 7.760 14.463 -19.919 5 HB2 MET 1 HB2 MET 1 8.195 14.672 -22.912 6 HB3 MET 1 HB1 MET 1 9.197 15.492 -21.714 7 HG2 MET 1 HG2 MET 1 9.688 13.272 -20.673 8 HG3 MET 1 HG1 MET 1 8.789 12.499 -21.978 9 HE1 MET 1 HE1 MET 1 10.821 11.025 -22.654 10 HE2 MET 1 HE2 MET 1 12.463 11.638 -22.828 11 HE3 MET 1 HE3 MET 1 11.646 11.720 -21.261 12 H THR 2 HN THR 2 5.016 15.174 -20.217 13 HA THR 2 HA THR 2 5.268 18.046 -20.191 14 HB THR 2 HB THR 2 3.496 16.785 -22.296 15 HG1 THR 2 HG1 THR 2 5.184 16.938 -23.502 16 HG21 THR 2 HG21 THR 2 3.306 19.228 -22.988 17 HG22 THR 2 HG22 THR 2 2.486 18.796 -21.487 18 HG23 THR 2 HG23 THR 2 4.038 19.632 -21.435 19 H VAL 3 HN VAL 3 4.590 17.422 -18.010 20 HA VAL 3 HA VAL 3 1.676 17.481 -17.779 21 HB VAL 3 HB VAL 3 1.829 15.651 -15.993 22 HG11 VAL 3 HG11 VAL 3 1.550 13.884 -17.644 23 HG12 VAL 3 HG12 VAL 3 0.821 15.364 -18.268 24 HG13 VAL 3 HG13 VAL 3 2.398 14.840 -18.859 25 HG21 VAL 3 HG21 VAL 3 4.393 15.778 -16.010 26 HG22 VAL 3 HG22 VAL 3 3.693 14.160 -16.054 27 HG23 VAL 3 HG23 VAL 3 4.321 14.890 -17.531 28 HA PRO 4 HA PRO 4 4.223 20.289 -14.963 29 HB2 PRO 4 HB2 PRO 4 1.742 21.868 -15.545 30 HB3 PRO 4 HB1 PRO 4 3.428 22.415 -15.441 31 HG2 PRO 4 HG2 PRO 4 2.226 22.109 -17.794 32 HG3 PRO 4 HG1 PRO 4 3.934 21.689 -17.571 33 HD2 PRO 4 HD2 PRO 4 1.572 19.875 -17.844 34 HD3 PRO 4 HD1 PRO 4 3.258 19.616 -18.344 35 H ASP 5 HN ASP 5 0.932 19.096 -15.030 36 HA ASP 5 HA ASP 5 0.032 19.900 -12.503 37 HB2 ASP 5 HB2 ASP 5 -0.586 17.393 -14.080 38 HB3 ASP 5 HB1 ASP 5 -1.478 17.916 -12.652 39 H ARG 6 HN ARG 6 1.924 17.064 -13.478 40 HA ARG 6 HA ARG 6 1.962 15.837 -10.913 41 HB2 ARG 6 HB2 ARG 6 2.446 14.593 -12.970 42 HB3 ARG 6 HB1 ARG 6 3.894 15.565 -13.229 43 HG2 ARG 6 HG2 ARG 6 3.751 14.321 -10.543 44 HG3 ARG 6 HG1 ARG 6 3.840 13.161 -11.864 45 HD2 ARG 6 HD2 ARG 6 5.739 15.499 -11.535 46 HD3 ARG 6 HD1 ARG 6 6.084 13.860 -10.993 47 HE ARG 6 HE ARG 6 5.453 13.498 -13.607 48 HH11 ARG 6 HH21 ARG 6 7.559 15.662 -11.918 49 HH12 ARG 6 HH22 ARG 6 8.700 15.785 -13.216 50 HH21 ARG 6 HH11 ARG 6 6.943 13.655 -15.313 51 HH22 ARG 6 HH12 ARG 6 8.350 14.649 -15.139 52 H SER 7 HN SER 7 4.372 17.809 -12.646 53 HA SER 7 HA SER 7 6.304 17.885 -10.609 54 HB2 SER 7 HB2 SER 7 7.250 19.761 -11.802 55 HB3 SER 7 HB1 SER 7 6.658 18.594 -12.980 56 HG SER 7 HG SER 7 4.812 19.861 -13.232 57 H GLU 8 HN GLU 8 3.391 19.738 -11.124 58 HA GLU 8 HA GLU 8 3.942 21.846 -9.301 59 HB2 GLU 8 HB2 GLU 8 2.168 21.833 -11.106 60 HB3 GLU 8 HB1 GLU 8 1.207 20.804 -10.043 61 HG2 GLU 8 HG2 GLU 8 0.503 23.063 -9.635 62 HG3 GLU 8 HG1 GLU 8 1.479 22.576 -8.251 63 H ILE 9 HN ILE 9 2.156 18.778 -8.930 64 HA ILE 9 HA ILE 9 1.728 19.318 -6.098 65 HB ILE 9 HB ILE 9 0.068 18.198 -7.689 66 HG12 ILE 9 HG12 ILE 9 0.322 18.091 -4.975 67 HG13 ILE 9 HG11 ILE 9 -1.030 17.400 -5.839 68 HG21 ILE 9 HG21 ILE 9 1.922 15.866 -7.226 69 HG22 ILE 9 HG22 ILE 9 0.300 15.734 -7.884 70 HG23 ILE 9 HG23 ILE 9 1.535 16.627 -8.763 71 HD11 ILE 9 HD11 ILE 9 0.056 15.217 -5.827 72 HD12 ILE 9 HD12 ILE 9 1.484 15.932 -5.068 73 HD13 ILE 9 HD13 ILE 9 -0.033 15.847 -4.184 74 H ALA 10 HN ALA 10 3.863 17.501 -8.114 75 HA ALA 10 HA ALA 10 4.753 15.662 -6.144 76 HB1 ALA 10 HB1 ALA 10 6.903 15.627 -7.596 77 HB2 ALA 10 HB2 ALA 10 5.970 16.632 -8.702 78 HB3 ALA 10 HB3 ALA 10 5.402 15.016 -8.289 79 H GLY 11 HN GLY 11 6.421 15.770 -4.632 80 HA2 GLY 11 HA2 GLY 11 8.352 17.023 -3.779 81 HA3 GLY 11 HA1 GLY 11 7.453 18.499 -4.138 82 H LYS 12 HN LYS 12 4.888 17.292 -3.348 83 HA LYS 12 HA LYS 12 5.081 16.551 -0.573 84 HB2 LYS 12 HB2 LYS 12 5.513 18.986 -0.446 85 HB3 LYS 12 HB1 LYS 12 3.963 19.280 -1.236 86 HG2 LYS 12 HG2 LYS 12 2.750 18.298 0.591 87 HG3 LYS 12 HG1 LYS 12 4.233 17.690 1.326 88 HD2 LYS 12 HD2 LYS 12 3.510 19.706 2.505 89 HD3 LYS 12 HD1 LYS 12 5.008 20.037 1.636 90 HE2 LYS 12 HE2 LYS 12 3.909 21.282 -0.036 91 HE3 LYS 12 HE1 LYS 12 2.333 20.593 0.359 92 HZ1 LYS 12 HZ1 LYS 12 3.328 22.967 1.262 93 HZ2 LYS 12 HZ2 LYS 12 1.990 22.136 1.898 94 HZ3 LYS 12 HZ3 LYS 12 3.524 21.922 2.588 95 H TRP 13 HN TRP 13 3.513 14.974 -0.555 96 HA TRP 13 HA TRP 13 0.875 15.585 -1.776 97 HB2 TRP 13 HB2 TRP 13 2.384 12.976 -1.415 98 HB3 TRP 13 HB1 TRP 13 0.689 13.015 -1.862 99 HD1 TRP 13 HD1 TRP 13 3.878 14.770 -3.129 100 HE1 TRP 13 HE1 TRP 13 3.814 14.608 -5.699 101 HE3 TRP 13 HE3 TRP 13 -0.586 12.382 -3.820 102 HZ2 TRP 13 HZ2 TRP 13 2.206 13.634 -7.713 103 HZ3 TRP 13 HZ3 TRP 13 -1.372 11.865 -6.117 104 HH2 TRP 13 HH2 TRP 13 0.013 12.497 -8.077 105 H TYR 14 HN TYR 14 -0.758 15.734 -0.261 106 HA TYR 14 HA TYR 14 -0.139 14.897 2.491 107 HB2 TYR 14 HB2 TYR 14 -1.557 17.084 1.211 108 HB3 TYR 14 HB1 TYR 14 -2.575 16.305 2.407 109 HD1 TYR 14 HD2 TYR 14 1.133 16.896 2.329 110 HD2 TYR 14 HD1 TYR 14 -2.609 17.663 4.291 111 HE1 TYR 14 HE2 TYR 14 2.316 18.131 4.127 112 HE2 TYR 14 HE1 TYR 14 -1.426 18.893 6.082 113 HH TYR 14 HH TYR 14 2.069 19.478 5.904 114 H VAL 15 HN VAL 15 -1.139 13.240 3.465 115 HA VAL 15 HA VAL 15 -3.494 11.986 2.168 116 HB VAL 15 HB VAL 15 -1.395 10.930 4.081 117 HG11 VAL 15 HG11 VAL 15 -4.090 9.790 3.326 118 HG12 VAL 15 HG12 VAL 15 -2.769 8.766 3.888 119 HG13 VAL 15 HG13 VAL 15 -3.420 10.022 4.941 120 HG21 VAL 15 HG21 VAL 15 -0.865 9.398 2.331 121 HG22 VAL 15 HG22 VAL 15 -2.343 9.786 1.455 122 HG23 VAL 15 HG23 VAL 15 -1.038 10.967 1.547 123 H VAL 16 HN VAL 16 -5.350 12.834 3.091 124 HA VAL 16 HA VAL 16 -5.290 13.264 6.027 125 HB VAL 16 HB VAL 16 -6.537 15.213 5.824 126 HG11 VAL 16 HG11 VAL 16 -4.960 15.612 3.325 127 HG12 VAL 16 HG12 VAL 16 -4.943 16.541 4.813 128 HG13 VAL 16 HG13 VAL 16 -4.063 15.024 4.710 129 HG21 VAL 16 HG21 VAL 16 -7.104 14.270 3.004 130 HG22 VAL 16 HG22 VAL 16 -8.262 14.627 4.286 131 HG23 VAL 16 HG23 VAL 16 -7.384 15.937 3.501 132 H ALA 17 HN ALA 17 -6.502 11.052 4.093 133 HA ALA 17 HA ALA 17 -8.503 10.349 5.939 134 HB1 ALA 17 HB1 ALA 17 -9.360 12.155 3.787 135 HB2 ALA 17 HB2 ALA 17 -10.161 11.773 5.298 136 HB3 ALA 17 HB3 ALA 17 -10.351 10.702 3.915 137 H LEU 18 HN LEU 18 -8.896 8.191 5.736 138 HA LEU 18 HA LEU 18 -8.375 6.961 3.121 139 HB2 LEU 18 HB2 LEU 18 -7.486 5.019 4.615 140 HB3 LEU 18 HB1 LEU 18 -6.442 6.394 4.275 141 HG LEU 18 HG LEU 18 -6.488 5.688 6.688 142 HD11 LEU 18 HD11 LEU 18 -6.401 8.253 5.622 143 HD12 LEU 18 HD12 LEU 18 -7.587 8.397 6.918 144 HD13 LEU 18 HD13 LEU 18 -5.967 7.801 7.268 145 HD21 LEU 18 HD21 LEU 18 -9.249 6.913 6.756 146 HD22 LEU 18 HD22 LEU 18 -8.996 5.177 6.607 147 HD23 LEU 18 HD23 LEU 18 -8.426 6.034 8.033 148 H ALA 19 HN ALA 19 -9.065 4.639 3.134 149 HA ALA 19 HA ALA 19 -11.512 4.139 4.662 150 HB1 ALA 19 HB1 ALA 19 -12.947 4.076 2.877 151 HB2 ALA 19 HB2 ALA 19 -11.703 3.532 1.756 152 HB3 ALA 19 HB3 ALA 19 -11.804 5.235 2.209 153 H SER 20 HN SER 20 -11.836 1.976 5.055 154 HA SER 20 HA SER 20 -10.505 -0.090 3.571 155 HB2 SER 20 HB2 SER 20 -8.500 0.344 4.634 156 HB3 SER 20 HB1 SER 20 -9.282 0.972 6.081 157 HG SER 20 HG SER 20 -8.476 -1.544 5.494 158 H ASN 21 HN ASN 21 -10.531 -2.183 4.984 159 HA ASN 21 HA ASN 21 -13.001 -2.286 6.596 160 HB2 ASN 21 HB2 ASN 21 -12.262 -4.172 4.361 161 HB3 ASN 21 HB1 ASN 21 -13.622 -4.385 5.456 162 HD21 ASN 21 HD21 ASN 21 -14.163 -1.411 5.490 163 HD22 ASN 21 HD22 ASN 21 -14.893 -1.081 3.993 164 H THR 22 HN THR 22 -9.744 -3.214 6.030 165 HA THR 22 HA THR 22 -9.779 -5.532 7.758 166 HB THR 22 HB THR 22 -8.080 -5.168 5.924 167 HG1 THR 22 HG1 THR 22 -6.341 -5.873 7.321 168 HG21 THR 22 HG21 THR 22 -6.432 -3.562 6.087 169 HG22 THR 22 HG22 THR 22 -7.770 -2.685 6.816 170 HG23 THR 22 HG23 THR 22 -6.558 -3.454 7.841 171 H GLU 23 HN GLU 23 -10.227 -5.269 9.834 172 HA GLU 23 HA GLU 23 -10.267 -2.887 11.201 173 HB2 GLU 23 HB2 GLU 23 -9.878 -5.643 12.364 174 HB3 GLU 23 HB1 GLU 23 -10.420 -4.221 13.255 175 HG2 GLU 23 HG2 GLU 23 -11.850 -5.373 10.843 176 HG3 GLU 23 HG1 GLU 23 -12.307 -5.692 12.515 177 H PHE 24 HN PHE 24 -7.579 -5.179 11.048 178 HA PHE 24 HA PHE 24 -6.010 -4.141 13.058 179 HB2 PHE 24 HB2 PHE 24 -4.601 -4.770 10.510 180 HB3 PHE 24 HB1 PHE 24 -4.289 -5.354 12.143 181 HD1 PHE 24 HD1 PHE 24 -6.943 -6.374 12.943 182 HD2 PHE 24 HD2 PHE 24 -4.860 -6.711 9.201 183 HE1 PHE 24 HE1 PHE 24 -8.199 -8.449 12.430 184 HE2 PHE 24 HE2 PHE 24 -6.116 -8.786 8.689 185 HZ PHE 24 HZ PHE 24 -7.785 -9.656 10.303 186 H PHE 25 HN PHE 25 -5.961 -3.072 9.634 187 HA PHE 25 HA PHE 25 -4.264 -0.829 10.244 188 HB2 PHE 25 HB2 PHE 25 -5.840 -1.277 7.712 189 HB3 PHE 25 HB1 PHE 25 -4.375 -0.326 7.916 190 HD1 PHE 25 HD2 PHE 25 -3.373 -2.805 9.959 191 HD2 PHE 25 HD1 PHE 25 -4.521 -2.373 5.829 192 HE1 PHE 25 HE2 PHE 25 -2.050 -4.797 9.378 193 HE2 PHE 25 HE1 PHE 25 -3.186 -4.383 5.265 194 HZ PHE 25 HZ PHE 25 -1.952 -5.591 7.036 195 H LEU 26 HN LEU 26 -7.684 -1.210 9.480 196 HA LEU 26 HA LEU 26 -8.378 1.531 9.406 197 HB2 LEU 26 HB2 LEU 26 -9.878 -0.133 8.541 198 HB3 LEU 26 HB1 LEU 26 -9.922 -0.975 10.080 199 HG LEU 26 HG LEU 26 -11.107 0.882 11.115 200 HD11 LEU 26 HD11 LEU 26 -10.591 2.195 8.440 201 HD12 LEU 26 HD12 LEU 26 -11.895 2.738 9.496 202 HD13 LEU 26 HD13 LEU 26 -10.222 2.812 10.051 203 HD21 LEU 26 HD21 LEU 26 -12.411 0.360 8.434 204 HD22 LEU 26 HD22 LEU 26 -12.279 -0.899 9.661 205 HD23 LEU 26 HD23 LEU 26 -13.191 0.570 10.003 206 H ARG 27 HN ARG 27 -7.915 -0.763 11.885 207 HA ARG 27 HA ARG 27 -9.029 0.637 14.111 208 HB2 ARG 27 HB2 ARG 27 -8.509 -1.684 14.436 209 HB3 ARG 27 HB1 ARG 27 -6.819 -1.430 13.998 210 HG2 ARG 27 HG2 ARG 27 -6.397 -0.184 15.996 211 HG3 ARG 27 HG1 ARG 27 -8.119 -0.052 16.356 212 HD2 ARG 27 HD2 ARG 27 -8.227 -2.517 16.630 213 HD3 ARG 27 HD1 ARG 27 -6.494 -2.610 16.334 214 HE ARG 27 HE ARG 27 -7.788 -1.716 18.769 215 HH11 ARG 27 HH21 ARG 27 -4.954 -1.663 16.783 216 HH12 ARG 27 HH22 ARG 27 -3.877 -1.297 18.090 217 HH21 ARG 27 HH11 ARG 27 -6.381 -1.238 20.488 218 HH22 ARG 27 HH12 ARG 27 -4.685 -1.057 20.188 219 H GLU 28 HN GLU 28 -5.746 0.529 12.748 220 HA GLU 28 HA GLU 28 -4.768 2.488 14.631 221 HB2 GLU 28 HB2 GLU 28 -3.498 1.272 12.177 222 HB3 GLU 28 HB1 GLU 28 -2.668 2.310 13.337 223 HG2 GLU 28 HG2 GLU 28 -3.252 0.698 15.145 224 HG3 GLU 28 HG1 GLU 28 -3.974 -0.361 13.934 225 H LYS 29 HN LYS 29 -5.565 2.634 11.065 226 HA LYS 29 HA LYS 29 -4.517 5.117 10.586 227 HB2 LYS 29 HB2 LYS 29 -6.992 3.755 9.541 228 HB3 LYS 29 HB1 LYS 29 -6.485 5.338 8.963 229 HG2 LYS 29 HG2 LYS 29 -4.770 4.480 7.726 230 HG3 LYS 29 HG1 LYS 29 -4.252 3.419 9.030 231 HD2 LYS 29 HD2 LYS 29 -4.904 1.896 7.380 232 HD3 LYS 29 HD1 LYS 29 -6.350 1.991 8.373 233 HE2 LYS 29 HE2 LYS 29 -7.368 3.563 6.825 234 HE3 LYS 29 HE1 LYS 29 -5.887 3.629 5.869 235 HZ1 LYS 29 HZ1 LYS 29 -7.930 1.968 5.387 236 HZ2 LYS 29 HZ2 LYS 29 -6.328 1.679 4.902 237 HZ3 LYS 29 HZ3 LYS 29 -6.923 0.973 6.325 238 H ASP 30 HN ASP 30 -7.395 4.228 12.318 239 HA ASP 30 HA ASP 30 -8.628 6.742 12.458 240 HB2 ASP 30 HB2 ASP 30 -8.677 4.474 14.454 241 HB3 ASP 30 HB1 ASP 30 -9.801 5.831 14.426 242 H LYS 31 HN LYS 31 -5.820 5.511 14.229 243 HA LYS 31 HA LYS 31 -6.083 7.699 16.140 244 HB2 LYS 31 HB2 LYS 31 -4.486 6.654 17.526 245 HB3 LYS 31 HB1 LYS 31 -5.577 5.402 16.955 246 HG2 LYS 31 HG2 LYS 31 -3.499 4.396 16.665 247 HG3 LYS 31 HG1 LYS 31 -3.815 5.052 15.077 248 HD2 LYS 31 HD2 LYS 31 -2.498 7.126 16.536 249 HD3 LYS 31 HD1 LYS 31 -1.623 5.643 16.874 250 HE2 LYS 31 HE2 LYS 31 -2.360 6.214 14.020 251 HE3 LYS 31 HE1 LYS 31 -1.026 7.103 14.737 252 HZ1 LYS 31 HZ1 LYS 31 -0.322 4.753 15.550 253 HZ2 LYS 31 HZ2 LYS 31 -1.282 4.222 14.252 254 HZ3 LYS 31 HZ3 LYS 31 0.036 5.251 13.966 255 H MET 32 HN MET 32 -4.212 7.140 13.253 256 HA MET 32 HA MET 32 -2.097 8.909 14.128 257 HB2 MET 32 HB2 MET 32 -1.547 8.958 11.589 258 HB3 MET 32 HB1 MET 32 -1.289 7.469 12.477 259 HG2 MET 32 HG2 MET 32 -3.804 6.992 11.696 260 HG3 MET 32 HG1 MET 32 -3.365 8.115 10.425 261 HE1 MET 32 HE1 MET 32 -2.905 5.012 12.251 262 HE2 MET 32 HE2 MET 32 -1.900 3.940 11.300 263 HE3 MET 32 HE3 MET 32 -1.162 5.179 12.317 264 H LYS 33 HN LYS 33 -1.507 10.733 12.656 265 HA LYS 33 HA LYS 33 -3.817 12.551 12.360 266 HB2 LYS 33 HB2 LYS 33 -0.949 13.423 12.637 267 HB3 LYS 33 HB1 LYS 33 -2.420 14.340 12.955 268 HG2 LYS 33 HG2 LYS 33 -1.440 11.964 14.566 269 HG3 LYS 33 HG1 LYS 33 -1.346 13.652 15.063 270 HD2 LYS 33 HD2 LYS 33 -3.895 13.722 14.742 271 HD3 LYS 33 HD1 LYS 33 -3.821 11.963 14.677 272 HE2 LYS 33 HE2 LYS 33 -2.873 13.715 16.961 273 HE3 LYS 33 HE1 LYS 33 -4.283 12.655 16.969 274 HZ1 LYS 33 HZ1 LYS 33 -1.975 11.878 17.915 275 HZ2 LYS 33 HZ2 LYS 33 -3.007 10.797 17.107 276 HZ3 LYS 33 HZ3 LYS 33 -1.691 11.484 16.287 277 H MET 34 HN MET 34 -3.173 14.378 10.571 278 HA MET 34 HA MET 34 -3.122 13.268 8.104 279 HB2 MET 34 HB2 MET 34 -3.360 15.739 9.153 280 HB3 MET 34 HB1 MET 34 -1.725 15.883 8.536 281 HG2 MET 34 HG2 MET 34 -2.512 15.205 6.311 282 HG3 MET 34 HG1 MET 34 -4.157 15.061 6.944 283 HE1 MET 34 HE1 MET 34 -5.257 16.749 8.276 284 HE2 MET 34 HE2 MET 34 -5.315 18.456 7.853 285 HE3 MET 34 HE3 MET 34 -5.867 17.240 6.702 286 H ALA 35 HN ALA 35 -1.557 12.704 6.625 287 HA ALA 35 HA ALA 35 1.266 12.704 7.537 288 HB1 ALA 35 HB1 ALA 35 1.379 10.695 5.872 289 HB2 ALA 35 HB2 ALA 35 -0.370 10.648 6.085 290 HB3 ALA 35 HB3 ALA 35 0.688 10.444 7.473 291 H MET 36 HN MET 36 2.853 12.642 5.711 292 HA MET 36 HA MET 36 1.880 14.086 3.328 293 HB2 MET 36 HB2 MET 36 4.492 15.059 3.895 294 HB3 MET 36 HB1 MET 36 2.978 15.953 3.904 295 HG2 MET 36 HG2 MET 36 3.899 14.322 6.280 296 HG3 MET 36 HG1 MET 36 4.332 16.015 6.067 297 HE1 MET 36 HE1 MET 36 3.494 16.258 8.298 298 HE2 MET 36 HE2 MET 36 2.864 17.724 7.551 299 HE3 MET 36 HE3 MET 36 1.852 16.787 8.659 300 H ALA 37 HN ALA 37 3.451 14.069 1.540 301 HA ALA 37 HA ALA 37 5.497 12.011 1.559 302 HB1 ALA 37 HB1 ALA 37 2.817 11.579 0.307 303 HB2 ALA 37 HB2 ALA 37 3.820 10.464 1.221 304 HB3 ALA 37 HB3 ALA 37 4.241 10.863 -0.446 305 H ARG 38 HN ARG 38 6.606 11.784 -0.534 306 HA ARG 38 HA ARG 38 6.276 14.132 -2.335 307 HB2 ARG 38 HB2 ARG 38 8.147 14.737 -0.978 308 HB3 ARG 38 HB1 ARG 38 8.822 13.110 -1.058 309 HG2 ARG 38 HG2 ARG 38 9.500 13.363 -3.298 310 HG3 ARG 38 HG1 ARG 38 8.406 14.717 -3.575 311 HD2 ARG 38 HD2 ARG 38 10.709 15.529 -3.382 312 HD3 ARG 38 HD1 ARG 38 9.750 16.103 -2.021 313 HE ARG 38 HE ARG 38 10.980 13.668 -1.298 314 HH11 ARG 38 HH21 ARG 38 11.729 16.958 -2.067 315 HH12 ARG 38 HH22 ARG 38 13.146 17.013 -1.071 316 HH21 ARG 38 HH11 ARG 38 12.837 13.733 0.009 317 HH22 ARG 38 HH12 ARG 38 13.773 15.187 0.103 318 H ILE 39 HN ILE 39 6.274 13.546 -4.571 319 HA ILE 39 HA ILE 39 7.133 10.837 -5.221 320 HB ILE 39 HB ILE 39 4.696 11.286 -5.093 321 HG12 ILE 39 HG12 ILE 39 5.591 10.576 -7.885 322 HG13 ILE 39 HG11 ILE 39 5.702 9.451 -6.535 323 HG21 ILE 39 HG21 ILE 39 4.866 13.512 -6.017 324 HG22 ILE 39 HG22 ILE 39 5.198 12.804 -7.587 325 HG23 ILE 39 HG23 ILE 39 3.684 12.479 -6.786 326 HD11 ILE 39 HD11 ILE 39 3.449 9.087 -6.507 327 HD12 ILE 39 HD12 ILE 39 3.081 10.802 -6.712 328 HD13 ILE 39 HD13 ILE 39 3.453 9.803 -8.109 329 H SER 40 HN SER 40 8.208 10.497 -7.137 330 HA SER 40 HA SER 40 8.875 12.863 -8.764 331 HB2 SER 40 HB2 SER 40 10.908 12.937 -7.736 332 HB3 SER 40 HB1 SER 40 10.716 11.329 -7.048 333 HG SER 40 HG SER 40 11.249 11.824 -9.791 334 H PHE 41 HN PHE 41 9.374 12.399 -10.922 335 HA PHE 41 HA PHE 41 8.436 9.777 -11.818 336 HB2 PHE 41 HB2 PHE 41 8.603 12.486 -12.943 337 HB3 PHE 41 HB1 PHE 41 8.921 11.205 -14.103 338 HD1 PHE 41 HD2 PHE 41 6.663 11.160 -11.121 339 HD2 PHE 41 HD1 PHE 41 6.955 11.103 -15.407 340 HE1 PHE 41 HE2 PHE 41 4.234 10.685 -11.282 341 HE2 PHE 41 HE1 PHE 41 4.527 10.629 -15.566 342 HZ PHE 41 HZ PHE 41 3.168 10.419 -13.505 343 H LEU 42 HN LEU 42 10.087 8.457 -11.434 344 HA LEU 42 HA LEU 42 12.806 8.864 -12.306 345 HB2 LEU 42 HB2 LEU 42 11.252 6.380 -11.556 346 HB3 LEU 42 HB1 LEU 42 12.906 6.306 -12.116 347 HG LEU 42 HG LEU 42 11.958 7.920 -9.735 348 HD11 LEU 42 HD11 LEU 42 13.155 5.157 -9.998 349 HD12 LEU 42 HD12 LEU 42 13.308 6.085 -8.506 350 HD13 LEU 42 HD13 LEU 42 11.711 5.647 -9.112 351 HD21 LEU 42 HD21 LEU 42 14.591 7.651 -9.334 352 HD22 LEU 42 HD22 LEU 42 14.607 7.517 -11.091 353 HD23 LEU 42 HD23 LEU 42 13.951 8.961 -10.320 354 H GLY 43 HN GLY 43 9.900 7.524 -13.533 355 HA2 GLY 43 HA2 GLY 43 10.386 7.951 -16.260 356 HA3 GLY 43 HA1 GLY 43 10.723 6.256 -15.891 357 H GLU 44 HN GLU 44 8.465 7.423 -17.479 358 HA GLU 44 HA GLU 44 6.062 7.503 -16.093 359 HB2 GLU 44 HB2 GLU 44 6.564 6.273 -18.823 360 HB3 GLU 44 HB1 GLU 44 4.991 6.763 -18.194 361 HG2 GLU 44 HG2 GLU 44 7.352 8.633 -18.529 362 HG3 GLU 44 HG1 GLU 44 6.029 8.485 -19.685 363 H ASP 45 HN ASP 45 8.115 4.791 -16.781 364 HA ASP 45 HA ASP 45 6.079 2.903 -15.772 365 HB2 ASP 45 HB2 ASP 45 8.750 2.062 -16.861 366 HB3 ASP 45 HB1 ASP 45 7.215 1.195 -16.875 367 H GLU 46 HN GLU 46 7.966 4.903 -14.337 368 HA GLU 46 HA GLU 46 8.472 3.257 -12.051 369 HB2 GLU 46 HB2 GLU 46 10.377 2.648 -13.584 370 HB3 GLU 46 HB1 GLU 46 10.907 4.327 -13.492 371 HG2 GLU 46 HG2 GLU 46 10.905 4.038 -10.948 372 HG3 GLU 46 HG1 GLU 46 10.733 2.311 -11.250 373 H LEU 47 HN LEU 47 8.253 4.542 -10.313 374 HA LEU 47 HA LEU 47 9.225 7.307 -10.440 375 HB2 LEU 47 HB2 LEU 47 6.947 7.739 -9.029 376 HB3 LEU 47 HB1 LEU 47 7.095 8.036 -10.756 377 HG LEU 47 HG LEU 47 6.215 5.368 -9.645 378 HD11 LEU 47 HD11 LEU 47 4.653 7.016 -8.822 379 HD12 LEU 47 HD12 LEU 47 4.561 7.782 -10.407 380 HD13 LEU 47 HD13 LEU 47 3.895 6.167 -10.170 381 HD21 LEU 47 HD21 LEU 47 5.024 5.829 -12.131 382 HD22 LEU 47 HD22 LEU 47 6.642 6.493 -12.330 383 HD23 LEU 47 HD23 LEU 47 6.432 4.815 -11.836 384 H LYS 48 HN LYS 48 9.714 8.227 -8.441 385 HA LYS 48 HA LYS 48 10.097 6.238 -6.280 386 HB2 LYS 48 HB2 LYS 48 12.023 7.692 -7.414 387 HB3 LYS 48 HB1 LYS 48 11.458 8.914 -6.279 388 HG2 LYS 48 HG2 LYS 48 11.780 7.350 -4.409 389 HG3 LYS 48 HG1 LYS 48 12.300 6.095 -5.535 390 HD2 LYS 48 HD2 LYS 48 14.059 7.920 -6.293 391 HD3 LYS 48 HD1 LYS 48 13.732 8.604 -4.700 392 HE2 LYS 48 HE2 LYS 48 14.141 6.228 -3.792 393 HE3 LYS 48 HE1 LYS 48 14.838 5.879 -5.373 394 HZ1 LYS 48 HZ1 LYS 48 16.541 7.377 -5.056 395 HZ2 LYS 48 HZ2 LYS 48 15.707 8.252 -3.862 396 HZ3 LYS 48 HZ3 LYS 48 16.358 6.729 -3.496 397 H VAL 49 HN VAL 49 8.729 6.426 -4.552 398 HA VAL 49 HA VAL 49 7.849 9.123 -3.868 399 HB VAL 49 HB VAL 49 6.108 7.692 -5.243 400 HG11 VAL 49 HG11 VAL 49 5.558 6.773 -2.421 401 HG12 VAL 49 HG12 VAL 49 4.400 6.681 -3.749 402 HG13 VAL 49 HG13 VAL 49 5.900 5.764 -3.818 403 HG21 VAL 49 HG21 VAL 49 4.586 9.256 -4.602 404 HG22 VAL 49 HG22 VAL 49 4.857 8.981 -2.899 405 HG23 VAL 49 HG23 VAL 49 5.951 9.967 -3.807 406 H SER 50 HN SER 50 7.481 9.609 -1.876 407 HA SER 50 HA SER 50 8.541 7.722 0.165 408 HB2 SER 50 HB2 SER 50 8.813 10.702 -0.150 409 HB3 SER 50 HB1 SER 50 9.120 9.902 1.382 410 HG SER 50 HG SER 50 10.934 9.184 0.606 411 H TYR 51 HN TYR 51 7.647 7.673 2.240 412 HA TYR 51 HA TYR 51 4.937 8.862 2.481 413 HB2 TYR 51 HB2 TYR 51 6.006 6.425 3.933 414 HB3 TYR 51 HB1 TYR 51 4.350 7.007 3.912 415 HD1 TYR 51 HD1 TYR 51 6.994 6.061 1.379 416 HD2 TYR 51 HD2 TYR 51 2.885 5.784 2.602 417 HE1 TYR 51 HE1 TYR 51 6.509 4.595 -0.547 418 HE2 TYR 51 HE2 TYR 51 2.415 4.306 0.671 419 HH TYR 51 HH TYR 51 3.403 3.879 -1.595 420 H ALA 52 HN ALA 52 4.665 10.295 4.147 421 HA ALA 52 HA ALA 52 6.588 10.204 6.399 422 HB1 ALA 52 HB1 ALA 52 5.327 12.740 5.378 423 HB2 ALA 52 HB2 ALA 52 6.855 12.146 4.731 424 HB3 ALA 52 HB3 ALA 52 6.722 12.556 6.441 425 H VAL 53 HN VAL 53 5.448 9.435 8.100 426 HA VAL 53 HA VAL 53 2.731 10.520 8.556 427 HB VAL 53 HB VAL 53 3.738 7.805 9.407 428 HG11 VAL 53 HG11 VAL 53 0.896 8.792 9.101 429 HG12 VAL 53 HG12 VAL 53 1.464 7.359 9.956 430 HG13 VAL 53 HG13 VAL 53 1.788 8.963 10.611 431 HG21 VAL 53 HG21 VAL 53 3.691 7.991 6.934 432 HG22 VAL 53 HG22 VAL 53 2.426 6.914 7.525 433 HG23 VAL 53 HG23 VAL 53 2.021 8.554 7.018 434 HA PRO 54 HA PRO 54 4.864 11.690 12.374 435 HB2 PRO 54 HB2 PRO 54 3.117 13.518 13.273 436 HB3 PRO 54 HB1 PRO 54 4.108 13.836 11.834 437 HG2 PRO 54 HG2 PRO 54 1.250 12.994 12.008 438 HG3 PRO 54 HG1 PRO 54 2.008 14.185 10.937 439 HD2 PRO 54 HD2 PRO 54 1.422 11.561 10.201 440 HD3 PRO 54 HD1 PRO 54 2.634 12.586 9.406 441 H LYS 55 HN LYS 55 4.576 9.604 13.374 442 HA LYS 55 HA LYS 55 2.055 9.082 14.765 443 HB2 LYS 55 HB2 LYS 55 4.589 7.451 14.519 444 HB3 LYS 55 HB1 LYS 55 3.121 6.921 15.341 445 HG2 LYS 55 HG2 LYS 55 1.912 7.436 13.115 446 HG3 LYS 55 HG1 LYS 55 3.523 7.476 12.399 447 HD2 LYS 55 HD2 LYS 55 2.349 5.150 13.953 448 HD3 LYS 55 HD1 LYS 55 2.518 5.228 12.199 449 HE2 LYS 55 HE2 LYS 55 5.020 5.632 12.620 450 HE3 LYS 55 HE1 LYS 55 4.708 5.123 14.279 451 HZ1 LYS 55 HZ1 LYS 55 5.068 3.522 12.009 452 HZ2 LYS 55 HZ2 LYS 55 4.790 3.031 13.611 453 HZ3 LYS 55 HZ3 LYS 55 3.480 3.292 12.567 454 HA PRO 56 HA PRO 56 3.754 11.335 18.345 455 HB2 PRO 56 HB2 PRO 56 1.605 9.684 19.641 456 HB3 PRO 56 HB1 PRO 56 1.991 11.404 19.861 457 HG2 PRO 56 HG2 PRO 56 -0.077 10.643 18.373 458 HG3 PRO 56 HG1 PRO 56 0.928 12.028 17.913 459 HD2 PRO 56 HD2 PRO 56 0.815 9.308 16.697 460 HD3 PRO 56 HD1 PRO 56 1.232 10.865 15.947 461 H ASN 57 HN ASN 57 3.208 7.882 18.053 462 HA ASN 57 HA ASN 57 4.717 7.148 20.390 463 HB2 ASN 57 HB2 ASN 57 2.948 5.698 19.450 464 HB3 ASN 57 HB1 ASN 57 3.920 5.477 17.995 465 HD21 ASN 57 HD21 ASN 57 4.477 5.264 21.566 466 HD22 ASN 57 HD22 ASN 57 5.350 3.810 21.479 467 H GLY 58 HN GLY 58 5.439 7.849 17.071 468 HA2 GLY 58 HA2 GLY 58 8.156 8.207 17.378 469 HA3 GLY 58 HA1 GLY 58 7.963 6.513 16.941 470 H CYS 59 HN CYS 59 8.154 9.694 15.784 471 HA CYS 59 HA CYS 59 6.677 9.708 13.441 472 HB2 CYS 59 HB2 CYS 59 9.480 10.805 13.532 473 HB3 CYS 59 HB1 CYS 59 8.058 11.466 12.722 474 H ARG 60 HN ARG 60 6.984 8.962 11.360 475 HA ARG 60 HA ARG 60 9.301 7.180 10.884 476 HB2 ARG 60 HB2 ARG 60 7.246 5.873 11.470 477 HB3 ARG 60 HB1 ARG 60 6.456 6.572 10.056 478 HG2 ARG 60 HG2 ARG 60 8.246 5.641 8.611 479 HG3 ARG 60 HG1 ARG 60 8.989 4.903 10.031 480 HD2 ARG 60 HD2 ARG 60 6.883 3.643 10.440 481 HD3 ARG 60 HD1 ARG 60 6.211 4.329 8.963 482 HE ARG 60 HE ARG 60 8.202 2.222 9.147 483 HH11 ARG 60 HH21 ARG 60 6.733 4.704 7.234 484 HH12 ARG 60 HH22 ARG 60 7.175 3.989 5.719 485 HH21 ARG 60 HH11 ARG 60 8.785 1.280 7.164 486 HH22 ARG 60 HH12 ARG 60 8.337 2.051 5.679 487 H LYS 61 HN LYS 61 10.412 7.938 9.227 488 HA LYS 61 HA LYS 61 8.964 8.968 6.862 489 HB2 LYS 61 HB2 LYS 61 10.691 10.706 6.593 490 HB3 LYS 61 HB1 LYS 61 9.826 10.901 8.117 491 HG2 LYS 61 HG2 LYS 61 11.688 9.556 9.211 492 HG3 LYS 61 HG1 LYS 61 12.580 9.717 7.698 493 HD2 LYS 61 HD2 LYS 61 12.278 12.220 7.890 494 HD3 LYS 61 HD1 LYS 61 11.628 11.951 9.508 495 HE2 LYS 61 HE2 LYS 61 14.015 12.464 9.660 496 HE3 LYS 61 HE1 LYS 61 13.737 10.787 10.133 497 HZ1 LYS 61 HZ1 LYS 61 15.625 11.101 8.585 498 HZ2 LYS 61 HZ2 LYS 61 14.434 10.044 7.994 499 HZ3 LYS 61 HZ3 LYS 61 14.528 11.631 7.401 500 H TRP 62 HN TRP 62 9.645 8.081 4.984 501 HA TRP 62 HA TRP 62 12.362 7.128 4.663 502 HB2 TRP 62 HB2 TRP 62 11.977 4.826 4.557 503 HB3 TRP 62 HB1 TRP 62 11.000 5.317 5.939 504 HD1 TRP 62 HD1 TRP 62 8.454 6.419 4.668 505 HE1 TRP 62 HE1 TRP 62 6.863 4.933 3.288 506 HE3 TRP 62 HE3 TRP 62 11.649 2.642 3.404 507 HZ2 TRP 62 HZ2 TRP 62 6.939 2.475 1.841 508 HZ3 TRP 62 HZ3 TRP 62 10.861 0.739 2.025 509 HH2 TRP 62 HH2 TRP 62 8.509 0.649 1.244 510 H GLU 63 HN GLU 63 12.467 5.803 2.527 511 HA GLU 63 HA GLU 63 10.810 7.184 0.492 512 HB2 GLU 63 HB2 GLU 63 13.266 7.829 0.605 513 HB3 GLU 63 HB1 GLU 63 13.633 6.180 0.100 514 HG2 GLU 63 HG2 GLU 63 12.435 6.467 -1.970 515 HG3 GLU 63 HG1 GLU 63 11.786 8.018 -1.445 516 H THR 64 HN THR 64 10.546 5.964 -1.540 517 HA THR 64 HA THR 64 10.971 3.088 -1.436 518 HB THR 64 HB THR 64 8.134 3.926 -1.921 519 HG1 THR 64 HG1 THR 64 9.509 3.916 0.500 520 HG21 THR 64 HG21 THR 64 9.447 1.462 -0.739 521 HG22 THR 64 HG22 THR 64 7.718 1.660 -1.024 522 HG23 THR 64 HG23 THR 64 8.837 1.620 -2.386 523 H THR 65 HN THR 65 10.938 2.126 -3.442 524 HA THR 65 HA THR 65 10.695 3.975 -5.737 525 HB THR 65 HB THR 65 12.107 1.300 -5.618 526 HG1 THR 65 HG1 THR 65 13.870 3.129 -5.827 527 HG21 THR 65 HG21 THR 65 12.004 3.558 -7.628 528 HG22 THR 65 HG22 THR 65 13.239 2.300 -7.663 529 HG23 THR 65 HG23 THR 65 11.540 1.874 -7.874 530 H PHE 66 HN PHE 66 9.343 3.533 -7.407 531 HA PHE 66 HA PHE 66 7.552 1.171 -7.180 532 HB2 PHE 66 HB2 PHE 66 7.176 3.989 -8.182 533 HB3 PHE 66 HB1 PHE 66 6.078 2.733 -8.643 534 HD1 PHE 66 HD2 PHE 66 7.162 2.040 -5.292 535 HD2 PHE 66 HD1 PHE 66 4.580 4.609 -7.580 536 HE1 PHE 66 HE2 PHE 66 5.822 2.490 -3.276 537 HE2 PHE 66 HE1 PHE 66 3.248 5.060 -5.547 538 HZ PHE 66 HZ PHE 66 3.861 4.000 -3.398 539 H LYS 67 HN LYS 67 7.931 -0.347 -8.760 540 HA LYS 67 HA LYS 67 9.136 0.606 -11.302 541 HB2 LYS 67 HB2 LYS 67 9.575 -2.078 -9.993 542 HB3 LYS 67 HB1 LYS 67 10.418 -1.413 -11.392 543 HG2 LYS 67 HG2 LYS 67 11.116 0.517 -9.832 544 HG3 LYS 67 HG1 LYS 67 10.588 -0.524 -8.510 545 HD2 LYS 67 HD2 LYS 67 12.095 -2.326 -9.458 546 HD3 LYS 67 HD1 LYS 67 12.740 -1.108 -10.557 547 HE2 LYS 67 HE2 LYS 67 13.544 0.233 -8.723 548 HE3 LYS 67 HE1 LYS 67 12.705 -0.779 -7.547 549 HZ1 LYS 67 HZ1 LYS 67 14.129 -2.587 -8.021 550 HZ2 LYS 67 HZ2 LYS 67 14.807 -1.804 -9.367 551 HZ3 LYS 67 HZ3 LYS 67 15.133 -1.233 -7.805 552 H LYS 68 HN LYS 68 8.727 -0.554 -13.189 553 HA LYS 68 HA LYS 68 7.344 -1.522 -14.766 554 HB2 LYS 68 HB2 LYS 68 7.979 -3.565 -13.386 555 HB3 LYS 68 HB1 LYS 68 6.447 -3.360 -12.538 556 HG2 LYS 68 HG2 LYS 68 5.249 -3.487 -14.711 557 HG3 LYS 68 HG1 LYS 68 6.790 -3.765 -15.523 558 HD2 LYS 68 HD2 LYS 68 7.128 -5.788 -14.098 559 HD3 LYS 68 HD1 LYS 68 5.523 -5.536 -13.413 560 HE2 LYS 68 HE2 LYS 68 5.306 -7.149 -15.196 561 HE3 LYS 68 HE1 LYS 68 4.597 -5.634 -15.758 562 HZ1 LYS 68 HZ1 LYS 68 7.373 -6.524 -16.329 563 HZ2 LYS 68 HZ2 LYS 68 6.068 -6.663 -17.409 564 HZ3 LYS 68 HZ3 LYS 68 6.614 -5.129 -16.935 565 H THR 69 HN THR 69 6.392 0.700 -14.018 566 HA THR 69 HA THR 69 3.676 0.350 -13.031 567 HB THR 69 HB THR 69 3.867 2.642 -12.390 568 HG1 THR 69 HG1 THR 69 5.326 3.958 -13.205 569 HG21 THR 69 HG21 THR 69 5.331 0.657 -11.286 570 HG22 THR 69 HG22 THR 69 6.638 1.722 -11.794 571 HG23 THR 69 HG23 THR 69 5.404 2.314 -10.693 572 H SER 70 HN SER 70 3.078 -0.485 -15.201 573 HA SER 70 HA SER 70 1.933 1.640 -16.790 574 HB2 SER 70 HB2 SER 70 4.122 -0.114 -17.907 575 HB3 SER 70 HB1 SER 70 2.957 0.723 -18.930 576 HG SER 70 HG SER 70 4.707 2.063 -18.680 577 H ASP 71 HN ASP 71 1.636 -1.150 -15.306 578 HA ASP 71 HA ASP 71 0.616 -3.071 -16.992 579 HB2 ASP 71 HB2 ASP 71 0.068 -2.278 -14.159 580 HB3 ASP 71 HB1 ASP 71 -0.943 -3.509 -14.902 581 H ASP 72 HN ASP 72 -1.693 -1.313 -14.990 582 HA ASP 72 HA ASP 72 -3.632 -1.399 -17.195 583 HB2 ASP 72 HB2 ASP 72 -3.893 -0.815 -14.243 584 HB3 ASP 72 HB1 ASP 72 -5.229 -0.646 -15.380 585 H GLY 73 HN GLY 73 -2.388 0.274 -18.346 586 HA2 GLY 73 HA2 GLY 73 -2.419 2.446 -19.158 587 HA3 GLY 73 HA1 GLY 73 -3.521 2.878 -17.848 588 H GLU 74 HN GLU 74 -2.691 3.575 -15.850 589 HA GLU 74 HA GLU 74 0.236 3.842 -15.666 590 HB2 GLU 74 HB2 GLU 74 -1.842 5.960 -15.064 591 HB3 GLU 74 HB1 GLU 74 -0.149 6.069 -14.580 592 HG2 GLU 74 HG2 GLU 74 -1.069 5.701 -17.445 593 HG3 GLU 74 HG1 GLU 74 -0.662 7.263 -16.736 594 H VAL 75 HN VAL 75 0.397 2.095 -14.129 595 HA VAL 75 HA VAL 75 -0.734 2.749 -11.506 596 HB VAL 75 HB VAL 75 -0.758 -0.007 -12.762 597 HG11 VAL 75 HG11 VAL 75 -1.400 1.089 -10.028 598 HG12 VAL 75 HG12 VAL 75 -2.255 -0.336 -10.621 599 HG13 VAL 75 HG13 VAL 75 -0.500 -0.361 -10.461 600 HG21 VAL 75 HG21 VAL 75 -3.324 0.434 -12.366 601 HG22 VAL 75 HG22 VAL 75 -2.850 2.131 -12.423 602 HG23 VAL 75 HG23 VAL 75 -2.542 1.083 -13.804 603 H TYR 76 HN TYR 76 0.553 1.930 -9.776 604 HA TYR 76 HA TYR 76 3.333 1.345 -10.645 605 HB2 TYR 76 HB2 TYR 76 3.829 3.032 -9.208 606 HB3 TYR 76 HB1 TYR 76 2.195 3.019 -8.561 607 HD1 TYR 76 HD1 TYR 76 5.216 0.745 -8.484 608 HD2 TYR 76 HD2 TYR 76 2.030 2.575 -6.272 609 HE1 TYR 76 HE1 TYR 76 6.010 -0.347 -6.423 610 HE2 TYR 76 HE2 TYR 76 2.842 1.482 -4.203 611 HH TYR 76 HH TYR 76 4.616 -1.021 -4.030 612 H TYR 77 HN TYR 77 4.554 -0.439 -9.899 613 HA TYR 77 HA TYR 77 3.258 -2.107 -7.888 614 HB2 TYR 77 HB2 TYR 77 2.389 -3.060 -9.910 615 HB3 TYR 77 HB1 TYR 77 3.987 -3.053 -10.654 616 HD1 TYR 77 HD1 TYR 77 1.891 -4.613 -8.017 617 HD2 TYR 77 HD2 TYR 77 5.603 -4.765 -10.174 618 HE1 TYR 77 HE1 TYR 77 2.338 -6.869 -7.089 619 HE2 TYR 77 HE2 TYR 77 6.050 -7.020 -9.246 620 HH TYR 77 HH TYR 77 4.558 -8.262 -6.639 621 H SER 78 HN SER 78 4.674 -2.824 -6.400 622 HA SER 78 HA SER 78 7.549 -2.840 -7.122 623 HB2 SER 78 HB2 SER 78 6.076 -1.954 -4.732 624 HB3 SER 78 HB1 SER 78 7.479 -2.951 -4.375 625 HG SER 78 HG SER 78 8.417 -1.430 -6.138 626 H GLU 79 HN GLU 79 7.928 -4.850 -7.769 627 HA GLU 79 HA GLU 79 6.732 -7.224 -7.017 628 HB2 GLU 79 HB2 GLU 79 8.460 -6.901 -8.836 629 HB3 GLU 79 HB1 GLU 79 9.690 -6.970 -7.575 630 HG2 GLU 79 HG2 GLU 79 8.782 -9.194 -6.876 631 HG3 GLU 79 HG1 GLU 79 7.678 -9.133 -8.248 632 H GLU 80 HN GLU 80 9.221 -5.405 -5.337 633 HA GLU 80 HA GLU 80 9.712 -7.481 -3.380 634 HB2 GLU 80 HB2 GLU 80 10.594 -4.592 -3.504 635 HB3 GLU 80 HB1 GLU 80 11.143 -5.765 -2.306 636 HG2 GLU 80 HG2 GLU 80 12.812 -5.775 -4.005 637 HG3 GLU 80 HG1 GLU 80 11.856 -7.230 -4.279 638 H ALA 81 HN ALA 81 8.031 -4.335 -3.399 639 HA ALA 81 HA ALA 81 7.236 -4.651 -0.619 640 HB1 ALA 81 HB1 ALA 81 6.508 -2.432 -0.714 641 HB2 ALA 81 HB2 ALA 81 6.227 -2.494 -2.454 642 HB3 ALA 81 HB3 ALA 81 7.875 -2.450 -1.828 643 H LYS 82 HN LYS 82 6.089 -6.094 -3.287 644 HA LYS 82 HA LYS 82 3.949 -6.630 -4.100 645 HB2 LYS 82 HB2 LYS 82 3.909 -7.453 -1.188 646 HB3 LYS 82 HB1 LYS 82 2.821 -8.076 -2.428 647 HG2 LYS 82 HG2 LYS 82 4.813 -8.852 -3.723 648 HG3 LYS 82 HG1 LYS 82 5.841 -8.338 -2.384 649 HD2 LYS 82 HD2 LYS 82 4.593 -9.862 -0.870 650 HD3 LYS 82 HD1 LYS 82 3.634 -10.414 -2.244 651 HE2 LYS 82 HE2 LYS 82 5.733 -11.141 -3.375 652 HE3 LYS 82 HE1 LYS 82 6.638 -10.677 -1.935 653 HZ1 LYS 82 HZ1 LYS 82 5.853 -12.420 -0.758 654 HZ2 LYS 82 HZ2 LYS 82 4.348 -12.437 -1.546 655 HZ3 LYS 82 HZ3 LYS 82 5.708 -13.114 -2.302 656 H LYS 83 HN LYS 83 3.681 -4.110 -3.995 657 HA LYS 83 HA LYS 83 0.965 -3.673 -3.070 658 HB2 LYS 83 HB2 LYS 83 2.457 -3.049 -1.113 659 HB3 LYS 83 HB1 LYS 83 3.105 -1.760 -2.128 660 HG2 LYS 83 HG2 LYS 83 0.584 -1.131 -2.499 661 HG3 LYS 83 HG1 LYS 83 0.312 -2.088 -1.044 662 HD2 LYS 83 HD2 LYS 83 2.311 0.186 -1.199 663 HD3 LYS 83 HD1 LYS 83 0.657 0.376 -0.620 664 HE2 LYS 83 HE2 LYS 83 2.769 -1.448 0.561 665 HE3 LYS 83 HE1 LYS 83 2.138 0.031 1.283 666 HZ1 LYS 83 HZ1 LYS 83 0.628 -1.258 2.241 667 HZ2 LYS 83 HZ2 LYS 83 -0.082 -1.445 0.709 668 HZ3 LYS 83 HZ3 LYS 83 1.026 -2.597 1.276 669 H LYS 84 HN LYS 84 -0.098 -2.410 -4.464 670 HA LYS 84 HA LYS 84 1.454 -0.668 -6.279 671 HB2 LYS 84 HB2 LYS 84 -0.343 -1.394 -8.025 672 HB3 LYS 84 HB1 LYS 84 0.998 -2.485 -7.692 673 HG2 LYS 84 HG2 LYS 84 -0.403 -3.742 -6.102 674 HG3 LYS 84 HG1 LYS 84 -1.744 -2.645 -6.422 675 HD2 LYS 84 HD2 LYS 84 -1.893 -3.355 -8.711 676 HD3 LYS 84 HD1 LYS 84 -0.380 -4.254 -8.589 677 HE2 LYS 84 HE2 LYS 84 -2.545 -5.628 -8.433 678 HE3 LYS 84 HE1 LYS 84 -1.346 -5.897 -7.168 679 HZ1 LYS 84 HZ1 LYS 84 -2.696 -5.073 -5.619 680 HZ2 LYS 84 HZ2 LYS 84 -3.167 -3.756 -6.581 681 HZ3 LYS 84 HZ3 LYS 84 -3.942 -5.254 -6.758 682 H VAL 85 HN VAL 85 0.452 1.158 -7.044 683 HA VAL 85 HA VAL 85 -2.204 1.758 -5.944 684 HB VAL 85 HB VAL 85 -1.642 3.727 -4.943 685 HG11 VAL 85 HG11 VAL 85 0.661 1.851 -4.563 686 HG12 VAL 85 HG12 VAL 85 0.496 3.324 -3.617 687 HG13 VAL 85 HG13 VAL 85 -0.751 2.081 -3.541 688 HG21 VAL 85 HG21 VAL 85 -0.377 5.267 -6.081 689 HG22 VAL 85 HG22 VAL 85 1.028 4.478 -5.389 690 HG23 VAL 85 HG23 VAL 85 0.457 4.019 -6.983 691 H GLU 86 HN GLU 86 -3.543 2.649 -7.307 692 HA GLU 86 HA GLU 86 -2.478 3.545 -9.929 693 HB2 GLU 86 HB2 GLU 86 -3.625 1.512 -10.308 694 HB3 GLU 86 HB1 GLU 86 -4.919 1.935 -9.195 695 HG2 GLU 86 HG2 GLU 86 -5.894 3.453 -10.698 696 HG3 GLU 86 HG1 GLU 86 -4.413 3.633 -11.634 697 H VAL 87 HN VAL 87 -2.969 5.473 -10.600 698 HA VAL 87 HA VAL 87 -4.248 7.408 -9.024 699 HB VAL 87 HB VAL 87 -2.783 8.116 -10.792 700 HG11 VAL 87 HG11 VAL 87 -3.029 7.585 -13.066 701 HG12 VAL 87 HG12 VAL 87 -3.483 6.081 -12.271 702 HG13 VAL 87 HG13 VAL 87 -4.731 7.164 -12.889 703 HG21 VAL 87 HG21 VAL 87 -4.926 9.459 -10.220 704 HG22 VAL 87 HG22 VAL 87 -4.063 9.885 -11.697 705 HG23 VAL 87 HG23 VAL 87 -5.525 8.903 -11.782 706 H LEU 88 HN LEU 88 -6.256 6.997 -8.275 707 HA LEU 88 HA LEU 88 -8.345 6.031 -10.086 708 HB2 LEU 88 HB2 LEU 88 -7.791 5.373 -7.528 709 HB3 LEU 88 HB1 LEU 88 -8.939 6.670 -7.233 710 HG LEU 88 HG LEU 88 -10.135 4.558 -7.325 711 HD11 LEU 88 HD11 LEU 88 -11.817 5.147 -8.872 712 HD12 LEU 88 HD12 LEU 88 -11.059 6.678 -8.437 713 HD13 LEU 88 HD13 LEU 88 -10.666 5.899 -9.973 714 HD21 LEU 88 HD21 LEU 88 -8.232 3.667 -9.038 715 HD22 LEU 88 HD22 LEU 88 -9.818 2.914 -8.898 716 HD23 LEU 88 HD23 LEU 88 -9.499 4.058 -10.200 717 H ASP 89 HN ASP 89 -7.224 8.971 -8.692 718 HA ASP 89 HA ASP 89 -8.858 10.627 -10.184 719 HB2 ASP 89 HB2 ASP 89 -10.417 9.593 -8.165 720 HB3 ASP 89 HB1 ASP 89 -9.768 11.033 -7.396 721 H THR 90 HN THR 90 -7.627 12.409 -10.324 722 HA THR 90 HA THR 90 -6.328 13.499 -7.954 723 HB THR 90 HB THR 90 -4.975 11.638 -9.453 724 HG1 THR 90 HG1 THR 90 -3.188 12.311 -8.312 725 HG21 THR 90 HG21 THR 90 -3.977 14.363 -10.330 726 HG22 THR 90 HG22 THR 90 -3.259 12.807 -10.732 727 HG23 THR 90 HG23 THR 90 -4.847 13.229 -11.363 728 H ASP 91 HN ASP 91 -6.287 15.652 -8.034 729 HA ASP 91 HA ASP 91 -6.423 17.003 -10.679 730 HB2 ASP 91 HB2 ASP 91 -8.732 16.818 -9.736 731 HB3 ASP 91 HB1 ASP 91 -8.189 17.731 -8.329 732 H TYR 92 HN TYR 92 -5.405 16.815 -7.467 733 HA TYR 92 HA TYR 92 -4.013 18.034 -6.136 734 HB2 TYR 92 HB2 TYR 92 -2.946 19.247 -8.679 735 HB3 TYR 92 HB1 TYR 92 -2.085 18.946 -7.174 736 HD1 TYR 92 HD2 TYR 92 -2.847 16.169 -6.508 737 HD2 TYR 92 HD1 TYR 92 -1.917 17.937 -10.317 738 HE1 TYR 92 HE2 TYR 92 -2.130 13.962 -7.361 739 HE2 TYR 92 HE1 TYR 92 -1.207 15.721 -11.166 740 HH TYR 92 HH TYR 92 -0.282 13.386 -9.647 741 H LYS 93 HN LYS 93 -6.419 19.437 -7.852 742 HA LYS 93 HA LYS 93 -5.806 22.212 -7.469 743 HB2 LYS 93 HB2 LYS 93 -7.392 21.330 -9.210 744 HB3 LYS 93 HB1 LYS 93 -8.519 20.944 -7.909 745 HG2 LYS 93 HG2 LYS 93 -8.619 23.284 -7.239 746 HG3 LYS 93 HG1 LYS 93 -7.390 23.709 -8.430 747 HD2 LYS 93 HD2 LYS 93 -9.574 24.265 -9.342 748 HD3 LYS 93 HD1 LYS 93 -8.919 22.893 -10.235 749 HE2 LYS 93 HE2 LYS 93 -10.388 21.368 -9.230 750 HE3 LYS 93 HE1 LYS 93 -10.690 22.418 -7.845 751 HZ1 LYS 93 HZ1 LYS 93 -12.298 22.178 -10.000 752 HZ2 LYS 93 HZ2 LYS 93 -12.304 23.488 -8.919 753 HZ3 LYS 93 HZ3 LYS 93 -11.425 23.589 -10.365 754 H SER 94 HN SER 94 -7.582 19.740 -5.744 755 HA SER 94 HA SER 94 -7.441 21.292 -3.298 756 HB2 SER 94 HB2 SER 94 -9.922 20.974 -2.895 757 HB3 SER 94 HB1 SER 94 -9.508 22.177 -4.112 758 HG SER 94 HG SER 94 -9.641 20.017 -5.467 759 H TYR 95 HN TYR 95 -7.958 18.352 -5.074 760 HA TYR 95 HA TYR 95 -7.127 16.776 -2.850 761 HB2 TYR 95 HB2 TYR 95 -9.235 15.462 -2.639 762 HB3 TYR 95 HB1 TYR 95 -9.379 17.129 -2.079 763 HD1 TYR 95 HD1 TYR 95 -10.180 14.791 -4.837 764 HD2 TYR 95 HD2 TYR 95 -10.759 18.734 -3.235 765 HE1 TYR 95 HE1 TYR 95 -12.011 15.184 -6.464 766 HE2 TYR 95 HE2 TYR 95 -12.590 19.125 -4.860 767 HH TYR 95 HH TYR 95 -13.657 18.333 -6.651 768 H ALA 96 HN ALA 96 -7.302 14.446 -3.273 769 HA ALA 96 HA ALA 96 -7.598 13.619 -6.047 770 HB1 ALA 96 HB1 ALA 96 -5.263 14.317 -6.038 771 HB2 ALA 96 HB2 ALA 96 -5.339 12.555 -6.072 772 HB3 ALA 96 HB3 ALA 96 -4.961 13.391 -4.571 773 H VAL 97 HN VAL 97 -8.178 11.490 -6.203 774 HA VAL 97 HA VAL 97 -8.262 9.957 -3.643 775 HB VAL 97 HB VAL 97 -10.265 9.502 -5.845 776 HG11 VAL 97 HG11 VAL 97 -9.897 7.982 -3.807 777 HG12 VAL 97 HG12 VAL 97 -10.589 9.292 -2.852 778 HG13 VAL 97 HG13 VAL 97 -11.548 8.518 -4.114 779 HG21 VAL 97 HG21 VAL 97 -10.369 11.921 -5.339 780 HG22 VAL 97 HG22 VAL 97 -11.786 11.089 -4.703 781 HG23 VAL 97 HG23 VAL 97 -10.478 11.555 -3.617 782 H ILE 98 HN ILE 98 -7.216 8.026 -3.687 783 HA ILE 98 HA ILE 98 -6.519 6.925 -6.335 784 HB ILE 98 HB ILE 98 -4.687 8.157 -5.293 785 HG12 ILE 98 HG12 ILE 98 -4.245 5.175 -4.998 786 HG13 ILE 98 HG11 ILE 98 -4.217 6.034 -6.541 787 HG21 ILE 98 HG21 ILE 98 -4.990 6.204 -2.998 788 HG22 ILE 98 HG22 ILE 98 -3.819 7.515 -3.122 789 HG23 ILE 98 HG23 ILE 98 -5.536 7.880 -2.952 790 HD11 ILE 98 HD11 ILE 98 -2.561 7.431 -4.614 791 HD12 ILE 98 HD12 ILE 98 -2.083 5.753 -4.713 792 HD13 ILE 98 HD13 ILE 98 -2.115 6.729 -6.174 793 H TYR 99 HN TYR 99 -6.363 4.727 -6.494 794 HA TYR 99 HA TYR 99 -7.708 3.169 -4.387 795 HB2 TYR 99 HB2 TYR 99 -8.520 2.975 -6.723 796 HB3 TYR 99 HB1 TYR 99 -6.934 2.379 -7.208 797 HD1 TYR 99 HD1 TYR 99 -9.872 1.664 -5.037 798 HD2 TYR 99 HD2 TYR 99 -6.300 0.109 -6.847 799 HE1 TYR 99 HE1 TYR 99 -10.532 -0.631 -4.368 800 HE2 TYR 99 HE2 TYR 99 -6.960 -2.186 -6.178 801 HH TYR 99 HH TYR 99 -8.364 -3.376 -4.842 802 H ALA 100 HN ALA 100 -6.311 2.534 -2.870 803 HA ALA 100 HA ALA 100 -3.662 1.486 -3.675 804 HB1 ALA 100 HB1 ALA 100 -3.200 1.711 -1.171 805 HB2 ALA 100 HB2 ALA 100 -4.717 2.605 -1.079 806 HB3 ALA 100 HB3 ALA 100 -3.394 3.213 -2.073 807 H THR 101 HN THR 101 -3.134 -0.591 -3.349 808 HA THR 101 HA THR 101 -4.787 -2.267 -1.594 809 HB THR 101 HB THR 101 -5.958 -2.812 -3.516 810 HG1 THR 101 HG1 THR 101 -4.576 -4.667 -4.474 811 HG21 THR 101 HG21 THR 101 -3.383 -2.149 -4.916 812 HG22 THR 101 HG22 THR 101 -4.627 -3.085 -5.743 813 HG23 THR 101 HG23 THR 101 -4.985 -1.460 -5.160 814 H ARG 102 HN ARG 102 -3.666 -3.757 -0.546 815 HA ARG 102 HA ARG 102 -0.875 -4.312 -1.379 816 HB2 ARG 102 HB2 ARG 102 -1.113 -2.945 0.728 817 HB3 ARG 102 HB1 ARG 102 -1.944 -4.324 1.448 818 HG2 ARG 102 HG2 ARG 102 0.101 -5.719 0.798 819 HG3 ARG 102 HG1 ARG 102 0.915 -4.190 0.469 820 HD2 ARG 102 HD2 ARG 102 0.506 -3.450 2.771 821 HD3 ARG 102 HD1 ARG 102 -0.376 -4.937 3.108 822 HE ARG 102 HE ARG 102 1.662 -6.070 3.253 823 HH11 ARG 102 HH21 ARG 102 2.052 -2.883 1.961 824 HH12 ARG 102 HH22 ARG 102 3.780 -2.906 2.060 825 HH21 ARG 102 HH11 ARG 102 3.928 -6.106 3.387 826 HH22 ARG 102 HH12 ARG 102 4.843 -4.730 2.868 827 H VAL 103 HN VAL 103 -0.440 -6.511 -1.780 828 HA VAL 103 HA VAL 103 -2.466 -8.407 -0.750 829 HB VAL 103 HB VAL 103 -2.583 -8.138 -3.183 830 HG11 VAL 103 HG11 VAL 103 -0.050 -7.498 -3.263 831 HG12 VAL 103 HG12 VAL 103 0.215 -9.236 -3.404 832 HG13 VAL 103 HG13 VAL 103 -0.744 -8.388 -4.617 833 HG21 VAL 103 HG21 VAL 103 -2.953 -10.382 -2.152 834 HG22 VAL 103 HG22 VAL 103 -2.316 -10.489 -3.791 835 HG23 VAL 103 HG23 VAL 103 -1.250 -10.755 -2.413 836 H LYS 104 HN LYS 104 -1.689 -9.681 0.779 837 HA LYS 104 HA LYS 104 1.192 -10.256 0.878 838 HB2 LYS 104 HB2 LYS 104 -0.257 -9.350 2.878 839 HB3 LYS 104 HB1 LYS 104 -0.787 -11.024 3.012 840 HG2 LYS 104 HG2 LYS 104 1.537 -11.770 3.234 841 HG3 LYS 104 HG1 LYS 104 2.107 -10.115 3.024 842 HD2 LYS 104 HD2 LYS 104 0.728 -9.486 5.052 843 HD3 LYS 104 HD1 LYS 104 0.448 -11.209 5.309 844 HE2 LYS 104 HE2 LYS 104 2.332 -10.673 6.664 845 HE3 LYS 104 HE1 LYS 104 2.994 -11.481 5.244 846 HZ1 LYS 104 HZ1 LYS 104 3.094 -8.646 5.989 847 HZ2 LYS 104 HZ2 LYS 104 4.315 -9.640 5.347 848 HZ3 LYS 104 HZ3 LYS 104 3.085 -9.052 4.339 849 H ASP 105 HN ASP 105 1.665 -12.568 1.669 850 HA ASP 105 HA ASP 105 0.802 -14.377 -0.272 851 HB2 ASP 105 HB2 ASP 105 1.826 -16.115 1.135 852 HB3 ASP 105 HB1 ASP 105 2.860 -14.692 1.024 853 H GLY 106 HN GLY 106 -1.205 -15.011 -0.576 854 HA2 GLY 106 HA2 GLY 106 -3.105 -16.284 -0.168 855 HA3 GLY 106 HA1 GLY 106 -2.627 -16.412 1.518 856 H ARG 107 HN ARG 107 -2.467 -13.178 0.937 857 HA ARG 107 HA ARG 107 -5.353 -12.747 1.478 858 HB2 ARG 107 HB2 ARG 107 -3.083 -11.389 2.940 859 HB3 ARG 107 HB1 ARG 107 -4.808 -11.162 3.226 860 HG2 ARG 107 HG2 ARG 107 -5.007 -13.564 3.819 861 HG3 ARG 107 HG1 ARG 107 -3.267 -13.748 3.594 862 HD2 ARG 107 HD2 ARG 107 -2.986 -11.880 5.310 863 HD3 ARG 107 HD1 ARG 107 -4.700 -12.073 5.662 864 HE ARG 107 HE ARG 107 -2.596 -13.794 6.536 865 HH11 ARG 107 HH21 ARG 107 -5.871 -13.717 5.421 866 HH12 ARG 107 HH22 ARG 107 -6.336 -15.160 6.260 867 HH21 ARG 107 HH11 ARG 107 -3.198 -15.686 7.638 868 HH22 ARG 107 HH12 ARG 107 -4.822 -16.275 7.515 869 H THR 108 HN THR 108 -6.279 -11.015 0.577 870 HA THR 108 HA THR 108 -4.586 -9.163 -1.007 871 HB THR 108 HB THR 108 -7.418 -10.043 -1.615 872 HG1 THR 108 HG1 THR 108 -6.185 -11.017 -3.443 873 HG21 THR 108 HG21 THR 108 -6.867 -8.965 -3.826 874 HG22 THR 108 HG22 THR 108 -6.964 -7.836 -2.475 875 HG23 THR 108 HG23 THR 108 -5.391 -8.346 -3.087 876 H LEU 109 HN LEU 109 -5.265 -6.931 -1.036 877 HA LEU 109 HA LEU 109 -7.452 -6.201 0.780 878 HB2 LEU 109 HB2 LEU 109 -5.435 -6.320 2.172 879 HB3 LEU 109 HB1 LEU 109 -4.636 -5.171 1.125 880 HG LEU 109 HG LEU 109 -6.394 -3.500 1.659 881 HD11 LEU 109 HD11 LEU 109 -8.335 -4.666 2.246 882 HD12 LEU 109 HD12 LEU 109 -7.460 -5.822 3.250 883 HD13 LEU 109 HD13 LEU 109 -7.736 -4.178 3.828 884 HD21 LEU 109 HD21 LEU 109 -5.530 -2.952 3.807 885 HD22 LEU 109 HD22 LEU 109 -5.234 -4.646 4.200 886 HD23 LEU 109 HD23 LEU 109 -4.236 -3.832 2.995 887 H HIS 110 HN HIS 110 -8.272 -4.201 0.509 888 HA HIS 110 HA HIS 110 -7.087 -2.465 -1.518 889 HB2 HIS 110 HB2 HIS 110 -9.265 -2.120 -2.618 890 HB3 HIS 110 HB1 HIS 110 -8.782 -3.815 -2.707 891 HD1 HIS 110 HD1 HIS 110 -9.610 -4.918 -0.040 892 HD2 HIS 110 HD2 HIS 110 -11.984 -2.203 -2.132 893 HE1 HIS 110 HE1 HIS 110 -11.969 -5.208 0.833 894 H MET 111 HN MET 111 -7.509 -0.232 -1.192 895 HA MET 111 HA MET 111 -9.387 0.584 0.845 896 HB2 MET 111 HB2 MET 111 -7.408 1.836 2.037 897 HB3 MET 111 HB1 MET 111 -7.741 0.151 2.434 898 HG2 MET 111 HG2 MET 111 -6.003 -0.595 0.885 899 HG3 MET 111 HG1 MET 111 -5.705 1.070 0.386 900 HE1 MET 111 HE1 MET 111 -5.327 2.921 2.007 901 HE2 MET 111 HE2 MET 111 -4.009 2.805 3.171 902 HE3 MET 111 HE3 MET 111 -3.725 2.429 1.465 903 H MET 112 HN MET 112 -9.768 2.838 0.813 904 HA MET 112 HA MET 112 -8.718 4.206 -1.593 905 HB2 MET 112 HB2 MET 112 -11.211 3.861 -1.348 906 HB3 MET 112 HB1 MET 112 -11.151 4.936 0.044 907 HG2 MET 112 HG2 MET 112 -11.722 6.351 -1.759 908 HG3 MET 112 HG1 MET 112 -9.998 6.621 -1.517 909 HE1 MET 112 HE1 MET 112 -12.207 4.583 -4.903 910 HE2 MET 112 HE2 MET 112 -12.746 4.883 -3.253 911 HE3 MET 112 HE3 MET 112 -12.481 6.237 -4.360 912 H ARG 113 HN ARG 113 -7.791 6.245 -1.433 913 HA ARG 113 HA ARG 113 -7.438 7.345 1.289 914 HB2 ARG 113 HB2 ARG 113 -5.331 6.938 -0.822 915 HB3 ARG 113 HB1 ARG 113 -5.117 7.997 0.571 916 HG2 ARG 113 HG2 ARG 113 -5.605 6.078 2.075 917 HG3 ARG 113 HG1 ARG 113 -5.718 5.027 0.662 918 HD2 ARG 113 HD2 ARG 113 -3.426 5.263 0.154 919 HD3 ARG 113 HD1 ARG 113 -3.259 6.704 1.155 920 HE ARG 113 HE ARG 113 -3.013 3.991 2.036 921 HH11 ARG 113 HH21 ARG 113 -4.097 7.158 2.918 922 HH12 ARG 113 HH22 ARG 113 -3.856 6.918 4.616 923 HH21 ARG 113 HH11 ARG 113 -2.695 3.670 4.264 924 HH22 ARG 113 HH12 ARG 113 -3.063 4.944 5.378 925 H LEU 114 HN LEU 114 -7.828 9.454 1.501 926 HA LEU 114 HA LEU 114 -8.261 11.044 -0.946 927 HB2 LEU 114 HB2 LEU 114 -10.293 10.914 0.264 928 HB3 LEU 114 HB1 LEU 114 -9.486 11.144 1.805 929 HG LEU 114 HG LEU 114 -8.858 13.479 1.042 930 HD11 LEU 114 HD11 LEU 114 -10.358 14.316 -0.875 931 HD12 LEU 114 HD12 LEU 114 -8.963 13.334 -1.320 932 HD13 LEU 114 HD13 LEU 114 -10.573 12.617 -1.289 933 HD21 LEU 114 HD21 LEU 114 -10.663 13.537 2.495 934 HD22 LEU 114 HD22 LEU 114 -11.387 14.250 1.059 935 HD23 LEU 114 HD23 LEU 114 -11.683 12.556 1.447 936 H TYR 115 HN TYR 115 -6.941 12.601 -1.366 937 HA TYR 115 HA TYR 115 -5.059 13.589 0.676 938 HB2 TYR 115 HB2 TYR 115 -4.969 13.625 -2.343 939 HB3 TYR 115 HB1 TYR 115 -3.778 14.418 -1.321 940 HD1 TYR 115 HD1 TYR 115 -5.471 11.058 -1.552 941 HD2 TYR 115 HD2 TYR 115 -1.816 13.237 -0.944 942 HE1 TYR 115 HE1 TYR 115 -4.234 8.932 -1.338 943 HE2 TYR 115 HE2 TYR 115 -0.584 11.099 -0.738 944 HH TYR 115 HH TYR 115 -0.715 8.895 -0.813 945 H SER 116 HN SER 116 -4.477 15.843 0.604 946 HA SER 116 HA SER 116 -6.493 17.666 -0.556 947 HB2 SER 116 HB2 SER 116 -7.056 17.465 1.814 948 HB3 SER 116 HB1 SER 116 -5.376 17.771 2.266 949 HG SER 116 HG SER 116 -6.337 19.720 2.385 950 H ARG 117 HN ARG 117 -5.561 19.473 -1.524 951 HA ARG 117 HA ARG 117 -2.730 19.455 -1.880 952 HB2 ARG 117 HB2 ARG 117 -4.566 20.334 -3.479 953 HB3 ARG 117 HB1 ARG 117 -4.535 21.793 -2.495 954 HG2 ARG 117 HG2 ARG 117 -3.009 22.142 -4.327 955 HG3 ARG 117 HG1 ARG 117 -2.042 21.905 -2.874 956 HD2 ARG 117 HD2 ARG 117 -2.681 19.436 -4.412 957 HD3 ARG 117 HD1 ARG 117 -1.582 20.568 -5.192 958 HE ARG 117 HE ARG 117 -1.038 18.985 -2.828 959 HH11 ARG 117 HH21 ARG 117 -0.265 21.789 -4.702 960 HH12 ARG 117 HH22 ARG 117 1.352 21.920 -4.094 961 HH21 ARG 117 HH11 ARG 117 1.082 19.149 -2.028 962 HH22 ARG 117 HH12 ARG 117 2.114 20.425 -2.580 963 H SER 118 HN SER 118 -4.803 20.726 0.502 964 HA SER 118 HA SER 118 -2.559 22.200 1.707 965 HB2 SER 118 HB2 SER 118 -3.867 23.923 0.633 966 HB3 SER 118 HB1 SER 118 -5.360 23.265 1.295 967 HG SER 118 HG SER 118 -4.260 25.117 2.413 968 HA PRO 119 HA PRO 119 -3.393 19.995 5.454 969 HB2 PRO 119 HB2 PRO 119 -3.687 22.758 6.603 970 HB3 PRO 119 HB1 PRO 119 -2.796 21.364 7.248 971 HG2 PRO 119 HG2 PRO 119 -1.570 23.375 5.949 972 HG3 PRO 119 HG1 PRO 119 -1.001 21.700 5.864 973 HD2 PRO 119 HD2 PRO 119 -2.251 23.332 3.752 974 HD3 PRO 119 HD1 PRO 119 -1.346 21.810 3.606 975 H GLU 120 HN GLU 120 -5.524 22.516 4.302 976 HA GLU 120 HA GLU 120 -7.706 21.769 6.064 977 HB2 GLU 120 HB2 GLU 120 -7.771 23.649 3.702 978 HB3 GLU 120 HB1 GLU 120 -8.904 23.576 5.052 979 HG2 GLU 120 HG2 GLU 120 -5.964 24.284 5.287 980 HG3 GLU 120 HG1 GLU 120 -7.289 25.447 5.300 981 H VAL 121 HN VAL 121 -9.777 21.189 5.191 982 HA VAL 121 HA VAL 121 -9.596 19.529 2.739 983 HB VAL 121 HB VAL 121 -11.534 18.250 3.899 984 HG11 VAL 121 HG11 VAL 121 -8.683 18.160 4.926 985 HG12 VAL 121 HG12 VAL 121 -9.877 16.888 5.188 986 HG13 VAL 121 HG13 VAL 121 -9.336 17.266 3.553 987 HG21 VAL 121 HG21 VAL 121 -11.637 18.408 6.291 988 HG22 VAL 121 HG22 VAL 121 -10.220 19.457 6.346 989 HG23 VAL 121 HG23 VAL 121 -11.738 20.061 5.683 990 H SER 122 HN SER 122 -11.074 19.850 1.183 991 HA SER 122 HA SER 122 -12.992 22.032 1.566 992 HB2 SER 122 HB2 SER 122 -11.739 22.354 -0.394 993 HB3 SER 122 HB1 SER 122 -11.834 20.654 -0.842 994 HG SER 122 HG SER 122 -13.573 21.149 -1.892 995 HA PRO 123 HA PRO 123 -16.506 19.351 2.248 996 HB2 PRO 123 HB2 PRO 123 -17.756 21.182 0.218 997 HB3 PRO 123 HB1 PRO 123 -18.405 20.614 1.769 998 HG2 PRO 123 HG2 PRO 123 -17.363 23.064 1.487 999 HG3 PRO 123 HG1 PRO 123 -17.197 22.136 2.988 1000 HD2 PRO 123 HD2 PRO 123 -15.125 22.803 0.976 1001 HD3 PRO 123 HD1 PRO 123 -14.934 22.326 2.678 1002 H ALA 124 HN ALA 124 -15.409 20.226 -0.980 1003 HA ALA 124 HA ALA 124 -16.848 18.129 -2.332 1004 HB1 ALA 124 HB1 ALA 124 -15.640 18.823 -4.297 1005 HB2 ALA 124 HB2 ALA 124 -14.459 19.696 -3.321 1006 HB3 ALA 124 HB3 ALA 124 -16.122 20.274 -3.419 1007 H ALA 125 HN ALA 125 -13.674 18.535 -0.917 1008 HA ALA 125 HA ALA 125 -12.431 16.259 -2.075 1009 HB1 ALA 125 HB1 ALA 125 -11.836 17.642 0.550 1010 HB2 ALA 125 HB2 ALA 125 -11.183 18.112 -1.018 1011 HB3 ALA 125 HB3 ALA 125 -10.755 16.552 -0.316 1012 H THR 126 HN THR 126 -14.013 16.790 1.043 1013 HA THR 126 HA THR 126 -13.690 14.067 1.906 1014 HB THR 126 HB THR 126 -15.809 15.766 3.143 1015 HG1 THR 126 HG1 THR 126 -14.493 17.400 3.103 1016 HG21 THR 126 HG21 THR 126 -13.453 14.532 4.544 1017 HG22 THR 126 HG22 THR 126 -15.107 14.734 5.118 1018 HG23 THR 126 HG23 THR 126 -14.731 13.477 3.938 1019 H ALA 127 HN ALA 127 -16.175 15.891 0.223 1020 HA ALA 127 HA ALA 127 -18.253 13.963 0.534 1021 HB1 ALA 127 HB1 ALA 127 -19.349 15.339 -1.220 1022 HB2 ALA 127 HB2 ALA 127 -17.862 16.280 -1.335 1023 HB3 ALA 127 HB3 ALA 127 -18.780 16.260 0.171 1024 H ILE 128 HN ILE 128 -16.143 14.797 -2.264 1025 HA ILE 128 HA ILE 128 -17.291 12.897 -4.015 1026 HB ILE 128 HB ILE 128 -15.555 14.877 -4.390 1027 HG12 ILE 128 HG12 ILE 128 -16.599 13.701 -6.213 1028 HG13 ILE 128 HG11 ILE 128 -14.870 13.780 -6.516 1029 HG21 ILE 128 HG21 ILE 128 -13.777 13.710 -3.018 1030 HG22 ILE 128 HG22 ILE 128 -13.678 12.500 -4.297 1031 HG23 ILE 128 HG23 ILE 128 -13.269 14.180 -4.638 1032 HD11 ILE 128 HD11 ILE 128 -16.516 11.414 -5.653 1033 HD12 ILE 128 HD12 ILE 128 -15.387 11.535 -6.999 1034 HD13 ILE 128 HD13 ILE 128 -14.781 11.453 -5.346 1035 H PHE 129 HN PHE 129 -14.873 12.900 -1.618 1036 HA PHE 129 HA PHE 129 -13.748 10.349 -1.943 1037 HB2 PHE 129 HB2 PHE 129 -12.714 12.048 -0.572 1038 HB3 PHE 129 HB1 PHE 129 -14.105 12.076 0.507 1039 HD1 PHE 129 HD1 PHE 129 -12.186 9.199 -1.018 1040 HD2 PHE 129 HD2 PHE 129 -13.449 11.200 2.570 1041 HE1 PHE 129 HE1 PHE 129 -11.221 7.372 0.337 1042 HE2 PHE 129 HE2 PHE 129 -12.470 9.375 3.922 1043 HZ PHE 129 HZ PHE 129 -11.355 7.463 2.810 1044 H ARG 130 HN ARG 130 -16.443 11.459 0.103 1045 HA ARG 130 HA ARG 130 -16.985 8.897 1.233 1046 HB2 ARG 130 HB2 ARG 130 -18.513 11.487 1.055 1047 HB3 ARG 130 HB1 ARG 130 -19.274 10.037 1.711 1048 HG2 ARG 130 HG2 ARG 130 -17.541 9.830 3.404 1049 HG3 ARG 130 HG1 ARG 130 -16.646 11.177 2.703 1050 HD2 ARG 130 HD2 ARG 130 -18.557 12.679 3.178 1051 HD3 ARG 130 HD1 ARG 130 -19.422 11.331 3.911 1052 HE ARG 130 HE ARG 130 -16.934 11.545 5.190 1053 HH11 ARG 130 HH21 ARG 130 -19.859 13.339 4.740 1054 HH12 ARG 130 HH22 ARG 130 -19.758 14.152 6.266 1055 HH21 ARG 130 HH11 ARG 130 -16.794 12.609 7.193 1056 HH22 ARG 130 HH12 ARG 130 -18.023 13.738 7.654 1057 H LYS 131 HN LYS 131 -18.126 10.608 -1.625 1058 HA LYS 131 HA LYS 131 -20.328 9.038 -2.302 1059 HB2 LYS 131 HB2 LYS 131 -19.599 11.127 -3.481 1060 HB3 LYS 131 HB1 LYS 131 -18.312 10.193 -4.242 1061 HG2 LYS 131 HG2 LYS 131 -20.011 8.661 -5.205 1062 HG3 LYS 131 HG1 LYS 131 -21.286 9.644 -4.482 1063 HD2 LYS 131 HD2 LYS 131 -20.480 11.607 -5.770 1064 HD3 LYS 131 HD1 LYS 131 -19.255 10.590 -6.527 1065 HE2 LYS 131 HE2 LYS 131 -21.082 10.666 -8.067 1066 HE3 LYS 131 HE1 LYS 131 -21.166 9.083 -7.294 1067 HZ1 LYS 131 HZ1 LYS 131 -23.204 10.833 -7.444 1068 HZ2 LYS 131 HZ2 LYS 131 -23.082 9.588 -6.294 1069 HZ3 LYS 131 HZ3 LYS 131 -22.590 11.160 -5.894 1070 H LEU 132 HN LEU 132 -16.934 8.630 -3.297 1071 HA LEU 132 HA LEU 132 -17.279 6.215 -4.697 1072 HB2 LEU 132 HB2 LEU 132 -14.993 7.711 -3.512 1073 HB3 LEU 132 HB1 LEU 132 -14.717 6.003 -3.828 1074 HG LEU 132 HG LEU 132 -14.130 7.697 -5.692 1075 HD11 LEU 132 HD11 LEU 132 -15.170 6.087 -7.444 1076 HD12 LEU 132 HD12 LEU 132 -14.029 5.432 -6.272 1077 HD13 LEU 132 HD13 LEU 132 -15.759 5.190 -6.047 1078 HD21 LEU 132 HD21 LEU 132 -16.577 8.716 -5.363 1079 HD22 LEU 132 HD22 LEU 132 -15.799 8.697 -6.941 1080 HD23 LEU 132 HD23 LEU 132 -16.999 7.472 -6.540 1081 H ALA 133 HN ALA 133 -16.271 6.795 -1.323 1082 HA ALA 133 HA ALA 133 -15.953 4.110 -0.610 1083 HB1 ALA 133 HB1 ALA 133 -17.012 6.121 1.350 1084 HB2 ALA 133 HB2 ALA 133 -15.368 6.257 0.724 1085 HB3 ALA 133 HB3 ALA 133 -15.858 4.812 1.608 1086 H GLY 134 HN GLY 134 -18.891 6.116 -0.807 1087 HA2 GLY 134 HA2 GLY 134 -20.588 4.300 0.566 1088 HA3 GLY 134 HA1 GLY 134 -21.095 5.576 -0.538 1089 H GLU 135 HN GLU 135 -19.666 4.738 -2.829 1090 HA GLU 135 HA GLU 135 -21.463 2.927 -3.988 1091 HB2 GLU 135 HB2 GLU 135 -18.645 3.703 -4.770 1092 HB3 GLU 135 HB1 GLU 135 -19.671 2.668 -5.762 1093 HG2 GLU 135 HG2 GLU 135 -21.378 4.444 -5.857 1094 HG3 GLU 135 HG1 GLU 135 -20.357 5.482 -4.865 1095 H ARG 136 HN ARG 136 -18.648 2.477 -2.034 1096 HA ARG 136 HA ARG 136 -18.524 -0.401 -2.625 1097 HB2 ARG 136 HB2 ARG 136 -16.487 1.271 -2.321 1098 HB3 ARG 136 HB1 ARG 136 -16.764 0.961 -0.610 1099 HG2 ARG 136 HG2 ARG 136 -15.257 -0.740 -1.129 1100 HG3 ARG 136 HG1 ARG 136 -16.793 -1.572 -1.374 1101 HD2 ARG 136 HD2 ARG 136 -16.604 -0.772 -3.829 1102 HD3 ARG 136 HD1 ARG 136 -14.921 -0.430 -3.448 1103 HE ARG 136 HE ARG 136 -15.519 -3.061 -2.623 1104 HH11 ARG 136 HH21 ARG 136 -15.187 -1.122 -5.470 1105 HH12 ARG 136 HH22 ARG 136 -14.674 -2.437 -6.473 1106 HH21 ARG 136 HH11 ARG 136 -14.848 -4.790 -3.933 1107 HH22 ARG 136 HH12 ARG 136 -14.481 -4.514 -5.603 1108 H ASN 137 HN ASN 137 -20.433 1.449 -0.879 1109 HA ASN 137 HA ASN 137 -21.828 1.147 0.928 1110 HB2 ASN 137 HB2 ASN 137 -20.741 -1.630 0.823 1111 HB3 ASN 137 HB1 ASN 137 -22.212 -1.143 1.649 1112 HD21 ASN 137 HD21 ASN 137 -23.343 0.580 -0.294 1113 HD22 ASN 137 HD22 ASN 137 -23.716 -0.320 -1.685 1114 H TYR 138 HN TYR 138 -19.269 2.140 1.447 1115 HA TYR 138 HA TYR 138 -18.241 0.836 3.844 1116 HB2 TYR 138 HB2 TYR 138 -17.384 3.145 2.148 1117 HB3 TYR 138 HB1 TYR 138 -16.838 3.107 3.817 1118 HD1 TYR 138 HD1 TYR 138 -17.485 0.191 1.599 1119 HD2 TYR 138 HD2 TYR 138 -14.543 2.607 3.570 1120 HE1 TYR 138 HE1 TYR 138 -15.740 -1.471 1.016 1121 HE2 TYR 138 HE2 TYR 138 -12.789 0.950 2.982 1122 HH TYR 138 HH TYR 138 -12.353 -1.007 2.037 1123 H THR 139 HN THR 139 -18.967 1.232 5.822 1124 HA THR 139 HA THR 139 -20.830 3.407 6.317 1125 HB THR 139 HB THR 139 -21.433 2.253 8.204 1126 HG1 THR 139 HG1 THR 139 -19.291 2.723 9.093 1127 HG21 THR 139 HG21 THR 139 -21.100 0.575 6.219 1128 HG22 THR 139 HG22 THR 139 -19.758 -0.031 7.188 1129 HG23 THR 139 HG23 THR 139 -21.395 -0.059 7.838 1130 H ASP 140 HN ASP 140 -20.459 5.026 7.993 1131 HA ASP 140 HA ASP 140 -18.249 6.547 7.689 1132 HB2 ASP 140 HB2 ASP 140 -18.732 7.574 9.873 1133 HB3 ASP 140 HB1 ASP 140 -20.203 7.291 8.943 1134 H GLU 141 HN GLU 141 -18.546 4.162 10.391 1135 HA GLU 141 HA GLU 141 -16.019 4.604 11.457 1136 HB2 GLU 141 HB2 GLU 141 -16.242 2.153 12.238 1137 HB3 GLU 141 HB1 GLU 141 -17.469 3.306 12.765 1138 HG2 GLU 141 HG2 GLU 141 -18.992 2.561 11.027 1139 HG3 GLU 141 HG1 GLU 141 -17.754 1.512 10.343 1140 H MET 142 HN MET 142 -16.856 3.021 8.506 1141 HA MET 142 HA MET 142 -14.442 1.454 8.308 1142 HB2 MET 142 HB2 MET 142 -16.232 2.230 6.019 1143 HB3 MET 142 HB1 MET 142 -15.231 0.787 6.191 1144 HG2 MET 142 HG2 MET 142 -16.822 0.614 8.431 1145 HG3 MET 142 HG1 MET 142 -17.923 1.337 7.267 1146 HE1 MET 142 HE1 MET 142 -16.299 -2.044 8.456 1147 HE2 MET 142 HE2 MET 142 -15.554 -2.524 6.933 1148 HE3 MET 142 HE3 MET 142 -15.116 -0.987 7.692 1149 H VAL 143 HN VAL 143 -15.347 4.669 7.677 1150 HA VAL 143 HA VAL 143 -12.773 5.166 6.294 1151 HB VAL 143 HB VAL 143 -14.963 5.438 4.930 1152 HG11 VAL 143 HG11 VAL 143 -16.078 6.692 6.847 1153 HG12 VAL 143 HG12 VAL 143 -15.060 8.065 6.419 1154 HG13 VAL 143 HG13 VAL 143 -16.223 7.432 5.255 1155 HG21 VAL 143 HG21 VAL 143 -12.794 7.517 5.211 1156 HG22 VAL 143 HG22 VAL 143 -12.965 6.266 3.980 1157 HG23 VAL 143 HG23 VAL 143 -14.047 7.658 3.976 1158 H ALA 144 HN ALA 144 -11.429 6.353 7.483 1159 HA ALA 144 HA ALA 144 -12.567 8.064 9.624 1160 HB1 ALA 144 HB1 ALA 144 -9.774 6.944 9.678 1161 HB2 ALA 144 HB2 ALA 144 -11.142 5.945 10.163 1162 HB3 ALA 144 HB3 ALA 144 -10.799 7.444 11.024 1163 H MET 145 HN MET 145 -12.370 10.189 9.251 1164 HA MET 145 HA MET 145 -10.411 11.218 7.398 1165 HB2 MET 145 HB2 MET 145 -11.911 13.082 9.178 1166 HB3 MET 145 HB1 MET 145 -11.631 13.172 7.443 1167 HG2 MET 145 HG2 MET 145 -13.293 10.885 7.855 1168 HG3 MET 145 HG1 MET 145 -13.961 12.175 8.846 1169 HE1 MET 145 HE1 MET 145 -12.785 12.310 4.506 1170 HE2 MET 145 HE2 MET 145 -12.370 11.149 5.760 1171 HE3 MET 145 HE3 MET 145 -13.887 10.983 4.864 1172 H LEU 146 HN LEU 146 -8.606 12.546 7.964 1173 HA LEU 146 HA LEU 146 -7.791 12.242 10.750 1174 HB2 LEU 146 HB2 LEU 146 -6.631 11.288 8.447 1175 HB3 LEU 146 HB1 LEU 146 -5.713 12.764 8.727 1176 HG LEU 146 HG LEU 146 -5.180 12.041 10.949 1177 HD11 LEU 146 HD11 LEU 146 -5.820 9.385 11.221 1178 HD12 LEU 146 HD12 LEU 146 -6.690 10.710 11.989 1179 HD13 LEU 146 HD13 LEU 146 -7.269 10.039 10.464 1180 HD21 LEU 146 HD21 LEU 146 -4.695 9.701 9.141 1181 HD22 LEU 146 HD22 LEU 146 -3.850 11.237 8.962 1182 HD23 LEU 146 HD23 LEU 146 -3.666 10.293 10.436 1183 HA PRO 147 HA PRO 147 -7.728 16.708 11.051 1184 HB2 PRO 147 HB2 PRO 147 -6.524 16.943 13.458 1185 HB3 PRO 147 HB1 PRO 147 -8.158 16.261 13.302 1186 HG2 PRO 147 HG2 PRO 147 -5.536 14.814 13.492 1187 HG3 PRO 147 HG1 PRO 147 -7.017 14.559 14.438 1188 HD2 PRO 147 HD2 PRO 147 -6.438 13.015 12.334 1189 HD3 PRO 147 HD1 PRO 147 -8.113 13.483 12.685 1190 H ARG 148 HN ARG 148 -6.269 18.481 10.978 1191 HA ARG 148 HA ARG 148 -3.849 18.085 9.591 1192 HB2 ARG 148 HB2 ARG 148 -3.504 20.505 9.950 1193 HB3 ARG 148 HB1 ARG 148 -5.140 20.146 9.397 1194 HG2 ARG 148 HG2 ARG 148 -5.915 20.188 11.766 1195 HG3 ARG 148 HG1 ARG 148 -4.290 20.657 12.261 1196 HD2 ARG 148 HD2 ARG 148 -5.753 22.261 10.173 1197 HD3 ARG 148 HD1 ARG 148 -6.085 22.519 11.880 1198 HE ARG 148 HE ARG 148 -3.911 23.383 12.151 1199 HH11 ARG 148 HH21 ARG 148 -4.472 22.158 8.957 1200 HH12 ARG 148 HH22 ARG 148 -3.066 22.906 8.280 1201 HH21 ARG 148 HH11 ARG 148 -2.070 24.362 11.262 1202 HH22 ARG 148 HH12 ARG 148 -1.708 24.152 9.581 1203 H GLN 149 HN GLN 149 -4.463 17.790 12.922 1204 HA GLN 149 HA GLN 149 -2.398 18.820 14.315 1205 HB2 GLN 149 HB2 GLN 149 -4.124 17.183 15.168 1206 HB3 GLN 149 HB1 GLN 149 -3.099 15.893 14.543 1207 HG2 GLN 149 HG2 GLN 149 -2.515 16.175 16.854 1208 HG3 GLN 149 HG1 GLN 149 -1.202 16.875 15.908 1209 HE21 GLN 149 HE21 GLN 149 -4.421 18.299 16.642 1210 HE22 GLN 149 HE22 GLN 149 -3.799 19.658 17.448 1211 H GLU 150 HN GLU 150 -0.259 18.909 14.110 1212 HA GLU 150 HA GLU 150 1.137 16.729 12.654 1213 HB2 GLU 150 HB2 GLU 150 2.650 18.381 11.737 1214 HB3 GLU 150 HB1 GLU 150 0.993 18.850 11.354 1215 HG2 GLU 150 HG2 GLU 150 1.079 20.270 13.498 1216 HG3 GLU 150 HG1 GLU 150 2.822 20.013 13.458 1217 H GLU 151 HN GLU 151 2.751 15.776 13.695 1218 HA GLU 151 HA GLU 151 3.833 17.056 16.145 1219 HB2 GLU 151 HB2 GLU 151 3.505 14.110 15.512 1220 HB3 GLU 151 HB1 GLU 151 4.240 14.768 16.975 1221 HG2 GLU 151 HG2 GLU 151 1.403 15.349 16.082 1222 HG3 GLU 151 HG1 GLU 151 1.837 14.133 17.282 1223 H CYS 152 HN CYS 152 4.484 15.333 13.179 1224 HA CYS 152 HA CYS 152 7.320 16.099 13.363 1225 HB2 CYS 152 HB2 CYS 152 6.229 13.339 13.233 1226 HB3 CYS 152 HB1 CYS 152 7.580 13.684 12.154 1227 H THR 153 HN THR 153 8.395 15.985 11.237 1228 HA THR 153 HA THR 153 6.670 15.892 8.889 1229 HB THR 153 HB THR 153 7.355 18.180 8.164 1230 HG1 THR 153 HG1 THR 153 8.192 18.404 10.863 1231 HG21 THR 153 HG21 THR 153 5.942 18.282 10.834 1232 HG22 THR 153 HG22 THR 153 5.676 19.306 9.424 1233 HG23 THR 153 HG23 THR 153 5.176 17.615 9.392 1234 H VAL 154 HN VAL 154 7.919 16.077 6.874 1235 HA VAL 154 HA VAL 154 10.655 15.037 7.250 1236 HB VAL 154 HB VAL 154 9.467 13.465 6.011 1237 HG11 VAL 154 HG11 VAL 154 7.980 14.108 4.089 1238 HG12 VAL 154 HG12 VAL 154 7.418 14.702 5.652 1239 HG13 VAL 154 HG13 VAL 154 8.229 15.797 4.531 1240 HG21 VAL 154 HG21 VAL 154 10.404 13.477 3.798 1241 HG22 VAL 154 HG22 VAL 154 10.571 15.231 3.812 1242 HG23 VAL 154 HG23 VAL 154 11.582 14.238 4.862 1243 H ASP 155 HN ASP 155 12.246 15.647 5.687 1244 HA ASP 155 HA ASP 155 12.003 18.493 4.900 1245 HB2 ASP 155 HB2 ASP 155 13.718 18.222 6.547 1246 HB3 ASP 155 HB1 ASP 155 14.445 16.894 5.657 1247 H GLU 156 HN GLU 156 13.413 19.111 3.118 1248 HA GLU 156 HA GLU 156 13.711 17.043 1.033 1249 HB2 GLU 156 HB2 GLU 156 12.784 18.847 -0.587 1250 HB3 GLU 156 HB1 GLU 156 11.641 17.916 0.379 1251 HG2 GLU 156 HG2 GLU 156 11.497 19.716 2.021 1252 HG3 GLU 156 HG1 GLU 156 12.722 20.639 1.151 1253 H VAL 157 HN VAL 157 15.952 17.269 1.553 1254 HA VAL 157 HA VAL 157 17.373 19.707 1.367 1255 HB VAL 157 HB VAL 157 19.334 18.060 0.946 1256 HG11 VAL 157 HG11 VAL 157 17.625 17.755 3.431 1257 HG12 VAL 157 HG12 VAL 157 19.352 17.419 3.310 1258 HG13 VAL 157 HG13 VAL 157 18.762 19.072 3.142 1259 HG21 VAL 157 HG21 VAL 157 18.900 15.745 1.283 1260 HG22 VAL 157 HG22 VAL 157 17.256 16.056 1.835 1261 HG23 VAL 157 HG23 VAL 157 17.671 16.276 0.135 1262 HN1 EB4 200 H17 EB4 200 0.103 -0.437 5.445 1263 H8 EB4 200 H8 EB4 200 4.699 1.440 0.722 1264 HN2 EB4 200 H25 EB4 200 3.262 0.208 6.039 1265 H9 EB4 200 H9 EB4 200 0.787 6.556 3.115 1266 H10 EB4 200 H10 EB4 200 -2.891 -0.103 0.343 1267 HN3 EB4 200 H32 EB4 200 0.777 2.296 7.056 1268 H7 EB4 200 H7 EB4 200 -1.252 1.756 0.262 1269 H11 EB4 200 H11 EB4 200 6.508 -0.167 1.262 1270 H12 EB4 200 H12 EB4 200 -0.067 7.811 5.078 1271 H15 EB4 200 H15 EB4 200 -0.217 6.702 7.290 1272 H14 EB4 200 H14 EB4 200 6.684 -1.116 3.547 1273 H13 EB4 200 H13 EB4 200 -2.972 -1.599 2.321 1274 H22 EB4 200 H22 EB4 200 -1.261 -2.739 6.689 1275 H30 EB4 200 H30 EB4 200 -0.588 0.376 9.898 1276 H30A EB4 200 H9N EB4 200 -1.534 1.522 8.828 1277 H24 EB4 200 H24 EB4 200 0.291 2.698 9.954 1278 H28 EB4 200 H28 EB4 200 0.884 -3.317 7.722 1279 H28A EB4 200 H9L EB4 200 0.909 -3.429 5.954 1280 H23 EB4 200 H23 EB4 200 4.850 -1.402 7.984 1281 H29 EB4 200 H29 EB4 200 3.789 -0.038 9.742 1282 H29A EB4 200 H9M EB4 200 4.733 1.002 8.567 1283 H21 ACD 300 HA3 ACD 300 1.239 9.777 -10.443 1284 H22 ACD 300 HA4 ACD 300 1.357 11.297 -9.529 1285 H31 ACD 300 HA1 ACD 300 -1.152 11.383 -9.438 1286 H32 ACD 300 HA2 ACD 300 -1.204 9.800 -10.244 1287 H41 ACD 300 HA0 ACD 300 0.176 10.346 -7.579 1288 H42 ACD 300 HAZ ACD 300 -0.001 8.764 -8.375 1289 H5 ACD 300 HAY ACD 300 -2.735 9.639 -8.209 1290 H6 ACD 300 HAX ACD 300 -2.964 9.233 -5.635 1291 H71 ACD 300 HAV ACD 300 -0.020 10.015 -5.539 1292 H72 ACD 300 HAW ACD 300 -0.993 9.444 -4.165 1293 H8 ACD 300 HAU ACD 300 0.198 7.502 -6.320 1294 H9 ACD 300 HAT ACD 300 0.540 5.982 -4.230 1295 H101 ACD 300 HAR ACD 300 0.575 7.637 -2.126 1296 H102 ACD 300 HAS ACD 300 -0.901 8.360 -2.800 1297 H11 ACD 300 HAQ ACD 300 -2.100 6.044 -2.476 1298 H12 ACD 300 HAP ACD 300 -1.306 4.964 -0.238 1299 H131 ACD 300 HAN ACD 300 1.474 6.179 -0.750 1300 H132 ACD 300 HAO ACD 300 0.792 5.554 0.831 1301 H14 ACD 300 HAM ACD 300 -0.539 7.919 0.775 1302 H15 ACD 300 HAL ACD 300 1.483 9.579 0.795 1303 H161 ACD 300 HAJ ACD 300 3.740 8.871 0.168 1304 H162 ACD 300 HAK ACD 300 3.282 7.183 0.472 1305 H171 ACD 300 HAH ACD 300 3.952 7.550 -1.885 1306 H172 ACD 300 HAI ACD 300 2.259 7.033 -1.770 1307 H181 ACD 300 HAF ACD 300 1.571 9.455 -1.888 1308 H182 ACD 300 HAG ACD 300 3.275 9.887 -2.162 1309 H191 ACD 300 HAD ACD 300 3.294 8.341 -4.150 1310 H192 ACD 300 HAE ACD 300 1.576 8.037 -3.890 1311 H201 ACD 300 HAA ACD 300 1.823 9.750 -5.615 1312 H202 ACD 300 HAB ACD 300 2.856 10.727 -4.551 1313 H203 ACD 300 HAC ACD 300 1.136 10.505 -4.157 Start of MODEL 17 1 H1 MET 1 HT1 MET 1 5.907 15.321 -20.325 2 H2 MET 1 HT2 MET 1 7.202 14.236 -20.502 3 H3 MET 1 HT3 MET 1 6.854 15.356 -21.731 4 HA MET 1 HA MET 1 8.100 15.810 -19.103 5 HB2 MET 1 HB2 MET 1 8.683 16.693 -21.945 6 HB3 MET 1 HB1 MET 1 9.629 17.172 -20.536 7 HG2 MET 1 HG2 MET 1 10.072 14.768 -20.054 8 HG3 MET 1 HG1 MET 1 9.201 14.339 -21.525 9 HE1 MET 1 HE1 MET 1 13.196 16.385 -20.946 10 HE2 MET 1 HE2 MET 1 11.868 17.528 -21.132 11 HE3 MET 1 HE3 MET 1 11.810 16.296 -19.864 12 H THR 2 HN THR 2 7.192 17.917 -21.823 13 HA THR 2 HA THR 2 6.589 20.112 -20.095 14 HB THR 2 HB THR 2 5.742 19.833 -22.979 15 HG1 THR 2 HG1 THR 2 7.799 20.638 -23.466 16 HG21 THR 2 HG21 THR 2 6.526 22.190 -21.243 17 HG22 THR 2 HG22 THR 2 6.090 22.283 -22.950 18 HG23 THR 2 HG23 THR 2 4.889 21.785 -21.759 19 H VAL 3 HN VAL 3 5.060 18.769 -18.747 20 HA VAL 3 HA VAL 3 2.311 19.226 -19.699 21 HB VAL 3 HB VAL 3 1.711 16.981 -18.612 22 HG11 VAL 3 HG11 VAL 3 2.411 15.721 -20.687 23 HG12 VAL 3 HG12 VAL 3 1.592 17.249 -21.010 24 HG13 VAL 3 HG13 VAL 3 3.345 17.139 -21.160 25 HG21 VAL 3 HG21 VAL 3 4.044 16.811 -17.558 26 HG22 VAL 3 HG22 VAL 3 3.442 15.356 -18.351 27 HG23 VAL 3 HG23 VAL 3 4.625 16.379 -19.165 28 HA PRO 4 HA PRO 4 3.405 20.942 -15.435 29 HB2 PRO 4 HB2 PRO 4 1.235 22.724 -16.500 30 HB3 PRO 4 HB1 PRO 4 2.678 23.150 -15.557 31 HG2 PRO 4 HG2 PRO 4 2.578 23.580 -18.179 32 HG3 PRO 4 HG1 PRO 4 4.072 23.042 -17.391 33 HD2 PRO 4 HD2 PRO 4 2.213 21.497 -19.142 34 HD3 PRO 4 HD1 PRO 4 3.959 21.288 -18.890 35 H ASP 5 HN ASP 5 2.521 19.363 -14.146 36 HA ASP 5 HA ASP 5 -0.154 19.677 -13.234 37 HB2 ASP 5 HB2 ASP 5 -0.534 18.499 -15.432 38 HB3 ASP 5 HB1 ASP 5 0.354 17.126 -14.775 39 H ARG 6 HN ARG 6 2.236 17.057 -13.669 40 HA ARG 6 HA ARG 6 1.838 16.080 -10.991 41 HB2 ARG 6 HB2 ARG 6 2.435 14.515 -12.734 42 HB3 ARG 6 HB1 ARG 6 3.899 15.420 -13.105 43 HG2 ARG 6 HG2 ARG 6 3.663 14.626 -10.258 44 HG3 ARG 6 HG1 ARG 6 3.786 13.270 -11.374 45 HD2 ARG 6 HD2 ARG 6 5.713 15.602 -11.178 46 HD3 ARG 6 HD1 ARG 6 6.019 13.950 -10.657 47 HE ARG 6 HE ARG 6 5.408 13.622 -13.272 48 HH11 ARG 6 HH21 ARG 6 7.512 15.775 -11.567 49 HH12 ARG 6 HH22 ARG 6 8.653 15.907 -12.862 50 HH21 ARG 6 HH11 ARG 6 6.903 13.787 -14.974 51 HH22 ARG 6 HH12 ARG 6 8.309 14.781 -14.790 52 H SER 7 HN SER 7 4.421 17.841 -12.680 53 HA SER 7 HA SER 7 6.287 17.996 -10.623 54 HB2 SER 7 HB2 SER 7 7.221 19.875 -11.797 55 HB3 SER 7 HB1 SER 7 6.616 18.737 -12.998 56 HG SER 7 HG SER 7 5.030 20.849 -11.990 57 H GLU 8 HN GLU 8 3.343 19.816 -11.132 58 HA GLU 8 HA GLU 8 3.864 21.910 -9.290 59 HB2 GLU 8 HB2 GLU 8 1.315 20.777 -10.442 60 HB3 GLU 8 HB1 GLU 8 1.328 22.146 -9.329 61 HG2 GLU 8 HG2 GLU 8 1.332 22.999 -11.603 62 HG3 GLU 8 HG1 GLU 8 2.905 23.324 -10.877 63 H ILE 9 HN ILE 9 2.092 18.826 -8.936 64 HA ILE 9 HA ILE 9 1.662 19.349 -6.105 65 HB ILE 9 HB ILE 9 0.029 18.194 -7.709 66 HG12 ILE 9 HG12 ILE 9 0.288 18.101 -4.980 67 HG13 ILE 9 HG11 ILE 9 -1.070 17.430 -5.849 68 HG21 ILE 9 HG21 ILE 9 1.903 15.883 -7.196 69 HG22 ILE 9 HG22 ILE 9 0.299 15.741 -7.900 70 HG23 ILE 9 HG23 ILE 9 1.554 16.638 -8.746 71 HD11 ILE 9 HD11 ILE 9 0.007 15.233 -5.851 72 HD12 ILE 9 HD12 ILE 9 1.424 15.935 -5.059 73 HD13 ILE 9 HD13 ILE 9 -0.112 15.852 -4.205 74 H ALA 10 HN ALA 10 3.835 17.578 -8.115 75 HA ALA 10 HA ALA 10 4.743 15.738 -6.157 76 HB1 ALA 10 HB1 ALA 10 6.886 15.725 -7.602 77 HB2 ALA 10 HB2 ALA 10 5.971 16.765 -8.693 78 HB3 ALA 10 HB3 ALA 10 5.387 15.143 -8.326 79 H GLY 11 HN GLY 11 6.400 15.861 -4.639 80 HA2 GLY 11 HA2 GLY 11 8.325 17.130 -3.785 81 HA3 GLY 11 HA1 GLY 11 7.402 18.595 -4.122 82 H LYS 12 HN LYS 12 4.860 17.360 -3.333 83 HA LYS 12 HA LYS 12 5.068 16.565 -0.577 84 HB2 LYS 12 HB2 LYS 12 5.497 19.017 -0.436 85 HB3 LYS 12 HB1 LYS 12 3.907 19.295 -1.149 86 HG2 LYS 12 HG2 LYS 12 2.799 18.247 0.710 87 HG3 LYS 12 HG1 LYS 12 4.329 17.659 1.363 88 HD2 LYS 12 HD2 LYS 12 3.521 19.669 2.578 89 HD3 LYS 12 HD1 LYS 12 5.067 19.958 1.782 90 HE2 LYS 12 HE2 LYS 12 3.185 21.743 1.525 91 HE3 LYS 12 HE1 LYS 12 4.096 21.269 0.091 92 HZ1 LYS 12 HZ1 LYS 12 1.700 19.731 0.763 93 HZ2 LYS 12 HZ2 LYS 12 1.482 21.288 0.116 94 HZ3 LYS 12 HZ3 LYS 12 2.348 20.120 -0.758 95 H TRP 13 HN TRP 13 3.498 14.999 -0.564 96 HA TRP 13 HA TRP 13 0.860 15.622 -1.780 97 HB2 TRP 13 HB2 TRP 13 2.361 13.009 -1.421 98 HB3 TRP 13 HB1 TRP 13 0.666 13.052 -1.862 99 HD1 TRP 13 HD1 TRP 13 3.858 14.792 -3.150 100 HE1 TRP 13 HE1 TRP 13 3.781 14.620 -5.719 101 HE3 TRP 13 HE3 TRP 13 -0.623 12.423 -3.811 102 HZ2 TRP 13 HZ2 TRP 13 2.162 13.643 -7.721 103 HZ3 TRP 13 HZ3 TRP 13 -1.421 11.900 -6.102 104 HH2 TRP 13 HH2 TRP 13 -0.040 12.517 -8.072 105 H TYR 14 HN TYR 14 -0.769 15.780 -0.262 106 HA TYR 14 HA TYR 14 -0.152 14.929 2.489 107 HB2 TYR 14 HB2 TYR 14 -1.489 17.167 1.230 108 HB3 TYR 14 HB1 TYR 14 -2.571 16.395 2.373 109 HD1 TYR 14 HD2 TYR 14 1.152 16.882 2.437 110 HD2 TYR 14 HD1 TYR 14 -2.634 17.706 4.286 111 HE1 TYR 14 HE2 TYR 14 2.304 18.045 4.301 112 HE2 TYR 14 HE1 TYR 14 -1.482 18.866 6.144 113 HH TYR 14 HH TYR 14 0.576 19.899 6.669 114 H VAL 15 HN VAL 15 -1.222 13.327 3.494 115 HA VAL 15 HA VAL 15 -3.588 12.112 2.175 116 HB VAL 15 HB VAL 15 -1.423 11.017 3.977 117 HG11 VAL 15 HG11 VAL 15 -4.225 9.959 3.576 118 HG12 VAL 15 HG12 VAL 15 -2.887 8.897 4.012 119 HG13 VAL 15 HG13 VAL 15 -3.361 10.207 5.092 120 HG21 VAL 15 HG21 VAL 15 -1.373 9.250 2.244 121 HG22 VAL 15 HG22 VAL 15 -2.693 10.058 1.403 122 HG23 VAL 15 HG23 VAL 15 -1.123 10.847 1.544 123 H VAL 16 HN VAL 16 -5.473 12.842 3.122 124 HA VAL 16 HA VAL 16 -5.398 13.307 6.051 125 HB VAL 16 HB VAL 16 -6.654 15.244 5.869 126 HG11 VAL 16 HG11 VAL 16 -5.144 15.653 3.327 127 HG12 VAL 16 HG12 VAL 16 -5.124 16.607 4.801 128 HG13 VAL 16 HG13 VAL 16 -4.211 15.110 4.705 129 HG21 VAL 16 HG21 VAL 16 -7.293 14.284 3.073 130 HG22 VAL 16 HG22 VAL 16 -8.414 14.651 4.383 131 HG23 VAL 16 HG23 VAL 16 -7.564 15.956 3.559 132 H ALA 17 HN ALA 17 -6.568 11.088 4.117 133 HA ALA 17 HA ALA 17 -8.558 10.339 5.958 134 HB1 ALA 17 HB1 ALA 17 -9.456 12.173 3.872 135 HB2 ALA 17 HB2 ALA 17 -10.298 11.644 5.316 136 HB3 ALA 17 HB3 ALA 17 -10.370 10.667 3.856 137 H LEU 18 HN LEU 18 -8.917 8.169 5.747 138 HA LEU 18 HA LEU 18 -8.330 6.964 3.132 139 HB2 LEU 18 HB2 LEU 18 -7.418 5.038 4.633 140 HB3 LEU 18 HB1 LEU 18 -6.402 6.437 4.309 141 HG LEU 18 HG LEU 18 -6.463 5.726 6.717 142 HD11 LEU 18 HD11 LEU 18 -6.420 8.293 5.662 143 HD12 LEU 18 HD12 LEU 18 -7.626 8.407 6.942 144 HD13 LEU 18 HD13 LEU 18 -5.997 7.848 7.313 145 HD21 LEU 18 HD21 LEU 18 -9.249 6.887 6.767 146 HD22 LEU 18 HD22 LEU 18 -8.959 5.158 6.601 147 HD23 LEU 18 HD23 LEU 18 -8.419 6.011 8.041 148 H ALA 19 HN ALA 19 -8.970 4.630 3.119 149 HA ALA 19 HA ALA 19 -11.429 4.071 4.615 150 HB1 ALA 19 HB1 ALA 19 -12.830 3.953 2.798 151 HB2 ALA 19 HB2 ALA 19 -11.538 3.496 1.693 152 HB3 ALA 19 HB3 ALA 19 -11.727 5.179 2.184 153 H SER 20 HN SER 20 -11.705 1.913 5.017 154 HA SER 20 HA SER 20 -10.375 -0.149 3.536 155 HB2 SER 20 HB2 SER 20 -8.964 -0.870 5.547 156 HB3 SER 20 HB1 SER 20 -8.378 0.500 4.609 157 HG SER 20 HG SER 20 -8.499 1.595 6.387 158 H ASN 21 HN ASN 21 -10.375 -2.230 4.973 159 HA ASN 21 HA ASN 21 -12.833 -2.313 6.604 160 HB2 ASN 21 HB2 ASN 21 -13.167 -3.090 4.175 161 HB3 ASN 21 HB1 ASN 21 -12.159 -4.463 4.615 162 HD21 ASN 21 HD21 ASN 21 -12.940 -5.496 6.869 163 HD22 ASN 21 HD22 ASN 21 -14.618 -5.720 6.995 164 H THR 22 HN THR 22 -9.574 -3.224 6.063 165 HA THR 22 HA THR 22 -9.601 -5.529 7.811 166 HB THR 22 HB THR 22 -7.898 -5.284 6.024 167 HG1 THR 22 HG1 THR 22 -6.626 -6.367 7.273 168 HG21 THR 22 HG21 THR 22 -6.474 -3.508 5.867 169 HG22 THR 22 HG22 THR 22 -7.728 -2.668 6.777 170 HG23 THR 22 HG23 THR 22 -6.332 -3.346 7.616 171 H GLU 23 HN GLU 23 -10.070 -5.242 9.875 172 HA GLU 23 HA GLU 23 -10.130 -2.860 11.233 173 HB2 GLU 23 HB2 GLU 23 -9.724 -5.621 12.376 174 HB3 GLU 23 HB1 GLU 23 -10.221 -4.204 13.302 175 HG2 GLU 23 HG2 GLU 23 -11.733 -5.278 10.906 176 HG3 GLU 23 HG1 GLU 23 -12.141 -5.655 12.578 177 H PHE 24 HN PHE 24 -7.408 -5.113 11.084 178 HA PHE 24 HA PHE 24 -5.851 -4.054 13.091 179 HB2 PHE 24 HB2 PHE 24 -4.410 -4.648 10.558 180 HB3 PHE 24 HB1 PHE 24 -4.129 -5.264 12.185 181 HD1 PHE 24 HD1 PHE 24 -6.757 -6.340 12.933 182 HD2 PHE 24 HD2 PHE 24 -4.672 -6.536 9.182 183 HE1 PHE 24 HE1 PHE 24 -7.993 -8.409 12.354 184 HE2 PHE 24 HE2 PHE 24 -5.908 -8.606 8.604 185 HZ PHE 24 HZ PHE 24 -7.568 -9.543 10.190 186 H PHE 25 HN PHE 25 -5.825 -2.980 9.670 187 HA PHE 25 HA PHE 25 -4.164 -0.708 10.277 188 HB2 PHE 25 HB2 PHE 25 -5.731 -1.164 7.743 189 HB3 PHE 25 HB1 PHE 25 -4.258 -0.229 7.954 190 HD1 PHE 25 HD2 PHE 25 -3.188 -2.623 9.983 191 HD2 PHE 25 HD1 PHE 25 -4.514 -2.363 5.893 192 HE1 PHE 25 HE2 PHE 25 -1.871 -4.627 9.427 193 HE2 PHE 25 HE1 PHE 25 -3.182 -4.383 5.354 194 HZ PHE 25 HZ PHE 25 -1.864 -5.512 7.116 195 H LEU 26 HN LEU 26 -7.577 -1.145 9.505 196 HA LEU 26 HA LEU 26 -8.314 1.583 9.430 197 HB2 LEU 26 HB2 LEU 26 -9.777 -0.122 8.566 198 HB3 LEU 26 HB1 LEU 26 -9.829 -0.938 10.119 199 HG LEU 26 HG LEU 26 -11.036 0.937 11.109 200 HD11 LEU 26 HD11 LEU 26 -10.531 2.173 8.396 201 HD12 LEU 26 HD12 LEU 26 -11.855 2.723 9.422 202 HD13 LEU 26 HD13 LEU 26 -10.191 2.851 9.989 203 HD21 LEU 26 HD21 LEU 26 -12.306 0.274 8.439 204 HD22 LEU 26 HD22 LEU 26 -12.190 -0.903 9.746 205 HD23 LEU 26 HD23 LEU 26 -13.117 0.579 9.977 206 H ARG 27 HN ARG 27 -7.831 -0.701 11.916 207 HA ARG 27 HA ARG 27 -8.970 0.692 14.133 208 HB2 ARG 27 HB2 ARG 27 -8.427 -1.626 14.463 209 HB3 ARG 27 HB1 ARG 27 -6.734 -1.349 14.045 210 HG2 ARG 27 HG2 ARG 27 -6.349 -0.105 16.046 211 HG3 ARG 27 HG1 ARG 27 -8.076 0.032 16.378 212 HD2 ARG 27 HD2 ARG 27 -8.250 -2.311 16.870 213 HD3 ARG 27 HD1 ARG 27 -6.626 -2.622 16.262 214 HE ARG 27 HE ARG 27 -7.324 -1.559 18.868 215 HH11 ARG 27 HH21 ARG 27 -4.927 -1.877 16.391 216 HH12 ARG 27 HH22 ARG 27 -3.589 -1.639 17.464 217 HH21 ARG 27 HH11 ARG 27 -5.573 -1.246 20.280 218 HH22 ARG 27 HH12 ARG 27 -3.954 -1.281 19.666 219 H GLU 28 HN GLU 28 -5.679 0.608 12.795 220 HA GLU 28 HA GLU 28 -4.729 2.578 14.680 221 HB2 GLU 28 HB2 GLU 28 -3.452 1.321 12.251 222 HB3 GLU 28 HB1 GLU 28 -2.628 2.433 13.346 223 HG2 GLU 28 HG2 GLU 28 -3.122 0.903 15.238 224 HG3 GLU 28 HG1 GLU 28 -3.877 -0.223 14.111 225 H LYS 29 HN LYS 29 -5.512 2.715 11.110 226 HA LYS 29 HA LYS 29 -4.480 5.205 10.634 227 HB2 LYS 29 HB2 LYS 29 -6.935 3.819 9.574 228 HB3 LYS 29 HB1 LYS 29 -6.449 5.411 9.003 229 HG2 LYS 29 HG2 LYS 29 -4.717 4.579 7.770 230 HG3 LYS 29 HG1 LYS 29 -4.187 3.528 9.075 231 HD2 LYS 29 HD2 LYS 29 -4.807 1.975 7.455 232 HD3 LYS 29 HD1 LYS 29 -6.281 2.077 8.403 233 HE2 LYS 29 HE2 LYS 29 -7.280 3.587 6.800 234 HE3 LYS 29 HE1 LYS 29 -5.764 3.707 5.904 235 HZ1 LYS 29 HZ1 LYS 29 -7.266 1.184 6.320 236 HZ2 LYS 29 HZ2 LYS 29 -7.377 2.142 4.922 237 HZ3 LYS 29 HZ3 LYS 29 -5.903 1.412 5.331 238 H ASP 30 HN ASP 30 -7.361 4.289 12.347 239 HA ASP 30 HA ASP 30 -8.626 6.783 12.489 240 HB2 ASP 30 HB2 ASP 30 -8.636 4.517 14.489 241 HB3 ASP 30 HB1 ASP 30 -9.781 5.859 14.463 242 H LYS 31 HN LYS 31 -5.798 5.601 14.260 243 HA LYS 31 HA LYS 31 -6.090 7.803 16.157 244 HB2 LYS 31 HB2 LYS 31 -4.502 6.775 17.565 245 HB3 LYS 31 HB1 LYS 31 -5.581 5.512 16.995 246 HG2 LYS 31 HG2 LYS 31 -3.493 4.516 16.732 247 HG3 LYS 31 HG1 LYS 31 -3.800 5.155 15.136 248 HD2 LYS 31 HD2 LYS 31 -2.507 7.248 16.596 249 HD3 LYS 31 HD1 LYS 31 -1.623 5.772 16.939 250 HE2 LYS 31 HE2 LYS 31 -2.352 6.324 14.080 251 HE3 LYS 31 HE1 LYS 31 -1.036 7.240 14.799 252 HZ1 LYS 31 HZ1 LYS 31 0.187 5.469 14.263 253 HZ2 LYS 31 HZ2 LYS 31 -0.500 4.747 15.639 254 HZ3 LYS 31 HZ3 LYS 31 -1.160 4.445 14.106 255 H MET 32 HN MET 32 -4.201 7.227 13.285 256 HA MET 32 HA MET 32 -2.099 9.018 14.160 257 HB2 MET 32 HB2 MET 32 -1.518 9.040 11.631 258 HB3 MET 32 HB1 MET 32 -1.268 7.558 12.531 259 HG2 MET 32 HG2 MET 32 -3.774 7.074 11.723 260 HG3 MET 32 HG1 MET 32 -3.316 8.186 10.448 261 HE1 MET 32 HE1 MET 32 -2.872 5.102 12.314 262 HE2 MET 32 HE2 MET 32 -1.861 4.020 11.383 263 HE3 MET 32 HE3 MET 32 -1.130 5.269 12.392 264 H LYS 33 HN LYS 33 -1.512 10.825 12.655 265 HA LYS 33 HA LYS 33 -3.843 12.610 12.331 266 HB2 LYS 33 HB2 LYS 33 -0.997 13.549 12.577 267 HB3 LYS 33 HB1 LYS 33 -2.491 14.419 12.923 268 HG2 LYS 33 HG2 LYS 33 -1.430 12.067 14.517 269 HG3 LYS 33 HG1 LYS 33 -1.342 13.758 15.007 270 HD2 LYS 33 HD2 LYS 33 -3.873 13.836 14.807 271 HD3 LYS 33 HD1 LYS 33 -3.835 12.086 14.624 272 HE2 LYS 33 HE2 LYS 33 -2.623 13.569 16.969 273 HE3 LYS 33 HE1 LYS 33 -4.221 12.823 16.988 274 HZ1 LYS 33 HZ1 LYS 33 -1.658 11.611 17.270 275 HZ2 LYS 33 HZ2 LYS 33 -3.197 10.964 17.584 276 HZ3 LYS 33 HZ3 LYS 33 -2.549 10.884 16.019 277 H MET 34 HN MET 34 -3.187 14.433 10.527 278 HA MET 34 HA MET 34 -3.169 13.299 8.069 279 HB2 MET 34 HB2 MET 34 -3.325 15.798 9.108 280 HB3 MET 34 HB1 MET 34 -1.718 15.891 8.418 281 HG2 MET 34 HG2 MET 34 -2.600 15.232 6.242 282 HG3 MET 34 HG1 MET 34 -4.214 15.061 6.939 283 HE1 MET 34 HE1 MET 34 -5.302 16.702 8.284 284 HE2 MET 34 HE2 MET 34 -5.380 18.422 7.925 285 HE3 MET 34 HE3 MET 34 -5.974 17.248 6.755 286 H ALA 35 HN ALA 35 -1.626 12.683 6.587 287 HA ALA 35 HA ALA 35 1.199 12.636 7.481 288 HB1 ALA 35 HB1 ALA 35 1.265 10.637 5.797 289 HB2 ALA 35 HB2 ALA 35 -0.483 10.623 6.027 290 HB3 ALA 35 HB3 ALA 35 0.586 10.390 7.405 291 H MET 36 HN MET 36 2.796 12.582 5.678 292 HA MET 36 HA MET 36 1.857 14.047 3.295 293 HB2 MET 36 HB2 MET 36 4.466 15.000 3.885 294 HB3 MET 36 HB1 MET 36 2.956 15.900 3.913 295 HG2 MET 36 HG2 MET 36 3.871 14.221 6.258 296 HG3 MET 36 HG1 MET 36 4.316 15.914 6.074 297 HE1 MET 36 HE1 MET 36 3.381 16.028 8.414 298 HE2 MET 36 HE2 MET 36 3.015 17.538 7.584 299 HE3 MET 36 HE3 MET 36 1.802 16.778 8.624 300 H ALA 37 HN ALA 37 3.441 14.046 1.520 301 HA ALA 37 HA ALA 37 5.501 12.007 1.531 302 HB1 ALA 37 HB1 ALA 37 2.837 11.548 0.250 303 HB2 ALA 37 HB2 ALA 37 3.840 10.441 1.176 304 HB3 ALA 37 HB3 ALA 37 4.279 10.851 -0.486 305 H ARG 38 HN ARG 38 6.634 11.822 -0.556 306 HA ARG 38 HA ARG 38 6.286 14.181 -2.335 307 HB2 ARG 38 HB2 ARG 38 8.160 14.766 -0.968 308 HB3 ARG 38 HB1 ARG 38 8.836 13.141 -1.077 309 HG2 ARG 38 HG2 ARG 38 9.462 13.424 -3.343 310 HG3 ARG 38 HG1 ARG 38 8.420 14.833 -3.542 311 HD2 ARG 38 HD2 ARG 38 9.846 16.089 -1.945 312 HD3 ARG 38 HD1 ARG 38 10.905 14.688 -1.812 313 HE ARG 38 HE ARG 38 10.514 15.633 -4.526 314 HH11 ARG 38 HH21 ARG 38 12.326 15.856 -1.587 315 HH12 ARG 38 HH22 ARG 38 13.747 16.490 -2.349 316 HH21 ARG 38 HH11 ARG 38 12.374 16.464 -5.533 317 HH22 ARG 38 HH12 ARG 38 13.774 16.834 -4.584 318 H ILE 39 HN ILE 39 6.292 13.613 -4.583 319 HA ILE 39 HA ILE 39 7.140 10.907 -5.251 320 HB ILE 39 HB ILE 39 4.713 11.342 -5.108 321 HG12 ILE 39 HG12 ILE 39 5.574 10.729 -7.934 322 HG13 ILE 39 HG11 ILE 39 5.705 9.557 -6.625 323 HG21 ILE 39 HG21 ILE 39 4.896 13.599 -5.950 324 HG22 ILE 39 HG22 ILE 39 5.194 12.945 -7.551 325 HG23 ILE 39 HG23 ILE 39 3.691 12.604 -6.735 326 HD11 ILE 39 HD11 ILE 39 3.454 9.187 -6.581 327 HD12 ILE 39 HD12 ILE 39 3.080 10.908 -6.716 328 HD13 ILE 39 HD13 ILE 39 3.432 9.963 -8.155 329 H SER 40 HN SER 40 8.227 10.583 -7.160 330 HA SER 40 HA SER 40 8.893 12.971 -8.756 331 HB2 SER 40 HB2 SER 40 10.993 13.029 -7.929 332 HB3 SER 40 HB1 SER 40 10.686 11.600 -6.952 333 HG SER 40 HG SER 40 12.338 11.650 -8.829 334 H PHE 41 HN PHE 41 9.347 12.557 -10.917 335 HA PHE 41 HA PHE 41 8.399 9.975 -11.878 336 HB2 PHE 41 HB2 PHE 41 8.680 12.699 -12.950 337 HB3 PHE 41 HB1 PHE 41 8.990 11.430 -14.124 338 HD1 PHE 41 HD2 PHE 41 6.644 11.366 -11.211 339 HD2 PHE 41 HD1 PHE 41 7.060 11.453 -15.485 340 HE1 PHE 41 HE2 PHE 41 4.207 10.976 -11.457 341 HE2 PHE 41 HE1 PHE 41 4.625 11.065 -15.731 342 HZ PHE 41 HZ PHE 41 3.199 10.825 -13.718 343 H LEU 42 HN LEU 42 9.877 8.496 -11.720 344 HA LEU 42 HA LEU 42 12.662 8.882 -12.512 345 HB2 LEU 42 HB2 LEU 42 11.070 6.475 -11.624 346 HB3 LEU 42 HB1 LEU 42 12.687 6.309 -12.270 347 HG LEU 42 HG LEU 42 11.924 8.014 -9.883 348 HD11 LEU 42 HD11 LEU 42 12.976 5.200 -10.175 349 HD12 LEU 42 HD12 LEU 42 13.366 6.146 -8.740 350 HD13 LEU 42 HD13 LEU 42 11.682 5.799 -9.136 351 HD21 LEU 42 HD21 LEU 42 13.901 9.003 -10.584 352 HD22 LEU 42 HD22 LEU 42 14.579 7.680 -9.643 353 HD23 LEU 42 HD23 LEU 42 14.471 7.547 -11.397 354 H GLY 43 HN GLY 43 9.703 7.583 -13.675 355 HA2 GLY 43 HA2 GLY 43 10.131 7.943 -16.406 356 HA3 GLY 43 HA1 GLY 43 10.536 6.266 -16.026 357 H GLU 44 HN GLU 44 8.225 7.305 -17.599 358 HA GLU 44 HA GLU 44 5.833 7.325 -16.186 359 HB2 GLU 44 HB2 GLU 44 6.345 6.067 -18.900 360 HB3 GLU 44 HB1 GLU 44 4.766 6.528 -18.262 361 HG2 GLU 44 HG2 GLU 44 7.078 8.446 -18.670 362 HG3 GLU 44 HG1 GLU 44 5.734 8.251 -19.793 363 H ASP 45 HN ASP 45 7.959 4.664 -16.907 364 HA ASP 45 HA ASP 45 6.003 2.722 -15.850 365 HB2 ASP 45 HB2 ASP 45 8.706 1.984 -16.939 366 HB3 ASP 45 HB1 ASP 45 7.217 1.040 -16.920 367 H GLU 46 HN GLU 46 7.867 4.804 -14.458 368 HA GLU 46 HA GLU 46 8.390 3.217 -12.134 369 HB2 GLU 46 HB2 GLU 46 10.292 2.568 -13.639 370 HB3 GLU 46 HB1 GLU 46 10.807 4.252 -13.631 371 HG2 GLU 46 HG2 GLU 46 10.848 4.084 -11.080 372 HG3 GLU 46 HG1 GLU 46 10.676 2.344 -11.293 373 H LEU 47 HN LEU 47 8.168 4.549 -10.426 374 HA LEU 47 HA LEU 47 9.126 7.317 -10.632 375 HB2 LEU 47 HB2 LEU 47 6.881 7.786 -9.204 376 HB3 LEU 47 HB1 LEU 47 6.970 7.993 -10.947 377 HG LEU 47 HG LEU 47 6.160 5.380 -9.670 378 HD11 LEU 47 HD11 LEU 47 4.597 7.032 -8.880 379 HD12 LEU 47 HD12 LEU 47 4.456 7.736 -10.490 380 HD13 LEU 47 HD13 LEU 47 3.814 6.125 -10.172 381 HD21 LEU 47 HD21 LEU 47 6.468 6.379 -12.427 382 HD22 LEU 47 HD22 LEU 47 6.346 4.723 -11.838 383 HD23 LEU 47 HD23 LEU 47 4.887 5.663 -12.129 384 H LYS 48 HN LYS 48 9.664 8.273 -8.660 385 HA LYS 48 HA LYS 48 10.108 6.318 -6.478 386 HB2 LYS 48 HB2 LYS 48 12.045 7.642 -7.570 387 HB3 LYS 48 HB1 LYS 48 11.407 9.033 -6.696 388 HG2 LYS 48 HG2 LYS 48 11.505 7.597 -4.592 389 HG3 LYS 48 HG1 LYS 48 12.434 6.433 -5.536 390 HD2 LYS 48 HD2 LYS 48 13.174 9.319 -4.975 391 HD3 LYS 48 HD1 LYS 48 13.993 7.880 -4.371 392 HE2 LYS 48 HE2 LYS 48 15.339 8.507 -6.188 393 HE3 LYS 48 HE1 LYS 48 14.289 7.279 -6.895 394 HZ1 LYS 48 HZ1 LYS 48 13.057 9.828 -7.002 395 HZ2 LYS 48 HZ2 LYS 48 14.594 9.892 -7.725 396 HZ3 LYS 48 HZ3 LYS 48 13.445 8.772 -8.275 397 H VAL 49 HN VAL 49 8.771 6.483 -4.730 398 HA VAL 49 HA VAL 49 7.884 9.167 -4.010 399 HB VAL 49 HB VAL 49 6.119 7.743 -5.367 400 HG11 VAL 49 HG11 VAL 49 5.625 6.798 -2.541 401 HG12 VAL 49 HG12 VAL 49 4.447 6.708 -3.849 402 HG13 VAL 49 HG13 VAL 49 5.950 5.798 -3.947 403 HG21 VAL 49 HG21 VAL 49 4.615 9.300 -4.684 404 HG22 VAL 49 HG22 VAL 49 4.902 8.991 -2.988 405 HG23 VAL 49 HG23 VAL 49 5.985 9.995 -3.883 406 H SER 50 HN SER 50 7.565 9.638 -2.024 407 HA SER 50 HA SER 50 8.657 7.746 -0.006 408 HB2 SER 50 HB2 SER 50 8.862 10.741 -0.260 409 HB3 SER 50 HB1 SER 50 9.221 9.901 1.241 410 HG SER 50 HG SER 50 10.351 8.966 -1.143 411 H TYR 51 HN TYR 51 7.734 7.603 2.041 412 HA TYR 51 HA TYR 51 5.001 8.727 2.284 413 HB2 TYR 51 HB2 TYR 51 6.228 6.260 3.553 414 HB3 TYR 51 HB1 TYR 51 4.588 6.829 3.813 415 HD1 TYR 51 HD1 TYR 51 6.759 6.237 0.758 416 HD2 TYR 51 HD2 TYR 51 3.016 5.517 2.746 417 HE1 TYR 51 HE1 TYR 51 5.990 4.895 -1.166 418 HE2 TYR 51 HE2 TYR 51 2.262 4.163 0.812 419 HH TYR 51 HH TYR 51 2.864 4.099 -1.729 420 H ALA 52 HN ALA 52 4.706 10.165 3.948 421 HA ALA 52 HA ALA 52 6.605 10.080 6.219 422 HB1 ALA 52 HB1 ALA 52 5.309 12.639 5.343 423 HB2 ALA 52 HB2 ALA 52 6.743 12.061 4.498 424 HB3 ALA 52 HB3 ALA 52 6.813 12.394 6.228 425 H VAL 53 HN VAL 53 5.459 9.258 7.897 426 HA VAL 53 HA VAL 53 2.721 10.289 8.339 427 HB VAL 53 HB VAL 53 3.746 7.613 9.275 428 HG11 VAL 53 HG11 VAL 53 0.915 8.440 8.629 429 HG12 VAL 53 HG12 VAL 53 1.468 7.120 9.657 430 HG13 VAL 53 HG13 VAL 53 1.631 8.788 10.202 431 HG21 VAL 53 HG21 VAL 53 2.524 6.685 7.276 432 HG22 VAL 53 HG22 VAL 53 2.393 8.331 6.655 433 HG23 VAL 53 HG23 VAL 53 3.981 7.589 6.861 434 HA PRO 54 HA PRO 54 4.869 11.480 12.157 435 HB2 PRO 54 HB2 PRO 54 3.180 13.392 12.988 436 HB3 PRO 54 HB1 PRO 54 4.210 13.643 11.562 437 HG2 PRO 54 HG2 PRO 54 1.316 12.924 11.698 438 HG3 PRO 54 HG1 PRO 54 2.144 14.058 10.616 439 HD2 PRO 54 HD2 PRO 54 1.463 11.441 9.928 440 HD3 PRO 54 HD1 PRO 54 2.727 12.400 9.132 441 H LYS 55 HN LYS 55 4.620 10.919 14.322 442 HA LYS 55 HA LYS 55 2.013 10.140 15.336 443 HB2 LYS 55 HB2 LYS 55 4.270 8.150 15.043 444 HB3 LYS 55 HB1 LYS 55 2.835 7.880 16.030 445 HG2 LYS 55 HG2 LYS 55 1.471 8.371 13.918 446 HG3 LYS 55 HG1 LYS 55 2.989 8.225 13.031 447 HD2 LYS 55 HD2 LYS 55 1.820 6.093 14.843 448 HD3 LYS 55 HD1 LYS 55 1.753 6.076 13.080 449 HE2 LYS 55 HE2 LYS 55 4.331 6.293 13.177 450 HE3 LYS 55 HE1 LYS 55 4.171 5.817 14.867 451 HZ1 LYS 55 HZ1 LYS 55 3.719 3.723 14.307 452 HZ2 LYS 55 HZ2 LYS 55 2.655 4.174 13.060 453 HZ3 LYS 55 HZ3 LYS 55 4.325 4.117 12.769 454 HA PRO 56 HA PRO 56 4.037 11.825 18.931 455 HB2 PRO 56 HB2 PRO 56 2.272 11.008 20.865 456 HB3 PRO 56 HB1 PRO 56 1.938 12.343 19.745 457 HG2 PRO 56 HG2 PRO 56 1.019 9.504 19.629 458 HG3 PRO 56 HG1 PRO 56 0.119 10.994 19.290 459 HD2 PRO 56 HD2 PRO 56 1.138 9.423 17.310 460 HD3 PRO 56 HD1 PRO 56 0.978 11.188 17.141 461 H ASN 57 HN ASN 57 3.206 8.438 18.679 462 HA ASN 57 HA ASN 57 4.776 7.626 20.974 463 HB2 ASN 57 HB2 ASN 57 2.718 6.416 20.115 464 HB3 ASN 57 HB1 ASN 57 3.709 5.864 18.766 465 HD21 ASN 57 HD21 ASN 57 2.937 3.733 20.078 466 HD22 ASN 57 HD22 ASN 57 4.073 3.166 21.203 467 H GLY 58 HN GLY 58 5.275 8.093 17.567 468 HA2 GLY 58 HA2 GLY 58 8.029 8.127 17.619 469 HA3 GLY 58 HA1 GLY 58 7.605 6.444 17.316 470 H CYS 59 HN CYS 59 8.205 9.413 15.894 471 HA CYS 59 HA CYS 59 6.476 9.305 13.634 472 HB2 CYS 59 HB2 CYS 59 9.182 10.617 13.581 473 HB3 CYS 59 HB1 CYS 59 7.675 11.145 12.830 474 H ARG 60 HN ARG 60 6.867 8.582 11.538 475 HA ARG 60 HA ARG 60 9.271 6.902 11.130 476 HB2 ARG 60 HB2 ARG 60 7.232 5.527 11.698 477 HB3 ARG 60 HB1 ARG 60 6.490 6.139 10.220 478 HG2 ARG 60 HG2 ARG 60 8.453 5.267 8.932 479 HG3 ARG 60 HG1 ARG 60 9.062 4.548 10.423 480 HD2 ARG 60 HD2 ARG 60 6.970 3.241 10.634 481 HD3 ARG 60 HD1 ARG 60 6.393 3.936 9.123 482 HE ARG 60 HE ARG 60 8.240 1.773 9.387 483 HH11 ARG 60 HH21 ARG 60 7.464 4.586 7.527 484 HH12 ARG 60 HH22 ARG 60 8.183 3.989 6.069 485 HH21 ARG 60 HH11 ARG 60 9.185 0.984 7.477 486 HH22 ARG 60 HH12 ARG 60 9.157 1.950 6.040 487 H LYS 61 HN LYS 61 10.362 7.595 9.432 488 HA LYS 61 HA LYS 61 8.897 8.612 7.072 489 HB2 LYS 61 HB2 LYS 61 10.489 10.411 6.796 490 HB3 LYS 61 HB1 LYS 61 9.813 10.516 8.420 491 HG2 LYS 61 HG2 LYS 61 11.823 9.155 9.205 492 HG3 LYS 61 HG1 LYS 61 12.520 9.439 7.610 493 HD2 LYS 61 HD2 LYS 61 12.107 11.928 8.026 494 HD3 LYS 61 HD1 LYS 61 11.790 11.492 9.705 495 HE2 LYS 61 HE2 LYS 61 14.039 10.351 9.749 496 HE3 LYS 61 HE1 LYS 61 14.351 11.034 8.153 497 HZ1 LYS 61 HZ1 LYS 61 14.927 12.933 9.099 498 HZ2 LYS 61 HZ2 LYS 61 13.406 13.064 9.846 499 HZ3 LYS 61 HZ3 LYS 61 14.672 12.260 10.638 500 H TRP 62 HN TRP 62 9.580 7.747 5.185 501 HA TRP 62 HA TRP 62 12.296 6.826 4.845 502 HB2 TRP 62 HB2 TRP 62 12.041 4.564 4.992 503 HB3 TRP 62 HB1 TRP 62 10.738 5.008 6.089 504 HD1 TRP 62 HD1 TRP 62 8.381 5.690 4.364 505 HE1 TRP 62 HE1 TRP 62 7.318 4.012 2.718 506 HE3 TRP 62 HE3 TRP 62 12.297 2.477 3.734 507 HZ2 TRP 62 HZ2 TRP 62 8.047 1.624 1.313 508 HZ3 TRP 62 HZ3 TRP 62 12.088 0.511 2.242 509 HH2 TRP 62 HH2 TRP 62 9.968 0.078 1.033 510 H GLU 63 HN GLU 63 12.387 5.504 2.696 511 HA GLU 63 HA GLU 63 10.746 6.952 0.692 512 HB2 GLU 63 HB2 GLU 63 13.190 7.564 0.790 513 HB3 GLU 63 HB1 GLU 63 13.558 5.908 0.313 514 HG2 GLU 63 HG2 GLU 63 12.399 6.165 -1.777 515 HG3 GLU 63 HG1 GLU 63 11.726 7.717 -1.279 516 H THR 64 HN THR 64 10.394 5.817 -1.335 517 HA THR 64 HA THR 64 10.748 2.921 -1.347 518 HB THR 64 HB THR 64 7.951 3.906 -1.814 519 HG1 THR 64 HG1 THR 64 8.332 4.689 0.202 520 HG21 THR 64 HG21 THR 64 9.140 1.328 -0.756 521 HG22 THR 64 HG22 THR 64 7.425 1.619 -1.041 522 HG23 THR 64 HG23 THR 64 8.553 1.597 -2.395 523 H THR 65 HN THR 65 10.728 2.047 -3.397 524 HA THR 65 HA THR 65 10.520 3.990 -5.625 525 HB THR 65 HB THR 65 11.995 1.348 -5.565 526 HG1 THR 65 HG1 THR 65 12.924 4.011 -5.275 527 HG21 THR 65 HG21 THR 65 13.090 2.326 -7.591 528 HG22 THR 65 HG22 THR 65 11.364 2.039 -7.808 529 HG23 THR 65 HG23 THR 65 11.956 3.673 -7.506 530 H PHE 66 HN PHE 66 9.255 3.544 -7.387 531 HA PHE 66 HA PHE 66 7.460 1.183 -7.225 532 HB2 PHE 66 HB2 PHE 66 7.146 3.980 -8.291 533 HB3 PHE 66 HB1 PHE 66 6.044 2.723 -8.738 534 HD1 PHE 66 HD2 PHE 66 7.031 2.112 -5.349 535 HD2 PHE 66 HD1 PHE 66 4.562 4.666 -7.772 536 HE1 PHE 66 HE2 PHE 66 5.650 2.646 -3.381 537 HE2 PHE 66 HE1 PHE 66 3.187 5.201 -5.790 538 HZ PHE 66 HZ PHE 66 3.724 4.191 -3.600 539 H LYS 67 HN LYS 67 7.896 -0.354 -8.788 540 HA LYS 67 HA LYS 67 9.136 0.598 -11.312 541 HB2 LYS 67 HB2 LYS 67 9.546 -2.064 -9.940 542 HB3 LYS 67 HB1 LYS 67 10.362 -1.485 -11.392 543 HG2 LYS 67 HG2 LYS 67 11.144 0.502 -9.958 544 HG3 LYS 67 HG1 LYS 67 10.623 -0.449 -8.567 545 HD2 LYS 67 HD2 LYS 67 12.068 -2.334 -9.426 546 HD3 LYS 67 HD1 LYS 67 12.708 -1.210 -10.626 547 HE2 LYS 67 HE2 LYS 67 13.404 0.312 -8.776 548 HE3 LYS 67 HE1 LYS 67 12.855 -0.895 -7.613 549 HZ1 LYS 67 HZ1 LYS 67 14.890 -1.737 -7.782 550 HZ2 LYS 67 HZ2 LYS 67 14.439 -2.300 -9.320 551 HZ3 LYS 67 HZ3 LYS 67 15.258 -0.824 -9.166 552 H LYS 68 HN LYS 68 8.723 -0.548 -13.210 553 HA LYS 68 HA LYS 68 7.324 -1.468 -14.801 554 HB2 LYS 68 HB2 LYS 68 7.985 -3.543 -13.496 555 HB3 LYS 68 HB1 LYS 68 6.472 -3.370 -12.607 556 HG2 LYS 68 HG2 LYS 68 5.193 -3.522 -14.686 557 HG3 LYS 68 HG1 LYS 68 6.686 -3.601 -15.623 558 HD2 LYS 68 HD2 LYS 68 7.295 -5.689 -14.381 559 HD3 LYS 68 HD1 LYS 68 5.717 -5.634 -13.593 560 HE2 LYS 68 HE2 LYS 68 4.562 -5.961 -15.648 561 HE3 LYS 68 HE1 LYS 68 6.004 -5.612 -16.602 562 HZ1 LYS 68 HZ1 LYS 68 6.178 -7.832 -16.651 563 HZ2 LYS 68 HZ2 LYS 68 6.848 -7.651 -15.101 564 HZ3 LYS 68 HZ3 LYS 68 5.212 -8.060 -15.273 565 H THR 69 HN THR 69 6.318 0.698 -14.151 566 HA THR 69 HA THR 69 3.626 0.326 -13.091 567 HB THR 69 HB THR 69 3.808 2.624 -12.465 568 HG1 THR 69 HG1 THR 69 4.967 3.189 -14.431 569 HG21 THR 69 HG21 THR 69 5.273 0.651 -11.352 570 HG22 THR 69 HG22 THR 69 6.581 1.706 -11.878 571 HG23 THR 69 HG23 THR 69 5.357 2.313 -10.774 572 H SER 70 HN SER 70 2.986 -0.508 -15.248 573 HA SER 70 HA SER 70 1.834 1.619 -16.829 574 HB2 SER 70 HB2 SER 70 3.642 -0.302 -18.288 575 HB3 SER 70 HB1 SER 70 2.895 1.172 -18.896 576 HG SER 70 HG SER 70 5.270 0.953 -17.898 577 H ASP 71 HN ASP 71 1.518 -1.154 -15.325 578 HA ASP 71 HA ASP 71 0.467 -3.078 -16.985 579 HB2 ASP 71 HB2 ASP 71 -0.114 -2.240 -14.163 580 HB3 ASP 71 HB1 ASP 71 -1.058 -3.523 -14.906 581 H ASP 72 HN ASP 72 -1.818 -1.293 -14.983 582 HA ASP 72 HA ASP 72 -3.763 -1.362 -17.185 583 HB2 ASP 72 HB2 ASP 72 -4.032 -0.732 -14.241 584 HB3 ASP 72 HB1 ASP 72 -5.363 -0.623 -15.390 585 H GLY 73 HN GLY 73 -2.528 0.293 -18.358 586 HA2 GLY 73 HA2 GLY 73 -2.533 2.465 -19.169 587 HA3 GLY 73 HA1 GLY 73 -3.617 2.913 -17.849 588 H GLU 74 HN GLU 74 -2.761 3.601 -15.858 589 HA GLU 74 HA GLU 74 0.169 3.832 -15.701 590 HB2 GLU 74 HB2 GLU 74 -1.879 5.974 -15.082 591 HB3 GLU 74 HB1 GLU 74 -0.181 6.064 -14.615 592 HG2 GLU 74 HG2 GLU 74 -1.134 5.707 -17.470 593 HG3 GLU 74 HG1 GLU 74 -0.698 7.262 -16.766 594 H VAL 75 HN VAL 75 0.340 2.097 -14.154 595 HA VAL 75 HA VAL 75 -0.774 2.766 -11.527 596 HB VAL 75 HB VAL 75 -0.814 0.002 -12.768 597 HG11 VAL 75 HG11 VAL 75 -1.432 1.118 -10.037 598 HG12 VAL 75 HG12 VAL 75 -2.314 -0.295 -10.617 599 HG13 VAL 75 HG13 VAL 75 -0.558 -0.349 -10.470 600 HG21 VAL 75 HG21 VAL 75 -3.379 0.463 -12.359 601 HG22 VAL 75 HG22 VAL 75 -2.891 2.155 -12.451 602 HG23 VAL 75 HG23 VAL 75 -2.599 1.078 -13.814 603 H TYR 76 HN TYR 76 0.524 1.960 -9.801 604 HA TYR 76 HA TYR 76 3.294 1.353 -10.685 605 HB2 TYR 76 HB2 TYR 76 3.808 3.039 -9.257 606 HB3 TYR 76 HB1 TYR 76 2.177 3.041 -8.604 607 HD1 TYR 76 HD1 TYR 76 5.183 0.742 -8.518 608 HD2 TYR 76 HD2 TYR 76 2.018 2.615 -6.312 609 HE1 TYR 76 HE1 TYR 76 5.971 -0.344 -6.449 610 HE2 TYR 76 HE2 TYR 76 2.827 1.532 -4.237 611 HH TYR 76 HH TYR 76 4.128 -0.395 -3.568 612 H TYR 77 HN TYR 77 4.515 -0.433 -9.943 613 HA TYR 77 HA TYR 77 3.218 -2.089 -7.922 614 HB2 TYR 77 HB2 TYR 77 2.344 -3.046 -9.939 615 HB3 TYR 77 HB1 TYR 77 3.940 -3.046 -10.685 616 HD1 TYR 77 HD1 TYR 77 1.861 -4.579 -8.016 617 HD2 TYR 77 HD2 TYR 77 5.536 -4.775 -10.231 618 HE1 TYR 77 HE1 TYR 77 2.300 -6.835 -7.086 619 HE2 TYR 77 HE2 TYR 77 5.975 -7.031 -9.302 620 HH TYR 77 HH TYR 77 4.309 -8.973 -8.325 621 H SER 78 HN SER 78 4.630 -2.798 -6.429 622 HA SER 78 HA SER 78 7.506 -2.816 -7.141 623 HB2 SER 78 HB2 SER 78 6.016 -1.953 -4.755 624 HB3 SER 78 HB1 SER 78 7.411 -2.960 -4.392 625 HG SER 78 HG SER 78 7.429 -0.430 -4.964 626 H GLU 79 HN GLU 79 7.893 -4.828 -7.807 627 HA GLU 79 HA GLU 79 6.686 -7.204 -7.080 628 HB2 GLU 79 HB2 GLU 79 8.423 -6.860 -8.892 629 HB3 GLU 79 HB1 GLU 79 9.647 -6.961 -7.626 630 HG2 GLU 79 HG2 GLU 79 8.731 -9.187 -6.971 631 HG3 GLU 79 HG1 GLU 79 7.610 -9.093 -8.328 632 H GLU 80 HN GLU 80 9.176 -5.408 -5.375 633 HA GLU 80 HA GLU 80 9.659 -7.508 -3.442 634 HB2 GLU 80 HB2 GLU 80 10.552 -4.623 -3.546 635 HB3 GLU 80 HB1 GLU 80 11.082 -5.794 -2.340 636 HG2 GLU 80 HG2 GLU 80 12.766 -5.802 -4.032 637 HG3 GLU 80 HG1 GLU 80 11.823 -7.269 -4.286 638 H ALA 81 HN ALA 81 7.979 -4.360 -3.419 639 HA ALA 81 HA ALA 81 7.185 -4.722 -0.642 640 HB1 ALA 81 HB1 ALA 81 6.199 -2.524 -2.442 641 HB2 ALA 81 HB2 ALA 81 7.838 -2.501 -1.792 642 HB3 ALA 81 HB3 ALA 81 6.456 -2.499 -0.698 643 H LYS 82 HN LYS 82 6.029 -6.123 -3.327 644 HA LYS 82 HA LYS 82 3.883 -6.633 -4.146 645 HB2 LYS 82 HB2 LYS 82 3.869 -7.485 -1.242 646 HB3 LYS 82 HB1 LYS 82 2.719 -8.055 -2.453 647 HG2 LYS 82 HG2 LYS 82 4.656 -8.868 -3.824 648 HG3 LYS 82 HG1 LYS 82 5.727 -8.432 -2.492 649 HD2 LYS 82 HD2 LYS 82 4.410 -9.936 -0.995 650 HD3 LYS 82 HD1 LYS 82 3.453 -10.435 -2.389 651 HE2 LYS 82 HE2 LYS 82 6.469 -10.678 -2.280 652 HE3 LYS 82 HE1 LYS 82 5.376 -11.983 -1.819 653 HZ1 LYS 82 HZ1 LYS 82 6.245 -11.350 -4.362 654 HZ2 LYS 82 HZ2 LYS 82 5.051 -12.481 -3.938 655 HZ3 LYS 82 HZ3 LYS 82 4.611 -10.888 -4.312 656 H LYS 83 HN LYS 83 3.645 -4.113 -4.027 657 HA LYS 83 HA LYS 83 0.937 -3.642 -3.080 658 HB2 LYS 83 HB2 LYS 83 2.457 -3.051 -1.141 659 HB3 LYS 83 HB1 LYS 83 3.127 -1.774 -2.156 660 HG2 LYS 83 HG2 LYS 83 0.644 -1.054 -2.501 661 HG3 LYS 83 HG1 LYS 83 0.319 -2.048 -1.083 662 HD2 LYS 83 HD2 LYS 83 2.399 0.157 -1.135 663 HD3 LYS 83 HD1 LYS 83 0.745 0.390 -0.572 664 HE2 LYS 83 HE2 LYS 83 2.786 -1.531 0.584 665 HE3 LYS 83 HE1 LYS 83 2.166 -0.068 1.345 666 HZ1 LYS 83 HZ1 LYS 83 0.572 -1.314 2.202 667 HZ2 LYS 83 HZ2 LYS 83 -0.049 -1.533 0.636 668 HZ3 LYS 83 HZ3 LYS 83 1.034 -2.665 1.283 669 H LYS 84 HN LYS 84 -0.122 -2.377 -4.476 670 HA LYS 84 HA LYS 84 1.433 -0.643 -6.297 671 HB2 LYS 84 HB2 LYS 84 -0.376 -1.358 -8.036 672 HB3 LYS 84 HB1 LYS 84 0.963 -2.455 -7.710 673 HG2 LYS 84 HG2 LYS 84 -0.431 -3.714 -6.123 674 HG3 LYS 84 HG1 LYS 84 -1.771 -2.607 -6.421 675 HD2 LYS 84 HD2 LYS 84 -1.917 -3.288 -8.729 676 HD3 LYS 84 HD1 LYS 84 -0.435 -4.234 -8.595 677 HE2 LYS 84 HE2 LYS 84 -2.658 -5.528 -8.455 678 HE3 LYS 84 HE1 LYS 84 -1.462 -5.853 -7.200 679 HZ1 LYS 84 HZ1 LYS 84 -2.735 -4.932 -5.629 680 HZ2 LYS 84 HZ2 LYS 84 -3.251 -3.659 -6.629 681 HZ3 LYS 84 HZ3 LYS 84 -4.010 -5.173 -6.725 682 H VAL 85 HN VAL 85 0.433 1.184 -7.065 683 HA VAL 85 HA VAL 85 -2.216 1.798 -5.958 684 HB VAL 85 HB VAL 85 -1.646 3.760 -4.949 685 HG11 VAL 85 HG11 VAL 85 0.658 1.882 -4.584 686 HG12 VAL 85 HG12 VAL 85 0.490 3.347 -3.626 687 HG13 VAL 85 HG13 VAL 85 -0.754 2.101 -3.560 688 HG21 VAL 85 HG21 VAL 85 -0.376 5.300 -6.083 689 HG22 VAL 85 HG22 VAL 85 1.028 4.503 -5.399 690 HG23 VAL 85 HG23 VAL 85 0.449 4.056 -6.994 691 H GLU 86 HN GLU 86 -3.552 2.707 -7.314 692 HA GLU 86 HA GLU 86 -2.483 3.616 -9.931 693 HB2 GLU 86 HB2 GLU 86 -3.646 1.585 -10.317 694 HB3 GLU 86 HB1 GLU 86 -4.945 2.026 -9.217 695 HG2 GLU 86 HG2 GLU 86 -5.879 3.564 -10.727 696 HG3 GLU 86 HG1 GLU 86 -4.385 3.717 -11.648 697 H VAL 87 HN VAL 87 -2.960 5.561 -10.572 698 HA VAL 87 HA VAL 87 -4.249 7.471 -8.965 699 HB VAL 87 HB VAL 87 -2.839 8.347 -10.625 700 HG11 VAL 87 HG11 VAL 87 -2.596 6.531 -12.124 701 HG12 VAL 87 HG12 VAL 87 -4.317 6.497 -12.498 702 HG13 VAL 87 HG13 VAL 87 -3.310 7.814 -13.100 703 HG21 VAL 87 HG21 VAL 87 -5.162 9.466 -10.415 704 HG22 VAL 87 HG22 VAL 87 -4.191 9.881 -11.827 705 HG23 VAL 87 HG23 VAL 87 -5.517 8.727 -11.976 706 H LEU 88 HN LEU 88 -6.266 7.034 -8.239 707 HA LEU 88 HA LEU 88 -8.331 6.068 -10.075 708 HB2 LEU 88 HB2 LEU 88 -7.799 5.414 -7.509 709 HB3 LEU 88 HB1 LEU 88 -8.958 6.704 -7.227 710 HG LEU 88 HG LEU 88 -10.139 4.583 -7.334 711 HD11 LEU 88 HD11 LEU 88 -11.811 5.165 -8.894 712 HD12 LEU 88 HD12 LEU 88 -11.066 6.699 -8.449 713 HD13 LEU 88 HD13 LEU 88 -10.653 5.927 -9.982 714 HD21 LEU 88 HD21 LEU 88 -8.213 3.713 -9.038 715 HD22 LEU 88 HD22 LEU 88 -9.792 2.943 -8.902 716 HD23 LEU 88 HD23 LEU 88 -9.481 4.089 -10.203 717 H ASP 89 HN ASP 89 -7.233 9.009 -8.676 718 HA ASP 89 HA ASP 89 -8.866 10.658 -10.176 719 HB2 ASP 89 HB2 ASP 89 -10.429 9.624 -8.163 720 HB3 ASP 89 HB1 ASP 89 -9.783 11.064 -7.389 721 H THR 90 HN THR 90 -7.637 12.439 -10.315 722 HA THR 90 HA THR 90 -6.325 13.518 -7.946 723 HB THR 90 HB THR 90 -4.990 11.655 -9.466 724 HG1 THR 90 HG1 THR 90 -4.307 13.568 -7.622 725 HG21 THR 90 HG21 THR 90 -3.990 14.385 -10.331 726 HG22 THR 90 HG22 THR 90 -3.268 12.829 -10.738 727 HG23 THR 90 HG23 THR 90 -4.858 13.251 -11.367 728 H ASP 91 HN ASP 91 -6.308 15.671 -8.017 729 HA ASP 91 HA ASP 91 -6.458 17.029 -10.661 730 HB2 ASP 91 HB2 ASP 91 -8.754 16.815 -9.627 731 HB3 ASP 91 HB1 ASP 91 -8.174 17.818 -8.299 732 H TYR 92 HN TYR 92 -5.412 16.841 -7.456 733 HA TYR 92 HA TYR 92 -4.001 18.056 -6.141 734 HB2 TYR 92 HB2 TYR 92 -2.969 19.275 -8.695 735 HB3 TYR 92 HB1 TYR 92 -2.090 18.981 -7.200 736 HD1 TYR 92 HD2 TYR 92 -2.865 16.189 -6.539 737 HD2 TYR 92 HD1 TYR 92 -1.910 17.980 -10.330 738 HE1 TYR 92 HE2 TYR 92 -2.141 13.988 -7.399 739 HE2 TYR 92 HE1 TYR 92 -1.194 15.770 -11.188 740 HH TYR 92 HH TYR 92 -0.289 13.564 -10.041 741 H LYS 93 HN LYS 93 -6.429 19.459 -7.828 742 HA LYS 93 HA LYS 93 -5.815 22.234 -7.456 743 HB2 LYS 93 HB2 LYS 93 -7.419 21.402 -9.173 744 HB3 LYS 93 HB1 LYS 93 -8.512 20.920 -7.875 745 HG2 LYS 93 HG2 LYS 93 -8.727 23.211 -7.119 746 HG3 LYS 93 HG1 LYS 93 -7.486 23.746 -8.252 747 HD2 LYS 93 HD2 LYS 93 -9.678 24.269 -9.177 748 HD3 LYS 93 HD1 LYS 93 -8.938 22.991 -10.138 749 HE2 LYS 93 HE2 LYS 93 -10.346 21.333 -9.252 750 HE3 LYS 93 HE1 LYS 93 -10.750 22.298 -7.832 751 HZ1 LYS 93 HZ1 LYS 93 -11.463 23.599 -10.274 752 HZ2 LYS 93 HZ2 LYS 93 -12.231 22.093 -10.110 753 HZ3 LYS 93 HZ3 LYS 93 -12.415 23.272 -8.905 754 H SER 94 HN SER 94 -7.594 19.774 -5.703 755 HA SER 94 HA SER 94 -7.383 21.314 -3.254 756 HB2 SER 94 HB2 SER 94 -9.851 21.070 -2.802 757 HB3 SER 94 HB1 SER 94 -9.449 22.233 -4.061 758 HG SER 94 HG SER 94 -10.934 21.030 -5.040 759 H TYR 95 HN TYR 95 -7.932 18.393 -5.033 760 HA TYR 95 HA TYR 95 -7.131 16.799 -2.812 761 HB2 TYR 95 HB2 TYR 95 -9.232 15.518 -2.576 762 HB3 TYR 95 HB1 TYR 95 -9.410 17.203 -2.090 763 HD1 TYR 95 HD1 TYR 95 -10.027 14.796 -4.856 764 HD2 TYR 95 HD2 TYR 95 -10.886 18.685 -3.246 765 HE1 TYR 95 HE1 TYR 95 -11.829 15.095 -6.535 766 HE2 TYR 95 HE2 TYR 95 -12.689 18.982 -4.922 767 HH TYR 95 HH TYR 95 -13.932 16.439 -6.752 768 H ALA 96 HN ALA 96 -7.314 14.474 -3.248 769 HA ALA 96 HA ALA 96 -7.608 13.656 -6.026 770 HB1 ALA 96 HB1 ALA 96 -4.965 13.442 -4.559 771 HB2 ALA 96 HB2 ALA 96 -5.278 14.354 -6.031 772 HB3 ALA 96 HB3 ALA 96 -5.345 12.592 -6.052 773 H VAL 97 HN VAL 97 -8.171 11.519 -6.190 774 HA VAL 97 HA VAL 97 -8.252 9.980 -3.634 775 HB VAL 97 HB VAL 97 -10.243 9.519 -5.846 776 HG11 VAL 97 HG11 VAL 97 -9.883 7.967 -3.848 777 HG12 VAL 97 HG12 VAL 97 -10.538 9.266 -2.851 778 HG13 VAL 97 HG13 VAL 97 -11.534 8.530 -4.108 779 HG21 VAL 97 HG21 VAL 97 -10.371 11.931 -5.313 780 HG22 VAL 97 HG22 VAL 97 -11.784 11.078 -4.696 781 HG23 VAL 97 HG23 VAL 97 -10.485 11.545 -3.598 782 H ILE 98 HN ILE 98 -7.209 8.043 -3.680 783 HA ILE 98 HA ILE 98 -6.489 6.964 -6.331 784 HB ILE 98 HB ILE 98 -4.662 8.187 -5.285 785 HG12 ILE 98 HG12 ILE 98 -4.220 5.211 -4.956 786 HG13 ILE 98 HG11 ILE 98 -4.198 6.047 -6.512 787 HG21 ILE 98 HG21 ILE 98 -5.011 6.259 -2.976 788 HG22 ILE 98 HG22 ILE 98 -3.796 7.529 -3.105 789 HG23 ILE 98 HG23 ILE 98 -5.501 7.953 -2.948 790 HD11 ILE 98 HD11 ILE 98 -2.539 7.474 -4.608 791 HD12 ILE 98 HD12 ILE 98 -2.056 5.796 -4.689 792 HD13 ILE 98 HD13 ILE 98 -2.098 6.754 -6.161 793 H TYR 99 HN TYR 99 -6.330 4.766 -6.502 794 HA TYR 99 HA TYR 99 -7.692 3.198 -4.414 795 HB2 TYR 99 HB2 TYR 99 -8.452 3.062 -6.798 796 HB3 TYR 99 HB1 TYR 99 -6.887 2.364 -7.212 797 HD1 TYR 99 HD1 TYR 99 -9.976 1.860 -5.211 798 HD2 TYR 99 HD2 TYR 99 -6.367 0.081 -6.714 799 HE1 TYR 99 HE1 TYR 99 -10.793 -0.378 -4.526 800 HE2 TYR 99 HE2 TYR 99 -7.185 -2.157 -6.028 801 HH TYR 99 HH TYR 99 -10.311 -2.835 -5.329 802 H ALA 100 HN ALA 100 -6.307 2.535 -2.897 803 HA ALA 100 HA ALA 100 -3.664 1.478 -3.707 804 HB1 ALA 100 HB1 ALA 100 -3.237 1.682 -1.170 805 HB2 ALA 100 HB2 ALA 100 -4.709 2.653 -1.139 806 HB3 ALA 100 HB3 ALA 100 -3.331 3.173 -2.106 807 H THR 101 HN THR 101 -3.169 -0.605 -3.416 808 HA THR 101 HA THR 101 -4.808 -2.273 -1.641 809 HB THR 101 HB THR 101 -6.018 -2.824 -3.532 810 HG1 THR 101 HG1 THR 101 -5.126 -4.760 -4.355 811 HG21 THR 101 HG21 THR 101 -3.494 -2.108 -4.994 812 HG22 THR 101 HG22 THR 101 -4.740 -3.062 -5.797 813 HG23 THR 101 HG23 THR 101 -5.117 -1.449 -5.192 814 H ARG 102 HN ARG 102 -3.687 -3.794 -0.631 815 HA ARG 102 HA ARG 102 -0.918 -4.366 -1.517 816 HB2 ARG 102 HB2 ARG 102 -1.123 -2.965 0.587 817 HB3 ARG 102 HB1 ARG 102 -1.891 -4.362 1.341 818 HG2 ARG 102 HG2 ARG 102 0.168 -5.701 0.591 819 HG3 ARG 102 HG1 ARG 102 0.925 -4.143 0.269 820 HD2 ARG 102 HD2 ARG 102 0.255 -3.515 2.674 821 HD3 ARG 102 HD1 ARG 102 -0.053 -5.233 2.909 822 HE ARG 102 HE ARG 102 2.554 -4.703 1.799 823 HH11 ARG 102 HH21 ARG 102 0.630 -4.862 4.670 824 HH12 ARG 102 HH22 ARG 102 1.970 -5.193 5.716 825 HH21 ARG 102 HH11 ARG 102 4.317 -5.137 3.164 826 HH22 ARG 102 HH12 ARG 102 4.057 -5.348 4.863 827 H VAL 103 HN VAL 103 -0.470 -6.572 -1.846 828 HA VAL 103 HA VAL 103 -2.494 -8.444 -0.768 829 HB VAL 103 HB VAL 103 -2.630 -8.230 -3.205 830 HG11 VAL 103 HG11 VAL 103 0.168 -9.330 -3.423 831 HG12 VAL 103 HG12 VAL 103 -0.802 -8.514 -4.647 832 HG13 VAL 103 HG13 VAL 103 -0.099 -7.589 -3.321 833 HG21 VAL 103 HG21 VAL 103 -2.988 -10.451 -2.120 834 HG22 VAL 103 HG22 VAL 103 -2.368 -10.594 -3.762 835 HG23 VAL 103 HG23 VAL 103 -1.287 -10.829 -2.390 836 H LYS 104 HN LYS 104 -1.707 -9.678 0.789 837 HA LYS 104 HA LYS 104 1.172 -10.243 0.891 838 HB2 LYS 104 HB2 LYS 104 -0.269 -9.313 2.876 839 HB3 LYS 104 HB1 LYS 104 -0.816 -10.981 3.031 840 HG2 LYS 104 HG2 LYS 104 1.493 -11.751 3.284 841 HG3 LYS 104 HG1 LYS 104 2.091 -10.111 3.032 842 HD2 LYS 104 HD2 LYS 104 0.645 -9.438 5.039 843 HD3 LYS 104 HD1 LYS 104 0.477 -11.164 5.359 844 HE2 LYS 104 HE2 LYS 104 2.340 -10.488 6.668 845 HE3 LYS 104 HE1 LYS 104 3.044 -11.267 5.251 846 HZ1 LYS 104 HZ1 LYS 104 4.078 -9.392 4.756 847 HZ2 LYS 104 HZ2 LYS 104 2.601 -8.556 4.674 848 HZ3 LYS 104 HZ3 LYS 104 3.438 -8.656 6.146 849 H ASP 105 HN ASP 105 1.663 -12.538 1.713 850 HA ASP 105 HA ASP 105 0.811 -14.384 -0.196 851 HB2 ASP 105 HB2 ASP 105 1.896 -16.077 1.173 852 HB3 ASP 105 HB1 ASP 105 2.878 -14.613 1.153 853 H GLY 106 HN GLY 106 -1.198 -15.027 -0.484 854 HA2 GLY 106 HA2 GLY 106 -3.080 -16.318 -0.048 855 HA3 GLY 106 HA1 GLY 106 -2.596 -16.413 1.638 856 H ARG 107 HN ARG 107 -2.475 -13.187 1.003 857 HA ARG 107 HA ARG 107 -5.364 -12.777 1.529 858 HB2 ARG 107 HB2 ARG 107 -3.098 -11.432 3.011 859 HB3 ARG 107 HB1 ARG 107 -4.821 -11.143 3.254 860 HG2 ARG 107 HG2 ARG 107 -5.127 -13.506 3.904 861 HG3 ARG 107 HG1 ARG 107 -3.400 -13.789 3.676 862 HD2 ARG 107 HD2 ARG 107 -3.009 -11.914 5.363 863 HD3 ARG 107 HD1 ARG 107 -4.731 -12.005 5.723 864 HE ARG 107 HE ARG 107 -2.700 -13.934 6.479 865 HH11 ARG 107 HH21 ARG 107 -6.051 -13.304 5.885 866 HH12 ARG 107 HH22 ARG 107 -6.614 -14.601 6.885 867 HH21 ARG 107 HH11 ARG 107 -3.430 -15.637 7.791 868 HH22 ARG 107 HH12 ARG 107 -5.130 -15.922 7.964 869 H THR 108 HN THR 108 -6.297 -11.037 0.641 870 HA THR 108 HA THR 108 -4.613 -9.207 -0.978 871 HB THR 108 HB THR 108 -7.468 -10.056 -1.526 872 HG1 THR 108 HG1 THR 108 -6.122 -11.775 -1.919 873 HG21 THR 108 HG21 THR 108 -6.978 -7.855 -2.406 874 HG22 THR 108 HG22 THR 108 -5.443 -8.415 -3.069 875 HG23 THR 108 HG23 THR 108 -6.961 -8.999 -3.748 876 H LEU 109 HN LEU 109 -5.318 -6.967 -1.049 877 HA LEU 109 HA LEU 109 -7.440 -6.206 0.827 878 HB2 LEU 109 HB2 LEU 109 -5.381 -6.323 2.163 879 HB3 LEU 109 HB1 LEU 109 -4.613 -5.181 1.087 880 HG LEU 109 HG LEU 109 -6.350 -3.504 1.661 881 HD11 LEU 109 HD11 LEU 109 -8.280 -4.652 2.307 882 HD12 LEU 109 HD12 LEU 109 -7.385 -5.819 3.281 883 HD13 LEU 109 HD13 LEU 109 -7.633 -4.176 3.874 884 HD21 LEU 109 HD21 LEU 109 -5.419 -2.944 3.775 885 HD22 LEU 109 HD22 LEU 109 -5.137 -4.636 4.181 886 HD23 LEU 109 HD23 LEU 109 -4.154 -3.850 2.944 887 H HIS 110 HN HIS 110 -8.240 -4.190 0.571 888 HA HIS 110 HA HIS 110 -7.107 -2.492 -1.516 889 HB2 HIS 110 HB2 HIS 110 -9.290 -2.142 -2.569 890 HB3 HIS 110 HB1 HIS 110 -8.875 -3.856 -2.605 891 HD1 HIS 110 HD1 HIS 110 -10.164 -5.440 -0.968 892 HD2 HIS 110 HD2 HIS 110 -11.501 -1.490 -0.922 893 HE1 HIS 110 HE1 HIS 110 -12.377 -5.446 0.264 894 H MET 111 HN MET 111 -7.479 -0.254 -1.192 895 HA MET 111 HA MET 111 -9.283 0.611 0.887 896 HB2 MET 111 HB2 MET 111 -7.270 1.834 2.028 897 HB3 MET 111 HB1 MET 111 -7.594 0.149 2.430 898 HG2 MET 111 HG2 MET 111 -5.904 -0.588 0.811 899 HG3 MET 111 HG1 MET 111 -5.600 1.085 0.347 900 HE1 MET 111 HE1 MET 111 -5.588 2.620 3.458 901 HE2 MET 111 HE2 MET 111 -3.878 2.773 3.069 902 HE3 MET 111 HE3 MET 111 -5.090 2.846 1.783 903 H MET 112 HN MET 112 -9.629 2.866 0.844 904 HA MET 112 HA MET 112 -8.574 4.212 -1.578 905 HB2 MET 112 HB2 MET 112 -11.076 3.857 -1.356 906 HB3 MET 112 HB1 MET 112 -11.032 4.967 0.010 907 HG2 MET 112 HG2 MET 112 -11.573 6.333 -1.847 908 HG3 MET 112 HG1 MET 112 -9.855 6.613 -1.569 909 HE1 MET 112 HE1 MET 112 -11.977 4.436 -4.925 910 HE2 MET 112 HE2 MET 112 -12.559 4.839 -3.313 911 HE3 MET 112 HE3 MET 112 -12.265 6.120 -4.498 912 H ARG 113 HN ARG 113 -7.694 6.277 -1.421 913 HA ARG 113 HA ARG 113 -7.362 7.377 1.304 914 HB2 ARG 113 HB2 ARG 113 -5.247 7.018 -0.809 915 HB3 ARG 113 HB1 ARG 113 -5.047 8.055 0.602 916 HG2 ARG 113 HG2 ARG 113 -5.450 6.133 2.085 917 HG3 ARG 113 HG1 ARG 113 -5.670 5.088 0.680 918 HD2 ARG 113 HD2 ARG 113 -3.400 5.307 0.025 919 HD3 ARG 113 HD1 ARG 113 -3.145 6.695 1.078 920 HE ARG 113 HE ARG 113 -3.055 3.904 1.847 921 HH11 ARG 113 HH21 ARG 113 -3.537 7.183 2.842 922 HH12 ARG 113 HH22 ARG 113 -3.090 6.893 4.491 923 HH21 ARG 113 HH11 ARG 113 -2.468 3.517 4.007 924 HH22 ARG 113 HH12 ARG 113 -2.486 4.818 5.150 925 H LEU 114 HN LEU 114 -7.786 9.481 1.517 926 HA LEU 114 HA LEU 114 -8.232 11.067 -0.931 927 HB2 LEU 114 HB2 LEU 114 -10.255 10.909 0.320 928 HB3 LEU 114 HB1 LEU 114 -9.424 11.209 1.836 929 HG LEU 114 HG LEU 114 -8.855 13.520 1.008 930 HD11 LEU 114 HD11 LEU 114 -10.366 14.264 -0.953 931 HD12 LEU 114 HD12 LEU 114 -8.925 13.327 -1.346 932 HD13 LEU 114 HD13 LEU 114 -10.505 12.545 -1.324 933 HD21 LEU 114 HD21 LEU 114 -10.697 13.502 2.453 934 HD22 LEU 114 HD22 LEU 114 -11.342 14.299 1.021 935 HD23 LEU 114 HD23 LEU 114 -11.703 12.600 1.322 936 H TYR 115 HN TYR 115 -6.913 12.627 -1.355 937 HA TYR 115 HA TYR 115 -5.029 13.610 0.686 938 HB2 TYR 115 HB2 TYR 115 -4.959 13.650 -2.332 939 HB3 TYR 115 HB1 TYR 115 -3.779 14.479 -1.328 940 HD1 TYR 115 HD1 TYR 115 -5.388 11.074 -1.516 941 HD2 TYR 115 HD2 TYR 115 -1.784 13.352 -0.964 942 HE1 TYR 115 HE1 TYR 115 -4.091 8.980 -1.308 943 HE2 TYR 115 HE2 TYR 115 -0.492 11.250 -0.760 944 HH TYR 115 HH TYR 115 -2.109 8.081 -0.951 945 H SER 116 HN SER 116 -4.469 15.865 0.647 946 HA SER 116 HA SER 116 -6.491 17.691 -0.497 947 HB2 SER 116 HB2 SER 116 -7.064 17.438 1.872 948 HB3 SER 116 HB1 SER 116 -5.395 17.774 2.334 949 HG SER 116 HG SER 116 -5.721 19.812 1.151 950 H ARG 117 HN ARG 117 -5.572 19.524 -1.422 951 HA ARG 117 HA ARG 117 -2.739 19.547 -1.759 952 HB2 ARG 117 HB2 ARG 117 -4.547 20.419 -3.368 953 HB3 ARG 117 HB1 ARG 117 -4.599 21.849 -2.346 954 HG2 ARG 117 HG2 ARG 117 -3.046 22.299 -4.142 955 HG3 ARG 117 HG1 ARG 117 -2.111 22.087 -2.664 956 HD2 ARG 117 HD2 ARG 117 -2.591 19.622 -4.274 957 HD3 ARG 117 HD1 ARG 117 -1.504 20.816 -4.975 958 HE ARG 117 HE ARG 117 -0.970 19.153 -2.687 959 HH11 ARG 117 HH21 ARG 117 -0.345 22.183 -4.238 960 HH12 ARG 117 HH22 ARG 117 1.204 22.401 -3.495 961 HH21 ARG 117 HH11 ARG 117 1.059 19.432 -1.709 962 HH22 ARG 117 HH12 ARG 117 1.999 20.844 -2.063 963 H SER 118 HN SER 118 -4.856 20.760 0.616 964 HA SER 118 HA SER 118 -2.642 22.224 1.884 965 HB2 SER 118 HB2 SER 118 -3.948 23.954 0.806 966 HB3 SER 118 HB1 SER 118 -5.443 23.285 1.454 967 HG SER 118 HG SER 118 -3.899 25.077 2.560 968 HA PRO 119 HA PRO 119 -3.547 19.943 5.570 969 HB2 PRO 119 HB2 PRO 119 -3.847 22.676 6.785 970 HB3 PRO 119 HB1 PRO 119 -2.964 21.266 7.401 971 HG2 PRO 119 HG2 PRO 119 -1.726 23.311 6.167 972 HG3 PRO 119 HG1 PRO 119 -1.152 21.640 6.051 973 HD2 PRO 119 HD2 PRO 119 -2.378 23.320 3.962 974 HD3 PRO 119 HD1 PRO 119 -1.465 21.805 3.793 975 H GLU 120 HN GLU 120 -5.653 22.461 4.396 976 HA GLU 120 HA GLU 120 -7.865 21.720 6.128 977 HB2 GLU 120 HB2 GLU 120 -7.896 23.605 3.771 978 HB3 GLU 120 HB1 GLU 120 -9.034 23.540 5.117 979 HG2 GLU 120 HG2 GLU 120 -7.165 24.124 6.670 980 HG3 GLU 120 HG1 GLU 120 -6.108 24.313 5.273 981 H VAL 121 HN VAL 121 -9.919 21.143 5.230 982 HA VAL 121 HA VAL 121 -9.716 19.497 2.770 983 HB VAL 121 HB VAL 121 -11.668 18.214 3.911 984 HG11 VAL 121 HG11 VAL 121 -8.769 18.132 4.752 985 HG12 VAL 121 HG12 VAL 121 -9.934 16.947 5.343 986 HG13 VAL 121 HG13 VAL 121 -9.612 17.080 3.614 987 HG21 VAL 121 HG21 VAL 121 -11.693 18.328 6.341 988 HG22 VAL 121 HG22 VAL 121 -10.370 19.494 6.337 989 HG23 VAL 121 HG23 VAL 121 -11.950 19.952 5.704 990 H SER 122 HN SER 122 -11.187 19.825 1.205 991 HA SER 122 HA SER 122 -13.121 21.994 1.597 992 HB2 SER 122 HB2 SER 122 -13.358 21.748 -0.933 993 HB3 SER 122 HB1 SER 122 -11.801 22.320 -0.339 994 HG SER 122 HG SER 122 -12.468 19.989 -1.623 995 HA PRO 123 HA PRO 123 -16.606 19.267 2.240 996 HB2 PRO 123 HB2 PRO 123 -17.859 21.098 0.211 997 HB3 PRO 123 HB1 PRO 123 -18.518 20.507 1.750 998 HG2 PRO 123 HG2 PRO 123 -17.503 22.972 1.506 999 HG3 PRO 123 HG1 PRO 123 -17.339 22.031 2.999 1000 HD2 PRO 123 HD2 PRO 123 -15.257 22.747 1.015 1001 HD3 PRO 123 HD1 PRO 123 -15.076 22.246 2.712 1002 H ALA 124 HN ALA 124 -15.488 20.167 -0.971 1003 HA ALA 124 HA ALA 124 -16.896 18.066 -2.349 1004 HB1 ALA 124 HB1 ALA 124 -15.384 18.721 -4.253 1005 HB2 ALA 124 HB2 ALA 124 -14.641 19.902 -3.175 1006 HB3 ALA 124 HB3 ALA 124 -16.349 20.043 -3.596 1007 H ALA 125 HN ALA 125 -13.717 18.495 -0.932 1008 HA ALA 125 HA ALA 125 -12.462 16.233 -2.097 1009 HB1 ALA 125 HB1 ALA 125 -11.871 17.572 0.550 1010 HB2 ALA 125 HB2 ALA 125 -11.243 18.099 -1.010 1011 HB3 ALA 125 HB3 ALA 125 -10.781 16.525 -0.357 1012 H THR 126 HN THR 126 -14.076 16.718 1.011 1013 HA THR 126 HA THR 126 -13.714 13.986 1.843 1014 HB THR 126 HB THR 126 -15.854 15.621 3.117 1015 HG1 THR 126 HG1 THR 126 -14.301 17.181 2.612 1016 HG21 THR 126 HG21 THR 126 -13.425 14.191 4.248 1017 HG22 THR 126 HG22 THR 126 -14.834 14.755 5.148 1018 HG23 THR 126 HG23 THR 126 -14.993 13.423 4.002 1019 H ALA 127 HN ALA 127 -16.217 15.807 0.188 1020 HA ALA 127 HA ALA 127 -18.275 13.852 0.461 1021 HB1 ALA 127 HB1 ALA 127 -19.381 15.245 -1.270 1022 HB2 ALA 127 HB2 ALA 127 -17.903 16.203 -1.371 1023 HB3 ALA 127 HB3 ALA 127 -18.821 16.152 0.135 1024 H ILE 128 HN ILE 128 -16.178 14.767 -2.318 1025 HA ILE 128 HA ILE 128 -17.284 12.884 -4.108 1026 HB ILE 128 HB ILE 128 -15.579 14.886 -4.443 1027 HG12 ILE 128 HG12 ILE 128 -16.553 13.706 -6.297 1028 HG13 ILE 128 HG11 ILE 128 -14.819 13.814 -6.558 1029 HG21 ILE 128 HG21 ILE 128 -13.802 13.768 -3.042 1030 HG22 ILE 128 HG22 ILE 128 -13.652 12.551 -4.311 1031 HG23 ILE 128 HG23 ILE 128 -13.273 14.238 -4.656 1032 HD11 ILE 128 HD11 ILE 128 -16.444 11.418 -5.735 1033 HD12 ILE 128 HD12 ILE 128 -15.301 11.563 -7.067 1034 HD13 ILE 128 HD13 ILE 128 -14.712 11.485 -5.409 1035 H PHE 129 HN PHE 129 -14.844 12.883 -1.728 1036 HA PHE 129 HA PHE 129 -13.733 10.324 -2.054 1037 HB2 PHE 129 HB2 PHE 129 -12.689 12.040 -0.700 1038 HB3 PHE 129 HB1 PHE 129 -14.066 12.059 0.396 1039 HD1 PHE 129 HD1 PHE 129 -12.149 9.190 -1.150 1040 HD2 PHE 129 HD2 PHE 129 -13.363 11.199 2.451 1041 HE1 PHE 129 HE1 PHE 129 -11.139 7.384 0.199 1042 HE2 PHE 129 HE2 PHE 129 -12.337 9.393 3.791 1043 HZ PHE 129 HZ PHE 129 -11.225 7.485 2.671 1044 H ARG 130 HN ARG 130 -16.390 11.484 -0.003 1045 HA ARG 130 HA ARG 130 -16.983 8.984 1.200 1046 HB2 ARG 130 HB2 ARG 130 -17.728 11.208 2.068 1047 HB3 ARG 130 HB1 ARG 130 -18.866 11.306 0.725 1048 HG2 ARG 130 HG2 ARG 130 -19.921 9.194 1.480 1049 HG3 ARG 130 HG1 ARG 130 -18.804 9.135 2.843 1050 HD2 ARG 130 HD2 ARG 130 -19.669 11.326 3.621 1051 HD3 ARG 130 HD1 ARG 130 -20.818 11.331 2.285 1052 HE ARG 130 HE ARG 130 -21.299 8.958 3.572 1053 HH11 ARG 130 HH21 ARG 130 -21.114 12.290 4.489 1054 HH12 ARG 130 HH22 ARG 130 -22.270 12.145 5.770 1055 HH21 ARG 130 HH11 ARG 130 -22.817 8.760 5.250 1056 HH22 ARG 130 HH12 ARG 130 -23.234 10.147 6.201 1057 H LYS 131 HN LYS 131 -18.023 10.553 -1.766 1058 HA LYS 131 HA LYS 131 -20.206 8.908 -2.414 1059 HB2 LYS 131 HB2 LYS 131 -19.569 11.026 -3.594 1060 HB3 LYS 131 HB1 LYS 131 -18.248 10.143 -4.361 1061 HG2 LYS 131 HG2 LYS 131 -19.899 8.535 -5.298 1062 HG3 LYS 131 HG1 LYS 131 -21.201 9.489 -4.587 1063 HD2 LYS 131 HD2 LYS 131 -20.446 11.460 -5.899 1064 HD3 LYS 131 HD1 LYS 131 -19.203 10.460 -6.650 1065 HE2 LYS 131 HE2 LYS 131 -21.299 10.697 -8.031 1066 HE3 LYS 131 HE1 LYS 131 -20.868 9.028 -7.660 1067 HZ1 LYS 131 HZ1 LYS 131 -22.571 8.814 -6.174 1068 HZ2 LYS 131 HZ2 LYS 131 -22.648 10.477 -5.832 1069 HZ3 LYS 131 HZ3 LYS 131 -23.284 9.881 -7.287 1070 H LEU 132 HN LEU 132 -16.779 8.631 -3.336 1071 HA LEU 132 HA LEU 132 -16.994 6.231 -4.785 1072 HB2 LEU 132 HB2 LEU 132 -14.793 7.737 -3.442 1073 HB3 LEU 132 HB1 LEU 132 -14.472 6.064 -3.876 1074 HG LEU 132 HG LEU 132 -13.851 7.831 -5.617 1075 HD11 LEU 132 HD11 LEU 132 -14.306 6.377 -7.398 1076 HD12 LEU 132 HD12 LEU 132 -14.350 5.305 -6.001 1077 HD13 LEU 132 HD13 LEU 132 -15.854 5.873 -6.727 1078 HD21 LEU 132 HD21 LEU 132 -16.174 8.999 -5.181 1079 HD22 LEU 132 HD22 LEU 132 -15.492 8.984 -6.804 1080 HD23 LEU 132 HD23 LEU 132 -16.763 7.842 -6.374 1081 H ALA 133 HN ALA 133 -16.123 6.782 -1.370 1082 HA ALA 133 HA ALA 133 -15.790 4.067 -0.721 1083 HB1 ALA 133 HB1 ALA 133 -15.645 4.734 1.501 1084 HB2 ALA 133 HB2 ALA 133 -16.814 6.039 1.295 1085 HB3 ALA 133 HB3 ALA 133 -15.184 6.202 0.642 1086 H GLY 134 HN GLY 134 -18.713 6.093 -0.900 1087 HA2 GLY 134 HA2 GLY 134 -20.413 4.275 0.471 1088 HA3 GLY 134 HA1 GLY 134 -20.919 5.559 -0.627 1089 H GLU 135 HN GLU 135 -19.483 4.745 -2.914 1090 HA GLU 135 HA GLU 135 -21.269 2.936 -4.100 1091 HB2 GLU 135 HB2 GLU 135 -18.470 3.795 -4.853 1092 HB3 GLU 135 HB1 GLU 135 -19.419 2.691 -5.848 1093 HG2 GLU 135 HG2 GLU 135 -21.229 4.383 -5.972 1094 HG3 GLU 135 HG1 GLU 135 -20.237 5.493 -5.029 1095 H ARG 136 HN ARG 136 -18.418 2.487 -2.181 1096 HA ARG 136 HA ARG 136 -18.280 -0.380 -2.793 1097 HB2 ARG 136 HB2 ARG 136 -16.263 1.304 -2.444 1098 HB3 ARG 136 HB1 ARG 136 -16.553 0.970 -0.740 1099 HG2 ARG 136 HG2 ARG 136 -15.023 -0.709 -1.268 1100 HG3 ARG 136 HG1 ARG 136 -16.547 -1.553 -1.535 1101 HD2 ARG 136 HD2 ARG 136 -16.415 -1.055 -3.942 1102 HD3 ARG 136 HD1 ARG 136 -14.921 -0.161 -3.685 1103 HE ARG 136 HE ARG 136 -14.503 -2.709 -2.644 1104 HH11 ARG 136 HH21 ARG 136 -15.291 -1.225 -5.670 1105 HH12 ARG 136 HH22 ARG 136 -14.516 -2.443 -6.627 1106 HH21 ARG 136 HH11 ARG 136 -13.484 -4.310 -3.894 1107 HH22 ARG 136 HH12 ARG 136 -13.493 -4.189 -5.621 1108 H ASN 137 HN ASN 137 -20.204 1.446 -1.031 1109 HA ASN 137 HA ASN 137 -21.628 1.106 0.746 1110 HB2 ASN 137 HB2 ASN 137 -20.523 -1.663 0.616 1111 HB3 ASN 137 HB1 ASN 137 -22.005 -1.196 1.435 1112 HD21 ASN 137 HD21 ASN 137 -20.758 -2.321 -1.536 1113 HD22 ASN 137 HD22 ASN 137 -22.115 -1.984 -2.496 1114 H TYR 138 HN TYR 138 -19.078 2.106 1.314 1115 HA TYR 138 HA TYR 138 -18.096 0.781 3.722 1116 HB2 TYR 138 HB2 TYR 138 -17.189 3.093 2.053 1117 HB3 TYR 138 HB1 TYR 138 -16.669 3.034 3.729 1118 HD1 TYR 138 HD1 TYR 138 -17.304 0.182 1.417 1119 HD2 TYR 138 HD2 TYR 138 -14.388 2.472 3.570 1120 HE1 TYR 138 HE1 TYR 138 -15.571 -1.496 0.842 1121 HE2 TYR 138 HE2 TYR 138 -12.646 0.799 2.990 1122 HH TYR 138 HH TYR 138 -12.728 -1.206 0.662 1123 H THR 139 HN THR 139 -18.752 1.225 5.713 1124 HA THR 139 HA THR 139 -20.657 3.377 6.187 1125 HB THR 139 HB THR 139 -21.260 2.223 8.074 1126 HG1 THR 139 HG1 THR 139 -18.851 1.008 8.628 1127 HG21 THR 139 HG21 THR 139 -19.562 -0.047 7.063 1128 HG22 THR 139 HG22 THR 139 -21.199 -0.091 7.716 1129 HG23 THR 139 HG23 THR 139 -20.913 0.545 6.096 1130 H ASP 140 HN ASP 140 -20.306 4.998 7.868 1131 HA ASP 140 HA ASP 140 -18.109 6.539 7.573 1132 HB2 ASP 140 HB2 ASP 140 -18.598 7.533 9.787 1133 HB3 ASP 140 HB1 ASP 140 -20.051 7.292 8.817 1134 H GLU 141 HN GLU 141 -18.398 4.159 10.283 1135 HA GLU 141 HA GLU 141 -15.880 4.616 11.357 1136 HB2 GLU 141 HB2 GLU 141 -16.082 2.159 12.129 1137 HB3 GLU 141 HB1 GLU 141 -17.322 3.298 12.654 1138 HG2 GLU 141 HG2 GLU 141 -18.832 2.546 10.909 1139 HG3 GLU 141 HG1 GLU 141 -17.581 1.511 10.225 1140 H MET 142 HN MET 142 -16.682 3.036 8.394 1141 HA MET 142 HA MET 142 -14.249 1.495 8.205 1142 HB2 MET 142 HB2 MET 142 -16.043 2.253 5.913 1143 HB3 MET 142 HB1 MET 142 -15.026 0.822 6.085 1144 HG2 MET 142 HG2 MET 142 -16.621 0.629 8.321 1145 HG3 MET 142 HG1 MET 142 -17.728 1.338 7.155 1146 HE1 MET 142 HE1 MET 142 -15.640 -2.700 7.139 1147 HE2 MET 142 HE2 MET 142 -14.771 -1.171 7.248 1148 HE3 MET 142 HE3 MET 142 -15.947 -1.614 8.492 1149 H VAL 143 HN VAL 143 -15.194 4.696 7.586 1150 HA VAL 143 HA VAL 143 -12.619 5.243 6.223 1151 HB VAL 143 HB VAL 143 -14.810 5.474 4.845 1152 HG11 VAL 143 HG11 VAL 143 -15.948 6.721 6.753 1153 HG12 VAL 143 HG12 VAL 143 -14.948 8.106 6.321 1154 HG13 VAL 143 HG13 VAL 143 -16.099 7.450 5.157 1155 HG21 VAL 143 HG21 VAL 143 -12.681 7.593 5.131 1156 HG22 VAL 143 HG22 VAL 143 -12.809 6.325 3.913 1157 HG23 VAL 143 HG23 VAL 143 -13.921 7.693 3.879 1158 H ALA 144 HN ALA 144 -11.312 6.463 7.436 1159 HA ALA 144 HA ALA 144 -12.518 8.108 9.588 1160 HB1 ALA 144 HB1 ALA 144 -10.748 7.518 10.990 1161 HB2 ALA 144 HB2 ALA 144 -9.684 7.106 9.646 1162 HB3 ALA 144 HB3 ALA 144 -11.011 6.030 10.081 1163 H MET 145 HN MET 145 -12.372 10.238 9.327 1164 HA MET 145 HA MET 145 -10.503 11.429 7.479 1165 HB2 MET 145 HB2 MET 145 -12.044 13.070 9.459 1166 HB3 MET 145 HB1 MET 145 -11.695 13.408 7.768 1167 HG2 MET 145 HG2 MET 145 -13.413 11.028 8.140 1168 HG3 MET 145 HG1 MET 145 -14.124 12.512 8.747 1169 HE1 MET 145 HE1 MET 145 -13.787 10.484 5.272 1170 HE2 MET 145 HE2 MET 145 -12.559 11.560 4.614 1171 HE3 MET 145 HE3 MET 145 -12.288 10.743 6.157 1172 H LEU 146 HN LEU 146 -8.663 12.640 8.020 1173 HA LEU 146 HA LEU 146 -7.800 12.348 10.793 1174 HB2 LEU 146 HB2 LEU 146 -6.702 11.336 8.487 1175 HB3 LEU 146 HB1 LEU 146 -5.752 12.800 8.722 1176 HG LEU 146 HG LEU 146 -5.202 12.108 10.954 1177 HD11 LEU 146 HD11 LEU 146 -5.869 9.460 11.258 1178 HD12 LEU 146 HD12 LEU 146 -6.704 10.804 12.031 1179 HD13 LEU 146 HD13 LEU 146 -7.321 10.131 10.522 1180 HD21 LEU 146 HD21 LEU 146 -4.758 9.739 9.174 1181 HD22 LEU 146 HD22 LEU 146 -3.902 11.266 8.961 1182 HD23 LEU 146 HD23 LEU 146 -3.709 10.343 10.447 1183 HA PRO 147 HA PRO 147 -7.648 16.818 11.022 1184 HB2 PRO 147 HB2 PRO 147 -6.396 17.065 13.406 1185 HB3 PRO 147 HB1 PRO 147 -8.049 16.424 13.289 1186 HG2 PRO 147 HG2 PRO 147 -5.464 14.913 13.470 1187 HG3 PRO 147 HG1 PRO 147 -6.939 14.710 14.435 1188 HD2 PRO 147 HD2 PRO 147 -6.419 13.120 12.349 1189 HD3 PRO 147 HD1 PRO 147 -8.079 13.630 12.714 1190 H ARG 148 HN ARG 148 -6.145 18.560 10.908 1191 HA ARG 148 HA ARG 148 -3.747 18.066 9.497 1192 HB2 ARG 148 HB2 ARG 148 -3.399 20.443 9.593 1193 HB3 ARG 148 HB1 ARG 148 -5.126 20.164 9.385 1194 HG2 ARG 148 HG2 ARG 148 -5.317 20.300 11.929 1195 HG3 ARG 148 HG1 ARG 148 -3.666 20.922 11.920 1196 HD2 ARG 148 HD2 ARG 148 -4.390 22.720 10.354 1197 HD3 ARG 148 HD1 ARG 148 -6.045 22.129 10.481 1198 HE ARG 148 HE ARG 148 -6.181 23.091 12.600 1199 HH11 ARG 148 HH21 ARG 148 -2.916 22.987 11.456 1200 HH12 ARG 148 HH22 ARG 148 -2.292 23.983 12.729 1201 HH21 ARG 148 HH11 ARG 148 -5.370 24.397 14.273 1202 HH22 ARG 148 HH12 ARG 148 -3.682 24.781 14.324 1203 H GLN 149 HN GLN 149 -4.368 17.878 12.823 1204 HA GLN 149 HA GLN 149 -2.256 18.887 14.181 1205 HB2 GLN 149 HB2 GLN 149 -4.050 17.406 15.126 1206 HB3 GLN 149 HB1 GLN 149 -3.152 16.020 14.510 1207 HG2 GLN 149 HG2 GLN 149 -1.197 16.664 15.846 1208 HG3 GLN 149 HG1 GLN 149 -2.054 18.086 16.437 1209 HE21 GLN 149 HE21 GLN 149 -4.520 15.997 16.287 1210 HE22 GLN 149 HE22 GLN 149 -4.407 15.256 17.810 1211 H GLU 150 HN GLU 150 -0.098 18.793 14.066 1212 HA GLU 150 HA GLU 150 1.157 16.485 12.684 1213 HB2 GLU 150 HB2 GLU 150 2.772 17.990 11.696 1214 HB3 GLU 150 HB1 GLU 150 1.151 18.549 11.287 1215 HG2 GLU 150 HG2 GLU 150 1.316 20.067 13.342 1216 HG3 GLU 150 HG1 GLU 150 3.035 19.677 13.361 1217 H GLU 151 HN GLU 151 2.781 15.518 13.718 1218 HA GLU 151 HA GLU 151 3.858 16.801 16.168 1219 HB2 GLU 151 HB2 GLU 151 3.610 13.847 15.531 1220 HB3 GLU 151 HB1 GLU 151 4.222 14.543 17.033 1221 HG2 GLU 151 HG2 GLU 151 1.430 15.007 15.947 1222 HG3 GLU 151 HG1 GLU 151 1.829 13.825 17.191 1223 H CYS 152 HN CYS 152 4.500 15.106 13.194 1224 HA CYS 152 HA CYS 152 7.337 15.865 13.360 1225 HB2 CYS 152 HB2 CYS 152 6.227 13.100 13.121 1226 HB3 CYS 152 HB1 CYS 152 7.677 13.493 12.202 1227 H THR 153 HN THR 153 8.396 15.739 11.217 1228 HA THR 153 HA THR 153 6.646 15.646 8.887 1229 HB THR 153 HB THR 153 7.336 17.929 8.146 1230 HG1 THR 153 HG1 THR 153 8.930 17.701 10.225 1231 HG21 THR 153 HG21 THR 153 5.935 18.043 10.822 1232 HG22 THR 153 HG22 THR 153 5.665 19.063 9.410 1233 HG23 THR 153 HG23 THR 153 5.161 17.374 9.385 1234 H VAL 154 HN VAL 154 7.875 15.831 6.857 1235 HA VAL 154 HA VAL 154 10.562 14.690 7.181 1236 HB VAL 154 HB VAL 154 9.317 13.302 5.788 1237 HG11 VAL 154 HG11 VAL 154 7.919 14.206 3.895 1238 HG12 VAL 154 HG12 VAL 154 7.341 14.655 5.500 1239 HG13 VAL 154 HG13 VAL 154 8.228 15.825 4.523 1240 HG21 VAL 154 HG21 VAL 154 10.293 13.457 3.596 1241 HG22 VAL 154 HG22 VAL 154 10.557 15.190 3.773 1242 HG23 VAL 154 HG23 VAL 154 11.492 14.050 4.743 1243 H ASP 155 HN ASP 155 12.212 15.346 5.695 1244 HA ASP 155 HA ASP 155 12.856 18.032 5.853 1245 HB2 ASP 155 HB2 ASP 155 14.565 16.429 5.360 1246 HB3 ASP 155 HB1 ASP 155 13.805 16.003 3.833 1247 H GLU 156 HN GLU 156 13.292 19.483 4.055 1248 HA GLU 156 HA GLU 156 11.318 19.409 1.875 1249 HB2 GLU 156 HB2 GLU 156 10.860 21.901 2.433 1250 HB3 GLU 156 HB1 GLU 156 10.056 20.663 3.396 1251 HG2 GLU 156 HG2 GLU 156 11.745 20.873 5.148 1252 HG3 GLU 156 HG1 GLU 156 12.638 22.042 4.178 1253 H VAL 157 HN VAL 157 13.189 19.054 0.580 1254 HA VAL 157 HA VAL 157 15.465 20.668 0.493 1255 HB VAL 157 HB VAL 157 15.514 19.875 -1.951 1256 HG11 VAL 157 HG11 VAL 157 16.741 18.704 -0.214 1257 HG12 VAL 157 HG12 VAL 157 15.265 17.917 0.346 1258 HG13 VAL 157 HG13 VAL 157 15.939 17.509 -1.232 1259 HG21 VAL 157 HG21 VAL 157 13.890 18.289 -2.653 1260 HG22 VAL 157 HG22 VAL 157 13.236 18.123 -1.023 1261 HG23 VAL 157 HG23 VAL 157 12.956 19.603 -1.940 1262 HN1 EB4 200 H17 EB4 200 0.107 -0.303 5.371 1263 H8 EB4 200 H8 EB4 200 4.567 1.663 0.553 1264 HN2 EB4 200 H25 EB4 200 3.208 0.618 5.928 1265 H9 EB4 200 H9 EB4 200 0.258 6.575 2.642 1266 H10 EB4 200 H10 EB4 200 -2.886 -0.500 0.262 1267 HN3 EB4 200 H32 EB4 200 0.564 2.561 6.823 1268 H7 EB4 200 H7 EB4 200 -1.392 1.470 0.071 1269 H11 EB4 200 H11 EB4 200 6.489 0.226 1.177 1270 H12 EB4 200 H12 EB4 200 -0.686 7.875 4.533 1271 H15 EB4 200 H15 EB4 200 -0.755 6.888 6.805 1272 H14 EB4 200 H14 EB4 200 6.728 -0.582 3.509 1273 H13 EB4 200 H13 EB4 200 -2.858 -1.878 2.325 1274 H22 EB4 200 H22 EB4 200 -1.082 -2.627 6.749 1275 H30 EB4 200 H30 EB4 200 -0.659 0.710 9.772 1276 H30A EB4 200 H9N EB4 200 -1.686 1.718 8.639 1277 H24 EB4 200 H24 EB4 200 0.042 3.092 9.693 1278 H28 EB4 200 H28 EB4 200 1.098 -2.979 7.812 1279 H28A EB4 200 H9L EB4 200 1.137 -3.190 6.054 1280 H23 EB4 200 H23 EB4 200 4.906 -0.757 7.959 1281 H29 EB4 200 H29 EB4 200 3.737 0.620 9.638 1282 H29A EB4 200 H9M EB4 200 4.604 1.661 8.404 1283 H21 ACD 300 HA3 ACD 300 1.257 9.853 -10.493 1284 H22 ACD 300 HA4 ACD 300 1.350 11.377 -9.582 1285 H31 ACD 300 HA1 ACD 300 -1.160 11.421 -9.489 1286 H32 ACD 300 HA2 ACD 300 -1.185 9.835 -10.290 1287 H41 ACD 300 HA0 ACD 300 0.188 10.412 -7.629 1288 H42 ACD 300 HAZ ACD 300 0.035 8.824 -8.420 1289 H5 ACD 300 HAY ACD 300 -2.711 9.669 -8.250 1290 H6 ACD 300 HAX ACD 300 -2.931 9.243 -5.680 1291 H71 ACD 300 HAV ACD 300 0.017 10.035 -5.596 1292 H72 ACD 300 HAW ACD 300 -0.958 9.487 -4.215 1293 H8 ACD 300 HAU ACD 300 0.213 7.509 -6.347 1294 H9 ACD 300 HAT ACD 300 0.562 6.019 -4.235 1295 H101 ACD 300 HAR ACD 300 0.622 7.690 -2.151 1296 H102 ACD 300 HAS ACD 300 -0.837 8.440 -2.832 1297 H11 ACD 300 HAQ ACD 300 -2.099 6.170 -2.471 1298 H12 ACD 300 HAP ACD 300 -1.305 5.068 -0.243 1299 H131 ACD 300 HAN ACD 300 1.500 6.205 -0.802 1300 H132 ACD 300 HAO ACD 300 0.831 5.583 0.786 1301 H14 ACD 300 HAM ACD 300 -0.436 7.982 0.777 1302 H15 ACD 300 HAL ACD 300 1.630 9.587 0.783 1303 H161 ACD 300 HAJ ACD 300 3.857 8.826 0.113 1304 H162 ACD 300 HAK ACD 300 3.360 7.148 0.408 1305 H171 ACD 300 HAH ACD 300 4.006 7.535 -1.959 1306 H172 ACD 300 HAI ACD 300 2.311 7.036 -1.817 1307 H181 ACD 300 HAF ACD 300 1.644 9.463 -1.905 1308 H182 ACD 300 HAG ACD 300 3.348 9.883 -2.198 1309 H191 ACD 300 HAD ACD 300 3.328 8.364 -4.204 1310 H192 ACD 300 HAE ACD 300 1.614 8.060 -3.921 1311 H201 ACD 300 HAA ACD 300 1.851 9.791 -5.635 1312 H202 ACD 300 HAB ACD 300 2.884 10.761 -4.564 1313 H203 ACD 300 HAC ACD 300 1.167 10.525 -4.167 Start of MODEL 18 1 H1 MET 1 HT1 MET 1 7.948 20.592 -17.385 2 H2 MET 1 HT2 MET 1 6.924 19.286 -17.747 3 H3 MET 1 HT3 MET 1 6.764 20.753 -18.589 4 HA MET 1 HA MET 1 9.013 20.448 -19.505 5 HB2 MET 1 HB2 MET 1 8.708 17.783 -18.092 6 HB3 MET 1 HB1 MET 1 9.941 18.118 -19.308 7 HG2 MET 1 HG2 MET 1 10.751 20.019 -17.909 8 HG3 MET 1 HG1 MET 1 9.582 19.566 -16.668 9 HE1 MET 1 HE1 MET 1 12.316 20.001 -15.992 10 HE2 MET 1 HE2 MET 1 11.482 19.106 -14.723 11 HE3 MET 1 HE3 MET 1 13.080 18.584 -15.276 12 H THR 2 HN THR 2 6.159 18.450 -19.148 13 HA THR 2 HA THR 2 5.704 18.494 -22.001 14 HB THR 2 HB THR 2 6.002 15.793 -20.676 15 HG1 THR 2 HG1 THR 2 7.990 17.052 -20.960 16 HG21 THR 2 HG21 THR 2 5.728 16.663 -23.567 17 HG22 THR 2 HG22 THR 2 5.908 15.001 -23.008 18 HG23 THR 2 HG23 THR 2 4.459 15.918 -22.596 19 H VAL 3 HN VAL 3 4.773 17.827 -18.749 20 HA VAL 3 HA VAL 3 1.950 18.050 -19.498 21 HB VAL 3 HB VAL 3 1.449 16.101 -17.909 22 HG11 VAL 3 HG11 VAL 3 1.217 15.997 -20.385 23 HG12 VAL 3 HG12 VAL 3 2.903 15.494 -20.502 24 HG13 VAL 3 HG13 VAL 3 1.728 14.453 -19.701 25 HG21 VAL 3 HG21 VAL 3 3.798 16.034 -16.999 26 HG22 VAL 3 HG22 VAL 3 3.219 14.473 -17.583 27 HG23 VAL 3 HG23 VAL 3 4.334 15.425 -18.565 28 HA PRO 4 HA PRO 4 3.523 20.555 -15.802 29 HB2 PRO 4 HB2 PRO 4 1.355 22.224 -17.040 30 HB3 PRO 4 HB1 PRO 4 2.901 22.733 -16.330 31 HG2 PRO 4 HG2 PRO 4 2.573 22.623 -18.967 32 HG3 PRO 4 HG1 PRO 4 4.108 22.159 -18.210 33 HD2 PRO 4 HD2 PRO 4 2.015 20.415 -19.432 34 HD3 PRO 4 HD1 PRO 4 3.767 20.149 -19.296 35 H ASP 5 HN ASP 5 2.634 19.079 -14.313 36 HA ASP 5 HA ASP 5 0.182 19.844 -13.096 37 HB2 ASP 5 HB2 ASP 5 -0.627 18.556 -15.132 38 HB3 ASP 5 HB1 ASP 5 0.099 17.124 -14.405 39 H ARG 6 HN ARG 6 2.126 16.889 -13.601 40 HA ARG 6 HA ARG 6 1.919 15.982 -10.929 41 HB2 ARG 6 HB2 ARG 6 2.527 14.468 -12.728 42 HB3 ARG 6 HB1 ARG 6 3.990 15.392 -13.055 43 HG2 ARG 6 HG2 ARG 6 3.716 14.514 -10.234 44 HG3 ARG 6 HG1 ARG 6 3.873 13.194 -11.390 45 HD2 ARG 6 HD2 ARG 6 5.773 15.538 -11.079 46 HD3 ARG 6 HD1 ARG 6 6.087 13.869 -10.616 47 HE ARG 6 HE ARG 6 5.535 13.615 -13.244 48 HH11 ARG 6 HH21 ARG 6 7.541 15.796 -11.455 49 HH12 ARG 6 HH22 ARG 6 8.691 16.006 -12.734 50 HH21 ARG 6 HH11 ARG 6 7.037 13.888 -14.925 51 HH22 ARG 6 HH12 ARG 6 8.405 14.926 -14.698 52 H SER 7 HN SER 7 4.423 17.843 -12.621 53 HA SER 7 HA SER 7 6.302 17.998 -10.558 54 HB2 SER 7 HB2 SER 7 7.219 19.890 -11.741 55 HB3 SER 7 HB1 SER 7 6.661 18.714 -12.927 56 HG SER 7 HG SER 7 5.345 21.071 -12.046 57 H GLU 8 HN GLU 8 3.352 19.809 -11.103 58 HA GLU 8 HA GLU 8 3.862 21.913 -9.266 59 HB2 GLU 8 HB2 GLU 8 1.304 20.778 -10.401 60 HB3 GLU 8 HB1 GLU 8 1.345 22.182 -9.334 61 HG2 GLU 8 HG2 GLU 8 1.356 22.991 -11.609 62 HG3 GLU 8 HG1 GLU 8 2.963 23.259 -10.938 63 H ILE 9 HN ILE 9 2.075 18.838 -8.915 64 HA ILE 9 HA ILE 9 1.635 19.370 -6.086 65 HB ILE 9 HB ILE 9 -0.003 18.229 -7.689 66 HG12 ILE 9 HG12 ILE 9 0.234 18.139 -4.969 67 HG13 ILE 9 HG11 ILE 9 -1.107 17.437 -5.840 68 HG21 ILE 9 HG21 ILE 9 1.870 15.916 -7.196 69 HG22 ILE 9 HG22 ILE 9 0.253 15.765 -7.867 70 HG23 ILE 9 HG23 ILE 9 1.487 16.663 -8.741 71 HD11 ILE 9 HD11 ILE 9 -0.023 15.260 -5.807 72 HD12 ILE 9 HD12 ILE 9 1.412 15.978 -5.066 73 HD13 ILE 9 HD13 ILE 9 -0.097 15.899 -4.167 74 H ALA 10 HN ALA 10 3.790 17.571 -8.089 75 HA ALA 10 HA ALA 10 4.688 15.737 -6.118 76 HB1 ALA 10 HB1 ALA 10 6.833 15.705 -7.564 77 HB2 ALA 10 HB2 ALA 10 5.919 16.733 -8.663 78 HB3 ALA 10 HB3 ALA 10 5.333 15.116 -8.278 79 H GLY 11 HN GLY 11 6.350 15.862 -4.602 80 HA2 GLY 11 HA2 GLY 11 8.269 17.138 -3.748 81 HA3 GLY 11 HA1 GLY 11 7.344 18.601 -4.095 82 H LYS 12 HN LYS 12 4.802 17.350 -3.320 83 HA LYS 12 HA LYS 12 4.997 16.571 -0.559 84 HB2 LYS 12 HB2 LYS 12 5.372 19.088 -0.566 85 HB3 LYS 12 HB1 LYS 12 3.693 19.235 -1.076 86 HG2 LYS 12 HG2 LYS 12 3.418 19.341 1.229 87 HG3 LYS 12 HG1 LYS 12 3.266 17.603 0.979 88 HD2 LYS 12 HD2 LYS 12 4.836 17.642 2.697 89 HD3 LYS 12 HD1 LYS 12 5.904 17.644 1.296 90 HE2 LYS 12 HE2 LYS 12 6.717 19.381 2.710 91 HE3 LYS 12 HE1 LYS 12 5.828 20.203 1.428 92 HZ1 LYS 12 HZ1 LYS 12 4.541 21.102 2.963 93 HZ2 LYS 12 HZ2 LYS 12 4.011 19.560 3.439 94 HZ3 LYS 12 HZ3 LYS 12 5.357 20.263 4.195 95 H TRP 13 HN TRP 13 3.437 15.006 -0.515 96 HA TRP 13 HA TRP 13 0.796 15.584 -1.747 97 HB2 TRP 13 HB2 TRP 13 2.342 12.994 -1.423 98 HB3 TRP 13 HB1 TRP 13 0.646 13.011 -1.861 99 HD1 TRP 13 HD1 TRP 13 3.828 14.780 -3.136 100 HE1 TRP 13 HE1 TRP 13 3.744 14.635 -5.707 101 HE3 TRP 13 HE3 TRP 13 -0.659 12.430 -3.809 102 HZ2 TRP 13 HZ2 TRP 13 2.112 13.687 -7.717 103 HZ3 TRP 13 HZ3 TRP 13 -1.467 11.933 -6.103 104 HH2 TRP 13 HH2 TRP 13 -0.092 12.569 -8.070 105 H TYR 14 HN TYR 14 -0.850 15.671 -0.226 106 HA TYR 14 HA TYR 14 -0.203 14.770 2.511 107 HB2 TYR 14 HB2 TYR 14 -1.933 16.856 1.292 108 HB3 TYR 14 HB1 TYR 14 -2.494 16.147 2.796 109 HD1 TYR 14 HD2 TYR 14 1.081 16.628 1.872 110 HD2 TYR 14 HD1 TYR 14 -2.241 18.024 4.196 111 HE1 TYR 14 HE2 TYR 14 2.595 18.113 3.151 112 HE2 TYR 14 HE1 TYR 14 -0.732 19.502 5.481 113 HH TYR 14 HH TYR 14 2.781 19.452 4.939 114 H VAL 15 HN VAL 15 -1.256 13.158 3.500 115 HA VAL 15 HA VAL 15 -3.607 11.925 2.175 116 HB VAL 15 HB VAL 15 -1.518 10.823 4.073 117 HG11 VAL 15 HG11 VAL 15 -4.208 9.706 3.271 118 HG12 VAL 15 HG12 VAL 15 -2.893 8.669 3.823 119 HG13 VAL 15 HG13 VAL 15 -3.551 9.904 4.895 120 HG21 VAL 15 HG21 VAL 15 -0.942 9.363 2.298 121 HG22 VAL 15 HG22 VAL 15 -2.436 9.702 1.432 122 HG23 VAL 15 HG23 VAL 15 -1.172 10.928 1.521 123 H VAL 16 HN VAL 16 -5.387 12.941 3.092 124 HA VAL 16 HA VAL 16 -5.360 13.256 6.041 125 HB VAL 16 HB VAL 16 -6.564 15.217 5.869 126 HG11 VAL 16 HG11 VAL 16 -4.961 15.288 3.311 127 HG12 VAL 16 HG12 VAL 16 -5.198 16.582 4.478 128 HG13 VAL 16 HG13 VAL 16 -4.189 15.201 4.883 129 HG21 VAL 16 HG21 VAL 16 -7.286 14.271 3.082 130 HG22 VAL 16 HG22 VAL 16 -8.376 14.630 4.422 131 HG23 VAL 16 HG23 VAL 16 -7.535 15.939 3.595 132 H ALA 17 HN ALA 17 -6.512 11.073 4.057 133 HA ALA 17 HA ALA 17 -8.527 10.303 5.873 134 HB1 ALA 17 HB1 ALA 17 -9.412 11.899 3.514 135 HB2 ALA 17 HB2 ALA 17 -10.078 11.856 5.137 136 HB3 ALA 17 HB3 ALA 17 -10.422 10.543 4.012 137 H LEU 18 HN LEU 18 -8.814 8.131 5.671 138 HA LEU 18 HA LEU 18 -8.199 6.911 3.080 139 HB2 LEU 18 HB2 LEU 18 -7.303 5.004 4.617 140 HB3 LEU 18 HB1 LEU 18 -6.284 6.398 4.281 141 HG LEU 18 HG LEU 18 -6.369 5.727 6.695 142 HD11 LEU 18 HD11 LEU 18 -6.321 8.278 5.601 143 HD12 LEU 18 HD12 LEU 18 -7.535 8.408 6.871 144 HD13 LEU 18 HD13 LEU 18 -5.909 7.857 7.259 145 HD21 LEU 18 HD21 LEU 18 -9.156 6.883 6.704 146 HD22 LEU 18 HD22 LEU 18 -8.861 5.152 6.569 147 HD23 LEU 18 HD23 LEU 18 -8.332 6.030 7.999 148 H ALA 19 HN ALA 19 -8.848 4.583 3.076 149 HA ALA 19 HA ALA 19 -11.305 4.032 4.572 150 HB1 ALA 19 HB1 ALA 19 -12.728 4.008 2.779 151 HB2 ALA 19 HB2 ALA 19 -11.478 3.481 1.655 152 HB3 ALA 19 HB3 ALA 19 -11.579 5.176 2.137 153 H SER 20 HN SER 20 -11.626 1.879 4.925 154 HA SER 20 HA SER 20 -10.346 -0.189 3.413 155 HB2 SER 20 HB2 SER 20 -8.389 0.670 4.649 156 HB3 SER 20 HB1 SER 20 -9.236 0.385 6.167 157 HG SER 20 HG SER 20 -7.813 -1.342 5.476 158 H ASN 21 HN ASN 21 -10.400 -2.294 4.820 159 HA ASN 21 HA ASN 21 -12.864 -2.318 6.445 160 HB2 ASN 21 HB2 ASN 21 -13.816 -4.080 5.261 161 HB3 ASN 21 HB1 ASN 21 -13.103 -3.118 3.971 162 HD21 ASN 21 HD21 ASN 21 -12.605 -6.035 5.955 163 HD22 ASN 21 HD22 ASN 21 -11.528 -6.778 4.879 164 H THR 22 HN THR 22 -9.615 -3.200 6.018 165 HA THR 22 HA THR 22 -9.669 -5.505 7.778 166 HB THR 22 HB THR 22 -7.951 -5.225 5.974 167 HG1 THR 22 HG1 THR 22 -6.361 -5.244 8.170 168 HG21 THR 22 HG21 THR 22 -6.392 -3.535 5.988 169 HG22 THR 22 HG22 THR 22 -7.726 -2.666 6.743 170 HG23 THR 22 HG23 THR 22 -6.445 -3.357 7.741 171 H GLU 23 HN GLU 23 -10.137 -5.193 9.843 172 HA GLU 23 HA GLU 23 -10.181 -2.787 11.170 173 HB2 GLU 23 HB2 GLU 23 -9.855 -5.559 12.308 174 HB3 GLU 23 HB1 GLU 23 -10.253 -4.131 13.265 175 HG2 GLU 23 HG2 GLU 23 -11.884 -5.067 10.890 176 HG3 GLU 23 HG1 GLU 23 -12.257 -5.493 12.560 177 H PHE 24 HN PHE 24 -7.489 -5.071 11.040 178 HA PHE 24 HA PHE 24 -5.918 -4.028 13.044 179 HB2 PHE 24 HB2 PHE 24 -4.512 -4.653 10.492 180 HB3 PHE 24 HB1 PHE 24 -4.194 -5.235 12.126 181 HD1 PHE 24 HD1 PHE 24 -6.849 -6.261 12.928 182 HD2 PHE 24 HD2 PHE 24 -4.760 -6.601 9.191 183 HE1 PHE 24 HE1 PHE 24 -8.096 -8.344 12.419 184 HE2 PHE 24 HE2 PHE 24 -6.005 -8.683 8.682 185 HZ PHE 24 HZ PHE 24 -7.673 -9.555 10.298 186 H PHE 25 HN PHE 25 -5.875 -2.964 9.621 187 HA PHE 25 HA PHE 25 -4.175 -0.723 10.218 188 HB2 PHE 25 HB2 PHE 25 -5.779 -1.147 7.702 189 HB3 PHE 25 HB1 PHE 25 -4.302 -0.216 7.899 190 HD1 PHE 25 HD2 PHE 25 -3.279 -2.697 9.903 191 HD2 PHE 25 HD1 PHE 25 -4.522 -2.253 5.803 192 HE1 PHE 25 HE2 PHE 25 -1.974 -4.692 9.288 193 HE2 PHE 25 HE1 PHE 25 -3.200 -4.260 5.203 194 HZ PHE 25 HZ PHE 25 -1.931 -5.479 6.941 195 H LEU 26 HN LEU 26 -7.611 -1.094 9.509 196 HA LEU 26 HA LEU 26 -8.280 1.659 9.444 197 HB2 LEU 26 HB2 LEU 26 -9.817 0.025 8.586 198 HB3 LEU 26 HB1 LEU 26 -9.847 -0.834 10.116 199 HG LEU 26 HG LEU 26 -10.945 1.107 11.186 200 HD11 LEU 26 HD11 LEU 26 -10.647 2.243 8.398 201 HD12 LEU 26 HD12 LEU 26 -11.869 2.844 9.519 202 HD13 LEU 26 HD13 LEU 26 -10.158 2.970 9.930 203 HD21 LEU 26 HD21 LEU 26 -12.303 0.214 8.626 204 HD22 LEU 26 HD22 LEU 26 -12.251 -0.729 10.113 205 HD23 LEU 26 HD23 LEU 26 -13.104 0.812 10.080 206 H ARG 27 HN ARG 27 -7.894 -0.677 11.920 207 HA ARG 27 HA ARG 27 -8.975 0.719 14.142 208 HB2 ARG 27 HB2 ARG 27 -8.440 -1.603 14.446 209 HB3 ARG 27 HB1 ARG 27 -6.749 -1.331 14.022 210 HG2 ARG 27 HG2 ARG 27 -6.351 -0.093 16.032 211 HG3 ARG 27 HG1 ARG 27 -8.077 0.018 16.384 212 HD2 ARG 27 HD2 ARG 27 -7.136 -1.698 17.804 213 HD3 ARG 27 HD1 ARG 27 -8.128 -2.487 16.582 214 HE ARG 27 HE ARG 27 -6.207 -3.517 15.807 215 HH11 ARG 27 HH21 ARG 27 -5.419 -0.672 17.613 216 HH12 ARG 27 HH22 ARG 27 -3.708 -0.931 17.537 217 HH21 ARG 27 HH11 ARG 27 -3.965 -3.862 15.702 218 HH22 ARG 27 HH12 ARG 27 -2.885 -2.737 16.455 219 H GLU 28 HN GLU 28 -5.682 0.625 12.805 220 HA GLU 28 HA GLU 28 -4.732 2.596 14.691 221 HB2 GLU 28 HB2 GLU 28 -3.435 1.329 12.279 222 HB3 GLU 28 HB1 GLU 28 -2.616 2.418 13.399 223 HG2 GLU 28 HG2 GLU 28 -3.172 0.876 15.268 224 HG3 GLU 28 HG1 GLU 28 -3.912 -0.230 14.111 225 H LYS 29 HN LYS 29 -5.490 2.729 11.117 226 HA LYS 29 HA LYS 29 -4.406 5.196 10.634 227 HB2 LYS 29 HB2 LYS 29 -6.872 3.844 9.561 228 HB3 LYS 29 HB1 LYS 29 -6.374 5.434 8.993 229 HG2 LYS 29 HG2 LYS 29 -4.639 4.596 7.769 230 HG3 LYS 29 HG1 LYS 29 -4.125 3.536 9.072 231 HD2 LYS 29 HD2 LYS 29 -4.746 1.978 7.472 232 HD3 LYS 29 HD1 LYS 29 -6.250 2.118 8.369 233 HE2 LYS 29 HE2 LYS 29 -7.181 3.593 6.712 234 HE3 LYS 29 HE1 LYS 29 -5.628 3.737 5.888 235 HZ1 LYS 29 HZ1 LYS 29 -5.736 1.294 5.534 236 HZ2 LYS 29 HZ2 LYS 29 -7.334 1.327 6.111 237 HZ3 LYS 29 HZ3 LYS 29 -6.925 2.176 4.701 238 H ASP 30 HN ASP 30 -7.292 4.365 12.367 239 HA ASP 30 HA ASP 30 -8.487 6.904 12.472 240 HB2 ASP 30 HB2 ASP 30 -8.614 4.617 14.443 241 HB3 ASP 30 HB1 ASP 30 -9.687 6.014 14.450 242 H LYS 31 HN LYS 31 -5.736 5.607 14.278 243 HA LYS 31 HA LYS 31 -5.973 7.787 16.199 244 HB2 LYS 31 HB2 LYS 31 -4.394 6.714 17.577 245 HB3 LYS 31 HB1 LYS 31 -5.471 5.465 16.974 246 HG2 LYS 31 HG2 LYS 31 -3.381 4.481 16.689 247 HG3 LYS 31 HG1 LYS 31 -3.690 5.158 15.109 248 HD2 LYS 31 HD2 LYS 31 -2.405 7.221 16.612 249 HD3 LYS 31 HD1 LYS 31 -1.517 5.741 16.930 250 HE2 LYS 31 HE2 LYS 31 -2.239 6.319 14.080 251 HE3 LYS 31 HE1 LYS 31 -0.947 7.262 14.811 252 HZ1 LYS 31 HZ1 LYS 31 -0.208 4.898 15.638 253 HZ2 LYS 31 HZ2 LYS 31 -1.063 4.396 14.258 254 HZ3 LYS 31 HZ3 LYS 31 0.234 5.478 14.102 255 H MET 32 HN MET 32 -4.121 7.227 13.302 256 HA MET 32 HA MET 32 -2.016 9.030 14.159 257 HB2 MET 32 HB2 MET 32 -1.438 9.020 11.632 258 HB3 MET 32 HB1 MET 32 -1.185 7.546 12.543 259 HG2 MET 32 HG2 MET 32 -3.688 7.048 11.748 260 HG3 MET 32 HG1 MET 32 -3.246 8.157 10.467 261 HE1 MET 32 HE1 MET 32 -2.798 5.073 12.324 262 HE2 MET 32 HE2 MET 32 -1.784 3.994 11.389 263 HE3 MET 32 HE3 MET 32 -1.055 5.240 12.404 264 H LYS 33 HN LYS 33 -1.453 10.834 12.648 265 HA LYS 33 HA LYS 33 -3.820 12.565 12.283 266 HB2 LYS 33 HB2 LYS 33 -0.997 13.569 12.555 267 HB3 LYS 33 HB1 LYS 33 -2.515 14.417 12.856 268 HG2 LYS 33 HG2 LYS 33 -1.439 12.116 14.514 269 HG3 LYS 33 HG1 LYS 33 -1.396 13.816 14.975 270 HD2 LYS 33 HD2 LYS 33 -3.955 13.788 14.639 271 HD3 LYS 33 HD1 LYS 33 -3.811 12.032 14.646 272 HE2 LYS 33 HE2 LYS 33 -2.809 13.854 16.852 273 HE3 LYS 33 HE1 LYS 33 -4.314 12.939 16.908 274 HZ1 LYS 33 HZ1 LYS 33 -3.023 10.900 16.626 275 HZ2 LYS 33 HZ2 LYS 33 -1.583 11.803 16.643 276 HZ3 LYS 33 HZ3 LYS 33 -2.561 11.742 18.028 277 H MET 34 HN MET 34 -3.154 14.407 10.491 278 HA MET 34 HA MET 34 -3.101 13.248 8.034 279 HB2 MET 34 HB2 MET 34 -3.786 15.485 8.404 280 HB3 MET 34 HB1 MET 34 -2.257 15.920 9.140 281 HG2 MET 34 HG2 MET 34 -1.117 15.698 6.993 282 HG3 MET 34 HG1 MET 34 -2.613 15.185 6.232 283 HE1 MET 34 HE1 MET 34 -4.757 16.383 6.714 284 HE2 MET 34 HE2 MET 34 -4.770 17.694 7.872 285 HE3 MET 34 HE3 MET 34 -4.914 18.040 6.153 286 H ALA 35 HN ALA 35 -1.525 12.766 6.537 287 HA ALA 35 HA ALA 35 1.289 12.787 7.467 288 HB1 ALA 35 HB1 ALA 35 1.431 10.796 5.781 289 HB2 ALA 35 HB2 ALA 35 -0.318 10.737 5.984 290 HB3 ALA 35 HB3 ALA 35 0.732 10.526 7.376 291 H MET 36 HN MET 36 2.894 12.746 5.675 292 HA MET 36 HA MET 36 1.981 14.254 3.305 293 HB2 MET 36 HB2 MET 36 4.635 15.086 3.930 294 HB3 MET 36 HB1 MET 36 3.167 16.051 3.951 295 HG2 MET 36 HG2 MET 36 4.000 14.310 6.281 296 HG3 MET 36 HG1 MET 36 4.475 15.998 6.129 297 HE1 MET 36 HE1 MET 36 3.005 17.566 7.866 298 HE2 MET 36 HE2 MET 36 1.987 16.488 8.817 299 HE3 MET 36 HE3 MET 36 3.630 16.002 8.382 300 H ALA 37 HN ALA 37 3.496 14.156 1.495 301 HA ALA 37 HA ALA 37 5.528 12.086 1.498 302 HB1 ALA 37 HB1 ALA 37 2.821 11.639 0.317 303 HB2 ALA 37 HB2 ALA 37 3.866 10.524 1.181 304 HB3 ALA 37 HB3 ALA 37 4.223 10.943 -0.495 305 H ARG 38 HN ARG 38 6.620 11.857 -0.598 306 HA ARG 38 HA ARG 38 6.260 14.195 -2.408 307 HB2 ARG 38 HB2 ARG 38 8.153 14.794 -1.075 308 HB3 ARG 38 HB1 ARG 38 8.824 13.166 -1.170 309 HG2 ARG 38 HG2 ARG 38 9.415 13.418 -3.452 310 HG3 ARG 38 HG1 ARG 38 8.378 14.829 -3.651 311 HD2 ARG 38 HD2 ARG 38 10.695 15.563 -3.511 312 HD3 ARG 38 HD1 ARG 38 9.840 16.079 -2.060 313 HE ARG 38 HE ARG 38 10.901 13.679 -1.333 314 HH11 ARG 38 HH21 ARG 38 12.152 16.548 -2.808 315 HH12 ARG 38 HH22 ARG 38 13.737 16.370 -2.133 316 HH21 ARG 38 HH11 ARG 38 12.978 13.437 -0.444 317 HH22 ARG 38 HH12 ARG 38 14.205 14.609 -0.795 318 H ILE 39 HN ILE 39 6.234 13.603 -4.647 319 HA ILE 39 HA ILE 39 7.071 10.889 -5.292 320 HB ILE 39 HB ILE 39 4.643 11.343 -5.151 321 HG12 ILE 39 HG12 ILE 39 5.512 10.661 -7.958 322 HG13 ILE 39 HG11 ILE 39 5.631 9.522 -6.620 323 HG21 ILE 39 HG21 ILE 39 4.824 13.581 -6.051 324 HG22 ILE 39 HG22 ILE 39 5.131 12.886 -7.631 325 HG23 ILE 39 HG23 ILE 39 3.624 12.566 -6.817 326 HD11 ILE 39 HD11 ILE 39 3.379 9.163 -6.577 327 HD12 ILE 39 HD12 ILE 39 3.013 10.880 -6.758 328 HD13 ILE 39 HD13 ILE 39 3.370 9.897 -8.170 329 H SER 40 HN SER 40 8.147 10.536 -7.198 330 HA SER 40 HA SER 40 8.825 12.899 -8.827 331 HB2 SER 40 HB2 SER 40 10.927 12.950 -8.003 332 HB3 SER 40 HB1 SER 40 10.615 11.528 -7.018 333 HG SER 40 HG SER 40 11.391 10.262 -8.573 334 H PHE 41 HN PHE 41 9.262 12.452 -10.989 335 HA PHE 41 HA PHE 41 8.309 9.850 -11.899 336 HB2 PHE 41 HB2 PHE 41 8.530 12.560 -13.011 337 HB3 PHE 41 HB1 PHE 41 8.855 11.285 -14.174 338 HD1 PHE 41 HD2 PHE 41 6.535 11.295 -11.235 339 HD2 PHE 41 HD1 PHE 41 6.920 11.161 -15.511 340 HE1 PHE 41 HE2 PHE 41 4.104 10.850 -11.441 341 HE2 PHE 41 HE1 PHE 41 4.490 10.715 -15.717 342 HZ PHE 41 HZ PHE 41 3.082 10.560 -13.682 343 H LEU 42 HN LEU 42 9.830 8.411 -11.689 344 HA LEU 42 HA LEU 42 12.591 8.810 -12.530 345 HB2 LEU 42 HB2 LEU 42 11.029 6.412 -11.574 346 HB3 LEU 42 HB1 LEU 42 12.630 6.230 -12.256 347 HG LEU 42 HG LEU 42 11.929 7.985 -9.886 348 HD11 LEU 42 HD11 LEU 42 12.998 5.173 -10.140 349 HD12 LEU 42 HD12 LEU 42 13.371 6.151 -8.722 350 HD13 LEU 42 HD13 LEU 42 11.696 5.769 -9.114 351 HD21 LEU 42 HD21 LEU 42 14.435 7.488 -11.456 352 HD22 LEU 42 HD22 LEU 42 13.890 8.956 -10.646 353 HD23 LEU 42 HD23 LEU 42 14.592 7.642 -9.707 354 H GLY 43 HN GLY 43 9.637 7.484 -13.662 355 HA2 GLY 43 HA2 GLY 43 10.044 7.802 -16.397 356 HA3 GLY 43 HA1 GLY 43 10.471 6.135 -15.997 357 H GLU 44 HN GLU 44 8.141 7.124 -17.570 358 HA GLU 44 HA GLU 44 5.754 7.142 -16.148 359 HB2 GLU 44 HB2 GLU 44 6.320 5.891 -18.854 360 HB3 GLU 44 HB1 GLU 44 4.708 6.211 -18.214 361 HG2 GLU 44 HG2 GLU 44 5.222 8.089 -19.585 362 HG3 GLU 44 HG1 GLU 44 5.462 8.640 -17.929 363 H ASP 45 HN ASP 45 7.892 4.482 -16.864 364 HA ASP 45 HA ASP 45 5.976 2.540 -15.744 365 HB2 ASP 45 HB2 ASP 45 8.683 1.904 -16.909 366 HB3 ASP 45 HB1 ASP 45 7.291 0.839 -16.721 367 H GLU 46 HN GLU 46 7.819 4.669 -14.399 368 HA GLU 46 HA GLU 46 8.385 3.124 -12.057 369 HB2 GLU 46 HB2 GLU 46 10.282 2.473 -13.558 370 HB3 GLU 46 HB1 GLU 46 10.773 4.165 -13.596 371 HG2 GLU 46 HG2 GLU 46 10.891 4.088 -11.066 372 HG3 GLU 46 HG1 GLU 46 10.647 2.347 -11.181 373 H LEU 47 HN LEU 47 8.125 4.476 -10.376 374 HA LEU 47 HA LEU 47 9.071 7.246 -10.608 375 HB2 LEU 47 HB2 LEU 47 6.825 7.740 -9.203 376 HB3 LEU 47 HB1 LEU 47 6.914 7.909 -10.950 377 HG LEU 47 HG LEU 47 6.101 5.319 -9.627 378 HD11 LEU 47 HD11 LEU 47 4.542 6.963 -8.831 379 HD12 LEU 47 HD12 LEU 47 4.406 7.688 -10.434 380 HD13 LEU 47 HD13 LEU 47 3.747 6.078 -10.134 381 HD21 LEU 47 HD21 LEU 47 6.328 6.320 -12.407 382 HD22 LEU 47 HD22 LEU 47 6.307 4.665 -11.802 383 HD23 LEU 47 HD23 LEU 47 4.794 5.529 -12.053 384 H LYS 48 HN LYS 48 9.586 8.228 -8.641 385 HA LYS 48 HA LYS 48 10.027 6.295 -6.438 386 HB2 LYS 48 HB2 LYS 48 11.980 7.572 -7.528 387 HB3 LYS 48 HB1 LYS 48 11.336 9.001 -6.721 388 HG2 LYS 48 HG2 LYS 48 11.386 7.626 -4.563 389 HG3 LYS 48 HG1 LYS 48 12.361 6.455 -5.451 390 HD2 LYS 48 HD2 LYS 48 13.028 9.374 -4.979 391 HD3 LYS 48 HD1 LYS 48 13.853 7.981 -4.283 392 HE2 LYS 48 HE2 LYS 48 15.241 8.564 -6.089 393 HE3 LYS 48 HE1 LYS 48 14.250 7.268 -6.760 394 HZ1 LYS 48 HZ1 LYS 48 14.525 9.789 -7.775 395 HZ2 LYS 48 HZ2 LYS 48 13.335 8.658 -8.209 396 HZ3 LYS 48 HZ3 LYS 48 13.003 9.822 -7.022 397 H VAL 49 HN VAL 49 8.678 6.482 -4.702 398 HA VAL 49 HA VAL 49 7.807 9.178 -4.011 399 HB VAL 49 HB VAL 49 6.029 7.752 -5.342 400 HG11 VAL 49 HG11 VAL 49 5.543 6.834 -2.506 401 HG12 VAL 49 HG12 VAL 49 4.362 6.732 -3.811 402 HG13 VAL 49 HG13 VAL 49 5.864 5.819 -3.905 403 HG21 VAL 49 HG21 VAL 49 4.539 9.327 -4.666 404 HG22 VAL 49 HG22 VAL 49 4.822 9.021 -2.968 405 HG23 VAL 49 HG23 VAL 49 5.913 10.018 -3.868 406 H SER 50 HN SER 50 7.484 9.674 -2.026 407 HA SER 50 HA SER 50 8.586 7.803 0.004 408 HB2 SER 50 HB2 SER 50 8.746 10.808 -0.213 409 HB3 SER 50 HB1 SER 50 9.203 9.915 1.228 410 HG SER 50 HG SER 50 10.227 9.381 -1.361 411 H TYR 51 HN TYR 51 7.673 7.665 2.047 412 HA TYR 51 HA TYR 51 4.957 8.826 2.317 413 HB2 TYR 51 HB2 TYR 51 6.145 6.336 3.587 414 HB3 TYR 51 HB1 TYR 51 4.516 6.935 3.846 415 HD1 TYR 51 HD1 TYR 51 6.646 6.316 0.768 416 HD2 TYR 51 HD2 TYR 51 2.938 5.589 2.823 417 HE1 TYR 51 HE1 TYR 51 5.853 4.960 -1.135 418 HE2 TYR 51 HE2 TYR 51 2.161 4.224 0.909 419 HH TYR 51 HH TYR 51 2.918 3.076 -0.948 420 H ALA 52 HN ALA 52 4.694 10.241 4.010 421 HA ALA 52 HA ALA 52 6.634 10.112 6.247 422 HB1 ALA 52 HB1 ALA 52 5.377 12.695 5.375 423 HB2 ALA 52 HB2 ALA 52 6.825 12.101 4.566 424 HB3 ALA 52 HB3 ALA 52 6.854 12.433 6.297 425 H VAL 53 HN VAL 53 5.498 9.298 7.933 426 HA VAL 53 HA VAL 53 2.781 10.362 8.409 427 HB VAL 53 HB VAL 53 3.752 7.687 9.384 428 HG11 VAL 53 HG11 VAL 53 0.967 8.544 8.584 429 HG12 VAL 53 HG12 VAL 53 1.445 7.214 9.637 430 HG13 VAL 53 HG13 VAL 53 1.607 8.879 10.192 431 HG21 VAL 53 HG21 VAL 53 2.522 6.790 7.320 432 HG22 VAL 53 HG22 VAL 53 2.647 8.423 6.664 433 HG23 VAL 53 HG23 VAL 53 4.107 7.505 7.032 434 HA PRO 54 HA PRO 54 4.950 11.546 12.209 435 HB2 PRO 54 HB2 PRO 54 3.247 13.437 13.071 436 HB3 PRO 54 HB1 PRO 54 4.268 13.710 11.642 437 HG2 PRO 54 HG2 PRO 54 1.380 12.969 11.788 438 HG3 PRO 54 HG1 PRO 54 2.196 14.113 10.707 439 HD2 PRO 54 HD2 PRO 54 1.522 11.495 10.014 440 HD3 PRO 54 HD1 PRO 54 2.771 12.465 9.208 441 H LYS 55 HN LYS 55 4.724 10.979 14.382 442 HA LYS 55 HA LYS 55 2.135 10.147 15.407 443 HB2 LYS 55 HB2 LYS 55 4.433 8.205 15.096 444 HB3 LYS 55 HB1 LYS 55 3.007 7.902 16.087 445 HG2 LYS 55 HG2 LYS 55 1.627 8.378 13.977 446 HG3 LYS 55 HG1 LYS 55 3.147 8.258 13.089 447 HD2 LYS 55 HD2 LYS 55 1.901 6.112 14.831 448 HD3 LYS 55 HD1 LYS 55 2.056 6.082 13.074 449 HE2 LYS 55 HE2 LYS 55 4.597 6.339 13.485 450 HE3 LYS 55 HE1 LYS 55 4.237 5.875 15.148 451 HZ1 LYS 55 HZ1 LYS 55 4.437 3.807 14.367 452 HZ2 LYS 55 HZ2 LYS 55 2.875 4.038 13.739 453 HZ3 LYS 55 HZ3 LYS 55 4.231 4.277 12.746 454 HA PRO 56 HA PRO 56 4.119 11.814 19.028 455 HB2 PRO 56 HB2 PRO 56 2.400 10.909 20.956 456 HB3 PRO 56 HB1 PRO 56 1.993 12.232 19.845 457 HG2 PRO 56 HG2 PRO 56 1.220 9.351 19.714 458 HG3 PRO 56 HG1 PRO 56 0.239 10.795 19.401 459 HD2 PRO 56 HD2 PRO 56 1.320 9.302 17.391 460 HD3 PRO 56 HD1 PRO 56 1.065 11.057 17.248 461 H ASN 57 HN ASN 57 3.234 8.394 18.932 462 HA ASN 57 HA ASN 57 4.931 7.630 21.125 463 HB2 ASN 57 HB2 ASN 57 3.668 5.943 18.951 464 HB3 ASN 57 HB1 ASN 57 4.406 5.334 20.432 465 HD21 ASN 57 HD21 ASN 57 3.401 7.262 22.288 466 HD22 ASN 57 HD22 ASN 57 1.715 7.089 22.380 467 H GLY 58 HN GLY 58 5.328 8.077 17.705 468 HA2 GLY 58 HA2 GLY 58 8.070 8.182 17.659 469 HA3 GLY 58 HA1 GLY 58 7.697 6.476 17.428 470 H CYS 59 HN CYS 59 8.040 9.476 15.918 471 HA CYS 59 HA CYS 59 6.281 9.225 13.717 472 HB2 CYS 59 HB2 CYS 59 8.963 10.582 13.552 473 HB3 CYS 59 HB1 CYS 59 7.444 11.035 12.778 474 H ARG 60 HN ARG 60 6.684 8.546 11.575 475 HA ARG 60 HA ARG 60 9.043 6.800 11.186 476 HB2 ARG 60 HB2 ARG 60 6.994 5.464 11.741 477 HB3 ARG 60 HB1 ARG 60 6.234 6.123 10.291 478 HG2 ARG 60 HG2 ARG 60 8.058 5.196 8.910 479 HG3 ARG 60 HG1 ARG 60 8.815 4.531 10.357 480 HD2 ARG 60 HD2 ARG 60 6.743 3.211 10.788 481 HD3 ARG 60 HD1 ARG 60 6.078 3.813 9.273 482 HE ARG 60 HE ARG 60 8.132 1.786 9.578 483 HH11 ARG 60 HH21 ARG 60 6.647 4.157 7.540 484 HH12 ARG 60 HH22 ARG 60 7.158 3.409 6.065 485 HH21 ARG 60 HH11 ARG 60 8.806 0.800 7.646 486 HH22 ARG 60 HH12 ARG 60 8.380 1.509 6.124 487 H LYS 61 HN LYS 61 10.174 7.537 9.526 488 HA LYS 61 HA LYS 61 8.748 8.540 7.137 489 HB2 LYS 61 HB2 LYS 61 10.472 10.291 6.883 490 HB3 LYS 61 HB1 LYS 61 9.557 10.491 8.378 491 HG2 LYS 61 HG2 LYS 61 11.400 9.181 9.545 492 HG3 LYS 61 HG1 LYS 61 12.336 9.338 8.058 493 HD2 LYS 61 HD2 LYS 61 12.005 11.836 8.211 494 HD3 LYS 61 HD1 LYS 61 11.298 11.582 9.807 495 HE2 LYS 61 HE2 LYS 61 13.420 10.378 10.459 496 HE3 LYS 61 HE1 LYS 61 14.114 10.900 8.925 497 HZ1 LYS 61 HZ1 LYS 61 14.112 12.320 11.249 498 HZ2 LYS 61 HZ2 LYS 61 14.427 12.945 9.701 499 HZ3 LYS 61 HZ3 LYS 61 12.864 13.042 10.350 500 H TRP 62 HN TRP 62 9.456 7.673 5.273 501 HA TRP 62 HA TRP 62 12.180 6.779 4.945 502 HB2 TRP 62 HB2 TRP 62 11.947 4.517 5.099 503 HB3 TRP 62 HB1 TRP 62 10.617 4.944 6.170 504 HD1 TRP 62 HD1 TRP 62 8.275 5.578 4.421 505 HE1 TRP 62 HE1 TRP 62 7.269 3.897 2.745 506 HE3 TRP 62 HE3 TRP 62 12.268 2.459 3.812 507 HZ2 TRP 62 HZ2 TRP 62 8.069 1.533 1.328 508 HZ3 TRP 62 HZ3 TRP 62 12.121 0.504 2.298 509 HH2 TRP 62 HH2 TRP 62 10.027 0.037 1.057 510 H GLU 63 HN GLU 63 12.286 5.470 2.786 511 HA GLU 63 HA GLU 63 10.637 6.924 0.791 512 HB2 GLU 63 HB2 GLU 63 13.059 7.569 0.868 513 HB3 GLU 63 HB1 GLU 63 13.465 5.908 0.433 514 HG2 GLU 63 HG2 GLU 63 12.329 6.093 -1.673 515 HG3 GLU 63 HG1 GLU 63 11.604 7.634 -1.217 516 H THR 64 HN THR 64 10.279 5.805 -1.238 517 HA THR 64 HA THR 64 10.633 2.904 -1.258 518 HB THR 64 HB THR 64 7.850 3.946 -1.725 519 HG1 THR 64 HG1 THR 64 7.510 3.273 0.512 520 HG21 THR 64 HG21 THR 64 8.990 1.292 -0.807 521 HG22 THR 64 HG22 THR 64 7.283 1.628 -1.090 522 HG23 THR 64 HG23 THR 64 8.423 1.663 -2.434 523 H THR 65 HN THR 65 10.639 2.033 -3.304 524 HA THR 65 HA THR 65 10.458 3.971 -5.537 525 HB THR 65 HB THR 65 11.939 1.333 -5.446 526 HG1 THR 65 HG1 THR 65 12.524 3.699 -4.380 527 HG21 THR 65 HG21 THR 65 13.071 2.379 -7.459 528 HG22 THR 65 HG22 THR 65 11.383 1.928 -7.703 529 HG23 THR 65 HG23 THR 65 11.814 3.616 -7.426 530 H PHE 66 HN PHE 66 9.195 3.526 -7.300 531 HA PHE 66 HA PHE 66 7.407 1.159 -7.148 532 HB2 PHE 66 HB2 PHE 66 7.095 3.959 -8.213 533 HB3 PHE 66 HB1 PHE 66 5.993 2.703 -8.662 534 HD1 PHE 66 HD2 PHE 66 6.966 2.077 -5.275 535 HD2 PHE 66 HD1 PHE 66 4.521 4.657 -7.695 536 HE1 PHE 66 HE2 PHE 66 5.582 2.614 -3.309 537 HE2 PHE 66 HE1 PHE 66 3.145 5.194 -5.716 538 HZ PHE 66 HZ PHE 66 3.668 4.173 -3.528 539 H LYS 67 HN LYS 67 7.859 -0.376 -8.705 540 HA LYS 67 HA LYS 67 9.126 0.572 -11.216 541 HB2 LYS 67 HB2 LYS 67 9.477 -2.075 -9.798 542 HB3 LYS 67 HB1 LYS 67 10.268 -1.586 -11.297 543 HG2 LYS 67 HG2 LYS 67 11.174 0.422 -9.995 544 HG3 LYS 67 HG1 LYS 67 10.631 -0.408 -8.536 545 HD2 LYS 67 HD2 LYS 67 11.974 -2.407 -9.256 546 HD3 LYS 67 HD1 LYS 67 12.623 -1.434 -10.575 547 HE2 LYS 67 HE2 LYS 67 12.813 -0.637 -7.659 548 HE3 LYS 67 HE1 LYS 67 14.090 -1.496 -8.520 549 HZ1 LYS 67 HZ1 LYS 67 13.770 0.431 -10.220 550 HZ2 LYS 67 HZ2 LYS 67 13.128 1.253 -8.878 551 HZ3 LYS 67 HZ3 LYS 67 14.718 0.665 -8.829 552 H LYS 68 HN LYS 68 8.714 -0.539 -13.125 553 HA LYS 68 HA LYS 68 7.313 -1.402 -14.747 554 HB2 LYS 68 HB2 LYS 68 7.960 -3.516 -13.527 555 HB3 LYS 68 HB1 LYS 68 6.474 -3.353 -12.589 556 HG2 LYS 68 HG2 LYS 68 5.154 -3.384 -14.679 557 HG3 LYS 68 HG1 LYS 68 6.642 -3.571 -15.609 558 HD2 LYS 68 HD2 LYS 68 7.112 -5.681 -14.360 559 HD3 LYS 68 HD1 LYS 68 5.555 -5.512 -13.548 560 HE2 LYS 68 HE2 LYS 68 4.348 -5.772 -15.586 561 HE3 LYS 68 HE1 LYS 68 5.800 -5.545 -16.561 562 HZ1 LYS 68 HZ1 LYS 68 6.679 -7.601 -15.484 563 HZ2 LYS 68 HZ2 LYS 68 5.135 -7.851 -14.820 564 HZ3 LYS 68 HZ3 LYS 68 5.343 -7.852 -16.503 565 H THR 69 HN THR 69 6.287 0.738 -14.118 566 HA THR 69 HA THR 69 3.601 0.354 -13.045 567 HB THR 69 HB THR 69 3.779 2.653 -12.413 568 HG1 THR 69 HG1 THR 69 5.138 3.971 -13.320 569 HG21 THR 69 HG21 THR 69 5.222 0.671 -11.295 570 HG22 THR 69 HG22 THR 69 6.542 1.712 -11.814 571 HG23 THR 69 HG23 THR 69 5.321 2.331 -10.715 572 H SER 70 HN SER 70 2.973 -0.469 -15.217 573 HA SER 70 HA SER 70 1.802 1.667 -16.773 574 HB2 SER 70 HB2 SER 70 2.877 1.258 -18.841 575 HB3 SER 70 HB1 SER 70 4.185 1.342 -17.666 576 HG SER 70 HG SER 70 3.712 -0.604 -19.301 577 H ASP 71 HN ASP 71 1.486 -1.113 -15.296 578 HA ASP 71 HA ASP 71 0.461 -3.031 -16.983 579 HB2 ASP 71 HB2 ASP 71 -0.110 -2.230 -14.153 580 HB3 ASP 71 HB1 ASP 71 -1.092 -3.479 -14.906 581 H ASP 72 HN ASP 72 -1.840 -1.252 -14.985 582 HA ASP 72 HA ASP 72 -3.772 -1.321 -17.201 583 HB2 ASP 72 HB2 ASP 72 -4.240 -0.462 -14.341 584 HB3 ASP 72 HB1 ASP 72 -5.453 -0.894 -15.543 585 H GLY 73 HN GLY 73 -2.538 0.354 -18.350 586 HA2 GLY 73 HA2 GLY 73 -2.562 2.535 -19.140 587 HA3 GLY 73 HA1 GLY 73 -3.644 2.964 -17.812 588 H GLU 74 HN GLU 74 -2.786 3.651 -15.827 589 HA GLU 74 HA GLU 74 0.145 3.878 -15.666 590 HB2 GLU 74 HB2 GLU 74 -1.902 6.021 -15.049 591 HB3 GLU 74 HB1 GLU 74 -0.207 6.106 -14.565 592 HG2 GLU 74 HG2 GLU 74 -1.130 5.755 -17.431 593 HG3 GLU 74 HG1 GLU 74 -0.712 7.313 -16.719 594 H VAL 75 HN VAL 75 0.314 2.139 -14.125 595 HA VAL 75 HA VAL 75 -0.815 2.790 -11.500 596 HB VAL 75 HB VAL 75 -0.848 0.037 -12.764 597 HG11 VAL 75 HG11 VAL 75 -1.495 1.129 -10.028 598 HG12 VAL 75 HG12 VAL 75 -2.347 -0.294 -10.627 599 HG13 VAL 75 HG13 VAL 75 -0.593 -0.320 -10.462 600 HG21 VAL 75 HG21 VAL 75 -3.412 0.482 -12.377 601 HG22 VAL 75 HG22 VAL 75 -2.935 2.180 -12.413 602 HG23 VAL 75 HG23 VAL 75 -2.623 1.148 -13.805 603 H TYR 76 HN TYR 76 0.472 1.968 -9.772 604 HA TYR 76 HA TYR 76 3.248 1.371 -10.645 605 HB2 TYR 76 HB2 TYR 76 3.761 3.048 -9.208 606 HB3 TYR 76 HB1 TYR 76 2.124 3.057 -8.568 607 HD1 TYR 76 HD1 TYR 76 5.114 0.741 -8.463 608 HD2 TYR 76 HD2 TYR 76 1.946 2.631 -6.277 609 HE1 TYR 76 HE1 TYR 76 5.879 -0.353 -6.393 610 HE2 TYR 76 HE2 TYR 76 2.731 1.538 -4.198 611 HH TYR 76 HH TYR 76 5.636 0.294 -3.764 612 H TYR 77 HN TYR 77 4.460 -0.422 -9.905 613 HA TYR 77 HA TYR 77 3.157 -2.075 -7.883 614 HB2 TYR 77 HB2 TYR 77 2.286 -3.057 -9.880 615 HB3 TYR 77 HB1 TYR 77 3.872 -3.028 -10.648 616 HD1 TYR 77 HD1 TYR 77 1.898 -4.565 -7.890 617 HD2 TYR 77 HD2 TYR 77 5.463 -4.766 -10.277 618 HE1 TYR 77 HE1 TYR 77 2.394 -6.809 -6.960 619 HE2 TYR 77 HE2 TYR 77 5.959 -7.010 -9.347 620 HH TYR 77 HH TYR 77 3.692 -8.627 -7.142 621 H SER 78 HN SER 78 4.570 -2.772 -6.381 622 HA SER 78 HA SER 78 7.447 -2.794 -7.092 623 HB2 SER 78 HB2 SER 78 5.957 -1.948 -4.694 624 HB3 SER 78 HB1 SER 78 7.368 -2.941 -4.350 625 HG SER 78 HG SER 78 7.606 -0.903 -6.247 626 H GLU 79 HN GLU 79 7.824 -4.804 -7.768 627 HA GLU 79 HA GLU 79 6.613 -7.178 -7.044 628 HB2 GLU 79 HB2 GLU 79 8.336 -6.838 -8.864 629 HB3 GLU 79 HB1 GLU 79 9.571 -6.928 -7.607 630 HG2 GLU 79 HG2 GLU 79 8.678 -9.159 -6.939 631 HG3 GLU 79 HG1 GLU 79 7.540 -9.074 -8.283 632 H GLU 80 HN GLU 80 9.108 -5.388 -5.347 633 HA GLU 80 HA GLU 80 9.600 -7.489 -3.419 634 HB2 GLU 80 HB2 GLU 80 10.481 -4.597 -3.472 635 HB3 GLU 80 HB1 GLU 80 11.057 -5.820 -2.339 636 HG2 GLU 80 HG2 GLU 80 12.688 -5.757 -4.072 637 HG3 GLU 80 HG1 GLU 80 11.723 -7.198 -4.390 638 H ALA 81 HN ALA 81 7.925 -4.340 -3.394 639 HA ALA 81 HA ALA 81 7.127 -4.708 -0.616 640 HB1 ALA 81 HB1 ALA 81 6.164 -2.488 -2.401 641 HB2 ALA 81 HB2 ALA 81 7.807 -2.487 -1.763 642 HB3 ALA 81 HB3 ALA 81 6.435 -2.474 -0.658 643 H LYS 82 HN LYS 82 5.959 -6.075 -3.317 644 HA LYS 82 HA LYS 82 3.806 -6.540 -4.147 645 HB2 LYS 82 HB2 LYS 82 3.859 -7.464 -1.269 646 HB3 LYS 82 HB1 LYS 82 2.608 -7.940 -2.418 647 HG2 LYS 82 HG2 LYS 82 4.401 -8.812 -3.934 648 HG3 LYS 82 HG1 LYS 82 5.584 -8.453 -2.675 649 HD2 LYS 82 HD2 LYS 82 4.368 -9.948 -1.118 650 HD3 LYS 82 HD1 LYS 82 3.217 -10.331 -2.401 651 HE2 LYS 82 HE2 LYS 82 4.839 -12.102 -2.384 652 HE3 LYS 82 HE1 LYS 82 5.194 -11.103 -3.794 653 HZ1 LYS 82 HZ1 LYS 82 6.661 -11.342 -1.264 654 HZ2 LYS 82 HZ2 LYS 82 7.253 -11.287 -2.855 655 HZ3 LYS 82 HZ3 LYS 82 6.717 -9.865 -2.103 656 H LYS 83 HN LYS 83 3.616 -4.019 -3.968 657 HA LYS 83 HA LYS 83 0.917 -3.519 -2.985 658 HB2 LYS 83 HB2 LYS 83 2.509 -2.929 -1.094 659 HB3 LYS 83 HB1 LYS 83 3.145 -1.659 -2.141 660 HG2 LYS 83 HG2 LYS 83 0.697 -0.895 -2.406 661 HG3 LYS 83 HG1 LYS 83 0.352 -1.935 -1.024 662 HD2 LYS 83 HD2 LYS 83 2.405 0.298 -1.048 663 HD3 LYS 83 HD1 LYS 83 0.798 0.409 -0.330 664 HE2 LYS 83 HE2 LYS 83 2.168 -0.152 1.502 665 HE3 LYS 83 HE1 LYS 83 1.493 -1.707 1.015 666 HZ1 LYS 83 HZ1 LYS 83 3.858 -1.094 -0.443 667 HZ2 LYS 83 HZ2 LYS 83 4.153 -1.070 1.230 668 HZ3 LYS 83 HZ3 LYS 83 3.501 -2.457 0.506 669 H LYS 84 HN LYS 84 -0.158 -2.311 -4.413 670 HA LYS 84 HA LYS 84 1.375 -0.585 -6.263 671 HB2 LYS 84 HB2 LYS 84 -0.362 -1.314 -8.015 672 HB3 LYS 84 HB1 LYS 84 0.891 -2.481 -7.602 673 HG2 LYS 84 HG2 LYS 84 -0.706 -3.507 -5.951 674 HG3 LYS 84 HG1 LYS 84 -1.948 -2.413 -6.562 675 HD2 LYS 84 HD2 LYS 84 -1.750 -3.356 -8.796 676 HD3 LYS 84 HD1 LYS 84 -0.407 -4.377 -8.278 677 HE2 LYS 84 HE2 LYS 84 -3.241 -4.512 -7.204 678 HE3 LYS 84 HE1 LYS 84 -2.509 -5.663 -8.322 679 HZ1 LYS 84 HZ1 LYS 84 -2.262 -5.493 -5.492 680 HZ2 LYS 84 HZ2 LYS 84 -1.806 -6.751 -6.539 681 HZ3 LYS 84 HZ3 LYS 84 -0.737 -5.468 -6.241 682 H VAL 85 HN VAL 85 0.368 1.223 -7.050 683 HA VAL 85 HA VAL 85 -2.286 1.834 -5.952 684 HB VAL 85 HB VAL 85 -1.727 3.822 -4.982 685 HG11 VAL 85 HG11 VAL 85 0.381 3.426 -3.618 686 HG12 VAL 85 HG12 VAL 85 -0.864 2.179 -3.554 687 HG13 VAL 85 HG13 VAL 85 0.567 1.947 -4.551 688 HG21 VAL 85 HG21 VAL 85 -0.434 5.337 -6.120 689 HG22 VAL 85 HG22 VAL 85 0.959 4.538 -5.416 690 HG23 VAL 85 HG23 VAL 85 0.386 4.072 -7.008 691 H GLU 86 HN GLU 86 -3.623 2.712 -7.320 692 HA GLU 86 HA GLU 86 -2.562 3.581 -9.952 693 HB2 GLU 86 HB2 GLU 86 -3.719 1.553 -10.312 694 HB3 GLU 86 HB1 GLU 86 -5.001 1.985 -9.190 695 HG2 GLU 86 HG2 GLU 86 -5.992 3.487 -10.696 696 HG3 GLU 86 HG1 GLU 86 -4.517 3.669 -11.642 697 H VAL 87 HN VAL 87 -3.047 5.505 -10.643 698 HA VAL 87 HA VAL 87 -4.308 7.462 -9.079 699 HB VAL 87 HB VAL 87 -2.847 8.138 -10.867 700 HG11 VAL 87 HG11 VAL 87 -3.602 6.100 -12.325 701 HG12 VAL 87 HG12 VAL 87 -4.829 7.206 -12.939 702 HG13 VAL 87 HG13 VAL 87 -3.121 7.589 -13.131 703 HG21 VAL 87 HG21 VAL 87 -4.952 9.518 -10.274 704 HG22 VAL 87 HG22 VAL 87 -4.125 9.911 -11.781 705 HG23 VAL 87 HG23 VAL 87 -5.602 8.946 -11.811 706 H LEU 88 HN LEU 88 -6.313 7.065 -8.313 707 HA LEU 88 HA LEU 88 -8.417 6.095 -10.107 708 HB2 LEU 88 HB2 LEU 88 -7.846 5.440 -7.552 709 HB3 LEU 88 HB1 LEU 88 -8.989 6.740 -7.251 710 HG LEU 88 HG LEU 88 -10.193 4.633 -7.332 711 HD11 LEU 88 HD11 LEU 88 -11.881 5.222 -8.871 712 HD12 LEU 88 HD12 LEU 88 -11.118 6.750 -8.444 713 HD13 LEU 88 HD13 LEU 88 -10.734 5.968 -9.980 714 HD21 LEU 88 HD21 LEU 88 -8.301 3.730 -9.051 715 HD22 LEU 88 HD22 LEU 88 -9.890 2.983 -8.901 716 HD23 LEU 88 HD23 LEU 88 -9.573 4.122 -10.209 717 H ASP 89 HN ASP 89 -7.279 9.037 -8.723 718 HA ASP 89 HA ASP 89 -8.912 10.697 -10.204 719 HB2 ASP 89 HB2 ASP 89 -10.477 9.660 -8.193 720 HB3 ASP 89 HB1 ASP 89 -9.824 11.093 -7.416 721 H THR 90 HN THR 90 -7.672 12.471 -10.340 722 HA THR 90 HA THR 90 -6.372 13.552 -7.962 723 HB THR 90 HB THR 90 -5.028 11.692 -9.477 724 HG1 THR 90 HG1 THR 90 -3.219 12.378 -8.349 725 HG21 THR 90 HG21 THR 90 -4.024 14.422 -10.332 726 HG22 THR 90 HG22 THR 90 -3.301 12.868 -10.740 727 HG23 THR 90 HG23 THR 90 -4.888 13.291 -11.375 728 H ASP 91 HN ASP 91 -6.343 15.706 -8.034 729 HA ASP 91 HA ASP 91 -6.479 17.063 -10.679 730 HB2 ASP 91 HB2 ASP 91 -8.782 16.845 -9.651 731 HB3 ASP 91 HB1 ASP 91 -8.210 17.866 -8.333 732 H TYR 92 HN TYR 92 -5.445 16.875 -7.469 733 HA TYR 92 HA TYR 92 -4.050 18.098 -6.145 734 HB2 TYR 92 HB2 TYR 92 -2.991 19.314 -8.689 735 HB3 TYR 92 HB1 TYR 92 -2.128 19.008 -7.188 736 HD1 TYR 92 HD2 TYR 92 -2.914 16.220 -6.544 737 HD2 TYR 92 HD1 TYR 92 -1.933 18.021 -10.323 738 HE1 TYR 92 HE2 TYR 92 -2.192 14.021 -7.407 739 HE2 TYR 92 HE1 TYR 92 -1.218 15.813 -11.185 740 HH TYR 92 HH TYR 92 -0.534 13.692 -10.446 741 H LYS 93 HN LYS 93 -6.465 19.499 -7.851 742 HA LYS 93 HA LYS 93 -5.840 22.275 -7.465 743 HB2 LYS 93 HB2 LYS 93 -7.409 21.423 -9.226 744 HB3 LYS 93 HB1 LYS 93 -8.546 21.005 -7.943 745 HG2 LYS 93 HG2 LYS 93 -8.773 23.300 -7.278 746 HG3 LYS 93 HG1 LYS 93 -7.420 23.792 -8.295 747 HD2 LYS 93 HD2 LYS 93 -9.496 24.382 -9.419 748 HD3 LYS 93 HD1 LYS 93 -8.723 23.066 -10.303 749 HE2 LYS 93 HE2 LYS 93 -10.247 21.458 -9.477 750 HE3 LYS 93 HE1 LYS 93 -10.783 22.511 -8.168 751 HZ1 LYS 93 HZ1 LYS 93 -11.702 22.356 -10.872 752 HZ2 LYS 93 HZ2 LYS 93 -12.437 23.073 -9.518 753 HZ3 LYS 93 HZ3 LYS 93 -11.298 23.945 -10.423 754 H SER 94 HN SER 94 -7.623 19.801 -5.751 755 HA SER 94 HA SER 94 -7.500 21.357 -3.307 756 HB2 SER 94 HB2 SER 94 -9.989 21.016 -2.923 757 HB3 SER 94 HB1 SER 94 -9.560 22.242 -4.113 758 HG SER 94 HG SER 94 -9.759 20.417 -5.669 759 H TYR 95 HN TYR 95 -8.012 18.410 -5.081 760 HA TYR 95 HA TYR 95 -7.184 16.839 -2.850 761 HB2 TYR 95 HB2 TYR 95 -9.299 15.528 -2.647 762 HB3 TYR 95 HB1 TYR 95 -9.429 17.193 -2.078 763 HD1 TYR 95 HD1 TYR 95 -10.282 14.861 -4.818 764 HD2 TYR 95 HD2 TYR 95 -10.769 18.830 -3.253 765 HE1 TYR 95 HE1 TYR 95 -12.109 15.277 -6.443 766 HE2 TYR 95 HE2 TYR 95 -12.597 19.247 -4.876 767 HH TYR 95 HH TYR 95 -14.211 17.942 -6.199 768 H ALA 96 HN ALA 96 -7.360 14.506 -3.268 769 HA ALA 96 HA ALA 96 -7.658 13.680 -6.046 770 HB1 ALA 96 HB1 ALA 96 -5.399 12.613 -6.075 771 HB2 ALA 96 HB2 ALA 96 -5.018 13.453 -4.577 772 HB3 ALA 96 HB3 ALA 96 -5.326 14.374 -6.044 773 H VAL 97 HN VAL 97 -8.222 11.546 -6.214 774 HA VAL 97 HA VAL 97 -8.317 10.002 -3.661 775 HB VAL 97 HB VAL 97 -10.307 9.552 -5.877 776 HG11 VAL 97 HG11 VAL 97 -9.999 7.975 -3.922 777 HG12 VAL 97 HG12 VAL 97 -10.548 9.283 -2.875 778 HG13 VAL 97 HG13 VAL 97 -11.629 8.623 -4.102 779 HG21 VAL 97 HG21 VAL 97 -10.422 11.966 -5.348 780 HG22 VAL 97 HG22 VAL 97 -11.841 11.122 -4.731 781 HG23 VAL 97 HG23 VAL 97 -10.543 11.583 -3.631 782 H ILE 98 HN ILE 98 -7.273 8.069 -3.710 783 HA ILE 98 HA ILE 98 -6.555 6.989 -6.361 784 HB ILE 98 HB ILE 98 -4.731 8.213 -5.311 785 HG12 ILE 98 HG12 ILE 98 -4.281 5.237 -4.998 786 HG13 ILE 98 HG11 ILE 98 -4.262 6.080 -6.551 787 HG21 ILE 98 HG21 ILE 98 -5.068 6.272 -3.012 788 HG22 ILE 98 HG22 ILE 98 -3.863 7.551 -3.136 789 HG23 ILE 98 HG23 ILE 98 -5.570 7.963 -2.976 790 HD11 ILE 98 HD11 ILE 98 -2.607 7.508 -4.647 791 HD12 ILE 98 HD12 ILE 98 -2.121 5.831 -4.724 792 HD13 ILE 98 HD13 ILE 98 -2.164 6.786 -6.198 793 H TYR 99 HN TYR 99 -6.393 4.790 -6.535 794 HA TYR 99 HA TYR 99 -7.759 3.218 -4.452 795 HB2 TYR 99 HB2 TYR 99 -8.570 3.051 -6.785 796 HB3 TYR 99 HB1 TYR 99 -6.984 2.465 -7.283 797 HD1 TYR 99 HD1 TYR 99 -9.992 1.694 -5.263 798 HD2 TYR 99 HD2 TYR 99 -6.270 0.213 -6.812 799 HE1 TYR 99 HE1 TYR 99 -10.645 -0.613 -4.627 800 HE2 TYR 99 HE2 TYR 99 -6.922 -2.093 -6.176 801 HH TYR 99 HH TYR 99 -9.181 -3.325 -5.803 802 H ALA 100 HN ALA 100 -6.386 2.526 -2.940 803 HA ALA 100 HA ALA 100 -3.737 1.481 -3.744 804 HB1 ALA 100 HB1 ALA 100 -3.553 3.191 -2.069 805 HB2 ALA 100 HB2 ALA 100 -3.240 1.647 -1.279 806 HB3 ALA 100 HB3 ALA 100 -4.804 2.437 -1.080 807 H THR 101 HN THR 101 -3.233 -0.617 -3.487 808 HA THR 101 HA THR 101 -4.939 -2.335 -1.822 809 HB THR 101 HB THR 101 -5.919 -2.479 -4.061 810 HG1 THR 101 HG1 THR 101 -4.762 -4.840 -4.284 811 HG21 THR 101 HG21 THR 101 -4.667 -3.041 -5.993 812 HG22 THR 101 HG22 THR 101 -3.702 -1.811 -5.176 813 HG23 THR 101 HG23 THR 101 -3.262 -3.513 -5.038 814 H ARG 102 HN ARG 102 -3.774 -3.732 -0.683 815 HA ARG 102 HA ARG 102 -0.992 -4.313 -1.525 816 HB2 ARG 102 HB2 ARG 102 -1.185 -2.863 0.517 817 HB3 ARG 102 HB1 ARG 102 -2.037 -4.189 1.308 818 HG2 ARG 102 HG2 ARG 102 -0.056 -5.661 0.829 819 HG3 ARG 102 HG1 ARG 102 0.795 -4.237 0.229 820 HD2 ARG 102 HD2 ARG 102 1.442 -4.509 2.523 821 HD3 ARG 102 HD1 ARG 102 0.331 -3.143 2.467 822 HE ARG 102 HE ARG 102 -1.190 -4.392 3.707 823 HH11 ARG 102 HH21 ARG 102 1.318 -6.390 2.409 824 HH12 ARG 102 HH22 ARG 102 0.846 -7.800 3.298 825 HH21 ARG 102 HH11 ARG 102 -1.816 -6.236 4.877 826 HH22 ARG 102 HH12 ARG 102 -0.929 -7.712 4.695 827 H VAL 103 HN VAL 103 -0.539 -6.509 -1.835 828 HA VAL 103 HA VAL 103 -2.542 -8.389 -0.728 829 HB VAL 103 HB VAL 103 -2.653 -8.201 -3.174 830 HG11 VAL 103 HG11 VAL 103 0.136 -9.325 -3.348 831 HG12 VAL 103 HG12 VAL 103 -0.812 -8.508 -4.589 832 HG13 VAL 103 HG13 VAL 103 -0.112 -7.580 -3.263 833 HG21 VAL 103 HG21 VAL 103 -3.055 -10.397 -2.080 834 HG22 VAL 103 HG22 VAL 103 -2.368 -10.582 -3.692 835 HG23 VAL 103 HG23 VAL 103 -1.346 -10.790 -2.271 836 H LYS 104 HN LYS 104 -1.748 -9.590 0.855 837 HA LYS 104 HA LYS 104 1.137 -10.110 0.988 838 HB2 LYS 104 HB2 LYS 104 -0.282 -9.184 2.956 839 HB3 LYS 104 HB1 LYS 104 -0.908 -10.825 3.090 840 HG2 LYS 104 HG2 LYS 104 1.328 -11.709 3.432 841 HG3 LYS 104 HG1 LYS 104 2.043 -10.126 3.127 842 HD2 LYS 104 HD2 LYS 104 0.687 -9.260 5.092 843 HD3 LYS 104 HD1 LYS 104 0.295 -10.940 5.459 844 HE2 LYS 104 HE2 LYS 104 3.116 -9.858 5.212 845 HE3 LYS 104 HE1 LYS 104 2.272 -10.099 6.742 846 HZ1 LYS 104 HZ1 LYS 104 3.759 -11.960 5.419 847 HZ2 LYS 104 HZ2 LYS 104 2.653 -12.274 6.670 848 HZ3 LYS 104 HZ3 LYS 104 2.160 -12.404 5.052 849 H ASP 105 HN ASP 105 1.660 -12.388 1.821 850 HA ASP 105 HA ASP 105 0.854 -14.263 -0.084 851 HB2 ASP 105 HB2 ASP 105 2.918 -14.417 1.311 852 HB3 ASP 105 HB1 ASP 105 1.909 -14.856 2.689 853 H GLY 106 HN GLY 106 -1.146 -14.941 -0.372 854 HA2 GLY 106 HA2 GLY 106 -2.997 -16.276 0.073 855 HA3 GLY 106 HA1 GLY 106 -2.523 -16.333 1.763 856 H ARG 107 HN ARG 107 -2.478 -13.111 1.071 857 HA ARG 107 HA ARG 107 -5.383 -12.768 1.553 858 HB2 ARG 107 HB2 ARG 107 -3.165 -11.411 3.097 859 HB3 ARG 107 HB1 ARG 107 -4.890 -11.088 3.272 860 HG2 ARG 107 HG2 ARG 107 -5.202 -13.535 3.820 861 HG3 ARG 107 HG1 ARG 107 -3.444 -13.683 3.865 862 HD2 ARG 107 HD2 ARG 107 -5.177 -11.934 5.626 863 HD3 ARG 107 HD1 ARG 107 -4.200 -13.311 6.125 864 HE ARG 107 HE ARG 107 -2.472 -11.476 4.919 865 HH11 ARG 107 HH21 ARG 107 -4.607 -11.692 7.634 866 HH12 ARG 107 HH22 ARG 107 -3.693 -10.596 8.615 867 HH21 ARG 107 HH11 ARG 107 -1.268 -10.037 6.200 868 HH22 ARG 107 HH12 ARG 107 -1.803 -9.658 7.804 869 H THR 108 HN THR 108 -6.332 -11.009 0.695 870 HA THR 108 HA THR 108 -4.661 -9.162 -0.916 871 HB THR 108 HB THR 108 -7.482 -10.105 -1.488 872 HG1 THR 108 HG1 THR 108 -6.311 -11.038 -3.330 873 HG21 THR 108 HG21 THR 108 -5.571 -8.237 -2.898 874 HG22 THR 108 HG22 THR 108 -6.949 -8.977 -3.715 875 HG23 THR 108 HG23 THR 108 -7.212 -7.896 -2.345 876 H LEU 109 HN LEU 109 -5.384 -6.941 -0.993 877 HA LEU 109 HA LEU 109 -7.528 -6.195 0.869 878 HB2 LEU 109 HB2 LEU 109 -5.488 -6.261 2.216 879 HB3 LEU 109 HB1 LEU 109 -4.706 -5.155 1.113 880 HG LEU 109 HG LEU 109 -6.444 -3.454 1.629 881 HD11 LEU 109 HD11 LEU 109 -8.372 -4.601 2.304 882 HD12 LEU 109 HD12 LEU 109 -7.472 -5.712 3.337 883 HD13 LEU 109 HD13 LEU 109 -7.736 -4.045 3.849 884 HD21 LEU 109 HD21 LEU 109 -5.509 -2.830 3.722 885 HD22 LEU 109 HD22 LEU 109 -5.233 -4.510 4.183 886 HD23 LEU 109 HD23 LEU 109 -4.247 -3.768 2.922 887 H HIS 110 HN HIS 110 -8.378 -4.211 0.561 888 HA HIS 110 HA HIS 110 -7.256 -2.538 -1.561 889 HB2 HIS 110 HB2 HIS 110 -10.222 -3.087 -1.409 890 HB3 HIS 110 HB1 HIS 110 -9.329 -2.301 -2.711 891 HD1 HIS 110 HD1 HIS 110 -10.521 -5.573 -1.586 892 HD2 HIS 110 HD2 HIS 110 -7.520 -4.186 -4.124 893 HE1 HIS 110 HE1 HIS 110 -9.800 -7.552 -2.992 894 H MET 111 HN MET 111 -7.635 -0.284 -1.275 895 HA MET 111 HA MET 111 -9.392 0.611 0.827 896 HB2 MET 111 HB2 MET 111 -7.226 1.868 1.816 897 HB3 MET 111 HB1 MET 111 -7.761 0.300 2.418 898 HG2 MET 111 HG2 MET 111 -6.198 -0.838 0.899 899 HG3 MET 111 HG1 MET 111 -5.678 0.718 0.254 900 HE1 MET 111 HE1 MET 111 -3.806 1.911 0.981 901 HE2 MET 111 HE2 MET 111 -4.935 2.719 2.065 902 HE3 MET 111 HE3 MET 111 -3.345 2.214 2.654 903 H MET 112 HN MET 112 -9.740 2.861 0.766 904 HA MET 112 HA MET 112 -8.704 4.195 -1.675 905 HB2 MET 112 HB2 MET 112 -11.201 3.820 -1.485 906 HB3 MET 112 HB1 MET 112 -11.188 4.921 -0.110 907 HG2 MET 112 HG2 MET 112 -11.729 6.270 -1.998 908 HG3 MET 112 HG1 MET 112 -10.038 6.609 -1.641 909 HE1 MET 112 HE1 MET 112 -11.895 4.132 -4.947 910 HE2 MET 112 HE2 MET 112 -12.574 4.692 -3.422 911 HE3 MET 112 HE3 MET 112 -12.324 5.830 -4.753 912 H ARG 113 HN ARG 113 -7.854 6.281 -1.520 913 HA ARG 113 HA ARG 113 -7.568 7.389 1.203 914 HB2 ARG 113 HB2 ARG 113 -5.399 7.007 -0.847 915 HB3 ARG 113 HB1 ARG 113 -5.231 8.047 0.567 916 HG2 ARG 113 HG2 ARG 113 -5.803 6.075 2.009 917 HG3 ARG 113 HG1 ARG 113 -5.773 5.066 0.562 918 HD2 ARG 113 HD2 ARG 113 -3.448 5.529 0.185 919 HD3 ARG 113 HD1 ARG 113 -3.439 6.790 1.414 920 HE ARG 113 HE ARG 113 -3.245 3.937 1.867 921 HH11 ARG 113 HH21 ARG 113 -4.116 7.031 3.150 922 HH12 ARG 113 HH22 ARG 113 -3.891 6.563 4.802 923 HH21 ARG 113 HH11 ARG 113 -2.947 3.316 4.032 924 HH22 ARG 113 HH12 ARG 113 -3.229 4.461 5.302 925 H LEU 114 HN LEU 114 -7.964 9.480 1.418 926 HA LEU 114 HA LEU 114 -8.341 11.083 -1.029 927 HB2 LEU 114 HB2 LEU 114 -10.416 11.219 -0.062 928 HB3 LEU 114 HB1 LEU 114 -9.807 10.862 1.545 929 HG LEU 114 HG LEU 114 -8.896 13.211 1.664 930 HD11 LEU 114 HD11 LEU 114 -9.304 14.792 -0.022 931 HD12 LEU 114 HD12 LEU 114 -8.909 13.350 -0.953 932 HD13 LEU 114 HD13 LEU 114 -10.591 13.833 -0.749 933 HD21 LEU 114 HD21 LEU 114 -10.925 14.129 2.334 934 HD22 LEU 114 HD22 LEU 114 -11.812 13.426 0.985 935 HD23 LEU 114 HD23 LEU 114 -11.323 12.413 2.340 936 H TYR 115 HN TYR 115 -7.007 12.632 -1.412 937 HA TYR 115 HA TYR 115 -5.128 13.574 0.651 938 HB2 TYR 115 HB2 TYR 115 -5.047 13.632 -2.364 939 HB3 TYR 115 HB1 TYR 115 -3.863 14.447 -1.356 940 HD1 TYR 115 HD1 TYR 115 -5.510 11.063 -1.537 941 HD2 TYR 115 HD2 TYR 115 -1.878 13.299 -1.006 942 HE1 TYR 115 HE1 TYR 115 -4.239 8.957 -1.325 943 HE2 TYR 115 HE2 TYR 115 -0.612 11.182 -0.798 944 HH TYR 115 HH TYR 115 -2.199 8.138 -0.437 945 H SER 116 HN SER 116 -4.495 15.828 0.587 946 HA SER 116 HA SER 116 -6.540 17.692 -0.467 947 HB2 SER 116 HB2 SER 116 -6.886 17.438 1.973 948 HB3 SER 116 HB1 SER 116 -5.187 17.838 2.252 949 HG SER 116 HG SER 116 -5.642 19.842 1.150 950 H ARG 117 HN ARG 117 -5.611 19.467 -1.529 951 HA ARG 117 HA ARG 117 -2.774 19.387 -1.943 952 HB2 ARG 117 HB2 ARG 117 -4.596 20.188 -3.582 953 HB3 ARG 117 HB1 ARG 117 -4.599 21.685 -2.657 954 HG2 ARG 117 HG2 ARG 117 -3.068 21.978 -4.501 955 HG3 ARG 117 HG1 ARG 117 -2.114 21.844 -3.027 956 HD2 ARG 117 HD2 ARG 117 -2.670 19.286 -4.454 957 HD3 ARG 117 HD1 ARG 117 -1.577 20.406 -5.260 958 HE ARG 117 HE ARG 117 -0.992 18.861 -2.927 959 HH11 ARG 117 HH21 ARG 117 -0.465 21.900 -4.498 960 HH12 ARG 117 HH22 ARG 117 1.072 22.176 -3.750 961 HH21 ARG 117 HH11 ARG 117 1.024 19.217 -1.942 962 HH22 ARG 117 HH12 ARG 117 1.915 20.657 -2.303 963 H SER 118 HN SER 118 -4.838 20.790 0.374 964 HA SER 118 HA SER 118 -2.592 22.350 1.475 965 HB2 SER 118 HB2 SER 118 -4.038 23.965 0.380 966 HB3 SER 118 HB1 SER 118 -5.454 23.289 1.179 967 HG SER 118 HG SER 118 -3.327 24.793 2.238 968 HA PRO 119 HA PRO 119 -3.204 20.213 5.307 969 HB2 PRO 119 HB2 PRO 119 -3.507 22.992 6.415 970 HB3 PRO 119 HB1 PRO 119 -2.547 21.633 7.035 971 HG2 PRO 119 HG2 PRO 119 -1.446 23.651 5.639 972 HG3 PRO 119 HG1 PRO 119 -0.835 21.991 5.557 973 HD2 PRO 119 HD2 PRO 119 -2.240 23.545 3.483 974 HD3 PRO 119 HD1 PRO 119 -1.290 22.052 3.318 975 H GLU 120 HN GLU 120 -5.452 22.635 4.173 976 HA GLU 120 HA GLU 120 -7.521 21.938 6.080 977 HB2 GLU 120 HB2 GLU 120 -7.686 23.683 3.616 978 HB3 GLU 120 HB1 GLU 120 -8.845 23.615 4.943 979 HG2 GLU 120 HG2 GLU 120 -7.041 24.359 6.503 980 HG3 GLU 120 HG1 GLU 120 -5.964 24.540 5.119 981 H VAL 121 HN VAL 121 -9.655 21.326 5.297 982 HA VAL 121 HA VAL 121 -9.523 19.435 3.015 983 HB VAL 121 HB VAL 121 -11.289 19.209 5.462 984 HG11 VAL 121 HG11 VAL 121 -10.578 17.269 3.240 985 HG12 VAL 121 HG12 VAL 121 -11.612 16.908 4.623 986 HG13 VAL 121 HG13 VAL 121 -12.125 18.096 3.424 987 HG21 VAL 121 HG21 VAL 121 -9.716 17.374 6.112 988 HG22 VAL 121 HG22 VAL 121 -8.653 17.862 4.792 989 HG23 VAL 121 HG23 VAL 121 -8.954 18.964 6.135 990 H SER 122 HN SER 122 -10.870 19.840 1.379 991 HA SER 122 HA SER 122 -12.805 21.990 1.611 992 HB2 SER 122 HB2 SER 122 -11.422 21.887 -0.382 993 HB3 SER 122 HB1 SER 122 -11.992 20.257 -0.728 994 HG SER 122 HG SER 122 -14.142 21.226 -0.784 995 HA PRO 123 HA PRO 123 -16.229 19.303 2.781 996 HB2 PRO 123 HB2 PRO 123 -17.687 21.231 0.994 997 HB3 PRO 123 HB1 PRO 123 -18.142 20.621 2.597 998 HG2 PRO 123 HG2 PRO 123 -17.100 23.054 2.283 999 HG3 PRO 123 HG1 PRO 123 -16.723 22.056 3.698 1000 HD2 PRO 123 HD2 PRO 123 -14.983 22.763 1.396 1001 HD3 PRO 123 HD1 PRO 123 -14.533 22.276 3.045 1002 H ALA 124 HN ALA 124 -15.534 20.270 -0.533 1003 HA ALA 124 HA ALA 124 -17.189 18.253 -1.754 1004 HB1 ALA 124 HB1 ALA 124 -15.987 18.914 -3.836 1005 HB2 ALA 124 HB2 ALA 124 -14.960 19.973 -2.868 1006 HB3 ALA 124 HB3 ALA 124 -16.692 20.288 -2.984 1007 H ALA 125 HN ALA 125 -13.818 18.563 -0.814 1008 HA ALA 125 HA ALA 125 -12.794 16.295 -2.145 1009 HB1 ALA 125 HB1 ALA 125 -11.903 17.547 0.463 1010 HB2 ALA 125 HB2 ALA 125 -11.368 18.034 -1.143 1011 HB3 ALA 125 HB3 ALA 125 -10.954 16.436 -0.522 1012 H THR 126 HN THR 126 -14.284 16.729 1.006 1013 HA THR 126 HA THR 126 -13.875 14.016 1.865 1014 HB THR 126 HB THR 126 -16.077 15.616 3.079 1015 HG1 THR 126 HG1 THR 126 -13.564 16.397 3.861 1016 HG21 THR 126 HG21 THR 126 -13.663 14.512 4.490 1017 HG22 THR 126 HG22 THR 126 -15.324 14.639 5.066 1018 HG23 THR 126 HG23 THR 126 -14.890 13.395 3.892 1019 H ALA 127 HN ALA 127 -16.376 15.775 0.161 1020 HA ALA 127 HA ALA 127 -18.417 13.799 0.402 1021 HB1 ALA 127 HB1 ALA 127 -19.616 15.188 -1.122 1022 HB2 ALA 127 HB2 ALA 127 -18.130 15.989 -1.633 1023 HB3 ALA 127 HB3 ALA 127 -18.744 16.230 0.003 1024 H ILE 128 HN ILE 128 -16.275 14.725 -2.338 1025 HA ILE 128 HA ILE 128 -17.327 12.808 -4.132 1026 HB ILE 128 HB ILE 128 -15.666 14.854 -4.459 1027 HG12 ILE 128 HG12 ILE 128 -16.613 13.650 -6.313 1028 HG13 ILE 128 HG11 ILE 128 -14.882 13.798 -6.574 1029 HG21 ILE 128 HG21 ILE 128 -13.870 13.765 -3.053 1030 HG22 ILE 128 HG22 ILE 128 -13.692 12.558 -4.327 1031 HG23 ILE 128 HG23 ILE 128 -13.347 14.253 -4.663 1032 HD11 ILE 128 HD11 ILE 128 -16.454 11.364 -5.755 1033 HD12 ILE 128 HD12 ILE 128 -15.307 11.536 -7.082 1034 HD13 ILE 128 HD13 ILE 128 -14.726 11.470 -5.419 1035 H PHE 129 HN PHE 129 -14.923 12.877 -1.716 1036 HA PHE 129 HA PHE 129 -13.727 10.356 -2.032 1037 HB2 PHE 129 HB2 PHE 129 -12.747 12.086 -0.657 1038 HB3 PHE 129 HB1 PHE 129 -14.146 12.080 0.414 1039 HD1 PHE 129 HD1 PHE 129 -12.082 9.295 -1.098 1040 HD2 PHE 129 HD2 PHE 129 -13.537 11.182 2.480 1041 HE1 PHE 129 HE1 PHE 129 -11.075 7.492 0.259 1042 HE2 PHE 129 HE2 PHE 129 -12.514 9.381 3.833 1043 HZ PHE 129 HZ PHE 129 -11.281 7.537 2.728 1044 H ARG 130 HN ARG 130 -16.442 11.417 0.003 1045 HA ARG 130 HA ARG 130 -16.957 8.868 1.154 1046 HB2 ARG 130 HB2 ARG 130 -17.741 11.134 2.015 1047 HB3 ARG 130 HB1 ARG 130 -18.982 11.074 0.763 1048 HG2 ARG 130 HG2 ARG 130 -19.802 8.932 1.671 1049 HG3 ARG 130 HG1 ARG 130 -18.561 8.987 2.924 1050 HD2 ARG 130 HD2 ARG 130 -19.535 11.250 3.597 1051 HD3 ARG 130 HD1 ARG 130 -20.895 10.870 2.546 1052 HE ARG 130 HE ARG 130 -20.420 9.791 5.151 1053 HH11 ARG 130 HH21 ARG 130 -21.621 9.068 1.986 1054 HH12 ARG 130 HH22 ARG 130 -22.710 7.836 2.530 1055 HH21 ARG 130 HH11 ARG 130 -21.847 8.178 5.871 1056 HH22 ARG 130 HH12 ARG 130 -22.839 7.333 4.730 1057 H LYS 131 HN LYS 131 -18.055 10.503 -1.752 1058 HA LYS 131 HA LYS 131 -20.215 8.859 -2.440 1059 HB2 LYS 131 HB2 LYS 131 -19.568 11.002 -3.579 1060 HB3 LYS 131 HB1 LYS 131 -18.258 10.123 -4.368 1061 HG2 LYS 131 HG2 LYS 131 -19.908 8.555 -5.343 1062 HG3 LYS 131 HG1 LYS 131 -21.212 9.470 -4.584 1063 HD2 LYS 131 HD2 LYS 131 -20.424 11.505 -5.827 1064 HD3 LYS 131 HD1 LYS 131 -19.270 10.479 -6.681 1065 HE2 LYS 131 HE2 LYS 131 -21.326 10.778 -8.011 1066 HE3 LYS 131 HE1 LYS 131 -21.130 9.093 -7.529 1067 HZ1 LYS 131 HZ1 LYS 131 -22.757 11.047 -6.003 1068 HZ2 LYS 131 HZ2 LYS 131 -23.403 10.029 -7.200 1069 HZ3 LYS 131 HZ3 LYS 131 -22.708 9.361 -5.805 1070 H LEU 132 HN LEU 132 -16.795 8.610 -3.412 1071 HA LEU 132 HA LEU 132 -17.033 6.215 -4.872 1072 HB2 LEU 132 HB2 LEU 132 -14.803 7.723 -3.575 1073 HB3 LEU 132 HB1 LEU 132 -14.487 6.060 -4.045 1074 HG LEU 132 HG LEU 132 -13.927 7.851 -5.777 1075 HD11 LEU 132 HD11 LEU 132 -14.458 5.327 -6.185 1076 HD12 LEU 132 HD12 LEU 132 -15.969 5.925 -6.868 1077 HD13 LEU 132 HD13 LEU 132 -14.430 6.425 -7.562 1078 HD21 LEU 132 HD21 LEU 132 -16.220 9.023 -5.246 1079 HD22 LEU 132 HD22 LEU 132 -15.612 9.014 -6.899 1080 HD23 LEU 132 HD23 LEU 132 -16.869 7.877 -6.418 1081 H ALA 133 HN ALA 133 -16.056 6.749 -1.479 1082 HA ALA 133 HA ALA 133 -15.670 4.050 -0.838 1083 HB1 ALA 133 HB1 ALA 133 -15.615 4.695 1.409 1084 HB2 ALA 133 HB2 ALA 133 -16.745 6.025 1.155 1085 HB3 ALA 133 HB3 ALA 133 -15.093 6.143 0.549 1086 H GLY 134 HN GLY 134 -18.632 5.998 -1.015 1087 HA2 GLY 134 HA2 GLY 134 -20.312 4.150 0.339 1088 HA3 GLY 134 HA1 GLY 134 -20.833 5.424 -0.761 1089 H GLU 135 HN GLU 135 -19.366 4.612 -3.047 1090 HA GLU 135 HA GLU 135 -21.137 2.787 -4.227 1091 HB2 GLU 135 HB2 GLU 135 -18.324 3.601 -4.991 1092 HB3 GLU 135 HB1 GLU 135 -19.335 2.559 -5.993 1093 HG2 GLU 135 HG2 GLU 135 -21.065 4.316 -6.079 1094 HG3 GLU 135 HG1 GLU 135 -20.051 5.363 -5.088 1095 H ARG 136 HN ARG 136 -18.285 2.361 -2.298 1096 HA ARG 136 HA ARG 136 -18.123 -0.511 -2.895 1097 HB2 ARG 136 HB2 ARG 136 -16.396 1.477 -1.453 1098 HB3 ARG 136 HB1 ARG 136 -16.241 -0.231 -1.056 1099 HG2 ARG 136 HG2 ARG 136 -14.654 0.458 -2.839 1100 HG3 ARG 136 HG1 ARG 136 -15.786 -0.772 -3.396 1101 HD2 ARG 136 HD2 ARG 136 -16.561 2.092 -3.778 1102 HD3 ARG 136 HD1 ARG 136 -15.307 1.437 -4.825 1103 HE ARG 136 HE ARG 136 -17.722 -0.179 -4.610 1104 HH11 ARG 136 HH21 ARG 136 -15.955 2.282 -6.282 1105 HH12 ARG 136 HH22 ARG 136 -16.808 2.072 -7.776 1106 HH21 ARG 136 HH11 ARG 136 -18.844 -0.459 -6.564 1107 HH22 ARG 136 HH12 ARG 136 -18.443 0.521 -7.935 1108 H ASN 137 HN ASN 137 -20.093 1.304 -1.160 1109 HA ASN 137 HA ASN 137 -21.522 0.959 0.611 1110 HB2 ASN 137 HB2 ASN 137 -20.407 -1.806 0.496 1111 HB3 ASN 137 HB1 ASN 137 -21.910 -1.342 1.280 1112 HD21 ASN 137 HD21 ASN 137 -22.723 0.535 -0.850 1113 HD22 ASN 137 HD22 ASN 137 -23.155 -0.412 -2.191 1114 H TYR 138 HN TYR 138 -18.974 1.962 1.185 1115 HA TYR 138 HA TYR 138 -17.967 0.637 3.576 1116 HB2 TYR 138 HB2 TYR 138 -17.135 3.011 1.953 1117 HB3 TYR 138 HB1 TYR 138 -16.605 2.927 3.625 1118 HD1 TYR 138 HD1 TYR 138 -17.166 0.078 1.290 1119 HD2 TYR 138 HD2 TYR 138 -14.301 2.476 3.395 1120 HE1 TYR 138 HE1 TYR 138 -15.375 -1.523 0.668 1121 HE2 TYR 138 HE2 TYR 138 -12.505 0.882 2.769 1122 HH TYR 138 HH TYR 138 -13.111 -2.192 1.585 1123 H THR 139 HN THR 139 -18.689 1.013 5.573 1124 HA THR 139 HA THR 139 -20.632 3.126 6.053 1125 HB THR 139 HB THR 139 -21.233 1.940 7.919 1126 HG1 THR 139 HG1 THR 139 -19.106 2.470 8.833 1127 HG21 THR 139 HG21 THR 139 -19.469 -0.285 6.921 1128 HG22 THR 139 HG22 THR 139 -21.114 -0.368 7.546 1129 HG23 THR 139 HG23 THR 139 -20.815 0.283 5.935 1130 H ASP 140 HN ASP 140 -20.329 4.747 7.742 1131 HA ASP 140 HA ASP 140 -18.155 6.328 7.473 1132 HB2 ASP 140 HB2 ASP 140 -18.693 7.330 9.654 1133 HB3 ASP 140 HB1 ASP 140 -20.148 7.008 8.711 1134 H GLU 141 HN GLU 141 -18.430 3.942 10.178 1135 HA GLU 141 HA GLU 141 -15.931 4.431 11.273 1136 HB2 GLU 141 HB2 GLU 141 -16.099 1.982 12.042 1137 HB3 GLU 141 HB1 GLU 141 -17.386 3.083 12.534 1138 HG2 GLU 141 HG2 GLU 141 -18.835 2.283 10.775 1139 HG3 GLU 141 HG1 GLU 141 -17.534 1.315 10.081 1140 H MET 142 HN MET 142 -16.682 2.847 8.296 1141 HA MET 142 HA MET 142 -14.236 1.330 8.121 1142 HB2 MET 142 HB2 MET 142 -16.025 2.118 5.831 1143 HB3 MET 142 HB1 MET 142 -14.973 0.709 5.956 1144 HG2 MET 142 HG2 MET 142 -16.554 0.374 8.174 1145 HG3 MET 142 HG1 MET 142 -17.682 1.139 7.061 1146 HE1 MET 142 HE1 MET 142 -15.921 -2.317 7.971 1147 HE2 MET 142 HE2 MET 142 -15.179 -2.591 6.399 1148 HE3 MET 142 HE3 MET 142 -14.809 -1.123 7.313 1149 H VAL 143 HN VAL 143 -15.189 4.525 7.527 1150 HA VAL 143 HA VAL 143 -12.611 5.102 6.183 1151 HB VAL 143 HB VAL 143 -14.786 5.309 4.785 1152 HG11 VAL 143 HG11 VAL 143 -15.973 6.538 6.671 1153 HG12 VAL 143 HG12 VAL 143 -14.978 7.935 6.267 1154 HG13 VAL 143 HG13 VAL 143 -16.098 7.276 5.076 1155 HG21 VAL 143 HG21 VAL 143 -12.696 7.463 5.094 1156 HG22 VAL 143 HG22 VAL 143 -12.782 6.186 3.882 1157 HG23 VAL 143 HG23 VAL 143 -13.920 7.532 3.823 1158 H ALA 144 HN ALA 144 -11.323 6.341 7.383 1159 HA ALA 144 HA ALA 144 -12.543 8.044 9.489 1160 HB1 ALA 144 HB1 ALA 144 -10.092 6.302 9.452 1161 HB2 ALA 144 HB2 ALA 144 -11.370 6.394 10.659 1162 HB3 ALA 144 HB3 ALA 144 -10.170 7.680 10.549 1163 H MET 145 HN MET 145 -12.334 10.177 9.131 1164 HA MET 145 HA MET 145 -10.397 11.202 7.254 1165 HB2 MET 145 HB2 MET 145 -11.872 13.073 9.044 1166 HB3 MET 145 HB1 MET 145 -11.623 13.150 7.303 1167 HG2 MET 145 HG2 MET 145 -13.266 10.863 7.740 1168 HG3 MET 145 HG1 MET 145 -13.919 12.135 8.765 1169 HE1 MET 145 HE1 MET 145 -13.923 10.984 4.784 1170 HE2 MET 145 HE2 MET 145 -12.871 12.339 4.390 1171 HE3 MET 145 HE3 MET 145 -12.389 11.173 5.628 1172 H LEU 146 HN LEU 146 -8.584 12.537 7.783 1173 HA LEU 146 HA LEU 146 -7.757 12.311 10.580 1174 HB2 LEU 146 HB2 LEU 146 -6.660 11.122 8.390 1175 HB3 LEU 146 HB1 LEU 146 -5.697 12.595 8.475 1176 HG LEU 146 HG LEU 146 -5.170 12.125 10.778 1177 HD11 LEU 146 HD11 LEU 146 -5.805 9.454 11.234 1178 HD12 LEU 146 HD12 LEU 146 -6.633 10.832 11.952 1179 HD13 LEU 146 HD13 LEU 146 -7.265 10.088 10.483 1180 HD21 LEU 146 HD21 LEU 146 -4.658 9.663 9.136 1181 HD22 LEU 146 HD22 LEU 146 -3.801 11.186 8.904 1182 HD23 LEU 146 HD23 LEU 146 -3.656 10.312 10.426 1183 HA PRO 147 HA PRO 147 -7.443 16.793 10.564 1184 HB2 PRO 147 HB2 PRO 147 -6.358 17.135 13.006 1185 HB3 PRO 147 HB1 PRO 147 -8.014 16.515 12.815 1186 HG2 PRO 147 HG2 PRO 147 -5.475 14.973 13.240 1187 HG3 PRO 147 HG1 PRO 147 -7.010 14.852 14.124 1188 HD2 PRO 147 HD2 PRO 147 -6.393 13.143 12.153 1189 HD3 PRO 147 HD1 PRO 147 -8.062 13.685 12.409 1190 H ARG 148 HN ARG 148 -5.812 18.509 10.749 1191 HA ARG 148 HA ARG 148 -3.368 17.878 9.430 1192 HB2 ARG 148 HB2 ARG 148 -2.916 20.257 9.551 1193 HB3 ARG 148 HB1 ARG 148 -4.601 19.996 9.098 1194 HG2 ARG 148 HG2 ARG 148 -5.220 20.255 11.525 1195 HG3 ARG 148 HG1 ARG 148 -3.547 20.714 11.847 1196 HD2 ARG 148 HD2 ARG 148 -3.801 22.528 10.113 1197 HD3 ARG 148 HD1 ARG 148 -5.517 22.142 10.045 1198 HE ARG 148 HE ARG 148 -4.126 23.504 12.210 1199 HH11 ARG 148 HH21 ARG 148 -6.923 21.776 11.132 1200 HH12 ARG 148 HH22 ARG 148 -7.960 22.409 12.366 1201 HH21 ARG 148 HH11 ARG 148 -5.480 24.340 13.831 1202 HH22 ARG 148 HH12 ARG 148 -7.143 23.861 13.894 1203 H GLN 149 HN GLN 149 -4.172 17.800 12.737 1204 HA GLN 149 HA GLN 149 -2.085 18.768 14.162 1205 HB2 GLN 149 HB2 GLN 149 -3.271 15.995 14.415 1206 HB3 GLN 149 HB1 GLN 149 -2.261 16.766 15.639 1207 HG2 GLN 149 HG2 GLN 149 -4.809 18.001 14.570 1208 HG3 GLN 149 HG1 GLN 149 -4.751 17.005 16.022 1209 HE21 GLN 149 HE21 GLN 149 -2.587 17.826 17.421 1210 HE22 GLN 149 HE22 GLN 149 -2.630 19.495 17.730 1211 H GLU 150 HN GLU 150 0.087 18.610 14.130 1212 HA GLU 150 HA GLU 150 1.314 16.239 12.832 1213 HB2 GLU 150 HB2 GLU 150 2.971 17.696 11.801 1214 HB3 GLU 150 HB1 GLU 150 1.349 18.181 11.305 1215 HG2 GLU 150 HG2 GLU 150 1.392 19.876 13.190 1216 HG3 GLU 150 HG1 GLU 150 3.100 19.492 13.397 1217 H GLU 151 HN GLU 151 3.020 15.360 13.822 1218 HA GLU 151 HA GLU 151 4.066 16.696 16.257 1219 HB2 GLU 151 HB2 GLU 151 3.860 13.740 15.604 1220 HB3 GLU 151 HB1 GLU 151 4.604 14.411 17.056 1221 HG2 GLU 151 HG2 GLU 151 1.724 14.887 16.240 1222 HG3 GLU 151 HG1 GLU 151 2.236 13.676 17.414 1223 H CYS 152 HN CYS 152 4.720 15.114 13.245 1224 HA CYS 152 HA CYS 152 7.545 15.927 13.403 1225 HB2 CYS 152 HB2 CYS 152 6.476 13.171 12.860 1226 HB3 CYS 152 HB1 CYS 152 7.996 13.692 12.139 1227 H THR 153 HN THR 153 8.556 15.998 11.241 1228 HA THR 153 HA THR 153 6.783 15.996 8.932 1229 HB THR 153 HB THR 153 7.357 18.369 8.360 1230 HG1 THR 153 HG1 THR 153 7.963 19.600 10.311 1231 HG21 THR 153 HG21 THR 153 5.928 18.207 11.018 1232 HG22 THR 153 HG22 THR 153 5.611 19.306 9.677 1233 HG23 THR 153 HG23 THR 153 5.206 17.598 9.528 1234 H VAL 154 HN VAL 154 7.996 16.427 6.902 1235 HA VAL 154 HA VAL 154 10.514 15.101 6.936 1236 HB VAL 154 HB VAL 154 10.380 15.197 4.587 1237 HG11 VAL 154 HG11 VAL 154 8.081 14.514 4.077 1238 HG12 VAL 154 HG12 VAL 154 8.599 13.829 5.617 1239 HG13 VAL 154 HG13 VAL 154 7.525 15.228 5.591 1240 HG21 VAL 154 HG21 VAL 154 8.643 16.773 3.499 1241 HG22 VAL 154 HG22 VAL 154 8.628 17.609 5.052 1242 HG23 VAL 154 HG23 VAL 154 10.121 17.507 4.119 1243 H ASP 155 HN ASP 155 12.429 16.014 5.962 1244 HA ASP 155 HA ASP 155 12.992 18.650 7.020 1245 HB2 ASP 155 HB2 ASP 155 14.714 17.005 7.276 1246 HB3 ASP 155 HB1 ASP 155 14.739 16.682 5.548 1247 H GLU 156 HN GLU 156 14.201 20.167 5.724 1248 HA GLU 156 HA GLU 156 13.542 20.260 2.869 1249 HB2 GLU 156 HB2 GLU 156 12.765 22.699 3.269 1250 HB3 GLU 156 HB1 GLU 156 11.646 21.390 3.644 1251 HG2 GLU 156 HG2 GLU 156 12.234 21.497 6.005 1252 HG3 GLU 156 HG1 GLU 156 13.458 22.721 5.674 1253 H VAL 157 HN VAL 157 15.830 19.987 2.693 1254 HA VAL 157 HA VAL 157 17.760 21.664 3.831 1255 HB VAL 157 HB VAL 157 19.207 20.838 2.044 1256 HG11 VAL 157 HG11 VAL 157 17.301 18.686 2.987 1257 HG12 VAL 157 HG12 VAL 157 18.984 18.463 2.509 1258 HG13 VAL 157 HG13 VAL 157 18.595 19.368 3.971 1259 HG21 VAL 157 HG21 VAL 157 17.802 20.984 0.114 1260 HG22 VAL 157 HG22 VAL 157 18.123 19.266 0.350 1261 HG23 VAL 157 HG23 VAL 157 16.578 19.951 0.852 1262 HN1 EB4 200 H17 EB4 200 0.846 -0.625 5.857 1263 H8 EB4 200 H8 EB4 200 3.824 2.230 0.411 1264 HN2 EB4 200 H25 EB4 200 3.746 0.893 5.890 1265 H9 EB4 200 H9 EB4 200 -0.837 6.192 3.478 1266 H10 EB4 200 H10 EB4 200 -2.948 -1.361 1.366 1267 HN3 EB4 200 H32 EB4 200 0.996 2.258 7.334 1268 H7 EB4 200 H7 EB4 200 -1.946 0.879 1.015 1269 H11 EB4 200 H11 EB4 200 6.083 1.227 0.609 1270 H12 EB4 200 H12 EB4 200 -1.672 7.240 5.566 1271 H15 EB4 200 H15 EB4 200 -1.137 6.223 7.763 1272 H14 EB4 200 H14 EB4 200 6.918 0.473 2.818 1273 H13 EB4 200 H13 EB4 200 -2.259 -2.736 3.313 1274 H22 EB4 200 H22 EB4 200 0.421 -3.161 7.306 1275 H30 EB4 200 H30 EB4 200 0.721 0.159 10.362 1276 H30A EB4 200 H9N EB4 200 -0.676 0.949 9.477 1277 H24 EB4 200 H24 EB4 200 0.908 2.635 10.274 1278 H28 EB4 200 H28 EB4 200 2.785 -3.074 7.943 1279 H28A EB4 200 H9L EB4 200 2.539 -3.251 6.198 1280 H23 EB4 200 H23 EB4 200 6.034 -0.119 7.512 1281 H29 EB4 200 H29 EB4 200 4.950 0.972 9.439 1282 H29A EB4 200 H9M EB4 200 5.345 2.181 8.121 1283 H21 ACD 300 HA3 ACD 300 1.271 9.913 -10.470 1284 H22 ACD 300 HA4 ACD 300 1.341 11.429 -9.544 1285 H31 ACD 300 HA1 ACD 300 -1.172 11.462 -9.503 1286 H32 ACD 300 HA2 ACD 300 -1.173 9.880 -10.312 1287 H41 ACD 300 HA0 ACD 300 0.150 10.449 -7.623 1288 H42 ACD 300 HAZ ACD 300 0.012 8.865 -8.423 1289 H5 ACD 300 HAY ACD 300 -2.739 9.703 -8.299 1290 H6 ACD 300 HAX ACD 300 -3.004 9.271 -5.735 1291 H71 ACD 300 HAV ACD 300 -0.067 10.083 -5.583 1292 H72 ACD 300 HAW ACD 300 -1.062 9.500 -4.230 1293 H8 ACD 300 HAU ACD 300 0.167 7.568 -6.373 1294 H9 ACD 300 HAT ACD 300 0.512 6.056 -4.277 1295 H101 ACD 300 HAR ACD 300 0.527 7.697 -2.170 1296 H102 ACD 300 HAS ACD 300 -0.935 8.438 -2.857 1297 H11 ACD 300 HAQ ACD 300 -2.165 6.139 -2.548 1298 H12 ACD 300 HAP ACD 300 -1.394 5.030 -0.317 1299 H131 ACD 300 HAN ACD 300 1.406 6.208 -0.810 1300 H132 ACD 300 HAO ACD 300 0.709 5.581 0.764 1301 H14 ACD 300 HAM ACD 300 -0.584 7.963 0.730 1302 H15 ACD 300 HAL ACD 300 1.461 9.595 0.766 1303 H161 ACD 300 HAJ ACD 300 3.709 8.862 0.143 1304 H162 ACD 300 HAK ACD 300 3.226 7.176 0.422 1305 H171 ACD 300 HAH ACD 300 3.914 7.571 -1.930 1306 H172 ACD 300 HAI ACD 300 2.218 7.062 -1.824 1307 H181 ACD 300 HAF ACD 300 1.544 9.492 -1.914 1308 H182 ACD 300 HAG ACD 300 3.251 9.912 -2.187 1309 H191 ACD 300 HAD ACD 300 3.255 8.389 -4.190 1310 H192 ACD 300 HAE ACD 300 1.537 8.086 -3.926 1311 H201 ACD 300 HAA ACD 300 1.786 9.811 -5.641 1312 H202 ACD 300 HAB ACD 300 2.821 10.779 -4.571 1313 H203 ACD 300 HAC ACD 300 1.101 10.557 -4.178 Start of MODEL 19 1 H1 MET 1 HT1 MET 1 4.776 18.980 -19.572 2 H2 MET 1 HT2 MET 1 6.096 18.925 -18.504 3 H3 MET 1 HT3 MET 1 6.074 17.934 -19.884 4 HA MET 1 HA MET 1 7.014 20.591 -19.605 5 HB2 MET 1 HB2 MET 1 8.109 18.605 -20.727 6 HB3 MET 1 HB1 MET 1 6.939 18.782 -22.035 7 HG2 MET 1 HG2 MET 1 7.711 21.183 -22.270 8 HG3 MET 1 HG1 MET 1 9.011 20.802 -21.142 9 HE1 MET 1 HE1 MET 1 11.231 18.335 -22.760 10 HE2 MET 1 HE2 MET 1 10.530 19.015 -21.293 11 HE3 MET 1 HE3 MET 1 9.758 17.638 -22.089 12 H THR 2 HN THR 2 4.895 19.111 -22.076 13 HA THR 2 HA THR 2 4.128 21.596 -23.220 14 HB THR 2 HB THR 2 2.628 18.973 -23.359 15 HG1 THR 2 HG1 THR 2 5.011 19.124 -23.930 16 HG21 THR 2 HG21 THR 2 1.428 20.946 -24.229 17 HG22 THR 2 HG22 THR 2 2.813 21.337 -25.247 18 HG23 THR 2 HG23 THR 2 1.894 19.860 -25.537 19 H VAL 3 HN VAL 3 2.754 19.552 -20.702 20 HA VAL 3 HA VAL 3 0.987 21.760 -19.909 21 HB VAL 3 HB VAL 3 -0.860 19.999 -19.572 22 HG11 VAL 3 HG11 VAL 3 -0.993 21.765 -21.268 23 HG12 VAL 3 HG12 VAL 3 0.004 20.810 -22.365 24 HG13 VAL 3 HG13 VAL 3 -1.611 20.251 -21.929 25 HG21 VAL 3 HG21 VAL 3 0.809 18.105 -20.063 26 HG22 VAL 3 HG22 VAL 3 -0.751 18.005 -20.878 27 HG23 VAL 3 HG23 VAL 3 0.669 18.569 -21.758 28 HA PRO 4 HA PRO 4 3.440 19.753 -16.457 29 HB2 PRO 4 HB2 PRO 4 2.939 22.544 -15.483 30 HB3 PRO 4 HB1 PRO 4 4.414 21.562 -15.379 31 HG2 PRO 4 HG2 PRO 4 4.201 23.531 -17.152 32 HG3 PRO 4 HG1 PRO 4 5.030 22.017 -17.555 33 HD2 PRO 4 HD2 PRO 4 2.335 22.976 -18.430 34 HD3 PRO 4 HD1 PRO 4 3.504 21.951 -19.295 35 H ASP 5 HN ASP 5 2.591 18.892 -14.593 36 HA ASP 5 HA ASP 5 0.236 19.976 -13.328 37 HB2 ASP 5 HB2 ASP 5 -0.662 18.703 -15.319 38 HB3 ASP 5 HB1 ASP 5 -0.003 17.240 -14.589 39 H ARG 6 HN ARG 6 2.103 16.960 -13.728 40 HA ARG 6 HA ARG 6 1.774 16.107 -11.038 41 HB2 ARG 6 HB2 ARG 6 2.344 14.504 -12.751 42 HB3 ARG 6 HB1 ARG 6 3.824 15.376 -13.139 43 HG2 ARG 6 HG2 ARG 6 3.575 14.618 -10.280 44 HG3 ARG 6 HG1 ARG 6 3.680 13.250 -11.384 45 HD2 ARG 6 HD2 ARG 6 5.644 15.553 -11.184 46 HD3 ARG 6 HD1 ARG 6 5.923 13.888 -10.681 47 HE ARG 6 HE ARG 6 5.331 13.558 -13.281 48 HH11 ARG 6 HH21 ARG 6 7.379 15.803 -11.626 49 HH12 ARG 6 HH22 ARG 6 8.492 15.971 -12.942 50 HH21 ARG 6 HH11 ARG 6 6.784 13.774 -15.012 51 HH22 ARG 6 HH12 ARG 6 8.156 14.822 -14.859 52 H SER 7 HN SER 7 4.283 17.946 -12.716 53 HA SER 7 HA SER 7 6.204 18.038 -10.680 54 HB2 SER 7 HB2 SER 7 5.556 20.175 -12.720 55 HB3 SER 7 HB1 SER 7 7.059 20.027 -11.816 56 HG SER 7 HG SER 7 6.074 17.865 -13.324 57 H GLU 8 HN GLU 8 3.254 19.856 -11.148 58 HA GLU 8 HA GLU 8 3.781 21.935 -9.288 59 HB2 GLU 8 HB2 GLU 8 1.216 20.802 -10.408 60 HB3 GLU 8 HB1 GLU 8 1.254 22.178 -9.304 61 HG2 GLU 8 HG2 GLU 8 1.225 23.037 -11.566 62 HG3 GLU 8 HG1 GLU 8 2.829 23.324 -10.895 63 H ILE 9 HN ILE 9 2.037 18.835 -8.952 64 HA ILE 9 HA ILE 9 1.639 19.325 -6.108 65 HB ILE 9 HB ILE 9 -0.019 18.195 -7.709 66 HG12 ILE 9 HG12 ILE 9 0.259 18.081 -4.988 67 HG13 ILE 9 HG11 ILE 9 -1.102 17.406 -5.848 68 HG21 ILE 9 HG21 ILE 9 1.857 15.879 -7.246 69 HG22 ILE 9 HG22 ILE 9 0.238 15.737 -7.912 70 HG23 ILE 9 HG23 ILE 9 1.472 16.640 -8.784 71 HD11 ILE 9 HD11 ILE 9 -0.007 15.215 -5.871 72 HD12 ILE 9 HD12 ILE 9 1.406 15.925 -5.080 73 HD13 ILE 9 HD13 ILE 9 -0.126 15.824 -4.223 74 H ALA 10 HN ALA 10 3.753 17.537 -8.181 75 HA ALA 10 HA ALA 10 4.701 15.690 -6.256 76 HB1 ALA 10 HB1 ALA 10 5.290 15.145 -8.467 77 HB2 ALA 10 HB2 ALA 10 6.806 15.647 -7.720 78 HB3 ALA 10 HB3 ALA 10 5.934 16.756 -8.777 79 H GLY 11 HN GLY 11 6.378 15.805 -4.751 80 HA2 GLY 11 HA2 GLY 11 8.312 17.064 -3.913 81 HA3 GLY 11 HA1 GLY 11 7.397 18.535 -4.243 82 H LYS 12 HN LYS 12 4.850 17.327 -3.417 83 HA LYS 12 HA LYS 12 5.089 16.530 -0.666 84 HB2 LYS 12 HB2 LYS 12 5.539 19.022 -0.625 85 HB3 LYS 12 HB1 LYS 12 3.877 19.247 -1.164 86 HG2 LYS 12 HG2 LYS 12 3.575 19.357 1.139 87 HG3 LYS 12 HG1 LYS 12 3.335 17.632 0.876 88 HD2 LYS 12 HD2 LYS 12 4.876 17.575 2.618 89 HD3 LYS 12 HD1 LYS 12 5.968 17.534 1.235 90 HE2 LYS 12 HE2 LYS 12 6.811 19.210 2.738 91 HE3 LYS 12 HE1 LYS 12 6.079 20.067 1.381 92 HZ1 LYS 12 HZ1 LYS 12 5.264 21.123 3.280 93 HZ2 LYS 12 HZ2 LYS 12 3.993 20.104 2.795 94 HZ3 LYS 12 HZ3 LYS 12 4.985 19.660 4.097 95 H TRP 13 HN TRP 13 3.508 14.996 -0.618 96 HA TRP 13 HA TRP 13 0.858 15.637 -1.798 97 HB2 TRP 13 HB2 TRP 13 2.320 13.002 -1.446 98 HB3 TRP 13 HB1 TRP 13 0.627 13.082 -1.890 99 HD1 TRP 13 HD1 TRP 13 3.826 14.814 -3.165 100 HE1 TRP 13 HE1 TRP 13 3.763 14.643 -5.732 101 HE3 TRP 13 HE3 TRP 13 -0.628 12.401 -3.851 102 HZ2 TRP 13 HZ2 TRP 13 2.173 13.645 -7.741 103 HZ3 TRP 13 HZ3 TRP 13 -1.405 11.869 -6.148 104 HH2 TRP 13 HH2 TRP 13 -0.017 12.499 -8.108 105 H TYR 14 HN TYR 14 -0.756 15.806 -0.270 106 HA TYR 14 HA TYR 14 -0.135 14.910 2.466 107 HB2 TYR 14 HB2 TYR 14 -1.303 17.261 1.283 108 HB3 TYR 14 HB1 TYR 14 -2.480 16.526 2.357 109 HD1 TYR 14 HD1 TYR 14 -1.437 15.662 4.653 110 HD2 TYR 14 HD2 TYR 14 0.194 18.790 2.223 111 HE1 TYR 14 HE1 TYR 14 -0.292 16.595 6.641 112 HE2 TYR 14 HE2 TYR 14 1.354 19.726 4.202 113 HH TYR 14 HH TYR 14 0.730 19.475 6.986 114 H VAL 15 HN VAL 15 -1.338 13.447 3.533 115 HA VAL 15 HA VAL 15 -3.738 12.311 2.202 116 HB VAL 15 HB VAL 15 -1.595 11.120 3.968 117 HG11 VAL 15 HG11 VAL 15 -4.442 10.164 3.625 118 HG12 VAL 15 HG12 VAL 15 -3.132 9.054 4.030 119 HG13 VAL 15 HG13 VAL 15 -3.536 10.378 5.123 120 HG21 VAL 15 HG21 VAL 15 -1.734 9.318 2.223 121 HG22 VAL 15 HG22 VAL 15 -2.929 10.300 1.378 122 HG23 VAL 15 HG23 VAL 15 -1.279 10.893 1.575 123 H VAL 16 HN VAL 16 -5.635 12.924 3.198 124 HA VAL 16 HA VAL 16 -5.517 13.428 6.117 125 HB VAL 16 HB VAL 16 -6.753 15.374 5.968 126 HG11 VAL 16 HG11 VAL 16 -5.324 15.728 3.366 127 HG12 VAL 16 HG12 VAL 16 -5.310 16.753 4.791 128 HG13 VAL 16 HG13 VAL 16 -4.367 15.276 4.754 129 HG21 VAL 16 HG21 VAL 16 -7.511 14.414 3.201 130 HG22 VAL 16 HG22 VAL 16 -8.575 14.786 4.557 131 HG23 VAL 16 HG23 VAL 16 -7.757 16.088 3.696 132 H ALA 17 HN ALA 17 -6.677 11.222 4.183 133 HA ALA 17 HA ALA 17 -8.659 10.438 6.016 134 HB1 ALA 17 HB1 ALA 17 -10.419 10.825 3.833 135 HB2 ALA 17 HB2 ALA 17 -9.570 12.351 4.048 136 HB3 ALA 17 HB3 ALA 17 -10.462 11.647 5.385 137 H LEU 18 HN LEU 18 -9.000 8.264 5.768 138 HA LEU 18 HA LEU 18 -8.391 7.112 3.135 139 HB2 LEU 18 HB2 LEU 18 -7.410 5.195 4.598 140 HB3 LEU 18 HB1 LEU 18 -6.441 6.632 4.295 141 HG LEU 18 HG LEU 18 -6.471 5.881 6.693 142 HD11 LEU 18 HD11 LEU 18 -6.511 8.463 5.688 143 HD12 LEU 18 HD12 LEU 18 -7.722 8.515 6.967 144 HD13 LEU 18 HD13 LEU 18 -6.078 8.001 7.330 145 HD21 LEU 18 HD21 LEU 18 -9.295 6.941 6.767 146 HD22 LEU 18 HD22 LEU 18 -8.944 5.226 6.574 147 HD23 LEU 18 HD23 LEU 18 -8.433 6.075 8.028 148 H ALA 19 HN ALA 19 -8.960 4.749 3.095 149 HA ALA 19 HA ALA 19 -11.380 4.095 4.606 150 HB1 ALA 19 HB1 ALA 19 -12.830 4.082 2.852 151 HB2 ALA 19 HB2 ALA 19 -11.611 3.509 1.714 152 HB3 ALA 19 HB3 ALA 19 -11.689 5.218 2.138 153 H SER 20 HN SER 20 -11.630 1.937 4.948 154 HA SER 20 HA SER 20 -10.283 -0.088 3.434 155 HB2 SER 20 HB2 SER 20 -8.787 -0.826 5.299 156 HB3 SER 20 HB1 SER 20 -8.308 0.700 4.563 157 HG SER 20 HG SER 20 -8.928 0.195 7.100 158 H ASN 21 HN ASN 21 -10.254 -2.189 4.853 159 HA ASN 21 HA ASN 21 -12.703 -2.302 6.498 160 HB2 ASN 21 HB2 ASN 21 -12.921 -4.676 5.332 161 HB3 ASN 21 HB1 ASN 21 -13.615 -3.237 4.593 162 HD21 ASN 21 HD21 ASN 21 -12.299 -2.161 2.870 163 HD22 ASN 21 HD22 ASN 21 -11.215 -3.094 1.963 164 H THR 22 HN THR 22 -9.435 -3.141 5.965 165 HA THR 22 HA THR 22 -9.379 -5.440 7.705 166 HB THR 22 HB THR 22 -7.648 -5.147 5.990 167 HG1 THR 22 HG1 THR 22 -7.155 -5.373 8.673 168 HG21 THR 22 HG21 THR 22 -6.301 -3.293 5.808 169 HG22 THR 22 HG22 THR 22 -7.717 -2.513 6.512 170 HG23 THR 22 HG23 THR 22 -6.353 -2.959 7.538 171 H GLU 23 HN GLU 23 -9.948 -5.166 9.760 172 HA GLU 23 HA GLU 23 -10.130 -2.824 11.157 173 HB2 GLU 23 HB2 GLU 23 -9.599 -5.601 12.208 174 HB3 GLU 23 HB1 GLU 23 -10.065 -4.235 13.222 175 HG2 GLU 23 HG2 GLU 23 -11.682 -5.177 10.840 176 HG3 GLU 23 HG1 GLU 23 -11.993 -5.699 12.496 177 H PHE 24 HN PHE 24 -7.283 -4.911 10.957 178 HA PHE 24 HA PHE 24 -5.761 -3.834 12.974 179 HB2 PHE 24 HB2 PHE 24 -4.344 -4.261 10.386 180 HB3 PHE 24 HB1 PHE 24 -3.972 -4.888 11.992 181 HD1 PHE 24 HD1 PHE 24 -6.539 -6.121 12.776 182 HD2 PHE 24 HD2 PHE 24 -4.485 -6.164 9.004 183 HE1 PHE 24 HE1 PHE 24 -7.655 -8.257 12.193 184 HE2 PHE 24 HE2 PHE 24 -5.599 -8.300 8.421 185 HZ PHE 24 HZ PHE 24 -7.186 -9.347 10.015 186 H PHE 25 HN PHE 25 -5.848 -2.632 9.602 187 HA PHE 25 HA PHE 25 -4.297 -0.300 10.278 188 HB2 PHE 25 HB2 PHE 25 -5.887 -0.703 7.754 189 HB3 PHE 25 HB1 PHE 25 -4.457 0.290 7.992 190 HD1 PHE 25 HD2 PHE 25 -3.241 -2.178 9.852 191 HD2 PHE 25 HD1 PHE 25 -4.661 -1.698 5.815 192 HE1 PHE 25 HE2 PHE 25 -1.845 -4.077 9.131 193 HE2 PHE 25 HE1 PHE 25 -3.251 -3.604 5.109 194 HZ PHE 25 HZ PHE 25 -1.847 -4.794 6.762 195 H LEU 26 HN LEU 26 -7.716 -0.873 9.573 196 HA LEU 26 HA LEU 26 -8.573 1.814 9.568 197 HB2 LEU 26 HB2 LEU 26 -9.947 -0.108 8.828 198 HB3 LEU 26 HB1 LEU 26 -10.046 -0.662 10.495 199 HG LEU 26 HG LEU 26 -11.172 1.457 11.118 200 HD11 LEU 26 HD11 LEU 26 -10.686 2.021 8.198 201 HD12 LEU 26 HD12 LEU 26 -12.107 2.704 8.986 202 HD13 LEU 26 HD13 LEU 26 -10.496 3.094 9.585 203 HD21 LEU 26 HD21 LEU 26 -12.484 0.045 8.771 204 HD22 LEU 26 HD22 LEU 26 -12.418 -0.607 10.408 205 HD23 LEU 26 HD23 LEU 26 -13.307 0.881 10.087 206 H ARG 27 HN ARG 27 -8.009 -0.493 12.031 207 HA ARG 27 HA ARG 27 -9.041 0.913 14.283 208 HB2 ARG 27 HB2 ARG 27 -8.446 -1.490 14.389 209 HB3 ARG 27 HB1 ARG 27 -6.743 -1.066 14.233 210 HG2 ARG 27 HG2 ARG 27 -6.928 -1.241 16.547 211 HG3 ARG 27 HG1 ARG 27 -7.272 0.473 16.344 212 HD2 ARG 27 HD2 ARG 27 -8.964 -0.434 17.795 213 HD3 ARG 27 HD1 ARG 27 -9.725 -0.115 16.241 214 HE ARG 27 HE ARG 27 -8.708 -2.814 16.525 215 HH11 ARG 27 HH21 ARG 27 -11.340 -0.625 17.033 216 HH12 ARG 27 HH22 ARG 27 -12.549 -1.866 17.053 217 HH21 ARG 27 HH11 ARG 27 -10.287 -4.446 16.551 218 HH22 ARG 27 HH12 ARG 27 -11.952 -4.029 16.781 219 H GLU 28 HN GLU 28 -5.800 0.798 12.824 220 HA GLU 28 HA GLU 28 -4.779 2.755 14.695 221 HB2 GLU 28 HB2 GLU 28 -3.542 1.443 12.277 222 HB3 GLU 28 HB1 GLU 28 -2.688 2.531 13.372 223 HG2 GLU 28 HG2 GLU 28 -3.242 1.019 15.266 224 HG3 GLU 28 HG1 GLU 28 -4.014 -0.088 14.132 225 H LYS 29 HN LYS 29 -5.533 2.887 11.106 226 HA LYS 29 HA LYS 29 -4.434 5.360 10.670 227 HB2 LYS 29 HB2 LYS 29 -6.794 3.921 9.495 228 HB3 LYS 29 HB1 LYS 29 -6.440 5.575 9.004 229 HG2 LYS 29 HG2 LYS 29 -4.664 4.926 7.726 230 HG3 LYS 29 HG1 LYS 29 -4.014 3.917 9.009 231 HD2 LYS 29 HD2 LYS 29 -4.520 2.475 7.160 232 HD3 LYS 29 HD1 LYS 29 -5.729 2.175 8.397 233 HE2 LYS 29 HE2 LYS 29 -7.234 3.805 7.196 234 HE3 LYS 29 HE1 LYS 29 -6.052 3.810 5.883 235 HZ1 LYS 29 HZ1 LYS 29 -7.715 1.579 6.864 236 HZ2 LYS 29 HZ2 LYS 29 -7.562 2.176 5.281 237 HZ3 LYS 29 HZ3 LYS 29 -6.294 1.290 5.977 238 H ASP 30 HN ASP 30 -7.363 4.489 12.316 239 HA ASP 30 HA ASP 30 -8.574 7.020 12.418 240 HB2 ASP 30 HB2 ASP 30 -8.719 4.740 14.398 241 HB3 ASP 30 HB1 ASP 30 -9.823 6.114 14.343 242 H LYS 31 HN LYS 31 -5.823 5.756 14.238 243 HA LYS 31 HA LYS 31 -6.117 7.920 16.174 244 HB2 LYS 31 HB2 LYS 31 -4.569 6.848 17.586 245 HB3 LYS 31 HB1 LYS 31 -5.633 5.600 16.960 246 HG2 LYS 31 HG2 LYS 31 -3.534 4.618 16.724 247 HG3 LYS 31 HG1 LYS 31 -3.813 5.286 15.136 248 HD2 LYS 31 HD2 LYS 31 -2.558 7.355 16.665 249 HD3 LYS 31 HD1 LYS 31 -1.672 5.875 16.988 250 HE2 LYS 31 HE2 LYS 31 -2.354 6.462 14.128 251 HE3 LYS 31 HE1 LYS 31 -1.078 7.406 14.882 252 HZ1 LYS 31 HZ1 LYS 31 -0.354 5.034 15.714 253 HZ2 LYS 31 HZ2 LYS 31 -1.168 4.548 14.304 254 HZ3 LYS 31 HZ3 LYS 31 0.130 5.635 14.202 255 H MET 32 HN MET 32 -4.208 7.372 13.317 256 HA MET 32 HA MET 32 -2.117 9.169 14.227 257 HB2 MET 32 HB2 MET 32 -1.490 9.177 11.711 258 HB3 MET 32 HB1 MET 32 -1.253 7.697 12.617 259 HG2 MET 32 HG2 MET 32 -3.742 7.207 11.768 260 HG3 MET 32 HG1 MET 32 -3.269 8.321 10.502 261 HE1 MET 32 HE1 MET 32 -2.850 5.231 12.363 262 HE2 MET 32 HE2 MET 32 -1.820 4.155 11.443 263 HE3 MET 32 HE3 MET 32 -1.109 5.401 12.470 264 H LYS 33 HN LYS 33 -1.532 10.974 12.684 265 HA LYS 33 HA LYS 33 -3.894 12.717 12.357 266 HB2 LYS 33 HB2 LYS 33 -1.074 13.737 12.519 267 HB3 LYS 33 HB1 LYS 33 -2.583 14.549 12.932 268 HG2 LYS 33 HG2 LYS 33 -1.372 12.231 14.472 269 HG3 LYS 33 HG1 LYS 33 -1.306 13.924 14.957 270 HD2 LYS 33 HD2 LYS 33 -3.879 13.890 14.807 271 HD3 LYS 33 HD1 LYS 33 -3.731 12.135 14.770 272 HE2 LYS 33 HE2 LYS 33 -2.574 13.917 16.931 273 HE3 LYS 33 HE1 LYS 33 -4.072 13.000 17.078 274 HZ1 LYS 33 HZ1 LYS 33 -1.306 12.056 17.036 275 HZ2 LYS 33 HZ2 LYS 33 -2.627 11.507 17.953 276 HZ3 LYS 33 HZ3 LYS 33 -2.485 11.061 16.323 277 H MET 34 HN MET 34 -3.265 14.533 10.537 278 HA MET 34 HA MET 34 -3.277 13.373 8.086 279 HB2 MET 34 HB2 MET 34 -3.411 15.889 9.122 280 HB3 MET 34 HB1 MET 34 -1.835 15.975 8.360 281 HG2 MET 34 HG2 MET 34 -2.847 15.179 6.264 282 HG3 MET 34 HG1 MET 34 -4.427 15.181 7.042 283 HE1 MET 34 HE1 MET 34 -5.337 16.940 8.299 284 HE2 MET 34 HE2 MET 34 -5.315 18.643 7.857 285 HE3 MET 34 HE3 MET 34 -6.033 17.454 6.769 286 H ALA 35 HN ALA 35 -1.709 12.778 6.580 287 HA ALA 35 HA ALA 35 1.109 12.725 7.501 288 HB1 ALA 35 HB1 ALA 35 1.223 10.711 5.878 289 HB2 ALA 35 HB2 ALA 35 -0.537 10.717 5.987 290 HB3 ALA 35 HB3 ALA 35 0.435 10.483 7.438 291 H MET 36 HN MET 36 2.733 12.622 5.720 292 HA MET 36 HA MET 36 1.866 14.122 3.323 293 HB2 MET 36 HB2 MET 36 4.489 14.981 3.886 294 HB3 MET 36 HB1 MET 36 3.010 15.922 4.047 295 HG2 MET 36 HG2 MET 36 3.991 14.083 6.239 296 HG3 MET 36 HG1 MET 36 4.482 15.771 6.129 297 HE1 MET 36 HE1 MET 36 3.109 17.328 7.988 298 HE2 MET 36 HE2 MET 36 2.193 16.198 8.983 299 HE3 MET 36 HE3 MET 36 3.807 15.765 8.402 300 H ALA 37 HN ALA 37 3.469 14.060 1.553 301 HA ALA 37 HA ALA 37 5.454 11.958 1.561 302 HB1 ALA 37 HB1 ALA 37 2.790 11.574 0.243 303 HB2 ALA 37 HB2 ALA 37 3.733 10.443 1.205 304 HB3 ALA 37 HB3 ALA 37 4.228 10.822 -0.446 305 H ARG 38 HN ARG 38 6.595 11.767 -0.532 306 HA ARG 38 HA ARG 38 6.284 14.140 -2.298 307 HB2 ARG 38 HB2 ARG 38 8.159 14.678 -0.899 308 HB3 ARG 38 HB1 ARG 38 8.826 13.055 -1.061 309 HG2 ARG 38 HG2 ARG 38 9.468 13.405 -3.303 310 HG3 ARG 38 HG1 ARG 38 8.395 14.791 -3.490 311 HD2 ARG 38 HD2 ARG 38 10.720 15.546 -3.287 312 HD3 ARG 38 HD1 ARG 38 9.786 16.071 -1.889 313 HE ARG 38 HE ARG 38 11.003 13.568 -1.340 314 HH11 ARG 38 HH21 ARG 38 11.705 16.923 -1.807 315 HH12 ARG 38 HH22 ARG 38 13.103 16.915 -0.785 316 HH21 ARG 38 HH11 ARG 38 12.836 13.548 0.001 317 HH22 ARG 38 HH12 ARG 38 13.743 15.004 0.239 318 H ILE 39 HN ILE 39 6.278 13.585 -4.548 319 HA ILE 39 HA ILE 39 7.125 10.884 -5.238 320 HB ILE 39 HB ILE 39 4.699 11.303 -5.081 321 HG12 ILE 39 HG12 ILE 39 5.541 10.731 -7.921 322 HG13 ILE 39 HG11 ILE 39 5.688 9.541 -6.630 323 HG21 ILE 39 HG21 ILE 39 4.852 13.564 -5.876 324 HG22 ILE 39 HG22 ILE 39 5.172 12.953 -7.492 325 HG23 ILE 39 HG23 ILE 39 3.668 12.574 -6.698 326 HD11 ILE 39 HD11 ILE 39 3.433 9.165 -6.566 327 HD12 ILE 39 HD12 ILE 39 3.053 10.885 -6.692 328 HD13 ILE 39 HD13 ILE 39 3.401 9.947 -8.136 329 H SER 40 HN SER 40 8.195 10.566 -7.145 330 HA SER 40 HA SER 40 8.861 12.950 -8.747 331 HB2 SER 40 HB2 SER 40 10.957 12.986 -7.897 332 HB3 SER 40 HB1 SER 40 10.665 11.513 -6.984 333 HG SER 40 HG SER 40 11.067 11.399 -9.764 334 H PHE 41 HN PHE 41 9.275 12.527 -10.919 335 HA PHE 41 HA PHE 41 8.299 9.941 -11.846 336 HB2 PHE 41 HB2 PHE 41 8.526 12.662 -12.934 337 HB3 PHE 41 HB1 PHE 41 8.844 11.397 -14.112 338 HD1 PHE 41 HD2 PHE 41 6.536 11.376 -11.163 339 HD2 PHE 41 HD1 PHE 41 6.902 11.300 -15.443 340 HE1 PHE 41 HE2 PHE 41 4.103 10.942 -11.365 341 HE2 PHE 41 HE1 PHE 41 4.469 10.866 -15.644 342 HZ PHE 41 HZ PHE 41 3.070 10.687 -13.606 343 H LEU 42 HN LEU 42 9.705 8.416 -11.870 344 HA LEU 42 HA LEU 42 12.499 8.812 -12.689 345 HB2 LEU 42 HB2 LEU 42 10.941 6.406 -11.740 346 HB3 LEU 42 HB1 LEU 42 12.550 6.254 -12.409 347 HG LEU 42 HG LEU 42 11.795 7.954 -10.016 348 HD11 LEU 42 HD11 LEU 42 12.923 5.172 -10.326 349 HD12 LEU 42 HD12 LEU 42 13.304 6.130 -8.896 350 HD13 LEU 42 HD13 LEU 42 11.627 5.730 -9.268 351 HD21 LEU 42 HD21 LEU 42 14.324 7.552 -11.579 352 HD22 LEU 42 HD22 LEU 42 13.730 8.995 -10.759 353 HD23 LEU 42 HD23 LEU 42 14.463 7.692 -9.827 354 H GLY 43 HN GLY 43 9.509 7.462 -13.744 355 HA2 GLY 43 HA2 GLY 43 9.863 7.796 -16.492 356 HA3 GLY 43 HA1 GLY 43 10.294 6.128 -16.099 357 H GLU 44 HN GLU 44 7.950 7.094 -17.642 358 HA GLU 44 HA GLU 44 5.580 7.134 -16.196 359 HB2 GLU 44 HB2 GLU 44 6.106 5.841 -18.888 360 HB3 GLU 44 HB1 GLU 44 4.506 6.201 -18.237 361 HG2 GLU 44 HG2 GLU 44 5.123 8.599 -18.091 362 HG3 GLU 44 HG1 GLU 44 6.693 8.226 -18.799 363 H ASP 45 HN ASP 45 7.680 4.437 -16.944 364 HA ASP 45 HA ASP 45 5.768 2.536 -15.749 365 HB2 ASP 45 HB2 ASP 45 8.433 1.802 -16.939 366 HB3 ASP 45 HB1 ASP 45 6.983 0.813 -16.775 367 H GLU 46 HN GLU 46 7.659 4.648 -14.458 368 HA GLU 46 HA GLU 46 8.268 3.099 -12.127 369 HB2 GLU 46 HB2 GLU 46 10.123 2.423 -13.656 370 HB3 GLU 46 HB1 GLU 46 10.617 4.111 -13.747 371 HG2 GLU 46 HG2 GLU 46 10.874 4.118 -11.255 372 HG3 GLU 46 HG1 GLU 46 10.516 2.395 -11.256 373 H LEU 47 HN LEU 47 8.066 4.454 -10.442 374 HA LEU 47 HA LEU 47 9.012 7.224 -10.700 375 HB2 LEU 47 HB2 LEU 47 6.791 7.699 -9.234 376 HB3 LEU 47 HB1 LEU 47 6.845 7.884 -10.982 377 HG LEU 47 HG LEU 47 6.076 5.282 -9.655 378 HD11 LEU 47 HD11 LEU 47 4.557 7.053 -8.893 379 HD12 LEU 47 HD12 LEU 47 4.279 7.542 -10.565 380 HD13 LEU 47 HD13 LEU 47 3.732 5.962 -10.005 381 HD21 LEU 47 HD21 LEU 47 6.339 6.239 -12.428 382 HD22 LEU 47 HD22 LEU 47 6.219 4.593 -11.814 383 HD23 LEU 47 HD23 LEU 47 4.759 5.535 -12.099 384 H LYS 48 HN LYS 48 9.583 8.201 -8.742 385 HA LYS 48 HA LYS 48 10.083 6.265 -6.557 386 HB2 LYS 48 HB2 LYS 48 11.993 7.587 -7.668 387 HB3 LYS 48 HB1 LYS 48 11.338 8.997 -6.839 388 HG2 LYS 48 HG2 LYS 48 11.440 7.580 -4.696 389 HG3 LYS 48 HG1 LYS 48 12.454 6.469 -5.618 390 HD2 LYS 48 HD2 LYS 48 13.006 9.404 -5.097 391 HD3 LYS 48 HD1 LYS 48 13.887 8.034 -4.422 392 HE2 LYS 48 HE2 LYS 48 15.240 8.717 -6.228 393 HE3 LYS 48 HE1 LYS 48 14.322 7.366 -6.895 394 HZ1 LYS 48 HZ1 LYS 48 14.445 9.911 -7.900 395 HZ2 LYS 48 HZ2 LYS 48 13.340 8.701 -8.351 396 HZ3 LYS 48 HZ3 LYS 48 12.918 9.832 -7.158 397 H VAL 49 HN VAL 49 8.750 6.415 -4.804 398 HA VAL 49 HA VAL 49 7.875 9.093 -4.056 399 HB VAL 49 HB VAL 49 6.088 7.695 -5.411 400 HG11 VAL 49 HG11 VAL 49 5.619 6.728 -2.586 401 HG12 VAL 49 HG12 VAL 49 4.421 6.665 -3.877 402 HG13 VAL 49 HG13 VAL 49 5.912 5.739 -4.008 403 HG21 VAL 49 HG21 VAL 49 4.600 9.254 -4.689 404 HG22 VAL 49 HG22 VAL 49 4.921 8.935 -3.001 405 HG23 VAL 49 HG23 VAL 49 5.992 9.934 -3.915 406 H SER 50 HN SER 50 7.531 9.544 -2.063 407 HA SER 50 HA SER 50 8.618 7.632 -0.062 408 HB2 SER 50 HB2 SER 50 8.802 10.642 -0.217 409 HB3 SER 50 HB1 SER 50 9.252 9.715 1.207 410 HG SER 50 HG SER 50 10.643 10.143 -1.038 411 H TYR 51 HN TYR 51 7.690 7.467 1.962 412 HA TYR 51 HA TYR 51 4.961 8.603 2.224 413 HB2 TYR 51 HB2 TYR 51 6.203 6.132 3.474 414 HB3 TYR 51 HB1 TYR 51 4.577 6.715 3.793 415 HD1 TYR 51 HD1 TYR 51 6.640 6.103 0.673 416 HD2 TYR 51 HD2 TYR 51 2.945 5.428 2.771 417 HE1 TYR 51 HE1 TYR 51 5.796 4.773 -1.229 418 HE2 TYR 51 HE2 TYR 51 2.120 4.091 0.857 419 HH TYR 51 HH TYR 51 3.937 2.778 -1.385 420 H ALA 52 HN ALA 52 4.690 10.067 3.870 421 HA ALA 52 HA ALA 52 6.604 9.984 6.128 422 HB1 ALA 52 HB1 ALA 52 6.759 11.947 4.387 423 HB2 ALA 52 HB2 ALA 52 6.850 12.292 6.114 424 HB3 ALA 52 HB3 ALA 52 5.344 12.553 5.242 425 H VAL 53 HN VAL 53 5.474 9.184 7.800 426 HA VAL 53 HA VAL 53 2.740 10.222 8.259 427 HB VAL 53 HB VAL 53 3.691 7.576 9.317 428 HG11 VAL 53 HG11 VAL 53 1.378 7.077 9.407 429 HG12 VAL 53 HG12 VAL 53 1.477 8.759 9.924 430 HG13 VAL 53 HG13 VAL 53 0.966 8.369 8.282 431 HG21 VAL 53 HG21 VAL 53 2.644 6.590 7.198 432 HG22 VAL 53 HG22 VAL 53 2.775 8.204 6.499 433 HG23 VAL 53 HG23 VAL 53 4.229 7.339 6.998 434 HA PRO 54 HA PRO 54 4.923 11.453 12.047 435 HB2 PRO 54 HB2 PRO 54 3.260 13.399 12.854 436 HB3 PRO 54 HB1 PRO 54 4.286 13.613 11.419 437 HG2 PRO 54 HG2 PRO 54 1.385 12.928 11.581 438 HG3 PRO 54 HG1 PRO 54 2.220 14.036 10.477 439 HD2 PRO 54 HD2 PRO 54 1.507 11.417 9.835 440 HD3 PRO 54 HD1 PRO 54 2.777 12.350 9.016 441 H LYS 55 HN LYS 55 4.652 11.012 14.251 442 HA LYS 55 HA LYS 55 2.055 10.247 15.287 443 HB2 LYS 55 HB2 LYS 55 4.307 8.244 15.025 444 HB3 LYS 55 HB1 LYS 55 2.898 8.008 16.058 445 HG2 LYS 55 HG2 LYS 55 1.482 8.432 13.957 446 HG3 LYS 55 HG1 LYS 55 2.979 8.237 13.045 447 HD2 LYS 55 HD2 LYS 55 1.733 6.199 14.911 448 HD3 LYS 55 HD1 LYS 55 1.829 6.091 13.153 449 HE2 LYS 55 HE2 LYS 55 4.067 5.916 15.168 450 HE3 LYS 55 HE1 LYS 55 3.642 4.772 13.894 451 HZ1 LYS 55 HZ1 LYS 55 5.614 6.154 13.388 452 HZ2 LYS 55 HZ2 LYS 55 4.369 6.306 12.241 453 HZ3 LYS 55 HZ3 LYS 55 4.615 7.528 13.390 454 HA PRO 56 HA PRO 56 4.108 12.016 18.826 455 HB2 PRO 56 HB2 PRO 56 2.343 11.297 20.789 456 HB3 PRO 56 HB1 PRO 56 2.002 12.576 19.607 457 HG2 PRO 56 HG2 PRO 56 1.094 9.732 19.624 458 HG3 PRO 56 HG1 PRO 56 0.183 11.203 19.233 459 HD2 PRO 56 HD2 PRO 56 1.198 9.558 17.307 460 HD3 PRO 56 HD1 PRO 56 1.023 11.312 17.070 461 H ASN 57 HN ASN 57 3.112 8.636 18.829 462 HA ASN 57 HA ASN 57 4.736 7.898 21.093 463 HB2 ASN 57 HB2 ASN 57 3.349 6.233 18.980 464 HB3 ASN 57 HB1 ASN 57 4.160 5.574 20.400 465 HD21 ASN 57 HD21 ASN 57 2.613 5.034 21.940 466 HD22 ASN 57 HD22 ASN 57 1.245 5.967 22.313 467 H GLY 58 HN GLY 58 5.185 8.186 17.663 468 HA2 GLY 58 HA2 GLY 58 7.939 8.159 17.664 469 HA3 GLY 58 HA1 GLY 58 7.474 6.474 17.453 470 H CYS 59 HN CYS 59 7.952 9.457 15.914 471 HA CYS 59 HA CYS 59 6.229 9.177 13.674 472 HB2 CYS 59 HB2 CYS 59 8.885 10.590 13.576 473 HB3 CYS 59 HB1 CYS 59 7.379 11.006 12.757 474 H ARG 60 HN ARG 60 6.677 8.460 11.569 475 HA ARG 60 HA ARG 60 9.106 6.800 11.234 476 HB2 ARG 60 HB2 ARG 60 7.176 5.345 11.775 477 HB3 ARG 60 HB1 ARG 60 6.305 6.014 10.394 478 HG2 ARG 60 HG2 ARG 60 7.924 5.138 8.846 479 HG3 ARG 60 HG1 ARG 60 9.012 4.681 10.156 480 HD2 ARG 60 HD2 ARG 60 6.226 3.545 9.818 481 HD3 ARG 60 HD1 ARG 60 7.680 2.763 9.203 482 HE ARG 60 HE ARG 60 7.784 3.413 12.028 483 HH11 ARG 60 HH21 ARG 60 6.881 1.128 9.590 484 HH12 ARG 60 HH22 ARG 60 6.952 -0.239 10.650 485 HH21 ARG 60 HH11 ARG 60 7.880 1.624 13.424 486 HH22 ARG 60 HH12 ARG 60 7.517 0.041 12.821 487 H LYS 61 HN LYS 61 10.219 7.464 9.538 488 HA LYS 61 HA LYS 61 8.783 8.458 7.151 489 HB2 LYS 61 HB2 LYS 61 10.557 10.180 6.875 490 HB3 LYS 61 HB1 LYS 61 9.590 10.428 8.330 491 HG2 LYS 61 HG2 LYS 61 11.371 9.142 9.603 492 HG3 LYS 61 HG1 LYS 61 12.362 9.224 8.147 493 HD2 LYS 61 HD2 LYS 61 12.155 11.710 8.188 494 HD3 LYS 61 HD1 LYS 61 11.269 11.582 9.708 495 HE2 LYS 61 HE2 LYS 61 13.186 10.543 10.791 496 HE3 LYS 61 HE1 LYS 61 14.071 10.514 9.266 497 HZ1 LYS 61 HZ1 LYS 61 14.841 12.498 9.847 498 HZ2 LYS 61 HZ2 LYS 61 13.284 13.113 9.556 499 HZ3 LYS 61 HZ3 LYS 61 13.733 12.654 11.126 500 H TRP 62 HN TRP 62 9.476 7.570 5.291 501 HA TRP 62 HA TRP 62 12.197 6.674 4.951 502 HB2 TRP 62 HB2 TRP 62 11.977 4.426 5.191 503 HB3 TRP 62 HB1 TRP 62 10.597 4.852 6.195 504 HD1 TRP 62 HD1 TRP 62 8.320 5.407 4.348 505 HE1 TRP 62 HE1 TRP 62 7.412 3.680 2.664 506 HE3 TRP 62 HE3 TRP 62 12.393 2.361 3.953 507 HZ2 TRP 62 HZ2 TRP 62 8.320 1.305 1.322 508 HZ3 TRP 62 HZ3 TRP 62 12.348 0.377 2.471 509 HH2 TRP 62 HH2 TRP 62 10.315 -0.155 1.155 510 H GLU 63 HN GLU 63 12.289 5.348 2.799 511 HA GLU 63 HA GLU 63 10.619 6.787 0.811 512 HB2 GLU 63 HB2 GLU 63 12.989 7.496 0.818 513 HB3 GLU 63 HB1 GLU 63 13.473 5.828 0.504 514 HG2 GLU 63 HG2 GLU 63 12.414 5.820 -1.634 515 HG3 GLU 63 HG1 GLU 63 11.549 7.317 -1.290 516 H THR 64 HN THR 64 10.261 5.681 -1.215 517 HA THR 64 HA THR 64 10.637 2.784 -1.272 518 HB THR 64 HB THR 64 7.850 3.863 -1.658 519 HG1 THR 64 HG1 THR 64 8.850 4.202 0.524 520 HG21 THR 64 HG21 THR 64 8.919 1.124 -0.929 521 HG22 THR 64 HG22 THR 64 7.242 1.531 -1.295 522 HG23 THR 64 HG23 THR 64 8.469 1.626 -2.559 523 H THR 65 HN THR 65 10.637 1.943 -3.332 524 HA THR 65 HA THR 65 10.427 3.911 -5.536 525 HB THR 65 HB THR 65 11.918 1.276 -5.480 526 HG1 THR 65 HG1 THR 65 13.717 2.878 -5.524 527 HG21 THR 65 HG21 THR 65 12.987 2.236 -7.526 528 HG22 THR 65 HG22 THR 65 11.261 1.938 -7.725 529 HG23 THR 65 HG23 THR 65 11.846 3.579 -7.448 530 H PHE 66 HN PHE 66 9.156 3.476 -7.309 531 HA PHE 66 HA PHE 66 7.364 1.114 -7.147 532 HB2 PHE 66 HB2 PHE 66 7.057 3.909 -8.221 533 HB3 PHE 66 HB1 PHE 66 5.948 2.652 -8.658 534 HD1 PHE 66 HD2 PHE 66 6.942 2.052 -5.270 535 HD2 PHE 66 HD1 PHE 66 4.485 4.610 -7.700 536 HE1 PHE 66 HE2 PHE 66 5.563 2.602 -3.302 537 HE2 PHE 66 HE1 PHE 66 3.116 5.160 -5.722 538 HZ PHE 66 HZ PHE 66 3.646 4.158 -3.530 539 H LYS 67 HN LYS 67 7.808 -0.428 -8.701 540 HA LYS 67 HA LYS 67 9.028 0.517 -11.236 541 HB2 LYS 67 HB2 LYS 67 9.447 -2.051 -9.702 542 HB3 LYS 67 HB1 LYS 67 10.069 -1.752 -11.324 543 HG2 LYS 67 HG2 LYS 67 11.113 0.398 -10.282 544 HG3 LYS 67 HG1 LYS 67 10.825 -0.398 -8.736 545 HD2 LYS 67 HD2 LYS 67 12.344 -1.672 -11.029 546 HD3 LYS 67 HD1 LYS 67 13.117 -0.809 -9.702 547 HE2 LYS 67 HE2 LYS 67 11.402 -3.300 -9.491 548 HE3 LYS 67 HE1 LYS 67 13.131 -3.174 -9.171 549 HZ1 LYS 67 HZ1 LYS 67 11.933 -3.125 -7.112 550 HZ2 LYS 67 HZ2 LYS 67 12.607 -1.589 -7.384 551 HZ3 LYS 67 HZ3 LYS 67 10.952 -1.848 -7.653 552 H LYS 68 HN LYS 68 8.594 -0.598 -13.127 553 HA LYS 68 HA LYS 68 7.171 -1.473 -14.729 554 HB2 LYS 68 HB2 LYS 68 6.571 -3.413 -12.476 555 HB3 LYS 68 HB1 LYS 68 6.112 -3.645 -14.164 556 HG2 LYS 68 HG2 LYS 68 8.527 -3.485 -14.795 557 HG3 LYS 68 HG1 LYS 68 8.933 -3.404 -13.081 558 HD2 LYS 68 HD2 LYS 68 7.775 -5.595 -12.748 559 HD3 LYS 68 HD1 LYS 68 7.525 -5.688 -14.492 560 HE2 LYS 68 HE2 LYS 68 9.940 -5.641 -14.874 561 HE3 LYS 68 HE1 LYS 68 10.231 -5.448 -13.145 562 HZ1 LYS 68 HZ1 LYS 68 10.423 -7.772 -14.057 563 HZ2 LYS 68 HZ2 LYS 68 9.407 -7.587 -12.707 564 HZ3 LYS 68 HZ3 LYS 68 8.736 -7.748 -14.257 565 H THR 69 HN THR 69 6.138 0.661 -14.094 566 HA THR 69 HA THR 69 3.471 0.264 -12.976 567 HB THR 69 HB THR 69 3.651 2.563 -12.344 568 HG1 THR 69 HG1 THR 69 4.652 3.496 -14.038 569 HG21 THR 69 HG21 THR 69 5.123 0.586 -11.254 570 HG22 THR 69 HG22 THR 69 6.430 1.637 -11.792 571 HG23 THR 69 HG23 THR 69 5.221 2.245 -10.674 572 H SER 70 HN SER 70 2.800 -0.557 -15.136 573 HA SER 70 HA SER 70 1.616 1.586 -16.673 574 HB2 SER 70 HB2 SER 70 3.412 -0.328 -18.162 575 HB3 SER 70 HB1 SER 70 2.623 1.123 -18.775 576 HG SER 70 HG SER 70 4.587 1.060 -16.720 577 H ASP 71 HN ASP 71 1.308 -1.183 -15.176 578 HA ASP 71 HA ASP 71 0.225 -3.102 -16.827 579 HB2 ASP 71 HB2 ASP 71 -0.283 -2.271 -13.991 580 HB3 ASP 71 HB1 ASP 71 -1.285 -3.522 -14.714 581 H ASP 72 HN ASP 72 -2.011 -1.290 -14.789 582 HA ASP 72 HA ASP 72 -3.993 -1.344 -16.961 583 HB2 ASP 72 HB2 ASP 72 -4.201 -0.749 -14.006 584 HB3 ASP 72 HB1 ASP 72 -5.551 -0.579 -15.125 585 H GLY 73 HN GLY 73 -2.737 0.308 -18.131 586 HA2 GLY 73 HA2 GLY 73 -2.743 2.483 -18.938 587 HA3 GLY 73 HA1 GLY 73 -3.812 2.933 -17.605 588 H GLU 74 HN GLU 74 -2.931 3.607 -15.622 589 HA GLU 74 HA GLU 74 0.003 3.825 -15.495 590 HB2 GLU 74 HB2 GLU 74 -2.037 5.973 -14.877 591 HB3 GLU 74 HB1 GLU 74 -0.350 6.052 -14.370 592 HG2 GLU 74 HG2 GLU 74 -1.225 5.702 -17.249 593 HG3 GLU 74 HG1 GLU 74 -0.830 7.262 -16.531 594 H VAL 75 HN VAL 75 0.161 2.063 -13.968 595 HA VAL 75 HA VAL 75 -0.904 2.730 -11.320 596 HB VAL 75 HB VAL 75 -0.998 -0.022 -12.583 597 HG11 VAL 75 HG11 VAL 75 -1.568 1.077 -9.833 598 HG12 VAL 75 HG12 VAL 75 -2.459 -0.330 -10.414 599 HG13 VAL 75 HG13 VAL 75 -0.703 -0.389 -10.289 600 HG21 VAL 75 HG21 VAL 75 -3.550 0.461 -12.132 601 HG22 VAL 75 HG22 VAL 75 -3.047 2.149 -12.199 602 HG23 VAL 75 HG23 VAL 75 -2.786 1.097 -13.587 603 H TYR 76 HN TYR 76 0.409 1.896 -9.620 604 HA TYR 76 HA TYR 76 3.160 1.281 -10.547 605 HB2 TYR 76 HB2 TYR 76 3.702 2.963 -9.129 606 HB3 TYR 76 HB1 TYR 76 2.083 2.970 -8.448 607 HD1 TYR 76 HD1 TYR 76 5.086 0.671 -8.412 608 HD2 TYR 76 HD2 TYR 76 1.953 2.538 -6.153 609 HE1 TYR 76 HE1 TYR 76 5.904 -0.422 -6.358 610 HE2 TYR 76 HE2 TYR 76 2.793 1.449 -4.094 611 HH TYR 76 HH TYR 76 4.432 -1.017 -3.867 612 H TYR 77 HN TYR 77 4.391 -0.496 -9.823 613 HA TYR 77 HA TYR 77 3.138 -2.161 -7.786 614 HB2 TYR 77 HB2 TYR 77 2.225 -3.121 -9.785 615 HB3 TYR 77 HB1 TYR 77 3.807 -3.120 -10.560 616 HD1 TYR 77 HD1 TYR 77 1.808 -4.624 -7.807 617 HD2 TYR 77 HD2 TYR 77 5.386 -4.870 -10.170 618 HE1 TYR 77 HE1 TYR 77 2.271 -6.874 -6.873 619 HE2 TYR 77 HE2 TYR 77 5.849 -7.119 -9.236 620 HH TYR 77 HH TYR 77 4.867 -8.282 -6.675 621 H SER 78 HN SER 78 4.572 -2.886 -6.330 622 HA SER 78 HA SER 78 7.436 -2.890 -7.092 623 HB2 SER 78 HB2 SER 78 5.991 -2.038 -4.674 624 HB3 SER 78 HB1 SER 78 7.397 -3.041 -4.344 625 HG SER 78 HG SER 78 7.752 -0.700 -4.572 626 H GLU 79 HN GLU 79 7.807 -4.899 -7.776 627 HA GLU 79 HA GLU 79 6.619 -7.279 -7.027 628 HB2 GLU 79 HB2 GLU 79 8.297 -6.931 -8.886 629 HB3 GLU 79 HB1 GLU 79 9.562 -7.013 -7.659 630 HG2 GLU 79 HG2 GLU 79 8.709 -9.249 -6.971 631 HG3 GLU 79 HG1 GLU 79 7.526 -9.173 -8.275 632 H GLU 80 HN GLU 80 9.161 -5.487 -5.395 633 HA GLU 80 HA GLU 80 9.701 -7.586 -3.479 634 HB2 GLU 80 HB2 GLU 80 10.586 -4.699 -3.604 635 HB3 GLU 80 HB1 GLU 80 11.162 -5.877 -2.423 636 HG2 GLU 80 HG2 GLU 80 11.952 -7.322 -4.287 637 HG3 GLU 80 HG1 GLU 80 11.445 -6.083 -5.435 638 H ALA 81 HN ALA 81 8.017 -4.440 -3.407 639 HA ALA 81 HA ALA 81 7.279 -4.840 -0.611 640 HB1 ALA 81 HB1 ALA 81 6.314 -2.571 -2.332 641 HB2 ALA 81 HB2 ALA 81 7.971 -2.606 -1.731 642 HB3 ALA 81 HB3 ALA 81 6.622 -2.597 -0.596 643 H LYS 82 HN LYS 82 6.061 -6.151 -3.308 644 HA LYS 82 HA LYS 82 3.890 -6.565 -4.126 645 HB2 LYS 82 HB2 LYS 82 3.901 -7.538 -1.260 646 HB3 LYS 82 HB1 LYS 82 2.717 -8.029 -2.472 647 HG2 LYS 82 HG2 LYS 82 4.586 -8.850 -3.910 648 HG3 LYS 82 HG1 LYS 82 5.715 -8.458 -2.612 649 HD2 LYS 82 HD2 LYS 82 4.422 -9.976 -1.097 650 HD3 LYS 82 HD1 LYS 82 3.425 -10.440 -2.475 651 HE2 LYS 82 HE2 LYS 82 5.144 -12.108 -2.273 652 HE3 LYS 82 HE1 LYS 82 5.565 -11.107 -3.664 653 HZ1 LYS 82 HZ1 LYS 82 7.232 -11.660 -1.647 654 HZ2 LYS 82 HZ2 LYS 82 7.361 -10.284 -2.637 655 HZ3 LYS 82 HZ3 LYS 82 6.594 -10.173 -1.127 656 H LYS 83 HN LYS 83 3.774 -4.039 -3.845 657 HA LYS 83 HA LYS 83 1.096 -3.515 -2.785 658 HB2 LYS 83 HB2 LYS 83 2.713 -2.912 -0.961 659 HB3 LYS 83 HB1 LYS 83 3.434 -1.733 -2.058 660 HG2 LYS 83 HG2 LYS 83 1.151 -0.689 -2.312 661 HG3 LYS 83 HG1 LYS 83 0.577 -1.771 -1.044 662 HD2 LYS 83 HD2 LYS 83 2.842 0.226 -0.752 663 HD3 LYS 83 HD1 LYS 83 1.207 0.439 -0.127 664 HE2 LYS 83 HE2 LYS 83 2.290 -0.412 1.753 665 HE3 LYS 83 HE1 LYS 83 1.673 -1.894 1.028 666 HZ1 LYS 83 HZ1 LYS 83 3.850 -2.441 1.332 667 HZ2 LYS 83 HZ2 LYS 83 3.940 -1.794 -0.237 668 HZ3 LYS 83 HZ3 LYS 83 4.413 -0.857 1.094 669 H LYS 84 HN LYS 84 -0.030 -2.373 -4.212 670 HA LYS 84 HA LYS 84 1.415 -0.657 -6.141 671 HB2 LYS 84 HB2 LYS 84 -0.494 -1.468 -7.752 672 HB3 LYS 84 HB1 LYS 84 0.910 -2.500 -7.490 673 HG2 LYS 84 HG2 LYS 84 -0.251 -3.914 -5.994 674 HG3 LYS 84 HG1 LYS 84 -1.552 -2.747 -5.771 675 HD2 LYS 84 HD2 LYS 84 -2.296 -3.072 -8.072 676 HD3 LYS 84 HD1 LYS 84 -0.936 -4.152 -8.386 677 HE2 LYS 84 HE2 LYS 84 -3.182 -4.632 -6.406 678 HE3 LYS 84 HE1 LYS 84 -2.942 -5.477 -7.935 679 HZ1 LYS 84 HZ1 LYS 84 -2.085 -6.774 -6.105 680 HZ2 LYS 84 HZ2 LYS 84 -0.805 -6.270 -7.102 681 HZ3 LYS 84 HZ3 LYS 84 -1.081 -5.492 -5.620 682 H VAL 85 HN VAL 85 0.378 1.148 -6.885 683 HA VAL 85 HA VAL 85 -2.254 1.740 -5.723 684 HB VAL 85 HB VAL 85 -1.683 3.731 -4.757 685 HG11 VAL 85 HG11 VAL 85 0.445 3.335 -3.432 686 HG12 VAL 85 HG12 VAL 85 -0.786 2.075 -3.358 687 HG13 VAL 85 HG13 VAL 85 0.631 1.867 -4.380 688 HG21 VAL 85 HG21 VAL 85 -0.420 5.250 -5.925 689 HG22 VAL 85 HG22 VAL 85 0.989 4.459 -5.241 690 HG23 VAL 85 HG23 VAL 85 0.394 3.988 -6.823 691 H GLU 86 HN GLU 86 -3.626 2.648 -7.046 692 HA GLU 86 HA GLU 86 -2.614 3.563 -9.686 693 HB2 GLU 86 HB2 GLU 86 -3.793 1.547 -10.068 694 HB3 GLU 86 HB1 GLU 86 -5.052 1.966 -8.916 695 HG2 GLU 86 HG2 GLU 86 -6.028 3.548 -10.367 696 HG3 GLU 86 HG1 GLU 86 -4.578 3.669 -11.360 697 H VAL 87 HN VAL 87 -3.041 5.534 -10.241 698 HA VAL 87 HA VAL 87 -4.416 7.349 -8.545 699 HB VAL 87 HB VAL 87 -2.765 8.328 -9.878 700 HG11 VAL 87 HG11 VAL 87 -2.332 6.644 -11.487 701 HG12 VAL 87 HG12 VAL 87 -3.973 6.713 -12.126 702 HG13 VAL 87 HG13 VAL 87 -2.851 8.038 -12.434 703 HG21 VAL 87 HG21 VAL 87 -5.141 9.447 -9.951 704 HG22 VAL 87 HG22 VAL 87 -3.876 10.046 -11.024 705 HG23 VAL 87 HG23 VAL 87 -5.122 8.962 -11.646 706 H LEU 88 HN LEU 88 -6.542 6.985 -8.163 707 HA LEU 88 HA LEU 88 -8.340 6.133 -10.254 708 HB2 LEU 88 HB2 LEU 88 -8.430 5.738 -7.626 709 HB3 LEU 88 HB1 LEU 88 -9.313 7.259 -7.646 710 HG LEU 88 HG LEU 88 -10.923 5.466 -7.807 711 HD11 LEU 88 HD11 LEU 88 -12.100 6.144 -9.749 712 HD12 LEU 88 HD12 LEU 88 -11.120 7.540 -9.304 713 HD13 LEU 88 HD13 LEU 88 -10.613 6.492 -10.630 714 HD21 LEU 88 HD21 LEU 88 -8.999 3.954 -8.959 715 HD22 LEU 88 HD22 LEU 88 -10.713 3.585 -9.119 716 HD23 LEU 88 HD23 LEU 88 -9.873 4.437 -10.412 717 H ASP 89 HN ASP 89 -8.031 9.110 -8.247 718 HA ASP 89 HA ASP 89 -8.854 10.716 -10.528 719 HB2 ASP 89 HB2 ASP 89 -10.880 10.098 -8.986 720 HB3 ASP 89 HB1 ASP 89 -10.113 11.176 -7.827 721 H THR 90 HN THR 90 -7.670 12.581 -10.544 722 HA THR 90 HA THR 90 -6.422 13.546 -8.086 723 HB THR 90 HB THR 90 -5.063 11.723 -9.620 724 HG1 THR 90 HG1 THR 90 -4.267 12.203 -7.672 725 HG21 THR 90 HG21 THR 90 -4.031 14.453 -10.422 726 HG22 THR 90 HG22 THR 90 -3.325 12.898 -10.853 727 HG23 THR 90 HG23 THR 90 -4.903 13.351 -11.488 728 H ASP 91 HN ASP 91 -6.404 15.700 -8.073 729 HA ASP 91 HA ASP 91 -6.497 17.146 -10.678 730 HB2 ASP 91 HB2 ASP 91 -8.802 16.934 -9.705 731 HB3 ASP 91 HB1 ASP 91 -8.235 17.834 -8.299 732 H TYR 92 HN TYR 92 -5.445 16.845 -7.483 733 HA TYR 92 HA TYR 92 -4.046 18.027 -6.132 734 HB2 TYR 92 HB2 TYR 92 -2.996 19.268 -8.668 735 HB3 TYR 92 HB1 TYR 92 -2.124 18.964 -7.172 736 HD1 TYR 92 HD2 TYR 92 -2.922 16.176 -6.518 737 HD2 TYR 92 HD1 TYR 92 -1.944 17.964 -10.305 738 HE1 TYR 92 HE2 TYR 92 -2.225 13.969 -7.381 739 HE2 TYR 92 HE1 TYR 92 -1.252 15.745 -11.166 740 HH TYR 92 HH TYR 92 -0.350 13.458 -9.822 741 H LYS 93 HN LYS 93 -6.457 19.483 -7.777 742 HA LYS 93 HA LYS 93 -5.812 22.248 -7.335 743 HB2 LYS 93 HB2 LYS 93 -7.393 21.429 -9.109 744 HB3 LYS 93 HB1 LYS 93 -8.532 21.016 -7.825 745 HG2 LYS 93 HG2 LYS 93 -8.658 23.326 -7.109 746 HG3 LYS 93 HG1 LYS 93 -7.368 23.786 -8.220 747 HD2 LYS 93 HD2 LYS 93 -9.486 24.405 -9.226 748 HD3 LYS 93 HD1 LYS 93 -8.823 23.041 -10.126 749 HE2 LYS 93 HE2 LYS 93 -10.353 21.516 -9.184 750 HE3 LYS 93 HE1 LYS 93 -10.734 22.587 -7.837 751 HZ1 LYS 93 HZ1 LYS 93 -12.026 23.940 -9.164 752 HZ2 LYS 93 HZ2 LYS 93 -11.314 23.401 -10.609 753 HZ3 LYS 93 HZ3 LYS 93 -12.389 22.395 -9.769 754 H SER 94 HN SER 94 -7.570 19.733 -5.661 755 HA SER 94 HA SER 94 -7.468 21.261 -3.197 756 HB2 SER 94 HB2 SER 94 -9.948 20.874 -2.813 757 HB3 SER 94 HB1 SER 94 -9.545 22.117 -3.995 758 HG SER 94 HG SER 94 -11.093 20.780 -4.885 759 H TYR 95 HN TYR 95 -7.981 18.309 -4.993 760 HA TYR 95 HA TYR 95 -7.135 16.750 -2.746 761 HB2 TYR 95 HB2 TYR 95 -9.182 15.444 -2.481 762 HB3 TYR 95 HB1 TYR 95 -9.484 17.149 -2.145 763 HD1 TYR 95 HD1 TYR 95 -9.809 14.497 -4.731 764 HD2 TYR 95 HD2 TYR 95 -10.975 18.443 -3.495 765 HE1 TYR 95 HE1 TYR 95 -11.516 14.556 -6.528 766 HE2 TYR 95 HE2 TYR 95 -12.685 18.499 -5.289 767 HH TYR 95 HH TYR 95 -13.782 15.850 -6.867 768 H ALA 96 HN ALA 96 -7.201 14.413 -3.181 769 HA ALA 96 HA ALA 96 -7.367 13.641 -5.998 770 HB1 ALA 96 HB1 ALA 96 -5.158 12.985 -6.227 771 HB2 ALA 96 HB2 ALA 96 -4.935 12.743 -4.497 772 HB3 ALA 96 HB3 ALA 96 -4.937 14.374 -5.167 773 H VAL 97 HN VAL 97 -8.108 11.585 -6.232 774 HA VAL 97 HA VAL 97 -8.429 9.972 -3.743 775 HB VAL 97 HB VAL 97 -10.199 9.629 -6.155 776 HG11 VAL 97 HG11 VAL 97 -10.253 7.980 -4.312 777 HG12 VAL 97 HG12 VAL 97 -10.625 9.275 -3.174 778 HG13 VAL 97 HG13 VAL 97 -11.779 8.855 -4.440 779 HG21 VAL 97 HG21 VAL 97 -10.308 12.027 -5.649 780 HG22 VAL 97 HG22 VAL 97 -11.791 11.238 -5.115 781 HG23 VAL 97 HG23 VAL 97 -10.551 11.672 -3.938 782 H ILE 98 HN ILE 98 -7.275 8.054 -3.763 783 HA ILE 98 HA ILE 98 -6.498 7.003 -6.405 784 HB ILE 98 HB ILE 98 -4.644 8.150 -5.476 785 HG12 ILE 98 HG12 ILE 98 -4.279 5.296 -4.535 786 HG13 ILE 98 HG11 ILE 98 -4.204 5.771 -6.232 787 HG21 ILE 98 HG21 ILE 98 -5.475 6.805 -2.906 788 HG22 ILE 98 HG22 ILE 98 -3.920 7.614 -3.096 789 HG23 ILE 98 HG23 ILE 98 -5.418 8.534 -3.245 790 HD11 ILE 98 HD11 ILE 98 -2.569 7.471 -4.457 791 HD12 ILE 98 HD12 ILE 98 -2.065 5.796 -4.508 792 HD13 ILE 98 HD13 ILE 98 -2.164 6.715 -6.004 793 H TYR 99 HN TYR 99 -6.391 4.812 -6.600 794 HA TYR 99 HA TYR 99 -7.729 3.235 -4.502 795 HB2 TYR 99 HB2 TYR 99 -8.592 3.109 -6.819 796 HB3 TYR 99 HB1 TYR 99 -7.030 2.499 -7.359 797 HD1 TYR 99 HD1 TYR 99 -9.853 1.796 -5.017 798 HD2 TYR 99 HD2 TYR 99 -6.509 0.195 -7.187 799 HE1 TYR 99 HE1 TYR 99 -10.546 -0.502 -4.390 800 HE2 TYR 99 HE2 TYR 99 -7.202 -2.102 -6.560 801 HH TYR 99 HH TYR 99 -10.244 -2.710 -4.890 802 H ALA 100 HN ALA 100 -6.325 2.537 -3.026 803 HA ALA 100 HA ALA 100 -3.700 1.475 -3.887 804 HB1 ALA 100 HB1 ALA 100 -3.393 3.168 -2.254 805 HB2 ALA 100 HB2 ALA 100 -3.185 1.643 -1.395 806 HB3 ALA 100 HB3 ALA 100 -4.697 2.540 -1.246 807 H THR 101 HN THR 101 -3.188 -0.607 -3.629 808 HA THR 101 HA THR 101 -4.779 -2.310 -1.849 809 HB THR 101 HB THR 101 -6.034 -2.901 -3.681 810 HG1 THR 101 HG1 THR 101 -3.627 -4.365 -3.922 811 HG21 THR 101 HG21 THR 101 -5.319 -1.429 -5.338 812 HG22 THR 101 HG22 THR 101 -3.646 -1.971 -5.241 813 HG23 THR 101 HG23 THR 101 -4.856 -2.988 -6.019 814 H ARG 102 HN ARG 102 -3.645 -3.872 -0.917 815 HA ARG 102 HA ARG 102 -0.889 -4.417 -1.865 816 HB2 ARG 102 HB2 ARG 102 -0.946 -3.025 0.215 817 HB3 ARG 102 HB1 ARG 102 -1.823 -4.330 1.012 818 HG2 ARG 102 HG2 ARG 102 0.148 -5.845 0.287 819 HG3 ARG 102 HG1 ARG 102 1.011 -4.344 -0.033 820 HD2 ARG 102 HD2 ARG 102 0.768 -3.638 2.268 821 HD3 ARG 102 HD1 ARG 102 -0.302 -4.992 2.620 822 HE ARG 102 HE ARG 102 1.585 -6.281 2.945 823 HH11 ARG 102 HH21 ARG 102 2.320 -3.568 0.925 824 HH12 ARG 102 HH22 ARG 102 4.011 -3.926 0.825 825 HH21 ARG 102 HH11 ARG 102 3.801 -6.754 2.819 826 HH22 ARG 102 HH12 ARG 102 4.850 -5.729 1.897 827 H VAL 103 HN VAL 103 -0.411 -6.621 -2.146 828 HA VAL 103 HA VAL 103 -2.425 -8.497 -1.050 829 HB VAL 103 HB VAL 103 -2.602 -8.296 -3.482 830 HG11 VAL 103 HG11 VAL 103 0.203 -9.375 -3.729 831 HG12 VAL 103 HG12 VAL 103 -0.793 -8.590 -4.953 832 HG13 VAL 103 HG13 VAL 103 -0.085 -7.636 -3.651 833 HG21 VAL 103 HG21 VAL 103 -2.903 -10.517 -2.346 834 HG22 VAL 103 HG22 VAL 103 -2.375 -10.654 -4.023 835 HG23 VAL 103 HG23 VAL 103 -1.217 -10.885 -2.712 836 H LYS 104 HN LYS 104 -1.630 -9.773 0.465 837 HA LYS 104 HA LYS 104 1.257 -10.320 0.536 838 HB2 LYS 104 HB2 LYS 104 -0.052 -9.378 2.550 839 HB3 LYS 104 HB1 LYS 104 -0.761 -10.984 2.682 840 HG2 LYS 104 HG2 LYS 104 1.395 -12.000 3.011 841 HG3 LYS 104 HG1 LYS 104 2.232 -10.503 2.607 842 HD2 LYS 104 HD2 LYS 104 0.278 -10.520 4.896 843 HD3 LYS 104 HD1 LYS 104 1.892 -11.183 5.138 844 HE2 LYS 104 HE2 LYS 104 2.864 -9.042 4.304 845 HE3 LYS 104 HE1 LYS 104 1.234 -8.380 4.181 846 HZ1 LYS 104 HZ1 LYS 104 2.604 -9.316 6.641 847 HZ2 LYS 104 HZ2 LYS 104 2.157 -7.722 6.259 848 HZ3 LYS 104 HZ3 LYS 104 0.962 -8.883 6.576 849 H ASP 105 HN ASP 105 1.769 -12.601 1.346 850 HA ASP 105 HA ASP 105 0.882 -14.460 -0.540 851 HB2 ASP 105 HB2 ASP 105 2.989 -14.664 0.750 852 HB3 ASP 105 HB1 ASP 105 2.048 -15.035 2.193 853 H GLY 106 HN GLY 106 -1.125 -15.134 -0.763 854 HA2 GLY 106 HA2 GLY 106 -2.964 -16.467 -0.251 855 HA3 GLY 106 HA1 GLY 106 -2.447 -16.500 1.426 856 H ARG 107 HN ARG 107 -2.400 -13.291 0.748 857 HA ARG 107 HA ARG 107 -5.301 -12.927 1.228 858 HB2 ARG 107 HB2 ARG 107 -3.066 -11.669 2.830 859 HB3 ARG 107 HB1 ARG 107 -4.775 -11.256 2.969 860 HG2 ARG 107 HG2 ARG 107 -5.210 -13.719 3.440 861 HG3 ARG 107 HG1 ARG 107 -3.463 -13.910 3.591 862 HD2 ARG 107 HD2 ARG 107 -5.207 -12.057 5.238 863 HD3 ARG 107 HD1 ARG 107 -4.457 -13.547 5.797 864 HE ARG 107 HE ARG 107 -2.357 -12.461 5.802 865 HH11 ARG 107 HH21 ARG 107 -4.919 -10.443 4.619 866 HH12 ARG 107 HH22 ARG 107 -4.010 -8.977 4.765 867 HH21 ARG 107 HH11 ARG 107 -1.171 -10.539 5.990 868 HH22 ARG 107 HH12 ARG 107 -1.892 -9.032 5.538 869 H THR 108 HN THR 108 -6.228 -11.146 0.402 870 HA THR 108 HA THR 108 -4.536 -9.301 -1.187 871 HB THR 108 HB THR 108 -7.407 -10.107 -1.714 872 HG1 THR 108 HG1 THR 108 -6.630 -11.570 -3.034 873 HG21 THR 108 HG21 THR 108 -6.895 -9.006 -3.931 874 HG22 THR 108 HG22 THR 108 -6.952 -7.899 -2.560 875 HG23 THR 108 HG23 THR 108 -5.396 -8.413 -3.214 876 H LEU 109 HN LEU 109 -5.291 -7.056 -1.270 877 HA LEU 109 HA LEU 109 -7.325 -6.306 0.700 878 HB2 LEU 109 HB2 LEU 109 -5.200 -6.433 1.944 879 HB3 LEU 109 HB1 LEU 109 -4.500 -5.259 0.858 880 HG LEU 109 HG LEU 109 -6.231 -3.622 1.538 881 HD11 LEU 109 HD11 LEU 109 -8.116 -4.803 2.251 882 HD12 LEU 109 HD12 LEU 109 -7.165 -5.980 3.156 883 HD13 LEU 109 HD13 LEU 109 -7.401 -4.354 3.796 884 HD21 LEU 109 HD21 LEU 109 -5.264 -3.149 3.699 885 HD22 LEU 109 HD22 LEU 109 -4.803 -4.839 3.910 886 HD23 LEU 109 HD23 LEU 109 -4.004 -3.853 2.684 887 H HIS 110 HN HIS 110 -8.111 -4.265 0.511 888 HA HIS 110 HA HIS 110 -7.072 -2.572 -1.627 889 HB2 HIS 110 HB2 HIS 110 -10.043 -3.021 -1.426 890 HB3 HIS 110 HB1 HIS 110 -9.116 -2.358 -2.773 891 HD1 HIS 110 HD1 HIS 110 -10.183 -5.577 -1.213 892 HD2 HIS 110 HD2 HIS 110 -7.750 -4.334 -4.362 893 HE1 HIS 110 HE1 HIS 110 -9.679 -7.644 -2.589 894 H MET 111 HN MET 111 -7.395 -0.336 -1.266 895 HA MET 111 HA MET 111 -9.105 0.539 0.886 896 HB2 MET 111 HB2 MET 111 -7.000 1.738 1.935 897 HB3 MET 111 HB1 MET 111 -7.396 0.081 2.389 898 HG2 MET 111 HG2 MET 111 -5.798 -0.777 0.731 899 HG3 MET 111 HG1 MET 111 -5.416 0.871 0.232 900 HE1 MET 111 HE1 MET 111 -4.711 2.702 1.899 901 HE2 MET 111 HE2 MET 111 -3.229 2.355 2.787 902 HE3 MET 111 HE3 MET 111 -3.337 1.983 1.062 903 H MET 112 HN MET 112 -9.414 2.798 0.886 904 HA MET 112 HA MET 112 -8.408 4.169 -1.548 905 HB2 MET 112 HB2 MET 112 -10.917 3.728 -1.279 906 HB3 MET 112 HB1 MET 112 -10.873 4.909 0.026 907 HG2 MET 112 HG2 MET 112 -11.451 6.187 -1.867 908 HG3 MET 112 HG1 MET 112 -9.720 6.470 -1.673 909 HE1 MET 112 HE1 MET 112 -11.978 4.502 -5.036 910 HE2 MET 112 HE2 MET 112 -12.544 4.799 -3.394 911 HE3 MET 112 HE3 MET 112 -12.116 6.156 -4.445 912 H ARG 113 HN ARG 113 -7.584 6.265 -1.364 913 HA ARG 113 HA ARG 113 -7.307 7.349 1.371 914 HB2 ARG 113 HB2 ARG 113 -5.135 7.004 -0.683 915 HB3 ARG 113 HB1 ARG 113 -4.984 8.066 0.715 916 HG2 ARG 113 HG2 ARG 113 -5.323 6.202 2.234 917 HG3 ARG 113 HG1 ARG 113 -5.647 5.115 0.883 918 HD2 ARG 113 HD2 ARG 113 -3.399 5.260 0.101 919 HD3 ARG 113 HD1 ARG 113 -3.045 6.628 1.151 920 HE ARG 113 HE ARG 113 -2.898 3.866 1.870 921 HH11 ARG 113 HH21 ARG 113 -3.734 7.024 3.013 922 HH12 ARG 113 HH22 ARG 113 -3.389 6.666 4.671 923 HH21 ARG 113 HH11 ARG 113 -2.441 3.391 4.044 924 HH22 ARG 113 HH12 ARG 113 -2.657 4.609 5.255 925 H LEU 114 HN LEU 114 -7.722 9.448 1.594 926 HA LEU 114 HA LEU 114 -8.223 11.038 -0.842 927 HB2 LEU 114 HB2 LEU 114 -10.166 10.797 0.622 928 HB3 LEU 114 HB1 LEU 114 -9.227 11.389 1.985 929 HG LEU 114 HG LEU 114 -8.865 13.545 0.745 930 HD11 LEU 114 HD11 LEU 114 -10.680 13.842 -1.139 931 HD12 LEU 114 HD12 LEU 114 -9.134 13.089 -1.524 932 HD13 LEU 114 HD13 LEU 114 -10.561 12.088 -1.265 933 HD21 LEU 114 HD21 LEU 114 -11.648 12.592 1.414 934 HD22 LEU 114 HD22 LEU 114 -10.575 13.609 2.374 935 HD23 LEU 114 HD23 LEU 114 -11.334 14.256 0.921 936 H TYR 115 HN TYR 115 -6.907 12.590 -1.327 937 HA TYR 115 HA TYR 115 -4.967 13.579 0.653 938 HB2 TYR 115 HB2 TYR 115 -4.987 13.558 -2.364 939 HB3 TYR 115 HB1 TYR 115 -3.803 14.462 -1.429 940 HD1 TYR 115 HD1 TYR 115 -5.318 11.016 -1.463 941 HD2 TYR 115 HD2 TYR 115 -1.773 13.408 -1.030 942 HE1 TYR 115 HE1 TYR 115 -3.962 8.964 -1.185 943 HE2 TYR 115 HE2 TYR 115 -0.423 11.350 -0.756 944 HH TYR 115 HH TYR 115 -1.902 8.245 -0.320 945 H SER 116 HN SER 116 -4.390 15.823 0.596 946 HA SER 116 HA SER 116 -6.444 17.676 -0.450 947 HB2 SER 116 HB2 SER 116 -6.853 17.349 1.976 948 HB3 SER 116 HB1 SER 116 -5.181 17.802 2.309 949 HG SER 116 HG SER 116 -5.757 19.789 1.085 950 H ARG 117 HN ARG 117 -5.549 19.522 -1.399 951 HA ARG 117 HA ARG 117 -2.730 19.506 -1.862 952 HB2 ARG 117 HB2 ARG 117 -4.594 20.353 -3.417 953 HB3 ARG 117 HB1 ARG 117 -4.600 21.804 -2.420 954 HG2 ARG 117 HG2 ARG 117 -3.117 22.215 -4.278 955 HG3 ARG 117 HG1 ARG 117 -2.126 22.021 -2.836 956 HD2 ARG 117 HD2 ARG 117 -2.682 19.537 -4.389 957 HD3 ARG 117 HD1 ARG 117 -1.614 20.712 -5.147 958 HE ARG 117 HE ARG 117 -0.980 19.046 -2.908 959 HH11 ARG 117 HH21 ARG 117 -0.496 22.163 -4.333 960 HH12 ARG 117 HH22 ARG 117 1.057 22.408 -3.603 961 HH21 ARG 117 HH11 ARG 117 1.055 19.361 -1.948 962 HH22 ARG 117 HH12 ARG 117 1.934 20.822 -2.253 963 H SER 118 HN SER 118 -4.759 20.841 0.555 964 HA SER 118 HA SER 118 -2.464 22.297 1.688 965 HB2 SER 118 HB2 SER 118 -3.762 24.018 0.606 966 HB3 SER 118 HB1 SER 118 -5.256 23.393 1.298 967 HG SER 118 HG SER 118 -4.602 24.052 3.293 968 HA PRO 119 HA PRO 119 -3.257 20.209 5.510 969 HB2 PRO 119 HB2 PRO 119 -3.485 23.002 6.601 970 HB3 PRO 119 HB1 PRO 119 -2.593 21.612 7.252 971 HG2 PRO 119 HG2 PRO 119 -1.384 23.584 5.876 972 HG3 PRO 119 HG1 PRO 119 -0.827 21.904 5.823 973 HD2 PRO 119 HD2 PRO 119 -2.109 23.490 3.698 974 HD3 PRO 119 HD1 PRO 119 -1.220 21.957 3.574 975 H GLU 120 HN GLU 120 -5.367 22.701 4.290 976 HA GLU 120 HA GLU 120 -7.509 22.204 6.142 977 HB2 GLU 120 HB2 GLU 120 -7.691 23.623 3.484 978 HB3 GLU 120 HB1 GLU 120 -8.724 23.829 4.900 979 HG2 GLU 120 HG2 GLU 120 -6.722 24.656 6.167 980 HG3 GLU 120 HG1 GLU 120 -5.801 24.593 4.665 981 H VAL 121 HN VAL 121 -9.578 21.445 5.477 982 HA VAL 121 HA VAL 121 -9.465 19.388 3.345 983 HB VAL 121 HB VAL 121 -11.114 19.333 5.884 984 HG11 VAL 121 HG11 VAL 121 -10.623 17.315 3.674 985 HG12 VAL 121 HG12 VAL 121 -11.445 16.948 5.190 986 HG13 VAL 121 HG13 VAL 121 -12.153 18.102 4.061 987 HG21 VAL 121 HG21 VAL 121 -9.534 17.564 6.590 988 HG22 VAL 121 HG22 VAL 121 -8.587 17.828 5.125 989 HG23 VAL 121 HG23 VAL 121 -8.699 19.097 6.346 990 H SER 122 HN SER 122 -10.714 19.853 1.667 991 HA SER 122 HA SER 122 -12.751 21.883 1.821 992 HB2 SER 122 HB2 SER 122 -11.669 21.927 -0.239 993 HB3 SER 122 HB1 SER 122 -11.598 20.171 -0.353 994 HG SER 122 HG SER 122 -13.211 21.319 -1.697 995 HA PRO 123 HA PRO 123 -16.112 19.172 2.817 996 HB2 PRO 123 HB2 PRO 123 -18.203 20.542 1.633 997 HB3 PRO 123 HB1 PRO 123 -17.471 20.992 3.185 998 HG2 PRO 123 HG2 PRO 123 -17.010 22.138 0.473 999 HG3 PRO 123 HG1 PRO 123 -17.121 22.956 2.041 1000 HD2 PRO 123 HD2 PRO 123 -14.736 22.469 0.823 1001 HD3 PRO 123 HD1 PRO 123 -14.909 22.492 2.593 1002 H ALA 124 HN ALA 124 -15.584 20.186 -0.498 1003 HA ALA 124 HA ALA 124 -17.283 18.170 -1.672 1004 HB1 ALA 124 HB1 ALA 124 -16.874 20.211 -2.913 1005 HB2 ALA 124 HB2 ALA 124 -16.158 18.864 -3.797 1006 HB3 ALA 124 HB3 ALA 124 -15.132 19.945 -2.854 1007 H ALA 125 HN ALA 125 -13.903 18.519 -0.825 1008 HA ALA 125 HA ALA 125 -12.859 16.296 -2.219 1009 HB1 ALA 125 HB1 ALA 125 -11.958 17.576 0.372 1010 HB2 ALA 125 HB2 ALA 125 -11.421 18.015 -1.248 1011 HB3 ALA 125 HB3 ALA 125 -11.007 16.436 -0.577 1012 H THR 126 HN THR 126 -14.288 16.649 0.968 1013 HA THR 126 HA THR 126 -13.819 13.917 1.748 1014 HB THR 126 HB THR 126 -15.990 15.440 3.100 1015 HG1 THR 126 HG1 THR 126 -13.722 16.628 2.409 1016 HG21 THR 126 HG21 THR 126 -13.478 14.026 4.063 1017 HG22 THR 126 HG22 THR 126 -14.751 14.664 5.103 1018 HG23 THR 126 HG23 THR 126 -15.094 13.322 4.009 1019 H ALA 127 HN ALA 127 -16.357 15.700 0.143 1020 HA ALA 127 HA ALA 127 -18.392 13.720 0.396 1021 HB1 ALA 127 HB1 ALA 127 -19.602 15.116 -1.155 1022 HB2 ALA 127 HB2 ALA 127 -18.120 15.976 -1.576 1023 HB3 ALA 127 HB3 ALA 127 -18.796 16.125 0.046 1024 H ILE 128 HN ILE 128 -16.278 14.666 -2.362 1025 HA ILE 128 HA ILE 128 -17.355 12.760 -4.156 1026 HB ILE 128 HB ILE 128 -15.684 14.810 -4.482 1027 HG12 ILE 128 HG12 ILE 128 -16.713 13.645 -6.324 1028 HG13 ILE 128 HG11 ILE 128 -14.992 13.799 -6.643 1029 HG21 ILE 128 HG21 ILE 128 -13.861 13.658 -3.155 1030 HG22 ILE 128 HG22 ILE 128 -13.741 12.484 -4.466 1031 HG23 ILE 128 HG23 ILE 128 -13.383 14.182 -4.767 1032 HD11 ILE 128 HD11 ILE 128 -16.535 11.347 -5.823 1033 HD12 ILE 128 HD12 ILE 128 -15.435 11.549 -7.186 1034 HD13 ILE 128 HD13 ILE 128 -14.797 11.444 -5.546 1035 H PHE 129 HN PHE 129 -14.950 12.810 -1.750 1036 HA PHE 129 HA PHE 129 -13.747 10.293 -2.105 1037 HB2 PHE 129 HB2 PHE 129 -12.803 12.073 -0.717 1038 HB3 PHE 129 HB1 PHE 129 -14.153 11.935 0.399 1039 HD1 PHE 129 HD1 PHE 129 -12.078 9.270 -1.302 1040 HD2 PHE 129 HD2 PHE 129 -13.307 11.078 2.400 1041 HE1 PHE 129 HE1 PHE 129 -10.893 7.510 -0.039 1042 HE2 PHE 129 HE2 PHE 129 -12.104 9.314 3.642 1043 HZ PHE 129 HZ PHE 129 -10.901 7.528 2.431 1044 H ARG 130 HN ARG 130 -16.456 11.339 -0.057 1045 HA ARG 130 HA ARG 130 -16.978 8.785 1.074 1046 HB2 ARG 130 HB2 ARG 130 -17.773 10.919 2.062 1047 HB3 ARG 130 HB1 ARG 130 -18.883 11.108 0.704 1048 HG2 ARG 130 HG2 ARG 130 -20.038 9.053 1.293 1049 HG3 ARG 130 HG1 ARG 130 -18.865 8.716 2.566 1050 HD2 ARG 130 HD2 ARG 130 -19.545 10.793 3.728 1051 HD3 ARG 130 HD1 ARG 130 -20.738 11.098 2.469 1052 HE ARG 130 HE ARG 130 -22.117 9.568 3.520 1053 HH11 ARG 130 HH21 ARG 130 -18.815 9.040 4.414 1054 HH12 ARG 130 HH22 ARG 130 -19.182 7.803 5.570 1055 HH21 ARG 130 HH11 ARG 130 -22.605 7.947 5.035 1056 HH22 ARG 130 HH12 ARG 130 -21.327 7.185 5.922 1057 H LYS 131 HN LYS 131 -18.076 10.426 -1.837 1058 HA LYS 131 HA LYS 131 -20.224 8.738 -2.518 1059 HB2 LYS 131 HB2 LYS 131 -18.324 10.401 -4.171 1060 HB3 LYS 131 HB1 LYS 131 -19.592 9.431 -4.920 1061 HG2 LYS 131 HG2 LYS 131 -21.283 10.587 -3.520 1062 HG3 LYS 131 HG1 LYS 131 -20.007 11.588 -2.829 1063 HD2 LYS 131 HD2 LYS 131 -19.445 12.378 -5.140 1064 HD3 LYS 131 HD1 LYS 131 -20.841 11.480 -5.741 1065 HE2 LYS 131 HE2 LYS 131 -21.622 13.707 -5.416 1066 HE3 LYS 131 HE1 LYS 131 -22.230 12.795 -4.035 1067 HZ1 LYS 131 HZ1 LYS 131 -21.247 14.884 -3.339 1068 HZ2 LYS 131 HZ2 LYS 131 -20.346 13.575 -2.737 1069 HZ3 LYS 131 HZ3 LYS 131 -19.771 14.460 -4.065 1070 H LEU 132 HN LEU 132 -16.790 8.585 -3.423 1071 HA LEU 132 HA LEU 132 -16.916 6.191 -4.908 1072 HB2 LEU 132 HB2 LEU 132 -14.780 7.776 -3.550 1073 HB3 LEU 132 HB1 LEU 132 -14.391 6.114 -3.968 1074 HG LEU 132 HG LEU 132 -13.819 7.897 -5.712 1075 HD11 LEU 132 HD11 LEU 132 -14.183 5.356 -6.086 1076 HD12 LEU 132 HD12 LEU 132 -15.717 5.831 -6.815 1077 HD13 LEU 132 HD13 LEU 132 -14.201 6.415 -7.493 1078 HD21 LEU 132 HD21 LEU 132 -16.206 8.957 -5.317 1079 HD22 LEU 132 HD22 LEU 132 -15.488 8.974 -6.924 1080 HD23 LEU 132 HD23 LEU 132 -16.714 7.774 -6.522 1081 H ALA 133 HN ALA 133 -16.137 6.803 -1.501 1082 HA ALA 133 HA ALA 133 -15.676 4.130 -0.765 1083 HB1 ALA 133 HB1 ALA 133 -15.593 4.906 1.426 1084 HB2 ALA 133 HB2 ALA 133 -16.850 6.110 1.159 1085 HB3 ALA 133 HB3 ALA 133 -15.230 6.366 0.513 1086 H GLY 134 HN GLY 134 -18.689 6.039 -0.889 1087 HA2 GLY 134 HA2 GLY 134 -20.310 4.148 0.464 1088 HA3 GLY 134 HA1 GLY 134 -20.877 5.411 -0.625 1089 H GLU 135 HN GLU 135 -19.423 4.600 -2.930 1090 HA GLU 135 HA GLU 135 -21.211 2.690 -4.017 1091 HB2 GLU 135 HB2 GLU 135 -18.578 3.812 -4.984 1092 HB3 GLU 135 HB1 GLU 135 -19.521 2.656 -5.925 1093 HG2 GLU 135 HG2 GLU 135 -21.458 4.183 -5.865 1094 HG3 GLU 135 HG1 GLU 135 -20.518 5.340 -4.926 1095 H ARG 136 HN ARG 136 -18.227 2.432 -2.290 1096 HA ARG 136 HA ARG 136 -17.884 -0.384 -3.065 1097 HB2 ARG 136 HB2 ARG 136 -16.032 1.590 -2.719 1098 HB3 ARG 136 HB1 ARG 136 -16.001 0.844 -1.125 1099 HG2 ARG 136 HG2 ARG 136 -14.417 -0.437 -2.279 1100 HG3 ARG 136 HG1 ARG 136 -15.872 -1.411 -2.483 1101 HD2 ARG 136 HD2 ARG 136 -16.244 -0.125 -4.669 1102 HD3 ARG 136 HD1 ARG 136 -14.601 0.475 -4.475 1103 HE ARG 136 HE ARG 136 -14.474 -2.298 -4.221 1104 HH11 ARG 136 HH21 ARG 136 -15.403 0.076 -6.560 1105 HH12 ARG 136 HH22 ARG 136 -14.980 -0.902 -7.925 1106 HH21 ARG 136 HH11 ARG 136 -13.917 -3.587 -6.007 1107 HH22 ARG 136 HH12 ARG 136 -14.139 -2.976 -7.612 1108 H ASN 137 HN ASN 137 -20.042 0.730 -1.272 1109 HA ASN 137 HA ASN 137 -21.165 0.121 0.640 1110 HB2 ASN 137 HB2 ASN 137 -19.383 -2.288 0.398 1111 HB3 ASN 137 HB1 ASN 137 -20.867 -2.202 1.343 1112 HD21 ASN 137 HD21 ASN 137 -22.386 -0.638 -0.616 1113 HD22 ASN 137 HD22 ASN 137 -22.690 -1.659 -1.937 1114 H TYR 138 HN TYR 138 -18.653 1.645 0.981 1115 HA TYR 138 HA TYR 138 -17.536 0.625 3.494 1116 HB2 TYR 138 HB2 TYR 138 -16.920 3.114 1.895 1117 HB3 TYR 138 HB1 TYR 138 -16.096 2.654 3.370 1118 HD1 TYR 138 HD1 TYR 138 -16.797 -0.416 1.800 1119 HD2 TYR 138 HD2 TYR 138 -14.267 3.042 1.385 1120 HE1 TYR 138 HE1 TYR 138 -15.180 -1.752 0.508 1121 HE2 TYR 138 HE2 TYR 138 -12.651 1.689 0.086 1122 HH TYR 138 HH TYR 138 -12.109 -0.350 -0.615 1123 H THR 139 HN THR 139 -18.454 1.044 5.361 1124 HA THR 139 HA THR 139 -20.417 3.168 5.650 1125 HB THR 139 HB THR 139 -21.117 2.042 7.520 1126 HG1 THR 139 HG1 THR 139 -19.293 0.838 8.728 1127 HG21 THR 139 HG21 THR 139 -19.273 -0.184 6.672 1128 HG22 THR 139 HG22 THR 139 -20.936 -0.284 7.247 1129 HG23 THR 139 HG23 THR 139 -20.599 0.326 5.628 1130 H ASP 140 HN ASP 140 -20.245 4.773 7.417 1131 HA ASP 140 HA ASP 140 -18.116 6.431 7.223 1132 HB2 ASP 140 HB2 ASP 140 -18.738 7.338 9.459 1133 HB3 ASP 140 HB1 ASP 140 -20.119 7.102 8.389 1134 H GLU 141 HN GLU 141 -18.415 4.023 9.912 1135 HA GLU 141 HA GLU 141 -15.978 4.554 11.100 1136 HB2 GLU 141 HB2 GLU 141 -17.385 1.887 10.855 1137 HB3 GLU 141 HB1 GLU 141 -16.117 2.272 12.020 1138 HG2 GLU 141 HG2 GLU 141 -17.540 4.110 12.915 1139 HG3 GLU 141 HG1 GLU 141 -18.821 3.626 11.804 1140 H MET 142 HN MET 142 -16.574 2.977 8.085 1141 HA MET 142 HA MET 142 -14.071 1.541 7.976 1142 HB2 MET 142 HB2 MET 142 -15.828 2.276 5.645 1143 HB3 MET 142 HB1 MET 142 -14.750 0.891 5.804 1144 HG2 MET 142 HG2 MET 142 -16.364 0.520 7.983 1145 HG3 MET 142 HG1 MET 142 -17.490 1.281 6.866 1146 HE1 MET 142 HE1 MET 142 -15.015 -2.490 6.281 1147 HE2 MET 142 HE2 MET 142 -14.549 -0.970 7.035 1148 HE3 MET 142 HE3 MET 142 -15.694 -2.046 7.844 1149 H VAL 143 HN VAL 143 -15.108 4.702 7.408 1150 HA VAL 143 HA VAL 143 -12.535 5.379 6.111 1151 HB VAL 143 HB VAL 143 -14.703 5.543 4.683 1152 HG11 VAL 143 HG11 VAL 143 -15.937 6.737 6.551 1153 HG12 VAL 143 HG12 VAL 143 -14.953 8.151 6.190 1154 HG13 VAL 143 HG13 VAL 143 -16.042 7.497 4.967 1155 HG21 VAL 143 HG21 VAL 143 -12.711 6.460 3.799 1156 HG22 VAL 143 HG22 VAL 143 -13.857 7.799 3.756 1157 HG23 VAL 143 HG23 VAL 143 -12.645 7.714 5.035 1158 H ALA 144 HN ALA 144 -11.300 6.637 7.350 1159 HA ALA 144 HA ALA 144 -12.599 8.186 9.521 1160 HB1 ALA 144 HB1 ALA 144 -10.791 7.658 10.921 1161 HB2 ALA 144 HB2 ALA 144 -9.740 7.242 9.568 1162 HB3 ALA 144 HB3 ALA 144 -11.057 6.163 10.024 1163 H MET 145 HN MET 145 -12.471 10.320 9.420 1164 HA MET 145 HA MET 145 -10.705 11.690 7.590 1165 HB2 MET 145 HB2 MET 145 -12.313 12.987 9.795 1166 HB3 MET 145 HB1 MET 145 -11.812 13.685 8.257 1167 HG2 MET 145 HG2 MET 145 -13.646 11.294 8.313 1168 HG3 MET 145 HG1 MET 145 -14.281 12.920 8.538 1169 HE1 MET 145 HE1 MET 145 -14.078 10.330 6.249 1170 HE2 MET 145 HE2 MET 145 -13.348 10.851 4.736 1171 HE3 MET 145 HE3 MET 145 -12.328 10.499 6.136 1172 H LEU 146 HN LEU 146 -8.790 12.750 8.104 1173 HA LEU 146 HA LEU 146 -7.883 12.433 10.865 1174 HB2 LEU 146 HB2 LEU 146 -6.842 11.372 8.571 1175 HB3 LEU 146 HB1 LEU 146 -5.878 12.838 8.730 1176 HG LEU 146 HG LEU 146 -5.285 12.215 10.981 1177 HD11 LEU 146 HD11 LEU 146 -5.921 9.558 11.338 1178 HD12 LEU 146 HD12 LEU 146 -6.743 10.907 12.114 1179 HD13 LEU 146 HD13 LEU 146 -7.394 10.213 10.630 1180 HD21 LEU 146 HD21 LEU 146 -4.847 9.821 9.229 1181 HD22 LEU 146 HD22 LEU 146 -4.000 11.350 8.995 1182 HD23 LEU 146 HD23 LEU 146 -3.790 10.443 10.487 1183 HA PRO 147 HA PRO 147 -7.679 16.903 11.074 1184 HB2 PRO 147 HB2 PRO 147 -6.416 17.149 13.452 1185 HB3 PRO 147 HB1 PRO 147 -8.079 16.531 13.341 1186 HG2 PRO 147 HG2 PRO 147 -5.514 14.986 13.532 1187 HG3 PRO 147 HG1 PRO 147 -6.995 14.808 14.496 1188 HD2 PRO 147 HD2 PRO 147 -6.488 13.200 12.417 1189 HD3 PRO 147 HD1 PRO 147 -8.142 13.727 12.781 1190 H ARG 148 HN ARG 148 -6.164 18.633 10.979 1191 HA ARG 148 HA ARG 148 -3.788 18.153 9.533 1192 HB2 ARG 148 HB2 ARG 148 -3.425 20.525 9.674 1193 HB3 ARG 148 HB1 ARG 148 -5.158 20.257 9.484 1194 HG2 ARG 148 HG2 ARG 148 -5.307 20.334 12.036 1195 HG3 ARG 148 HG1 ARG 148 -3.658 20.961 12.011 1196 HD2 ARG 148 HD2 ARG 148 -4.407 22.796 10.511 1197 HD3 ARG 148 HD1 ARG 148 -6.057 22.191 10.625 1198 HE ARG 148 HE ARG 148 -4.652 23.725 12.619 1199 HH11 ARG 148 HH21 ARG 148 -7.089 21.342 12.022 1200 HH12 ARG 148 HH22 ARG 148 -7.980 21.691 13.466 1201 HH21 ARG 148 HH11 ARG 148 -5.815 24.188 14.514 1202 HH22 ARG 148 HH12 ARG 148 -7.258 23.302 14.877 1203 H GLN 149 HN GLN 149 -4.360 17.906 12.865 1204 HA GLN 149 HA GLN 149 -2.237 18.878 14.221 1205 HB2 GLN 149 HB2 GLN 149 -3.476 16.136 14.404 1206 HB3 GLN 149 HB1 GLN 149 -2.249 16.691 15.543 1207 HG2 GLN 149 HG2 GLN 149 -4.785 18.240 14.961 1208 HG3 GLN 149 HG1 GLN 149 -4.652 17.072 16.274 1209 HE21 GLN 149 HE21 GLN 149 -5.131 19.853 16.791 1210 HE22 GLN 149 HE22 GLN 149 -3.764 20.489 17.570 1211 H GLU 150 HN GLU 150 -0.089 18.825 14.056 1212 HA GLU 150 HA GLU 150 1.184 16.548 12.639 1213 HB2 GLU 150 HB2 GLU 150 2.810 18.136 11.712 1214 HB3 GLU 150 HB1 GLU 150 1.171 18.548 11.211 1215 HG2 GLU 150 HG2 GLU 150 1.096 20.144 13.193 1216 HG3 GLU 150 HG1 GLU 150 2.828 19.871 13.368 1217 H GLU 151 HN GLU 151 2.858 15.609 13.643 1218 HA GLU 151 HA GLU 151 3.941 16.915 16.079 1219 HB2 GLU 151 HB2 GLU 151 3.600 13.963 15.476 1220 HB3 GLU 151 HB1 GLU 151 4.364 14.627 16.921 1221 HG2 GLU 151 HG2 GLU 151 1.514 15.217 16.075 1222 HG3 GLU 151 HG1 GLU 151 1.963 14.006 17.274 1223 H CYS 152 HN CYS 152 4.563 15.188 13.117 1224 HA CYS 152 HA CYS 152 7.419 15.897 13.310 1225 HB2 CYS 152 HB2 CYS 152 6.224 13.181 12.878 1226 HB3 CYS 152 HB1 CYS 152 7.750 13.586 12.099 1227 H THR 153 HN THR 153 8.483 15.953 11.212 1228 HA THR 153 HA THR 153 6.809 15.901 8.829 1229 HB THR 153 HB THR 153 7.423 18.245 8.216 1230 HG1 THR 153 HG1 THR 153 9.134 18.647 9.525 1231 HG21 THR 153 HG21 THR 153 5.936 18.179 10.846 1232 HG22 THR 153 HG22 THR 153 5.669 19.251 9.473 1233 HG23 THR 153 HG23 THR 153 5.237 17.545 9.356 1234 H VAL 154 HN VAL 154 8.101 16.243 6.848 1235 HA VAL 154 HA VAL 154 10.559 14.850 6.965 1236 HB VAL 154 HB VAL 154 10.545 15.000 4.619 1237 HG11 VAL 154 HG11 VAL 154 8.298 14.394 3.990 1238 HG12 VAL 154 HG12 VAL 154 8.574 13.802 5.627 1239 HG13 VAL 154 HG13 VAL 154 7.627 15.268 5.367 1240 HG21 VAL 154 HG21 VAL 154 8.971 16.725 3.493 1241 HG22 VAL 154 HG22 VAL 154 8.957 17.528 5.063 1242 HG23 VAL 154 HG23 VAL 154 10.473 17.327 4.189 1243 H ASP 155 HN ASP 155 12.559 15.677 6.105 1244 HA ASP 155 HA ASP 155 13.317 18.128 7.368 1245 HB2 ASP 155 HB2 ASP 155 14.944 16.374 7.264 1246 HB3 ASP 155 HB1 ASP 155 14.848 16.312 5.511 1247 H GLU 156 HN GLU 156 14.547 19.754 6.231 1248 HA GLU 156 HA GLU 156 13.638 20.343 3.493 1249 HB2 GLU 156 HB2 GLU 156 13.267 22.769 4.355 1250 HB3 GLU 156 HB1 GLU 156 12.010 21.568 4.644 1251 HG2 GLU 156 HG2 GLU 156 12.832 21.186 6.907 1252 HG3 GLU 156 HG1 GLU 156 14.182 22.284 6.630 1253 H VAL 157 HN VAL 157 15.825 19.848 2.967 1254 HA VAL 157 HA VAL 157 18.095 21.049 4.071 1255 HB VAL 157 HB VAL 157 19.056 20.577 1.738 1256 HG11 VAL 157 HG11 VAL 157 17.649 18.351 3.238 1257 HG12 VAL 157 HG12 VAL 157 19.002 18.145 2.126 1258 HG13 VAL 157 HG13 VAL 157 19.232 19.013 3.644 1259 HG21 VAL 157 HG21 VAL 157 16.740 20.764 0.676 1260 HG22 VAL 157 HG22 VAL 157 17.692 19.359 0.196 1261 HG23 VAL 157 HG23 VAL 157 16.397 19.184 1.380 1262 HN1 EB4 200 H17 EB4 200 0.895 -0.763 5.564 1263 H8 EB4 200 H8 EB4 200 4.182 1.925 0.221 1264 HN2 EB4 200 H25 EB4 200 3.836 0.669 5.706 1265 H9 EB4 200 H9 EB4 200 -0.461 6.072 3.020 1266 H10 EB4 200 H10 EB4 200 -2.719 -1.455 0.921 1267 HN3 EB4 200 H32 EB4 200 1.071 2.138 7.006 1268 H7 EB4 200 H7 EB4 200 -1.640 0.752 0.587 1269 H11 EB4 200 H11 EB4 200 6.401 0.860 0.526 1270 H12 EB4 200 H12 EB4 200 -1.355 7.175 5.055 1271 H15 EB4 200 H15 EB4 200 -0.954 6.174 7.286 1272 H14 EB4 200 H14 EB4 200 7.121 0.113 2.778 1273 H13 EB4 200 H13 EB4 200 -2.156 -2.821 2.914 1274 H22 EB4 200 H22 EB4 200 0.331 -3.264 7.028 1275 H30 EB4 200 H30 EB4 200 0.596 0.094 10.047 1276 H30A EB4 200 H9N EB4 200 -0.735 0.911 9.090 1277 H24 EB4 200 H24 EB4 200 0.863 2.560 9.934 1278 H28 EB4 200 H28 EB4 200 2.667 -3.237 7.767 1279 H28A EB4 200 H9L EB4 200 2.492 -3.432 6.015 1280 H23 EB4 200 H23 EB4 200 6.020 -0.386 7.440 1281 H29 EB4 200 H29 EB4 200 4.886 0.765 9.303 1282 H29A EB4 200 H9M EB4 200 5.376 1.941 7.987 1283 H21 ACD 300 HA3 ACD 300 1.120 9.820 -10.478 1284 H22 ACD 300 HA4 ACD 300 1.235 11.354 -9.584 1285 H31 ACD 300 HA1 ACD 300 -1.267 11.399 -9.419 1286 H32 ACD 300 HA2 ACD 300 -1.321 9.814 -10.223 1287 H41 ACD 300 HA0 ACD 300 0.121 10.384 -7.595 1288 H42 ACD 300 HAZ ACD 300 -0.053 8.798 -8.383 1289 H5 ACD 300 HAY ACD 300 -2.795 9.639 -8.148 1290 H6 ACD 300 HAX ACD 300 -2.953 9.226 -5.570 1291 H71 ACD 300 HAV ACD 300 0.002 10.005 -5.572 1292 H72 ACD 300 HAW ACD 300 -0.945 9.498 -4.156 1293 H8 ACD 300 HAU ACD 300 0.155 7.461 -6.272 1294 H9 ACD 300 HAT ACD 300 0.535 6.011 -4.139 1295 H101 ACD 300 HAR ACD 300 0.661 7.705 -2.085 1296 H102 ACD 300 HAS ACD 300 -0.792 8.482 -2.752 1297 H11 ACD 300 HAQ ACD 300 -2.104 6.252 -2.332 1298 H12 ACD 300 HAP ACD 300 -1.297 5.158 -0.105 1299 H131 ACD 300 HAN ACD 300 1.526 6.223 -0.732 1300 H132 ACD 300 HAO ACD 300 0.875 5.625 0.873 1301 H14 ACD 300 HAM ACD 300 -0.335 8.050 0.882 1302 H15 ACD 300 HAL ACD 300 1.766 9.609 0.831 1303 H161 ACD 300 HAJ ACD 300 3.959 8.797 0.113 1304 H162 ACD 300 HAK ACD 300 3.432 7.131 0.429 1305 H171 ACD 300 HAH ACD 300 4.033 7.499 -1.957 1306 H172 ACD 300 HAI ACD 300 2.336 7.022 -1.769 1307 H181 ACD 300 HAF ACD 300 1.694 9.453 -1.860 1308 H182 ACD 300 HAG ACD 300 3.395 9.856 -2.187 1309 H191 ACD 300 HAD ACD 300 3.325 8.341 -4.191 1310 H192 ACD 300 HAE ACD 300 1.618 8.035 -3.869 1311 H201 ACD 300 HAA ACD 300 1.832 9.765 -5.596 1312 H202 ACD 300 HAB ACD 300 2.863 10.744 -4.530 1313 H203 ACD 300 HAC ACD 300 1.151 10.489 -4.120 Start of MODEL 20 1 H1 MET 1 HT1 MET 1 5.621 23.098 -19.986 2 H2 MET 1 HT2 MET 1 7.098 22.459 -19.444 3 H3 MET 1 HT3 MET 1 5.789 21.425 -19.764 4 HA MET 1 HA MET 1 7.434 22.945 -21.701 5 HB2 MET 1 HB2 MET 1 8.262 20.731 -20.975 6 HB3 MET 1 HB1 MET 1 6.719 20.008 -21.431 7 HG2 MET 1 HG2 MET 1 7.061 20.634 -23.760 8 HG3 MET 1 HG1 MET 1 8.540 21.498 -23.343 9 HE1 MET 1 HE1 MET 1 7.803 17.020 -23.727 10 HE2 MET 1 HE2 MET 1 6.864 17.974 -22.582 11 HE3 MET 1 HE3 MET 1 6.831 18.370 -24.306 12 H THR 2 HN THR 2 4.291 21.755 -20.918 13 HA THR 2 HA THR 2 3.179 22.918 -23.317 14 HB THR 2 HB THR 2 2.666 19.976 -22.883 15 HG1 THR 2 HG1 THR 2 4.621 19.748 -23.611 16 HG21 THR 2 HG21 THR 2 1.697 20.081 -25.071 17 HG22 THR 2 HG22 THR 2 1.055 21.458 -24.176 18 HG23 THR 2 HG23 THR 2 2.349 21.696 -25.350 19 H VAL 3 HN VAL 3 2.363 20.502 -20.812 20 HA VAL 3 HA VAL 3 0.318 22.298 -19.740 21 HB VAL 3 HB VAL 3 -1.337 20.341 -19.783 22 HG11 VAL 3 HG11 VAL 3 -1.495 22.382 -21.216 23 HG12 VAL 3 HG12 VAL 3 -0.527 21.561 -22.441 24 HG13 VAL 3 HG13 VAL 3 -2.123 20.941 -22.015 25 HG21 VAL 3 HG21 VAL 3 0.521 18.717 -20.482 26 HG22 VAL 3 HG22 VAL 3 -0.989 18.605 -21.387 27 HG23 VAL 3 HG23 VAL 3 0.401 19.433 -22.089 28 HA PRO 4 HA PRO 4 2.964 19.855 -16.691 29 HB2 PRO 4 HB2 PRO 4 2.421 22.457 -15.302 30 HB3 PRO 4 HB1 PRO 4 3.915 21.499 -15.356 31 HG2 PRO 4 HG2 PRO 4 3.650 23.705 -16.814 32 HG3 PRO 4 HG1 PRO 4 4.499 22.283 -17.447 33 HD2 PRO 4 HD2 PRO 4 1.781 23.316 -18.147 34 HD3 PRO 4 HD1 PRO 4 2.955 22.448 -19.162 35 H ASP 5 HN ASP 5 2.330 19.141 -14.525 36 HA ASP 5 HA ASP 5 -0.177 19.842 -13.369 37 HB2 ASP 5 HB2 ASP 5 -0.898 18.534 -15.415 38 HB3 ASP 5 HB1 ASP 5 -0.125 17.126 -14.688 39 H ARG 6 HN ARG 6 1.895 16.964 -13.800 40 HA ARG 6 HA ARG 6 1.629 16.103 -11.100 41 HB2 ARG 6 HB2 ARG 6 2.234 14.586 -12.948 42 HB3 ARG 6 HB1 ARG 6 3.768 15.430 -13.136 43 HG2 ARG 6 HG2 ARG 6 3.197 14.517 -10.367 44 HG3 ARG 6 HG1 ARG 6 3.406 13.218 -11.537 45 HD2 ARG 6 HD2 ARG 6 5.365 15.466 -10.988 46 HD3 ARG 6 HD1 ARG 6 5.564 13.773 -10.546 47 HE ARG 6 HE ARG 6 5.254 13.599 -13.215 48 HH11 ARG 6 HH21 ARG 6 7.160 15.676 -11.206 49 HH12 ARG 6 HH22 ARG 6 8.420 15.880 -12.376 50 HH21 ARG 6 HH11 ARG 6 6.903 13.863 -14.753 51 HH22 ARG 6 HH12 ARG 6 8.275 14.854 -14.385 52 H SER 7 HN SER 7 4.192 17.848 -12.839 53 HA SER 7 HA SER 7 6.080 18.044 -10.812 54 HB2 SER 7 HB2 SER 7 5.395 20.149 -12.872 55 HB3 SER 7 HB1 SER 7 6.907 20.028 -11.977 56 HG SER 7 HG SER 7 5.856 18.360 -13.986 57 H GLU 8 HN GLU 8 3.108 19.822 -11.278 58 HA GLU 8 HA GLU 8 3.624 21.935 -9.458 59 HB2 GLU 8 HB2 GLU 8 1.065 20.744 -10.525 60 HB3 GLU 8 HB1 GLU 8 1.093 22.138 -9.445 61 HG2 GLU 8 HG2 GLU 8 1.025 22.925 -11.749 62 HG3 GLU 8 HG1 GLU 8 2.602 23.305 -11.057 63 H ILE 9 HN ILE 9 1.944 18.812 -9.039 64 HA ILE 9 HA ILE 9 1.569 19.352 -6.201 65 HB ILE 9 HB ILE 9 -0.083 18.163 -7.766 66 HG12 ILE 9 HG12 ILE 9 0.230 18.106 -5.038 67 HG13 ILE 9 HG11 ILE 9 -1.140 17.418 -5.874 68 HG21 ILE 9 HG21 ILE 9 1.841 15.895 -7.270 69 HG22 ILE 9 HG22 ILE 9 0.217 15.702 -7.906 70 HG23 ILE 9 HG23 ILE 9 1.416 16.608 -8.821 71 HD11 ILE 9 HD11 ILE 9 -0.038 15.226 -5.885 72 HD12 ILE 9 HD12 ILE 9 1.373 15.949 -5.104 73 HD13 ILE 9 HD13 ILE 9 -0.156 15.851 -4.243 74 H ALA 10 HN ALA 10 3.690 17.562 -8.260 75 HA ALA 10 HA ALA 10 4.679 15.749 -6.328 76 HB1 ALA 10 HB1 ALA 10 5.285 15.209 -8.535 77 HB2 ALA 10 HB2 ALA 10 6.790 15.745 -7.788 78 HB3 ALA 10 HB3 ALA 10 5.897 16.832 -8.850 79 H GLY 11 HN GLY 11 6.332 15.910 -4.802 80 HA2 GLY 11 HA2 GLY 11 8.243 17.215 -3.973 81 HA3 GLY 11 HA1 GLY 11 7.293 18.663 -4.309 82 H LYS 12 HN LYS 12 4.772 17.407 -3.473 83 HA LYS 12 HA LYS 12 5.035 16.618 -0.721 84 HB2 LYS 12 HB2 LYS 12 5.442 19.120 -0.690 85 HB3 LYS 12 HB1 LYS 12 3.764 19.311 -1.202 86 HG2 LYS 12 HG2 LYS 12 3.150 17.822 0.796 87 HG3 LYS 12 HG1 LYS 12 4.801 18.082 1.357 88 HD2 LYS 12 HD2 LYS 12 2.763 20.253 0.774 89 HD3 LYS 12 HD1 LYS 12 3.284 19.727 2.376 90 HE2 LYS 12 HE2 LYS 12 4.618 21.623 1.988 91 HE3 LYS 12 HE1 LYS 12 5.684 20.295 1.531 92 HZ1 LYS 12 HZ1 LYS 12 5.714 20.980 -0.567 93 HZ2 LYS 12 HZ2 LYS 12 4.025 21.143 -0.633 94 HZ3 LYS 12 HZ3 LYS 12 4.976 22.415 -0.039 95 H TRP 13 HN TRP 13 3.471 15.070 -0.638 96 HA TRP 13 HA TRP 13 0.805 15.663 -1.808 97 HB2 TRP 13 HB2 TRP 13 2.299 13.044 -1.457 98 HB3 TRP 13 HB1 TRP 13 0.608 13.110 -1.906 99 HD1 TRP 13 HD1 TRP 13 3.798 14.861 -3.177 100 HE1 TRP 13 HE1 TRP 13 3.741 14.685 -5.744 101 HE3 TRP 13 HE3 TRP 13 -0.643 12.423 -3.867 102 HZ2 TRP 13 HZ2 TRP 13 2.160 13.666 -7.757 103 HZ3 TRP 13 HZ3 TRP 13 -1.412 11.882 -6.164 104 HH2 TRP 13 HH2 TRP 13 -0.024 12.510 -8.124 105 H TYR 14 HN TYR 14 -0.809 15.794 -0.275 106 HA TYR 14 HA TYR 14 -0.160 14.889 2.457 107 HB2 TYR 14 HB2 TYR 14 -1.266 17.274 1.332 108 HB3 TYR 14 HB1 TYR 14 -2.516 16.528 2.313 109 HD1 TYR 14 HD1 TYR 14 -1.518 15.488 4.608 110 HD2 TYR 14 HD2 TYR 14 0.106 18.805 2.433 111 HE1 TYR 14 HE1 TYR 14 -0.447 16.316 6.683 112 HE2 TYR 14 HE2 TYR 14 1.185 19.637 4.502 113 HH TYR 14 HH TYR 14 0.396 18.445 7.592 114 H VAL 15 HN VAL 15 -1.409 13.466 3.551 115 HA VAL 15 HA VAL 15 -3.796 12.329 2.196 116 HB VAL 15 HB VAL 15 -1.690 11.102 3.989 117 HG11 VAL 15 HG11 VAL 15 -4.528 10.180 3.503 118 HG12 VAL 15 HG12 VAL 15 -3.245 9.046 3.924 119 HG13 VAL 15 HG13 VAL 15 -3.680 10.339 5.041 120 HG21 VAL 15 HG21 VAL 15 -1.746 9.358 2.190 121 HG22 VAL 15 HG22 VAL 15 -2.932 10.341 1.335 122 HG23 VAL 15 HG23 VAL 15 -1.299 10.953 1.589 123 H VAL 16 HN VAL 16 -5.714 12.864 3.217 124 HA VAL 16 HA VAL 16 -5.585 13.322 6.139 125 HB VAL 16 HB VAL 16 -6.776 15.293 6.063 126 HG11 VAL 16 HG11 VAL 16 -5.291 15.697 3.492 127 HG12 VAL 16 HG12 VAL 16 -5.314 16.705 4.929 128 HG13 VAL 16 HG13 VAL 16 -4.381 15.222 4.903 129 HG21 VAL 16 HG21 VAL 16 -7.538 14.462 3.260 130 HG22 VAL 16 HG22 VAL 16 -8.599 14.834 4.618 131 HG23 VAL 16 HG23 VAL 16 -7.728 16.129 3.799 132 H ALA 17 HN ALA 17 -6.810 11.211 4.139 133 HA ALA 17 HA ALA 17 -8.827 10.467 5.965 134 HB1 ALA 17 HB1 ALA 17 -10.514 10.880 3.696 135 HB2 ALA 17 HB2 ALA 17 -9.698 12.405 4.035 136 HB3 ALA 17 HB3 ALA 17 -10.645 11.619 5.286 137 H LEU 18 HN LEU 18 -9.132 8.303 5.747 138 HA LEU 18 HA LEU 18 -8.580 7.113 3.128 139 HB2 LEU 18 HB2 LEU 18 -7.567 5.219 4.624 140 HB3 LEU 18 HB1 LEU 18 -6.601 6.639 4.241 141 HG LEU 18 HG LEU 18 -6.563 5.967 6.667 142 HD11 LEU 18 HD11 LEU 18 -6.606 8.512 5.565 143 HD12 LEU 18 HD12 LEU 18 -7.769 8.624 6.886 144 HD13 LEU 18 HD13 LEU 18 -6.117 8.102 7.205 145 HD21 LEU 18 HD21 LEU 18 -9.374 7.072 6.787 146 HD22 LEU 18 HD22 LEU 18 -9.052 5.348 6.657 147 HD23 LEU 18 HD23 LEU 18 -8.483 6.252 8.055 148 H ALA 19 HN ALA 19 -9.137 4.742 3.167 149 HA ALA 19 HA ALA 19 -11.478 4.077 4.776 150 HB1 ALA 19 HB1 ALA 19 -13.008 3.882 3.068 151 HB2 ALA 19 HB2 ALA 19 -11.776 3.566 1.848 152 HB3 ALA 19 HB3 ALA 19 -12.052 5.211 2.419 153 H SER 20 HN SER 20 -11.771 1.839 4.984 154 HA SER 20 HA SER 20 -10.249 -0.029 3.412 155 HB2 SER 20 HB2 SER 20 -8.321 0.248 4.590 156 HB3 SER 20 HB1 SER 20 -9.143 1.041 5.927 157 HG SER 20 HG SER 20 -8.906 -1.724 5.370 158 H ASN 21 HN ASN 21 -10.226 -2.227 4.641 159 HA ASN 21 HA ASN 21 -12.832 -2.607 5.997 160 HB2 ASN 21 HB2 ASN 21 -11.599 -4.178 3.747 161 HB3 ASN 21 HB1 ASN 21 -12.853 -4.858 4.782 162 HD21 ASN 21 HD21 ASN 21 -13.432 -1.565 4.637 163 HD22 ASN 21 HD22 ASN 21 -14.538 -1.545 3.351 164 H THR 22 HN THR 22 -9.446 -3.168 5.901 165 HA THR 22 HA THR 22 -9.541 -5.448 7.721 166 HB THR 22 HB THR 22 -7.733 -5.198 5.989 167 HG1 THR 22 HG1 THR 22 -7.541 -6.401 7.993 168 HG21 THR 22 HG21 THR 22 -6.157 -3.514 6.086 169 HG22 THR 22 HG22 THR 22 -7.569 -2.628 6.652 170 HG23 THR 22 HG23 THR 22 -6.393 -3.248 7.812 171 H GLU 23 HN GLU 23 -10.196 -5.006 9.715 172 HA GLU 23 HA GLU 23 -10.305 -2.519 10.895 173 HB2 GLU 23 HB2 GLU 23 -10.110 -5.218 12.229 174 HB3 GLU 23 HB1 GLU 23 -10.595 -3.729 13.041 175 HG2 GLU 23 HG2 GLU 23 -12.442 -3.482 11.364 176 HG3 GLU 23 HG1 GLU 23 -12.004 -5.059 10.711 177 H PHE 24 HN PHE 24 -7.636 -4.827 11.032 178 HA PHE 24 HA PHE 24 -6.204 -3.721 13.116 179 HB2 PHE 24 HB2 PHE 24 -4.641 -4.440 10.678 180 HB3 PHE 24 HB1 PHE 24 -4.414 -4.950 12.351 181 HD1 PHE 24 HD1 PHE 24 -7.076 -5.975 13.069 182 HD2 PHE 24 HD2 PHE 24 -4.841 -6.422 9.428 183 HE1 PHE 24 HE1 PHE 24 -8.289 -8.082 12.583 184 HE2 PHE 24 HE2 PHE 24 -6.053 -8.530 8.942 185 HZ PHE 24 HZ PHE 24 -7.777 -9.360 10.520 186 H PHE 25 HN PHE 25 -5.914 -2.806 9.665 187 HA PHE 25 HA PHE 25 -4.315 -0.495 10.297 188 HB2 PHE 25 HB2 PHE 25 -5.657 -1.090 7.665 189 HB3 PHE 25 HB1 PHE 25 -4.218 -0.123 7.954 190 HD1 PHE 25 HD2 PHE 25 -3.321 -2.440 10.173 191 HD2 PHE 25 HD1 PHE 25 -4.253 -2.318 5.973 192 HE1 PHE 25 HE2 PHE 25 -1.949 -4.452 9.807 193 HE2 PHE 25 HE1 PHE 25 -2.874 -4.348 5.622 194 HZ PHE 25 HZ PHE 25 -1.722 -5.410 7.537 195 H LEU 26 HN LEU 26 -7.639 -0.992 9.188 196 HA LEU 26 HA LEU 26 -8.363 1.723 8.931 197 HB2 LEU 26 HB2 LEU 26 -9.794 0.124 7.963 198 HB3 LEU 26 HB1 LEU 26 -9.857 -0.839 9.427 199 HG LEU 26 HG LEU 26 -11.218 0.857 10.534 200 HD11 LEU 26 HD11 LEU 26 -10.731 2.383 7.964 201 HD12 LEU 26 HD12 LEU 26 -12.042 2.788 9.073 202 HD13 LEU 26 HD13 LEU 26 -10.366 2.897 9.611 203 HD21 LEU 26 HD21 LEU 26 -12.392 0.484 7.775 204 HD22 LEU 26 HD22 LEU 26 -12.166 -0.890 8.856 205 HD23 LEU 26 HD23 LEU 26 -13.213 0.443 9.337 206 H ARG 27 HN ARG 27 -8.986 -0.520 11.511 207 HA ARG 27 HA ARG 27 -10.096 1.204 13.401 208 HB2 ARG 27 HB2 ARG 27 -9.803 -1.305 13.713 209 HB3 ARG 27 HB1 ARG 27 -8.148 -0.960 14.223 210 HG2 ARG 27 HG2 ARG 27 -9.230 -0.934 16.280 211 HG3 ARG 27 HG1 ARG 27 -9.344 0.769 15.843 212 HD2 ARG 27 HD2 ARG 27 -11.608 0.376 14.927 213 HD3 ARG 27 HD1 ARG 27 -11.488 -1.324 15.368 214 HE ARG 27 HE ARG 27 -11.847 -0.731 17.600 215 HH11 ARG 27 HH21 ARG 27 -11.265 2.037 15.606 216 HH12 ARG 27 HH22 ARG 27 -11.729 3.181 16.821 217 HH21 ARG 27 HH11 ARG 27 -12.456 0.764 19.198 218 HH22 ARG 27 HH12 ARG 27 -12.403 2.461 18.854 219 H GLU 28 HN GLU 28 -6.676 0.663 12.650 220 HA GLU 28 HA GLU 28 -5.789 2.530 14.691 221 HB2 GLU 28 HB2 GLU 28 -4.347 0.985 12.541 222 HB3 GLU 28 HB1 GLU 28 -3.534 2.096 13.642 223 HG2 GLU 28 HG2 GLU 28 -4.391 0.813 15.570 224 HG3 GLU 28 HG1 GLU 28 -5.194 -0.304 14.468 225 H LYS 29 HN LYS 29 -6.122 2.645 11.093 226 HA LYS 29 HA LYS 29 -4.664 4.922 10.621 227 HB2 LYS 29 HB2 LYS 29 -7.066 3.677 9.346 228 HB3 LYS 29 HB1 LYS 29 -6.600 5.297 8.843 229 HG2 LYS 29 HG2 LYS 29 -4.695 4.576 7.780 230 HG3 LYS 29 HG1 LYS 29 -4.345 3.367 9.009 231 HD2 LYS 29 HD2 LYS 29 -4.838 2.161 7.009 232 HD3 LYS 29 HD1 LYS 29 -6.253 1.993 8.034 233 HE2 LYS 29 HE2 LYS 29 -7.360 3.822 6.815 234 HE3 LYS 29 HE1 LYS 29 -5.944 3.977 5.773 235 HZ1 LYS 29 HZ1 LYS 29 -6.304 1.884 4.851 236 HZ2 LYS 29 HZ2 LYS 29 -7.381 1.415 6.078 237 HZ3 LYS 29 HZ3 LYS 29 -7.857 2.567 4.930 238 H ASP 30 HN ASP 30 -7.661 4.569 12.283 239 HA ASP 30 HA ASP 30 -8.476 7.296 12.110 240 HB2 ASP 30 HB2 ASP 30 -9.255 5.170 14.115 241 HB3 ASP 30 HB1 ASP 30 -10.099 6.693 13.837 242 H LYS 31 HN LYS 31 -6.207 5.583 14.150 243 HA LYS 31 HA LYS 31 -6.306 7.632 16.190 244 HB2 LYS 31 HB2 LYS 31 -4.802 6.363 17.475 245 HB3 LYS 31 HB1 LYS 31 -5.874 5.199 16.711 246 HG2 LYS 31 HG2 LYS 31 -3.795 4.226 16.347 247 HG3 LYS 31 HG1 LYS 31 -4.042 5.110 14.861 248 HD2 LYS 31 HD2 LYS 31 -2.788 6.972 16.579 249 HD3 LYS 31 HD1 LYS 31 -1.960 5.451 16.874 250 HE2 LYS 31 HE2 LYS 31 -2.459 6.172 14.016 251 HE3 LYS 31 HE1 LYS 31 -1.228 7.085 14.872 252 HZ1 LYS 31 HZ1 LYS 31 -1.346 4.177 14.395 253 HZ2 LYS 31 HZ2 LYS 31 -0.098 5.265 14.015 254 HZ3 LYS 31 HZ3 LYS 31 -0.378 4.829 15.629 255 H MET 32 HN MET 32 -4.410 7.063 13.311 256 HA MET 32 HA MET 32 -2.265 8.788 14.198 257 HB2 MET 32 HB2 MET 32 -1.747 8.833 11.627 258 HB3 MET 32 HB1 MET 32 -1.439 7.373 12.545 259 HG2 MET 32 HG2 MET 32 -3.967 6.834 11.819 260 HG3 MET 32 HG1 MET 32 -3.557 7.925 10.509 261 HE1 MET 32 HE1 MET 32 -3.177 4.854 12.369 262 HE2 MET 32 HE2 MET 32 -2.252 3.731 11.391 263 HE3 MET 32 HE3 MET 32 -1.422 4.886 12.435 264 H LYS 33 HN LYS 33 -1.631 10.587 12.644 265 HA LYS 33 HA LYS 33 -3.906 12.456 12.397 266 HB2 LYS 33 HB2 LYS 33 -1.044 13.336 12.638 267 HB3 LYS 33 HB1 LYS 33 -2.519 14.206 13.059 268 HG2 LYS 33 HG2 LYS 33 -1.462 11.772 14.532 269 HG3 LYS 33 HG1 LYS 33 -1.289 13.439 15.072 270 HD2 LYS 33 HD2 LYS 33 -3.856 13.580 14.907 271 HD3 LYS 33 HD1 LYS 33 -3.826 11.823 14.809 272 HE2 LYS 33 HE2 LYS 33 -2.613 13.471 17.044 273 HE3 LYS 33 HE1 LYS 33 -4.129 12.576 17.140 274 HZ1 LYS 33 HZ1 LYS 33 -2.495 11.186 18.061 275 HZ2 LYS 33 HZ2 LYS 33 -2.778 10.565 16.505 276 HZ3 LYS 33 HZ3 LYS 33 -1.393 11.495 16.806 277 H MET 34 HN MET 34 -3.244 14.283 10.618 278 HA MET 34 HA MET 34 -3.208 13.180 8.146 279 HB2 MET 34 HB2 MET 34 -3.395 15.661 9.260 280 HB3 MET 34 HB1 MET 34 -1.818 15.794 8.507 281 HG2 MET 34 HG2 MET 34 -2.811 15.036 6.382 282 HG3 MET 34 HG1 MET 34 -4.394 15.000 7.159 283 HE1 MET 34 HE1 MET 34 -5.317 16.738 8.469 284 HE2 MET 34 HE2 MET 34 -5.299 18.451 8.067 285 HE3 MET 34 HE3 MET 34 -6.021 17.288 6.956 286 H ALA 35 HN ALA 35 -1.646 12.624 6.652 287 HA ALA 35 HA ALA 35 1.185 12.619 7.535 288 HB1 ALA 35 HB1 ALA 35 1.379 10.636 5.967 289 HB2 ALA 35 HB2 ALA 35 -0.381 10.644 5.875 290 HB3 ALA 35 HB3 ALA 35 0.420 10.366 7.420 291 H MET 36 HN MET 36 2.786 12.611 5.733 292 HA MET 36 HA MET 36 1.843 14.111 3.360 293 HB2 MET 36 HB2 MET 36 4.446 15.046 3.913 294 HB3 MET 36 HB1 MET 36 2.941 15.940 4.090 295 HG2 MET 36 HG2 MET 36 3.993 14.116 6.262 296 HG3 MET 36 HG1 MET 36 4.428 15.820 6.162 297 HE1 MET 36 HE1 MET 36 3.200 14.424 8.551 298 HE2 MET 36 HE2 MET 36 3.384 16.173 8.651 299 HE3 MET 36 HE3 MET 36 1.851 15.414 9.100 300 H ALA 37 HN ALA 37 3.423 14.104 1.568 301 HA ALA 37 HA ALA 37 5.471 12.058 1.553 302 HB1 ALA 37 HB1 ALA 37 2.812 11.620 0.242 303 HB2 ALA 37 HB2 ALA 37 3.779 10.507 1.201 304 HB3 ALA 37 HB3 ALA 37 4.266 10.901 -0.450 305 H ARG 38 HN ARG 38 6.606 11.902 -0.535 306 HA ARG 38 HA ARG 38 6.233 14.263 -2.304 307 HB2 ARG 38 HB2 ARG 38 8.094 14.870 -0.929 308 HB3 ARG 38 HB1 ARG 38 8.790 13.254 -1.038 309 HG2 ARG 38 HG2 ARG 38 9.417 13.551 -3.305 310 HG3 ARG 38 HG1 ARG 38 8.368 14.955 -3.497 311 HD2 ARG 38 HD2 ARG 38 10.758 15.600 -3.286 312 HD3 ARG 38 HD1 ARG 38 9.777 16.255 -1.978 313 HE ARG 38 HE ARG 38 10.694 13.899 -0.957 314 HH11 ARG 38 HH21 ARG 38 12.155 16.627 -2.503 315 HH12 ARG 38 HH22 ARG 38 13.656 16.482 -1.649 316 HH21 ARG 38 HH11 ARG 38 12.659 13.702 0.167 317 HH22 ARG 38 HH12 ARG 38 13.941 14.826 -0.138 318 H ILE 39 HN ILE 39 6.254 13.702 -4.558 319 HA ILE 39 HA ILE 39 7.154 11.015 -5.229 320 HB ILE 39 HB ILE 39 4.721 11.391 -5.086 321 HG12 ILE 39 HG12 ILE 39 5.578 10.826 -7.923 322 HG13 ILE 39 HG11 ILE 39 5.744 9.643 -6.629 323 HG21 ILE 39 HG21 ILE 39 4.834 13.648 -5.886 324 HG22 ILE 39 HG22 ILE 39 5.174 13.043 -7.499 325 HG23 ILE 39 HG23 ILE 39 3.672 12.635 -6.713 326 HD11 ILE 39 HD11 ILE 39 3.495 9.226 -6.571 327 HD12 ILE 39 HD12 ILE 39 3.086 10.940 -6.694 328 HD13 ILE 39 HD13 ILE 39 3.451 10.011 -8.140 329 H SER 40 HN SER 40 8.244 10.704 -7.119 330 HA SER 40 HA SER 40 8.873 13.080 -8.747 331 HB2 SER 40 HB2 SER 40 10.957 13.173 -7.865 332 HB3 SER 40 HB1 SER 40 10.703 11.682 -6.967 333 HG SER 40 HG SER 40 12.286 11.235 -8.416 334 H PHE 41 HN PHE 41 9.316 12.627 -10.912 335 HA PHE 41 HA PHE 41 8.377 10.013 -11.798 336 HB2 PHE 41 HB2 PHE 41 8.587 12.720 -12.943 337 HB3 PHE 41 HB1 PHE 41 8.885 11.422 -14.091 338 HD1 PHE 41 HD2 PHE 41 6.624 11.463 -11.109 339 HD2 PHE 41 HD1 PHE 41 6.923 11.314 -15.392 340 HE1 PHE 41 HE2 PHE 41 4.188 11.027 -11.264 341 HE2 PHE 41 HE1 PHE 41 4.487 10.878 -15.547 342 HZ PHE 41 HZ PHE 41 3.120 10.734 -13.484 343 H LEU 42 HN LEU 42 9.779 8.491 -11.857 344 HA LEU 42 HA LEU 42 12.584 8.899 -12.622 345 HB2 LEU 42 HB2 LEU 42 11.011 6.430 -11.856 346 HB3 LEU 42 HB1 LEU 42 12.675 6.369 -12.396 347 HG LEU 42 HG LEU 42 11.680 7.962 -10.020 348 HD11 LEU 42 HD11 LEU 42 12.858 5.199 -10.306 349 HD12 LEU 42 HD12 LEU 42 13.122 6.121 -8.827 350 HD13 LEU 42 HD13 LEU 42 11.480 5.723 -9.337 351 HD21 LEU 42 HD21 LEU 42 13.659 9.042 -10.598 352 HD22 LEU 42 HD22 LEU 42 14.310 7.751 -9.593 353 HD23 LEU 42 HD23 LEU 42 14.351 7.606 -11.351 354 H GLY 43 HN GLY 43 9.624 7.520 -13.753 355 HA2 GLY 43 HA2 GLY 43 10.016 7.974 -16.488 356 HA3 GLY 43 HA1 GLY 43 10.449 6.298 -16.144 357 H GLU 44 HN GLU 44 8.097 7.420 -17.650 358 HA GLU 44 HA GLU 44 5.724 7.324 -16.219 359 HB2 GLU 44 HB2 GLU 44 6.281 6.251 -19.003 360 HB3 GLU 44 HB1 GLU 44 4.671 6.514 -18.334 361 HG2 GLU 44 HG2 GLU 44 5.244 8.912 -17.978 362 HG3 GLU 44 HG1 GLU 44 6.804 8.627 -18.749 363 H ASP 45 HN ASP 45 7.961 4.790 -16.902 364 HA ASP 45 HA ASP 45 6.048 2.683 -16.198 365 HB2 ASP 45 HB2 ASP 45 8.980 2.240 -16.699 366 HB3 ASP 45 HB1 ASP 45 7.627 1.145 -16.976 367 H GLU 46 HN GLU 46 8.365 4.719 -14.710 368 HA GLU 46 HA GLU 46 8.030 3.286 -12.179 369 HB2 GLU 46 HB2 GLU 46 10.817 4.109 -12.959 370 HB3 GLU 46 HB1 GLU 46 10.302 2.963 -11.722 371 HG2 GLU 46 HG2 GLU 46 9.493 1.444 -13.523 372 HG3 GLU 46 HG1 GLU 46 10.122 2.573 -14.717 373 H LEU 47 HN LEU 47 8.074 4.606 -10.403 374 HA LEU 47 HA LEU 47 9.021 7.365 -10.705 375 HB2 LEU 47 HB2 LEU 47 6.794 7.814 -9.181 376 HB3 LEU 47 HB1 LEU 47 6.890 8.118 -10.909 377 HG LEU 47 HG LEU 47 6.035 5.449 -9.781 378 HD11 LEU 47 HD11 LEU 47 4.515 7.131 -8.910 379 HD12 LEU 47 HD12 LEU 47 4.352 7.857 -10.510 380 HD13 LEU 47 HD13 LEU 47 3.705 6.245 -10.203 381 HD21 LEU 47 HD21 LEU 47 4.782 5.961 -12.243 382 HD22 LEU 47 HD22 LEU 47 6.426 6.554 -12.467 383 HD23 LEU 47 HD23 LEU 47 6.150 4.887 -11.973 384 H LYS 48 HN LYS 48 9.609 8.362 -8.765 385 HA LYS 48 HA LYS 48 10.160 6.444 -6.576 386 HB2 LYS 48 HB2 LYS 48 12.015 7.831 -7.741 387 HB3 LYS 48 HB1 LYS 48 11.366 9.198 -6.840 388 HG2 LYS 48 HG2 LYS 48 11.593 7.767 -4.746 389 HG3 LYS 48 HG1 LYS 48 12.517 6.630 -5.728 390 HD2 LYS 48 HD2 LYS 48 13.195 9.533 -5.179 391 HD3 LYS 48 HD1 LYS 48 14.086 8.113 -4.635 392 HE2 LYS 48 HE2 LYS 48 15.323 8.811 -6.505 393 HE3 LYS 48 HE1 LYS 48 14.285 7.553 -7.177 394 HZ1 LYS 48 HZ1 LYS 48 14.463 10.172 -8.005 395 HZ2 LYS 48 HZ2 LYS 48 13.304 9.028 -8.486 396 HZ3 LYS 48 HZ3 LYS 48 12.975 10.072 -7.190 397 H VAL 49 HN VAL 49 8.848 6.580 -4.801 398 HA VAL 49 HA VAL 49 7.928 9.242 -4.060 399 HB VAL 49 HB VAL 49 6.168 7.820 -5.415 400 HG11 VAL 49 HG11 VAL 49 5.706 6.830 -2.601 401 HG12 VAL 49 HG12 VAL 49 4.517 6.747 -3.900 402 HG13 VAL 49 HG13 VAL 49 6.030 5.855 -4.026 403 HG21 VAL 49 HG21 VAL 49 4.646 9.343 -4.692 404 HG22 VAL 49 HG22 VAL 49 4.972 9.027 -3.005 405 HG23 VAL 49 HG23 VAL 49 6.022 10.050 -3.915 406 H SER 50 HN SER 50 7.592 9.696 -2.069 407 HA SER 50 HA SER 50 8.722 7.812 -0.062 408 HB2 SER 50 HB2 SER 50 8.884 10.815 -0.277 409 HB3 SER 50 HB1 SER 50 9.305 9.942 1.188 410 HG SER 50 HG SER 50 10.376 9.007 -1.201 411 H TYR 51 HN TYR 51 7.832 7.681 1.999 412 HA TYR 51 HA TYR 51 5.084 8.766 2.273 413 HB2 TYR 51 HB2 TYR 51 6.340 6.321 3.555 414 HB3 TYR 51 HB1 TYR 51 4.685 6.862 3.777 415 HD1 TYR 51 HD1 TYR 51 6.934 6.280 0.780 416 HD2 TYR 51 HD2 TYR 51 3.152 5.521 2.682 417 HE1 TYR 51 HE1 TYR 51 6.230 4.918 -1.154 418 HE2 TYR 51 HE2 TYR 51 2.464 4.146 0.740 419 HH TYR 51 HH TYR 51 2.991 3.863 -1.588 420 H ALA 52 HN ALA 52 4.778 10.184 3.940 421 HA ALA 52 HA ALA 52 6.677 10.117 6.210 422 HB1 ALA 52 HB1 ALA 52 5.392 12.653 5.236 423 HB2 ALA 52 HB2 ALA 52 6.911 12.088 4.552 424 HB3 ALA 52 HB3 ALA 52 6.802 12.457 6.272 425 H VAL 53 HN VAL 53 5.536 9.297 7.862 426 HA VAL 53 HA VAL 53 2.796 10.320 8.321 427 HB VAL 53 HB VAL 53 3.798 7.576 9.074 428 HG11 VAL 53 HG11 VAL 53 1.541 7.094 9.562 429 HG12 VAL 53 HG12 VAL 53 1.763 8.720 10.204 430 HG13 VAL 53 HG13 VAL 53 0.951 8.485 8.658 431 HG21 VAL 53 HG21 VAL 53 2.369 6.852 7.089 432 HG22 VAL 53 HG22 VAL 53 2.381 8.540 6.577 433 HG23 VAL 53 HG23 VAL 53 3.893 7.638 6.679 434 HA PRO 54 HA PRO 54 4.811 11.349 12.238 435 HB2 PRO 54 HB2 PRO 54 2.855 12.857 13.320 436 HB3 PRO 54 HB1 PRO 54 3.818 13.438 11.945 437 HG2 PRO 54 HG2 PRO 54 1.070 12.270 11.968 438 HG3 PRO 54 HG1 PRO 54 1.698 13.653 11.053 439 HD2 PRO 54 HD2 PRO 54 1.405 11.111 9.991 440 HD3 PRO 54 HD1 PRO 54 2.555 12.320 9.379 441 H LYS 55 HN LYS 55 4.974 9.867 13.830 442 HA LYS 55 HA LYS 55 2.498 8.684 14.950 443 HB2 LYS 55 HB2 LYS 55 5.169 7.343 14.503 444 HB3 LYS 55 HB1 LYS 55 3.794 6.617 15.335 445 HG2 LYS 55 HG2 LYS 55 2.452 7.135 13.195 446 HG3 LYS 55 HG1 LYS 55 4.018 7.398 12.426 447 HD2 LYS 55 HD2 LYS 55 3.127 4.859 13.828 448 HD3 LYS 55 HD1 LYS 55 3.291 5.078 12.086 449 HE2 LYS 55 HE2 LYS 55 5.335 4.087 12.596 450 HE3 LYS 55 HE1 LYS 55 5.760 5.794 12.717 451 HZ1 LYS 55 HZ1 LYS 55 5.012 3.993 14.958 452 HZ2 LYS 55 HZ2 LYS 55 6.558 4.621 14.638 453 HZ3 LYS 55 HZ3 LYS 55 5.303 5.659 15.114 454 HA PRO 56 HA PRO 56 4.254 11.006 18.490 455 HB2 PRO 56 HB2 PRO 56 2.070 9.381 19.761 456 HB3 PRO 56 HB1 PRO 56 2.490 11.089 20.007 457 HG2 PRO 56 HG2 PRO 56 0.415 10.407 18.502 458 HG3 PRO 56 HG1 PRO 56 1.466 11.761 18.049 459 HD2 PRO 56 HD2 PRO 56 1.281 9.039 16.839 460 HD3 PRO 56 HD1 PRO 56 1.729 10.583 16.078 461 H ASN 57 HN ASN 57 3.583 7.555 18.260 462 HA ASN 57 HA ASN 57 5.159 6.826 20.556 463 HB2 ASN 57 HB2 ASN 57 4.110 5.175 18.246 464 HB3 ASN 57 HB1 ASN 57 4.879 4.515 19.687 465 HD21 ASN 57 HD21 ASN 57 2.143 3.912 18.974 466 HD22 ASN 57 HD22 ASN 57 1.138 4.585 20.166 467 H GLY 58 HN GLY 58 5.756 7.428 17.198 468 HA2 GLY 58 HA2 GLY 58 8.484 7.720 17.345 469 HA3 GLY 58 HA1 GLY 58 8.241 6.009 17.006 470 H CYS 59 HN CYS 59 7.959 9.254 15.767 471 HA CYS 59 HA CYS 59 6.522 8.923 13.434 472 HB2 CYS 59 HB2 CYS 59 9.076 10.531 13.611 473 HB3 CYS 59 HB1 CYS 59 7.684 10.829 12.569 474 H ARG 60 HN ARG 60 7.004 8.302 11.325 475 HA ARG 60 HA ARG 60 9.573 6.898 10.901 476 HB2 ARG 60 HB2 ARG 60 7.645 5.322 11.424 477 HB3 ARG 60 HB1 ARG 60 6.915 5.858 9.912 478 HG2 ARG 60 HG2 ARG 60 8.102 4.010 9.155 479 HG3 ARG 60 HG1 ARG 60 9.313 5.269 8.921 480 HD2 ARG 60 HD2 ARG 60 10.242 4.719 11.184 481 HD3 ARG 60 HD1 ARG 60 9.096 3.388 11.290 482 HE ARG 60 HE ARG 60 11.505 3.474 9.680 483 HH11 ARG 60 HH21 ARG 60 8.378 2.080 10.178 484 HH12 ARG 60 HH22 ARG 60 8.747 0.609 9.341 485 HH21 ARG 60 HH11 ARG 60 11.998 1.547 8.582 486 HH22 ARG 60 HH12 ARG 60 10.796 0.308 8.438 487 H LYS 61 HN LYS 61 10.588 7.600 9.172 488 HA LYS 61 HA LYS 61 9.042 8.616 6.866 489 HB2 LYS 61 HB2 LYS 61 10.565 10.479 6.601 490 HB3 LYS 61 HB1 LYS 61 9.913 10.525 8.239 491 HG2 LYS 61 HG2 LYS 61 11.981 9.232 8.970 492 HG3 LYS 61 HG1 LYS 61 12.641 9.552 7.364 493 HD2 LYS 61 HD2 LYS 61 12.154 12.023 7.813 494 HD3 LYS 61 HD1 LYS 61 11.888 11.560 9.494 495 HE2 LYS 61 HE2 LYS 61 14.421 10.995 7.926 496 HE3 LYS 61 HE1 LYS 61 14.227 12.308 9.087 497 HZ1 LYS 61 HZ1 LYS 61 15.272 10.294 10.027 498 HZ2 LYS 61 HZ2 LYS 61 13.840 10.741 10.825 499 HZ3 LYS 61 HZ3 LYS 61 13.832 9.440 9.737 500 H TRP 62 HN TRP 62 9.740 7.827 4.940 501 HA TRP 62 HA TRP 62 12.479 7.000 4.563 502 HB2 TRP 62 HB2 TRP 62 12.288 4.713 4.584 503 HB3 TRP 62 HB1 TRP 62 11.094 5.109 5.816 504 HD1 TRP 62 HD1 TRP 62 8.606 5.876 4.240 505 HE1 TRP 62 HE1 TRP 62 7.390 4.194 2.707 506 HE3 TRP 62 HE3 TRP 62 12.392 2.557 3.403 507 HZ2 TRP 62 HZ2 TRP 62 7.962 1.765 1.302 508 HZ3 TRP 62 HZ3 TRP 62 12.032 0.569 1.968 509 HH2 TRP 62 HH2 TRP 62 9.822 0.168 0.920 510 H GLU 63 HN GLU 63 12.596 5.696 2.407 511 HA GLU 63 HA GLU 63 10.910 7.116 0.421 512 HB2 GLU 63 HB2 GLU 63 13.360 7.756 0.532 513 HB3 GLU 63 HB1 GLU 63 13.730 6.118 -0.007 514 HG2 GLU 63 HG2 GLU 63 12.501 6.442 -2.060 515 HG3 GLU 63 HG1 GLU 63 11.887 7.999 -1.504 516 H THR 64 HN THR 64 10.541 5.977 -1.596 517 HA THR 64 HA THR 64 10.992 3.098 -1.641 518 HB THR 64 HB THR 64 8.142 3.976 -1.976 519 HG1 THR 64 HG1 THR 64 7.806 3.940 0.146 520 HG21 THR 64 HG21 THR 64 9.484 1.435 -1.010 521 HG22 THR 64 HG22 THR 64 7.744 1.661 -1.192 522 HG23 THR 64 HG23 THR 64 8.792 1.698 -2.611 523 H THR 65 HN THR 65 10.931 2.236 -3.690 524 HA THR 65 HA THR 65 10.532 4.169 -5.897 525 HB THR 65 HB THR 65 12.118 1.588 -5.870 526 HG1 THR 65 HG1 THR 65 12.723 3.869 -4.839 527 HG21 THR 65 HG21 THR 65 11.255 2.076 -8.087 528 HG22 THR 65 HG22 THR 65 11.752 3.762 -7.952 529 HG23 THR 65 HG23 THR 65 12.969 2.490 -8.054 530 H PHE 66 HN PHE 66 9.234 3.646 -7.623 531 HA PHE 66 HA PHE 66 7.478 1.269 -7.317 532 HB2 PHE 66 HB2 PHE 66 7.071 4.033 -8.445 533 HB3 PHE 66 HB1 PHE 66 5.975 2.741 -8.810 534 HD1 PHE 66 HD2 PHE 66 7.116 2.256 -5.446 535 HD2 PHE 66 HD1 PHE 66 4.484 4.666 -7.844 536 HE1 PHE 66 HE2 PHE 66 5.800 2.815 -3.441 537 HE2 PHE 66 HE1 PHE 66 3.174 5.225 -5.827 538 HZ PHE 66 HZ PHE 66 3.823 4.299 -3.628 539 H LYS 67 HN LYS 67 7.871 -0.302 -8.852 540 HA LYS 67 HA LYS 67 8.920 0.600 -11.473 541 HB2 LYS 67 HB2 LYS 67 9.660 -1.829 -9.844 542 HB3 LYS 67 HB1 LYS 67 10.136 -1.588 -11.524 543 HG2 LYS 67 HG2 LYS 67 11.065 0.704 -10.697 544 HG3 LYS 67 HG1 LYS 67 10.958 -0.011 -9.090 545 HD2 LYS 67 HD2 LYS 67 12.433 -1.256 -11.428 546 HD3 LYS 67 HD1 LYS 67 13.200 -0.326 -10.141 547 HE2 LYS 67 HE2 LYS 67 13.441 -2.580 -9.452 548 HE3 LYS 67 HE1 LYS 67 12.069 -1.986 -8.517 549 HZ1 LYS 67 HZ1 LYS 67 11.343 -3.039 -11.092 550 HZ2 LYS 67 HZ2 LYS 67 12.059 -4.194 -10.072 551 HZ3 LYS 67 HZ3 LYS 67 10.677 -3.356 -9.561 552 H LYS 68 HN LYS 68 8.479 -0.669 -13.289 553 HA LYS 68 HA LYS 68 7.073 -1.793 -14.736 554 HB2 LYS 68 HB2 LYS 68 6.579 -3.481 -12.266 555 HB3 LYS 68 HB1 LYS 68 6.056 -3.903 -13.897 556 HG2 LYS 68 HG2 LYS 68 8.442 -3.783 -14.642 557 HG3 LYS 68 HG1 LYS 68 8.914 -3.514 -12.965 558 HD2 LYS 68 HD2 LYS 68 7.892 -5.666 -12.325 559 HD3 LYS 68 HD1 LYS 68 7.419 -5.939 -14.003 560 HE2 LYS 68 HE2 LYS 68 9.452 -7.148 -13.726 561 HE3 LYS 68 HE1 LYS 68 9.903 -5.676 -14.585 562 HZ1 LYS 68 HZ1 LYS 68 11.022 -6.561 -12.283 563 HZ2 LYS 68 HZ2 LYS 68 11.114 -4.969 -12.872 564 HZ3 LYS 68 HZ3 LYS 68 9.931 -5.381 -11.730 565 H THR 69 HN THR 69 6.092 0.456 -14.059 566 HA THR 69 HA THR 69 3.420 0.084 -12.964 567 HB THR 69 HB THR 69 3.578 2.401 -12.420 568 HG1 THR 69 HG1 THR 69 4.734 3.689 -13.568 569 HG21 THR 69 HG21 THR 69 5.133 0.512 -11.289 570 HG22 THR 69 HG22 THR 69 6.395 1.570 -11.909 571 HG23 THR 69 HG23 THR 69 5.204 2.198 -10.784 572 H SER 70 HN SER 70 2.710 -0.838 -15.047 573 HA SER 70 HA SER 70 1.510 1.208 -16.695 574 HB2 SER 70 HB2 SER 70 3.509 1.188 -17.938 575 HB3 SER 70 HB1 SER 70 3.711 -0.552 -17.754 576 HG SER 70 HG SER 70 1.340 0.111 -18.916 577 H ASP 71 HN ASP 71 1.278 -1.524 -15.079 578 HA ASP 71 HA ASP 71 0.169 -3.499 -16.648 579 HB2 ASP 71 HB2 ASP 71 -0.208 -2.620 -13.815 580 HB3 ASP 71 HB1 ASP 71 -1.287 -3.850 -14.461 581 H ASP 72 HN ASP 72 -2.019 -1.650 -14.587 582 HA ASP 72 HA ASP 72 -4.077 -1.805 -16.681 583 HB2 ASP 72 HB2 ASP 72 -4.166 -1.147 -13.737 584 HB3 ASP 72 HB1 ASP 72 -5.560 -0.959 -14.797 585 H GLY 73 HN GLY 73 -2.857 -0.181 -17.940 586 HA2 GLY 73 HA2 GLY 73 -2.917 1.961 -18.829 587 HA3 GLY 73 HA1 GLY 73 -3.966 2.445 -17.493 588 H GLU 74 HN GLU 74 -3.062 3.222 -15.566 589 HA GLU 74 HA GLU 74 -0.129 3.482 -15.502 590 HB2 GLU 74 HB2 GLU 74 -2.198 5.624 -14.988 591 HB3 GLU 74 HB1 GLU 74 -0.529 5.750 -14.432 592 HG2 GLU 74 HG2 GLU 74 -1.289 5.250 -17.320 593 HG3 GLU 74 HG1 GLU 74 -0.978 6.856 -16.665 594 H VAL 75 HN VAL 75 0.070 1.781 -13.923 595 HA VAL 75 HA VAL 75 -0.930 2.536 -11.271 596 HB VAL 75 HB VAL 75 -0.997 -0.264 -12.425 597 HG11 VAL 75 HG11 VAL 75 -1.517 0.930 -9.710 598 HG12 VAL 75 HG12 VAL 75 -2.441 -0.485 -10.217 599 HG13 VAL 75 HG13 VAL 75 -0.683 -0.563 -10.133 600 HG21 VAL 75 HG21 VAL 75 -3.557 0.209 -11.940 601 HG22 VAL 75 HG22 VAL 75 -3.071 1.892 -12.131 602 HG23 VAL 75 HG23 VAL 75 -2.826 0.751 -13.448 603 H TYR 76 HN TYR 76 0.452 1.808 -9.577 604 HA TYR 76 HA TYR 76 3.182 1.209 -10.561 605 HB2 TYR 76 HB2 TYR 76 3.719 2.945 -9.210 606 HB3 TYR 76 HB1 TYR 76 2.121 2.929 -8.484 607 HD1 TYR 76 HD1 TYR 76 5.186 0.711 -8.463 608 HD2 TYR 76 HD2 TYR 76 2.072 2.576 -6.178 609 HE1 TYR 76 HE1 TYR 76 6.097 -0.281 -6.392 610 HE2 TYR 76 HE2 TYR 76 2.999 1.591 -4.107 611 HH TYR 76 HH TYR 76 4.741 0.526 -3.214 612 H TYR 77 HN TYR 77 4.471 -0.525 -9.843 613 HA TYR 77 HA TYR 77 3.255 -2.232 -7.795 614 HB2 TYR 77 HB2 TYR 77 2.685 -2.946 -10.214 615 HB3 TYR 77 HB1 TYR 77 4.371 -3.444 -10.305 616 HD1 TYR 77 HD2 TYR 77 5.230 -4.959 -8.311 617 HD2 TYR 77 HD1 TYR 77 1.098 -4.442 -9.370 618 HE1 TYR 77 HE2 TYR 77 4.663 -7.066 -7.138 619 HE2 TYR 77 HE1 TYR 77 0.536 -6.556 -8.199 620 HH TYR 77 HH TYR 77 2.902 -8.259 -6.249 621 H SER 78 HN SER 78 4.713 -2.803 -6.265 622 HA SER 78 HA SER 78 7.586 -2.701 -6.980 623 HB2 SER 78 HB2 SER 78 6.056 -1.895 -4.614 624 HB3 SER 78 HB1 SER 78 7.455 -2.884 -4.220 625 HG SER 78 HG SER 78 8.707 -1.446 -5.498 626 H GLU 79 HN GLU 79 8.089 -4.695 -7.649 627 HA GLU 79 HA GLU 79 6.983 -7.125 -6.933 628 HB2 GLU 79 HB2 GLU 79 8.692 -6.692 -8.746 629 HB3 GLU 79 HB1 GLU 79 9.925 -6.736 -7.486 630 HG2 GLU 79 HG2 GLU 79 9.073 -9.006 -6.824 631 HG3 GLU 79 HG1 GLU 79 8.012 -8.963 -8.231 632 H GLU 80 HN GLU 80 9.429 -5.244 -5.245 633 HA GLU 80 HA GLU 80 9.993 -7.326 -3.321 634 HB2 GLU 80 HB2 GLU 80 10.804 -4.421 -3.470 635 HB3 GLU 80 HB1 GLU 80 11.358 -5.542 -2.225 636 HG2 GLU 80 HG2 GLU 80 12.281 -7.023 -3.982 637 HG3 GLU 80 HG1 GLU 80 11.758 -5.872 -5.212 638 H ALA 81 HN ALA 81 8.218 -4.227 -3.258 639 HA ALA 81 HA ALA 81 7.475 -4.650 -0.471 640 HB1 ALA 81 HB1 ALA 81 6.404 -2.433 -2.191 641 HB2 ALA 81 HB2 ALA 81 8.074 -2.398 -1.627 642 HB3 ALA 81 HB3 ALA 81 6.751 -2.435 -0.462 643 H LYS 82 HN LYS 82 6.307 -6.034 -3.153 644 HA LYS 82 HA LYS 82 4.156 -6.554 -3.958 645 HB2 LYS 82 HB2 LYS 82 4.289 -7.467 -1.079 646 HB3 LYS 82 HB1 LYS 82 2.985 -7.935 -2.166 647 HG2 LYS 82 HG2 LYS 82 4.548 -9.708 -2.334 648 HG3 LYS 82 HG1 LYS 82 4.836 -8.735 -3.773 649 HD2 LYS 82 HD2 LYS 82 6.795 -7.749 -2.842 650 HD3 LYS 82 HD1 LYS 82 6.405 -8.318 -1.219 651 HE2 LYS 82 HE2 LYS 82 8.186 -9.683 -2.301 652 HE3 LYS 82 HE1 LYS 82 6.754 -10.635 -1.907 653 HZ1 LYS 82 HZ1 LYS 82 7.225 -11.240 -4.074 654 HZ2 LYS 82 HZ2 LYS 82 6.032 -10.048 -4.281 655 HZ3 LYS 82 HZ3 LYS 82 7.664 -9.666 -4.540 656 H LYS 83 HN LYS 83 3.925 -4.034 -3.786 657 HA LYS 83 HA LYS 83 1.231 -3.582 -2.755 658 HB2 LYS 83 HB2 LYS 83 2.845 -2.935 -0.912 659 HB3 LYS 83 HB1 LYS 83 3.447 -1.675 -1.990 660 HG2 LYS 83 HG2 LYS 83 1.052 -0.868 -2.214 661 HG3 LYS 83 HG1 LYS 83 0.635 -1.980 -0.911 662 HD2 LYS 83 HD2 LYS 83 2.638 0.292 -0.756 663 HD3 LYS 83 HD1 LYS 83 1.053 0.243 0.016 664 HE2 LYS 83 HE2 LYS 83 2.389 -0.452 1.785 665 HE3 LYS 83 HE1 LYS 83 2.009 -2.013 1.061 666 HZ1 LYS 83 HZ1 LYS 83 4.343 -0.528 0.083 667 HZ2 LYS 83 HZ2 LYS 83 4.461 -1.341 1.569 668 HZ3 LYS 83 HZ3 LYS 83 4.084 -2.205 0.160 669 H LYS 84 HN LYS 84 0.093 -2.420 -4.163 670 HA LYS 84 HA LYS 84 1.534 -0.703 -6.095 671 HB2 LYS 84 HB2 LYS 84 -0.321 -1.486 -7.728 672 HB3 LYS 84 HB1 LYS 84 1.005 -2.600 -7.393 673 HG2 LYS 84 HG2 LYS 84 -0.334 -3.803 -5.772 674 HG3 LYS 84 HG1 LYS 84 -1.629 -2.617 -5.903 675 HD2 LYS 84 HD2 LYS 84 -1.705 -3.226 -8.405 676 HD3 LYS 84 HD1 LYS 84 -0.726 -4.624 -7.967 677 HE2 LYS 84 HE2 LYS 84 -2.559 -5.018 -6.138 678 HE3 LYS 84 HE1 LYS 84 -3.545 -3.970 -7.158 679 HZ1 LYS 84 HZ1 LYS 84 -2.351 -6.588 -7.809 680 HZ2 LYS 84 HZ2 LYS 84 -3.967 -6.085 -7.965 681 HZ3 LYS 84 HZ3 LYS 84 -2.791 -5.501 -9.039 682 H VAL 85 HN VAL 85 0.498 1.108 -6.840 683 HA VAL 85 HA VAL 85 -2.124 1.706 -5.653 684 HB VAL 85 HB VAL 85 -1.541 3.685 -4.677 685 HG11 VAL 85 HG11 VAL 85 -0.564 2.059 -3.308 686 HG12 VAL 85 HG12 VAL 85 0.804 1.844 -4.389 687 HG13 VAL 85 HG13 VAL 85 0.659 3.320 -3.445 688 HG21 VAL 85 HG21 VAL 85 -0.351 5.232 -5.891 689 HG22 VAL 85 HG22 VAL 85 1.092 4.479 -5.237 690 HG23 VAL 85 HG23 VAL 85 0.475 3.992 -6.806 691 H GLU 86 HN GLU 86 -3.518 2.573 -6.974 692 HA GLU 86 HA GLU 86 -2.550 3.488 -9.629 693 HB2 GLU 86 HB2 GLU 86 -3.728 1.440 -9.945 694 HB3 GLU 86 HB1 GLU 86 -4.999 1.914 -8.826 695 HG2 GLU 86 HG2 GLU 86 -5.933 3.456 -10.339 696 HG3 GLU 86 HG1 GLU 86 -4.464 3.541 -11.307 697 H VAL 87 HN VAL 87 -2.993 5.463 -10.168 698 HA VAL 87 HA VAL 87 -4.375 7.256 -8.451 699 HB VAL 87 HB VAL 87 -2.603 8.023 -9.938 700 HG11 VAL 87 HG11 VAL 87 -2.657 7.861 -12.259 701 HG12 VAL 87 HG12 VAL 87 -3.485 6.370 -11.815 702 HG13 VAL 87 HG13 VAL 87 -4.417 7.779 -12.323 703 HG21 VAL 87 HG21 VAL 87 -4.596 9.491 -9.241 704 HG22 VAL 87 HG22 VAL 87 -3.633 10.058 -10.606 705 HG23 VAL 87 HG23 VAL 87 -5.187 9.271 -10.887 706 H LEU 88 HN LEU 88 -6.498 6.959 -8.067 707 HA LEU 88 HA LEU 88 -8.314 6.078 -10.132 708 HB2 LEU 88 HB2 LEU 88 -8.395 5.733 -7.501 709 HB3 LEU 88 HB1 LEU 88 -9.258 7.265 -7.541 710 HG LEU 88 HG LEU 88 -10.895 5.496 -7.655 711 HD11 LEU 88 HD11 LEU 88 -12.077 6.141 -9.607 712 HD12 LEU 88 HD12 LEU 88 -11.083 7.536 -9.195 713 HD13 LEU 88 HD13 LEU 88 -10.592 6.457 -10.501 714 HD21 LEU 88 HD21 LEU 88 -9.013 3.920 -8.767 715 HD22 LEU 88 HD22 LEU 88 -10.734 3.590 -8.942 716 HD23 LEU 88 HD23 LEU 88 -9.857 4.398 -10.240 717 H ASP 89 HN ASP 89 -7.996 9.091 -8.185 718 HA ASP 89 HA ASP 89 -8.828 10.655 -10.494 719 HB2 ASP 89 HB2 ASP 89 -10.851 10.054 -8.951 720 HB3 ASP 89 HB1 ASP 89 -10.089 11.143 -7.799 721 H THR 90 HN THR 90 -7.677 12.539 -10.537 722 HA THR 90 HA THR 90 -6.419 13.544 -8.103 723 HB THR 90 HB THR 90 -5.067 11.709 -9.626 724 HG1 THR 90 HG1 THR 90 -3.508 12.101 -8.262 725 HG21 THR 90 HG21 THR 90 -4.044 14.432 -10.454 726 HG22 THR 90 HG22 THR 90 -3.336 12.875 -10.873 727 HG23 THR 90 HG23 THR 90 -4.918 13.317 -11.507 728 H ASP 91 HN ASP 91 -6.404 15.698 -8.114 729 HA ASP 91 HA ASP 91 -6.504 17.120 -10.729 730 HB2 ASP 91 HB2 ASP 91 -8.815 16.905 -9.776 731 HB3 ASP 91 HB1 ASP 91 -8.266 17.811 -8.368 732 H TYR 92 HN TYR 92 -5.449 16.837 -7.537 733 HA TYR 92 HA TYR 92 -4.068 18.036 -6.186 734 HB2 TYR 92 HB2 TYR 92 -3.017 19.269 -8.725 735 HB3 TYR 92 HB1 TYR 92 -2.150 18.974 -7.224 736 HD1 TYR 92 HD2 TYR 92 -2.946 16.187 -6.559 737 HD2 TYR 92 HD1 TYR 92 -1.955 17.958 -10.351 738 HE1 TYR 92 HE2 TYR 92 -2.245 13.977 -7.408 739 HE2 TYR 92 HE1 TYR 92 -1.260 15.735 -11.199 740 HH TYR 92 HH TYR 92 -0.368 13.411 -9.731 741 H LYS 93 HN LYS 93 -6.490 19.472 -7.821 742 HA LYS 93 HA LYS 93 -5.847 22.243 -7.388 743 HB2 LYS 93 HB2 LYS 93 -7.441 21.340 -9.155 744 HB3 LYS 93 HB1 LYS 93 -8.596 21.073 -7.847 745 HG2 LYS 93 HG2 LYS 93 -8.263 23.518 -7.219 746 HG3 LYS 93 HG1 LYS 93 -7.398 23.704 -8.743 747 HD2 LYS 93 HD2 LYS 93 -10.228 22.641 -8.501 748 HD3 LYS 93 HD1 LYS 93 -9.823 24.307 -8.915 749 HE2 LYS 93 HE2 LYS 93 -8.389 23.285 -10.812 750 HE3 LYS 93 HE1 LYS 93 -9.290 21.800 -10.509 751 HZ1 LYS 93 HZ1 LYS 93 -11.315 23.411 -10.646 752 HZ2 LYS 93 HZ2 LYS 93 -10.240 24.373 -11.545 753 HZ3 LYS 93 HZ3 LYS 93 -10.605 22.800 -12.064 754 H SER 94 HN SER 94 -7.587 19.721 -5.709 755 HA SER 94 HA SER 94 -7.501 21.259 -3.251 756 HB2 SER 94 HB2 SER 94 -10.013 20.781 -2.906 757 HB3 SER 94 HB1 SER 94 -9.574 22.121 -3.960 758 HG SER 94 HG SER 94 -11.179 20.418 -4.690 759 H TYR 95 HN TYR 95 -7.969 18.305 -5.040 760 HA TYR 95 HA TYR 95 -7.135 16.748 -2.783 761 HB2 TYR 95 HB2 TYR 95 -9.202 15.411 -2.599 762 HB3 TYR 95 HB1 TYR 95 -9.454 17.098 -2.152 763 HD1 TYR 95 HD1 TYR 95 -10.015 14.553 -4.771 764 HD2 TYR 95 HD2 TYR 95 -10.783 18.592 -3.526 765 HE1 TYR 95 HE1 TYR 95 -11.737 14.773 -6.542 766 HE2 TYR 95 HE2 TYR 95 -12.508 18.809 -5.292 767 HH TYR 95 HH TYR 95 -13.475 16.044 -7.265 768 H ALA 96 HN ALA 96 -7.175 14.418 -3.210 769 HA ALA 96 HA ALA 96 -7.348 13.613 -6.013 770 HB1 ALA 96 HB1 ALA 96 -4.915 14.388 -5.199 771 HB2 ALA 96 HB2 ALA 96 -5.133 13.000 -6.263 772 HB3 ALA 96 HB3 ALA 96 -4.891 12.754 -4.539 773 H VAL 97 HN VAL 97 -8.074 11.544 -6.201 774 HA VAL 97 HA VAL 97 -8.338 9.976 -3.674 775 HB VAL 97 HB VAL 97 -10.149 9.674 -6.071 776 HG11 VAL 97 HG11 VAL 97 -10.375 8.998 -3.126 777 HG12 VAL 97 HG12 VAL 97 -11.674 8.787 -4.299 778 HG13 VAL 97 HG13 VAL 97 -10.184 7.857 -4.456 779 HG21 VAL 97 HG21 VAL 97 -10.444 11.973 -5.468 780 HG22 VAL 97 HG22 VAL 97 -11.763 11.098 -4.690 781 HG23 VAL 97 HG23 VAL 97 -10.361 11.601 -3.747 782 H ILE 98 HN ILE 98 -7.186 8.061 -3.669 783 HA ILE 98 HA ILE 98 -6.447 6.958 -6.299 784 HB ILE 98 HB ILE 98 -4.635 8.201 -5.225 785 HG12 ILE 98 HG12 ILE 98 -4.205 5.218 -4.924 786 HG13 ILE 98 HG11 ILE 98 -4.130 6.088 -6.455 787 HG21 ILE 98 HG21 ILE 98 -4.986 6.253 -2.935 788 HG22 ILE 98 HG22 ILE 98 -3.801 7.552 -3.039 789 HG23 ILE 98 HG23 ILE 98 -5.517 7.935 -2.898 790 HD11 ILE 98 HD11 ILE 98 -2.510 7.468 -4.500 791 HD12 ILE 98 HD12 ILE 98 -2.049 5.781 -4.569 792 HD13 ILE 98 HD13 ILE 98 -2.036 6.743 -6.040 793 H TYR 99 HN TYR 99 -6.399 4.768 -6.469 794 HA TYR 99 HA TYR 99 -7.702 3.240 -4.315 795 HB2 TYR 99 HB2 TYR 99 -8.626 3.018 -6.583 796 HB3 TYR 99 HB1 TYR 99 -7.056 2.476 -7.177 797 HD1 TYR 99 HD1 TYR 99 -9.712 1.659 -4.672 798 HD2 TYR 99 HD2 TYR 99 -6.463 0.196 -7.072 799 HE1 TYR 99 HE1 TYR 99 -10.265 -0.663 -4.004 800 HE2 TYR 99 HE2 TYR 99 -7.016 -2.127 -6.402 801 HH TYR 99 HH TYR 99 -9.650 -3.169 -5.395 802 H ALA 100 HN ALA 100 -6.274 2.590 -2.842 803 HA ALA 100 HA ALA 100 -3.671 1.493 -3.724 804 HB1 ALA 100 HB1 ALA 100 -3.139 1.760 -1.217 805 HB2 ALA 100 HB2 ALA 100 -4.606 2.738 -1.148 806 HB3 ALA 100 HB3 ALA 100 -3.269 3.228 -2.187 807 H THR 101 HN THR 101 -3.118 -0.549 -3.330 808 HA THR 101 HA THR 101 -4.683 -2.192 -1.475 809 HB THR 101 HB THR 101 -5.935 -2.938 -3.241 810 HG1 THR 101 HG1 THR 101 -3.646 -4.317 -4.088 811 HG21 THR 101 HG21 THR 101 -5.258 -1.385 -4.885 812 HG22 THR 101 HG22 THR 101 -3.620 -2.030 -4.938 813 HG23 THR 101 HG23 THR 101 -4.955 -2.963 -5.610 814 H ARG 102 HN ARG 102 -3.518 -3.716 -0.499 815 HA ARG 102 HA ARG 102 -0.748 -4.212 -1.426 816 HB2 ARG 102 HB2 ARG 102 -0.921 -2.774 0.648 817 HB3 ARG 102 HB1 ARG 102 -1.666 -4.156 1.453 818 HG2 ARG 102 HG2 ARG 102 0.360 -5.518 0.809 819 HG3 ARG 102 HG1 ARG 102 1.110 -4.024 0.247 820 HD2 ARG 102 HD2 ARG 102 0.606 -3.086 2.585 821 HD3 ARG 102 HD1 ARG 102 0.279 -4.751 3.059 822 HE ARG 102 HE ARG 102 2.716 -4.970 1.922 823 HH11 ARG 102 HH21 ARG 102 1.375 -2.748 4.212 824 HH12 ARG 102 HH22 ARG 102 2.877 -2.464 5.024 825 HH21 ARG 102 HH11 ARG 102 4.690 -4.601 2.982 826 HH22 ARG 102 HH12 ARG 102 4.755 -3.513 4.328 827 H VAL 103 HN VAL 103 -0.231 -6.410 -1.703 828 HA VAL 103 HA VAL 103 -2.181 -8.316 -0.547 829 HB VAL 103 HB VAL 103 -2.409 -8.146 -2.977 830 HG11 VAL 103 HG11 VAL 103 -0.619 -8.423 -4.480 831 HG12 VAL 103 HG12 VAL 103 0.077 -7.417 -3.212 832 HG13 VAL 103 HG13 VAL 103 0.424 -9.146 -3.257 833 HG21 VAL 103 HG21 VAL 103 -2.129 -10.502 -3.503 834 HG22 VAL 103 HG22 VAL 103 -0.943 -10.692 -2.213 835 HG23 VAL 103 HG23 VAL 103 -2.629 -10.365 -1.819 836 H LYS 104 HN LYS 104 -1.347 -9.599 0.932 837 HA LYS 104 HA LYS 104 1.555 -10.088 0.971 838 HB2 LYS 104 HB2 LYS 104 -0.574 -10.455 3.097 839 HB3 LYS 104 HB1 LYS 104 1.133 -10.847 3.301 840 HG2 LYS 104 HG2 LYS 104 1.622 -8.425 2.637 841 HG3 LYS 104 HG1 LYS 104 -0.104 -8.127 2.845 842 HD2 LYS 104 HD2 LYS 104 1.713 -9.291 4.975 843 HD3 LYS 104 HD1 LYS 104 1.202 -7.605 4.902 844 HE2 LYS 104 HE2 LYS 104 -1.210 -8.533 4.871 845 HE3 LYS 104 HE1 LYS 104 -0.490 -10.054 5.401 846 HZ1 LYS 104 HZ1 LYS 104 -0.785 -7.539 6.829 847 HZ2 LYS 104 HZ2 LYS 104 -0.806 -9.133 7.416 848 HZ3 LYS 104 HZ3 LYS 104 0.673 -8.372 7.080 849 H ASP 105 HN ASP 105 2.104 -12.356 1.802 850 HA ASP 105 HA ASP 105 1.225 -14.244 -0.062 851 HB2 ASP 105 HB2 ASP 105 3.346 -14.407 1.212 852 HB3 ASP 105 HB1 ASP 105 2.421 -14.784 2.665 853 H GLY 106 HN GLY 106 -0.772 -14.958 -0.261 854 HA2 GLY 106 HA2 GLY 106 -2.598 -16.293 0.273 855 HA3 GLY 106 HA1 GLY 106 -2.054 -16.332 1.942 856 H ARG 107 HN ARG 107 -2.030 -13.126 1.293 857 HA ARG 107 HA ARG 107 -4.921 -12.774 1.852 858 HB2 ARG 107 HB2 ARG 107 -2.603 -11.568 3.363 859 HB3 ARG 107 HB1 ARG 107 -4.267 -11.000 3.504 860 HG2 ARG 107 HG2 ARG 107 -4.968 -13.283 4.181 861 HG3 ARG 107 HG1 ARG 107 -3.287 -13.810 4.093 862 HD2 ARG 107 HD2 ARG 107 -4.333 -11.605 5.891 863 HD3 ARG 107 HD1 ARG 107 -3.948 -13.242 6.413 864 HE ARG 107 HE ARG 107 -2.067 -11.124 5.882 865 HH11 ARG 107 HH21 ARG 107 -2.612 -14.541 5.919 866 HH12 ARG 107 HH22 ARG 107 -0.945 -14.944 6.153 867 HH21 ARG 107 HH11 ARG 107 0.123 -11.646 6.188 868 HH22 ARG 107 HH12 ARG 107 0.604 -13.306 6.305 869 H THR 108 HN THR 108 -5.896 -11.052 0.975 870 HA THR 108 HA THR 108 -4.268 -9.175 -0.646 871 HB THR 108 HB THR 108 -7.093 -10.105 -1.211 872 HG1 THR 108 HG1 THR 108 -6.242 -11.562 -2.505 873 HG21 THR 108 HG21 THR 108 -6.621 -9.039 -3.423 874 HG22 THR 108 HG22 THR 108 -6.624 -7.888 -2.087 875 HG23 THR 108 HG23 THR 108 -5.095 -8.445 -2.769 876 H LEU 109 HN LEU 109 -5.076 -6.972 -0.753 877 HA LEU 109 HA LEU 109 -7.206 -6.267 1.131 878 HB2 LEU 109 HB2 LEU 109 -5.206 -6.304 2.507 879 HB3 LEU 109 HB1 LEU 109 -4.377 -5.244 1.392 880 HG LEU 109 HG LEU 109 -6.110 -3.493 1.852 881 HD11 LEU 109 HD11 LEU 109 -8.019 -4.689 2.587 882 HD12 LEU 109 HD12 LEU 109 -7.083 -5.646 3.734 883 HD13 LEU 109 HD13 LEU 109 -7.402 -3.942 4.056 884 HD21 LEU 109 HD21 LEU 109 -5.148 -2.818 3.912 885 HD22 LEU 109 HD22 LEU 109 -4.846 -4.483 4.404 886 HD23 LEU 109 HD23 LEU 109 -3.898 -3.761 3.104 887 H HIS 110 HN HIS 110 -8.039 -4.257 0.896 888 HA HIS 110 HA HIS 110 -6.985 -2.551 -1.225 889 HB2 HIS 110 HB2 HIS 110 -9.321 -2.184 -2.082 890 HB3 HIS 110 HB1 HIS 110 -8.709 -3.812 -2.369 891 HD1 HIS 110 HD1 HIS 110 -9.729 -5.747 -0.962 892 HD2 HIS 110 HD2 HIS 110 -11.431 -2.023 -0.178 893 HE1 HIS 110 HE1 HIS 110 -11.824 -6.188 0.390 894 H MET 111 HN MET 111 -7.369 -0.319 -0.887 895 HA MET 111 HA MET 111 -9.102 0.519 1.270 896 HB2 MET 111 HB2 MET 111 -7.246 1.683 2.485 897 HB3 MET 111 HB1 MET 111 -7.174 -0.075 2.592 898 HG2 MET 111 HG2 MET 111 -5.521 -0.123 0.766 899 HG3 MET 111 HG1 MET 111 -5.592 1.634 0.654 900 HE1 MET 111 HE1 MET 111 -5.547 2.861 3.539 901 HE2 MET 111 HE2 MET 111 -3.797 3.039 3.554 902 HE3 MET 111 HE3 MET 111 -4.695 3.234 2.044 903 H MET 112 HN MET 112 -9.476 2.775 1.259 904 HA MET 112 HA MET 112 -8.634 4.114 -1.242 905 HB2 MET 112 HB2 MET 112 -11.143 3.669 -0.418 906 HB3 MET 112 HB1 MET 112 -10.854 5.160 0.470 907 HG2 MET 112 HG2 MET 112 -11.724 5.935 -1.555 908 HG3 MET 112 HG1 MET 112 -9.983 6.071 -1.807 909 HE1 MET 112 HE1 MET 112 -12.432 4.659 -4.878 910 HE2 MET 112 HE2 MET 112 -13.254 4.668 -3.321 911 HE3 MET 112 HE3 MET 112 -12.291 6.063 -3.825 912 H ARG 113 HN ARG 113 -7.684 6.146 -1.181 913 HA ARG 113 HA ARG 113 -7.173 7.328 1.488 914 HB2 ARG 113 HB2 ARG 113 -5.202 6.941 -0.761 915 HB3 ARG 113 HB1 ARG 113 -4.913 7.978 0.633 916 HG2 ARG 113 HG2 ARG 113 -5.224 6.051 2.140 917 HG3 ARG 113 HG1 ARG 113 -5.509 5.008 0.746 918 HD2 ARG 113 HD2 ARG 113 -3.286 5.167 0.011 919 HD3 ARG 113 HD1 ARG 113 -2.988 6.646 0.920 920 HE ARG 113 HE ARG 113 -2.790 3.936 1.920 921 HH11 ARG 113 HH21 ARG 113 -3.281 7.279 2.658 922 HH12 ARG 113 HH22 ARG 113 -2.717 7.146 4.291 923 HH21 ARG 113 HH11 ARG 113 -2.047 3.752 4.061 924 HH22 ARG 113 HH12 ARG 113 -2.019 5.149 5.084 925 H LEU 114 HN LEU 114 -7.577 9.462 1.653 926 HA LEU 114 HA LEU 114 -8.186 10.965 -0.818 927 HB2 LEU 114 HB2 LEU 114 -10.065 10.676 0.794 928 HB3 LEU 114 HB1 LEU 114 -9.095 11.478 2.015 929 HG LEU 114 HG LEU 114 -8.930 13.471 0.459 930 HD11 LEU 114 HD11 LEU 114 -10.970 13.464 -1.202 931 HD12 LEU 114 HD12 LEU 114 -9.451 12.712 -1.685 932 HD13 LEU 114 HD13 LEU 114 -10.791 11.713 -1.122 933 HD21 LEU 114 HD21 LEU 114 -11.543 12.508 1.619 934 HD22 LEU 114 HD22 LEU 114 -10.432 13.719 2.258 935 HD23 LEU 114 HD23 LEU 114 -11.421 14.088 0.846 936 H TYR 115 HN TYR 115 -6.878 12.535 -1.348 937 HA TYR 115 HA TYR 115 -4.942 13.561 0.612 938 HB2 TYR 115 HB2 TYR 115 -4.975 13.525 -2.404 939 HB3 TYR 115 HB1 TYR 115 -3.798 14.451 -1.479 940 HD1 TYR 115 HD1 TYR 115 -5.267 10.987 -1.512 941 HD2 TYR 115 HD2 TYR 115 -1.757 13.422 -1.041 942 HE1 TYR 115 HE1 TYR 115 -3.891 8.952 -1.212 943 HE2 TYR 115 HE2 TYR 115 -0.386 11.379 -0.744 944 HH TYR 115 HH TYR 115 -1.791 8.297 -0.225 945 H SER 116 HN SER 116 -4.393 15.807 0.563 946 HA SER 116 HA SER 116 -6.468 17.637 -0.468 947 HB2 SER 116 HB2 SER 116 -6.918 17.284 1.938 948 HB3 SER 116 HB1 SER 116 -5.251 17.718 2.313 949 HG SER 116 HG SER 116 -7.401 19.299 1.530 950 H ARG 117 HN ARG 117 -5.590 19.464 -1.422 951 HA ARG 117 HA ARG 117 -2.778 19.523 -1.864 952 HB2 ARG 117 HB2 ARG 117 -4.663 20.382 -3.389 953 HB3 ARG 117 HB1 ARG 117 -4.681 21.810 -2.360 954 HG2 ARG 117 HG2 ARG 117 -3.215 22.276 -4.222 955 HG3 ARG 117 HG1 ARG 117 -2.214 22.070 -2.788 956 HD2 ARG 117 HD2 ARG 117 -2.737 19.597 -4.362 957 HD3 ARG 117 HD1 ARG 117 -1.713 20.802 -5.134 958 HE ARG 117 HE ARG 117 -1.036 19.187 -2.838 959 HH11 ARG 117 HH21 ARG 117 -0.502 22.145 -4.553 960 HH12 ARG 117 HH22 ARG 117 1.099 22.377 -3.933 961 HH21 ARG 117 HH11 ARG 117 1.063 19.484 -2.022 962 HH22 ARG 117 HH12 ARG 117 1.984 20.870 -2.499 963 H SER 118 HN SER 118 -4.806 20.749 0.602 964 HA SER 118 HA SER 118 -2.531 22.214 1.760 965 HB2 SER 118 HB2 SER 118 -3.877 23.940 0.735 966 HB3 SER 118 HB1 SER 118 -5.347 23.274 1.441 967 HG SER 118 HG SER 118 -3.160 24.533 2.724 968 HA PRO 119 HA PRO 119 -3.258 19.983 5.513 969 HB2 PRO 119 HB2 PRO 119 -3.507 22.729 6.708 970 HB3 PRO 119 HB1 PRO 119 -2.588 21.328 7.295 971 HG2 PRO 119 HG2 PRO 119 -1.424 23.368 5.978 972 HG3 PRO 119 HG1 PRO 119 -0.843 21.699 5.861 973 HD2 PRO 119 HD2 PRO 119 -2.170 23.338 3.804 974 HD3 PRO 119 HD1 PRO 119 -1.263 21.822 3.619 975 H GLU 120 HN GLU 120 -5.416 22.499 4.418 976 HA GLU 120 HA GLU 120 -7.529 21.875 6.274 977 HB2 GLU 120 HB2 GLU 120 -7.649 23.497 3.723 978 HB3 GLU 120 HB1 GLU 120 -8.820 23.508 5.041 979 HG2 GLU 120 HG2 GLU 120 -7.527 25.404 5.516 980 HG3 GLU 120 HG1 GLU 120 -6.776 24.176 6.531 981 H VAL 121 HN VAL 121 -9.649 21.240 5.501 982 HA VAL 121 HA VAL 121 -9.510 19.240 3.316 983 HB VAL 121 HB VAL 121 -11.274 19.154 5.774 984 HG11 VAL 121 HG11 VAL 121 -10.681 17.176 3.551 985 HG12 VAL 121 HG12 VAL 121 -11.587 16.785 5.013 986 HG13 VAL 121 HG13 VAL 121 -12.224 17.969 3.872 987 HG21 VAL 121 HG21 VAL 121 -9.712 17.205 6.349 988 HG22 VAL 121 HG22 VAL 121 -8.619 17.852 5.125 989 HG23 VAL 121 HG23 VAL 121 -9.033 18.821 6.538 990 H SER 122 HN SER 122 -10.647 19.846 1.600 991 HA SER 122 HA SER 122 -12.606 21.920 1.712 992 HB2 SER 122 HB2 SER 122 -12.371 20.134 -0.671 993 HB3 SER 122 HB1 SER 122 -12.512 21.885 -0.589 994 HG SER 122 HG SER 122 -10.402 21.154 -1.179 995 HA PRO 123 HA PRO 123 -16.151 19.423 2.634 996 HB2 PRO 123 HB2 PRO 123 -18.110 20.852 1.283 997 HB3 PRO 123 HB1 PRO 123 -17.457 21.298 2.870 998 HG2 PRO 123 HG2 PRO 123 -16.778 22.372 0.176 999 HG3 PRO 123 HG1 PRO 123 -16.934 23.221 1.724 1000 HD2 PRO 123 HD2 PRO 123 -14.514 22.604 0.654 1001 HD3 PRO 123 HD1 PRO 123 -14.786 22.648 2.412 1002 H ALA 124 HN ALA 124 -15.543 20.352 -0.714 1003 HA ALA 124 HA ALA 124 -17.217 18.295 -1.848 1004 HB1 ALA 124 HB1 ALA 124 -16.168 18.957 -3.982 1005 HB2 ALA 124 HB2 ALA 124 -15.033 19.979 -3.102 1006 HB3 ALA 124 HB3 ALA 124 -16.755 20.360 -3.092 1007 H ALA 125 HN ALA 125 -13.861 18.677 -0.949 1008 HA ALA 125 HA ALA 125 -12.766 16.440 -2.280 1009 HB1 ALA 125 HB1 ALA 125 -11.963 17.826 0.286 1010 HB2 ALA 125 HB2 ALA 125 -11.330 18.140 -1.327 1011 HB3 ALA 125 HB3 ALA 125 -10.985 16.605 -0.527 1012 H THR 126 HN THR 126 -14.219 16.848 0.890 1013 HA THR 126 HA THR 126 -13.775 14.127 1.717 1014 HB THR 126 HB THR 126 -15.917 15.760 3.007 1015 HG1 THR 126 HG1 THR 126 -13.296 16.371 3.672 1016 HG21 THR 126 HG21 THR 126 -13.528 14.436 4.284 1017 HG22 THR 126 HG22 THR 126 -15.118 14.745 4.982 1018 HG23 THR 126 HG23 THR 126 -14.918 13.479 3.770 1019 H ALA 127 HN ALA 127 -16.322 15.896 0.079 1020 HA ALA 127 HA ALA 127 -18.346 13.914 0.387 1021 HB1 ALA 127 HB1 ALA 127 -19.590 15.272 -1.149 1022 HB2 ALA 127 HB2 ALA 127 -18.122 16.108 -1.658 1023 HB3 ALA 127 HB3 ALA 127 -18.739 16.326 -0.019 1024 H ILE 128 HN ILE 128 -16.236 14.804 -2.399 1025 HA ILE 128 HA ILE 128 -17.315 12.899 -4.174 1026 HB ILE 128 HB ILE 128 -15.530 14.864 -4.476 1027 HG12 ILE 128 HG12 ILE 128 -16.592 13.724 -6.324 1028 HG13 ILE 128 HG11 ILE 128 -14.861 13.813 -6.619 1029 HG21 ILE 128 HG21 ILE 128 -13.793 13.654 -3.106 1030 HG22 ILE 128 HG22 ILE 128 -13.723 12.432 -4.376 1031 HG23 ILE 128 HG23 ILE 128 -13.260 14.094 -4.725 1032 HD11 ILE 128 HD11 ILE 128 -16.494 11.422 -5.777 1033 HD12 ILE 128 HD12 ILE 128 -15.416 11.576 -7.162 1034 HD13 ILE 128 HD13 ILE 128 -14.749 11.462 -5.535 1035 H PHE 129 HN PHE 129 -14.927 12.881 -1.737 1036 HA PHE 129 HA PHE 129 -13.879 10.288 -2.011 1037 HB2 PHE 129 HB2 PHE 129 -13.002 12.188 -0.573 1038 HB3 PHE 129 HB1 PHE 129 -14.257 11.774 0.586 1039 HD1 PHE 129 HD1 PHE 129 -11.966 9.642 -1.543 1040 HD2 PHE 129 HD2 PHE 129 -13.287 10.691 2.413 1041 HE1 PHE 129 HE1 PHE 129 -10.549 7.864 -0.593 1042 HE2 PHE 129 HE2 PHE 129 -11.844 8.911 3.350 1043 HZ PHE 129 HZ PHE 129 -10.484 7.492 1.850 1044 H ARG 130 HN ARG 130 -16.598 11.536 -0.119 1045 HA ARG 130 HA ARG 130 -17.312 9.055 1.067 1046 HB2 ARG 130 HB2 ARG 130 -18.035 11.591 1.552 1047 HB3 ARG 130 HB1 ARG 130 -19.404 11.131 0.548 1048 HG2 ARG 130 HG2 ARG 130 -18.465 9.731 3.071 1049 HG3 ARG 130 HG1 ARG 130 -19.932 10.691 2.891 1050 HD2 ARG 130 HD2 ARG 130 -19.299 7.994 1.707 1051 HD3 ARG 130 HD1 ARG 130 -20.682 8.465 2.687 1052 HE ARG 130 HE ARG 130 -20.466 9.808 0.110 1053 HH11 ARG 130 HH21 ARG 130 -21.735 7.183 1.972 1054 HH12 ARG 130 HH22 ARG 130 -23.049 6.869 0.888 1055 HH21 ARG 130 HH11 ARG 130 -22.185 9.401 -1.316 1056 HH22 ARG 130 HH12 ARG 130 -23.304 8.125 -0.973 1057 H LYS 131 HN LYS 131 -18.376 10.759 -1.857 1058 HA LYS 131 HA LYS 131 -20.479 9.112 -2.640 1059 HB2 LYS 131 HB2 LYS 131 -18.439 10.631 -4.271 1060 HB3 LYS 131 HB1 LYS 131 -19.801 9.781 -5.000 1061 HG2 LYS 131 HG2 LYS 131 -21.355 11.100 -3.575 1062 HG3 LYS 131 HG1 LYS 131 -19.976 11.990 -2.931 1063 HD2 LYS 131 HD2 LYS 131 -19.400 12.687 -5.268 1064 HD3 LYS 131 HD1 LYS 131 -20.885 11.912 -5.822 1065 HE2 LYS 131 HE2 LYS 131 -21.461 14.201 -5.522 1066 HE3 LYS 131 HE1 LYS 131 -22.103 13.378 -4.100 1067 HZ1 LYS 131 HZ1 LYS 131 -20.973 15.278 -3.328 1068 HZ2 LYS 131 HZ2 LYS 131 -19.952 13.965 -2.984 1069 HZ3 LYS 131 HZ3 LYS 131 -19.616 14.975 -4.304 1070 H LEU 132 HN LEU 132 -17.048 8.853 -3.581 1071 HA LEU 132 HA LEU 132 -17.276 6.416 -4.978 1072 HB2 LEU 132 HB2 LEU 132 -15.084 8.053 -3.817 1073 HB3 LEU 132 HB1 LEU 132 -14.708 6.350 -4.033 1074 HG LEU 132 HG LEU 132 -14.168 7.962 -5.975 1075 HD11 LEU 132 HD11 LEU 132 -15.674 5.366 -6.224 1076 HD12 LEU 132 HD12 LEU 132 -15.092 6.214 -7.657 1077 HD13 LEU 132 HD13 LEU 132 -13.951 5.674 -6.426 1078 HD21 LEU 132 HD21 LEU 132 -16.703 8.840 -5.731 1079 HD22 LEU 132 HD22 LEU 132 -15.846 8.859 -7.269 1080 HD23 LEU 132 HD23 LEU 132 -16.981 7.560 -6.911 1081 H ALA 133 HN ALA 133 -16.514 7.136 -1.596 1082 HA ALA 133 HA ALA 133 -15.981 4.520 -0.748 1083 HB1 ALA 133 HB1 ALA 133 -15.711 6.806 0.484 1084 HB2 ALA 133 HB2 ALA 133 -16.061 5.359 1.424 1085 HB3 ALA 133 HB3 ALA 133 -17.352 6.499 1.047 1086 H GLY 134 HN GLY 134 -19.077 6.294 -0.976 1087 HA2 GLY 134 HA2 GLY 134 -20.653 4.315 0.297 1088 HA3 GLY 134 HA1 GLY 134 -21.243 5.569 -0.789 1089 H GLU 135 HN GLU 135 -19.676 4.843 -3.061 1090 HA GLU 135 HA GLU 135 -21.360 2.971 -4.294 1091 HB2 GLU 135 HB2 GLU 135 -18.592 3.957 -4.995 1092 HB3 GLU 135 HB1 GLU 135 -19.498 2.850 -6.026 1093 HG2 GLU 135 HG2 GLU 135 -21.351 4.475 -6.147 1094 HG3 GLU 135 HG1 GLU 135 -20.441 5.586 -5.125 1095 H ARG 136 HN ARG 136 -18.435 2.590 -2.422 1096 HA ARG 136 HA ARG 136 -18.301 -0.274 -3.078 1097 HB2 ARG 136 HB2 ARG 136 -16.266 1.376 -2.978 1098 HB3 ARG 136 HB1 ARG 136 -16.385 1.129 -1.240 1099 HG2 ARG 136 HG2 ARG 136 -14.843 -0.524 -2.033 1100 HG3 ARG 136 HG1 ARG 136 -16.347 -1.378 -1.708 1101 HD2 ARG 136 HD2 ARG 136 -16.790 -1.729 -3.961 1102 HD3 ARG 136 HD1 ARG 136 -15.909 -0.293 -4.472 1103 HE ARG 136 HE ARG 136 -13.983 -1.583 -4.581 1104 HH11 ARG 136 HH21 ARG 136 -16.458 -3.185 -2.769 1105 HH12 ARG 136 HH22 ARG 136 -15.592 -4.680 -2.644 1106 HH21 ARG 136 HH11 ARG 136 -12.842 -3.539 -4.422 1107 HH22 ARG 136 HH12 ARG 136 -13.544 -4.881 -3.579 1108 H ASN 137 HN ASN 137 -20.378 1.070 -1.348 1109 HA ASN 137 HA ASN 137 -21.551 0.623 0.587 1110 HB2 ASN 137 HB2 ASN 137 -19.955 -1.912 0.458 1111 HB3 ASN 137 HB1 ASN 137 -21.457 -1.686 1.348 1112 HD21 ASN 137 HD21 ASN 137 -21.829 0.146 -1.391 1113 HD22 ASN 137 HD22 ASN 137 -22.575 -0.997 -2.399 1114 H TYR 138 HN TYR 138 -19.021 2.012 0.931 1115 HA TYR 138 HA TYR 138 -17.838 0.958 3.384 1116 HB2 TYR 138 HB2 TYR 138 -17.341 3.491 1.817 1117 HB3 TYR 138 HB1 TYR 138 -16.510 3.098 3.307 1118 HD1 TYR 138 HD1 TYR 138 -17.082 0.005 1.655 1119 HD2 TYR 138 HD2 TYR 138 -14.626 3.533 1.461 1120 HE1 TYR 138 HE1 TYR 138 -15.365 -1.256 0.413 1121 HE2 TYR 138 HE2 TYR 138 -12.911 2.258 0.211 1122 HH TYR 138 HH TYR 138 -12.319 -0.420 0.116 1123 H THR 139 HN THR 139 -18.844 1.212 5.251 1124 HA THR 139 HA THR 139 -20.783 3.316 5.686 1125 HB THR 139 HB THR 139 -21.421 2.117 7.533 1126 HG1 THR 139 HG1 THR 139 -20.007 2.114 9.054 1127 HG21 THR 139 HG21 THR 139 -19.587 -0.078 6.602 1128 HG22 THR 139 HG22 THR 139 -21.254 -0.186 7.157 1129 HG23 THR 139 HG23 THR 139 -20.898 0.468 5.559 1130 H ASP 140 HN ASP 140 -20.565 4.894 7.465 1131 HA ASP 140 HA ASP 140 -18.436 6.549 7.260 1132 HB2 ASP 140 HB2 ASP 140 -19.026 7.481 9.451 1133 HB3 ASP 140 HB1 ASP 140 -20.469 7.119 8.504 1134 H GLU 141 HN GLU 141 -18.675 4.086 9.901 1135 HA GLU 141 HA GLU 141 -16.205 4.583 11.040 1136 HB2 GLU 141 HB2 GLU 141 -17.653 1.940 10.772 1137 HB3 GLU 141 HB1 GLU 141 -16.323 2.259 11.886 1138 HG2 GLU 141 HG2 GLU 141 -17.666 4.100 12.902 1139 HG3 GLU 141 HG1 GLU 141 -19.010 3.663 11.848 1140 H MET 142 HN MET 142 -16.890 3.079 8.006 1141 HA MET 142 HA MET 142 -14.397 1.647 7.807 1142 HB2 MET 142 HB2 MET 142 -16.198 2.410 5.522 1143 HB3 MET 142 HB1 MET 142 -15.119 1.021 5.651 1144 HG2 MET 142 HG2 MET 142 -16.704 0.651 7.860 1145 HG3 MET 142 HG1 MET 142 -17.841 1.393 6.745 1146 HE1 MET 142 HE1 MET 142 -15.992 -2.131 7.558 1147 HE2 MET 142 HE2 MET 142 -15.151 -2.160 6.011 1148 HE3 MET 142 HE3 MET 142 -14.966 -0.778 7.097 1149 H VAL 143 HN VAL 143 -15.436 4.833 7.282 1150 HA VAL 143 HA VAL 143 -12.866 5.501 5.962 1151 HB VAL 143 HB VAL 143 -15.029 5.723 4.553 1152 HG11 VAL 143 HG11 VAL 143 -16.269 6.825 6.480 1153 HG12 VAL 143 HG12 VAL 143 -15.311 8.268 6.156 1154 HG13 VAL 143 HG13 VAL 143 -16.400 7.637 4.922 1155 HG21 VAL 143 HG21 VAL 143 -14.189 7.782 3.502 1156 HG22 VAL 143 HG22 VAL 143 -13.239 8.135 4.946 1157 HG23 VAL 143 HG23 VAL 143 -12.849 6.731 3.956 1158 H ALA 144 HN ALA 144 -11.604 6.694 7.244 1159 HA ALA 144 HA ALA 144 -12.876 8.292 9.401 1160 HB1 ALA 144 HB1 ALA 144 -11.097 7.685 10.843 1161 HB2 ALA 144 HB2 ALA 144 -10.106 7.099 9.507 1162 HB3 ALA 144 HB3 ALA 144 -11.531 6.192 10.010 1163 H MET 145 HN MET 145 -12.582 10.428 9.291 1164 HA MET 145 HA MET 145 -10.628 11.596 7.504 1165 HB2 MET 145 HB2 MET 145 -12.286 13.075 9.551 1166 HB3 MET 145 HB1 MET 145 -11.626 13.689 8.037 1167 HG2 MET 145 HG2 MET 145 -13.679 11.465 8.122 1168 HG3 MET 145 HG1 MET 145 -14.127 13.166 8.043 1169 HE1 MET 145 HE1 MET 145 -13.986 10.231 6.145 1170 HE2 MET 145 HE2 MET 145 -12.984 10.437 4.711 1171 HE3 MET 145 HE3 MET 145 -12.231 10.223 6.297 1172 H LEU 146 HN LEU 146 -8.727 12.683 8.112 1173 HA LEU 146 HA LEU 146 -7.915 12.247 10.886 1174 HB2 LEU 146 HB2 LEU 146 -6.834 11.264 8.577 1175 HB3 LEU 146 HB1 LEU 146 -5.859 12.712 8.806 1176 HG LEU 146 HG LEU 146 -5.287 11.993 11.030 1177 HD11 LEU 146 HD11 LEU 146 -5.961 9.350 11.321 1178 HD12 LEU 146 HD12 LEU 146 -6.806 10.683 12.098 1179 HD13 LEU 146 HD13 LEU 146 -7.417 10.017 10.584 1180 HD21 LEU 146 HD21 LEU 146 -4.897 9.672 9.171 1181 HD22 LEU 146 HD22 LEU 146 -4.008 11.185 9.025 1182 HD23 LEU 146 HD23 LEU 146 -3.830 10.192 10.470 1183 HA PRO 147 HA PRO 147 -7.652 16.705 11.272 1184 HB2 PRO 147 HB2 PRO 147 -6.364 16.848 13.652 1185 HB3 PRO 147 HB1 PRO 147 -8.041 16.270 13.528 1186 HG2 PRO 147 HG2 PRO 147 -5.512 14.667 13.663 1187 HG3 PRO 147 HG1 PRO 147 -6.999 14.482 14.613 1188 HD2 PRO 147 HD2 PRO 147 -6.512 12.942 12.479 1189 HD3 PRO 147 HD1 PRO 147 -8.158 13.483 12.855 1190 H ARG 148 HN ARG 148 -6.134 18.416 11.171 1191 HA ARG 148 HA ARG 148 -3.764 17.937 9.719 1192 HB2 ARG 148 HB2 ARG 148 -3.388 20.302 9.876 1193 HB3 ARG 148 HB1 ARG 148 -5.125 20.054 9.706 1194 HG2 ARG 148 HG2 ARG 148 -5.235 20.103 12.264 1195 HG3 ARG 148 HG1 ARG 148 -3.584 20.722 12.219 1196 HD2 ARG 148 HD2 ARG 148 -5.986 21.978 10.861 1197 HD3 ARG 148 HD1 ARG 148 -5.197 22.576 12.318 1198 HE ARG 148 HE ARG 148 -4.310 22.976 9.624 1199 HH11 ARG 148 HH21 ARG 148 -3.285 22.481 12.892 1200 HH12 ARG 148 HH22 ARG 148 -1.776 23.310 12.690 1201 HH21 ARG 148 HH11 ARG 148 -2.335 24.063 9.351 1202 HH22 ARG 148 HH12 ARG 148 -1.238 24.205 10.684 1203 H GLN 149 HN GLN 149 -4.335 17.648 13.046 1204 HA GLN 149 HA GLN 149 -2.217 18.576 14.430 1205 HB2 GLN 149 HB2 GLN 149 -3.431 15.817 14.524 1206 HB3 GLN 149 HB1 GLN 149 -2.219 16.354 15.687 1207 HG2 GLN 149 HG2 GLN 149 -4.769 17.887 15.132 1208 HG3 GLN 149 HG1 GLN 149 -4.630 16.687 16.414 1209 HE21 GLN 149 HE21 GLN 149 -4.336 19.981 15.825 1210 HE22 GLN 149 HE22 GLN 149 -3.324 20.388 17.126 1211 H GLU 150 HN GLU 150 -0.081 18.595 14.177 1212 HA GLU 150 HA GLU 150 1.223 16.319 12.795 1213 HB2 GLU 150 HB2 GLU 150 2.646 17.801 11.593 1214 HB3 GLU 150 HB1 GLU 150 1.007 18.409 11.376 1215 HG2 GLU 150 HG2 GLU 150 3.128 19.480 13.257 1216 HG3 GLU 150 HG1 GLU 150 2.409 20.301 11.876 1217 H GLU 151 HN GLU 151 3.005 15.516 13.721 1218 HA GLU 151 HA GLU 151 4.129 16.938 16.072 1219 HB2 GLU 151 HB2 GLU 151 3.866 13.948 15.648 1220 HB3 GLU 151 HB1 GLU 151 4.593 14.735 17.049 1221 HG2 GLU 151 HG2 GLU 151 1.721 15.122 16.157 1222 HG3 GLU 151 HG1 GLU 151 2.229 14.043 17.456 1223 H CYS 152 HN CYS 152 4.652 15.114 13.161 1224 HA CYS 152 HA CYS 152 7.522 15.800 13.248 1225 HB2 CYS 152 HB2 CYS 152 6.277 13.115 12.675 1226 HB3 CYS 152 HB1 CYS 152 7.870 13.546 12.055 1227 H THR 153 HN THR 153 8.496 15.973 11.140 1228 HA THR 153 HA THR 153 6.754 15.941 8.804 1229 HB THR 153 HB THR 153 7.288 18.320 8.246 1230 HG1 THR 153 HG1 THR 153 7.787 18.941 10.864 1231 HG21 THR 153 HG21 THR 153 5.150 17.518 9.413 1232 HG22 THR 153 HG22 THR 153 5.864 18.130 10.905 1233 HG23 THR 153 HG23 THR 153 5.532 19.232 9.570 1234 H VAL 154 HN VAL 154 7.972 16.385 6.798 1235 HA VAL 154 HA VAL 154 10.520 15.116 6.847 1236 HB VAL 154 HB VAL 154 10.370 15.160 4.501 1237 HG11 VAL 154 HG11 VAL 154 8.096 14.426 4.015 1238 HG12 VAL 154 HG12 VAL 154 8.587 13.821 5.597 1239 HG13 VAL 154 HG13 VAL 154 7.507 15.211 5.480 1240 HG21 VAL 154 HG21 VAL 154 10.094 17.457 3.987 1241 HG22 VAL 154 HG22 VAL 154 8.616 16.706 3.391 1242 HG23 VAL 154 HG23 VAL 154 8.607 17.572 4.927 1243 H ASP 155 HN ASP 155 12.411 16.065 5.854 1244 HA ASP 155 HA ASP 155 12.999 18.639 6.965 1245 HB2 ASP 155 HB2 ASP 155 14.767 17.026 6.906 1246 HB3 ASP 155 HB1 ASP 155 14.622 16.848 5.164 1247 H GLU 156 HN GLU 156 14.051 20.291 5.691 1248 HA GLU 156 HA GLU 156 13.046 20.623 2.949 1249 HB2 GLU 156 HB2 GLU 156 12.411 23.038 3.663 1250 HB3 GLU 156 HB1 GLU 156 11.303 21.725 4.055 1251 HG2 GLU 156 HG2 GLU 156 12.166 21.596 6.322 1252 HG3 GLU 156 HG1 GLU 156 13.411 22.787 5.953 1253 H VAL 157 HN VAL 157 15.265 20.346 2.406 1254 HA VAL 157 HA VAL 157 17.486 21.628 3.351 1255 HB VAL 157 HB VAL 157 16.906 21.363 0.398 1256 HG11 VAL 157 HG11 VAL 157 19.456 21.099 2.021 1257 HG12 VAL 157 HG12 VAL 157 19.323 20.999 0.265 1258 HG13 VAL 157 HG13 VAL 157 18.999 22.525 1.088 1259 HG21 VAL 157 HG21 VAL 157 16.289 19.252 1.369 1260 HG22 VAL 157 HG22 VAL 157 17.919 19.050 0.724 1261 HG23 VAL 157 HG23 VAL 157 17.679 19.278 2.456 1262 HN1 EB4 200 H17 EB4 200 0.141 -0.247 5.412 1263 H8 EB4 200 H8 EB4 200 4.616 1.635 0.579 1264 HN2 EB4 200 H25 EB4 200 3.242 0.660 5.965 1265 H9 EB4 200 H9 EB4 200 0.354 6.615 2.622 1266 H10 EB4 200 H10 EB4 200 -2.832 -0.478 0.294 1267 HN3 EB4 200 H32 EB4 200 0.614 2.631 6.836 1268 H7 EB4 200 H7 EB4 200 -1.329 1.482 0.090 1269 H11 EB4 200 H11 EB4 200 6.531 0.197 1.225 1270 H12 EB4 200 H12 EB4 200 -0.593 7.935 4.496 1271 H15 EB4 200 H15 EB4 200 -0.680 6.966 6.777 1272 H14 EB4 200 H14 EB4 200 6.761 -0.583 3.568 1273 H13 EB4 200 H13 EB4 200 -2.821 -1.838 2.370 1274 H22 EB4 200 H22 EB4 200 -1.065 -2.550 6.811 1275 H30 EB4 200 H30 EB4 200 -0.632 0.816 9.800 1276 H30A EB4 200 H9N EB4 200 -1.649 1.818 8.653 1277 H24 EB4 200 H24 EB4 200 0.084 3.192 9.699 1278 H28 EB4 200 H28 EB4 200 1.109 -2.902 7.883 1279 H28A EB4 200 H9L EB4 200 1.151 -3.133 6.128 1280 H23 EB4 200 H23 EB4 200 4.930 -0.700 8.014 1281 H29 EB4 200 H29 EB4 200 3.766 0.700 9.677 1282 H29A EB4 200 H9M EB4 200 4.640 1.723 8.434 1283 H21 ACD 300 HA3 ACD 300 1.076 9.795 -10.508 1284 H22 ACD 300 HA4 ACD 300 1.214 11.340 -9.638 1285 H31 ACD 300 HA1 ACD 300 -1.283 11.399 -9.423 1286 H32 ACD 300 HA2 ACD 300 -1.362 9.805 -10.206 1287 H41 ACD 300 HA0 ACD 300 0.130 10.400 -7.612 1288 H42 ACD 300 HAZ ACD 300 -0.056 8.807 -8.380 1289 H5 ACD 300 HAY ACD 300 -2.794 9.654 -8.106 1290 H6 ACD 300 HAX ACD 300 -2.906 9.259 -5.523 1291 H71 ACD 300 HAV ACD 300 0.048 10.039 -5.586 1292 H72 ACD 300 HAW ACD 300 -0.869 9.535 -4.149 1293 H8 ACD 300 HAU ACD 300 0.212 7.503 -6.278 1294 H9 ACD 300 HAT ACD 300 0.587 6.039 -4.154 1295 H101 ACD 300 HAR ACD 300 0.711 7.745 -2.098 1296 H102 ACD 300 HAS ACD 300 -0.763 8.489 -2.755 1297 H11 ACD 300 HAQ ACD 300 -2.028 6.240 -2.315 1298 H12 ACD 300 HAP ACD 300 -1.160 5.140 -0.113 1299 H131 ACD 300 HAN ACD 300 1.629 6.265 -0.793 1300 H132 ACD 300 HAO ACD 300 1.032 5.624 0.816 1301 H14 ACD 300 HAM ACD 300 -0.241 8.029 0.875 1302 H15 ACD 300 HAL ACD 300 1.831 9.624 0.847 1303 H161 ACD 300 HAJ ACD 300 4.032 8.875 0.088 1304 H162 ACD 300 HAK ACD 300 3.553 7.196 0.411 1305 H171 ACD 300 HAH ACD 300 4.116 7.567 -1.980 1306 H172 ACD 300 HAI ACD 300 2.428 7.066 -1.777 1307 H181 ACD 300 HAF ACD 300 1.743 9.480 -1.870 1308 H182 ACD 300 HAG ACD 300 3.436 9.916 -2.203 1309 H191 ACD 300 HAD ACD 300 3.386 8.392 -4.203 1310 H192 ACD 300 HAE ACD 300 1.684 8.065 -3.878 1311 H201 ACD 300 HAA ACD 300 1.874 9.795 -5.608 1312 H202 ACD 300 HAB ACD 300 2.896 10.787 -4.547 1313 H203 ACD 300 HAC ACD 300 1.188 10.514 -4.132
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