NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
12024 | 1se9 | 6128 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H GLU 1 HT1 GLU 1 1.806 2.248 1.437 2 HA GLU 1 HA GLU 1 3.300 0.681 2.249 3 1HB GLU 1 HB2 GLU 1 3.213 -1.661 1.390 4 2HB GLU 1 HB1 GLU 1 1.887 -1.261 2.466 5 1HG GLU 1 HG2 GLU 1 0.423 -0.990 0.529 6 2HG GLU 1 HG1 GLU 1 1.775 -1.381 -0.535 7 H ALA 2 HN ALA 2 5.034 -0.374 0.854 8 HA ALA 2 HA ALA 2 5.332 1.320 -1.467 9 1HB ALA 2 HB1 ALA 2 7.633 0.473 -1.492 10 2HB ALA 2 HB2 ALA 2 7.234 -0.653 -0.196 11 3HB ALA 2 HB3 ALA 2 7.200 1.083 0.107 12 H GLU 3 HN GLU 3 5.693 0.520 -3.560 13 HA GLU 3 HA GLU 3 4.222 -1.780 -4.082 14 1HB GLU 3 HB2 GLU 3 4.831 -1.370 -6.521 15 2HB GLU 3 HB1 GLU 3 3.953 -0.088 -5.717 16 1HG GLU 3 HG2 GLU 3 6.939 -0.081 -6.168 17 2HG GLU 3 HG1 GLU 3 5.774 0.677 -7.246 18 H VAL 4 HN VAL 4 4.840 -3.752 -4.714 19 HA VAL 4 HA VAL 4 5.923 -5.555 -4.336 20 HB VAL 4 HB VAL 4 6.432 -5.405 -6.542 21 1HG1 VAL 4 HG11 VAL 4 7.571 -3.232 -6.740 22 2HG1 VAL 4 HG12 VAL 4 8.591 -4.461 -7.488 23 3HG1 VAL 4 HG13 VAL 4 8.971 -3.864 -5.874 24 1HG2 VAL 4 HG21 VAL 4 7.413 -7.305 -5.511 25 2HG2 VAL 4 HG22 VAL 4 8.861 -6.400 -5.080 26 3HG2 VAL 4 HG23 VAL 4 8.523 -6.767 -6.773 27 H HIS 5 HN HIS 5 6.351 -6.079 -2.639 28 HA HIS 5 HA HIS 5 8.283 -4.664 -1.054 29 1HB HIS 5 HB2 HIS 5 7.615 -6.070 0.928 30 2HB HIS 5 HB1 HIS 5 6.349 -5.083 0.235 31 HD1 HIS 5 HD1 HIS 5 4.205 -6.290 -0.260 32 HD2 HIS 5 HD2 HIS 5 7.382 -8.917 0.217 33 HE1 HIS 5 HE1 HIS 5 3.193 -8.581 -0.235 34 HE2 HIS 5 HE2 HIS 5 5.075 -10.076 0.391 35 H ASN 6 HN ASN 6 10.074 -5.077 -2.100 36 HA ASN 6 HA ASN 6 11.275 -7.563 -1.207 37 1HB ASN 6 HB2 ASN 6 11.962 -5.975 -3.681 38 2HB ASN 6 HB1 ASN 6 13.055 -7.175 -2.999 39 1HD2 ASN 6 HD21 ASN 6 11.757 -7.154 -5.587 40 2HD2 ASN 6 HD22 ASN 6 10.809 -8.605 -5.652 41 H GLN 7 HN GLN 7 11.632 -6.763 0.739 42 HA GLN 7 HA GLN 7 13.871 -4.938 0.918 43 1HB GLN 7 HB2 GLN 7 11.823 -5.809 2.977 44 2HB GLN 7 HB1 GLN 7 13.269 -4.913 3.376 45 1HG GLN 7 HG2 GLN 7 11.425 -3.418 3.321 46 2HG GLN 7 HG1 GLN 7 12.450 -3.060 1.939 47 1HE2 GLN 7 HE21 GLN 7 10.834 -2.070 0.822 48 2HE2 GLN 7 HE22 GLN 7 9.488 -2.893 0.137 49 H LEU 8 HN LEU 8 14.858 -5.915 3.401 50 HA LEU 8 HA LEU 8 15.731 -8.475 2.353 51 1HB LEU 8 HB2 LEU 8 16.961 -6.759 4.486 52 2HB LEU 8 HB1 LEU 8 17.534 -8.336 4.049 53 HG LEU 8 HG LEU 8 18.027 -7.468 1.732 54 1HD1 LEU 8 HD11 LEU 8 18.235 -5.071 1.376 55 2HD1 LEU 8 HD12 LEU 8 17.507 -4.771 2.955 56 3HD1 LEU 8 HD13 LEU 8 16.564 -5.547 1.684 57 1HD2 LEU 8 HD21 LEU 8 19.795 -7.730 3.369 58 2HD2 LEU 8 HD22 LEU 8 19.463 -6.118 4.006 59 3HD2 LEU 8 HD23 LEU 8 20.082 -6.309 2.366 60 H GLU 9 HN GLU 9 15.311 -10.270 3.311 61 HA GLU 9 HA GLU 9 13.241 -10.090 5.330 62 1HB GLU 9 HB2 GLU 9 14.101 -12.422 3.639 63 2HB GLU 9 HB1 GLU 9 12.740 -12.382 4.738 64 1HG GLU 9 HG2 GLU 9 11.658 -10.674 3.417 65 2HG GLU 9 HG1 GLU 9 13.039 -10.612 2.324 66 H ILE 10 HN ILE 10 13.252 -11.044 7.212 67 HA ILE 10 HA ILE 10 15.750 -12.352 8.058 68 HB ILE 10 HB ILE 10 13.992 -10.564 9.785 69 1HG1 ILE 10 HG12 ILE 10 16.769 -10.013 8.679 70 2HG1 ILE 10 HG11 ILE 10 15.288 -9.220 8.163 71 1HG2 ILE 10 HG21 ILE 10 15.020 -12.341 11.048 72 2HG2 ILE 10 HG22 ILE 10 15.745 -10.784 11.458 73 3HG2 ILE 10 HG23 ILE 10 16.610 -11.911 10.405 74 1HD1 ILE 10 HD11 ILE 10 16.521 -9.063 10.901 75 2HD1 ILE 10 HD12 ILE 10 15.040 -8.252 10.389 76 3HD1 ILE 10 HD13 ILE 10 16.588 -7.813 9.658 77 H LYS 11 HN LYS 11 15.413 -14.220 8.996 78 HA LYS 11 HA LYS 11 12.758 -14.645 10.144 79 1HB LYS 11 HB2 LYS 11 12.726 -16.998 9.719 80 2HB LYS 11 HB1 LYS 11 13.003 -16.176 8.211 81 1HG LYS 11 HG2 LYS 11 15.308 -16.863 8.214 82 2HG LYS 11 HG1 LYS 11 15.118 -17.533 9.850 83 1HD LYS 11 HD2 LYS 11 13.342 -19.025 9.000 84 2HD LYS 11 HD1 LYS 11 13.657 -18.425 7.377 85 1HE LYS 11 HE2 LYS 11 15.877 -19.343 7.434 86 2HE LYS 11 HE1 LYS 11 15.667 -19.828 9.120 87 1HZ LYS 11 HZ1 LYS 11 14.111 -20.844 6.814 88 2HZ LYS 11 HZ2 LYS 11 13.824 -21.258 8.407 89 3HZ LYS 11 HZ3 LYS 11 15.283 -21.715 7.668 90 H PHE 12 HN PHE 12 12.654 -16.006 12.004 91 HA PHE 12 HA PHE 12 15.025 -15.463 13.642 92 1HB PHE 12 HB2 PHE 12 12.165 -15.934 14.487 93 2HB PHE 12 HB1 PHE 12 13.498 -15.463 15.530 94 HD1 PHE 12 HD1 PHE 12 14.573 -13.202 15.149 95 HD2 PHE 12 HD2 PHE 12 10.878 -14.325 13.364 96 HE1 PHE 12 HE1 PHE 12 14.040 -10.834 14.759 97 HE2 PHE 12 HE2 PHE 12 10.342 -11.952 12.970 98 HZ PHE 12 HZ PHE 12 11.946 -10.197 13.681 99 H ARG 13 HN ARG 13 16.219 -17.213 14.264 100 HA ARG 13 HA ARG 13 14.787 -19.734 14.506 101 1HB ARG 13 HB2 ARG 13 17.736 -19.293 14.095 102 2HB ARG 13 HB1 ARG 13 16.978 -20.837 14.424 103 1HG ARG 13 HG2 ARG 13 15.607 -20.368 12.300 104 2HG ARG 13 HG1 ARG 13 16.817 -19.134 11.982 105 1HD ARG 13 HD2 ARG 13 17.359 -22.064 12.408 106 2HD ARG 13 HD1 ARG 13 17.405 -21.228 10.863 107 HE ARG 13 HE ARG 13 19.295 -19.903 11.901 108 1HH1 ARG 13 HH11 ARG 13 18.588 -23.246 12.913 109 2HH1 ARG 13 HH12 ARG 13 20.184 -23.590 13.349 110 1HH2 ARG 13 HH21 ARG 13 21.502 -20.420 12.442 111 2HH2 ARG 13 HH22 ARG 13 21.883 -21.949 13.085 112 H LEU 14 HN LEU 14 14.483 -20.459 16.379 113 HA LEU 14 HA LEU 14 15.451 -19.092 18.672 114 1HB LEU 14 HB2 LEU 14 13.838 -21.622 18.351 115 2HB LEU 14 HB1 LEU 14 14.248 -20.936 19.900 116 HG LEU 14 HG LEU 14 12.881 -18.926 19.337 117 1HD1 LEU 14 HD11 LEU 14 12.054 -20.483 16.892 118 2HD1 LEU 14 HD12 LEU 14 12.994 -18.991 16.903 119 3HD1 LEU 14 HD13 LEU 14 11.323 -18.983 17.464 120 1HD2 LEU 14 HD21 LEU 14 11.456 -21.566 19.150 121 2HD2 LEU 14 HD22 LEU 14 10.715 -20.021 19.569 122 3HD2 LEU 14 HD23 LEU 14 11.935 -20.731 20.627 123 H THR 15 HN THR 15 16.674 -20.017 20.310 124 HA THR 15 HA THR 15 19.068 -21.196 19.563 125 HB THR 15 HB THR 15 18.704 -19.834 21.521 126 HG1 THR 15 HG1 THR 15 19.726 -21.745 23.024 127 1HG2 THR 15 HG21 THR 15 16.600 -20.715 22.311 128 2HG2 THR 15 HG22 THR 15 17.784 -20.769 23.614 129 3HG2 THR 15 HG23 THR 15 17.359 -22.247 22.742 130 H ASP 16 HN ASP 16 16.121 -22.639 20.434 131 HA ASP 16 HA ASP 16 17.223 -25.263 20.951 132 1HB ASP 16 HB2 ASP 16 14.927 -26.044 21.217 133 2HB ASP 16 HB1 ASP 16 15.195 -24.569 22.132 134 H GLY 17 HN GLY 17 16.774 -23.617 18.134 135 1HA GLY 17 HA2 GLY 17 17.462 -24.548 16.077 136 2HA GLY 17 HA1 GLY 17 16.981 -26.131 16.654 137 H SER 18 HN SER 18 14.473 -24.055 17.322 138 HA SER 18 HA SER 18 13.025 -24.927 14.935 139 1HB SER 18 HB2 SER 18 12.030 -23.434 17.382 140 2HB SER 18 HB1 SER 18 11.032 -24.211 16.146 141 HG SER 18 HG SER 18 12.472 -25.274 18.246 142 H ASP 19 HN ASP 19 12.119 -23.343 13.371 143 HA ASP 19 HA ASP 19 13.080 -20.657 13.879 144 1HB ASP 19 HB2 ASP 19 13.619 -20.394 11.623 145 2HB ASP 19 HB1 ASP 19 14.409 -21.873 12.174 146 H ILE 20 HN ILE 20 11.957 -19.006 12.931 147 HA ILE 20 HA ILE 20 9.091 -19.498 12.500 148 HB ILE 20 HB ILE 20 10.562 -16.946 13.287 149 1HG1 ILE 20 HG12 ILE 20 8.782 -18.750 14.953 150 2HG1 ILE 20 HG11 ILE 20 10.529 -18.621 15.094 151 1HG2 ILE 20 HG21 ILE 20 7.597 -17.468 13.068 152 2HG2 ILE 20 HG22 ILE 20 8.554 -16.451 11.993 153 3HG2 ILE 20 HG23 ILE 20 8.329 -15.985 13.681 154 1HD1 ILE 20 HD11 ILE 20 10.292 -16.287 15.807 155 2HD1 ILE 20 HD12 ILE 20 9.395 -17.383 16.859 156 3HD1 ILE 20 HD13 ILE 20 8.540 -16.426 15.652 157 H GLY 21 HN GLY 21 8.145 -18.687 10.602 158 1HA GLY 21 HA2 GLY 21 9.646 -18.639 8.278 159 2HA GLY 21 HA1 GLY 21 8.011 -18.026 8.429 160 HA PRO 22 HA PRO 22 11.505 -14.671 8.048 161 1HB PRO 22 HB2 PRO 22 11.832 -14.500 5.364 162 2HB PRO 22 HB1 PRO 22 12.867 -15.485 6.389 163 1HG PRO 22 HG2 PRO 22 10.560 -16.298 4.676 164 2HG PRO 22 HG1 PRO 22 12.091 -17.142 4.962 165 1HD PRO 22 HD2 PRO 22 9.771 -17.849 6.173 166 2HD PRO 22 HD1 PRO 22 11.359 -18.066 6.938 167 H LYS 23 HN LYS 23 11.040 -12.652 7.716 168 HA LYS 23 HA LYS 23 8.641 -11.867 6.191 169 1HB LYS 23 HB2 LYS 23 8.155 -11.760 8.601 170 2HB LYS 23 HB1 LYS 23 9.626 -10.841 8.877 171 1HG LYS 23 HG2 LYS 23 8.693 -9.023 7.497 172 2HG LYS 23 HG1 LYS 23 7.199 -9.940 7.348 173 1HD LYS 23 HD2 LYS 23 6.914 -9.875 9.770 174 2HD LYS 23 HD1 LYS 23 8.436 -8.994 9.930 175 1HE LYS 23 HE2 LYS 23 5.982 -8.033 8.461 176 2HE LYS 23 HE1 LYS 23 6.513 -7.489 10.047 177 1HZ LYS 23 HZ1 LYS 23 7.146 -5.947 8.306 178 2HZ LYS 23 HZ2 LYS 23 8.051 -7.103 7.504 179 3HZ LYS 23 HZ3 LYS 23 8.521 -6.562 9.036 180 H ALA 24 HN ALA 24 8.908 -9.651 5.297 181 HA ALA 24 HA ALA 24 11.701 -9.097 4.754 182 1HB ALA 24 HB1 ALA 24 10.865 -7.529 3.094 183 2HB ALA 24 HB2 ALA 24 9.229 -7.729 3.702 184 3HB ALA 24 HB3 ALA 24 10.043 -9.079 2.907 185 H PHE 25 HN PHE 25 12.861 -7.558 5.754 186 HA PHE 25 HA PHE 25 11.367 -5.568 7.308 187 1HB PHE 25 HB2 PHE 25 13.987 -6.879 8.046 188 2HB PHE 25 HB1 PHE 25 13.190 -5.605 8.941 189 HD1 PHE 25 HD1 PHE 25 13.047 -9.109 7.954 190 HD2 PHE 25 HD2 PHE 25 11.455 -6.124 10.506 191 HE1 PHE 25 HE1 PHE 25 11.990 -10.842 9.298 192 HE2 PHE 25 HE2 PHE 25 10.382 -7.874 11.865 193 HZ PHE 25 HZ PHE 25 10.705 -10.283 11.216 194 HA PRO 26 HA PRO 26 13.894 -2.960 4.677 195 1HB PRO 26 HB2 PRO 26 12.774 -0.970 6.568 196 2HB PRO 26 HB1 PRO 26 12.796 -0.879 4.821 197 1HG PRO 26 HG2 PRO 26 10.568 -1.419 6.208 198 2HG PRO 26 HG1 PRO 26 10.844 -2.181 4.641 199 1HD PRO 26 HD2 PRO 26 11.057 -3.306 7.379 200 2HD PRO 26 HD1 PRO 26 10.633 -4.125 5.858 201 H ASP 27 HN ASP 27 15.840 -1.879 5.195 202 HA ASP 27 HA ASP 27 17.207 -2.495 7.579 203 1HB ASP 27 HB2 ASP 27 17.816 -0.311 5.570 204 2HB ASP 27 HB1 ASP 27 18.927 -0.915 6.792 205 H ALA 28 HN ALA 28 15.158 0.123 6.683 206 HA ALA 28 HA ALA 28 16.003 1.924 8.748 207 1HB ALA 28 HB1 ALA 28 13.549 1.993 7.004 208 2HB ALA 28 HB2 ALA 28 15.102 2.747 6.633 209 3HB ALA 28 HB3 ALA 28 14.149 3.314 8.003 210 H THR 29 HN THR 29 14.252 -0.879 8.904 211 HA THR 29 HA THR 29 12.181 -0.138 10.712 212 HB THR 29 HB THR 29 13.574 -2.833 10.496 213 HG1 THR 29 HG1 THR 29 12.843 -2.593 8.559 214 1HG2 THR 29 HG21 THR 29 10.783 -2.099 11.419 215 2HG2 THR 29 HG22 THR 29 12.110 -2.595 12.465 216 3HG2 THR 29 HG23 THR 29 11.433 -3.736 11.300 217 H THR 30 HN THR 30 12.284 0.120 12.916 218 HA THR 30 HA THR 30 14.856 0.269 14.154 219 HB THR 30 HB THR 30 13.517 0.911 16.172 220 HG1 THR 30 HG1 THR 30 11.217 1.067 14.586 221 1HG2 THR 30 HG21 THR 30 12.811 2.381 13.621 222 2HG2 THR 30 HG22 THR 30 14.251 2.647 14.605 223 3HG2 THR 30 HG23 THR 30 12.657 3.034 15.251 224 H VAL 31 HN VAL 31 15.550 -1.076 15.936 225 HA VAL 31 HA VAL 31 14.678 -3.736 15.774 226 HB VAL 31 HB VAL 31 16.411 -2.388 17.881 227 1HG1 VAL 31 HG11 VAL 31 15.969 -5.363 17.435 228 2HG1 VAL 31 HG12 VAL 31 15.312 -4.441 18.777 229 3HG1 VAL 31 HG13 VAL 31 17.055 -4.634 18.624 230 1HG2 VAL 31 HG21 VAL 31 18.240 -3.544 16.728 231 2HG2 VAL 31 HG22 VAL 31 17.379 -2.435 15.657 232 3HG2 VAL 31 HG23 VAL 31 17.087 -4.170 15.544 233 H SER 32 HN SER 32 13.634 -1.049 17.681 234 HA SER 32 HA SER 32 12.140 -2.364 19.627 235 1HB SER 32 HB2 SER 32 11.505 0.229 18.185 236 2HB SER 32 HB1 SER 32 10.720 -0.319 19.664 237 HG SER 32 HG SER 32 13.404 0.523 19.291 238 H ALA 33 HN ALA 33 11.168 -1.413 16.309 239 HA ALA 33 HA ALA 33 8.585 -2.601 16.473 240 1HB ALA 33 HB1 ALA 33 10.216 -1.903 14.027 241 2HB ALA 33 HB2 ALA 33 9.136 -0.799 14.880 242 3HB ALA 33 HB3 ALA 33 8.483 -2.221 14.067 243 H LEU 34 HN LEU 34 11.777 -3.815 15.449 244 HA LEU 34 HA LEU 34 10.998 -6.157 14.227 245 1HB LEU 34 HB2 LEU 34 13.197 -5.136 14.053 246 2HB LEU 34 HB1 LEU 34 13.370 -5.244 15.790 247 HG LEU 34 HG LEU 34 13.505 -7.526 15.723 248 1HD1 LEU 34 HD11 LEU 34 13.768 -8.761 13.520 249 2HD1 LEU 34 HD12 LEU 34 13.379 -7.257 12.688 250 3HD1 LEU 34 HD13 LEU 34 12.167 -8.043 13.702 251 1HD2 LEU 34 HD21 LEU 34 15.414 -6.167 13.848 252 2HD2 LEU 34 HD22 LEU 34 15.716 -7.737 14.579 253 3HD2 LEU 34 HD23 LEU 34 15.542 -6.311 15.598 254 H LYS 35 HN LYS 35 11.872 -5.309 17.528 255 HA LYS 35 HA LYS 35 11.671 -7.816 18.750 256 1HB LYS 35 HB2 LYS 35 12.762 -5.642 19.538 257 2HB LYS 35 HB1 LYS 35 11.162 -5.093 19.960 258 1HG LYS 35 HG2 LYS 35 10.994 -6.844 21.646 259 2HG LYS 35 HG1 LYS 35 12.580 -7.465 21.165 260 1HD LYS 35 HD2 LYS 35 13.583 -5.260 21.700 261 2HD LYS 35 HD1 LYS 35 12.012 -4.704 22.260 262 1HE LYS 35 HE2 LYS 35 13.410 -5.330 24.137 263 2HE LYS 35 HE1 LYS 35 12.053 -6.441 24.003 264 1HZ LYS 35 HZ1 LYS 35 14.126 -7.555 24.469 265 2HZ LYS 35 HZ2 LYS 35 14.816 -6.992 23.053 266 3HZ LYS 35 HZ3 LYS 35 13.525 -8.077 22.997 267 H GLU 36 HN GLU 36 9.337 -5.149 18.354 268 HA GLU 36 HA GLU 36 7.074 -6.232 19.596 269 1HB GLU 36 HB2 GLU 36 7.406 -4.375 17.253 270 2HB GLU 36 HB1 GLU 36 5.830 -4.743 17.897 271 1HG GLU 36 HG2 GLU 36 8.070 -3.531 19.480 272 2HG GLU 36 HG1 GLU 36 6.821 -2.600 18.660 273 H THR 37 HN THR 37 8.252 -6.547 16.284 274 HA THR 37 HA THR 37 6.112 -7.885 15.111 275 HB THR 37 HB THR 37 9.071 -8.186 14.493 276 HG1 THR 37 HG1 THR 37 8.173 -6.010 14.396 277 1HG2 THR 37 HG21 THR 37 6.657 -8.712 12.746 278 2HG2 THR 37 HG22 THR 37 7.694 -9.951 13.444 279 3HG2 THR 37 HG23 THR 37 8.341 -8.836 12.238 280 H VAL 38 HN VAL 38 8.874 -9.116 16.895 281 HA VAL 38 HA VAL 38 8.410 -11.857 16.499 282 HB VAL 38 HB VAL 38 9.728 -10.557 18.891 283 1HG1 VAL 38 HG11 VAL 38 9.252 -12.900 19.267 284 2HG1 VAL 38 HG12 VAL 38 10.991 -12.677 19.025 285 3HG1 VAL 38 HG13 VAL 38 9.997 -13.324 17.727 286 1HG2 VAL 38 HG21 VAL 38 11.820 -10.800 17.705 287 2HG2 VAL 38 HG22 VAL 38 10.713 -9.771 16.797 288 3HG2 VAL 38 HG23 VAL 38 10.978 -11.442 16.298 289 H ILE 39 HN ILE 39 7.371 -9.587 18.987 290 HA ILE 39 HA ILE 39 6.207 -11.421 20.774 291 HB ILE 39 HB ILE 39 5.291 -8.559 20.337 292 1HG1 ILE 39 HG12 ILE 39 7.681 -8.500 20.559 293 2HG1 ILE 39 HG11 ILE 39 6.970 -7.965 22.077 294 1HG2 ILE 39 HG21 ILE 39 3.849 -9.838 21.865 295 2HG2 ILE 39 HG22 ILE 39 4.766 -8.628 22.770 296 3HG2 ILE 39 HG23 ILE 39 5.256 -10.305 22.819 297 1HD1 ILE 39 HD11 ILE 39 8.037 -10.711 21.527 298 2HD1 ILE 39 HD12 ILE 39 7.454 -10.103 23.090 299 3HD1 ILE 39 HD13 ILE 39 8.905 -9.420 22.336 300 H SER 40 HN SER 40 4.966 -9.873 17.909 301 HA SER 40 HA SER 40 2.278 -10.737 18.298 302 1HB SER 40 HB2 SER 40 3.676 -9.801 15.796 303 2HB SER 40 HB1 SER 40 1.926 -9.907 16.024 304 HG SER 40 HG SER 40 3.077 -8.481 18.025 305 H GLU 41 HN GLU 41 5.150 -12.140 16.663 306 HA GLU 41 HA GLU 41 3.698 -14.153 15.297 307 1HB GLU 41 HB2 GLU 41 6.615 -13.739 15.893 308 2HB GLU 41 HB1 GLU 41 5.974 -15.030 14.903 309 1HG GLU 41 HG2 GLU 41 5.786 -12.082 14.341 310 2HG GLU 41 HG1 GLU 41 6.871 -13.221 13.549 311 H TRP 42 HN TRP 42 5.476 -13.795 18.262 312 HA TRP 42 HA TRP 42 5.851 -16.506 18.913 313 1HB TRP 42 HB2 TRP 42 7.047 -14.352 19.686 314 2HB TRP 42 HB1 TRP 42 5.730 -14.197 20.828 315 HD1 TRP 42 HD1 TRP 42 5.690 -16.020 22.869 316 HE1 TRP 42 HE1 TRP 42 7.565 -17.407 23.881 317 HE3 TRP 42 HE3 TRP 42 9.037 -15.645 19.043 318 HZ2 TRP 42 HZ2 TRP 42 10.168 -18.303 23.094 319 HZ3 TRP 42 HZ3 TRP 42 11.189 -16.795 19.241 320 HH2 TRP 42 HH2 TRP 42 11.741 -18.092 21.220 321 HA PRO 43 HA PRO 43 1.645 -17.240 20.297 322 1HB PRO 43 HB2 PRO 43 2.821 -19.412 21.910 323 2HB PRO 43 HB1 PRO 43 1.585 -19.506 20.662 324 1HG PRO 43 HG2 PRO 43 4.065 -20.400 20.212 325 2HG PRO 43 HG1 PRO 43 3.146 -19.572 18.943 326 1HD PRO 43 HD2 PRO 43 5.333 -18.507 20.689 327 2HD PRO 43 HD1 PRO 43 5.033 -18.266 18.949 328 H ARG 44 HN ARG 44 0.805 -15.947 21.801 329 HA ARG 44 HA ARG 44 2.124 -15.341 24.269 330 1HB ARG 44 HB2 ARG 44 0.149 -14.000 24.821 331 2HB ARG 44 HB1 ARG 44 0.684 -13.663 23.189 332 1HG ARG 44 HG2 ARG 44 -1.105 -15.165 22.355 333 2HG ARG 44 HG1 ARG 44 -1.670 -15.340 24.017 334 1HD ARG 44 HD2 ARG 44 -2.009 -12.920 24.138 335 2HD ARG 44 HD1 ARG 44 -1.466 -12.764 22.469 336 HE ARG 44 HE ARG 44 -3.878 -14.229 23.309 337 1HH1 ARG 44 HH11 ARG 44 -2.181 -12.234 20.908 338 2HH1 ARG 44 HH12 ARG 44 -3.541 -12.040 19.911 339 1HH2 ARG 44 HH21 ARG 44 -5.714 -13.951 21.956 340 2HH2 ARG 44 HH22 ARG 44 -5.602 -13.065 20.501 341 H GLU 45 HN GLU 45 -0.043 -17.688 23.193 342 HA GLU 45 HA GLU 45 -1.126 -18.592 25.661 343 1HB GLU 45 HB2 GLU 45 -1.655 -20.648 24.408 344 2HB GLU 45 HB1 GLU 45 -2.144 -19.193 23.543 345 1HG GLU 45 HG2 GLU 45 -0.226 -19.349 22.093 346 2HG GLU 45 HG1 GLU 45 0.404 -20.711 23.014 347 H LYS 46 HN LYS 46 2.004 -18.739 24.379 348 HA LYS 46 HA LYS 46 2.872 -21.307 25.187 349 1HB LYS 46 HB2 LYS 46 4.047 -19.893 23.479 350 2HB LYS 46 HB1 LYS 46 4.452 -18.789 24.763 351 1HG LYS 46 HG2 LYS 46 5.785 -20.488 25.868 352 2HG LYS 46 HG1 LYS 46 5.400 -21.636 24.587 353 1HD LYS 46 HD2 LYS 46 6.436 -20.112 22.949 354 2HD LYS 46 HD1 LYS 46 6.855 -19.019 24.265 355 1HE LYS 46 HE2 LYS 46 8.784 -20.349 23.704 356 2HE LYS 46 HE1 LYS 46 8.184 -20.820 25.294 357 1HZ LYS 46 HZ1 LYS 46 7.117 -22.749 24.262 358 2HZ LYS 46 HZ2 LYS 46 8.771 -22.730 23.960 359 3HZ LYS 46 HZ3 LYS 46 7.709 -22.268 22.758 360 H GLU 47 HN GLU 47 3.128 -21.979 27.262 361 HA GLU 47 HA GLU 47 3.888 -20.033 29.189 362 1HB GLU 47 HB2 GLU 47 3.248 -22.950 29.516 363 2HB GLU 47 HB1 GLU 47 3.757 -21.917 30.813 364 1HG GLU 47 HG2 GLU 47 1.258 -21.444 29.211 365 2HG GLU 47 HG1 GLU 47 1.323 -22.232 30.787 366 H ASN 48 HN ASN 48 5.762 -20.261 30.298 367 HA ASN 48 HA ASN 48 7.958 -20.432 30.533 368 1HB ASN 48 HB2 ASN 48 7.524 -22.716 31.268 369 2HB ASN 48 HB1 ASN 48 7.560 -23.290 29.610 370 1HD2 ASN 48 HD21 ASN 48 9.501 -23.677 28.652 371 2HD2 ASN 48 HD22 ASN 48 11.017 -23.614 29.471 372 H GLY 49 HN GLY 49 8.032 -18.817 28.869 373 1HA GLY 49 HA2 GLY 49 10.301 -18.968 27.552 374 2HA GLY 49 HA1 GLY 49 9.058 -19.404 26.366 375 HA PRO 50 HA PRO 50 9.179 -14.667 27.096 376 1HB PRO 50 HB2 PRO 50 9.552 -15.014 24.159 377 2HB PRO 50 HB1 PRO 50 10.194 -13.761 25.220 378 1HG PRO 50 HG2 PRO 50 11.777 -15.696 24.393 379 2HG PRO 50 HG1 PRO 50 11.843 -15.183 26.090 380 1HD PRO 50 HD2 PRO 50 10.580 -17.626 24.911 381 2HD PRO 50 HD1 PRO 50 11.445 -17.407 26.450 382 H LYS 51 HN LYS 51 7.646 -13.254 26.035 383 HA LYS 51 HA LYS 51 5.989 -13.749 23.970 384 1HB LYS 51 HB2 LYS 51 3.759 -14.115 25.020 385 2HB LYS 51 HB1 LYS 51 4.827 -15.500 25.073 386 1HG LYS 51 HG2 LYS 51 5.322 -14.933 27.437 387 2HG LYS 51 HG1 LYS 51 4.076 -13.670 27.333 388 1HD LYS 51 HD2 LYS 51 2.431 -15.279 26.706 389 2HD LYS 51 HD1 LYS 51 3.642 -16.550 26.644 390 1HE LYS 51 HE2 LYS 51 3.992 -16.247 29.075 391 2HE LYS 51 HE1 LYS 51 2.659 -15.079 29.073 392 1HZ LYS 51 HZ1 LYS 51 1.900 -17.411 29.619 393 2HZ LYS 51 HZ2 LYS 51 2.488 -17.854 28.132 394 3HZ LYS 51 HZ3 LYS 51 1.202 -16.772 28.214 395 H THR 52 HN THR 52 6.789 -12.069 26.790 396 HA THR 52 HA THR 52 5.396 -9.828 25.607 397 HB THR 52 HB THR 52 5.926 -8.580 27.601 398 HG1 THR 52 HG1 THR 52 7.068 -11.062 28.508 399 1HG2 THR 52 HG21 THR 52 4.615 -11.226 28.207 400 2HG2 THR 52 HG22 THR 52 3.829 -9.782 27.562 401 3HG2 THR 52 HG23 THR 52 4.479 -9.776 29.202 402 H VAL 53 HN VAL 53 6.715 -7.763 25.687 403 HA VAL 53 HA VAL 53 8.630 -8.097 23.723 404 HB VAL 53 HB VAL 53 7.278 -6.107 23.844 405 1HG1 VAL 53 HG11 VAL 53 7.689 -4.328 25.475 406 2HG1 VAL 53 HG12 VAL 53 8.779 -5.409 26.345 407 3HG1 VAL 53 HG13 VAL 53 7.066 -5.810 26.196 408 1HG2 VAL 53 HG21 VAL 53 8.983 -4.384 23.464 409 2HG2 VAL 53 HG22 VAL 53 9.356 -5.896 22.640 410 3HG2 VAL 53 HG23 VAL 53 10.205 -5.465 24.129 411 H LYS 54 HN LYS 54 9.144 -7.514 27.136 412 HA LYS 54 HA LYS 54 11.930 -6.974 26.829 413 1HB LYS 54 HB2 LYS 54 11.990 -6.962 29.247 414 2HB LYS 54 HB1 LYS 54 10.688 -5.950 28.628 415 1HG LYS 54 HG2 LYS 54 9.131 -7.880 29.085 416 2HG LYS 54 HG1 LYS 54 10.469 -8.677 29.889 417 1HD LYS 54 HD2 LYS 54 9.331 -5.993 30.690 418 2HD LYS 54 HD1 LYS 54 8.884 -7.517 31.429 419 1HE LYS 54 HE2 LYS 54 10.448 -6.389 32.865 420 2HE LYS 54 HE1 LYS 54 11.243 -7.789 32.165 421 1HZ LYS 54 HZ1 LYS 54 12.444 -6.300 30.656 422 2HZ LYS 54 HZ2 LYS 54 12.666 -5.814 32.223 423 3HZ LYS 54 HZ3 LYS 54 11.585 -4.975 31.236 424 H GLU 55 HN GLU 55 10.187 -9.876 26.965 425 HA GLU 55 HA GLU 55 12.192 -11.382 28.411 426 1HB GLU 55 HB2 GLU 55 9.778 -12.305 26.882 427 2HB GLU 55 HB1 GLU 55 10.803 -13.334 27.872 428 1HG GLU 55 HG2 GLU 55 10.182 -12.089 29.844 429 2HG GLU 55 HG1 GLU 55 9.225 -10.979 28.860 430 H VAL 56 HN VAL 56 11.530 -10.738 25.066 431 HA VAL 56 HA VAL 56 13.132 -13.039 24.273 432 HB VAL 56 HB VAL 56 10.982 -12.733 23.144 433 1HG1 VAL 56 HG11 VAL 56 10.616 -10.918 21.543 434 2HG1 VAL 56 HG12 VAL 56 12.127 -10.172 22.062 435 3HG1 VAL 56 HG13 VAL 56 10.787 -10.332 23.201 436 1HG2 VAL 56 HG21 VAL 56 13.318 -12.334 21.286 437 2HG2 VAL 56 HG22 VAL 56 11.733 -12.977 20.837 438 3HG2 VAL 56 HG23 VAL 56 12.763 -13.869 21.948 439 H LYS 57 HN LYS 57 15.125 -12.952 23.428 440 HA LYS 57 HA LYS 57 16.323 -10.333 22.944 441 1HB LYS 57 HB2 LYS 57 17.455 -12.851 24.110 442 2HB LYS 57 HB1 LYS 57 18.509 -11.706 23.316 443 1HG LYS 57 HG2 LYS 57 18.526 -11.400 25.731 444 2HG LYS 57 HG1 LYS 57 17.864 -9.987 24.920 445 1HD LYS 57 HD2 LYS 57 15.605 -10.713 25.511 446 2HD LYS 57 HD1 LYS 57 16.267 -12.152 26.292 447 1HE LYS 57 HE2 LYS 57 17.450 -10.774 27.895 448 2HE LYS 57 HE1 LYS 57 16.906 -9.311 27.084 449 1HZ LYS 57 HZ1 LYS 57 15.111 -11.293 28.367 450 2HZ LYS 57 HZ2 LYS 57 14.654 -9.784 27.729 451 3HZ LYS 57 HZ3 LYS 57 15.636 -9.864 29.065 452 H LEU 58 HN LEU 58 16.993 -9.903 20.989 453 HA LEU 58 HA LEU 58 17.138 -12.039 18.993 454 1HB LEU 58 HB2 LEU 58 17.042 -9.021 18.639 455 2HB LEU 58 HB1 LEU 58 17.097 -10.181 17.334 456 HG LEU 58 HG LEU 58 14.878 -9.409 17.416 457 1HD1 LEU 58 HD11 LEU 58 14.998 -11.767 17.085 458 2HD1 LEU 58 HD12 LEU 58 13.559 -11.384 18.033 459 3HD1 LEU 58 HD13 LEU 58 14.979 -12.047 18.821 460 1HD2 LEU 58 HD21 LEU 58 13.472 -9.396 19.442 461 2HD2 LEU 58 HD22 LEU 58 14.883 -8.351 19.625 462 3HD2 LEU 58 HD23 LEU 58 14.851 -9.938 20.396 463 H ILE 59 HN ILE 59 19.130 -12.700 18.335 464 HA ILE 59 HA ILE 59 21.395 -10.873 18.769 465 HB ILE 59 HB ILE 59 21.286 -13.801 19.555 466 1HG1 ILE 59 HG12 ILE 59 21.792 -11.311 21.201 467 2HG1 ILE 59 HG11 ILE 59 20.267 -12.185 21.142 468 1HG2 ILE 59 HG21 ILE 59 23.656 -11.915 19.591 469 2HG2 ILE 59 HG22 ILE 59 23.456 -13.303 18.524 470 3HG2 ILE 59 HG23 ILE 59 23.637 -13.547 20.260 471 1HD1 ILE 59 HD11 ILE 59 21.316 -14.090 22.117 472 2HD1 ILE 59 HD12 ILE 59 21.551 -12.670 23.142 473 3HD1 ILE 59 HD13 ILE 59 22.882 -13.280 22.142 474 H SER 60 HN SER 60 22.571 -10.558 17.095 475 HA SER 60 HA SER 60 22.735 -12.597 14.995 476 1HB SER 60 HB2 SER 60 21.108 -10.850 14.294 477 2HB SER 60 HB1 SER 60 22.331 -9.618 14.584 478 HG SER 60 HG SER 60 22.342 -11.674 12.649 479 H ALA 61 HN ALA 61 24.792 -12.985 14.369 480 HA ALA 61 HA ALA 61 27.024 -12.949 14.198 481 1HB ALA 61 HB1 ALA 61 26.775 -9.943 14.421 482 2HB ALA 61 HB2 ALA 61 26.648 -10.869 12.923 483 3HB ALA 61 HB3 ALA 61 28.172 -10.826 13.805 484 H GLY 62 HN GLY 62 25.656 -12.888 16.807 485 1HA GLY 62 HA2 GLY 62 26.459 -13.350 18.966 486 2HA GLY 62 HA1 GLY 62 28.050 -12.807 18.441 487 H LYS 63 HN LYS 63 25.271 -10.826 17.889 488 HA LYS 63 HA LYS 63 26.049 -9.080 20.110 489 1HB LYS 63 HB2 LYS 63 26.970 -8.288 17.945 490 2HB LYS 63 HB1 LYS 63 25.350 -8.281 17.281 491 1HG LYS 63 HG2 LYS 63 24.688 -6.578 18.913 492 2HG LYS 63 HG1 LYS 63 26.330 -6.566 19.554 493 1HD LYS 63 HD2 LYS 63 25.528 -5.851 16.728 494 2HD LYS 63 HD1 LYS 63 25.959 -4.704 17.995 495 1HE LYS 63 HE2 LYS 63 27.770 -6.804 16.789 496 2HE LYS 63 HE1 LYS 63 27.815 -5.080 16.448 497 1HZ LYS 63 HZ1 LYS 63 28.350 -4.696 18.784 498 2HZ LYS 63 HZ2 LYS 63 29.501 -5.618 18.012 499 3HZ LYS 63 HZ3 LYS 63 28.412 -6.358 19.074 500 H VAL 64 HN VAL 64 24.302 -8.706 21.358 501 HA VAL 64 HA VAL 64 21.694 -9.428 20.446 502 HB VAL 64 HB VAL 64 22.329 -9.711 22.831 503 1HG1 VAL 64 HG11 VAL 64 22.448 -7.799 24.354 504 2HG1 VAL 64 HG12 VAL 64 22.362 -6.705 22.975 505 3HG1 VAL 64 HG13 VAL 64 23.742 -7.785 23.156 506 1HG2 VAL 64 HG21 VAL 64 20.033 -7.794 22.427 507 2HG2 VAL 64 HG22 VAL 64 20.281 -8.804 23.852 508 3HG2 VAL 64 HG23 VAL 64 19.965 -9.551 22.289 509 H LEU 65 HN LEU 65 20.113 -8.186 19.663 510 HA LEU 65 HA LEU 65 20.885 -5.605 18.788 511 1HB LEU 65 HB2 LEU 65 18.449 -7.283 18.288 512 2HB LEU 65 HB1 LEU 65 18.599 -5.642 17.716 513 HG LEU 65 HG LEU 65 20.620 -6.358 16.421 514 1HD1 LEU 65 HD11 LEU 65 19.752 -9.128 17.155 515 2HD1 LEU 65 HD12 LEU 65 21.250 -8.329 17.627 516 3HD1 LEU 65 HD13 LEU 65 20.946 -8.706 15.929 517 1HD2 LEU 65 HD21 LEU 65 19.349 -7.442 14.635 518 2HD2 LEU 65 HD22 LEU 65 18.485 -6.075 15.338 519 3HD2 LEU 65 HD23 LEU 65 18.023 -7.724 15.763 520 H GLU 66 HN GLU 66 20.816 -4.019 20.181 521 HA GLU 66 HA GLU 66 18.826 -3.723 22.184 522 1HB GLU 66 HB2 GLU 66 21.052 -2.669 22.385 523 2HB GLU 66 HB1 GLU 66 20.727 -1.694 20.963 524 1HG GLU 66 HG2 GLU 66 20.480 -0.403 23.006 525 2HG GLU 66 HG1 GLU 66 18.949 -0.525 22.145 526 H ASN 67 HN ASN 67 16.992 -2.487 22.152 527 HA ASN 67 HA ASN 67 15.629 -2.412 19.655 528 1HB ASN 67 HB2 ASN 67 13.685 -1.622 20.847 529 2HB ASN 67 HB1 ASN 67 14.464 -2.856 21.823 530 1HD2 ASN 67 HD21 ASN 67 13.578 0.467 21.547 531 2HD2 ASN 67 HD22 ASN 67 13.994 0.940 23.146 532 H SER 68 HN SER 68 17.516 -0.179 21.293 533 HA SER 68 HA SER 68 16.409 2.244 20.224 534 1HB SER 68 HB2 SER 68 17.486 2.121 22.434 535 2HB SER 68 HB1 SER 68 19.014 1.721 21.662 536 HG SER 68 HG SER 68 18.326 3.857 20.469 537 H LYS 69 HN LYS 69 18.018 -0.120 18.658 538 HA LYS 69 HA LYS 69 19.453 1.695 16.908 539 1HB LYS 69 HB2 LYS 69 19.872 -1.224 17.531 540 2HB LYS 69 HB1 LYS 69 20.770 -0.284 16.349 541 1HG LYS 69 HG2 LYS 69 21.651 1.147 18.122 542 2HG LYS 69 HG1 LYS 69 20.692 0.279 19.310 543 1HD LYS 69 HD2 LYS 69 22.955 -0.522 19.436 544 2HD LYS 69 HD1 LYS 69 21.934 -1.769 18.741 545 1HE LYS 69 HE2 LYS 69 24.064 -1.627 17.565 546 2HE LYS 69 HE1 LYS 69 22.717 -1.220 16.510 547 1HZ LYS 69 HZ1 LYS 69 24.652 0.239 16.271 548 2HZ LYS 69 HZ2 LYS 69 24.468 0.794 17.846 549 3HZ LYS 69 HZ3 LYS 69 23.274 1.098 16.683 550 H THR 70 HN THR 70 19.435 0.721 14.524 551 HA THR 70 HA THR 70 16.749 -0.231 14.083 552 HB THR 70 HB THR 70 17.115 0.594 11.819 553 HG1 THR 70 HG1 THR 70 19.638 1.260 12.837 554 1HG2 THR 70 HG21 THR 70 16.946 3.019 12.304 555 2HG2 THR 70 HG22 THR 70 17.487 2.693 13.950 556 3HG2 THR 70 HG23 THR 70 15.950 2.042 13.382 557 H VAL 71 HN VAL 71 16.715 -1.564 11.956 558 HA VAL 71 HA VAL 71 18.380 -3.815 12.330 559 HB VAL 71 HB VAL 71 16.723 -3.061 9.883 560 1HG1 VAL 71 HG11 VAL 71 18.355 -4.804 9.392 561 2HG1 VAL 71 HG12 VAL 71 16.720 -5.458 9.388 562 3HG1 VAL 71 HG13 VAL 71 17.781 -5.747 10.766 563 1HG2 VAL 71 HG21 VAL 71 15.352 -3.156 11.894 564 2HG2 VAL 71 HG22 VAL 71 16.000 -4.749 12.275 565 3HG2 VAL 71 HG23 VAL 71 14.999 -4.528 10.841 566 H LYS 72 HN LYS 72 18.514 -0.984 10.302 567 HA LYS 72 HA LYS 72 20.488 -1.570 8.466 568 1HB LYS 72 HB2 LYS 72 19.109 0.455 8.456 569 2HB LYS 72 HB1 LYS 72 19.955 1.054 9.869 570 1HG LYS 72 HG2 LYS 72 22.018 1.242 8.590 571 2HG LYS 72 HG1 LYS 72 21.213 0.556 7.180 572 1HD LYS 72 HD2 LYS 72 20.446 3.153 8.527 573 2HD LYS 72 HD1 LYS 72 21.403 3.016 7.056 574 1HE LYS 72 HE2 LYS 72 19.513 1.907 5.936 575 2HE LYS 72 HE1 LYS 72 18.554 2.059 7.406 576 1HZ LYS 72 HZ1 LYS 72 19.628 4.311 5.805 577 2HZ LYS 72 HZ2 LYS 72 18.722 4.457 7.216 578 3HZ LYS 72 HZ3 LYS 72 18.025 3.788 5.843 579 H ASP 73 HN ASP 73 20.789 -0.703 11.858 580 HA ASP 73 HA ASP 73 23.481 -0.088 12.059 581 1HB ASP 73 HB2 ASP 73 21.444 -1.235 13.920 582 2HB ASP 73 HB1 ASP 73 23.057 -1.008 14.489 583 H TYR 74 HN TYR 74 21.884 -3.222 11.719 584 HA TYR 74 HA TYR 74 24.371 -4.615 12.388 585 1HB TYR 74 HB2 TYR 74 21.523 -5.596 12.254 586 2HB TYR 74 HB1 TYR 74 22.924 -6.530 12.752 587 HD1 TYR 74 HD1 TYR 74 20.620 -3.831 13.683 588 HD2 TYR 74 HD2 TYR 74 23.870 -6.246 14.980 589 HE1 TYR 74 HE1 TYR 74 20.257 -3.067 15.977 590 HE2 TYR 74 HE2 TYR 74 23.504 -5.477 17.292 591 HH TYR 74 HH TYR 74 20.696 -3.764 18.181 592 H ARG 75 HN ARG 75 22.700 -3.485 9.769 593 HA ARG 75 HA ARG 75 22.749 -5.835 8.136 594 1HB ARG 75 HB2 ARG 75 21.651 -3.127 8.055 595 2HB ARG 75 HB1 ARG 75 21.872 -4.000 6.553 596 1HG ARG 75 HG2 ARG 75 20.417 -5.162 8.889 597 2HG ARG 75 HG1 ARG 75 19.606 -4.148 7.688 598 1HD ARG 75 HD2 ARG 75 20.270 -5.648 5.928 599 2HD ARG 75 HD1 ARG 75 21.151 -6.663 7.058 600 HE ARG 75 HE ARG 75 19.249 -7.606 7.686 601 1HH1 ARG 75 HH11 ARG 75 18.427 -4.593 5.942 602 2HH1 ARG 75 HH12 ARG 75 16.771 -4.963 5.797 603 1HH2 ARG 75 HH21 ARG 75 16.918 -8.096 7.426 604 2HH2 ARG 75 HH22 ARG 75 15.893 -6.989 6.636 605 H SER 76 HN SER 76 23.332 -5.412 5.836 606 HA SER 76 HA SER 76 26.044 -4.556 5.589 607 1HB SER 76 HB2 SER 76 24.053 -5.626 3.578 608 2HB SER 76 HB1 SER 76 25.809 -5.585 3.413 609 HG SER 76 HG SER 76 25.517 -6.863 5.597 610 HA PRO 77 HA PRO 77 25.024 -0.522 3.835 611 1HB PRO 77 HB2 PRO 77 26.858 -1.064 1.572 612 2HB PRO 77 HB1 PRO 77 26.932 0.214 2.787 613 1HG PRO 77 HG2 PRO 77 28.656 -1.820 2.840 614 2HG PRO 77 HG1 PRO 77 28.002 -1.135 4.338 615 1HD PRO 77 HD2 PRO 77 27.212 -3.639 2.901 616 2HD PRO 77 HD1 PRO 77 27.434 -3.359 4.642 617 H VAL 78 HN VAL 78 24.622 0.515 1.486 618 HA VAL 78 HA VAL 78 22.331 -0.854 0.456 619 HB VAL 78 HB VAL 78 23.655 1.637 -0.563 620 1HG1 VAL 78 HG11 VAL 78 22.034 0.762 -2.163 621 2HG1 VAL 78 HG12 VAL 78 21.408 2.251 -1.449 622 3HG1 VAL 78 HG13 VAL 78 20.802 0.687 -0.903 623 1HG2 VAL 78 HG21 VAL 78 22.038 2.905 0.807 624 2HG2 VAL 78 HG22 VAL 78 23.129 1.911 1.776 625 3HG2 VAL 78 HG23 VAL 78 21.479 1.379 1.487 626 H SER 79 HN SER 79 25.484 -1.317 -0.112 627 HA SER 79 HA SER 79 25.428 -1.754 -2.951 628 1HB SER 79 HB2 SER 79 27.776 -2.599 -2.461 629 2HB SER 79 HB1 SER 79 27.463 -0.913 -2.036 630 HG SER 79 HG SER 79 28.335 -1.605 -0.274 631 H ASN 80 HN ASN 80 23.750 -3.149 -1.108 632 HA ASN 80 HA ASN 80 24.204 -5.904 -2.004 633 1HB ASN 80 HB2 ASN 80 24.860 -5.696 0.418 634 2HB ASN 80 HB1 ASN 80 23.245 -5.100 0.770 635 1HD2 ASN 80 HD21 ASN 80 21.530 -6.566 0.819 636 2HD2 ASN 80 HD22 ASN 80 21.786 -8.261 0.803 637 H LEU 81 HN LEU 81 22.177 -6.959 -2.693 638 HA LEU 81 HA LEU 81 20.151 -5.111 -3.235 639 1HB LEU 81 HB2 LEU 81 20.738 -7.926 -3.875 640 2HB LEU 81 HB1 LEU 81 19.412 -7.014 -4.530 641 HG LEU 81 HG LEU 81 22.354 -6.501 -4.986 642 1HD1 LEU 81 HD11 LEU 81 21.548 -8.425 -6.201 643 2HD1 LEU 81 HD12 LEU 81 21.883 -7.088 -7.305 644 3HD1 LEU 81 HD13 LEU 81 20.221 -7.472 -6.865 645 1HD2 LEU 81 HD21 LEU 81 21.156 -4.384 -4.944 646 2HD2 LEU 81 HD22 LEU 81 19.960 -5.014 -6.074 647 3HD2 LEU 81 HD23 LEU 81 21.628 -4.779 -6.598 648 H ALA 82 HN ALA 82 17.893 -6.403 -3.223 649 HA ALA 82 HA ALA 82 17.390 -6.911 -0.483 650 1HB ALA 82 HB1 ALA 82 15.941 -5.413 -1.743 651 2HB ALA 82 HB2 ALA 82 15.036 -6.791 -1.116 652 3HB ALA 82 HB3 ALA 82 15.499 -6.742 -2.816 653 H GLY 83 HN GLY 83 18.770 -8.840 -2.267 654 1HA GLY 83 HA2 GLY 83 16.889 -11.092 -2.295 655 2HA GLY 83 HA1 GLY 83 18.424 -11.040 -3.152 656 H ALA 84 HN ALA 84 19.175 -9.790 -0.305 657 HA ALA 84 HA ALA 84 20.256 -12.298 0.625 658 1HB ALA 84 HB1 ALA 84 21.708 -10.327 0.527 659 2HB ALA 84 HB2 ALA 84 21.552 -10.939 2.175 660 3HB ALA 84 HB3 ALA 84 20.658 -9.505 1.680 661 H VAL 85 HN VAL 85 19.134 -13.496 1.942 662 HA VAL 85 HA VAL 85 17.224 -12.250 3.747 663 HB VAL 85 HB VAL 85 16.370 -14.144 2.436 664 1HG1 VAL 85 HG11 VAL 85 17.175 -16.437 2.760 665 2HG1 VAL 85 HG12 VAL 85 18.473 -15.821 3.779 666 3HG1 VAL 85 HG13 VAL 85 18.411 -15.385 2.069 667 1HG2 VAL 85 HG21 VAL 85 15.392 -13.844 4.644 668 2HG2 VAL 85 HG22 VAL 85 16.631 -14.875 5.355 669 3HG2 VAL 85 HG23 VAL 85 15.454 -15.558 4.239 670 H THR 86 HN THR 86 17.340 -12.589 5.999 671 HA THR 86 HA THR 86 20.023 -13.321 6.929 672 HB THR 86 HB THR 86 18.123 -11.281 8.103 673 HG1 THR 86 HG1 THR 86 20.397 -10.956 6.411 674 1HG2 THR 86 HG21 THR 86 20.096 -10.557 9.397 675 2HG2 THR 86 HG22 THR 86 21.046 -11.848 8.661 676 3HG2 THR 86 HG23 THR 86 19.694 -12.243 9.724 677 H THR 87 HN THR 87 20.047 -14.774 8.587 678 HA THR 87 HA THR 87 17.478 -15.491 9.786 679 HB THR 87 HB THR 87 19.965 -17.201 9.540 680 HG1 THR 87 HG1 THR 87 18.216 -16.568 7.640 681 1HG2 THR 87 HG21 THR 87 18.437 -19.004 10.135 682 2HG2 THR 87 HG22 THR 87 17.118 -17.840 10.248 683 3HG2 THR 87 HG23 THR 87 18.468 -17.755 11.381 684 H MET 88 HN MET 88 17.366 -14.877 11.885 685 HA MET 88 HA MET 88 19.902 -14.370 13.273 686 1HB MET 88 HB2 MET 88 18.773 -12.293 12.738 687 2HB MET 88 HB1 MET 88 17.292 -12.881 13.473 688 1HG MET 88 HG2 MET 88 18.291 -12.829 15.649 689 2HG MET 88 HG1 MET 88 19.861 -12.416 14.968 690 1HE MET 88 HE1 MET 88 16.175 -11.251 15.474 691 2HE MET 88 HE2 MET 88 16.389 -10.966 13.743 692 3HE MET 88 HE3 MET 88 16.216 -9.607 14.852 693 H HIS 89 HN HIS 89 20.136 -14.980 15.404 694 HA HIS 89 HA HIS 89 18.357 -17.097 16.193 695 1HB HIS 89 HB2 HIS 89 21.002 -16.183 17.261 696 2HB HIS 89 HB1 HIS 89 19.983 -17.281 18.174 697 HD1 HIS 89 HD1 HIS 89 22.682 -17.313 15.897 698 HD2 HIS 89 HD2 HIS 89 19.318 -19.659 16.458 699 HE1 HIS 89 HE1 HIS 89 23.226 -19.529 14.849 700 HE2 HIS 89 HE2 HIS 89 21.367 -20.974 15.690 701 H VAL 90 HN VAL 90 17.127 -17.218 17.843 702 HA VAL 90 HA VAL 90 16.798 -14.888 19.643 703 HB VAL 90 HB VAL 90 14.761 -16.992 18.825 704 1HG1 VAL 90 HG11 VAL 90 14.436 -16.196 21.092 705 2HG1 VAL 90 HG12 VAL 90 13.151 -15.601 20.042 706 3HG1 VAL 90 HG13 VAL 90 14.463 -14.527 20.526 707 1HG2 VAL 90 HG21 VAL 90 15.159 -15.478 16.973 708 2HG2 VAL 90 HG22 VAL 90 14.904 -14.089 18.033 709 3HG2 VAL 90 HG23 VAL 90 13.567 -15.181 17.677 710 H ILE 91 HN ILE 91 17.437 -15.175 21.466 711 HA ILE 91 HA ILE 91 17.742 -17.897 22.389 712 HB ILE 91 HB ILE 91 19.125 -15.375 23.003 713 1HG1 ILE 91 HG12 ILE 91 20.025 -18.044 21.932 714 2HG1 ILE 91 HG11 ILE 91 20.033 -16.480 21.132 715 1HG2 ILE 91 HG21 ILE 91 19.402 -18.004 24.572 716 2HG2 ILE 91 HG22 ILE 91 18.765 -16.495 25.216 717 3HG2 ILE 91 HG23 ILE 91 20.473 -16.620 24.794 718 1HD1 ILE 91 HD11 ILE 91 21.828 -17.387 23.367 719 2HD1 ILE 91 HD12 ILE 91 21.861 -15.778 22.681 720 3HD1 ILE 91 HD13 ILE 91 22.282 -17.172 21.681 721 H ILE 92 HN ILE 92 16.886 -18.597 24.181 722 HA ILE 92 HA ILE 92 14.514 -17.177 25.018 723 HB ILE 92 HB ILE 92 15.520 -19.941 25.685 724 1HG1 ILE 92 HG12 ILE 92 15.129 -19.746 23.293 725 2HG1 ILE 92 HG11 ILE 92 13.887 -20.754 24.024 726 1HG2 ILE 92 HG21 ILE 92 12.796 -18.730 26.031 727 2HG2 ILE 92 HG22 ILE 92 13.946 -19.097 27.323 728 3HG2 ILE 92 HG23 ILE 92 13.241 -20.405 26.368 729 1HD1 ILE 92 HD11 ILE 92 12.972 -19.289 22.344 730 2HD1 ILE 92 HD12 ILE 92 13.602 -17.875 23.189 731 3HD1 ILE 92 HD13 ILE 92 12.338 -18.860 23.932 732 H GLN 93 HN GLN 93 14.900 -15.731 26.611 733 HA GLN 93 HA GLN 93 16.379 -16.773 28.896 734 1HB GLN 93 HB2 GLN 93 16.130 -13.904 27.981 735 2HB GLN 93 HB1 GLN 93 16.922 -14.414 29.469 736 1HG GLN 93 HG2 GLN 93 18.553 -15.686 28.116 737 2HG GLN 93 HG1 GLN 93 17.773 -15.081 26.656 738 1HE2 GLN 93 HE21 GLN 93 19.661 -14.047 25.971 739 2HE2 GLN 93 HE22 GLN 93 20.222 -12.603 26.720 740 H ALA 94 HN ALA 94 15.027 -17.324 30.368 741 HA ALA 94 HA ALA 94 12.413 -16.047 30.494 742 1HB ALA 94 HB1 ALA 94 12.471 -18.487 30.327 743 2HB ALA 94 HB2 ALA 94 11.757 -17.973 31.860 744 3HB ALA 94 HB3 ALA 94 13.417 -18.566 31.812 745 HA PRO 95 HA PRO 95 13.739 -13.871 34.170 746 1HB PRO 95 HB2 PRO 95 11.345 -12.807 34.792 747 2HB PRO 95 HB1 PRO 95 12.347 -12.172 33.488 748 1HG PRO 95 HG2 PRO 95 9.971 -13.998 33.335 749 2HG PRO 95 HG1 PRO 95 10.397 -12.637 32.278 750 1HD PRO 95 HD2 PRO 95 10.806 -15.246 31.656 751 2HD PRO 95 HD1 PRO 95 11.823 -13.925 31.038 752 H VAL 96 HN VAL 96 13.480 -14.032 36.402 753 HA VAL 96 HA VAL 96 12.360 -16.520 37.325 754 HB VAL 96 HB VAL 96 13.650 -14.294 38.897 755 1HG1 VAL 96 HG11 VAL 96 12.223 -15.683 40.323 756 2HG1 VAL 96 HG12 VAL 96 13.920 -15.970 40.700 757 3HG1 VAL 96 HG13 VAL 96 13.024 -17.138 39.729 758 1HG2 VAL 96 HG21 VAL 96 15.645 -15.723 38.953 759 2HG2 VAL 96 HG22 VAL 96 15.173 -15.322 37.295 760 3HG2 VAL 96 HG23 VAL 96 14.809 -16.910 37.956 761 H THR 97 HN THR 97 10.268 -16.594 37.430 762 HA THR 97 HA THR 97 8.150 -16.187 37.770 763 HB THR 97 HB THR 97 9.231 -14.750 40.155 764 HG1 THR 97 HG1 THR 97 8.076 -17.292 40.271 765 1HG2 THR 97 HG21 THR 97 7.022 -15.193 41.216 766 2HG2 THR 97 HG22 THR 97 6.445 -15.865 39.691 767 3HG2 THR 97 HG23 THR 97 6.859 -14.153 39.798 768 H GLU 98 HN GLU 98 7.807 -15.041 35.959 769 HA GLU 98 HA GLU 98 6.670 -12.478 36.261 770 1HB GLU 98 HB2 GLU 98 9.038 -11.804 36.064 771 2HB GLU 98 HB1 GLU 98 9.195 -12.744 34.595 772 1HG GLU 98 HG2 GLU 98 8.982 -10.357 34.140 773 2HG GLU 98 HG1 GLU 98 7.642 -11.273 33.454 774 H LYS 99 HN LYS 99 5.242 -12.149 34.577 775 HA LYS 99 HA LYS 99 5.238 -13.564 32.222 776 1HB LYS 99 HB2 LYS 99 4.803 -15.561 33.427 777 2HB LYS 99 HB1 LYS 99 3.621 -14.774 34.456 778 1HG LYS 99 HG2 LYS 99 2.169 -14.496 32.445 779 2HG LYS 99 HG1 LYS 99 3.332 -15.465 31.543 780 1HD LYS 99 HD2 LYS 99 2.928 -17.366 32.886 781 2HD LYS 99 HD1 LYS 99 2.013 -16.430 34.068 782 1HE LYS 99 HE2 LYS 99 0.320 -15.964 32.361 783 2HE LYS 99 HE1 LYS 99 1.236 -16.925 31.204 784 1HZ LYS 99 HZ1 LYS 99 0.068 -17.972 33.722 785 2HZ LYS 99 HZ2 LYS 99 0.873 -18.860 32.515 786 3HZ LYS 99 HZ3 LYS 99 -0.606 -18.146 32.177 787 H GLU 100 HN GLU 100 4.305 -11.934 31.091 788 HA GLU 100 HA GLU 100 3.023 -10.121 30.579 789 1HB GLU 100 HB2 GLU 100 1.971 -12.084 29.566 790 2HB GLU 100 HB1 GLU 100 1.019 -12.349 31.005 791 1HG GLU 100 HG2 GLU 100 -0.254 -11.459 29.149 792 2HG GLU 100 HG1 GLU 100 -0.270 -10.399 30.554 793 H LYS 101 HN LYS 101 0.275 -11.118 32.597 794 HA LYS 101 HA LYS 101 1.134 -10.088 34.922 795 1HB LYS 101 HB2 LYS 101 -0.002 -8.024 35.405 796 2HB LYS 101 HB1 LYS 101 0.876 -7.796 33.933 797 1HG LYS 101 HG2 LYS 101 -2.130 -8.126 34.181 798 2HG LYS 101 HG1 LYS 101 -1.280 -6.605 34.051 799 1HD LYS 101 HD2 LYS 101 -2.094 -6.947 31.911 800 2HD LYS 101 HD1 LYS 101 -0.454 -7.569 31.787 801 1HE LYS 101 HE2 LYS 101 -1.272 -9.816 32.075 802 2HE LYS 101 HE1 LYS 101 -2.907 -9.219 32.289 803 1HZ LYS 101 HZ1 LYS 101 -2.846 -8.294 30.075 804 2HZ LYS 101 HZ2 LYS 101 -2.627 -9.950 30.029 805 3HZ LYS 101 HZ3 LYS 101 -1.291 -8.899 29.822 Start of MODEL 2 1 H GLU 1 HT1 GLU 1 2.870 -8.814 4.200 2 HA GLU 1 HA GLU 1 2.144 -7.071 2.739 3 1HB GLU 1 HB2 GLU 1 0.787 -7.880 4.760 4 2HB GLU 1 HB1 GLU 1 1.420 -6.511 5.636 5 1HG GLU 1 HG2 GLU 1 -0.326 -6.325 3.176 6 2HG GLU 1 HG1 GLU 1 -0.898 -6.205 4.829 7 H ALA 2 HN ALA 2 3.363 -5.510 1.829 8 HA ALA 2 HA ALA 2 3.686 -3.008 2.993 9 1HB ALA 2 HB1 ALA 2 6.130 -2.928 3.166 10 2HB ALA 2 HB2 ALA 2 6.220 -4.652 2.815 11 3HB ALA 2 HB3 ALA 2 5.460 -4.095 4.309 12 H GLU 3 HN GLU 3 5.090 -1.654 1.498 13 HA GLU 3 HA GLU 3 4.623 -2.435 -1.144 14 1HB GLU 3 HB2 GLU 3 6.050 -0.016 -0.025 15 2HB GLU 3 HB1 GLU 3 5.631 -0.238 -1.716 16 1HG GLU 3 HG2 GLU 3 3.268 -0.228 -1.161 17 2HG GLU 3 HG1 GLU 3 3.661 -0.087 0.553 18 H VAL 4 HN VAL 4 5.909 -4.259 -1.285 19 HA VAL 4 HA VAL 4 8.707 -4.121 -0.634 20 HB VAL 4 HB VAL 4 7.211 -6.362 -1.871 21 1HG1 VAL 4 HG11 VAL 4 9.849 -6.351 -0.416 22 2HG1 VAL 4 HG12 VAL 4 9.588 -6.601 -2.139 23 3HG1 VAL 4 HG13 VAL 4 9.021 -7.803 -0.980 24 1HG2 VAL 4 HG21 VAL 4 7.704 -5.874 1.066 25 2HG2 VAL 4 HG22 VAL 4 7.041 -7.366 0.399 26 3HG2 VAL 4 HG23 VAL 4 6.145 -5.856 0.243 27 H HIS 5 HN HIS 5 10.014 -3.569 -1.916 28 HA HIS 5 HA HIS 5 9.971 -4.309 -4.743 29 1HB HIS 5 HB2 HIS 5 10.744 -1.552 -3.711 30 2HB HIS 5 HB1 HIS 5 11.025 -2.106 -5.354 31 HD1 HIS 5 HD1 HIS 5 8.647 -0.228 -3.409 32 HD2 HIS 5 HD2 HIS 5 8.417 -2.805 -6.659 33 HE1 HIS 5 HE1 HIS 5 6.429 0.218 -4.483 34 HE2 HIS 5 HE2 HIS 5 6.531 -1.056 -6.616 35 H ASN 6 HN ASN 6 11.898 -2.839 -2.150 36 HA ASN 6 HA ASN 6 13.688 -5.028 -2.373 37 1HB ASN 6 HB2 ASN 6 15.762 -3.631 -2.452 38 2HB ASN 6 HB1 ASN 6 14.808 -3.530 -3.919 39 1HD2 ASN 6 HD21 ASN 6 13.839 -1.577 -4.446 40 2HD2 ASN 6 HD22 ASN 6 14.272 -0.098 -3.660 41 H GLN 7 HN GLN 7 13.175 -5.794 -0.364 42 HA GLN 7 HA GLN 7 14.433 -4.430 1.701 43 1HB GLN 7 HB2 GLN 7 12.443 -4.997 3.141 44 2HB GLN 7 HB1 GLN 7 12.325 -3.512 2.199 45 1HG GLN 7 HG2 GLN 7 10.958 -4.838 0.571 46 2HG GLN 7 HG1 GLN 7 10.998 -6.185 1.708 47 1HE2 GLN 7 HE21 GLN 7 9.739 -3.005 1.060 48 2HE2 GLN 7 HE22 GLN 7 8.578 -3.002 2.327 49 H LEU 8 HN LEU 8 14.610 -5.974 3.546 50 HA LEU 8 HA LEU 8 15.487 -8.393 2.191 51 1HB LEU 8 HB2 LEU 8 16.372 -7.151 4.773 52 2HB LEU 8 HB1 LEU 8 16.906 -8.714 4.232 53 HG LEU 8 HG LEU 8 17.951 -7.625 2.224 54 1HD1 LEU 8 HD11 LEU 8 16.620 -5.611 2.074 55 2HD1 LEU 8 HD12 LEU 8 18.333 -5.215 2.211 56 3HD1 LEU 8 HD13 LEU 8 17.272 -5.040 3.607 57 1HD2 LEU 8 HD21 LEU 8 19.291 -8.164 4.172 58 2HD2 LEU 8 HD22 LEU 8 18.890 -6.605 4.896 59 3HD2 LEU 8 HD23 LEU 8 19.856 -6.671 3.424 60 H GLU 9 HN GLU 9 15.010 -10.383 2.802 61 HA GLU 9 HA GLU 9 12.690 -10.639 4.527 62 1HB GLU 9 HB2 GLU 9 14.055 -12.743 2.898 63 2HB GLU 9 HB1 GLU 9 12.501 -12.851 3.673 64 1HG GLU 9 HG2 GLU 9 11.590 -11.109 2.215 65 2HG GLU 9 HG1 GLU 9 13.143 -10.990 1.393 66 H ILE 10 HN ILE 10 12.809 -11.215 6.406 67 HA ILE 10 HA ILE 10 15.249 -12.479 7.467 68 HB ILE 10 HB ILE 10 13.316 -10.677 8.980 69 1HG1 ILE 10 HG12 ILE 10 16.130 -10.094 7.971 70 2HG1 ILE 10 HG11 ILE 10 14.651 -9.422 7.298 71 1HG2 ILE 10 HG21 ILE 10 15.963 -11.876 9.813 72 2HG2 ILE 10 HG22 ILE 10 14.370 -12.338 10.411 73 3HG2 ILE 10 HG23 ILE 10 15.011 -10.732 10.760 74 1HD1 ILE 10 HD11 ILE 10 14.237 -8.261 9.410 75 2HD1 ILE 10 HD12 ILE 10 15.797 -7.820 8.713 76 3HD1 ILE 10 HD13 ILE 10 15.723 -8.946 10.070 77 H LYS 11 HN LYS 11 14.998 -14.273 8.491 78 HA LYS 11 HA LYS 11 12.296 -15.067 9.301 79 1HB LYS 11 HB2 LYS 11 12.914 -17.409 9.036 80 2HB LYS 11 HB1 LYS 11 13.062 -16.560 7.507 81 1HG LYS 11 HG2 LYS 11 15.476 -16.491 7.755 82 2HG LYS 11 HG1 LYS 11 15.340 -17.238 9.348 83 1HD LYS 11 HD2 LYS 11 14.503 -18.507 6.735 84 2HD LYS 11 HD1 LYS 11 15.983 -18.878 7.627 85 1HE LYS 11 HE2 LYS 11 14.614 -19.619 9.544 86 2HE LYS 11 HE1 LYS 11 13.155 -19.289 8.617 87 1HZ LYS 11 HZ1 LYS 11 13.659 -21.575 8.566 88 2HZ LYS 11 HZ2 LYS 11 15.217 -21.327 7.993 89 3HZ LYS 11 HZ3 LYS 11 13.884 -20.977 7.010 90 H PHE 12 HN PHE 12 12.110 -16.078 11.281 91 HA PHE 12 HA PHE 12 14.263 -15.314 13.110 92 1HB PHE 12 HB2 PHE 12 11.374 -15.973 13.667 93 2HB PHE 12 HB1 PHE 12 12.549 -15.424 14.849 94 HD1 PHE 12 HD1 PHE 12 13.458 -13.105 14.677 95 HD2 PHE 12 HD2 PHE 12 10.199 -14.460 12.299 96 HE1 PHE 12 HE1 PHE 12 12.821 -10.774 14.225 97 HE2 PHE 12 HE2 PHE 12 9.558 -12.137 11.843 98 HZ PHE 12 HZ PHE 12 10.868 -10.289 12.805 99 H ARG 13 HN ARG 13 15.375 -16.841 14.151 100 HA ARG 13 HA ARG 13 14.215 -19.527 14.184 101 1HB ARG 13 HB2 ARG 13 16.184 -19.440 12.721 102 2HB ARG 13 HB1 ARG 13 17.147 -18.804 14.048 103 1HG ARG 13 HG2 ARG 13 16.870 -20.842 15.290 104 2HG ARG 13 HG1 ARG 13 15.784 -21.480 14.061 105 1HD ARG 13 HD2 ARG 13 17.603 -21.417 12.430 106 2HD ARG 13 HD1 ARG 13 18.687 -20.786 13.673 107 HE ARG 13 HE ARG 13 18.144 -22.880 14.906 108 1HH1 ARG 13 HH11 ARG 13 18.149 -22.764 11.357 109 2HH1 ARG 13 HH12 ARG 13 18.529 -24.410 11.174 110 1HH2 ARG 13 HH21 ARG 13 18.690 -25.161 14.621 111 2HH2 ARG 13 HH22 ARG 13 18.853 -25.776 13.039 112 H LEU 14 HN LEU 14 13.709 -20.216 16.070 113 HA LEU 14 HA LEU 14 14.328 -18.707 18.471 114 1HB LEU 14 HB2 LEU 14 12.807 -21.277 18.098 115 2HB LEU 14 HB1 LEU 14 12.885 -20.337 19.563 116 HG LEU 14 HG LEU 14 10.751 -19.961 18.658 117 1HD1 LEU 14 HD11 LEU 14 11.727 -17.927 19.455 118 2HD1 LEU 14 HD12 LEU 14 10.623 -17.633 18.119 119 3HD1 LEU 14 HD13 LEU 14 12.360 -17.591 17.841 120 1HD2 LEU 14 HD21 LEU 14 11.074 -20.816 16.408 121 2HD2 LEU 14 HD22 LEU 14 11.982 -19.364 15.971 122 3HD2 LEU 14 HD23 LEU 14 10.270 -19.249 16.381 123 H THR 15 HN THR 15 14.936 -19.745 20.416 124 HA THR 15 HA THR 15 17.515 -20.827 20.167 125 HB THR 15 HB THR 15 15.827 -20.917 22.577 126 HG1 THR 15 HG1 THR 15 16.586 -18.692 21.077 127 1HG2 THR 15 HG21 THR 15 17.972 -20.389 23.685 128 2HG2 THR 15 HG22 THR 15 18.718 -20.373 22.078 129 3HG2 THR 15 HG23 THR 15 18.039 -21.877 22.721 130 H ASP 16 HN ASP 16 14.376 -22.239 20.377 131 HA ASP 16 HA ASP 16 15.198 -24.798 21.391 132 1HB ASP 16 HB2 ASP 16 12.602 -23.861 20.183 133 2HB ASP 16 HB1 ASP 16 12.866 -25.487 20.795 134 H GLY 17 HN GLY 17 15.653 -23.417 18.458 135 1HA GLY 17 HA2 GLY 17 16.652 -24.509 16.617 136 2HA GLY 17 HA1 GLY 17 16.105 -26.046 17.268 137 H SER 18 HN SER 18 13.725 -23.695 17.232 138 HA SER 18 HA SER 18 12.462 -24.879 14.874 139 1HB SER 18 HB2 SER 18 11.298 -23.154 17.073 140 2HB SER 18 HB1 SER 18 10.405 -24.090 15.871 141 HG SER 18 HG SER 18 11.580 -25.956 16.823 142 H ASP 19 HN ASP 19 11.603 -23.298 13.230 143 HA ASP 19 HA ASP 19 12.534 -20.598 13.666 144 1HB ASP 19 HB2 ASP 19 13.217 -20.483 11.387 145 2HB ASP 19 HB1 ASP 19 14.187 -21.699 12.220 146 H ILE 20 HN ILE 20 11.486 -19.067 12.407 147 HA ILE 20 HA ILE 20 8.752 -19.792 11.611 148 HB ILE 20 HB ILE 20 9.874 -17.138 12.605 149 1HG1 ILE 20 HG12 ILE 20 7.937 -19.065 13.918 150 2HG1 ILE 20 HG11 ILE 20 9.617 -18.826 14.374 151 1HG2 ILE 20 HG21 ILE 20 8.126 -16.764 10.961 152 2HG2 ILE 20 HG22 ILE 20 7.557 -16.319 12.573 153 3HG2 ILE 20 HG23 ILE 20 7.037 -17.838 11.840 154 1HD1 ILE 20 HD11 ILE 20 9.105 -16.522 15.021 155 2HD1 ILE 20 HD12 ILE 20 8.106 -17.682 15.900 156 3HD1 ILE 20 HD13 ILE 20 7.422 -16.769 14.555 157 H GLY 21 HN GLY 21 8.046 -19.109 9.606 158 1HA GLY 21 HA2 GLY 21 9.863 -19.015 7.514 159 2HA GLY 21 HA1 GLY 21 8.171 -18.570 7.400 160 HA PRO 22 HA PRO 22 11.322 -14.896 7.197 161 1HB PRO 22 HB2 PRO 22 11.766 -14.794 4.497 162 2HB PRO 22 HB1 PRO 22 12.858 -15.565 5.649 163 1HG PRO 22 HG2 PRO 22 10.843 -16.784 3.828 164 2HG PRO 22 HG1 PRO 22 12.425 -17.391 4.337 165 1HD PRO 22 HD2 PRO 22 10.068 -18.297 5.351 166 2HD PRO 22 HD1 PRO 22 11.598 -18.319 6.251 167 H LYS 23 HN LYS 23 10.701 -12.903 6.743 168 HA LYS 23 HA LYS 23 8.407 -12.414 4.996 169 1HB LYS 23 HB2 LYS 23 7.792 -12.672 7.526 170 2HB LYS 23 HB1 LYS 23 8.715 -11.210 7.787 171 1HG LYS 23 HG2 LYS 23 6.324 -11.316 5.946 172 2HG LYS 23 HG1 LYS 23 6.171 -11.027 7.665 173 1HD LYS 23 HD2 LYS 23 7.839 -9.324 5.827 174 2HD LYS 23 HD1 LYS 23 6.145 -8.982 6.190 175 1HE LYS 23 HE2 LYS 23 6.778 -8.852 8.596 176 2HE LYS 23 HE1 LYS 23 8.463 -9.071 8.127 177 1HZ LYS 23 HZ1 LYS 23 6.711 -6.830 7.281 178 2HZ LYS 23 HZ2 LYS 23 8.298 -7.012 6.806 179 3HZ LYS 23 HZ3 LYS 23 7.921 -6.719 8.434 180 H ALA 24 HN ALA 24 8.560 -10.109 4.191 181 HA ALA 24 HA ALA 24 11.365 -9.331 4.160 182 1HB ALA 24 HB1 ALA 24 10.078 -9.505 2.014 183 2HB ALA 24 HB2 ALA 24 10.887 -7.984 2.252 184 3HB ALA 24 HB3 ALA 24 9.140 -8.095 2.518 185 H PHE 25 HN PHE 25 12.220 -7.716 5.189 186 HA PHE 25 HA PHE 25 10.481 -5.694 6.470 187 1HB PHE 25 HB2 PHE 25 13.106 -6.785 7.522 188 2HB PHE 25 HB1 PHE 25 12.068 -5.616 8.301 189 HD1 PHE 25 HD1 PHE 25 12.267 -9.117 7.202 190 HD2 PHE 25 HD2 PHE 25 10.491 -6.352 9.880 191 HE1 PHE 25 HE1 PHE 25 11.330 -10.971 8.471 192 HE2 PHE 25 HE2 PHE 25 9.534 -8.226 11.163 193 HZ PHE 25 HZ PHE 25 10.009 -10.581 10.399 194 HA PRO 26 HA PRO 26 13.497 -3.031 4.324 195 1HB PRO 26 HB2 PRO 26 12.645 -1.148 6.455 196 2HB PRO 26 HB1 PRO 26 12.692 -0.857 4.724 197 1HG PRO 26 HG2 PRO 26 10.367 -1.191 5.950 198 2HG PRO 26 HG1 PRO 26 10.645 -1.976 4.383 199 1HD PRO 26 HD2 PRO 26 10.747 -3.173 7.133 200 2HD PRO 26 HD1 PRO 26 10.044 -3.826 5.634 201 H ASP 27 HN ASP 27 15.637 -2.889 4.904 202 HA ASP 27 HA ASP 27 16.404 -3.761 7.489 203 1HB ASP 27 HB2 ASP 27 18.717 -3.460 6.769 204 2HB ASP 27 HB1 ASP 27 17.755 -4.292 5.542 205 H ALA 28 HN ALA 28 15.587 -0.844 6.291 206 HA ALA 28 HA ALA 28 16.999 0.759 8.252 207 1HB ALA 28 HB1 ALA 28 14.627 1.531 6.556 208 2HB ALA 28 HB2 ALA 28 16.323 1.747 6.114 209 3HB ALA 28 HB3 ALA 28 15.647 2.635 7.477 210 H THR 29 HN THR 29 14.506 -1.388 8.599 211 HA THR 29 HA THR 29 12.768 0.074 10.329 212 HB THR 29 HB THR 29 12.078 -2.055 9.051 213 HG1 THR 29 HG1 THR 29 11.451 -2.578 11.706 214 1HG2 THR 29 HG21 THR 29 13.494 -3.390 11.379 215 2HG2 THR 29 HG22 THR 29 13.987 -3.490 9.688 216 3HG2 THR 29 HG23 THR 29 12.461 -4.207 10.207 217 H THR 30 HN THR 30 12.573 0.021 12.570 218 HA THR 30 HA THR 30 14.931 -0.159 14.053 219 HB THR 30 HB THR 30 13.411 -0.033 16.028 220 HG1 THR 30 HG1 THR 30 11.134 0.400 15.366 221 1HG2 THR 30 HG21 THR 30 12.813 1.910 13.797 222 2HG2 THR 30 HG22 THR 30 14.170 2.002 14.919 223 3HG2 THR 30 HG23 THR 30 12.521 2.194 15.515 224 H VAL 31 HN VAL 31 15.653 -1.753 15.478 225 HA VAL 31 HA VAL 31 14.983 -4.439 14.911 226 HB VAL 31 HB VAL 31 16.445 -3.311 17.326 227 1HG1 VAL 31 HG11 VAL 31 16.441 -6.110 16.188 228 2HG1 VAL 31 HG12 VAL 31 15.667 -5.601 17.687 229 3HG1 VAL 31 HG13 VAL 31 17.424 -5.544 17.540 230 1HG2 VAL 31 HG21 VAL 31 17.537 -4.342 14.705 231 2HG2 VAL 31 HG22 VAL 31 18.500 -3.827 16.098 232 3HG2 VAL 31 HG23 VAL 31 17.510 -2.660 15.232 233 H SER 32 HN SER 32 13.799 -2.058 17.105 234 HA SER 32 HA SER 32 12.390 -3.642 18.915 235 1HB SER 32 HB2 SER 32 12.700 -1.196 19.162 236 2HB SER 32 HB1 SER 32 11.651 -0.932 17.778 237 HG SER 32 HG SER 32 10.321 -0.718 19.373 238 H ALA 33 HN ALA 33 11.340 -2.213 15.773 239 HA ALA 33 HA ALA 33 8.785 -3.408 15.811 240 1HB ALA 33 HB1 ALA 33 8.653 -2.742 13.465 241 2HB ALA 33 HB2 ALA 33 10.388 -2.431 13.447 242 3HB ALA 33 HB3 ALA 33 9.326 -1.439 14.444 243 H LEU 34 HN LEU 34 11.940 -4.509 14.664 244 HA LEU 34 HA LEU 34 11.165 -6.649 13.128 245 1HB LEU 34 HB2 LEU 34 13.352 -5.717 13.039 246 2HB LEU 34 HB1 LEU 34 13.555 -5.902 14.767 247 HG LEU 34 HG LEU 34 13.697 -8.194 14.574 248 1HD1 LEU 34 HD11 LEU 34 13.875 -9.308 12.286 249 2HD1 LEU 34 HD12 LEU 34 13.468 -7.754 11.553 250 3HD1 LEU 34 HD13 LEU 34 12.286 -8.592 12.556 251 1HD2 LEU 34 HD21 LEU 34 15.727 -6.966 14.434 252 2HD2 LEU 34 HD22 LEU 34 15.548 -6.756 12.693 253 3HD2 LEU 34 HD23 LEU 34 15.867 -8.357 13.361 254 H LYS 35 HN LYS 35 12.049 -6.382 16.550 255 HA LYS 35 HA LYS 35 11.558 -9.146 17.125 256 1HB LYS 35 HB2 LYS 35 13.087 -7.570 18.377 257 2HB LYS 35 HB1 LYS 35 11.652 -6.844 19.063 258 1HG LYS 35 HG2 LYS 35 11.012 -9.051 20.002 259 2HG LYS 35 HG1 LYS 35 12.546 -9.696 19.420 260 1HD LYS 35 HD2 LYS 35 12.184 -7.473 21.440 261 2HD LYS 35 HD1 LYS 35 12.705 -9.114 21.768 262 1HE LYS 35 HE2 LYS 35 14.734 -8.752 20.474 263 2HE LYS 35 HE1 LYS 35 14.204 -7.116 20.070 264 1HZ LYS 35 HZ1 LYS 35 15.759 -7.101 21.939 265 2HZ LYS 35 HZ2 LYS 35 14.736 -8.142 22.793 266 3HZ LYS 35 HZ3 LYS 35 14.229 -6.595 22.447 267 H GLU 36 HN GLU 36 9.735 -6.146 17.630 268 HA GLU 36 HA GLU 36 7.549 -7.238 18.952 269 1HB GLU 36 HB2 GLU 36 7.794 -4.897 17.092 270 2HB GLU 36 HB1 GLU 36 6.271 -5.297 17.860 271 1HG GLU 36 HG2 GLU 36 8.787 -4.846 19.424 272 2HG GLU 36 HG1 GLU 36 7.714 -3.530 18.962 273 H THR 37 HN THR 37 8.337 -7.299 15.538 274 HA THR 37 HA THR 37 5.851 -8.261 14.663 275 HB THR 37 HB THR 37 8.606 -8.693 13.449 276 HG1 THR 37 HG1 THR 37 8.136 -6.532 13.395 277 1HG2 THR 37 HG21 THR 37 6.988 -10.352 12.609 278 2HG2 THR 37 HG22 THR 37 7.396 -9.186 11.350 279 3HG2 THR 37 HG23 THR 37 5.862 -9.054 12.212 280 H VAL 38 HN VAL 38 8.783 -9.957 15.840 281 HA VAL 38 HA VAL 38 7.670 -12.538 15.362 282 HB VAL 38 HB VAL 38 10.190 -11.989 15.736 283 1HG1 VAL 38 HG11 VAL 38 10.155 -10.846 17.784 284 2HG1 VAL 38 HG12 VAL 38 11.129 -12.308 17.934 285 3HG1 VAL 38 HG13 VAL 38 9.502 -12.257 18.614 286 1HG2 VAL 38 HG21 VAL 38 10.690 -14.243 16.590 287 2HG2 VAL 38 HG22 VAL 38 9.423 -14.253 15.364 288 3HG2 VAL 38 HG23 VAL 38 9.002 -14.420 17.067 289 H ILE 39 HN ILE 39 7.727 -10.363 18.005 290 HA ILE 39 HA ILE 39 6.538 -12.006 19.987 291 HB ILE 39 HB ILE 39 6.155 -8.990 19.749 292 1HG1 ILE 39 HG12 ILE 39 8.545 -9.509 19.719 293 2HG1 ILE 39 HG11 ILE 39 8.098 -8.745 21.234 294 1HG2 ILE 39 HG21 ILE 39 5.897 -9.064 22.212 295 2HG2 ILE 39 HG22 ILE 39 6.000 -10.820 22.147 296 3HG2 ILE 39 HG23 ILE 39 4.658 -9.985 21.362 297 1HD1 ILE 39 HD11 ILE 39 8.565 -11.679 20.796 298 2HD1 ILE 39 HD12 ILE 39 8.132 -10.912 22.333 299 3HD1 ILE 39 HD13 ILE 39 9.672 -10.536 21.557 300 H SER 40 HN SER 40 5.151 -9.998 17.448 301 HA SER 40 HA SER 40 2.443 -10.382 18.248 302 1HB SER 40 HB2 SER 40 3.556 -9.528 15.562 303 2HB SER 40 HB1 SER 40 1.878 -9.368 16.085 304 HG SER 40 HG SER 40 4.179 -8.048 17.030 305 H GLU 41 HN GLU 41 4.600 -12.001 15.866 306 HA GLU 41 HA GLU 41 2.691 -13.654 14.727 307 1HB GLU 41 HB2 GLU 41 5.667 -13.818 15.019 308 2HB GLU 41 HB1 GLU 41 4.721 -14.976 14.109 309 1HG GLU 41 HG2 GLU 41 4.865 -12.023 13.572 310 2HG GLU 41 HG1 GLU 41 5.724 -13.274 12.669 311 H TRP 42 HN TRP 42 4.671 -13.909 17.570 312 HA TRP 42 HA TRP 42 4.463 -16.643 18.058 313 1HB TRP 42 HB2 TRP 42 5.973 -14.859 19.113 314 2HB TRP 42 HB1 TRP 42 4.613 -14.494 20.159 315 HD1 TRP 42 HD1 TRP 42 4.435 -15.969 22.346 316 HE1 TRP 42 HE1 TRP 42 5.759 -17.934 23.248 317 HE3 TRP 42 HE3 TRP 42 7.053 -17.144 18.123 318 HZ2 TRP 42 HZ2 TRP 42 7.614 -19.855 22.261 319 HZ3 TRP 42 HZ3 TRP 42 8.560 -19.088 18.180 320 HH2 TRP 42 HH2 TRP 42 8.829 -20.410 20.211 321 HA PRO 43 HA PRO 43 0.063 -16.859 18.685 322 1HB PRO 43 HB2 PRO 43 0.740 -19.252 20.298 323 2HB PRO 43 HB1 PRO 43 -0.349 -19.094 18.921 324 1HG PRO 43 HG2 PRO 43 2.048 -20.259 18.695 325 2HG PRO 43 HG1 PRO 43 1.336 -19.306 17.382 326 1HD PRO 43 HD2 PRO 43 3.541 -18.618 19.256 327 2HD PRO 43 HD1 PRO 43 3.280 -18.144 17.562 328 H ARG 44 HN ARG 44 -1.299 -16.103 20.182 329 HA ARG 44 HA ARG 44 -0.388 -15.331 22.763 330 1HB ARG 44 HB2 ARG 44 -2.759 -14.635 23.205 331 2HB ARG 44 HB1 ARG 44 -2.104 -13.964 21.729 332 1HG ARG 44 HG2 ARG 44 -4.375 -14.559 21.303 333 2HG ARG 44 HG1 ARG 44 -3.373 -15.728 20.460 334 1HD ARG 44 HD2 ARG 44 -3.743 -17.314 22.339 335 2HD ARG 44 HD1 ARG 44 -4.815 -16.133 23.087 336 HE ARG 44 HE ARG 44 -5.820 -16.465 20.591 337 1HH1 ARG 44 HH11 ARG 44 -5.178 -18.649 23.311 338 2HH1 ARG 44 HH12 ARG 44 -6.336 -19.802 22.845 339 1HH2 ARG 44 HH21 ARG 44 -7.399 -18.008 19.966 340 2HH2 ARG 44 HH22 ARG 44 -7.637 -19.437 20.889 341 H GLU 45 HN GLU 45 -1.762 -18.103 21.463 342 HA GLU 45 HA GLU 45 -2.729 -19.356 23.818 343 1HB GLU 45 HB2 GLU 45 -3.538 -19.929 21.604 344 2HB GLU 45 HB1 GLU 45 -1.923 -20.385 21.101 345 1HG GLU 45 HG2 GLU 45 -1.959 -22.250 22.647 346 2HG GLU 45 HG1 GLU 45 -3.566 -21.780 23.195 347 H LYS 46 HN LYS 46 0.374 -18.903 22.371 348 HA LYS 46 HA LYS 46 1.619 -21.208 23.436 349 1HB LYS 46 HB2 LYS 46 2.488 -19.749 21.380 350 2HB LYS 46 HB1 LYS 46 2.866 -18.638 22.598 351 1HG LYS 46 HG2 LYS 46 4.856 -19.782 21.859 352 2HG LYS 46 HG1 LYS 46 4.559 -19.976 23.572 353 1HD LYS 46 HD2 LYS 46 3.850 -22.109 21.538 354 2HD LYS 46 HD1 LYS 46 5.447 -22.000 22.263 355 1HE LYS 46 HE2 LYS 46 4.314 -22.185 24.506 356 2HE LYS 46 HE1 LYS 46 2.818 -22.519 23.658 357 1HZ LYS 46 HZ1 LYS 46 5.275 -24.145 23.485 358 2HZ LYS 46 HZ2 LYS 46 3.818 -24.479 22.704 359 3HZ LYS 46 HZ3 LYS 46 3.904 -24.473 24.391 360 H GLU 47 HN GLU 47 2.628 -21.376 25.445 361 HA GLU 47 HA GLU 47 2.274 -19.658 27.534 362 1HB GLU 47 HB2 GLU 47 4.707 -21.407 27.109 363 2HB GLU 47 HB1 GLU 47 4.198 -20.741 28.629 364 1HG GLU 47 HG2 GLU 47 3.601 -23.071 28.602 365 2HG GLU 47 HG1 GLU 47 2.124 -22.117 28.531 366 H ASN 48 HN ASN 48 3.652 -18.104 28.502 367 HA ASN 48 HA ASN 48 4.790 -16.603 26.457 368 1HB ASN 48 HB2 ASN 48 3.825 -15.749 29.134 369 2HB ASN 48 HB1 ASN 48 4.984 -14.735 28.296 370 1HD2 ASN 48 HD21 ASN 48 2.545 -16.620 26.584 371 2HD2 ASN 48 HD22 ASN 48 1.617 -15.257 26.086 372 H GLY 49 HN GLY 49 6.413 -18.142 26.405 373 1HA GLY 49 HA2 GLY 49 8.750 -17.686 27.999 374 2HA GLY 49 HA1 GLY 49 8.782 -18.378 26.368 375 HA PRO 50 HA PRO 50 9.558 -14.287 24.566 376 1HB PRO 50 HB2 PRO 50 7.414 -15.294 22.738 377 2HB PRO 50 HB1 PRO 50 8.909 -14.510 22.269 378 1HG PRO 50 HG2 PRO 50 8.770 -17.059 21.974 379 2HG PRO 50 HG1 PRO 50 10.184 -16.403 22.840 380 1HD PRO 50 HD2 PRO 50 7.713 -17.674 23.988 381 2HD PRO 50 HD1 PRO 50 9.423 -17.989 24.382 382 H LYS 51 HN LYS 51 8.568 -13.162 26.227 383 HA LYS 51 HA LYS 51 5.665 -13.068 26.356 384 1HB LYS 51 HB2 LYS 51 7.062 -13.404 28.392 385 2HB LYS 51 HB1 LYS 51 7.728 -11.800 28.155 386 1HG LYS 51 HG2 LYS 51 5.499 -10.834 28.491 387 2HG LYS 51 HG1 LYS 51 4.845 -12.453 28.737 388 1HD LYS 51 HD2 LYS 51 6.384 -12.768 30.633 389 2HD LYS 51 HD1 LYS 51 6.975 -11.126 30.401 390 1HE LYS 51 HE2 LYS 51 4.693 -10.286 30.830 391 2HE LYS 51 HE1 LYS 51 4.165 -11.941 31.119 392 1HZ LYS 51 HZ1 LYS 51 6.238 -10.505 32.678 393 2HZ LYS 51 HZ2 LYS 51 5.722 -12.086 32.964 394 3HZ LYS 51 HZ3 LYS 51 4.666 -10.810 33.203 395 H THR 52 HN THR 52 8.261 -10.595 26.537 396 HA THR 52 HA THR 52 6.650 -8.915 24.783 397 HB THR 52 HB THR 52 7.399 -6.967 26.065 398 HG1 THR 52 HG1 THR 52 8.079 -7.667 28.363 399 1HG2 THR 52 HG21 THR 52 5.170 -7.888 26.528 400 2HG2 THR 52 HG22 THR 52 5.880 -7.247 28.008 401 3HG2 THR 52 HG23 THR 52 5.859 -8.984 27.725 402 H VAL 53 HN VAL 53 8.018 -7.061 24.020 403 HA VAL 53 HA VAL 53 10.276 -7.858 22.606 404 HB VAL 53 HB VAL 53 8.825 -5.940 22.017 405 1HG1 VAL 53 HG11 VAL 53 9.091 -3.755 23.084 406 2HG1 VAL 53 HG12 VAL 53 10.130 -4.493 24.302 407 3HG1 VAL 53 HG13 VAL 53 8.441 -4.974 24.183 408 1HG2 VAL 53 HG21 VAL 53 10.589 -4.355 21.290 409 2HG2 VAL 53 HG22 VAL 53 10.953 -6.027 20.923 410 3HG2 VAL 53 HG23 VAL 53 11.751 -5.234 22.291 411 H LYS 54 HN LYS 54 9.945 -6.644 25.827 412 HA LYS 54 HA LYS 54 12.675 -5.907 26.274 413 1HB LYS 54 HB2 LYS 54 10.873 -4.901 27.551 414 2HB LYS 54 HB1 LYS 54 10.382 -6.472 28.155 415 1HG LYS 54 HG2 LYS 54 12.570 -6.656 29.315 416 2HG LYS 54 HG1 LYS 54 12.944 -5.015 28.786 417 1HD LYS 54 HD2 LYS 54 10.995 -4.167 29.978 418 2HD LYS 54 HD1 LYS 54 10.563 -5.809 30.456 419 1HE LYS 54 HE2 LYS 54 12.678 -5.980 31.696 420 2HE LYS 54 HE1 LYS 54 13.065 -4.324 31.237 421 1HZ LYS 54 HZ1 LYS 54 10.721 -5.153 32.864 422 2HZ LYS 54 HZ2 LYS 54 11.101 -3.576 32.418 423 3HZ LYS 54 HZ3 LYS 54 12.113 -4.413 33.462 424 H GLU 55 HN GLU 55 10.679 -8.748 26.841 425 HA GLU 55 HA GLU 55 12.667 -10.048 28.461 426 1HB GLU 55 HB2 GLU 55 10.097 -11.150 27.323 427 2HB GLU 55 HB1 GLU 55 11.106 -11.940 28.527 428 1HG GLU 55 HG2 GLU 55 9.651 -9.319 28.875 429 2HG GLU 55 HG1 GLU 55 9.179 -10.870 29.562 430 H VAL 56 HN VAL 56 11.842 -10.056 25.142 431 HA VAL 56 HA VAL 56 13.411 -12.471 24.598 432 HB VAL 56 HB VAL 56 11.726 -10.752 22.756 433 1HG1 VAL 56 HG11 VAL 56 13.051 -13.419 22.244 434 2HG1 VAL 56 HG12 VAL 56 13.529 -11.878 21.537 435 3HG1 VAL 56 HG13 VAL 56 11.957 -12.578 21.145 436 1HG2 VAL 56 HG21 VAL 56 10.173 -12.631 22.825 437 2HG2 VAL 56 HG22 VAL 56 10.433 -11.936 24.426 438 3HG2 VAL 56 HG23 VAL 56 11.240 -13.443 23.968 439 H LYS 57 HN LYS 57 15.396 -12.425 23.596 440 HA LYS 57 HA LYS 57 16.360 -9.826 22.730 441 1HB LYS 57 HB2 LYS 57 17.808 -12.140 23.970 442 2HB LYS 57 HB1 LYS 57 18.655 -10.905 23.051 443 1HG LYS 57 HG2 LYS 57 17.819 -9.192 24.583 444 2HG LYS 57 HG1 LYS 57 16.956 -10.427 25.494 445 1HD LYS 57 HD2 LYS 57 19.014 -11.457 26.167 446 2HD LYS 57 HD1 LYS 57 19.939 -10.423 25.073 447 1HE LYS 57 HE2 LYS 57 20.104 -9.663 27.398 448 2HE LYS 57 HE1 LYS 57 19.334 -8.467 26.365 449 1HZ LYS 57 HZ1 LYS 57 18.188 -8.670 28.473 450 2HZ LYS 57 HZ2 LYS 57 17.911 -10.309 28.236 451 3HZ LYS 57 HZ3 LYS 57 17.172 -9.179 27.247 452 H LEU 58 HN LEU 58 17.563 -9.681 20.783 453 HA LEU 58 HA LEU 58 17.028 -11.932 18.987 454 1HB LEU 58 HB2 LEU 58 15.617 -9.725 18.831 455 2HB LEU 58 HB1 LEU 58 17.079 -8.988 18.237 456 HG LEU 58 HG LEU 58 15.540 -9.495 16.393 457 1HD1 LEU 58 HD11 LEU 58 16.945 -10.775 14.952 458 2HD1 LEU 58 HD12 LEU 58 17.898 -11.334 16.335 459 3HD1 LEU 58 HD13 LEU 58 17.872 -9.621 15.903 460 1HD2 LEU 58 HD21 LEU 58 14.942 -11.781 15.834 461 2HD2 LEU 58 HD22 LEU 58 14.324 -11.323 17.420 462 3HD2 LEU 58 HD23 LEU 58 15.747 -12.359 17.292 463 H ILE 59 HN ILE 59 18.907 -12.725 18.161 464 HA ILE 59 HA ILE 59 21.342 -11.049 18.237 465 HB ILE 59 HB ILE 59 21.061 -13.967 18.999 466 1HG1 ILE 59 HG12 ILE 59 22.014 -11.542 20.522 467 2HG1 ILE 59 HG11 ILE 59 20.540 -12.453 20.818 468 1HG2 ILE 59 HG21 ILE 59 23.626 -12.430 18.616 469 2HG2 ILE 59 HG22 ILE 59 23.046 -13.762 17.620 470 3HG2 ILE 59 HG23 ILE 59 23.492 -14.049 19.304 471 1HD1 ILE 59 HD11 ILE 59 23.369 -13.399 21.234 472 2HD1 ILE 59 HD12 ILE 59 21.952 -14.407 21.444 473 3HD1 ILE 59 HD13 ILE 59 22.199 -13.004 22.496 474 H SER 60 HN SER 60 22.547 -10.960 16.531 475 HA SER 60 HA SER 60 22.316 -12.984 14.450 476 1HB SER 60 HB2 SER 60 20.859 -11.042 13.801 477 2HB SER 60 HB1 SER 60 22.260 -9.985 13.943 478 HG SER 60 HG SER 60 22.512 -10.457 11.921 479 H ALA 61 HN ALA 61 24.302 -13.605 13.802 480 HA ALA 61 HA ALA 61 26.529 -13.785 13.583 481 1HB ALA 61 HB1 ALA 61 27.864 -11.762 13.163 482 2HB ALA 61 HB2 ALA 61 26.550 -10.758 13.773 483 3HB ALA 61 HB3 ALA 61 26.330 -11.689 12.294 484 H GLY 62 HN GLY 62 25.265 -13.767 16.234 485 1HA GLY 62 HA2 GLY 62 26.020 -14.187 18.385 486 2HA GLY 62 HA1 GLY 62 27.653 -13.867 17.820 487 H LYS 63 HN LYS 63 25.208 -11.469 17.277 488 HA LYS 63 HA LYS 63 26.285 -9.848 19.471 489 1HB LYS 63 HB2 LYS 63 27.213 -9.245 17.235 490 2HB LYS 63 HB1 LYS 63 25.577 -8.956 16.669 491 1HG LYS 63 HG2 LYS 63 25.384 -7.187 18.441 492 2HG LYS 63 HG1 LYS 63 27.104 -7.413 18.760 493 1HD LYS 63 HD2 LYS 63 25.851 -6.539 16.149 494 2HD LYS 63 HD1 LYS 63 26.774 -5.529 17.252 495 1HE LYS 63 HE2 LYS 63 27.831 -7.903 15.703 496 2HE LYS 63 HE1 LYS 63 28.086 -6.216 15.298 497 1HZ LYS 63 HZ1 LYS 63 29.270 -5.938 17.395 498 2HZ LYS 63 HZ2 LYS 63 29.988 -7.090 16.408 499 3HZ LYS 63 HZ3 LYS 63 29.081 -7.586 17.746 500 H VAL 64 HN VAL 64 24.680 -8.632 20.510 501 HA VAL 64 HA VAL 64 21.953 -9.420 19.923 502 HB VAL 64 HB VAL 64 22.987 -7.595 22.107 503 1HG1 VAL 64 HG11 VAL 64 20.636 -7.269 21.676 504 2HG1 VAL 64 HG12 VAL 64 20.860 -8.069 23.235 505 3HG1 VAL 64 HG13 VAL 64 20.337 -9.002 21.832 506 1HG2 VAL 64 HG21 VAL 64 22.360 -10.547 22.272 507 2HG2 VAL 64 HG22 VAL 64 22.824 -9.511 23.623 508 3HG2 VAL 64 HG23 VAL 64 23.966 -9.826 22.317 509 H LEU 65 HN LEU 65 20.643 -8.203 18.680 510 HA LEU 65 HA LEU 65 21.498 -5.526 18.252 511 1HB LEU 65 HB2 LEU 65 19.594 -5.516 16.536 512 2HB LEU 65 HB1 LEU 65 21.130 -6.235 16.100 513 HG LEU 65 HG LEU 65 18.648 -7.802 16.912 514 1HD1 LEU 65 HD11 LEU 65 18.283 -6.458 14.855 515 2HD1 LEU 65 HD12 LEU 65 18.390 -8.179 14.483 516 3HD1 LEU 65 HD13 LEU 65 19.766 -7.122 14.176 517 1HD2 LEU 65 HD21 LEU 65 19.853 -9.654 15.833 518 2HD2 LEU 65 HD22 LEU 65 20.805 -8.982 17.149 519 3HD2 LEU 65 HD23 LEU 65 21.193 -8.569 15.484 520 H GLU 66 HN GLU 66 20.789 -4.009 19.161 521 HA GLU 66 HA GLU 66 18.864 -4.291 21.216 522 1HB GLU 66 HB2 GLU 66 20.462 -1.963 20.227 523 2HB GLU 66 HB1 GLU 66 19.517 -1.997 21.717 524 1HG GLU 66 HG2 GLU 66 20.874 -3.717 22.634 525 2HG GLU 66 HG1 GLU 66 21.700 -3.954 21.098 526 H ASN 67 HN ASN 67 16.927 -3.489 21.380 527 HA ASN 67 HA ASN 67 15.318 -3.103 19.127 528 1HB ASN 67 HB2 ASN 67 13.514 -2.560 20.709 529 2HB ASN 67 HB1 ASN 67 14.425 -3.970 21.226 530 1HD2 ASN 67 HD21 ASN 67 12.754 -2.132 22.761 531 2HD2 ASN 67 HD22 ASN 67 13.732 -1.511 24.017 532 H SER 68 HN SER 68 17.181 -0.822 20.905 533 HA SER 68 HA SER 68 15.647 1.419 20.056 534 1HB SER 68 HB2 SER 68 17.535 2.676 21.193 535 2HB SER 68 HB1 SER 68 16.585 1.590 22.210 536 HG SER 68 HG SER 68 18.370 0.664 22.672 537 H LYS 69 HN LYS 69 17.859 -0.506 18.469 538 HA LYS 69 HA LYS 69 18.847 1.705 16.866 539 1HB LYS 69 HB2 LYS 69 19.751 -1.145 17.169 540 2HB LYS 69 HB1 LYS 69 20.436 0.020 16.059 541 1HG LYS 69 HG2 LYS 69 21.183 1.410 17.886 542 2HG LYS 69 HG1 LYS 69 20.388 0.355 19.049 543 1HD LYS 69 HD2 LYS 69 21.902 -1.470 18.433 544 2HD LYS 69 HD1 LYS 69 22.664 -0.434 17.224 545 1HE LYS 69 HE2 LYS 69 23.381 1.101 18.965 546 2HE LYS 69 HE1 LYS 69 22.582 0.120 20.184 547 1HZ LYS 69 HZ1 LYS 69 24.841 -0.853 18.495 548 2HZ LYS 69 HZ2 LYS 69 24.125 -1.649 19.817 549 3HZ LYS 69 HZ3 LYS 69 24.983 -0.245 20.056 550 H THR 70 HN THR 70 18.934 1.226 14.491 551 HA THR 70 HA THR 70 16.684 -0.352 13.608 552 HB THR 70 HB THR 70 17.104 0.882 11.511 553 HG1 THR 70 HG1 THR 70 18.795 2.605 12.984 554 1HG2 THR 70 HG21 THR 70 16.251 3.087 12.260 555 2HG2 THR 70 HG22 THR 70 16.633 2.641 13.923 556 3HG2 THR 70 HG23 THR 70 15.406 1.751 13.028 557 H VAL 71 HN VAL 71 17.133 -1.618 11.587 558 HA VAL 71 HA VAL 71 19.467 -3.131 12.011 559 HB VAL 71 HB VAL 71 17.687 -3.119 9.543 560 1HG1 VAL 71 HG11 VAL 71 18.562 -5.366 9.115 561 2HG1 VAL 71 HG12 VAL 71 19.664 -5.190 10.481 562 3HG1 VAL 71 HG13 VAL 71 19.831 -4.144 9.070 563 1HG2 VAL 71 HG21 VAL 71 17.592 -4.883 11.992 564 2HG2 VAL 71 HG22 VAL 71 16.602 -5.085 10.548 565 3HG2 VAL 71 HG23 VAL 71 16.419 -3.643 11.551 566 H LYS 72 HN LYS 72 18.714 -0.490 9.824 567 HA LYS 72 HA LYS 72 21.031 -0.373 8.294 568 1HB LYS 72 HB2 LYS 72 19.069 1.645 9.173 569 2HB LYS 72 HB1 LYS 72 20.629 2.270 8.679 570 1HG LYS 72 HG2 LYS 72 18.813 0.549 6.977 571 2HG LYS 72 HG1 LYS 72 18.978 2.302 6.873 572 1HD LYS 72 HD2 LYS 72 21.460 1.912 6.466 573 2HD LYS 72 HD1 LYS 72 21.064 0.211 6.261 574 1HE LYS 72 HE2 LYS 72 20.024 2.514 4.597 575 2HE LYS 72 HE1 LYS 72 21.225 1.333 4.099 576 1HZ LYS 72 HZ1 LYS 72 18.346 0.845 4.632 577 2HZ LYS 72 HZ2 LYS 72 19.446 -0.379 4.404 578 3HZ LYS 72 HZ3 LYS 72 19.143 0.731 3.150 579 H ASP 73 HN ASP 73 20.578 0.779 11.610 580 HA ASP 73 HA ASP 73 23.160 2.052 11.762 581 1HB ASP 73 HB2 ASP 73 21.201 2.711 13.214 582 2HB ASP 73 HB1 ASP 73 21.351 1.165 14.026 583 H TYR 74 HN TYR 74 21.911 -1.053 12.198 584 HA TYR 74 HA TYR 74 24.104 -2.146 13.739 585 1HB TYR 74 HB2 TYR 74 21.669 -2.788 13.909 586 2HB TYR 74 HB1 TYR 74 21.804 -3.486 12.312 587 HD1 TYR 74 HD1 TYR 74 22.631 -5.696 12.036 588 HD2 TYR 74 HD2 TYR 74 22.976 -3.716 15.777 589 HE1 TYR 74 HE1 TYR 74 23.239 -7.827 13.104 590 HE2 TYR 74 HE2 TYR 74 23.576 -5.787 16.857 591 HH TYR 74 HH TYR 74 24.376 -8.671 15.118 592 H ARG 75 HN ARG 75 23.201 -1.621 10.448 593 HA ARG 75 HA ARG 75 24.986 -3.541 9.271 594 1HB ARG 75 HB2 ARG 75 22.907 -1.610 8.357 595 2HB ARG 75 HB1 ARG 75 24.001 -2.382 7.242 596 1HG ARG 75 HG2 ARG 75 22.154 -3.871 9.098 597 2HG ARG 75 HG1 ARG 75 21.724 -3.423 7.447 598 1HD ARG 75 HD2 ARG 75 23.979 -5.214 8.315 599 2HD ARG 75 HD1 ARG 75 22.512 -5.706 7.475 600 HE ARG 75 HE ARG 75 24.853 -4.551 6.368 601 1HH1 ARG 75 HH11 ARG 75 21.375 -4.986 5.818 602 2HH1 ARG 75 HH12 ARG 75 21.458 -4.616 4.146 603 1HH2 ARG 75 HH21 ARG 75 24.940 -4.085 4.073 604 2HH2 ARG 75 HH22 ARG 75 23.511 -4.126 3.139 605 H SER 76 HN SER 76 26.292 -2.631 7.434 606 HA SER 76 HA SER 76 27.232 0.059 7.890 607 1HB SER 76 HB2 SER 76 28.476 -2.337 6.537 608 2HB SER 76 HB1 SER 76 29.192 -0.732 6.621 609 HG SER 76 HG SER 76 28.939 -0.998 8.966 610 HA PRO 77 HA PRO 77 24.982 0.838 4.071 611 1HB PRO 77 HB2 PRO 77 26.836 3.077 3.701 612 2HB PRO 77 HB1 PRO 77 25.081 3.113 3.854 613 1HG PRO 77 HG2 PRO 77 26.670 4.004 5.835 614 2HG PRO 77 HG1 PRO 77 25.135 3.179 6.160 615 1HD PRO 77 HD2 PRO 77 27.923 2.137 6.348 616 2HD PRO 77 HD1 PRO 77 26.514 1.820 7.384 617 H VAL 78 HN VAL 78 25.378 -0.238 2.312 618 HA VAL 78 HA VAL 78 28.085 -0.194 1.150 619 HB VAL 78 HB VAL 78 27.523 -2.364 2.195 620 1HG1 VAL 78 HG11 VAL 78 25.166 -2.457 1.901 621 2HG1 VAL 78 HG12 VAL 78 25.900 -3.884 1.166 622 3HG1 VAL 78 HG13 VAL 78 25.345 -2.556 0.149 623 1HG2 VAL 78 HG21 VAL 78 27.857 -2.506 -0.803 624 2HG2 VAL 78 HG22 VAL 78 28.160 -3.839 0.312 625 3HG2 VAL 78 HG23 VAL 78 29.146 -2.379 0.396 626 H SER 79 HN SER 79 24.935 0.529 0.754 627 HA SER 79 HA SER 79 23.620 1.342 -0.921 628 1HB SER 79 HB2 SER 79 25.595 2.815 -1.364 629 2HB SER 79 HB1 SER 79 26.262 1.584 -2.428 630 HG SER 79 HG SER 79 24.315 1.824 -3.663 631 H ASN 80 HN ASN 80 23.963 -1.420 -0.660 632 HA ASN 80 HA ASN 80 23.101 -2.312 -3.291 633 1HB ASN 80 HB2 ASN 80 25.549 -2.707 -3.298 634 2HB ASN 80 HB1 ASN 80 25.396 -3.671 -1.834 635 1HD2 ASN 80 HD21 ASN 80 26.189 -5.542 -2.780 636 2HD2 ASN 80 HD22 ASN 80 25.317 -6.445 -3.953 637 H LEU 81 HN LEU 81 21.718 -4.208 -3.181 638 HA LEU 81 HA LEU 81 20.651 -4.714 -0.640 639 1HB LEU 81 HB2 LEU 81 20.098 -5.363 -3.454 640 2HB LEU 81 HB1 LEU 81 19.188 -6.082 -2.168 641 HG LEU 81 HG LEU 81 17.845 -4.335 -3.060 642 1HD1 LEU 81 HD11 LEU 81 17.768 -4.353 -0.676 643 2HD1 LEU 81 HD12 LEU 81 17.593 -2.706 -1.275 644 3HD1 LEU 81 HD13 LEU 81 19.127 -3.230 -0.583 645 1HD2 LEU 81 HD21 LEU 81 19.544 -3.161 -4.354 646 2HD2 LEU 81 HD22 LEU 81 20.222 -2.476 -2.876 647 3HD2 LEU 81 HD23 LEU 81 18.596 -2.028 -3.395 648 H ALA 82 HN ALA 82 19.934 -7.279 -0.713 649 HA ALA 82 HA ALA 82 22.067 -8.907 -1.554 650 1HB ALA 82 HB1 ALA 82 22.902 -8.164 0.604 651 2HB ALA 82 HB2 ALA 82 22.433 -9.862 0.705 652 3HB ALA 82 HB3 ALA 82 21.383 -8.615 1.374 653 H GLY 83 HN GLY 83 20.970 -10.414 -2.514 654 1HA GLY 83 HA2 GLY 83 18.260 -11.117 -1.733 655 2HA GLY 83 HA1 GLY 83 19.133 -11.734 -3.130 656 H ALA 84 HN ALA 84 19.931 -11.737 0.269 657 HA ALA 84 HA ALA 84 20.035 -14.673 0.219 658 1HB ALA 84 HB1 ALA 84 21.637 -14.483 2.082 659 2HB ALA 84 HB2 ALA 84 21.532 -12.726 1.991 660 3HB ALA 84 HB3 ALA 84 22.225 -13.639 0.651 661 H VAL 85 HN VAL 85 19.199 -15.730 2.153 662 HA VAL 85 HA VAL 85 17.001 -14.221 3.285 663 HB VAL 85 HB VAL 85 17.851 -17.067 3.878 664 1HG1 VAL 85 HG11 VAL 85 15.542 -17.371 4.681 665 2HG1 VAL 85 HG12 VAL 85 15.231 -15.663 4.376 666 3HG1 VAL 85 HG13 VAL 85 16.417 -16.137 5.593 667 1HG2 VAL 85 HG21 VAL 85 15.800 -16.103 1.882 668 2HG2 VAL 85 HG22 VAL 85 16.081 -17.789 2.318 669 3HG2 VAL 85 HG23 VAL 85 17.347 -16.862 1.511 670 H THR 86 HN THR 86 17.024 -13.391 5.291 671 HA THR 86 HA THR 86 19.573 -13.575 6.685 672 HB THR 86 HB THR 86 17.273 -11.655 7.152 673 HG1 THR 86 HG1 THR 86 17.988 -11.086 5.196 674 1HG2 THR 86 HG21 THR 86 18.826 -11.894 9.046 675 2HG2 THR 86 HG22 THR 86 19.001 -10.308 8.283 676 3HG2 THR 86 HG23 THR 86 20.186 -11.573 7.970 677 H THR 87 HN THR 87 19.629 -15.028 8.297 678 HA THR 87 HA THR 87 17.110 -15.655 9.625 679 HB THR 87 HB THR 87 19.696 -17.240 9.572 680 HG1 THR 87 HG1 THR 87 18.010 -16.846 7.668 681 1HG2 THR 87 HG21 THR 87 18.240 -17.697 11.526 682 2HG2 THR 87 HG22 THR 87 18.281 -19.072 10.422 683 3HG2 THR 87 HG23 THR 87 16.885 -17.999 10.440 684 H MET 88 HN MET 88 16.877 -14.750 11.538 685 HA MET 88 HA MET 88 19.291 -14.037 13.008 686 1HB MET 88 HB2 MET 88 16.590 -12.692 13.050 687 2HB MET 88 HB1 MET 88 17.915 -12.322 14.148 688 1HG MET 88 HG2 MET 88 19.307 -11.661 12.242 689 2HG MET 88 HG1 MET 88 17.964 -12.010 11.158 690 1HE MET 88 HE1 MET 88 19.567 -9.210 11.290 691 2HE MET 88 HE2 MET 88 18.224 -8.077 11.141 692 3HE MET 88 HE3 MET 88 18.260 -9.532 10.149 693 H HIS 89 HN HIS 89 19.385 -14.420 15.175 694 HA HIS 89 HA HIS 89 17.794 -16.741 15.881 695 1HB HIS 89 HB2 HIS 89 20.309 -15.624 17.125 696 2HB HIS 89 HB1 HIS 89 19.465 -17.056 17.693 697 HD1 HIS 89 HD1 HIS 89 19.976 -19.223 16.514 698 HD2 HIS 89 HD2 HIS 89 21.539 -15.922 14.556 699 HE1 HIS 89 HE1 HIS 89 21.439 -20.143 14.701 700 HE2 HIS 89 HE2 HIS 89 22.061 -18.150 13.360 701 H VAL 90 HN VAL 90 16.231 -16.635 17.192 702 HA VAL 90 HA VAL 90 15.861 -14.299 18.951 703 HB VAL 90 HB VAL 90 14.007 -16.615 18.365 704 1HG1 VAL 90 HG11 VAL 90 12.263 -15.161 19.297 705 2HG1 VAL 90 HG12 VAL 90 13.482 -13.933 19.637 706 3HG1 VAL 90 HG13 VAL 90 13.544 -15.489 20.465 707 1HG2 VAL 90 HG21 VAL 90 14.362 -15.395 16.297 708 2HG2 VAL 90 HG22 VAL 90 13.983 -13.877 17.112 709 3HG2 VAL 90 HG23 VAL 90 12.735 -15.106 16.917 710 H ILE 91 HN ILE 91 16.406 -14.384 20.818 711 HA ILE 91 HA ILE 91 17.196 -16.923 21.997 712 HB ILE 91 HB ILE 91 17.717 -14.068 22.592 713 1HG1 ILE 91 HG12 ILE 91 18.963 -14.784 20.693 714 2HG1 ILE 91 HG11 ILE 91 20.077 -14.596 22.040 715 1HG2 ILE 91 HG21 ILE 91 19.343 -14.883 24.364 716 2HG2 ILE 91 HG22 ILE 91 18.806 -16.530 24.038 717 3HG2 ILE 91 HG23 ILE 91 17.680 -15.359 24.719 718 1HD1 ILE 91 HD11 ILE 91 18.991 -17.206 20.981 719 2HD1 ILE 91 HD12 ILE 91 20.081 -17.034 22.352 720 3HD1 ILE 91 HD13 ILE 91 20.620 -16.571 20.738 721 H ILE 92 HN ILE 92 15.949 -17.821 23.298 722 HA ILE 92 HA ILE 92 13.609 -16.442 24.255 723 HB ILE 92 HB ILE 92 14.450 -19.324 24.623 724 1HG1 ILE 92 HG12 ILE 92 14.172 -18.825 22.247 725 2HG1 ILE 92 HG11 ILE 92 12.853 -19.838 22.814 726 1HG2 ILE 92 HG21 ILE 92 11.787 -17.979 25.008 727 2HG2 ILE 92 HG22 ILE 92 12.853 -18.580 26.283 728 3HG2 ILE 92 HG23 ILE 92 12.091 -19.715 25.157 729 1HD1 ILE 92 HD11 ILE 92 11.422 -17.899 22.942 730 2HD1 ILE 92 HD12 ILE 92 12.061 -18.128 21.315 731 3HD1 ILE 92 HD13 ILE 92 12.728 -16.864 22.362 732 H GLN 93 HN GLN 93 14.236 -15.136 25.886 733 HA GLN 93 HA GLN 93 15.534 -16.433 28.136 734 1HB GLN 93 HB2 GLN 93 14.947 -13.511 27.598 735 2HB GLN 93 HB1 GLN 93 15.617 -14.126 29.097 736 1HG GLN 93 HG2 GLN 93 16.903 -14.261 26.383 737 2HG GLN 93 HG1 GLN 93 17.347 -13.174 27.697 738 1HE2 GLN 93 HE21 GLN 93 18.332 -14.037 29.555 739 2HE2 GLN 93 HE22 GLN 93 19.127 -15.562 29.511 740 H ALA 94 HN ALA 94 14.114 -17.410 29.271 741 HA ALA 94 HA ALA 94 11.386 -16.679 29.292 742 1HB ALA 94 HB1 ALA 94 12.084 -18.998 29.610 743 2HB ALA 94 HB2 ALA 94 11.135 -18.430 30.985 744 3HB ALA 94 HB3 ALA 94 12.890 -18.551 31.114 745 HA PRO 95 HA PRO 95 11.683 -13.511 32.431 746 1HB PRO 95 HB2 PRO 95 8.851 -14.319 32.886 747 2HB PRO 95 HB1 PRO 95 9.520 -12.711 32.577 748 1HG PRO 95 HG2 PRO 95 8.181 -13.967 30.668 749 2HG PRO 95 HG1 PRO 95 9.658 -13.068 30.283 750 1HD PRO 95 HD2 PRO 95 9.275 -16.018 30.593 751 2HD PRO 95 HD1 PRO 95 10.214 -15.106 29.387 752 H VAL 96 HN VAL 96 11.467 -13.418 34.743 753 HA VAL 96 HA VAL 96 12.339 -15.637 36.082 754 HB VAL 96 HB VAL 96 12.578 -13.414 37.052 755 1HG1 VAL 96 HG11 VAL 96 9.599 -13.422 37.463 756 2HG1 VAL 96 HG12 VAL 96 10.500 -12.415 36.333 757 3HG1 VAL 96 HG13 VAL 96 10.720 -12.201 38.068 758 1HG2 VAL 96 HG21 VAL 96 10.924 -15.190 38.843 759 2HG2 VAL 96 HG22 VAL 96 11.960 -13.865 39.383 760 3HG2 VAL 96 HG23 VAL 96 12.669 -15.279 38.610 761 H THR 97 HN THR 97 11.468 -17.495 36.544 762 HA THR 97 HA THR 97 8.656 -17.785 36.087 763 HB THR 97 HB THR 97 10.643 -20.009 36.611 764 HG1 THR 97 HG1 THR 97 10.466 -18.259 34.531 765 1HG2 THR 97 HG21 THR 97 7.993 -19.874 35.146 766 2HG2 THR 97 HG22 THR 97 8.256 -20.621 36.724 767 3HG2 THR 97 HG23 THR 97 9.006 -21.307 35.284 768 H GLU 98 HN GLU 98 8.301 -16.545 37.959 769 HA GLU 98 HA GLU 98 6.963 -17.859 39.936 770 1HB GLU 98 HB2 GLU 98 9.242 -18.473 40.836 771 2HB GLU 98 HB1 GLU 98 9.623 -16.762 40.940 772 1HG GLU 98 HG2 GLU 98 9.012 -17.730 43.110 773 2HG GLU 98 HG1 GLU 98 7.911 -16.444 42.616 774 H LYS 99 HN LYS 99 5.456 -16.337 39.646 775 HA LYS 99 HA LYS 99 6.236 -13.698 39.211 776 1HB LYS 99 HB2 LYS 99 4.470 -14.604 37.864 777 2HB LYS 99 HB1 LYS 99 3.508 -14.925 39.298 778 1HG LYS 99 HG2 LYS 99 3.253 -12.540 39.689 779 2HG LYS 99 HG1 LYS 99 4.287 -12.190 38.308 780 1HD LYS 99 HD2 LYS 99 1.995 -11.872 37.633 781 2HD LYS 99 HD1 LYS 99 2.609 -13.311 36.840 782 1HE LYS 99 HE2 LYS 99 0.882 -13.321 39.333 783 2HE LYS 99 HE1 LYS 99 0.254 -13.491 37.708 784 1HZ LYS 99 HZ1 LYS 99 1.616 -15.572 37.527 785 2HZ LYS 99 HZ2 LYS 99 0.406 -15.603 38.678 786 3HZ LYS 99 HZ3 LYS 99 1.972 -15.455 39.186 787 H GLU 100 HN GLU 100 7.056 -12.916 41.077 788 HA GLU 100 HA GLU 100 5.718 -12.943 43.598 789 1HB GLU 100 HB2 GLU 100 8.066 -11.361 42.546 790 2HB GLU 100 HB1 GLU 100 7.502 -11.282 44.205 791 1HG GLU 100 HG2 GLU 100 8.532 -13.754 42.826 792 2HG GLU 100 HG1 GLU 100 9.460 -12.735 43.927 793 H LYS 101 HN LYS 101 5.157 -10.877 44.699 794 HA LYS 101 HA LYS 101 3.835 -9.126 42.794 795 1HB LYS 101 HB2 LYS 101 3.283 -9.584 45.725 796 2HB LYS 101 HB1 LYS 101 2.433 -8.413 44.719 797 1HG LYS 101 HG2 LYS 101 1.641 -10.251 43.288 798 2HG LYS 101 HG1 LYS 101 2.451 -11.404 44.349 799 1HD LYS 101 HD2 LYS 101 1.062 -10.688 46.211 800 2HD LYS 101 HD1 LYS 101 0.272 -9.491 45.183 801 1HE LYS 101 HE2 LYS 101 -1.137 -11.454 45.397 802 2HE LYS 101 HE1 LYS 101 -0.556 -11.302 43.745 803 1HZ LYS 101 HZ1 LYS 101 -0.442 -13.573 44.537 804 2HZ LYS 101 HZ2 LYS 101 0.594 -13.137 45.790 805 3HZ LYS 101 HZ3 LYS 101 1.096 -13.009 44.189 Start of MODEL 3 1 H GLU 1 HT1 GLU 1 4.569 -5.902 -11.767 2 HA GLU 1 HA GLU 1 4.519 -8.364 -10.165 3 1HB GLU 1 HB2 GLU 1 5.872 -5.701 -9.612 4 2HB GLU 1 HB1 GLU 1 5.671 -6.974 -8.427 5 1HG GLU 1 HG2 GLU 1 7.926 -7.002 -9.238 6 2HG GLU 1 HG1 GLU 1 7.102 -8.438 -9.829 7 H ALA 2 HN ALA 2 2.557 -8.534 -9.292 8 HA ALA 2 HA ALA 2 0.831 -6.286 -9.049 9 1HB ALA 2 HB1 ALA 2 0.565 -9.063 -7.886 10 2HB ALA 2 HB2 ALA 2 -0.056 -8.546 -9.457 11 3HB ALA 2 HB3 ALA 2 -0.718 -7.857 -7.974 12 H GLU 3 HN GLU 3 1.336 -4.794 -7.700 13 HA GLU 3 HA GLU 3 2.269 -3.685 -6.011 14 1HB GLU 3 HB2 GLU 3 1.087 -3.911 -3.833 15 2HB GLU 3 HB1 GLU 3 0.027 -3.760 -5.215 16 1HG GLU 3 HG2 GLU 3 -0.466 -6.136 -5.116 17 2HG GLU 3 HG1 GLU 3 0.679 -6.323 -3.789 18 H VAL 4 HN VAL 4 4.334 -4.144 -6.138 19 HA VAL 4 HA VAL 4 5.316 -6.291 -4.524 20 HB VAL 4 HB VAL 4 6.415 -5.965 -6.599 21 1HG1 VAL 4 HG11 VAL 4 6.116 -3.582 -6.960 22 2HG1 VAL 4 HG12 VAL 4 7.827 -3.977 -7.100 23 3HG1 VAL 4 HG13 VAL 4 7.212 -3.220 -5.628 24 1HG2 VAL 4 HG21 VAL 4 8.262 -5.240 -4.334 25 2HG2 VAL 4 HG22 VAL 4 8.783 -5.864 -5.899 26 3HG2 VAL 4 HG23 VAL 4 7.788 -6.862 -4.836 27 H HIS 5 HN HIS 5 6.117 -6.223 -2.722 28 HA HIS 5 HA HIS 5 6.601 -3.678 -1.335 29 1HB HIS 5 HB2 HIS 5 5.279 -4.422 0.645 30 2HB HIS 5 HB1 HIS 5 4.280 -4.200 -0.779 31 HD1 HIS 5 HD1 HIS 5 5.038 -6.590 1.866 32 HD2 HIS 5 HD2 HIS 5 3.499 -6.780 -1.987 33 HE1 HIS 5 HE1 HIS 5 3.850 -8.793 1.725 34 HE2 HIS 5 HE2 HIS 5 2.665 -8.688 -0.503 35 H ASN 6 HN ASN 6 8.241 -5.680 -2.416 36 HA ASN 6 HA ASN 6 9.232 -7.407 -0.396 37 1HB ASN 6 HB2 ASN 6 9.503 -7.948 -2.778 38 2HB ASN 6 HB1 ASN 6 10.529 -6.539 -2.990 39 1HD2 ASN 6 HD21 ASN 6 10.601 -8.815 -0.251 40 2HD2 ASN 6 HD22 ASN 6 12.180 -9.393 -0.554 41 H GLN 7 HN GLN 7 9.685 -6.177 1.329 42 HA GLN 7 HA GLN 7 11.856 -4.263 1.230 43 1HB GLN 7 HB2 GLN 7 10.251 -5.399 3.552 44 2HB GLN 7 HB1 GLN 7 11.375 -4.061 3.649 45 1HG GLN 7 HG2 GLN 7 9.962 -2.702 2.245 46 2HG GLN 7 HG1 GLN 7 8.856 -4.049 2.003 47 1HE2 GLN 7 HE21 GLN 7 7.491 -4.650 3.670 48 2HE2 GLN 7 HE22 GLN 7 7.187 -3.640 5.032 49 H LEU 8 HN LEU 8 13.122 -5.210 3.767 50 HA LEU 8 HA LEU 8 14.168 -7.627 2.584 51 1HB LEU 8 HB2 LEU 8 15.235 -5.971 4.837 52 2HB LEU 8 HB1 LEU 8 15.949 -7.459 4.304 53 HG LEU 8 HG LEU 8 16.242 -6.384 2.019 54 1HD1 LEU 8 HD11 LEU 8 16.415 -3.947 1.911 55 2HD1 LEU 8 HD12 LEU 8 15.667 -3.845 3.512 56 3HD1 LEU 8 HD13 LEU 8 14.773 -4.531 2.164 57 1HD2 LEU 8 HD21 LEU 8 18.316 -5.202 2.665 58 2HD2 LEU 8 HD22 LEU 8 18.130 -6.786 3.409 59 3HD2 LEU 8 HD23 LEU 8 17.830 -5.338 4.361 60 H GLU 9 HN GLU 9 13.835 -9.504 3.368 61 HA GLU 9 HA GLU 9 11.865 -9.612 5.477 62 1HB GLU 9 HB2 GLU 9 12.793 -11.808 3.648 63 2HB GLU 9 HB1 GLU 9 11.471 -11.879 4.779 64 1HG GLU 9 HG2 GLU 9 10.233 -10.189 3.583 65 2HG GLU 9 HG1 GLU 9 11.563 -9.977 2.451 66 H ILE 10 HN ILE 10 12.175 -10.399 7.316 67 HA ILE 10 HA ILE 10 14.794 -11.588 7.957 68 HB ILE 10 HB ILE 10 13.098 -9.803 9.747 69 1HG1 ILE 10 HG12 ILE 10 15.752 -9.219 8.374 70 2HG1 ILE 10 HG11 ILE 10 14.201 -8.537 7.914 71 1HG2 ILE 10 HG21 ILE 10 14.954 -9.883 11.296 72 2HG2 ILE 10 HG22 ILE 10 15.833 -10.979 10.228 73 3HG2 ILE 10 HG23 ILE 10 14.331 -11.503 10.990 74 1HD1 ILE 10 HD11 ILE 10 15.632 -8.086 10.527 75 2HD1 ILE 10 HD12 ILE 10 14.080 -7.384 10.064 76 3HD1 ILE 10 HD13 ILE 10 15.542 -6.953 9.178 77 H LYS 11 HN LYS 11 14.729 -13.394 9.180 78 HA LYS 11 HA LYS 11 12.223 -13.963 10.440 79 1HB LYS 11 HB2 LYS 11 12.347 -16.343 10.044 80 2HB LYS 11 HB1 LYS 11 12.307 -15.484 8.532 81 1HG LYS 11 HG2 LYS 11 14.643 -15.940 8.175 82 2HG LYS 11 HG1 LYS 11 14.767 -16.677 9.786 83 1HD LYS 11 HD2 LYS 11 13.025 -18.302 9.143 84 2HD LYS 11 HD1 LYS 11 13.020 -17.617 7.522 85 1HE LYS 11 HE2 LYS 11 15.305 -18.300 7.201 86 2HE LYS 11 HE1 LYS 11 15.388 -18.877 8.871 87 1HZ LYS 11 HZ1 LYS 11 13.616 -19.964 6.747 88 2HZ LYS 11 HZ2 LYS 11 13.617 -20.463 8.342 89 3HZ LYS 11 HZ3 LYS 11 14.979 -20.731 7.380 90 H PHE 12 HN PHE 12 12.541 -15.527 12.275 91 HA PHE 12 HA PHE 12 15.076 -14.791 13.568 92 1HB PHE 12 HB2 PHE 12 12.346 -15.123 14.787 93 2HB PHE 12 HB1 PHE 12 13.817 -14.676 15.642 94 HD1 PHE 12 HD1 PHE 12 10.987 -13.499 13.786 95 HD2 PHE 12 HD2 PHE 12 14.932 -12.486 15.010 96 HE1 PHE 12 HE1 PHE 12 10.506 -11.135 13.348 97 HE2 PHE 12 HE2 PHE 12 14.462 -10.117 14.578 98 HZ PHE 12 HZ PHE 12 12.263 -9.422 13.754 99 H ARG 13 HN ARG 13 16.181 -16.381 14.646 100 HA ARG 13 HA ARG 13 14.882 -18.986 14.832 101 1HB ARG 13 HB2 ARG 13 17.750 -18.321 14.302 102 2HB ARG 13 HB1 ARG 13 17.297 -19.855 15.019 103 1HG ARG 13 HG2 ARG 13 15.826 -20.247 13.111 104 2HG ARG 13 HG1 ARG 13 16.471 -18.790 12.325 105 1HD ARG 13 HD2 ARG 13 18.695 -19.786 12.343 106 2HD ARG 13 HD1 ARG 13 18.082 -21.189 13.218 107 HE ARG 13 HE ARG 13 17.277 -20.478 10.475 108 1HH1 ARG 13 HH11 ARG 13 18.123 -22.950 12.904 109 2HH1 ARG 13 HH12 ARG 13 17.869 -24.247 11.835 110 1HH2 ARG 13 HH21 ARG 13 16.934 -22.337 9.055 111 2HH2 ARG 13 HH22 ARG 13 17.190 -23.907 9.668 112 H LEU 14 HN LEU 14 14.637 -19.859 16.663 113 HA LEU 14 HA LEU 14 15.292 -18.399 19.051 114 1HB LEU 14 HB2 LEU 14 13.889 -21.023 18.596 115 2HB LEU 14 HB1 LEU 14 14.152 -20.371 20.186 116 HG LEU 14 HG LEU 14 12.702 -18.417 19.556 117 1HD1 LEU 14 HD11 LEU 14 12.942 -18.473 17.133 118 2HD1 LEU 14 HD12 LEU 14 11.246 -18.586 17.603 119 3HD1 LEU 14 HD13 LEU 14 12.114 -20.029 17.079 120 1HD2 LEU 14 HD21 LEU 14 11.797 -20.262 20.812 121 2HD2 LEU 14 HD22 LEU 14 11.491 -21.155 19.323 122 3HD2 LEU 14 HD23 LEU 14 10.593 -19.677 19.661 123 H THR 15 HN THR 15 16.081 -19.731 20.956 124 HA THR 15 HA THR 15 18.721 -20.612 20.522 125 HB THR 15 HB THR 15 17.951 -19.619 22.585 126 HG1 THR 15 HG1 THR 15 19.713 -21.398 22.490 127 1HG2 THR 15 HG21 THR 15 16.405 -22.166 23.030 128 2HG2 THR 15 HG22 THR 15 15.740 -20.552 22.813 129 3HG2 THR 15 HG23 THR 15 16.660 -20.941 24.270 130 H ASP 16 HN ASP 16 15.750 -22.165 20.506 131 HA ASP 16 HA ASP 16 16.681 -24.893 20.784 132 1HB ASP 16 HB2 ASP 16 14.434 -24.298 21.515 133 2HB ASP 16 HB1 ASP 16 14.013 -23.793 19.885 134 H GLY 17 HN GLY 17 16.791 -22.682 18.280 135 1HA GLY 17 HA2 GLY 17 17.750 -23.037 16.188 136 2HA GLY 17 HA1 GLY 17 17.507 -24.768 16.386 137 H SER 18 HN SER 18 14.685 -23.270 17.194 138 HA SER 18 HA SER 18 13.426 -24.026 14.752 139 1HB SER 18 HB2 SER 18 11.413 -23.245 16.108 140 2HB SER 18 HB1 SER 18 12.327 -24.597 16.785 141 HG SER 18 HG SER 18 11.966 -23.117 18.390 142 H ASP 19 HN ASP 19 12.307 -22.486 13.348 143 HA ASP 19 HA ASP 19 13.151 -19.775 13.849 144 1HB ASP 19 HB2 ASP 19 13.298 -19.452 11.453 145 2HB ASP 19 HB1 ASP 19 14.434 -20.685 11.973 146 H ILE 20 HN ILE 20 11.865 -18.181 12.944 147 HA ILE 20 HA ILE 20 8.987 -18.821 13.012 148 HB ILE 20 HB ILE 20 10.399 -16.138 13.369 149 1HG1 ILE 20 HG12 ILE 20 9.090 -17.903 15.459 150 2HG1 ILE 20 HG11 ILE 20 10.822 -17.647 15.275 151 1HG2 ILE 20 HG21 ILE 20 7.492 -16.858 13.752 152 2HG2 ILE 20 HG22 ILE 20 8.166 -15.888 12.443 153 3HG2 ILE 20 HG23 ILE 20 8.216 -15.286 14.103 154 1HD1 ILE 20 HD11 ILE 20 10.518 -15.272 15.844 155 2HD1 ILE 20 HD12 ILE 20 9.917 -16.328 17.118 156 3HD1 ILE 20 HD13 ILE 20 8.788 -15.540 16.021 157 H GLY 21 HN GLY 21 7.727 -18.226 11.245 158 1HA GLY 21 HA2 GLY 21 8.827 -18.168 8.705 159 2HA GLY 21 HA1 GLY 21 7.211 -17.591 9.091 160 HA PRO 22 HA PRO 22 10.631 -14.173 8.416 161 1HB PRO 22 HB2 PRO 22 10.830 -13.985 5.716 162 2HB PRO 22 HB1 PRO 22 11.956 -14.889 6.700 163 1HG PRO 22 HG2 PRO 22 9.635 -15.915 5.118 164 2HG PRO 22 HG1 PRO 22 11.237 -16.637 5.350 165 1HD PRO 22 HD2 PRO 22 9.054 -17.497 6.682 166 2HD PRO 22 HD1 PRO 22 10.674 -17.521 7.408 167 H LYS 23 HN LYS 23 10.132 -12.111 8.013 168 HA LYS 23 HA LYS 23 7.499 -11.492 6.841 169 1HB LYS 23 HB2 LYS 23 7.552 -11.641 9.398 170 2HB LYS 23 HB1 LYS 23 8.672 -10.294 9.362 171 1HG LYS 23 HG2 LYS 23 6.928 -8.932 8.279 172 2HG LYS 23 HG1 LYS 23 5.805 -10.287 8.440 173 1HD LYS 23 HD2 LYS 23 6.266 -10.253 10.901 174 2HD LYS 23 HD1 LYS 23 7.182 -8.768 10.647 175 1HE LYS 23 HE2 LYS 23 4.988 -8.167 11.366 176 2HE LYS 23 HE1 LYS 23 5.126 -7.768 9.654 177 1HZ LYS 23 HZ1 LYS 23 3.916 -9.827 9.127 178 2HZ LYS 23 HZ2 LYS 23 3.019 -8.855 10.183 179 3HZ LYS 23 HZ3 LYS 23 3.836 -10.187 10.778 180 H ALA 24 HN ALA 24 7.485 -9.150 6.126 181 HA ALA 24 HA ALA 24 10.136 -8.449 5.172 182 1HB ALA 24 HB1 ALA 24 7.454 -7.240 4.490 183 2HB ALA 24 HB2 ALA 24 8.269 -8.508 3.576 184 3HB ALA 24 HB3 ALA 24 8.979 -6.902 3.674 185 H PHE 25 HN PHE 25 11.363 -6.926 6.088 186 HA PHE 25 HA PHE 25 10.084 -4.890 7.787 187 1HB PHE 25 HB2 PHE 25 12.798 -6.186 8.149 188 2HB PHE 25 HB1 PHE 25 12.103 -4.940 9.159 189 HD1 PHE 25 HD1 PHE 25 11.705 -8.426 8.071 190 HD2 PHE 25 HD2 PHE 25 10.862 -5.541 11.059 191 HE1 PHE 25 HE1 PHE 25 10.927 -10.205 9.544 192 HE2 PHE 25 HE2 PHE 25 10.068 -7.335 12.547 193 HZ PHE 25 HZ PHE 25 10.129 -9.701 11.744 194 HA PRO 26 HA PRO 26 12.792 -2.293 5.232 195 1HB PRO 26 HB2 PRO 26 12.973 -0.503 7.563 196 2HB PRO 26 HB1 PRO 26 12.329 -0.125 5.974 197 1HG PRO 26 HG2 PRO 26 10.742 -0.354 8.140 198 2HG PRO 26 HG1 PRO 26 10.196 -0.876 6.540 199 1HD PRO 26 HD2 PRO 26 11.176 -2.535 8.831 200 2HD PRO 26 HD1 PRO 26 9.868 -2.845 7.674 201 H ASP 27 HN ASP 27 15.075 -2.155 5.208 202 HA ASP 27 HA ASP 27 16.456 -3.618 7.255 203 1HB ASP 27 HB2 ASP 27 17.182 -3.526 4.823 204 2HB ASP 27 HB1 ASP 27 17.688 -1.869 5.104 205 H ALA 28 HN ALA 28 15.808 -0.337 6.530 206 HA ALA 28 HA ALA 28 17.646 0.754 8.475 207 1HB ALA 28 HB1 ALA 28 17.144 1.948 6.402 208 2HB ALA 28 HB2 ALA 28 16.727 2.909 7.822 209 3HB ALA 28 HB3 ALA 28 15.461 2.099 6.902 210 H THR 29 HN THR 29 15.099 -1.004 9.126 211 HA THR 29 HA THR 29 13.568 0.734 10.797 212 HB THR 29 HB THR 29 12.625 -1.421 9.785 213 HG1 THR 29 HG1 THR 29 12.252 -1.746 12.511 214 1HG2 THR 29 HG21 THR 29 13.003 -3.522 11.016 215 2HG2 THR 29 HG22 THR 29 14.184 -2.710 12.043 216 3HG2 THR 29 HG23 THR 29 14.512 -2.924 10.323 217 H THR 30 HN THR 30 13.610 0.872 13.044 218 HA THR 30 HA THR 30 16.149 0.587 14.258 219 HB THR 30 HB THR 30 14.995 1.246 16.344 220 HG1 THR 30 HG1 THR 30 12.601 1.626 14.946 221 1HG2 THR 30 HG21 THR 30 14.199 2.871 13.930 222 2HG2 THR 30 HG22 THR 30 15.734 2.969 14.791 223 3HG2 THR 30 HG23 THR 30 14.242 3.456 15.594 224 H VAL 31 HN VAL 31 16.742 -0.794 15.972 225 HA VAL 31 HA VAL 31 15.821 -3.462 15.868 226 HB VAL 31 HB VAL 31 17.395 -2.029 18.040 227 1HG1 VAL 31 HG11 VAL 31 17.071 -4.999 17.563 228 2HG1 VAL 31 HG12 VAL 31 16.356 -4.088 18.887 229 3HG1 VAL 31 HG13 VAL 31 18.108 -4.254 18.783 230 1HG2 VAL 31 HG21 VAL 31 19.360 -3.068 17.008 231 2HG2 VAL 31 HG22 VAL 31 18.519 -1.999 15.886 232 3HG2 VAL 31 HG23 VAL 31 18.333 -3.747 15.744 233 H SER 32 HN SER 32 14.908 -0.683 17.725 234 HA SER 32 HA SER 32 13.322 -1.917 19.654 235 1HB SER 32 HB2 SER 32 14.020 0.454 19.724 236 2HB SER 32 HB1 SER 32 12.976 0.794 18.351 237 HG SER 32 HG SER 32 11.478 1.077 19.705 238 H ALA 33 HN ALA 33 12.447 -0.585 16.423 239 HA ALA 33 HA ALA 33 9.737 -1.427 16.523 240 1HB ALA 33 HB1 ALA 33 9.695 -0.916 14.127 241 2HB ALA 33 HB2 ALA 33 11.454 -0.817 14.117 242 3HB ALA 33 HB3 ALA 33 10.513 0.360 15.029 243 H LEU 34 HN LEU 34 12.719 -3.013 15.508 244 HA LEU 34 HA LEU 34 11.736 -5.164 14.117 245 1HB LEU 34 HB2 LEU 34 14.053 -4.495 14.158 246 2HB LEU 34 HB1 LEU 34 14.068 -4.631 15.900 247 HG LEU 34 HG LEU 34 13.854 -6.927 15.783 248 1HD1 LEU 34 HD11 LEU 34 14.176 -8.131 13.565 249 2HD1 LEU 34 HD12 LEU 34 14.099 -6.565 12.759 250 3HD1 LEU 34 HD13 LEU 34 12.685 -7.189 13.607 251 1HD2 LEU 34 HD21 LEU 34 16.029 -5.969 15.924 252 2HD2 LEU 34 HD22 LEU 34 16.155 -5.860 14.164 253 3HD2 LEU 34 HD23 LEU 34 16.117 -7.435 14.959 254 H LYS 35 HN LYS 35 12.446 -4.599 17.528 255 HA LYS 35 HA LYS 35 11.608 -7.142 18.295 256 1HB LYS 35 HB2 LYS 35 12.256 -4.697 19.900 257 2HB LYS 35 HB1 LYS 35 11.894 -6.272 20.618 258 1HG LYS 35 HG2 LYS 35 13.662 -7.291 19.466 259 2HG LYS 35 HG1 LYS 35 14.042 -5.842 18.548 260 1HD LYS 35 HD2 LYS 35 15.695 -6.071 20.250 261 2HD LYS 35 HD1 LYS 35 14.612 -4.801 20.806 262 1HE LYS 35 HE2 LYS 35 13.453 -6.444 22.228 263 2HE LYS 35 HE1 LYS 35 14.540 -7.684 21.641 264 1HZ LYS 35 HZ1 LYS 35 15.186 -6.763 23.793 265 2HZ LYS 35 HZ2 LYS 35 15.510 -5.266 23.054 266 3HZ LYS 35 HZ3 LYS 35 16.385 -6.627 22.632 267 H GLU 36 HN GLU 36 10.059 -3.993 18.314 268 HA GLU 36 HA GLU 36 7.677 -4.628 19.599 269 1HB GLU 36 HB2 GLU 36 8.201 -2.839 17.229 270 2HB GLU 36 HB1 GLU 36 6.647 -2.922 18.028 271 1HG GLU 36 HG2 GLU 36 9.232 -2.105 19.317 272 2HG GLU 36 HG1 GLU 36 7.968 -1.005 18.760 273 H THR 37 HN THR 37 8.676 -5.178 16.285 274 HA THR 37 HA THR 37 6.225 -6.256 15.425 275 HB THR 37 HB THR 37 8.988 -6.639 14.250 276 HG1 THR 37 HG1 THR 37 8.491 -4.459 14.260 277 1HG2 THR 37 HG21 THR 37 7.343 -8.264 13.409 278 2HG2 THR 37 HG22 THR 37 7.760 -7.089 12.160 279 3HG2 THR 37 HG23 THR 37 6.236 -6.948 13.032 280 H VAL 38 HN VAL 38 9.275 -7.814 16.564 281 HA VAL 38 HA VAL 38 8.383 -10.459 16.106 282 HB VAL 38 HB VAL 38 10.774 -9.722 16.604 283 1HG1 VAL 38 HG11 VAL 38 11.631 -9.763 18.859 284 2HG1 VAL 38 HG12 VAL 38 10.000 -10.024 19.460 285 3HG1 VAL 38 HG13 VAL 38 10.389 -8.509 18.673 286 1HG2 VAL 38 HG21 VAL 38 9.737 -12.165 18.016 287 2HG2 VAL 38 HG22 VAL 38 11.433 -11.846 17.635 288 3HG2 VAL 38 HG23 VAL 38 10.261 -12.051 16.330 289 H ILE 39 HN ILE 39 8.127 -8.383 18.857 290 HA ILE 39 HA ILE 39 6.936 -10.185 20.687 291 HB ILE 39 HB ILE 39 6.636 -7.168 20.524 292 1HG1 ILE 39 HG12 ILE 39 8.425 -8.855 22.270 293 2HG1 ILE 39 HG11 ILE 39 8.939 -8.051 20.790 294 1HG2 ILE 39 HG21 ILE 39 4.827 -8.114 21.887 295 2HG2 ILE 39 HG22 ILE 39 6.000 -7.270 22.909 296 3HG2 ILE 39 HG23 ILE 39 6.008 -9.024 22.830 297 1HD1 ILE 39 HD11 ILE 39 8.409 -5.894 21.780 298 2HD1 ILE 39 HD12 ILE 39 9.575 -6.790 22.756 299 3HD1 ILE 39 HD13 ILE 39 7.883 -6.706 23.255 300 H SER 40 HN SER 40 5.509 -8.264 18.125 301 HA SER 40 HA SER 40 2.825 -8.816 18.936 302 1HB SER 40 HB2 SER 40 3.889 -7.787 16.296 303 2HB SER 40 HB1 SER 40 2.194 -7.791 16.791 304 HG SER 40 HG SER 40 4.013 -6.623 18.542 305 H GLU 41 HN GLU 41 5.142 -10.316 16.662 306 HA GLU 41 HA GLU 41 3.240 -12.086 15.559 307 1HB GLU 41 HB2 GLU 41 6.259 -12.128 15.543 308 2HB GLU 41 HB1 GLU 41 5.186 -13.045 14.504 309 1HG GLU 41 HG2 GLU 41 5.458 -10.041 14.538 310 2HG GLU 41 HG1 GLU 41 6.163 -11.119 13.341 311 H TRP 42 HN TRP 42 5.325 -11.997 18.297 312 HA TRP 42 HA TRP 42 5.418 -14.820 18.819 313 1HB TRP 42 HB2 TRP 42 7.270 -13.240 19.329 314 2HB TRP 42 HB1 TRP 42 6.237 -12.422 20.478 315 HD1 TRP 42 HD1 TRP 42 6.204 -13.390 22.921 316 HE1 TRP 42 HE1 TRP 42 7.463 -15.243 24.100 317 HE3 TRP 42 HE3 TRP 42 8.143 -15.693 18.805 318 HZ2 TRP 42 HZ2 TRP 42 9.086 -17.503 23.349 319 HZ3 TRP 42 HZ3 TRP 42 9.533 -17.703 19.119 320 HH2 TRP 42 HH2 TRP 42 9.991 -18.579 21.355 321 HA PRO 43 HA PRO 43 1.480 -14.858 21.005 322 1HB PRO 43 HB2 PRO 43 2.683 -17.122 22.476 323 2HB PRO 43 HB1 PRO 43 1.184 -17.066 21.560 324 1HG PRO 43 HG2 PRO 43 3.307 -18.341 20.592 325 2HG PRO 43 HG1 PRO 43 2.271 -17.385 19.521 326 1HD PRO 43 HD2 PRO 43 4.942 -16.692 20.677 327 2HD PRO 43 HD1 PRO 43 4.293 -16.404 19.045 328 H ARG 44 HN ARG 44 0.922 -13.687 22.707 329 HA ARG 44 HA ARG 44 2.819 -12.997 24.729 330 1HB ARG 44 HB2 ARG 44 -0.109 -12.296 24.448 331 2HB ARG 44 HB1 ARG 44 0.830 -11.829 25.852 332 1HG ARG 44 HG2 ARG 44 0.770 -9.949 24.396 333 2HG ARG 44 HG1 ARG 44 2.388 -10.623 24.318 334 1HD ARG 44 HD2 ARG 44 1.780 -11.743 22.202 335 2HD ARG 44 HD1 ARG 44 0.191 -10.974 22.275 336 HE ARG 44 HE ARG 44 2.755 -9.571 22.042 337 1HH1 ARG 44 HH11 ARG 44 -0.736 -9.722 21.329 338 2HH1 ARG 44 HH12 ARG 44 -0.773 -8.258 20.489 339 1HH2 ARG 44 HH21 ARG 44 2.681 -7.493 20.844 340 2HH2 ARG 44 HH22 ARG 44 1.191 -6.983 20.213 341 H GLU 45 HN GLU 45 0.526 -15.404 24.344 342 HA GLU 45 HA GLU 45 0.316 -16.134 27.133 343 1HB GLU 45 HB2 GLU 45 -1.554 -16.440 25.557 344 2HB GLU 45 HB1 GLU 45 -0.576 -17.527 24.593 345 1HG GLU 45 HG2 GLU 45 -0.506 -19.086 26.507 346 2HG GLU 45 HG1 GLU 45 -1.566 -17.994 27.397 347 H LYS 46 HN LYS 46 2.782 -16.345 24.954 348 HA LYS 46 HA LYS 46 3.559 -19.031 24.955 349 1HB LYS 46 HB2 LYS 46 4.511 -17.254 23.413 350 2HB LYS 46 HB1 LYS 46 5.380 -16.644 24.789 351 1HG LYS 46 HG2 LYS 46 6.825 -18.008 23.390 352 2HG LYS 46 HG1 LYS 46 6.637 -18.703 25.001 353 1HD LYS 46 HD2 LYS 46 5.017 -20.300 24.142 354 2HD LYS 46 HD1 LYS 46 5.126 -19.577 22.537 355 1HE LYS 46 HE2 LYS 46 7.490 -20.212 22.428 356 2HE LYS 46 HE1 LYS 46 7.374 -20.918 24.037 357 1HZ LYS 46 HZ1 LYS 46 5.778 -22.542 23.159 358 2HZ LYS 46 HZ2 LYS 46 7.215 -22.587 22.279 359 3HZ LYS 46 HZ3 LYS 46 5.877 -21.833 21.633 360 H GLU 47 HN GLU 47 3.702 -20.100 26.782 361 HA GLU 47 HA GLU 47 4.943 -19.040 29.065 362 1HB GLU 47 HB2 GLU 47 4.674 -21.380 29.946 363 2HB GLU 47 HB1 GLU 47 3.193 -20.556 29.487 364 1HG GLU 47 HG2 GLU 47 3.150 -21.762 27.396 365 2HG GLU 47 HG1 GLU 47 4.677 -22.557 27.789 366 H ASN 48 HN ASN 48 6.833 -19.907 30.005 367 HA ASN 48 HA ASN 48 9.076 -20.290 29.980 368 1HB ASN 48 HB2 ASN 48 8.380 -22.309 27.817 369 2HB ASN 48 HB1 ASN 48 9.946 -22.201 28.608 370 1HD2 ASN 48 HD21 ASN 48 6.654 -23.224 28.875 371 2HD2 ASN 48 HD22 ASN 48 6.817 -24.065 30.366 372 H GLY 49 HN GLY 49 7.766 -18.418 28.012 373 1HA GLY 49 HA2 GLY 49 10.208 -17.932 26.510 374 2HA GLY 49 HA1 GLY 49 8.656 -17.916 25.680 375 HA PRO 50 HA PRO 50 9.761 -13.646 27.475 376 1HB PRO 50 HB2 PRO 50 9.773 -12.931 24.626 377 2HB PRO 50 HB1 PRO 50 10.930 -12.518 25.883 378 1HG PRO 50 HG2 PRO 50 11.578 -14.266 24.003 379 2HG PRO 50 HG1 PRO 50 12.047 -14.566 25.689 380 1HD PRO 50 HD2 PRO 50 9.715 -15.657 24.162 381 2HD PRO 50 HD1 PRO 50 10.894 -16.539 25.158 382 H LYS 51 HN LYS 51 8.505 -11.735 27.236 383 HA LYS 51 HA LYS 51 6.094 -11.939 25.625 384 1HB LYS 51 HB2 LYS 51 6.191 -11.449 28.555 385 2HB LYS 51 HB1 LYS 51 5.138 -10.391 27.643 386 1HG LYS 51 HG2 LYS 51 3.833 -12.209 28.476 387 2HG LYS 51 HG1 LYS 51 3.970 -12.382 26.740 388 1HD LYS 51 HD2 LYS 51 4.189 -14.548 27.713 389 2HD LYS 51 HD1 LYS 51 5.785 -14.064 27.144 390 1HE LYS 51 HE2 LYS 51 6.424 -13.449 29.403 391 2HE LYS 51 HE1 LYS 51 4.803 -13.833 29.981 392 1HZ LYS 51 HZ1 LYS 51 5.161 -16.115 29.249 393 2HZ LYS 51 HZ2 LYS 51 6.223 -15.661 30.457 394 3HZ LYS 51 HZ3 LYS 51 6.764 -15.757 28.834 395 H THR 52 HN THR 52 8.532 -9.817 27.096 396 HA THR 52 HA THR 52 7.775 -7.914 25.124 397 HB THR 52 HB THR 52 8.319 -6.041 26.791 398 HG1 THR 52 HG1 THR 52 9.004 -7.646 28.434 399 1HG2 THR 52 HG21 THR 52 5.978 -5.961 27.569 400 2HG2 THR 52 HG22 THR 52 5.775 -7.641 27.065 401 3HG2 THR 52 HG23 THR 52 6.103 -6.396 25.866 402 H VAL 53 HN VAL 53 9.413 -5.984 25.306 403 HA VAL 53 HA VAL 53 11.513 -6.785 23.716 404 HB VAL 53 HB VAL 53 10.566 -4.618 23.542 405 1HG1 VAL 53 HG11 VAL 53 10.965 -2.828 25.212 406 2HG1 VAL 53 HG12 VAL 53 11.767 -4.007 26.249 407 3HG1 VAL 53 HG13 VAL 53 10.055 -4.173 25.901 408 1HG2 VAL 53 HG21 VAL 53 12.804 -4.723 22.712 409 2HG2 VAL 53 HG22 VAL 53 13.468 -4.472 24.324 410 3HG2 VAL 53 HG23 VAL 53 12.604 -3.167 23.516 411 H LYS 54 HN LYS 54 11.623 -6.303 27.225 412 HA LYS 54 HA LYS 54 14.484 -6.269 27.184 413 1HB LYS 54 HB2 LYS 54 13.218 -5.068 28.952 414 2HB LYS 54 HB1 LYS 54 12.643 -6.615 29.562 415 1HG LYS 54 HG2 LYS 54 14.923 -7.278 30.104 416 2HG LYS 54 HG1 LYS 54 15.526 -5.774 29.418 417 1HD LYS 54 HD2 LYS 54 15.478 -5.627 31.842 418 2HD LYS 54 HD1 LYS 54 14.305 -4.516 31.144 419 1HE LYS 54 HE2 LYS 54 12.506 -6.068 31.638 420 2HE LYS 54 HE1 LYS 54 13.665 -7.246 32.262 421 1HZ LYS 54 HZ1 LYS 54 12.608 -6.010 34.050 422 2HZ LYS 54 HZ2 LYS 54 13.142 -4.551 33.414 423 3HZ LYS 54 HZ3 LYS 54 14.252 -5.680 33.999 424 H GLU 55 HN GLU 55 12.014 -8.673 27.562 425 HA GLU 55 HA GLU 55 14.088 -10.536 28.293 426 1HB GLU 55 HB2 GLU 55 12.214 -12.251 28.628 427 2HB GLU 55 HB1 GLU 55 12.441 -10.973 29.796 428 1HG GLU 55 HG2 GLU 55 10.381 -10.848 27.610 429 2HG GLU 55 HG1 GLU 55 10.140 -11.590 29.196 430 H VAL 56 HN VAL 56 12.729 -9.654 25.467 431 HA VAL 56 HA VAL 56 13.602 -12.192 24.265 432 HB VAL 56 HB VAL 56 11.339 -11.481 23.525 433 1HG1 VAL 56 HG11 VAL 56 11.495 -9.089 23.760 434 2HG1 VAL 56 HG12 VAL 56 10.994 -9.502 22.120 435 3HG1 VAL 56 HG13 VAL 56 12.657 -9.009 22.437 436 1HG2 VAL 56 HG21 VAL 56 13.395 -11.275 21.332 437 2HG2 VAL 56 HG22 VAL 56 11.677 -11.582 21.088 438 3HG2 VAL 56 HG23 VAL 56 12.668 -12.756 21.954 439 H LYS 57 HN LYS 57 15.645 -12.270 23.560 440 HA LYS 57 HA LYS 57 16.935 -9.709 23.031 441 1HB LYS 57 HB2 LYS 57 18.066 -12.354 23.862 442 2HB LYS 57 HB1 LYS 57 19.034 -10.941 23.470 443 1HG LYS 57 HG2 LYS 57 17.991 -9.741 25.340 444 2HG LYS 57 HG1 LYS 57 17.032 -11.176 25.709 445 1HD LYS 57 HD2 LYS 57 19.099 -12.441 26.099 446 2HD LYS 57 HD1 LYS 57 20.042 -10.991 25.753 447 1HE LYS 57 HE2 LYS 57 18.993 -9.852 27.634 448 2HE LYS 57 HE1 LYS 57 18.020 -11.279 27.964 449 1HZ LYS 57 HZ1 LYS 57 20.078 -12.499 28.370 450 2HZ LYS 57 HZ2 LYS 57 19.887 -11.231 29.436 451 3HZ LYS 57 HZ3 LYS 57 20.981 -11.094 28.145 452 H LEU 58 HN LEU 58 17.631 -9.254 21.101 453 HA LEU 58 HA LEU 58 17.707 -11.354 19.063 454 1HB LEU 58 HB2 LEU 58 17.459 -8.340 18.838 455 2HB LEU 58 HB1 LEU 58 17.886 -9.338 17.470 456 HG LEU 58 HG LEU 58 15.499 -8.703 17.401 457 1HD1 LEU 58 HD11 LEU 58 14.567 -10.920 17.116 458 2HD1 LEU 58 HD12 LEU 58 15.956 -11.611 17.960 459 3HD1 LEU 58 HD13 LEU 58 16.180 -10.788 16.417 460 1HD2 LEU 58 HD21 LEU 58 15.143 -8.531 19.833 461 2HD2 LEU 58 HD22 LEU 58 15.238 -10.289 19.959 462 3HD2 LEU 58 HD23 LEU 58 13.928 -9.536 19.044 463 H ILE 59 HN ILE 59 19.591 -12.079 18.447 464 HA ILE 59 HA ILE 59 21.931 -10.403 18.932 465 HB ILE 59 HB ILE 59 21.635 -13.378 19.371 466 1HG1 ILE 59 HG12 ILE 59 22.502 -11.091 21.117 467 2HG1 ILE 59 HG11 ILE 59 20.996 -11.993 21.249 468 1HG2 ILE 59 HG21 ILE 59 24.231 -11.845 19.298 469 2HG2 ILE 59 HG22 ILE 59 23.716 -13.080 18.149 470 3HG2 ILE 59 HG23 ILE 59 24.034 -13.516 19.829 471 1HD1 ILE 59 HD11 ILE 59 22.541 -12.644 22.991 472 2HD1 ILE 59 HD12 ILE 59 23.780 -12.995 21.790 473 3HD1 ILE 59 HD13 ILE 59 22.327 -13.988 21.866 474 H SER 60 HN SER 60 23.334 -10.100 17.386 475 HA SER 60 HA SER 60 23.284 -11.781 15.014 476 1HB SER 60 HB2 SER 60 23.403 -8.762 15.088 477 2HB SER 60 HB1 SER 60 23.471 -9.776 13.648 478 HG SER 60 HG SER 60 21.353 -10.452 15.092 479 H ALA 61 HN ALA 61 25.324 -12.393 14.496 480 HA ALA 61 HA ALA 61 27.549 -12.636 14.463 481 1HB ALA 61 HB1 ALA 61 28.987 -10.663 14.420 482 2HB ALA 61 HB2 ALA 61 27.686 -9.682 15.099 483 3HB ALA 61 HB3 ALA 61 27.520 -10.363 13.482 484 H GLY 62 HN GLY 62 26.008 -12.645 17.021 485 1HA GLY 62 HA2 GLY 62 26.647 -13.563 19.106 486 2HA GLY 62 HA1 GLY 62 28.314 -13.126 18.752 487 H LYS 63 HN LYS 63 25.812 -10.750 18.403 488 HA LYS 63 HA LYS 63 26.509 -9.594 20.990 489 1HB LYS 63 HB2 LYS 63 27.869 -8.485 19.324 490 2HB LYS 63 HB1 LYS 63 26.464 -8.196 18.318 491 1HG LYS 63 HG2 LYS 63 27.131 -6.158 19.434 492 2HG LYS 63 HG1 LYS 63 25.563 -6.687 20.036 493 1HD LYS 63 HD2 LYS 63 26.633 -7.623 21.997 494 2HD LYS 63 HD1 LYS 63 28.216 -7.136 21.383 495 1HE LYS 63 HE2 LYS 63 27.492 -4.802 21.440 496 2HE LYS 63 HE1 LYS 63 25.929 -5.310 22.081 497 1HZ LYS 63 HZ1 LYS 63 28.558 -5.695 23.403 498 2HZ LYS 63 HZ2 LYS 63 27.068 -6.211 24.003 499 3HZ LYS 63 HZ3 LYS 63 27.369 -4.570 23.828 500 H VAL 64 HN VAL 64 24.796 -8.823 22.081 501 HA VAL 64 HA VAL 64 22.116 -9.113 21.084 502 HB VAL 64 HB VAL 64 23.061 -7.684 23.590 503 1HG1 VAL 64 HG11 VAL 64 20.771 -8.052 24.421 504 2HG1 VAL 64 HG12 VAL 64 20.328 -8.745 22.860 505 3HG1 VAL 64 HG13 VAL 64 20.800 -7.051 22.969 506 1HG2 VAL 64 HG21 VAL 64 22.102 -10.529 23.289 507 2HG2 VAL 64 HG22 VAL 64 22.523 -9.742 24.813 508 3HG2 VAL 64 HG23 VAL 64 23.764 -10.039 23.595 509 H LEU 65 HN LEU 65 21.085 -7.729 19.899 510 HA LEU 65 HA LEU 65 22.151 -5.285 19.036 511 1HB LEU 65 HB2 LEU 65 19.330 -6.315 18.861 512 2HB LEU 65 HB1 LEU 65 20.006 -4.989 17.941 513 HG LEU 65 HG LEU 65 20.839 -7.874 17.736 514 1HD1 LEU 65 HD11 LEU 65 19.271 -6.125 15.847 515 2HD1 LEU 65 HD12 LEU 65 18.621 -7.445 16.811 516 3HD1 LEU 65 HD13 LEU 65 19.787 -7.782 15.529 517 1HD2 LEU 65 HD21 LEU 65 21.702 -5.458 16.157 518 2HD2 LEU 65 HD22 LEU 65 22.120 -7.127 15.785 519 3HD2 LEU 65 HD23 LEU 65 22.703 -6.387 17.275 520 H GLU 66 HN GLU 66 21.761 -3.237 19.618 521 HA GLU 66 HA GLU 66 20.331 -2.781 22.102 522 1HB GLU 66 HB2 GLU 66 22.722 -2.038 21.775 523 2HB GLU 66 HB1 GLU 66 22.178 -0.972 20.503 524 1HG GLU 66 HG2 GLU 66 21.245 -0.727 23.354 525 2HG GLU 66 HG1 GLU 66 22.699 0.055 22.765 526 H ASN 67 HN ASN 67 18.424 -1.813 22.107 527 HA ASN 67 HA ASN 67 16.752 -1.805 19.907 528 1HB ASN 67 HB2 ASN 67 16.323 -0.169 22.406 529 2HB ASN 67 HB1 ASN 67 15.100 -0.569 21.221 530 1HD2 ASN 67 HD21 ASN 67 15.083 -1.101 23.975 531 2HD2 ASN 67 HD22 ASN 67 15.005 -2.798 24.218 532 H SER 68 HN SER 68 18.826 0.858 20.833 533 HA SER 68 HA SER 68 17.230 2.793 19.424 534 1HB SER 68 HB2 SER 68 20.023 3.132 20.486 535 2HB SER 68 HB1 SER 68 18.854 4.407 20.134 536 HG SER 68 HG SER 68 18.908 2.495 22.138 537 H LYS 69 HN LYS 69 19.606 0.585 18.552 538 HA LYS 69 HA LYS 69 20.614 2.052 16.306 539 1HB LYS 69 HB2 LYS 69 20.901 -0.779 17.228 540 2HB LYS 69 HB1 LYS 69 21.493 -0.244 15.682 541 1HG LYS 69 HG2 LYS 69 22.299 1.041 18.245 542 2HG LYS 69 HG1 LYS 69 23.231 -0.300 17.527 543 1HD LYS 69 HD2 LYS 69 23.415 1.158 15.480 544 2HD LYS 69 HD1 LYS 69 22.659 2.446 16.418 545 1HE LYS 69 HE2 LYS 69 24.498 2.372 18.018 546 2HE LYS 69 HE1 LYS 69 25.236 1.049 17.119 547 1HZ LYS 69 HZ1 LYS 69 26.291 3.099 16.508 548 2HZ LYS 69 HZ2 LYS 69 24.825 3.826 16.170 549 3HZ LYS 69 HZ3 LYS 69 25.368 2.559 15.188 550 H THR 70 HN THR 70 20.427 1.148 14.114 551 HA THR 70 HA THR 70 17.826 0.026 13.653 552 HB THR 70 HB THR 70 18.270 0.969 11.374 553 HG1 THR 70 HG1 THR 70 19.896 2.371 11.080 554 1HG2 THR 70 HG21 THR 70 16.725 2.093 12.875 555 2HG2 THR 70 HG22 THR 70 17.681 3.303 12.012 556 3HG2 THR 70 HG23 THR 70 18.066 2.899 13.682 557 H VAL 71 HN VAL 71 17.776 -1.579 11.991 558 HA VAL 71 HA VAL 71 19.790 -3.496 12.305 559 HB VAL 71 HB VAL 71 17.740 -3.265 10.064 560 1HG1 VAL 71 HG11 VAL 71 19.507 -4.813 9.517 561 2HG1 VAL 71 HG12 VAL 71 18.001 -5.687 9.826 562 3HG1 VAL 71 HG13 VAL 71 19.281 -5.665 11.043 563 1HG2 VAL 71 HG21 VAL 71 17.579 -4.714 12.706 564 2HG2 VAL 71 HG22 VAL 71 16.371 -4.783 11.422 565 3HG2 VAL 71 HG23 VAL 71 16.687 -3.262 12.255 566 H LYS 72 HN LYS 72 19.108 -1.283 9.674 567 HA LYS 72 HA LYS 72 21.157 -1.919 7.936 568 1HB LYS 72 HB2 LYS 72 19.249 -0.516 7.344 569 2HB LYS 72 HB1 LYS 72 19.847 0.759 8.395 570 1HG LYS 72 HG2 LYS 72 21.773 1.073 6.953 571 2HG LYS 72 HG1 LYS 72 21.239 -0.262 5.927 572 1HD LYS 72 HD2 LYS 72 19.182 0.967 5.406 573 2HD LYS 72 HD1 LYS 72 19.724 2.305 6.418 574 1HE LYS 72 HE2 LYS 72 21.636 2.651 4.958 575 2HE LYS 72 HE1 LYS 72 21.160 1.269 3.977 576 1HZ LYS 72 HZ1 LYS 72 19.111 2.433 3.433 577 2HZ LYS 72 HZ2 LYS 72 20.458 3.299 2.941 578 3HZ LYS 72 HZ3 LYS 72 19.603 3.790 4.308 579 H ASP 73 HN ASP 73 21.300 0.160 10.809 580 HA ASP 73 HA ASP 73 23.861 1.290 10.140 581 1HB ASP 73 HB2 ASP 73 22.290 2.343 11.952 582 2HB ASP 73 HB1 ASP 73 22.717 0.959 12.910 583 H TYR 74 HN TYR 74 22.686 -1.454 11.861 584 HA TYR 74 HA TYR 74 25.155 -2.122 13.103 585 1HB TYR 74 HB2 TYR 74 22.853 -2.705 13.938 586 2HB TYR 74 HB1 TYR 74 22.762 -3.898 12.650 587 HD1 TYR 74 HD1 TYR 74 24.133 -5.934 12.751 588 HD2 TYR 74 HD2 TYR 74 24.272 -2.985 15.801 589 HE1 TYR 74 HE1 TYR 74 25.302 -7.520 14.231 590 HE2 TYR 74 HE2 TYR 74 25.416 -4.532 17.272 591 HH TYR 74 HH TYR 74 26.713 -7.511 16.156 592 H ARG 75 HN ARG 75 23.387 -3.270 10.179 593 HA ARG 75 HA ARG 75 25.180 -5.336 9.610 594 1HB ARG 75 HB2 ARG 75 23.213 -3.877 7.875 595 2HB ARG 75 HB1 ARG 75 23.968 -5.427 7.565 596 1HG ARG 75 HG2 ARG 75 22.809 -6.347 9.529 597 2HG ARG 75 HG1 ARG 75 22.020 -4.793 9.752 598 1HD ARG 75 HD2 ARG 75 20.506 -6.229 8.608 599 2HD ARG 75 HD1 ARG 75 21.072 -5.019 7.454 600 HE ARG 75 HE ARG 75 22.668 -7.319 7.352 601 1HH1 ARG 75 HH11 ARG 75 19.558 -6.011 6.290 602 2HH1 ARG 75 HH12 ARG 75 19.223 -7.266 5.203 603 1HH2 ARG 75 HH21 ARG 75 22.245 -9.054 5.841 604 2HH2 ARG 75 HH22 ARG 75 20.807 -9.078 4.929 605 H SER 76 HN SER 76 27.145 -5.075 8.683 606 HA SER 76 HA SER 76 27.994 -2.593 7.681 607 1HB SER 76 HB2 SER 76 29.142 -5.373 7.396 608 2HB SER 76 HB1 SER 76 30.001 -3.863 7.079 609 HG SER 76 HG SER 76 28.913 -3.661 9.456 610 HA PRO 77 HA PRO 77 26.005 -3.054 3.685 611 1HB PRO 77 HB2 PRO 77 27.980 -1.196 2.689 612 2HB PRO 77 HB1 PRO 77 26.229 -1.006 2.743 613 1HG PRO 77 HG2 PRO 77 27.884 0.417 4.386 614 2HG PRO 77 HG1 PRO 77 26.247 -0.057 4.851 615 1HD PRO 77 HD2 PRO 77 28.859 -1.184 5.699 616 2HD PRO 77 HD1 PRO 77 27.318 -1.070 6.578 617 H VAL 78 HN VAL 78 26.527 -4.831 2.737 618 HA VAL 78 HA VAL 78 29.270 -5.137 1.758 619 HB VAL 78 HB VAL 78 28.883 -6.697 3.611 620 1HG1 VAL 78 HG11 VAL 78 26.527 -7.068 3.438 621 2HG1 VAL 78 HG12 VAL 78 27.375 -8.617 3.364 622 3HG1 VAL 78 HG13 VAL 78 26.732 -7.888 1.893 623 1HG2 VAL 78 HG21 VAL 78 30.475 -7.361 1.916 624 2HG2 VAL 78 HG22 VAL 78 29.187 -8.078 0.952 625 3HG2 VAL 78 HG23 VAL 78 29.614 -8.779 2.514 626 H SER 79 HN SER 79 26.041 -5.903 1.075 627 HA SER 79 HA SER 79 26.488 -5.666 -1.770 628 1HB SER 79 HB2 SER 79 25.581 -8.337 -0.651 629 2HB SER 79 HB1 SER 79 25.664 -7.912 -2.358 630 HG SER 79 HG SER 79 27.999 -7.347 -1.420 631 H ASN 80 HN ASN 80 24.748 -4.679 -2.550 632 HA ASN 80 HA ASN 80 22.267 -4.688 -1.066 633 1HB ASN 80 HB2 ASN 80 23.015 -2.565 -2.059 634 2HB ASN 80 HB1 ASN 80 23.024 -3.298 -3.655 635 1HD2 ASN 80 HD21 ASN 80 21.567 -1.832 -4.479 636 2HD2 ASN 80 HD22 ASN 80 19.890 -1.834 -4.039 637 H LEU 81 HN LEU 81 21.333 -6.721 -1.233 638 HA LEU 81 HA LEU 81 21.171 -8.003 -3.721 639 1HB LEU 81 HB2 LEU 81 20.419 -8.567 -0.932 640 2HB LEU 81 HB1 LEU 81 20.235 -9.686 -2.251 641 HG LEU 81 HG LEU 81 22.833 -8.617 -1.122 642 1HD1 LEU 81 HD11 LEU 81 21.672 -11.393 -1.065 643 2HD1 LEU 81 HD12 LEU 81 21.805 -10.282 0.300 644 3HD1 LEU 81 HD13 LEU 81 23.261 -10.928 -0.457 645 1HD2 LEU 81 HD21 LEU 81 23.969 -10.157 -2.667 646 2HD2 LEU 81 HD22 LEU 81 23.054 -8.927 -3.532 647 3HD2 LEU 81 HD23 LEU 81 22.417 -10.566 -3.396 648 H ALA 82 HN ALA 82 18.873 -9.184 -3.856 649 HA ALA 82 HA ALA 82 16.744 -7.479 -3.155 650 1HB ALA 82 HB1 ALA 82 17.379 -6.715 -5.392 651 2HB ALA 82 HB2 ALA 82 15.851 -7.591 -5.460 652 3HB ALA 82 HB3 ALA 82 17.341 -8.377 -5.981 653 H GLY 83 HN GLY 83 15.406 -8.775 -2.285 654 1HA GLY 83 HA2 GLY 83 13.997 -10.659 -1.985 655 2HA GLY 83 HA1 GLY 83 14.786 -11.399 -3.377 656 H ALA 84 HN ALA 84 16.092 -10.134 -0.366 657 HA ALA 84 HA ALA 84 17.420 -12.711 0.029 658 1HB ALA 84 HB1 ALA 84 18.977 -10.883 -0.418 659 2HB ALA 84 HB2 ALA 84 19.165 -11.478 1.232 660 3HB ALA 84 HB3 ALA 84 18.301 -9.970 0.929 661 H VAL 85 HN VAL 85 17.489 -13.549 2.128 662 HA VAL 85 HA VAL 85 15.558 -12.349 3.977 663 HB VAL 85 HB VAL 85 16.355 -15.271 3.737 664 1HG1 VAL 85 HG11 VAL 85 14.549 -15.711 5.352 665 2HG1 VAL 85 HG12 VAL 85 14.280 -13.976 5.508 666 3HG1 VAL 85 HG13 VAL 85 15.808 -14.679 6.036 667 1HG2 VAL 85 HG21 VAL 85 13.757 -13.918 3.003 668 2HG2 VAL 85 HG22 VAL 85 14.060 -15.654 2.943 669 3HG2 VAL 85 HG23 VAL 85 14.948 -14.558 1.876 670 H THR 86 HN THR 86 16.219 -11.939 5.961 671 HA THR 86 HA THR 86 19.017 -12.530 6.625 672 HB THR 86 HB THR 86 17.228 -10.330 7.697 673 HG1 THR 86 HG1 THR 86 18.144 -10.531 5.360 674 1HG2 THR 86 HG21 THR 86 19.358 -9.348 8.493 675 2HG2 THR 86 HG22 THR 86 20.231 -10.740 7.852 676 3HG2 THR 86 HG23 THR 86 19.101 -10.950 9.188 677 H THR 87 HN THR 87 19.389 -13.617 8.548 678 HA THR 87 HA THR 87 17.004 -14.328 10.095 679 HB THR 87 HB THR 87 19.465 -16.030 9.604 680 HG1 THR 87 HG1 THR 87 17.798 -15.566 7.854 681 1HG2 THR 87 HG21 THR 87 16.799 -16.673 10.897 682 2HG2 THR 87 HG22 THR 87 18.330 -16.485 11.753 683 3HG2 THR 87 HG23 THR 87 18.110 -17.820 10.620 684 H MET 88 HN MET 88 17.076 -13.745 12.153 685 HA MET 88 HA MET 88 19.699 -13.295 13.359 686 1HB MET 88 HB2 MET 88 17.227 -11.616 13.743 687 2HB MET 88 HB1 MET 88 18.599 -11.542 14.843 688 1HG MET 88 HG2 MET 88 20.060 -10.882 13.001 689 2HG MET 88 HG1 MET 88 18.702 -10.973 11.886 690 1HE MET 88 HE1 MET 88 16.341 -9.682 13.571 691 2HE MET 88 HE2 MET 88 16.740 -9.341 11.889 692 3HE MET 88 HE3 MET 88 16.483 -8.006 13.012 693 H HIS 89 HN HIS 89 20.046 -13.802 15.495 694 HA HIS 89 HA HIS 89 18.496 -16.144 16.207 695 1HB HIS 89 HB2 HIS 89 21.018 -16.118 16.070 696 2HB HIS 89 HB1 HIS 89 21.019 -15.082 17.481 697 HD1 HIS 89 HD1 HIS 89 22.050 -16.648 19.202 698 HD2 HIS 89 HD2 HIS 89 18.921 -18.404 17.096 699 HE1 HIS 89 HE1 HIS 89 21.661 -18.849 20.293 700 HE2 HIS 89 HE2 HIS 89 20.067 -20.006 18.731 701 H VAL 90 HN VAL 90 17.170 -16.258 17.855 702 HA VAL 90 HA VAL 90 16.830 -13.936 19.664 703 HB VAL 90 HB VAL 90 14.860 -16.140 19.006 704 1HG1 VAL 90 HG11 VAL 90 14.485 -13.537 20.479 705 2HG1 VAL 90 HG12 VAL 90 14.521 -15.141 21.201 706 3HG1 VAL 90 HG13 VAL 90 13.211 -14.698 20.102 707 1HG2 VAL 90 HG21 VAL 90 13.643 -14.492 17.705 708 2HG2 VAL 90 HG22 VAL 90 15.273 -14.759 17.052 709 3HG2 VAL 90 HG23 VAL 90 14.919 -13.312 17.993 710 H ILE 91 HN ILE 91 17.271 -14.075 21.539 711 HA ILE 91 HA ILE 91 17.669 -16.672 22.818 712 HB ILE 91 HB ILE 91 18.875 -13.988 23.194 713 1HG1 ILE 91 HG12 ILE 91 21.072 -15.270 23.169 714 2HG1 ILE 91 HG11 ILE 91 20.135 -16.704 22.798 715 1HG2 ILE 91 HG21 ILE 91 20.049 -14.823 25.284 716 2HG2 ILE 91 HG22 ILE 91 19.069 -16.283 25.191 717 3HG2 ILE 91 HG23 ILE 91 18.297 -14.723 25.473 718 1HD1 ILE 91 HD11 ILE 91 21.127 -15.749 20.803 719 2HD1 ILE 91 HD12 ILE 91 20.311 -14.215 21.112 720 3HD1 ILE 91 HD13 ILE 91 19.370 -15.654 20.731 721 H ILE 92 HN ILE 92 16.461 -17.205 24.393 722 HA ILE 92 HA ILE 92 14.288 -15.423 25.049 723 HB ILE 92 HB ILE 92 14.635 -18.411 25.261 724 1HG1 ILE 92 HG12 ILE 92 12.529 -18.480 23.901 725 2HG1 ILE 92 HG11 ILE 92 12.549 -16.728 23.838 726 1HG2 ILE 92 HG21 ILE 92 12.403 -16.837 26.496 727 2HG2 ILE 92 HG22 ILE 92 13.622 -17.811 27.318 728 3HG2 ILE 92 HG23 ILE 92 12.419 -18.593 26.287 729 1HD1 ILE 92 HD11 ILE 92 13.349 -17.715 21.772 730 2HD1 ILE 92 HD12 ILE 92 14.633 -18.554 22.655 731 3HD1 ILE 92 HD13 ILE 92 14.606 -16.786 22.587 732 H GLN 93 HN GLN 93 14.439 -14.274 26.842 733 HA GLN 93 HA GLN 93 15.765 -15.443 29.132 734 1HB GLN 93 HB2 GLN 93 16.524 -13.187 28.503 735 2HB GLN 93 HB1 GLN 93 14.862 -12.616 28.501 736 1HG GLN 93 HG2 GLN 93 14.719 -12.981 30.903 737 2HG GLN 93 HG1 GLN 93 16.363 -13.627 30.893 738 1HE2 GLN 93 HE21 GLN 93 15.202 -11.291 32.302 739 2HE2 GLN 93 HE22 GLN 93 16.189 -9.959 31.793 740 H ALA 94 HN ALA 94 14.386 -16.528 30.265 741 HA ALA 94 HA ALA 94 11.579 -16.214 29.934 742 1HB ALA 94 HB1 ALA 94 12.588 -18.412 30.312 743 2HB ALA 94 HB2 ALA 94 11.331 -18.044 31.491 744 3HB ALA 94 HB3 ALA 94 13.033 -17.912 31.944 745 HA PRO 95 HA PRO 95 11.184 -13.185 33.216 746 1HB PRO 95 HB2 PRO 95 8.613 -12.568 32.703 747 2HB PRO 95 HB1 PRO 95 9.922 -11.988 31.664 748 1HG PRO 95 HG2 PRO 95 8.026 -14.254 31.253 749 2HG PRO 95 HG1 PRO 95 8.625 -13.065 30.082 750 1HD PRO 95 HD2 PRO 95 9.598 -15.613 30.331 751 2HD PRO 95 HD1 PRO 95 10.532 -14.251 29.681 752 H VAL 96 HN VAL 96 9.438 -12.915 34.951 753 HA VAL 96 HA VAL 96 9.069 -15.519 36.045 754 HB VAL 96 HB VAL 96 9.862 -13.797 37.578 755 1HG1 VAL 96 HG11 VAL 96 7.226 -12.420 37.200 756 2HG1 VAL 96 HG12 VAL 96 8.811 -11.835 36.695 757 3HG1 VAL 96 HG13 VAL 96 8.434 -11.994 38.410 758 1HG2 VAL 96 HG21 VAL 96 7.125 -14.796 38.353 759 2HG2 VAL 96 HG22 VAL 96 8.335 -14.171 39.474 760 3HG2 VAL 96 HG23 VAL 96 8.654 -15.651 38.570 761 H THR 97 HN THR 97 7.720 -16.333 34.489 762 HA THR 97 HA THR 97 4.957 -16.137 35.196 763 HB THR 97 HB THR 97 4.650 -16.658 32.750 764 HG1 THR 97 HG1 THR 97 7.067 -16.738 32.557 765 1HG2 THR 97 HG21 THR 97 5.475 -13.856 33.512 766 2HG2 THR 97 HG22 THR 97 3.859 -14.547 33.675 767 3HG2 THR 97 HG23 THR 97 4.536 -14.256 32.073 768 H GLU 98 HN GLU 98 4.333 -18.234 35.672 769 HA GLU 98 HA GLU 98 5.777 -20.464 34.473 770 1HB GLU 98 HB2 GLU 98 6.327 -21.401 36.654 771 2HB GLU 98 HB1 GLU 98 7.096 -19.831 36.434 772 1HG GLU 98 HG2 GLU 98 5.255 -18.813 37.738 773 2HG GLU 98 HG1 GLU 98 4.632 -20.430 38.050 774 H LYS 99 HN LYS 99 4.780 -22.563 35.377 775 HA LYS 99 HA LYS 99 2.004 -22.216 35.420 776 1HB LYS 99 HB2 LYS 99 1.887 -24.717 35.394 777 2HB LYS 99 HB1 LYS 99 2.754 -24.016 34.043 778 1HG LYS 99 HG2 LYS 99 4.891 -24.558 35.144 779 2HG LYS 99 HG1 LYS 99 4.003 -25.282 36.484 780 1HD LYS 99 HD2 LYS 99 3.960 -26.207 33.606 781 2HD LYS 99 HD1 LYS 99 4.829 -26.969 34.923 782 1HE LYS 99 HE2 LYS 99 2.721 -27.460 36.064 783 2HE LYS 99 HE1 LYS 99 1.831 -26.636 34.795 784 1HZ LYS 99 HZ1 LYS 99 3.498 -29.058 34.374 785 2HZ LYS 99 HZ2 LYS 99 2.559 -28.263 33.214 786 3HZ LYS 99 HZ3 LYS 99 1.819 -29.025 34.509 787 H GLU 100 HN GLU 100 1.545 -21.297 37.366 788 HA GLU 100 HA GLU 100 2.351 -22.775 39.701 789 1HB GLU 100 HB2 GLU 100 1.572 -20.617 40.931 790 2HB GLU 100 HB1 GLU 100 3.115 -20.624 40.089 791 1HG GLU 100 HG2 GLU 100 2.127 -19.459 38.212 792 2HG GLU 100 HG1 GLU 100 0.539 -19.553 38.952 793 H LYS 101 HN LYS 101 -0.477 -20.677 39.703 794 HA LYS 101 HA LYS 101 -2.373 -22.651 39.390 795 1HB LYS 101 HB2 LYS 101 -3.283 -22.751 41.722 796 2HB LYS 101 HB1 LYS 101 -1.751 -23.579 41.537 797 1HG LYS 101 HG2 LYS 101 -0.606 -21.691 42.597 798 2HG LYS 101 HG1 LYS 101 -2.143 -20.843 42.750 799 1HD LYS 101 HD2 LYS 101 -1.476 -23.497 44.040 800 2HD LYS 101 HD1 LYS 101 -1.449 -21.937 44.856 801 1HE LYS 101 HE2 LYS 101 -3.851 -21.670 44.392 802 2HE LYS 101 HE1 LYS 101 -3.865 -23.236 43.594 803 1HZ LYS 101 HZ1 LYS 101 -3.240 -24.267 45.682 804 2HZ LYS 101 HZ2 LYS 101 -4.663 -23.387 45.860 805 3HZ LYS 101 HZ3 LYS 101 -3.218 -22.768 46.453 Start of MODEL 4 1 H GLU 1 HT1 GLU 1 1.792 -10.094 1.768 2 HA GLU 1 HA GLU 1 0.012 -8.790 2.624 3 1HB GLU 1 HB2 GLU 1 0.514 -10.300 5.214 4 2HB GLU 1 HB1 GLU 1 -0.618 -8.976 4.998 5 1HG GLU 1 HG2 GLU 1 -1.927 -10.351 3.448 6 2HG GLU 1 HG1 GLU 1 -0.792 -11.676 3.672 7 H ALA 2 HN ALA 2 1.269 -7.041 2.348 8 HA ALA 2 HA ALA 2 2.847 -5.421 2.658 9 1HB ALA 2 HB1 ALA 2 2.739 -6.345 5.544 10 2HB ALA 2 HB2 ALA 2 1.653 -5.158 4.816 11 3HB ALA 2 HB3 ALA 2 3.369 -4.796 4.982 12 H GLU 3 HN GLU 3 3.731 -7.710 1.697 13 HA GLU 3 HA GLU 3 6.337 -8.018 2.834 14 1HB GLU 3 HB2 GLU 3 4.966 -9.914 3.442 15 2HB GLU 3 HB1 GLU 3 4.529 -10.165 1.765 16 1HG GLU 3 HG2 GLU 3 6.874 -10.687 1.270 17 2HG GLU 3 HG1 GLU 3 7.251 -10.539 2.991 18 H VAL 4 HN VAL 4 7.531 -6.974 1.246 19 HA VAL 4 HA VAL 4 7.126 -7.883 -1.504 20 HB VAL 4 HB VAL 4 8.250 -5.194 -0.683 21 1HG1 VAL 4 HG11 VAL 4 7.398 -6.222 -3.379 22 2HG1 VAL 4 HG12 VAL 4 9.050 -5.914 -2.843 23 3HG1 VAL 4 HG13 VAL 4 7.920 -4.574 -3.040 24 1HG2 VAL 4 HG21 VAL 4 5.890 -5.263 -0.066 25 2HG2 VAL 4 HG22 VAL 4 5.472 -5.796 -1.695 26 3HG2 VAL 4 HG23 VAL 4 6.132 -4.183 -1.443 27 H HIS 5 HN HIS 5 9.003 -8.418 -2.609 28 HA HIS 5 HA HIS 5 11.174 -9.232 -0.852 29 1HB HIS 5 HB2 HIS 5 10.060 -10.791 -2.505 30 2HB HIS 5 HB1 HIS 5 10.766 -9.845 -3.796 31 HD1 HIS 5 HD1 HIS 5 11.798 -12.157 -0.924 32 HD2 HIS 5 HD2 HIS 5 13.322 -10.569 -4.469 33 HE1 HIS 5 HE1 HIS 5 13.866 -13.419 -1.396 34 HE2 HIS 5 HE2 HIS 5 14.865 -12.364 -3.424 35 H ASN 6 HN ASN 6 10.573 -6.505 -2.164 36 HA ASN 6 HA ASN 6 13.120 -5.840 -3.391 37 1HB ASN 6 HB2 ASN 6 10.870 -4.784 -4.014 38 2HB ASN 6 HB1 ASN 6 10.901 -3.979 -2.461 39 1HD2 ASN 6 HD21 ASN 6 13.839 -3.368 -2.655 40 2HD2 ASN 6 HD22 ASN 6 13.938 -2.126 -3.843 41 H GLN 7 HN GLN 7 11.554 -5.895 -0.308 42 HA GLN 7 HA GLN 7 13.587 -4.315 0.987 43 1HB GLN 7 HB2 GLN 7 11.075 -5.679 1.961 44 2HB GLN 7 HB1 GLN 7 12.248 -4.998 3.068 45 1HG GLN 7 HG2 GLN 7 10.372 -3.499 2.747 46 2HG GLN 7 HG1 GLN 7 11.849 -2.776 2.127 47 1HE2 GLN 7 HE21 GLN 7 8.752 -4.131 1.339 48 2HE2 GLN 7 HE22 GLN 7 8.713 -3.510 -0.277 49 H LEU 8 HN LEU 8 14.153 -5.575 3.282 50 HA LEU 8 HA LEU 8 15.508 -7.963 2.298 51 1HB LEU 8 HB2 LEU 8 15.821 -6.528 4.899 52 2HB LEU 8 HB1 LEU 8 16.809 -7.826 4.342 53 HG LEU 8 HG LEU 8 17.644 -6.335 2.463 54 1HD1 LEU 8 HD11 LEU 8 15.879 -4.673 2.439 55 2HD1 LEU 8 HD12 LEU 8 17.451 -3.922 2.693 56 3HD1 LEU 8 HD13 LEU 8 16.344 -4.129 4.052 57 1HD2 LEU 8 HD21 LEU 8 18.216 -5.452 5.284 58 2HD2 LEU 8 HD22 LEU 8 19.214 -5.097 3.876 59 3HD2 LEU 8 HD23 LEU 8 19.010 -6.766 4.413 60 H GLU 9 HN GLU 9 14.655 -9.879 2.818 61 HA GLU 9 HA GLU 9 12.616 -9.890 4.862 62 1HB GLU 9 HB2 GLU 9 13.338 -12.178 3.029 63 2HB GLU 9 HB1 GLU 9 12.027 -12.083 4.146 64 1HG GLU 9 HG2 GLU 9 10.999 -10.247 2.934 65 2HG GLU 9 HG1 GLU 9 12.296 -10.306 1.733 66 H ILE 10 HN ILE 10 12.739 -10.849 6.693 67 HA ILE 10 HA ILE 10 15.217 -12.309 7.366 68 HB ILE 10 HB ILE 10 13.798 -10.277 9.135 69 1HG1 ILE 10 HG12 ILE 10 16.495 -10.067 7.753 70 2HG1 ILE 10 HG11 ILE 10 15.040 -9.219 7.258 71 1HG2 ILE 10 HG21 ILE 10 16.333 -11.821 9.604 72 2HG2 ILE 10 HG22 ILE 10 14.782 -12.053 10.425 73 3HG2 ILE 10 HG23 ILE 10 15.685 -10.544 10.641 74 1HD1 ILE 10 HD11 ILE 10 16.489 -8.871 9.874 75 2HD1 ILE 10 HD12 ILE 10 15.034 -8.008 9.379 76 3HD1 ILE 10 HD13 ILE 10 16.545 -7.769 8.498 77 H LYS 11 HN LYS 11 14.900 -14.082 8.612 78 HA LYS 11 HA LYS 11 12.198 -14.441 9.658 79 1HB LYS 11 HB2 LYS 11 12.423 -16.881 9.586 80 2HB LYS 11 HB1 LYS 11 12.541 -16.169 7.991 81 1HG LYS 11 HG2 LYS 11 14.797 -16.700 7.797 82 2HG LYS 11 HG1 LYS 11 15.001 -16.874 9.544 83 1HD LYS 11 HD2 LYS 11 14.974 -19.060 8.343 84 2HD LYS 11 HD1 LYS 11 13.712 -18.914 9.561 85 1HE LYS 11 HE2 LYS 11 12.109 -18.325 7.761 86 2HE LYS 11 HE1 LYS 11 13.394 -18.583 6.580 87 1HZ LYS 11 HZ1 LYS 11 13.529 -20.894 7.306 88 2HZ LYS 11 HZ2 LYS 11 11.967 -20.532 6.790 89 3HZ LYS 11 HZ3 LYS 11 12.300 -20.637 8.439 90 H PHE 12 HN PHE 12 12.016 -15.524 11.671 91 HA PHE 12 HA PHE 12 14.319 -14.941 13.381 92 1HB PHE 12 HB2 PHE 12 11.418 -15.355 14.101 93 2HB PHE 12 HB1 PHE 12 12.701 -14.843 15.189 94 HD1 PHE 12 HD1 PHE 12 10.098 -13.766 13.074 95 HD2 PHE 12 HD2 PHE 12 13.953 -12.670 14.495 96 HE1 PHE 12 HE1 PHE 12 9.644 -11.428 12.481 97 HE2 PHE 12 HE2 PHE 12 13.504 -10.326 13.913 98 HZ PHE 12 HZ PHE 12 11.345 -9.704 12.905 99 H ARG 13 HN ARG 13 15.469 -16.668 14.008 100 HA ARG 13 HA ARG 13 14.034 -19.219 14.189 101 1HB ARG 13 HB2 ARG 13 15.654 -19.159 12.323 102 2HB ARG 13 HB1 ARG 13 16.936 -18.800 13.464 103 1HG ARG 13 HG2 ARG 13 16.665 -20.969 14.509 104 2HG ARG 13 HG1 ARG 13 15.296 -21.336 13.461 105 1HD ARG 13 HD2 ARG 13 16.792 -21.123 11.503 106 2HD ARG 13 HD1 ARG 13 18.147 -20.855 12.595 107 HE ARG 13 HE ARG 13 16.799 -23.260 13.231 108 1HH1 ARG 13 HH11 ARG 13 19.075 -21.924 10.842 109 2HH1 ARG 13 HH12 ARG 13 19.751 -23.431 10.446 110 1HH2 ARG 13 HH21 ARG 13 17.723 -25.299 12.688 111 2HH2 ARG 13 HH22 ARG 13 18.990 -25.407 11.545 112 H LEU 14 HN LEU 14 13.782 -19.871 16.131 113 HA LEU 14 HA LEU 14 15.256 -18.826 18.363 114 1HB LEU 14 HB2 LEU 14 13.121 -20.956 18.146 115 2HB LEU 14 HB1 LEU 14 13.844 -20.469 19.653 116 HG LEU 14 HG LEU 14 12.784 -18.235 19.451 117 1HD1 LEU 14 HD11 LEU 14 11.506 -19.305 16.936 118 2HD1 LEU 14 HD12 LEU 14 12.726 -18.039 16.997 119 3HD1 LEU 14 HD13 LEU 14 11.142 -17.770 17.724 120 1HD2 LEU 14 HD21 LEU 14 10.506 -18.952 19.726 121 2HD2 LEU 14 HD22 LEU 14 11.621 -20.020 20.584 122 3HD2 LEU 14 HD23 LEU 14 10.897 -20.533 19.057 123 H THR 15 HN THR 15 16.492 -20.103 19.812 124 HA THR 15 HA THR 15 18.278 -21.886 18.618 125 HB THR 15 HB THR 15 18.935 -22.233 21.072 126 HG1 THR 15 HG1 THR 15 17.462 -21.498 22.419 127 1HG2 THR 15 HG21 THR 15 18.854 -19.438 19.914 128 2HG2 THR 15 HG22 THR 15 20.077 -20.664 19.569 129 3HG2 THR 15 HG23 THR 15 19.938 -19.991 21.191 130 H ASP 16 HN ASP 16 15.228 -22.416 20.006 131 HA ASP 16 HA ASP 16 15.646 -25.183 20.713 132 1HB ASP 16 HB2 ASP 16 13.068 -23.625 20.434 133 2HB ASP 16 HB1 ASP 16 13.168 -25.292 20.981 134 H GLY 17 HN GLY 17 15.470 -23.728 17.778 135 1HA GLY 17 HA2 GLY 17 15.588 -24.908 15.748 136 2HA GLY 17 HA1 GLY 17 14.791 -26.277 16.507 137 H SER 18 HN SER 18 13.285 -23.396 17.210 138 HA SER 18 HA SER 18 11.147 -23.974 15.306 139 1HB SER 18 HB2 SER 18 11.224 -22.192 17.745 140 2HB SER 18 HB1 SER 18 9.792 -22.610 16.806 141 HG SER 18 HG SER 18 9.639 -24.341 17.859 142 H ASP 19 HN ASP 19 11.022 -22.564 13.487 143 HA ASP 19 HA ASP 19 12.120 -19.939 13.950 144 1HB ASP 19 HB2 ASP 19 12.810 -19.826 11.692 145 2HB ASP 19 HB1 ASP 19 13.548 -21.259 12.390 146 H ILE 20 HN ILE 20 11.157 -18.315 12.756 147 HA ILE 20 HA ILE 20 8.292 -18.765 12.285 148 HB ILE 20 HB ILE 20 9.794 -16.176 12.858 149 1HG1 ILE 20 HG12 ILE 20 8.019 -17.819 14.691 150 2HG1 ILE 20 HG11 ILE 20 9.765 -17.673 14.814 151 1HG2 ILE 20 HG21 ILE 20 6.827 -16.718 12.709 152 2HG2 ILE 20 HG22 ILE 20 7.773 -15.823 11.524 153 3HG2 ILE 20 HG23 ILE 20 7.566 -15.180 13.158 154 1HD1 ILE 20 HD11 ILE 20 8.639 -16.281 16.458 155 2HD1 ILE 20 HD12 ILE 20 7.774 -15.439 15.172 156 3HD1 ILE 20 HD13 ILE 20 9.524 -15.281 15.304 157 H GLY 21 HN GLY 21 7.454 -18.197 10.294 158 1HA GLY 21 HA2 GLY 21 8.982 -18.267 8.020 159 2HA GLY 21 HA1 GLY 21 7.362 -17.587 8.092 160 HA PRO 22 HA PRO 22 10.949 -14.390 7.785 161 1HB PRO 22 HB2 PRO 22 10.975 -14.332 4.913 162 2HB PRO 22 HB1 PRO 22 12.295 -14.681 6.014 163 1HG PRO 22 HG2 PRO 22 11.079 -16.546 4.365 164 2HG PRO 22 HG1 PRO 22 12.054 -16.928 5.787 165 1HD PRO 22 HD2 PRO 22 9.112 -16.963 5.438 166 2HD PRO 22 HD1 PRO 22 10.149 -17.907 6.529 167 H LYS 23 HN LYS 23 10.633 -12.294 7.451 168 HA LYS 23 HA LYS 23 8.038 -11.438 6.314 169 1HB LYS 23 HB2 LYS 23 9.465 -10.023 8.544 170 2HB LYS 23 HB1 LYS 23 7.819 -9.801 7.999 171 1HG LYS 23 HG2 LYS 23 8.918 -12.168 9.293 172 2HG LYS 23 HG1 LYS 23 8.088 -10.805 10.124 173 1HD LYS 23 HD2 LYS 23 6.836 -12.636 8.038 174 2HD LYS 23 HD1 LYS 23 6.635 -12.877 9.772 175 1HE LYS 23 HE2 LYS 23 5.636 -10.626 9.922 176 2HE LYS 23 HE1 LYS 23 5.736 -10.482 8.170 177 1HZ LYS 23 HZ1 LYS 23 4.175 -12.502 9.695 178 2HZ LYS 23 HZ2 LYS 23 4.302 -12.458 8.005 179 3HZ LYS 23 HZ3 LYS 23 3.547 -11.200 8.824 180 H ALA 24 HN ALA 24 8.237 -9.230 5.924 181 HA ALA 24 HA ALA 24 10.847 -8.743 4.577 182 1HB ALA 24 HB1 ALA 24 8.935 -8.824 3.021 183 2HB ALA 24 HB2 ALA 24 9.727 -7.253 2.997 184 3HB ALA 24 HB3 ALA 24 8.205 -7.462 3.869 185 H PHE 25 HN PHE 25 12.158 -7.255 5.406 186 HA PHE 25 HA PHE 25 10.942 -5.125 7.018 187 1HB PHE 25 HB2 PHE 25 13.648 -6.412 7.363 188 2HB PHE 25 HB1 PHE 25 12.953 -5.147 8.364 189 HD1 PHE 25 HD1 PHE 25 12.762 -8.660 7.414 190 HD2 PHE 25 HD2 PHE 25 11.402 -5.672 10.098 191 HE1 PHE 25 HE1 PHE 25 11.843 -10.396 8.860 192 HE2 PHE 25 HE2 PHE 25 10.479 -7.424 11.558 193 HZ PHE 25 HZ PHE 25 10.739 -9.825 10.891 194 HA PRO 26 HA PRO 26 13.038 -2.560 3.932 195 1HB PRO 26 HB2 PRO 26 12.123 -0.627 5.996 196 2HB PRO 26 HB1 PRO 26 11.994 -0.475 4.253 197 1HG PRO 26 HG2 PRO 26 9.856 -1.075 5.685 198 2HG PRO 26 HG1 PRO 26 10.143 -1.949 4.168 199 1HD PRO 26 HD2 PRO 26 10.592 -2.847 6.988 200 2HD PRO 26 HD1 PRO 26 9.990 -3.771 5.594 201 H ASP 27 HN ASP 27 15.016 -1.512 4.092 202 HA ASP 27 HA ASP 27 16.777 -2.125 6.160 203 1HB ASP 27 HB2 ASP 27 18.323 -0.520 5.111 204 2HB ASP 27 HB1 ASP 27 17.526 -1.527 3.914 205 H ALA 28 HN ALA 28 14.641 0.583 5.757 206 HA ALA 28 HA ALA 28 15.848 2.150 7.834 207 1HB ALA 28 HB1 ALA 28 14.054 3.725 7.437 208 2HB ALA 28 HB2 ALA 28 13.230 2.547 6.413 209 3HB ALA 28 HB3 ALA 28 14.793 3.205 5.922 210 H THR 29 HN THR 29 14.058 -0.590 8.048 211 HA THR 29 HA THR 29 12.354 0.237 10.205 212 HB THR 29 HB THR 29 13.059 -2.511 9.114 213 HG1 THR 29 HG1 THR 29 11.551 -0.586 8.218 214 1HG2 THR 29 HG21 THR 29 11.107 -3.327 10.376 215 2HG2 THR 29 HG22 THR 29 10.881 -1.718 11.067 216 3HG2 THR 29 HG23 THR 29 12.321 -2.656 11.468 217 H THR 30 HN THR 30 12.774 -0.021 12.366 218 HA THR 30 HA THR 30 15.544 -0.212 13.009 219 HB THR 30 HB THR 30 14.840 0.388 15.283 220 HG1 THR 30 HG1 THR 30 12.252 0.905 14.323 221 1HG2 THR 30 HG21 THR 30 13.706 2.130 13.088 222 2HG2 THR 30 HG22 THR 30 15.368 2.142 13.671 223 3HG2 THR 30 HG23 THR 30 14.057 2.666 14.730 224 H VAL 31 HN VAL 31 16.308 -1.452 14.859 225 HA VAL 31 HA VAL 31 15.586 -4.197 14.755 226 HB VAL 31 HB VAL 31 17.267 -2.685 16.800 227 1HG1 VAL 31 HG11 VAL 31 16.513 -4.857 17.688 228 2HG1 VAL 31 HG12 VAL 31 18.247 -4.853 17.380 229 3HG1 VAL 31 HG13 VAL 31 17.161 -5.664 16.258 230 1HG2 VAL 31 HG21 VAL 31 18.094 -4.248 14.361 231 2HG2 VAL 31 HG22 VAL 31 19.194 -3.526 15.539 232 3HG2 VAL 31 HG23 VAL 31 18.157 -2.496 14.552 233 H SER 32 HN SER 32 14.573 -1.497 16.668 234 HA SER 32 HA SER 32 13.209 -2.900 18.696 235 1HB SER 32 HB2 SER 32 13.722 -0.428 18.753 236 2HB SER 32 HB1 SER 32 12.503 -0.199 17.503 237 HG SER 32 HG SER 32 11.256 0.041 19.168 238 H ALA 33 HN ALA 33 12.186 -1.626 15.529 239 HA ALA 33 HA ALA 33 9.570 -2.668 15.716 240 1HB ALA 33 HB1 ALA 33 10.126 -0.803 14.243 241 2HB ALA 33 HB2 ALA 33 9.399 -2.130 13.333 242 3HB ALA 33 HB3 ALA 33 11.143 -1.869 13.276 243 H LEU 34 HN LEU 34 12.651 -4.030 14.721 244 HA LEU 34 HA LEU 34 11.770 -6.253 13.356 245 1HB LEU 34 HB2 LEU 34 14.040 -5.346 13.346 246 2HB LEU 34 HB1 LEU 34 14.158 -5.614 15.070 247 HG LEU 34 HG LEU 34 14.026 -7.882 14.751 248 1HD1 LEU 34 HD11 LEU 34 14.190 -7.245 11.772 249 2HD1 LEU 34 HD12 LEU 34 12.845 -8.046 12.586 250 3HD1 LEU 34 HD13 LEU 34 14.391 -8.874 12.413 251 1HD2 LEU 34 HD21 LEU 34 16.181 -6.924 14.950 252 2HD2 LEU 34 HD22 LEU 34 16.243 -6.544 13.232 253 3HD2 LEU 34 HD23 LEU 34 16.311 -8.222 13.766 254 H LYS 35 HN LYS 35 12.620 -5.646 16.767 255 HA LYS 35 HA LYS 35 11.790 -8.064 17.913 256 1HB LYS 35 HB2 LYS 35 12.011 -5.256 18.936 257 2HB LYS 35 HB1 LYS 35 11.305 -6.505 19.942 258 1HG LYS 35 HG2 LYS 35 13.286 -7.655 20.131 259 2HG LYS 35 HG1 LYS 35 14.025 -6.873 18.727 260 1HD LYS 35 HD2 LYS 35 14.224 -4.802 19.931 261 2HD LYS 35 HD1 LYS 35 13.229 -5.400 21.245 262 1HE LYS 35 HE2 LYS 35 15.894 -6.579 20.514 263 2HE LYS 35 HE1 LYS 35 15.694 -5.279 21.687 264 1HZ LYS 35 HZ1 LYS 35 14.505 -8.035 21.958 265 2HZ LYS 35 HZ2 LYS 35 14.280 -6.744 23.010 266 3HZ LYS 35 HZ3 LYS 35 15.789 -7.369 22.807 267 H GLU 36 HN GLU 36 9.967 -5.044 17.387 268 HA GLU 36 HA GLU 36 7.539 -5.815 18.464 269 1HB GLU 36 HB2 GLU 36 8.103 -3.986 16.136 270 2HB GLU 36 HB1 GLU 36 6.539 -4.149 16.909 271 1HG GLU 36 HG2 GLU 36 9.041 -3.255 18.310 272 2HG GLU 36 HG1 GLU 36 7.809 -2.173 17.661 273 H THR 37 HN THR 37 8.859 -6.425 15.262 274 HA THR 37 HA THR 37 6.526 -7.509 14.147 275 HB THR 37 HB THR 37 9.418 -8.160 13.480 276 HG1 THR 37 HG1 THR 37 8.917 -5.942 13.216 277 1HG2 THR 37 HG21 THR 37 8.528 -8.862 11.289 278 2HG2 THR 37 HG22 THR 37 6.886 -8.551 11.856 279 3HG2 THR 37 HG23 THR 37 7.841 -9.840 12.588 280 H VAL 38 HN VAL 38 9.168 -8.972 15.997 281 HA VAL 38 HA VAL 38 8.311 -11.652 15.916 282 HB VAL 38 HB VAL 38 9.633 -10.257 18.264 283 1HG1 VAL 38 HG11 VAL 38 8.819 -12.440 18.859 284 2HG1 VAL 38 HG12 VAL 38 10.587 -12.471 18.743 285 3HG1 VAL 38 HG13 VAL 38 9.610 -13.150 17.448 286 1HG2 VAL 38 HG21 VAL 38 10.951 -11.567 15.893 287 2HG2 VAL 38 HG22 VAL 38 11.783 -10.966 17.326 288 3HG2 VAL 38 HG23 VAL 38 10.939 -9.844 16.261 289 H ILE 39 HN ILE 39 7.688 -9.040 18.185 290 HA ILE 39 HA ILE 39 5.962 -10.326 19.988 291 HB ILE 39 HB ILE 39 5.867 -7.383 19.198 292 1HG1 ILE 39 HG12 ILE 39 8.151 -7.947 19.725 293 2HG1 ILE 39 HG11 ILE 39 7.476 -7.015 21.051 294 1HG2 ILE 39 HG21 ILE 39 5.102 -8.747 21.779 295 2HG2 ILE 39 HG22 ILE 39 3.985 -7.990 20.641 296 3HG2 ILE 39 HG23 ILE 39 5.154 -7.015 21.542 297 1HD1 ILE 39 HD11 ILE 39 7.869 -9.988 20.970 298 2HD1 ILE 39 HD12 ILE 39 7.151 -9.082 22.309 299 3HD1 ILE 39 HD13 ILE 39 8.838 -8.811 21.861 300 H SER 40 HN SER 40 5.355 -8.863 16.902 301 HA SER 40 HA SER 40 2.521 -8.857 17.084 302 1HB SER 40 HB2 SER 40 4.325 -8.639 14.681 303 2HB SER 40 HB1 SER 40 2.598 -8.279 14.698 304 HG SER 40 HG SER 40 4.719 -6.945 15.993 305 H GLU 41 HN GLU 41 4.906 -11.178 15.757 306 HA GLU 41 HA GLU 41 2.858 -12.776 14.587 307 1HB GLU 41 HB2 GLU 41 5.823 -13.150 14.928 308 2HB GLU 41 HB1 GLU 41 4.765 -14.168 13.979 309 1HG GLU 41 HG2 GLU 41 5.364 -11.260 13.465 310 2HG GLU 41 HG1 GLU 41 6.012 -12.624 12.561 311 H TRP 42 HN TRP 42 4.706 -12.614 17.515 312 HA TRP 42 HA TRP 42 4.421 -15.334 18.312 313 1HB TRP 42 HB2 TRP 42 6.264 -13.688 18.933 314 2HB TRP 42 HB1 TRP 42 5.107 -12.925 20.001 315 HD1 TRP 42 HD1 TRP 42 4.631 -14.153 22.342 316 HE1 TRP 42 HE1 TRP 42 5.845 -16.039 23.563 317 HE3 TRP 42 HE3 TRP 42 7.443 -15.905 18.457 318 HZ2 TRP 42 HZ2 TRP 42 7.752 -18.077 22.930 319 HZ3 TRP 42 HZ3 TRP 42 8.925 -17.815 18.839 320 HH2 TRP 42 HH2 TRP 42 9.082 -18.878 21.034 321 HA PRO 43 HA PRO 43 0.269 -14.939 19.977 322 1HB PRO 43 HB2 PRO 43 1.133 -16.997 21.906 323 2HB PRO 43 HB1 PRO 43 -0.228 -17.029 20.803 324 1HG PRO 43 HG2 PRO 43 1.939 -18.505 20.315 325 2HG PRO 43 HG1 PRO 43 1.099 -17.681 18.989 326 1HD PRO 43 HD2 PRO 43 3.631 -16.917 20.391 327 2HD PRO 43 HD1 PRO 43 3.218 -16.852 18.661 328 H ARG 44 HN ARG 44 -0.238 -13.332 21.212 329 HA ARG 44 HA ARG 44 1.277 -12.389 23.454 330 1HB ARG 44 HB2 ARG 44 -1.501 -11.688 22.515 331 2HB ARG 44 HB1 ARG 44 -0.570 -10.770 23.691 332 1HG ARG 44 HG2 ARG 44 1.042 -10.172 21.996 333 2HG ARG 44 HG1 ARG 44 0.235 -11.211 20.821 334 1HD ARG 44 HD2 ARG 44 -0.387 -8.886 20.467 335 2HD ARG 44 HD1 ARG 44 -1.776 -9.833 20.981 336 HE ARG 44 HE ARG 44 -0.302 -8.358 23.011 337 1HH1 ARG 44 HH11 ARG 44 -3.240 -8.614 20.997 338 2HH1 ARG 44 HH12 ARG 44 -4.075 -7.431 21.880 339 1HH2 ARG 44 HH21 ARG 44 -1.522 -6.728 24.180 340 2HH2 ARG 44 HH22 ARG 44 -3.126 -6.353 23.684 341 H GLU 45 HN GLU 45 -1.290 -14.559 22.930 342 HA GLU 45 HA GLU 45 -2.268 -14.615 25.654 343 1HB GLU 45 HB2 GLU 45 -3.774 -14.905 23.712 344 2HB GLU 45 HB1 GLU 45 -2.901 -16.352 23.256 345 1HG GLU 45 HG2 GLU 45 -5.008 -16.903 24.318 346 2HG GLU 45 HG1 GLU 45 -3.651 -17.460 25.294 347 H LYS 46 HN LYS 46 0.499 -15.718 24.340 348 HA LYS 46 HA LYS 46 0.581 -18.421 25.268 349 1HB LYS 46 HB2 LYS 46 2.108 -17.359 23.467 350 2HB LYS 46 HB1 LYS 46 2.942 -16.603 24.800 351 1HG LYS 46 HG2 LYS 46 3.550 -18.752 25.710 352 2HG LYS 46 HG1 LYS 46 2.654 -19.564 24.426 353 1HD LYS 46 HD2 LYS 46 4.148 -18.491 22.767 354 2HD LYS 46 HD1 LYS 46 5.076 -17.798 24.099 355 1HE LYS 46 HE2 LYS 46 4.660 -20.738 23.562 356 2HE LYS 46 HE1 LYS 46 6.139 -19.831 23.250 357 1HZ LYS 46 HZ1 LYS 46 6.327 -19.442 25.660 358 2HZ LYS 46 HZ2 LYS 46 6.261 -21.072 25.301 359 3HZ LYS 46 HZ3 LYS 46 4.922 -20.332 25.923 360 H GLU 47 HN GLU 47 1.947 -19.191 27.038 361 HA GLU 47 HA GLU 47 1.596 -18.001 29.508 362 1HB GLU 47 HB2 GLU 47 1.949 -20.381 29.178 363 2HB GLU 47 HB1 GLU 47 3.560 -20.109 28.550 364 1HG GLU 47 HG2 GLU 47 4.224 -19.321 30.817 365 2HG GLU 47 HG1 GLU 47 2.604 -19.740 31.389 366 H ASN 48 HN ASN 48 3.707 -17.651 30.960 367 HA ASN 48 HA ASN 48 4.970 -15.369 30.142 368 1HB ASN 48 HB2 ASN 48 5.411 -17.048 32.575 369 2HB ASN 48 HB1 ASN 48 6.403 -15.632 32.246 370 1HD2 ASN 48 HD21 ASN 48 4.490 -16.192 34.358 371 2HD2 ASN 48 HD22 ASN 48 3.338 -14.894 34.303 372 H GLY 49 HN GLY 49 5.668 -16.311 28.320 373 1HA GLY 49 HA2 GLY 49 8.593 -16.904 28.387 374 2HA GLY 49 HA1 GLY 49 7.521 -17.304 27.048 375 HA PRO 50 HA PRO 50 8.872 -13.182 25.803 376 1HB PRO 50 HB2 PRO 50 8.220 -14.235 23.139 377 2HB PRO 50 HB1 PRO 50 9.728 -13.510 23.704 378 1HG PRO 50 HG2 PRO 50 9.502 -16.115 23.150 379 2HG PRO 50 HG1 PRO 50 10.573 -15.504 24.436 380 1HD PRO 50 HD2 PRO 50 7.857 -16.765 24.649 381 2HD PRO 50 HD1 PRO 50 9.288 -16.998 25.680 382 H LYS 51 HN LYS 51 7.505 -11.593 25.128 383 HA LYS 51 HA LYS 51 4.954 -12.013 23.969 384 1HB LYS 51 HB2 LYS 51 4.424 -12.802 26.250 385 2HB LYS 51 HB1 LYS 51 5.046 -11.303 26.920 386 1HG LYS 51 HG2 LYS 51 3.268 -10.065 25.794 387 2HG LYS 51 HG1 LYS 51 2.657 -11.568 25.108 388 1HD LYS 51 HD2 LYS 51 2.217 -12.430 27.329 389 2HD LYS 51 HD1 LYS 51 2.880 -10.967 28.055 390 1HE LYS 51 HE2 LYS 51 1.134 -9.649 26.963 391 2HE LYS 51 HE1 LYS 51 0.477 -11.117 26.245 392 1HZ LYS 51 HZ1 LYS 51 -0.739 -10.463 28.217 393 2HZ LYS 51 HZ2 LYS 51 0.673 -10.571 29.151 394 3HZ LYS 51 HZ3 LYS 51 0.023 -11.953 28.445 395 H THR 52 HN THR 52 7.107 -10.090 25.931 396 HA THR 52 HA THR 52 6.523 -7.937 24.169 397 HB THR 52 HB THR 52 7.071 -6.362 26.029 398 HG1 THR 52 HG1 THR 52 7.247 -8.746 27.414 399 1HG2 THR 52 HG21 THR 52 4.824 -6.591 25.177 400 2HG2 THR 52 HG22 THR 52 4.759 -6.402 26.928 401 3HG2 THR 52 HG23 THR 52 4.539 -7.995 26.206 402 H VAL 53 HN VAL 53 8.383 -6.145 24.723 403 HA VAL 53 HA VAL 53 10.265 -7.062 22.843 404 HB VAL 53 HB VAL 53 9.304 -4.854 22.784 405 1HG1 VAL 53 HG11 VAL 53 10.048 -3.067 24.312 406 2HG1 VAL 53 HG12 VAL 53 10.861 -4.288 25.290 407 3HG1 VAL 53 HG13 VAL 53 9.107 -4.327 25.114 408 1HG2 VAL 53 HG21 VAL 53 11.350 -3.526 22.365 409 2HG2 VAL 53 HG22 VAL 53 11.359 -5.127 21.636 410 3HG2 VAL 53 HG23 VAL 53 12.295 -4.826 23.109 411 H LYS 54 HN LYS 54 10.562 -6.539 26.321 412 HA LYS 54 HA LYS 54 13.418 -6.299 26.288 413 1HB LYS 54 HB2 LYS 54 11.672 -7.054 28.621 414 2HB LYS 54 HB1 LYS 54 13.323 -6.480 28.691 415 1HG LYS 54 HG2 LYS 54 12.615 -4.308 27.864 416 2HG LYS 54 HG1 LYS 54 10.945 -4.857 27.771 417 1HD LYS 54 HD2 LYS 54 11.168 -5.457 30.229 418 2HD LYS 54 HD1 LYS 54 12.672 -4.548 30.209 419 1HE LYS 54 HE2 LYS 54 10.907 -3.125 31.013 420 2HE LYS 54 HE1 LYS 54 11.411 -2.570 29.415 421 1HZ LYS 54 HZ1 LYS 54 8.995 -2.614 29.677 422 2HZ LYS 54 HZ2 LYS 54 9.025 -4.267 29.954 423 3HZ LYS 54 HZ3 LYS 54 9.477 -3.659 28.455 424 H GLU 55 HN GLU 55 11.147 -8.921 26.786 425 HA GLU 55 HA GLU 55 13.276 -10.639 27.744 426 1HB GLU 55 HB2 GLU 55 11.602 -12.411 28.016 427 2HB GLU 55 HB1 GLU 55 11.205 -10.933 28.866 428 1HG GLU 55 HG2 GLU 55 10.060 -11.466 26.168 429 2HG GLU 55 HG1 GLU 55 9.442 -12.270 27.615 430 H VAL 56 HN VAL 56 12.286 -9.876 24.720 431 HA VAL 56 HA VAL 56 13.129 -12.492 23.743 432 HB VAL 56 HB VAL 56 10.965 -11.809 22.845 433 1HG1 VAL 56 HG11 VAL 56 11.133 -9.408 22.994 434 2HG1 VAL 56 HG12 VAL 56 10.706 -9.881 21.346 435 3HG1 VAL 56 HG13 VAL 56 12.355 -9.386 21.724 436 1HG2 VAL 56 HG21 VAL 56 11.413 -12.004 20.450 437 2HG2 VAL 56 HG22 VAL 56 12.366 -13.147 21.401 438 3HG2 VAL 56 HG23 VAL 56 13.124 -11.693 20.748 439 H LYS 57 HN LYS 57 15.179 -12.715 23.172 440 HA LYS 57 HA LYS 57 16.711 -10.324 22.585 441 1HB LYS 57 HB2 LYS 57 17.560 -13.159 23.135 442 2HB LYS 57 HB1 LYS 57 18.664 -11.868 22.701 443 1HG LYS 57 HG2 LYS 57 17.964 -10.661 24.749 444 2HG LYS 57 HG1 LYS 57 16.962 -12.051 25.176 445 1HD LYS 57 HD2 LYS 57 18.929 -13.492 25.229 446 2HD LYS 57 HD1 LYS 57 19.949 -12.144 24.723 447 1HE LYS 57 HE2 LYS 57 19.358 -10.947 26.772 448 2HE LYS 57 HE1 LYS 57 18.365 -12.313 27.280 449 1HZ LYS 57 HZ1 LYS 57 21.313 -12.382 26.846 450 2HZ LYS 57 HZ2 LYS 57 20.375 -13.684 27.336 451 3HZ LYS 57 HZ3 LYS 57 20.530 -12.342 28.332 452 H LEU 58 HN LEU 58 17.537 -9.870 20.636 453 HA LEU 58 HA LEU 58 17.097 -11.847 18.541 454 1HB LEU 58 HB2 LEU 58 15.821 -9.594 18.489 455 2HB LEU 58 HB1 LEU 58 17.370 -8.830 18.262 456 HG LEU 58 HG LEU 58 16.121 -9.000 16.168 457 1HD1 LEU 58 HD11 LEU 58 17.790 -10.058 14.754 458 2HD1 LEU 58 HD12 LEU 58 18.554 -10.755 16.190 459 3HD1 LEU 58 HD13 LEU 58 18.481 -9.001 15.977 460 1HD2 LEU 58 HD21 LEU 58 14.817 -10.989 16.646 461 2HD2 LEU 58 HD22 LEU 58 16.271 -11.983 16.558 462 3HD2 LEU 58 HD23 LEU 58 15.681 -11.154 15.120 463 H ILE 59 HN ILE 59 18.960 -12.616 17.760 464 HA ILE 59 HA ILE 59 21.476 -11.236 18.442 465 HB ILE 59 HB ILE 59 20.691 -14.084 19.025 466 1HG1 ILE 59 HG12 ILE 59 21.716 -11.856 20.786 467 2HG1 ILE 59 HG11 ILE 59 20.038 -12.366 20.661 468 1HG2 ILE 59 HG21 ILE 59 22.926 -14.125 18.059 469 2HG2 ILE 59 HG22 ILE 59 22.991 -14.461 19.787 470 3HG2 ILE 59 HG23 ILE 59 23.446 -12.870 19.181 471 1HD1 ILE 59 HD11 ILE 59 21.117 -13.228 22.661 472 2HD1 ILE 59 HD12 ILE 59 22.313 -14.061 21.649 473 3HD1 ILE 59 HD13 ILE 59 20.599 -14.490 21.552 474 H SER 60 HN SER 60 22.894 -11.116 17.017 475 HA SER 60 HA SER 60 23.049 -13.001 14.836 476 1HB SER 60 HB2 SER 60 21.665 -10.992 14.088 477 2HB SER 60 HB1 SER 60 23.068 -9.983 14.427 478 HG SER 60 HG SER 60 24.152 -10.909 12.795 479 H ALA 61 HN ALA 61 25.149 -13.465 14.447 480 HA ALA 61 HA ALA 61 27.378 -13.676 14.705 481 1HB ALA 61 HB1 ALA 61 27.349 -10.748 15.504 482 2HB ALA 61 HB2 ALA 61 27.570 -11.365 13.861 483 3HB ALA 61 HB3 ALA 61 28.781 -11.693 15.098 484 H GLY 62 HN GLY 62 25.399 -13.933 16.859 485 1HA GLY 62 HA2 GLY 62 25.480 -14.820 19.010 486 2HA GLY 62 HA1 GLY 62 27.224 -14.573 18.994 487 H LYS 63 HN LYS 63 25.459 -11.727 18.137 488 HA LYS 63 HA LYS 63 25.971 -10.666 20.756 489 1HB LYS 63 HB2 LYS 63 26.099 -9.536 18.002 490 2HB LYS 63 HB1 LYS 63 26.221 -8.603 19.479 491 1HG LYS 63 HG2 LYS 63 28.263 -9.816 20.068 492 2HG LYS 63 HG1 LYS 63 28.087 -10.802 18.613 493 1HD LYS 63 HD2 LYS 63 28.293 -8.809 17.228 494 2HD LYS 63 HD1 LYS 63 28.464 -7.815 18.673 495 1HE LYS 63 HE2 LYS 63 30.509 -8.995 19.247 496 2HE LYS 63 HE1 LYS 63 30.317 -10.032 17.833 497 1HZ LYS 63 HZ1 LYS 63 31.875 -8.248 17.395 498 2HZ LYS 63 HZ2 LYS 63 30.705 -7.093 17.776 499 3HZ LYS 63 HZ3 LYS 63 30.498 -8.082 16.431 500 H VAL 64 HN VAL 64 24.375 -9.490 21.612 501 HA VAL 64 HA VAL 64 21.739 -9.619 20.458 502 HB VAL 64 HB VAL 64 22.711 -8.105 22.909 503 1HG1 VAL 64 HG11 VAL 64 19.941 -8.965 22.106 504 2HG1 VAL 64 HG12 VAL 64 20.576 -7.321 22.099 505 3HG1 VAL 64 HG13 VAL 64 20.376 -8.183 23.626 506 1HG2 VAL 64 HG21 VAL 64 23.205 -10.484 23.163 507 2HG2 VAL 64 HG22 VAL 64 21.532 -10.883 22.764 508 3HG2 VAL 64 HG23 VAL 64 21.898 -9.999 24.243 509 H LEU 65 HN LEU 65 20.811 -7.948 19.281 510 HA LEU 65 HA LEU 65 22.529 -5.673 19.033 511 1HB LEU 65 HB2 LEU 65 20.997 -5.164 17.016 512 2HB LEU 65 HB1 LEU 65 22.375 -6.237 16.840 513 HG LEU 65 HG LEU 65 19.515 -7.211 17.213 514 1HD1 LEU 65 HD11 LEU 65 21.096 -6.774 14.664 515 2HD1 LEU 65 HD12 LEU 65 19.716 -5.802 15.173 516 3HD1 LEU 65 HD13 LEU 65 19.496 -7.503 14.771 517 1HD2 LEU 65 HD21 LEU 65 20.445 -9.267 16.235 518 2HD2 LEU 65 HD22 LEU 65 21.321 -8.816 17.695 519 3HD2 LEU 65 HD23 LEU 65 22.021 -8.488 16.113 520 H GLU 66 HN GLU 66 22.015 -3.689 19.220 521 HA GLU 66 HA GLU 66 20.105 -3.060 21.145 522 1HB GLU 66 HB2 GLU 66 22.183 -1.865 20.965 523 2HB GLU 66 HB1 GLU 66 21.789 -1.347 19.338 524 1HG GLU 66 HG2 GLU 66 20.043 0.077 20.167 525 2HG GLU 66 HG1 GLU 66 20.280 -0.533 21.806 526 H ASN 67 HN ASN 67 18.093 -2.470 20.992 527 HA ASN 67 HA ASN 67 16.619 -2.752 18.608 528 1HB ASN 67 HB2 ASN 67 14.650 -2.084 19.903 529 2HB ASN 67 HB1 ASN 67 15.632 -3.235 20.793 530 1HD2 ASN 67 HD21 ASN 67 14.369 0.022 20.699 531 2HD2 ASN 67 HD22 ASN 67 14.943 0.453 22.254 532 H SER 68 HN SER 68 18.137 0.007 19.969 533 HA SER 68 HA SER 68 16.482 1.892 18.626 534 1HB SER 68 HB2 SER 68 19.111 2.252 20.060 535 2HB SER 68 HB1 SER 68 18.032 3.559 19.558 536 HG SER 68 HG SER 68 16.471 2.759 20.900 537 H LYS 69 HN LYS 69 18.866 -0.129 17.494 538 HA LYS 69 HA LYS 69 19.898 1.745 15.591 539 1HB LYS 69 HB2 LYS 69 20.504 -1.158 16.107 540 2HB LYS 69 HB1 LYS 69 21.259 -0.196 14.851 541 1HG LYS 69 HG2 LYS 69 22.138 1.331 16.565 542 2HG LYS 69 HG1 LYS 69 21.404 0.329 17.812 543 1HD LYS 69 HD2 LYS 69 22.814 -1.560 17.110 544 2HD LYS 69 HD1 LYS 69 23.531 -0.544 15.857 545 1HE LYS 69 HE2 LYS 69 24.350 0.992 17.583 546 2HE LYS 69 HE1 LYS 69 23.648 -0.039 18.824 547 1HZ LYS 69 HZ1 LYS 69 25.809 -0.798 16.938 548 2HZ LYS 69 HZ2 LYS 69 25.197 -1.818 18.118 549 3HZ LYS 69 HZ3 LYS 69 26.010 -0.408 18.554 550 H THR 70 HN THR 70 19.969 0.955 13.264 551 HA THR 70 HA THR 70 17.262 0.050 12.579 552 HB THR 70 HB THR 70 19.082 1.314 10.594 553 HG1 THR 70 HG1 THR 70 19.258 2.981 11.825 554 1HG2 THR 70 HG21 THR 70 16.970 2.313 9.843 555 2HG2 THR 70 HG22 THR 70 16.155 1.563 11.219 556 3HG2 THR 70 HG23 THR 70 16.863 0.555 9.960 557 H VAL 71 HN VAL 71 17.127 -1.347 10.540 558 HA VAL 71 HA VAL 71 18.996 -3.493 10.624 559 HB VAL 71 HB VAL 71 16.992 -2.791 8.429 560 1HG1 VAL 71 HG11 VAL 71 17.166 -5.141 7.740 561 2HG1 VAL 71 HG12 VAL 71 18.421 -5.400 8.952 562 3HG1 VAL 71 HG13 VAL 71 18.720 -4.311 7.597 563 1HG2 VAL 71 HG21 VAL 71 15.916 -3.172 10.585 564 2HG2 VAL 71 HG22 VAL 71 16.756 -4.715 10.746 565 3HG2 VAL 71 HG23 VAL 71 15.559 -4.491 9.470 566 H LYS 72 HN LYS 72 18.554 -0.748 8.569 567 HA LYS 72 HA LYS 72 20.451 -1.045 6.585 568 1HB LYS 72 HB2 LYS 72 18.694 0.689 6.800 569 2HB LYS 72 HB1 LYS 72 19.616 1.422 8.085 570 1HG LYS 72 HG2 LYS 72 21.386 1.978 6.534 571 2HG LYS 72 HG1 LYS 72 20.505 1.173 5.228 572 1HD LYS 72 HD2 LYS 72 18.614 2.691 5.574 573 2HD LYS 72 HD1 LYS 72 19.520 3.507 6.847 574 1HE LYS 72 HE2 LYS 72 21.197 4.183 5.231 575 2HE LYS 72 HE1 LYS 72 20.338 3.306 3.961 576 1HZ LYS 72 HZ1 LYS 72 18.446 4.757 4.297 577 2HZ LYS 72 HZ2 LYS 72 19.798 5.666 3.904 578 3HZ LYS 72 HZ3 LYS 72 19.257 5.596 5.499 579 H ASP 73 HN ASP 73 20.819 0.573 9.786 580 HA ASP 73 HA ASP 73 23.528 1.197 9.487 581 1HB ASP 73 HB2 ASP 73 21.761 0.992 11.903 582 2HB ASP 73 HB1 ASP 73 23.399 1.591 11.941 583 H TYR 74 HN TYR 74 21.892 -1.689 10.414 584 HA TYR 74 HA TYR 74 24.108 -2.681 11.960 585 1HB TYR 74 HB2 TYR 74 21.685 -3.214 12.488 586 2HB TYR 74 HB1 TYR 74 21.660 -4.218 11.045 587 HD1 TYR 74 HD1 TYR 74 22.498 -6.451 11.115 588 HD2 TYR 74 HD2 TYR 74 23.277 -3.779 14.329 589 HE1 TYR 74 HE1 TYR 74 23.421 -8.310 12.432 590 HE2 TYR 74 HE2 TYR 74 24.193 -5.605 15.654 591 HH TYR 74 HH TYR 74 24.030 -8.082 15.758 592 H ARG 75 HN ARG 75 23.446 -2.448 8.646 593 HA ARG 75 HA ARG 75 24.788 -4.829 7.889 594 1HB ARG 75 HB2 ARG 75 23.672 -2.435 6.460 595 2HB ARG 75 HB1 ARG 75 24.504 -3.745 5.653 596 1HG ARG 75 HG2 ARG 75 21.969 -4.011 7.270 597 2HG ARG 75 HG1 ARG 75 22.045 -3.949 5.509 598 1HD ARG 75 HD2 ARG 75 23.382 -6.008 5.497 599 2HD ARG 75 HD1 ARG 75 23.327 -6.061 7.254 600 HE ARG 75 HE ARG 75 20.726 -5.988 6.499 601 1HH1 ARG 75 HH11 ARG 75 23.452 -8.121 5.728 602 2HH1 ARG 75 HH12 ARG 75 22.515 -9.511 5.530 603 1HH2 ARG 75 HH21 ARG 75 19.393 -7.967 6.219 604 2HH2 ARG 75 HH22 ARG 75 20.137 -9.433 5.822 605 H SER 76 HN SER 76 26.489 -4.153 5.962 606 HA SER 76 HA SER 76 28.658 -2.955 7.369 607 1HB SER 76 HB2 SER 76 28.362 -4.078 4.577 608 2HB SER 76 HB1 SER 76 29.898 -3.684 5.354 609 HG SER 76 HG SER 76 28.371 -5.240 6.933 610 HA PRO 77 HA PRO 77 28.772 1.308 6.043 611 1HB PRO 77 HB2 PRO 77 31.000 1.098 4.228 612 2HB PRO 77 HB1 PRO 77 30.979 1.766 5.860 613 1HG PRO 77 HG2 PRO 77 31.769 -0.934 4.942 614 2HG PRO 77 HG1 PRO 77 32.267 -0.056 6.395 615 1HD PRO 77 HD2 PRO 77 30.620 -2.156 6.541 616 2HD PRO 77 HD1 PRO 77 30.399 -0.746 7.596 617 H VAL 78 HN VAL 78 27.787 2.505 4.592 618 HA VAL 78 HA VAL 78 26.581 3.266 2.953 619 HB VAL 78 HB VAL 78 28.631 2.743 1.514 620 1HG1 VAL 78 HG11 VAL 78 26.876 0.564 0.421 621 2HG1 VAL 78 HG12 VAL 78 28.432 0.366 1.227 622 3HG1 VAL 78 HG13 VAL 78 28.349 1.149 -0.355 623 1HG2 VAL 78 HG21 VAL 78 27.003 4.342 0.796 624 2HG2 VAL 78 HG22 VAL 78 25.949 3.064 0.192 625 3HG2 VAL 78 HG23 VAL 78 27.492 3.381 -0.601 626 H SER 79 HN SER 79 26.376 0.388 4.098 627 HA SER 79 HA SER 79 24.714 -0.995 4.600 628 1HB SER 79 HB2 SER 79 22.899 0.867 3.062 629 2HB SER 79 HB1 SER 79 22.398 -0.375 4.212 630 HG SER 79 HG SER 79 23.121 2.116 4.674 631 H ASN 80 HN ASN 80 25.204 -2.824 3.689 632 HA ASN 80 HA ASN 80 24.635 -3.213 0.886 633 1HB ASN 80 HB2 ASN 80 25.711 -5.449 1.171 634 2HB ASN 80 HB1 ASN 80 26.772 -4.128 1.620 635 1HD2 ASN 80 HD21 ASN 80 26.878 -6.928 2.352 636 2HD2 ASN 80 HD22 ASN 80 26.806 -6.995 4.078 637 H LEU 81 HN LEU 81 22.399 -3.276 0.628 638 HA LEU 81 HA LEU 81 20.848 -4.751 2.385 639 1HB LEU 81 HB2 LEU 81 20.338 -3.442 -0.215 640 2HB LEU 81 HB1 LEU 81 19.169 -3.981 0.950 641 HG LEU 81 HG LEU 81 21.089 -1.683 1.281 642 1HD1 LEU 81 HD11 LEU 81 18.092 -1.724 1.127 643 2HD1 LEU 81 HD12 LEU 81 19.205 -1.133 -0.108 644 3HD1 LEU 81 HD13 LEU 81 19.088 -0.304 1.445 645 1HD2 LEU 81 HD21 LEU 81 20.882 -2.838 3.405 646 2HD2 LEU 81 HD22 LEU 81 19.126 -2.804 3.285 647 3HD2 LEU 81 HD23 LEU 81 20.029 -1.297 3.469 648 H ALA 82 HN ALA 82 19.185 -6.290 1.183 649 HA ALA 82 HA ALA 82 20.133 -7.702 -0.984 650 1HB ALA 82 HB1 ALA 82 21.735 -8.547 0.652 651 2HB ALA 82 HB2 ALA 82 20.575 -9.807 0.217 652 3HB ALA 82 HB3 ALA 82 20.417 -8.952 1.749 653 H GLY 83 HN GLY 83 18.417 -8.569 -1.785 654 1HA GLY 83 HA2 GLY 83 15.882 -8.545 -0.401 655 2HA GLY 83 HA1 GLY 83 16.158 -9.141 -2.040 656 H ALA 84 HN ALA 84 18.465 -10.594 -0.610 657 HA ALA 84 HA ALA 84 17.284 -13.150 -0.427 658 1HB ALA 84 HB1 ALA 84 19.640 -12.829 -1.000 659 2HB ALA 84 HB2 ALA 84 19.468 -13.877 0.410 660 3HB ALA 84 HB3 ALA 84 19.950 -12.194 0.615 661 H VAL 85 HN VAL 85 17.175 -14.488 1.468 662 HA VAL 85 HA VAL 85 15.942 -12.975 3.595 663 HB VAL 85 HB VAL 85 16.183 -15.971 3.252 664 1HG1 VAL 85 HG11 VAL 85 15.740 -15.357 5.558 665 2HG1 VAL 85 HG12 VAL 85 14.308 -16.101 4.844 666 3HG1 VAL 85 HG13 VAL 85 14.381 -14.353 5.053 667 1HG2 VAL 85 HG21 VAL 85 13.910 -14.128 2.513 668 2HG2 VAL 85 HG22 VAL 85 13.863 -15.889 2.443 669 3HG2 VAL 85 HG23 VAL 85 14.961 -14.995 1.392 670 H THR 86 HN THR 86 16.724 -12.703 5.513 671 HA THR 86 HA THR 86 19.375 -13.798 6.173 672 HB THR 86 HB THR 86 17.948 -11.370 7.312 673 HG1 THR 86 HG1 THR 86 18.824 -11.545 4.958 674 1HG2 THR 86 HG21 THR 86 19.665 -12.330 8.803 675 2HG2 THR 86 HG22 THR 86 20.169 -10.763 8.175 676 3HG2 THR 86 HG23 THR 86 20.847 -12.241 7.494 677 H THR 87 HN THR 87 19.546 -15.017 8.083 678 HA THR 87 HA THR 87 17.047 -15.426 9.562 679 HB THR 87 HB THR 87 19.459 -17.253 9.316 680 HG1 THR 87 HG1 THR 87 17.969 -16.938 7.511 681 1HG2 THR 87 HG21 THR 87 18.321 -17.495 11.488 682 2HG2 THR 87 HG22 THR 87 18.055 -18.910 10.471 683 3HG2 THR 87 HG23 THR 87 16.780 -17.707 10.657 684 H MET 88 HN MET 88 16.969 -14.528 11.507 685 HA MET 88 HA MET 88 19.501 -14.048 12.882 686 1HB MET 88 HB2 MET 88 16.901 -12.517 13.056 687 2HB MET 88 HB1 MET 88 18.260 -12.257 14.143 688 1HG MET 88 HG2 MET 88 19.666 -11.623 12.252 689 2HG MET 88 HG1 MET 88 18.327 -11.910 11.148 690 1HE MET 88 HE1 MET 88 18.772 -9.472 10.148 691 2HE MET 88 HE2 MET 88 20.064 -9.189 11.316 692 3HE MET 88 HE3 MET 88 18.773 -8.003 11.122 693 H HIS 89 HN HIS 89 19.695 -14.547 15.040 694 HA HIS 89 HA HIS 89 18.053 -16.817 15.770 695 1HB HIS 89 HB2 HIS 89 20.538 -15.679 17.063 696 2HB HIS 89 HB1 HIS 89 19.672 -17.089 17.652 697 HD1 HIS 89 HD1 HIS 89 22.402 -16.132 15.462 698 HD2 HIS 89 HD2 HIS 89 19.654 -19.255 15.637 699 HE1 HIS 89 HE1 HIS 89 23.346 -17.944 14.042 700 HE2 HIS 89 HE2 HIS 89 21.688 -19.821 14.156 701 H VAL 90 HN VAL 90 16.620 -16.883 17.310 702 HA VAL 90 HA VAL 90 16.321 -14.527 19.054 703 HB VAL 90 HB VAL 90 14.158 -16.412 18.044 704 1HG1 VAL 90 HG11 VAL 90 12.589 -14.949 19.233 705 2HG1 VAL 90 HG12 VAL 90 13.942 -14.007 19.858 706 3HG1 VAL 90 HG13 VAL 90 13.743 -15.692 20.346 707 1HG2 VAL 90 HG21 VAL 90 14.802 -14.843 16.319 708 2HG2 VAL 90 HG22 VAL 90 14.689 -13.513 17.469 709 3HG2 VAL 90 HG23 VAL 90 13.231 -14.378 16.993 710 H ILE 91 HN ILE 91 16.742 -14.765 20.918 711 HA ILE 91 HA ILE 91 16.655 -17.429 22.038 712 HB ILE 91 HB ILE 91 18.365 -15.090 22.539 713 1HG1 ILE 91 HG12 ILE 91 18.873 -17.998 21.976 714 2HG1 ILE 91 HG11 ILE 91 19.255 -16.602 20.981 715 1HG2 ILE 91 HG21 ILE 91 19.299 -16.177 24.616 716 2HG2 ILE 91 HG22 ILE 91 18.025 -17.388 24.525 717 3HG2 ILE 91 HG23 ILE 91 17.613 -15.698 24.815 718 1HD1 ILE 91 HD11 ILE 91 20.595 -17.412 23.549 719 2HD1 ILE 91 HD12 ILE 91 21.001 -15.972 22.642 720 3HD1 ILE 91 HD13 ILE 91 21.261 -17.566 21.931 721 H ILE 92 HN ILE 92 15.471 -17.883 23.602 722 HA ILE 92 HA ILE 92 13.369 -16.039 24.340 723 HB ILE 92 HB ILE 92 13.792 -18.949 25.042 724 1HG1 ILE 92 HG12 ILE 92 13.649 -18.753 22.625 725 2HG1 ILE 92 HG11 ILE 92 12.164 -19.463 23.242 726 1HG2 ILE 92 HG21 ILE 92 11.316 -17.253 25.203 727 2HG2 ILE 92 HG22 ILE 92 12.262 -17.867 26.559 728 3HG2 ILE 92 HG23 ILE 92 11.389 -18.988 25.512 729 1HD1 ILE 92 HD11 ILE 92 12.539 -16.601 22.384 730 2HD1 ILE 92 HD12 ILE 92 11.050 -17.317 23.011 731 3HD1 ILE 92 HD13 ILE 92 11.712 -17.869 21.474 732 H GLN 93 HN GLN 93 14.127 -14.658 26.027 733 HA GLN 93 HA GLN 93 15.541 -16.040 28.116 734 1HB GLN 93 HB2 GLN 93 16.528 -13.930 27.303 735 2HB GLN 93 HB1 GLN 93 15.061 -13.075 27.771 736 1HG GLN 93 HG2 GLN 93 15.432 -13.706 30.097 737 2HG GLN 93 HG1 GLN 93 16.892 -14.566 29.620 738 1HE2 GLN 93 HE21 GLN 93 18.198 -13.328 30.905 739 2HE2 GLN 93 HE22 GLN 93 18.561 -11.673 30.558 740 H ALA 94 HN ALA 94 14.304 -16.909 29.446 741 HA ALA 94 HA ALA 94 11.699 -15.814 30.083 742 1HB ALA 94 HB1 ALA 94 13.069 -18.331 31.044 743 2HB ALA 94 HB2 ALA 94 11.894 -18.228 29.735 744 3HB ALA 94 HB3 ALA 94 11.401 -17.877 31.394 745 HA PRO 95 HA PRO 95 13.225 -13.607 33.611 746 1HB PRO 95 HB2 PRO 95 10.735 -14.459 34.944 747 2HB PRO 95 HB1 PRO 95 11.354 -12.819 34.718 748 1HG PRO 95 HG2 PRO 95 9.283 -13.688 33.270 749 2HG PRO 95 HG1 PRO 95 10.535 -12.658 32.552 750 1HD PRO 95 HD2 PRO 95 10.105 -15.598 32.265 751 2HD PRO 95 HD1 PRO 95 10.657 -14.401 31.070 752 H VAL 96 HN VAL 96 14.320 -14.151 35.442 753 HA VAL 96 HA VAL 96 14.885 -16.883 35.853 754 HB VAL 96 HB VAL 96 16.580 -15.143 36.212 755 1HG1 VAL 96 HG11 VAL 96 14.991 -14.352 38.629 756 2HG1 VAL 96 HG12 VAL 96 15.250 -13.394 37.170 757 3HG1 VAL 96 HG13 VAL 96 16.607 -13.766 38.234 758 1HG2 VAL 96 HG21 VAL 96 16.043 -16.752 38.708 759 2HG2 VAL 96 HG22 VAL 96 17.581 -15.994 38.300 760 3HG2 VAL 96 HG23 VAL 96 16.939 -17.292 37.290 761 H THR 97 HN THR 97 12.659 -14.755 37.410 762 HA THR 97 HA THR 97 11.590 -17.047 38.784 763 HB THR 97 HB THR 97 12.209 -14.441 40.212 764 HG1 THR 97 HG1 THR 97 13.502 -16.737 39.819 765 1HG2 THR 97 HG21 THR 97 10.057 -15.424 40.938 766 2HG2 THR 97 HG22 THR 97 11.281 -15.553 42.200 767 3HG2 THR 97 HG23 THR 97 10.866 -16.965 41.228 768 H GLU 98 HN GLU 98 9.798 -17.174 37.700 769 HA GLU 98 HA GLU 98 7.830 -15.103 37.936 770 1HB GLU 98 HB2 GLU 98 9.086 -14.465 35.918 771 2HB GLU 98 HB1 GLU 98 8.785 -16.049 35.206 772 1HG GLU 98 HG2 GLU 98 7.321 -14.358 34.272 773 2HG GLU 98 HG1 GLU 98 6.382 -15.529 35.204 774 H LYS 99 HN LYS 99 5.734 -15.976 37.332 775 HA LYS 99 HA LYS 99 5.583 -18.687 38.025 776 1HB LYS 99 HB2 LYS 99 3.145 -18.361 37.949 777 2HB LYS 99 HB1 LYS 99 3.979 -17.218 38.989 778 1HG LYS 99 HG2 LYS 99 3.675 -15.433 37.488 779 2HG LYS 99 HG1 LYS 99 3.265 -16.515 36.159 780 1HD LYS 99 HD2 LYS 99 1.580 -16.122 38.636 781 2HD LYS 99 HD1 LYS 99 1.303 -15.304 37.094 782 1HE LYS 99 HE2 LYS 99 1.056 -17.494 35.994 783 2HE LYS 99 HE1 LYS 99 1.267 -18.301 37.536 784 1HZ LYS 99 HZ1 LYS 99 -0.747 -17.212 38.316 785 2HZ LYS 99 HZ2 LYS 99 -0.999 -18.149 36.919 786 3HZ LYS 99 HZ3 LYS 99 -0.936 -16.474 36.797 787 H GLU 100 HN GLU 100 4.450 -20.308 36.775 788 HA GLU 100 HA GLU 100 4.289 -19.834 33.912 789 1HB GLU 100 HB2 GLU 100 4.117 -22.400 35.517 790 2HB GLU 100 HB1 GLU 100 3.918 -22.284 33.780 791 1HG GLU 100 HG2 GLU 100 6.221 -21.539 33.547 792 2HG GLU 100 HG1 GLU 100 6.425 -21.608 35.299 793 H LYS 101 HN LYS 101 2.296 -20.881 32.896 794 HA LYS 101 HA LYS 101 0.151 -20.415 32.481 795 1HB LYS 101 HB2 LYS 101 -1.488 -21.750 33.784 796 2HB LYS 101 HB1 LYS 101 -0.122 -22.672 33.198 797 1HG LYS 101 HG2 LYS 101 0.820 -22.831 35.368 798 2HG LYS 101 HG1 LYS 101 -0.274 -21.607 36.006 799 1HD LYS 101 HD2 LYS 101 -1.100 -24.326 34.986 800 2HD LYS 101 HD1 LYS 101 -0.910 -23.871 36.685 801 1HE LYS 101 HE2 LYS 101 -2.898 -22.683 34.729 802 2HE LYS 101 HE1 LYS 101 -3.249 -23.766 36.065 803 1HZ LYS 101 HZ1 LYS 101 -2.475 -22.103 37.600 804 2HZ LYS 101 HZ2 LYS 101 -3.715 -21.480 36.650 805 3HZ LYS 101 HZ3 LYS 101 -2.102 -21.042 36.337 Start of MODEL 5 1 H GLU 1 HT1 GLU 1 -3.716 -3.154 0.262 2 HA GLU 1 HA GLU 1 -3.247 -3.702 -1.945 3 1HB GLU 1 HB2 GLU 1 -2.748 -1.926 -3.591 4 2HB GLU 1 HB1 GLU 1 -4.421 -1.902 -3.061 5 1HG GLU 1 HG2 GLU 1 -3.933 -0.040 -1.577 6 2HG GLU 1 HG1 GLU 1 -2.247 -0.069 -2.098 7 H ALA 2 HN ALA 2 -0.950 -3.045 -3.052 8 HA ALA 2 HA ALA 2 0.862 -2.093 -0.999 9 1HB ALA 2 HB1 ALA 2 0.616 -4.473 -0.522 10 2HB ALA 2 HB2 ALA 2 2.235 -4.105 -1.120 11 3HB ALA 2 HB3 ALA 2 1.050 -4.854 -2.189 12 H GLU 3 HN GLU 3 3.169 -2.201 -1.896 13 HA GLU 3 HA GLU 3 3.470 -2.285 -4.674 14 1HB GLU 3 HB2 GLU 3 2.650 0.117 -4.013 15 2HB GLU 3 HB1 GLU 3 4.202 0.285 -3.225 16 1HG GLU 3 HG2 GLU 3 3.773 -0.190 -6.180 17 2HG GLU 3 HG1 GLU 3 4.121 1.360 -5.442 18 H VAL 4 HN VAL 4 5.229 -3.592 -4.618 19 HA VAL 4 HA VAL 4 6.630 -3.830 -2.152 20 HB VAL 4 HB VAL 4 6.005 -5.812 -3.224 21 1HG1 VAL 4 HG11 VAL 4 7.889 -5.081 -5.485 22 2HG1 VAL 4 HG12 VAL 4 6.135 -5.176 -5.579 23 3HG1 VAL 4 HG13 VAL 4 7.083 -6.642 -5.321 24 1HG2 VAL 4 HG21 VAL 4 7.942 -5.986 -1.806 25 2HG2 VAL 4 HG22 VAL 4 9.008 -5.555 -3.141 26 3HG2 VAL 4 HG23 VAL 4 8.139 -7.090 -3.169 27 H HIS 5 HN HIS 5 8.362 -3.174 -1.571 28 HA HIS 5 HA HIS 5 10.338 -2.005 -3.445 29 1HB HIS 5 HB2 HIS 5 9.867 -1.350 -0.508 30 2HB HIS 5 HB1 HIS 5 11.207 -0.726 -1.453 31 HD1 HIS 5 HD1 HIS 5 10.798 1.558 -2.377 32 HD2 HIS 5 HD2 HIS 5 7.260 -0.493 -1.700 33 HE1 HIS 5 HE1 HIS 5 8.965 3.184 -2.866 34 HE2 HIS 5 HE2 HIS 5 6.866 1.985 -2.203 35 H ASN 6 HN ASN 6 12.632 -2.372 -2.690 36 HA ASN 6 HA ASN 6 12.846 -5.137 -2.006 37 1HB ASN 6 HB2 ASN 6 14.364 -4.109 -3.657 38 2HB ASN 6 HB1 ASN 6 15.030 -3.084 -2.397 39 1HD2 ASN 6 HD21 ASN 6 17.101 -3.878 -2.666 40 2HD2 ASN 6 HD22 ASN 6 17.570 -5.469 -2.208 41 H GLN 7 HN GLN 7 12.046 -5.362 0.036 42 HA GLN 7 HA GLN 7 13.280 -3.961 2.233 43 1HB GLN 7 HB2 GLN 7 11.181 -6.082 2.066 44 2HB GLN 7 HB1 GLN 7 11.629 -5.255 3.551 45 1HG GLN 7 HG2 GLN 7 10.785 -3.151 2.643 46 2HG GLN 7 HG1 GLN 7 10.410 -3.944 1.115 47 1HE2 GLN 7 HE21 GLN 7 9.499 -3.603 4.432 48 2HE2 GLN 7 HE22 GLN 7 7.940 -4.332 4.298 49 H LEU 8 HN LEU 8 14.149 -5.307 4.004 50 HA LEU 8 HA LEU 8 15.588 -7.590 2.891 51 1HB LEU 8 HB2 LEU 8 16.018 -5.993 5.380 52 2HB LEU 8 HB1 LEU 8 16.930 -7.410 5.009 53 HG LEU 8 HG LEU 8 17.905 -6.300 3.010 54 1HD1 LEU 8 HD11 LEU 8 16.128 -4.719 2.498 55 2HD1 LEU 8 HD12 LEU 8 17.680 -3.902 2.688 56 3HD1 LEU 8 HD13 LEU 8 16.482 -3.829 3.979 57 1HD2 LEU 8 HD21 LEU 8 18.244 -4.768 5.572 58 2HD2 LEU 8 HD22 LEU 8 19.372 -4.775 4.214 59 3HD2 LEU 8 HD23 LEU 8 19.071 -6.256 5.127 60 H GLU 9 HN GLU 9 15.083 -9.534 3.478 61 HA GLU 9 HA GLU 9 12.918 -9.792 5.374 62 1HB GLU 9 HB2 GLU 9 14.026 -11.962 3.613 63 2HB GLU 9 HB1 GLU 9 12.588 -11.968 4.557 64 1HG GLU 9 HG2 GLU 9 11.473 -10.351 3.276 65 2HG GLU 9 HG1 GLU 9 12.920 -9.939 2.371 66 H ILE 10 HN ILE 10 13.076 -10.544 7.214 67 HA ILE 10 HA ILE 10 15.574 -11.832 8.129 68 HB ILE 10 HB ILE 10 13.805 -9.912 9.704 69 1HG1 ILE 10 HG12 ILE 10 16.615 -9.487 8.622 70 2HG1 ILE 10 HG11 ILE 10 15.161 -8.756 7.963 71 1HG2 ILE 10 HG21 ILE 10 14.777 -11.586 11.133 72 2HG2 ILE 10 HG22 ILE 10 15.516 -10.011 11.426 73 3HG2 ILE 10 HG23 ILE 10 16.388 -11.233 10.497 74 1HD1 ILE 10 HD11 ILE 10 16.404 -7.187 9.342 75 2HD1 ILE 10 HD12 ILE 10 16.289 -8.289 10.718 76 3HD1 ILE 10 HD13 ILE 10 14.833 -7.546 10.060 77 H LYS 11 HN LYS 11 15.282 -13.599 9.389 78 HA LYS 11 HA LYS 11 12.586 -14.069 10.370 79 1HB LYS 11 HB2 LYS 11 12.691 -16.450 10.039 80 2HB LYS 11 HB1 LYS 11 12.976 -15.657 8.513 81 1HG LYS 11 HG2 LYS 11 15.327 -16.194 8.640 82 2HG LYS 11 HG1 LYS 11 15.105 -16.878 10.259 83 1HD LYS 11 HD2 LYS 11 13.463 -18.480 9.321 84 2HD LYS 11 HD1 LYS 11 13.811 -17.852 7.714 85 1HE LYS 11 HE2 LYS 11 16.104 -18.612 7.898 86 2HE LYS 11 HE1 LYS 11 15.810 -19.170 9.548 87 1HZ LYS 11 HZ1 LYS 11 14.133 -20.687 8.678 88 2HZ LYS 11 HZ2 LYS 11 15.656 -21.018 8.026 89 3HZ LYS 11 HZ3 LYS 11 14.494 -20.209 7.094 90 H PHE 12 HN PHE 12 12.482 -15.356 12.297 91 HA PHE 12 HA PHE 12 14.765 -14.681 14.009 92 1HB PHE 12 HB2 PHE 12 11.920 -15.377 14.763 93 2HB PHE 12 HB1 PHE 12 13.167 -14.768 15.842 94 HD1 PHE 12 HD1 PHE 12 14.017 -12.414 15.488 95 HD2 PHE 12 HD2 PHE 12 10.556 -13.931 13.524 96 HE1 PHE 12 HE1 PHE 12 13.270 -10.114 15.021 97 HE2 PHE 12 HE2 PHE 12 9.807 -11.640 13.054 98 HZ PHE 12 HZ PHE 12 11.161 -9.729 13.802 99 H ARG 13 HN ARG 13 16.050 -16.368 14.624 100 HA ARG 13 HA ARG 13 14.764 -18.994 14.752 101 1HB ARG 13 HB2 ARG 13 16.388 -18.785 12.868 102 2HB ARG 13 HB1 ARG 13 17.652 -18.460 14.043 103 1HG ARG 13 HG2 ARG 13 17.349 -20.647 15.025 104 2HG ARG 13 HG1 ARG 13 16.025 -21.003 13.928 105 1HD ARG 13 HD2 ARG 13 17.660 -20.657 12.036 106 2HD ARG 13 HD1 ARG 13 18.932 -20.591 13.261 107 HE ARG 13 HE ARG 13 17.170 -22.914 13.228 108 1HH1 ARG 13 HH11 ARG 13 20.394 -21.611 12.544 109 2HH1 ARG 13 HH12 ARG 13 21.091 -23.152 12.355 110 1HH2 ARG 13 HH21 ARG 13 18.166 -25.006 12.949 111 2HH2 ARG 13 HH22 ARG 13 19.832 -25.087 12.589 112 H LEU 14 HN LEU 14 14.677 -19.795 16.647 113 HA LEU 14 HA LEU 14 15.752 -18.637 18.985 114 1HB LEU 14 HB2 LEU 14 14.692 -21.403 18.481 115 2HB LEU 14 HB1 LEU 14 15.006 -20.756 20.065 116 HG LEU 14 HG LEU 14 12.870 -19.802 18.128 117 1HD1 LEU 14 HD11 LEU 14 11.341 -20.671 19.695 118 2HD1 LEU 14 HD12 LEU 14 12.636 -21.163 20.780 119 3HD1 LEU 14 HD13 LEU 14 12.447 -21.955 19.217 120 1HD2 LEU 14 HD21 LEU 14 13.547 -18.829 20.911 121 2HD2 LEU 14 HD22 LEU 14 12.163 -18.327 19.944 122 3HD2 LEU 14 HD23 LEU 14 13.794 -17.919 19.421 123 H THR 15 HN THR 15 17.161 -19.792 20.530 124 HA THR 15 HA THR 15 19.614 -20.468 19.259 125 HB THR 15 HB THR 15 19.331 -19.269 21.458 126 HG1 THR 15 HG1 THR 15 21.184 -20.733 22.417 127 1HG2 THR 15 HG21 THR 15 18.969 -22.081 22.517 128 2HG2 THR 15 HG22 THR 15 17.781 -20.784 22.581 129 3HG2 THR 15 HG23 THR 15 19.266 -20.663 23.521 130 H ASP 16 HN ASP 16 16.942 -22.116 20.172 131 HA ASP 16 HA ASP 16 18.036 -24.770 20.505 132 1HB ASP 16 HB2 ASP 16 15.200 -23.954 19.825 133 2HB ASP 16 HB1 ASP 16 15.714 -25.538 20.387 134 H GLY 17 HN GLY 17 17.581 -22.735 17.878 135 1HA GLY 17 HA2 GLY 17 18.224 -23.197 15.694 136 2HA GLY 17 HA1 GLY 17 18.014 -24.915 16.006 137 H SER 18 HN SER 18 15.338 -23.367 17.177 138 HA SER 18 HA SER 18 13.727 -24.238 14.921 139 1HB SER 18 HB2 SER 18 12.907 -22.987 17.539 140 2HB SER 18 HB1 SER 18 11.887 -23.930 16.448 141 HG SER 18 HG SER 18 13.685 -25.605 16.872 142 H ASP 19 HN ASP 19 12.887 -22.746 13.372 143 HA ASP 19 HA ASP 19 13.229 -19.949 14.069 144 1HB ASP 19 HB2 ASP 19 13.661 -19.503 11.762 145 2HB ASP 19 HB1 ASP 19 14.867 -20.620 12.379 146 H ILE 20 HN ILE 20 11.931 -18.485 13.064 147 HA ILE 20 HA ILE 20 9.188 -19.373 12.475 148 HB ILE 20 HB ILE 20 10.227 -16.635 13.325 149 1HG1 ILE 20 HG12 ILE 20 8.720 -18.694 14.960 150 2HG1 ILE 20 HG11 ILE 20 10.428 -18.306 15.137 151 1HG2 ILE 20 HG21 ILE 20 7.857 -16.057 13.669 152 2HG2 ILE 20 HG22 ILE 20 7.391 -17.638 13.045 153 3HG2 ILE 20 HG23 ILE 20 8.196 -16.479 11.990 154 1HD1 ILE 20 HD11 ILE 20 9.821 -16.032 15.833 155 2HD1 ILE 20 HD12 ILE 20 9.096 -17.260 16.873 156 3HD1 ILE 20 HD13 ILE 20 8.114 -16.446 15.656 157 H GLY 21 HN GLY 21 8.272 -18.667 10.502 158 1HA GLY 21 HA2 GLY 21 9.866 -18.400 8.265 159 2HA GLY 21 HA1 GLY 21 8.184 -17.911 8.335 160 HA PRO 22 HA PRO 22 11.457 -14.311 8.173 161 1HB PRO 22 HB2 PRO 22 11.926 -14.037 5.536 162 2HB PRO 22 HB1 PRO 22 12.916 -15.048 6.586 163 1HG PRO 22 HG2 PRO 22 10.700 -15.851 4.736 164 2HG PRO 22 HG1 PRO 22 12.266 -16.639 5.010 165 1HD PRO 22 HD2 PRO 22 9.968 -17.526 6.134 166 2HD PRO 22 HD1 PRO 22 11.543 -17.680 6.939 167 H LYS 23 HN LYS 23 10.954 -12.250 7.791 168 HA LYS 23 HA LYS 23 8.485 -11.644 6.290 169 1HB LYS 23 HB2 LYS 23 9.398 -10.269 8.831 170 2HB LYS 23 HB1 LYS 23 8.059 -9.760 7.836 171 1HG LYS 23 HG2 LYS 23 7.159 -10.743 9.674 172 2HG LYS 23 HG1 LYS 23 6.971 -11.947 8.413 173 1HD LYS 23 HD2 LYS 23 8.898 -13.192 9.235 174 2HD LYS 23 HD1 LYS 23 9.205 -11.960 10.458 175 1HE LYS 23 HE2 LYS 23 8.097 -13.901 11.429 176 2HE LYS 23 HE1 LYS 23 7.079 -12.468 11.514 177 1HZ LYS 23 HZ1 LYS 23 5.809 -14.346 10.892 178 2HZ LYS 23 HZ2 LYS 23 6.802 -14.721 9.590 179 3HZ LYS 23 HZ3 LYS 23 5.862 -13.309 9.563 180 H ALA 24 HN ALA 24 8.493 -9.354 5.675 181 HA ALA 24 HA ALA 24 11.220 -8.690 4.831 182 1HB ALA 24 HB1 ALA 24 8.592 -7.637 3.760 183 2HB ALA 24 HB2 ALA 24 9.545 -8.931 3.039 184 3HB ALA 24 HB3 ALA 24 10.188 -7.296 3.093 185 H PHE 25 HN PHE 25 12.268 -7.107 5.842 186 HA PHE 25 HA PHE 25 10.695 -5.102 7.283 187 1HB PHE 25 HB2 PHE 25 13.453 -6.155 7.924 188 2HB PHE 25 HB1 PHE 25 12.561 -4.955 8.846 189 HD1 PHE 25 HD1 PHE 25 12.789 -8.475 7.921 190 HD2 PHE 25 HD2 PHE 25 10.856 -5.630 10.408 191 HE1 PHE 25 HE1 PHE 25 11.896 -10.291 9.282 192 HE2 PHE 25 HE2 PHE 25 9.954 -7.471 11.788 193 HZ PHE 25 HZ PHE 25 10.534 -9.842 11.173 194 HA PRO 26 HA PRO 26 12.880 -2.337 4.462 195 1HB PRO 26 HB2 PRO 26 11.881 -0.390 6.463 196 2HB PRO 26 HB1 PRO 26 11.692 -0.335 4.720 197 1HG PRO 26 HG2 PRO 26 9.636 -0.954 6.260 198 2HG PRO 26 HG1 PRO 26 9.908 -1.865 4.761 199 1HD PRO 26 HD2 PRO 26 10.532 -2.639 7.588 200 2HD PRO 26 HD1 PRO 26 9.833 -3.612 6.273 201 H ASP 27 HN ASP 27 14.853 -1.227 4.663 202 HA ASP 27 HA ASP 27 16.577 -1.711 6.829 203 1HB ASP 27 HB2 ASP 27 16.749 0.608 4.875 204 2HB ASP 27 HB1 ASP 27 18.041 0.065 5.924 205 H ALA 28 HN ALA 28 14.280 0.788 6.222 206 HA ALA 28 HA ALA 28 15.241 2.580 8.252 207 1HB ALA 28 HB1 ALA 28 12.677 2.655 6.691 208 2HB ALA 28 HB2 ALA 28 14.193 3.430 6.217 209 3HB ALA 28 HB3 ALA 28 13.338 3.967 7.664 210 H THR 29 HN THR 29 13.650 -0.281 8.563 211 HA THR 29 HA THR 29 11.895 0.593 10.668 212 HB THR 29 HB THR 29 12.561 -2.174 9.614 213 HG1 THR 29 HG1 THR 29 10.862 -0.172 8.984 214 1HG2 THR 29 HG21 THR 29 10.422 -1.349 11.601 215 2HG2 THR 29 HG22 THR 29 11.866 -2.282 11.997 216 3HG2 THR 29 HG23 THR 29 10.639 -2.967 10.933 217 H THR 30 HN THR 30 12.216 0.305 12.856 218 HA THR 30 HA THR 30 14.984 0.190 13.618 219 HB THR 30 HB THR 30 14.177 0.795 15.838 220 HG1 THR 30 HG1 THR 30 11.615 1.394 15.265 221 1HG2 THR 30 HG21 THR 30 12.979 2.450 13.615 222 2HG2 THR 30 HG22 THR 30 14.629 2.581 14.228 223 3HG2 THR 30 HG23 THR 30 13.267 3.020 15.258 224 H VAL 31 HN VAL 31 15.701 -1.046 15.493 225 HA VAL 31 HA VAL 31 14.951 -3.762 15.340 226 HB VAL 31 HB VAL 31 16.622 -2.321 17.436 227 1HG1 VAL 31 HG11 VAL 31 17.486 -4.535 18.068 228 2HG1 VAL 31 HG12 VAL 31 16.369 -5.300 16.943 229 3HG1 VAL 31 HG13 VAL 31 15.746 -4.439 18.349 230 1HG2 VAL 31 HG21 VAL 31 18.509 -3.296 16.231 231 2HG2 VAL 31 HG22 VAL 31 17.548 -2.225 15.205 232 3HG2 VAL 31 HG23 VAL 31 17.395 -3.974 15.049 233 H SER 32 HN SER 32 13.917 -1.075 17.206 234 HA SER 32 HA SER 32 12.561 -2.321 19.291 235 1HB SER 32 HB2 SER 32 12.980 0.137 19.111 236 2HB SER 32 HB1 SER 32 11.825 0.208 17.790 237 HG SER 32 HG SER 32 10.199 -0.246 19.155 238 H ALA 33 HN ALA 33 11.439 -1.360 16.026 239 HA ALA 33 HA ALA 33 8.849 -2.516 16.330 240 1HB ALA 33 HB1 ALA 33 8.584 -2.053 13.944 241 2HB ALA 33 HB2 ALA 33 10.314 -1.727 13.809 242 3HB ALA 33 HB3 ALA 33 9.290 -0.665 14.771 243 H LEU 34 HN LEU 34 11.970 -3.737 15.269 244 HA LEU 34 HA LEU 34 11.159 -5.999 13.940 245 1HB LEU 34 HB2 LEU 34 13.360 -5.005 13.792 246 2HB LEU 34 HB1 LEU 34 13.575 -5.189 15.518 247 HG LEU 34 HG LEU 34 13.651 -7.481 15.322 248 1HD1 LEU 34 HD11 LEU 34 13.834 -8.597 13.041 249 2HD1 LEU 34 HD12 LEU 34 13.476 -7.035 12.307 250 3HD1 LEU 34 HD13 LEU 34 12.260 -7.843 13.290 251 1HD2 LEU 34 HD21 LEU 34 15.561 -6.081 13.473 252 2HD2 LEU 34 HD22 LEU 34 15.830 -7.693 14.134 253 3HD2 LEU 34 HD23 LEU 34 15.714 -6.306 15.215 254 H LYS 35 HN LYS 35 12.027 -5.354 17.358 255 HA LYS 35 HA LYS 35 11.405 -7.940 18.197 256 1HB LYS 35 HB2 LYS 35 11.729 -5.382 19.715 257 2HB LYS 35 HB1 LYS 35 11.251 -6.870 20.520 258 1HG LYS 35 HG2 LYS 35 13.243 -7.948 19.842 259 2HG LYS 35 HG1 LYS 35 13.782 -6.548 18.901 260 1HD LYS 35 HD2 LYS 35 13.786 -5.254 21.049 261 2HD LYS 35 HD1 LYS 35 13.334 -6.738 21.882 262 1HE LYS 35 HE2 LYS 35 15.407 -7.781 21.208 263 2HE LYS 35 HE1 LYS 35 15.861 -6.333 20.306 264 1HZ LYS 35 HZ1 LYS 35 16.929 -6.326 22.476 265 2HZ LYS 35 HZ2 LYS 35 15.459 -6.454 23.266 266 3HZ LYS 35 HZ3 LYS 35 15.820 -5.083 22.375 267 H GLU 36 HN GLU 36 9.448 -5.007 18.000 268 HA GLU 36 HA GLU 36 7.179 -5.906 19.332 269 1HB GLU 36 HB2 GLU 36 7.420 -4.146 16.897 270 2HB GLU 36 HB1 GLU 36 5.935 -4.361 17.799 271 1HG GLU 36 HG2 GLU 36 8.497 -3.201 18.871 272 2HG GLU 36 HG1 GLU 36 7.072 -2.285 18.386 273 H THR 37 HN THR 37 8.357 -6.596 16.137 274 HA THR 37 HA THR 37 6.047 -7.944 15.232 275 HB THR 37 HB THR 37 8.905 -8.082 14.230 276 HG1 THR 37 HG1 THR 37 8.133 -5.978 14.054 277 1HG2 THR 37 HG21 THR 37 7.886 -8.831 12.107 278 2HG2 THR 37 HG22 THR 37 6.296 -8.824 12.868 279 3HG2 THR 37 HG23 THR 37 7.528 -9.963 13.411 280 H VAL 38 HN VAL 38 9.150 -9.070 16.651 281 HA VAL 38 HA VAL 38 8.584 -11.824 16.311 282 HB VAL 38 HB VAL 38 10.852 -10.865 16.767 283 1HG1 VAL 38 HG11 VAL 38 10.067 -10.844 19.649 284 2HG1 VAL 38 HG12 VAL 38 10.306 -9.449 18.630 285 3HG1 VAL 38 HG13 VAL 38 11.681 -10.506 18.999 286 1HG2 VAL 38 HG21 VAL 38 11.707 -12.759 18.058 287 2HG2 VAL 38 HG22 VAL 38 10.562 -13.253 16.807 288 3HG2 VAL 38 HG23 VAL 38 10.055 -13.189 18.502 289 H ILE 39 HN ILE 39 8.022 -9.663 18.918 290 HA ILE 39 HA ILE 39 7.016 -11.513 20.841 291 HB ILE 39 HB ILE 39 6.209 -8.582 20.578 292 1HG1 ILE 39 HG12 ILE 39 8.466 -9.777 22.180 293 2HG1 ILE 39 HG11 ILE 39 8.669 -8.977 20.627 294 1HG2 ILE 39 HG21 ILE 39 6.225 -10.452 22.969 295 2HG2 ILE 39 HG22 ILE 39 4.780 -9.783 22.205 296 3HG2 ILE 39 HG23 ILE 39 5.917 -8.733 23.061 297 1HD1 ILE 39 HD11 ILE 39 7.613 -7.740 23.147 298 2HD1 ILE 39 HD12 ILE 39 7.775 -6.922 21.589 299 3HD1 ILE 39 HD13 ILE 39 9.209 -7.503 22.438 300 H SER 40 HN SER 40 5.492 -9.797 18.193 301 HA SER 40 HA SER 40 2.827 -10.623 18.831 302 1HB SER 40 HB2 SER 40 3.961 -9.517 16.253 303 2HB SER 40 HB1 SER 40 2.246 -9.687 16.629 304 HG SER 40 HG SER 40 4.168 -7.998 17.847 305 H GLU 41 HN GLU 41 5.448 -11.884 16.774 306 HA GLU 41 HA GLU 41 3.885 -13.788 15.441 307 1HB GLU 41 HB2 GLU 41 6.828 -13.486 15.896 308 2HB GLU 41 HB1 GLU 41 6.105 -14.719 14.887 309 1HG GLU 41 HG2 GLU 41 5.898 -11.752 14.485 310 2HG GLU 41 HG1 GLU 41 6.908 -12.865 13.561 311 H TRP 42 HN TRP 42 5.490 -13.672 18.483 312 HA TRP 42 HA TRP 42 5.366 -16.533 18.827 313 1HB TRP 42 HB2 TRP 42 7.183 -14.986 19.761 314 2HB TRP 42 HB1 TRP 42 5.969 -14.434 20.907 315 HD1 TRP 42 HD1 TRP 42 5.226 -16.207 22.850 316 HE1 TRP 42 HE1 TRP 42 6.448 -18.261 23.784 317 HE3 TRP 42 HE3 TRP 42 8.579 -16.908 19.073 318 HZ2 TRP 42 HZ2 TRP 42 8.532 -20.000 22.975 319 HZ3 TRP 42 HZ3 TRP 42 10.146 -18.784 19.218 320 HH2 TRP 42 HH2 TRP 42 10.131 -20.297 21.117 321 HA PRO 43 HA PRO 43 1.080 -15.949 20.091 322 1HB PRO 43 HB2 PRO 43 1.397 -18.731 21.040 323 2HB PRO 43 HB1 PRO 43 0.201 -18.064 19.933 324 1HG PRO 43 HG2 PRO 43 2.183 -19.615 19.045 325 2HG PRO 43 HG1 PRO 43 1.612 -18.227 18.101 326 1HD PRO 43 HD2 PRO 43 4.063 -18.489 19.796 327 2HD PRO 43 HD1 PRO 43 3.838 -17.678 18.228 328 H ARG 44 HN ARG 44 0.684 -14.910 21.931 329 HA ARG 44 HA ARG 44 2.090 -15.438 24.331 330 1HB ARG 44 HB2 ARG 44 0.587 -13.812 25.416 331 2HB ARG 44 HB1 ARG 44 1.162 -13.195 23.885 332 1HG ARG 44 HG2 ARG 44 -1.072 -12.555 23.967 333 2HG ARG 44 HG1 ARG 44 -1.087 -13.985 22.942 334 1HD ARG 44 HD2 ARG 44 -1.769 -15.337 24.889 335 2HD ARG 44 HD1 ARG 44 -1.802 -13.874 25.872 336 HE ARG 44 HE ARG 44 -3.414 -14.103 23.463 337 1HH1 ARG 44 HH11 ARG 44 -3.278 -13.849 27.011 338 2HH1 ARG 44 HH12 ARG 44 -4.903 -13.392 27.183 339 1HH2 ARG 44 HH21 ARG 44 -5.682 -13.444 23.734 340 2HH2 ARG 44 HH22 ARG 44 -6.281 -13.137 25.285 341 H GLU 45 HN GLU 45 -0.575 -16.776 22.788 342 HA GLU 45 HA GLU 45 -1.900 -18.120 24.885 343 1HB GLU 45 HB2 GLU 45 -1.629 -18.838 21.960 344 2HB GLU 45 HB1 GLU 45 -2.759 -19.571 23.074 345 1HG GLU 45 HG2 GLU 45 -3.920 -18.012 21.666 346 2HG GLU 45 HG1 GLU 45 -3.893 -17.387 23.304 347 H LYS 46 HN LYS 46 1.208 -18.535 23.570 348 HA LYS 46 HA LYS 46 1.470 -21.393 23.825 349 1HB LYS 46 HB2 LYS 46 2.868 -19.707 22.325 350 2HB LYS 46 HB1 LYS 46 3.660 -19.305 23.806 351 1HG LYS 46 HG2 LYS 46 4.989 -20.846 22.461 352 2HG LYS 46 HG1 LYS 46 4.569 -21.553 24.017 353 1HD LYS 46 HD2 LYS 46 2.824 -22.877 22.991 354 2HD LYS 46 HD1 LYS 46 3.074 -22.064 21.444 355 1HE LYS 46 HE2 LYS 46 5.134 -23.749 22.862 356 2HE LYS 46 HE1 LYS 46 4.087 -24.333 21.571 357 1HZ LYS 46 HZ1 LYS 46 5.077 -22.667 20.098 358 2HZ LYS 46 HZ2 LYS 46 6.227 -23.716 20.683 359 3HZ LYS 46 HZ3 LYS 46 6.144 -22.165 21.300 360 H GLU 47 HN GLU 47 3.610 -21.901 25.436 361 HA GLU 47 HA GLU 47 2.795 -21.519 28.033 362 1HB GLU 47 HB2 GLU 47 5.589 -22.024 27.020 363 2HB GLU 47 HB1 GLU 47 5.098 -22.160 28.699 364 1HG GLU 47 HG2 GLU 47 3.531 -23.951 28.065 365 2HG GLU 47 HG1 GLU 47 4.115 -23.835 26.403 366 H ASN 48 HN ASN 48 3.879 -20.264 29.742 367 HA ASN 48 HA ASN 48 4.056 -17.585 29.053 368 1HB ASN 48 HB2 ASN 48 4.424 -19.005 31.666 369 2HB ASN 48 HB1 ASN 48 4.694 -17.271 31.535 370 1HD2 ASN 48 HD21 ASN 48 2.319 -19.822 31.494 371 2HD2 ASN 48 HD22 ASN 48 0.950 -18.763 31.557 372 H GLY 49 HN GLY 49 6.093 -18.898 27.729 373 1HA GLY 49 HA2 GLY 49 8.643 -18.312 28.960 374 2HA GLY 49 HA1 GLY 49 8.355 -18.868 27.322 375 HA PRO 50 HA PRO 50 9.291 -14.637 26.093 376 1HB PRO 50 HB2 PRO 50 8.233 -15.794 23.562 377 2HB PRO 50 HB1 PRO 50 9.720 -14.887 23.813 378 1HG PRO 50 HG2 PRO 50 9.844 -17.481 23.442 379 2HG PRO 50 HG1 PRO 50 10.834 -16.741 24.716 380 1HD PRO 50 HD2 PRO 50 8.253 -18.243 24.960 381 2HD PRO 50 HD1 PRO 50 9.733 -18.355 25.947 382 H LYS 51 HN LYS 51 7.850 -13.124 26.522 383 HA LYS 51 HA LYS 51 5.310 -13.119 25.152 384 1HB LYS 51 HB2 LYS 51 4.125 -12.598 27.333 385 2HB LYS 51 HB1 LYS 51 4.631 -14.256 27.086 386 1HG LYS 51 HG2 LYS 51 6.705 -13.652 28.442 387 2HG LYS 51 HG1 LYS 51 5.821 -12.197 28.906 388 1HD LYS 51 HD2 LYS 51 4.021 -13.546 29.803 389 2HD LYS 51 HD1 LYS 51 4.826 -15.011 29.250 390 1HE LYS 51 HE2 LYS 51 5.857 -13.102 31.364 391 2HE LYS 51 HE1 LYS 51 5.197 -14.708 31.630 392 1HZ LYS 51 HZ1 LYS 51 7.728 -14.070 30.179 393 2HZ LYS 51 HZ2 LYS 51 7.084 -15.613 30.311 394 3HZ LYS 51 HZ3 LYS 51 7.585 -14.795 31.687 395 H THR 52 HN THR 52 7.900 -11.460 26.721 396 HA THR 52 HA THR 52 6.807 -8.977 25.665 397 HB THR 52 HB THR 52 7.843 -7.765 27.430 398 HG1 THR 52 HG1 THR 52 8.261 -10.371 28.560 399 1HG2 THR 52 HG21 THR 52 5.486 -8.286 27.689 400 2HG2 THR 52 HG22 THR 52 6.249 -8.331 29.276 401 3HG2 THR 52 HG23 THR 52 5.873 -9.836 28.431 402 H VAL 53 HN VAL 53 8.584 -7.278 25.577 403 HA VAL 53 HA VAL 53 10.653 -8.094 23.819 404 HB VAL 53 HB VAL 53 9.596 -5.896 23.655 405 1HG1 VAL 53 HG11 VAL 53 9.216 -5.391 25.987 406 2HG1 VAL 53 HG12 VAL 53 10.121 -4.081 25.224 407 3HG1 VAL 53 HG13 VAL 53 10.951 -5.242 26.258 408 1HG2 VAL 53 HG21 VAL 53 11.606 -4.473 23.415 409 2HG2 VAL 53 HG22 VAL 53 11.726 -6.060 22.671 410 3HG2 VAL 53 HG23 VAL 53 12.546 -5.747 24.211 411 H LYS 54 HN LYS 54 10.520 -7.611 27.202 412 HA LYS 54 HA LYS 54 13.158 -7.185 28.005 413 1HB LYS 54 HB2 LYS 54 11.188 -7.073 29.440 414 2HB LYS 54 HB1 LYS 54 10.967 -8.803 29.299 415 1HG LYS 54 HG2 LYS 54 13.237 -9.057 30.380 416 2HG LYS 54 HG1 LYS 54 13.173 -7.325 30.706 417 1HD LYS 54 HD2 LYS 54 11.204 -9.407 31.679 418 2HD LYS 54 HD1 LYS 54 12.413 -8.570 32.644 419 1HE LYS 54 HE2 LYS 54 11.283 -6.437 32.187 420 2HE LYS 54 HE1 LYS 54 10.080 -7.305 31.233 421 1HZ LYS 54 HZ1 LYS 54 9.269 -6.881 33.452 422 2HZ LYS 54 HZ2 LYS 54 10.582 -7.674 34.131 423 3HZ LYS 54 HZ3 LYS 54 9.450 -8.543 33.247 424 H GLU 55 HN GLU 55 11.487 -10.036 26.991 425 HA GLU 55 HA GLU 55 13.411 -11.863 28.178 426 1HB GLU 55 HB2 GLU 55 10.871 -12.361 26.674 427 2HB GLU 55 HB1 GLU 55 11.757 -13.516 27.672 428 1HG GLU 55 HG2 GLU 55 11.313 -12.288 29.652 429 2HG GLU 55 HG1 GLU 55 10.691 -10.926 28.733 430 H VAL 56 HN VAL 56 12.500 -10.685 25.043 431 HA VAL 56 HA VAL 56 13.907 -12.857 23.689 432 HB VAL 56 HB VAL 56 12.278 -10.587 22.524 433 1HG1 VAL 56 HG11 VAL 56 13.892 -11.436 20.927 434 2HG1 VAL 56 HG12 VAL 56 12.262 -11.935 20.466 435 3HG1 VAL 56 HG13 VAL 56 13.351 -13.086 21.234 436 1HG2 VAL 56 HG21 VAL 56 11.520 -13.469 23.005 437 2HG2 VAL 56 HG22 VAL 56 10.529 -12.277 22.161 438 3HG2 VAL 56 HG23 VAL 56 10.891 -12.069 23.875 439 H LYS 57 HN LYS 57 16.064 -12.601 23.299 440 HA LYS 57 HA LYS 57 17.136 -9.923 22.886 441 1HB LYS 57 HB2 LYS 57 18.470 -12.633 23.040 442 2HB LYS 57 HB1 LYS 57 19.319 -11.148 22.686 443 1HG LYS 57 HG2 LYS 57 18.693 -10.306 24.925 444 2HG LYS 57 HG1 LYS 57 17.916 -11.863 25.248 445 1HD LYS 57 HD2 LYS 57 20.022 -13.028 24.970 446 2HD LYS 57 HD1 LYS 57 20.825 -11.532 24.497 447 1HE LYS 57 HE2 LYS 57 20.412 -10.609 26.714 448 2HE LYS 57 HE1 LYS 57 19.585 -12.091 27.191 449 1HZ LYS 57 HZ1 LYS 57 21.660 -13.298 26.881 450 2HZ LYS 57 HZ2 LYS 57 21.894 -12.040 27.972 451 3HZ LYS 57 HZ3 LYS 57 22.442 -11.896 26.393 452 H LEU 58 HN LEU 58 17.898 -9.226 20.901 453 HA LEU 58 HA LEU 58 17.366 -11.046 18.682 454 1HB LEU 58 HB2 LEU 58 16.018 -8.868 18.950 455 2HB LEU 58 HB1 LEU 58 17.514 -8.006 18.727 456 HG LEU 58 HG LEU 58 16.060 -8.008 16.721 457 1HD1 LEU 58 HD11 LEU 58 17.726 -8.641 15.076 458 2HD1 LEU 58 HD12 LEU 58 18.652 -9.470 16.331 459 3HD1 LEU 58 HD13 LEU 58 18.414 -7.718 16.410 460 1HD2 LEU 58 HD21 LEU 58 15.028 -10.185 17.012 461 2HD2 LEU 58 HD22 LEU 58 16.572 -10.975 16.680 462 3HD2 LEU 58 HD23 LEU 58 15.774 -10.043 15.421 463 H ILE 59 HN ILE 59 19.227 -11.755 17.739 464 HA ILE 59 HA ILE 59 21.734 -10.275 18.228 465 HB ILE 59 HB ILE 59 21.235 -13.222 18.737 466 1HG1 ILE 59 HG12 ILE 59 21.984 -10.988 20.619 467 2HG1 ILE 59 HG11 ILE 59 20.403 -11.752 20.524 468 1HG2 ILE 59 HG21 ILE 59 23.417 -12.896 17.752 469 2HG2 ILE 59 HG22 ILE 59 23.574 -13.306 19.464 470 3HG2 ILE 59 HG23 ILE 59 23.786 -11.639 18.932 471 1HD1 ILE 59 HD11 ILE 59 22.974 -13.076 21.362 472 2HD1 ILE 59 HD12 ILE 59 21.400 -13.863 21.248 473 3HD1 ILE 59 HD13 ILE 59 21.659 -12.574 22.427 474 H SER 60 HN SER 60 23.039 -10.167 16.599 475 HA SER 60 HA SER 60 22.606 -11.929 14.298 476 1HB SER 60 HB2 SER 60 23.524 -10.057 12.927 477 2HB SER 60 HB1 SER 60 22.043 -9.599 13.768 478 HG SER 60 HG SER 60 24.619 -9.135 14.783 479 H ALA 61 HN ALA 61 24.158 -13.439 14.395 480 HA ALA 61 HA ALA 61 26.166 -14.480 14.458 481 1HB ALA 61 HB1 ALA 61 28.096 -13.320 13.543 482 2HB ALA 61 HB2 ALA 61 27.313 -11.764 13.819 483 3HB ALA 61 HB3 ALA 61 26.646 -12.884 12.634 484 H GLY 62 HN GLY 62 25.218 -13.082 16.917 485 1HA GLY 62 HA2 GLY 62 26.141 -13.591 19.109 486 2HA GLY 62 HA1 GLY 62 27.744 -13.402 18.417 487 H LYS 63 HN LYS 63 25.624 -10.871 17.400 488 HA LYS 63 HA LYS 63 26.703 -9.127 19.422 489 1HB LYS 63 HB2 LYS 63 25.806 -8.693 16.588 490 2HB LYS 63 HB1 LYS 63 26.353 -7.461 17.701 491 1HG LYS 63 HG2 LYS 63 28.571 -8.501 17.782 492 2HG LYS 63 HG1 LYS 63 28.016 -9.769 16.689 493 1HD LYS 63 HD2 LYS 63 29.304 -8.104 15.470 494 2HD LYS 63 HD1 LYS 63 27.614 -8.052 14.963 495 1HE LYS 63 HE2 LYS 63 27.223 -6.119 16.376 496 2HE LYS 63 HE1 LYS 63 28.878 -6.200 16.979 497 1HZ LYS 63 HZ1 LYS 63 28.658 -4.528 15.302 498 2HZ LYS 63 HZ2 LYS 63 28.015 -5.608 14.211 499 3HZ LYS 63 HZ3 LYS 63 29.636 -5.757 14.687 500 H VAL 64 HN VAL 64 25.167 -8.130 20.663 501 HA VAL 64 HA VAL 64 22.378 -8.756 20.152 502 HB VAL 64 HB VAL 64 23.624 -7.228 22.453 503 1HG1 VAL 64 HG11 VAL 64 21.547 -7.730 23.653 504 2HG1 VAL 64 HG12 VAL 64 20.907 -8.493 22.198 505 3HG1 VAL 64 HG13 VAL 64 21.262 -6.764 22.203 506 1HG2 VAL 64 HG21 VAL 64 23.422 -9.304 23.756 507 2HG2 VAL 64 HG22 VAL 64 24.522 -9.490 22.390 508 3HG2 VAL 64 HG23 VAL 64 22.889 -10.154 22.307 509 H LEU 65 HN LEU 65 20.997 -7.315 19.182 510 HA LEU 65 HA LEU 65 22.058 -4.708 18.587 511 1HB LEU 65 HB2 LEU 65 19.598 -6.123 17.616 512 2HB LEU 65 HB1 LEU 65 20.236 -4.613 17.020 513 HG LEU 65 HG LEU 65 20.729 -6.185 15.461 514 1HD1 LEU 65 HD11 LEU 65 22.599 -4.738 15.808 515 2HD1 LEU 65 HD12 LEU 65 23.181 -6.344 15.365 516 3HD1 LEU 65 HD13 LEU 65 23.249 -5.816 17.047 517 1HD2 LEU 65 HD21 LEU 65 20.372 -8.239 16.629 518 2HD2 LEU 65 HD22 LEU 65 21.849 -8.006 17.556 519 3HD2 LEU 65 HD23 LEU 65 21.936 -8.303 15.822 520 H GLU 66 HN GLU 66 21.161 -2.876 19.330 521 HA GLU 66 HA GLU 66 19.168 -3.173 21.427 522 1HB GLU 66 HB2 GLU 66 21.222 -1.852 21.899 523 2HB GLU 66 HB1 GLU 66 20.761 -0.716 20.642 524 1HG GLU 66 HG2 GLU 66 20.218 0.144 22.867 525 2HG GLU 66 HG1 GLU 66 18.768 -0.103 21.897 526 H ASN 67 HN ASN 67 17.308 -1.955 21.519 527 HA ASN 67 HA ASN 67 15.696 -2.046 19.232 528 1HB ASN 67 HB2 ASN 67 15.248 -0.669 21.869 529 2HB ASN 67 HB1 ASN 67 14.018 -0.815 20.630 530 1HD2 ASN 67 HD21 ASN 67 12.693 -1.957 21.971 531 2HD2 ASN 67 HD22 ASN 67 12.983 -3.583 22.441 532 H SER 68 HN SER 68 17.485 0.646 20.572 533 HA SER 68 HA SER 68 15.913 2.673 19.429 534 1HB SER 68 HB2 SER 68 17.803 4.159 20.125 535 2HB SER 68 HB1 SER 68 17.119 3.167 21.410 536 HG SER 68 HG SER 68 19.069 2.600 21.705 537 H LYS 69 HN LYS 69 18.384 0.830 18.073 538 HA LYS 69 HA LYS 69 18.922 2.863 16.095 539 1HB LYS 69 HB2 LYS 69 20.209 0.203 16.595 540 2HB LYS 69 HB1 LYS 69 20.674 1.337 15.340 541 1HG LYS 69 HG2 LYS 69 21.279 2.987 17.035 542 2HG LYS 69 HG1 LYS 69 20.765 1.874 18.306 543 1HD LYS 69 HD2 LYS 69 22.487 0.268 17.534 544 2HD LYS 69 HD1 LYS 69 23.025 1.455 16.347 545 1HE LYS 69 HE2 LYS 69 23.584 3.004 18.121 546 2HE LYS 69 HE1 LYS 69 22.987 1.868 19.325 547 1HZ LYS 69 HZ1 LYS 69 24.727 0.313 18.661 548 2HZ LYS 69 HZ2 LYS 69 25.385 1.763 19.163 549 3HZ LYS 69 HZ3 LYS 69 25.302 1.408 17.515 550 H THR 70 HN THR 70 19.116 2.071 13.803 551 HA THR 70 HA THR 70 16.571 0.814 13.179 552 HB THR 70 HB THR 70 18.313 2.115 11.159 553 HG1 THR 70 HG1 THR 70 18.444 3.599 12.780 554 1HG2 THR 70 HG21 THR 70 15.378 2.205 11.791 555 2HG2 THR 70 HG22 THR 70 16.143 1.213 10.549 556 3HG2 THR 70 HG23 THR 70 16.136 2.975 10.399 557 H VAL 71 HN VAL 71 16.593 -0.705 11.218 558 HA VAL 71 HA VAL 71 18.610 -2.685 11.372 559 HB VAL 71 HB VAL 71 16.687 -2.111 9.063 560 1HG1 VAL 71 HG11 VAL 71 18.586 -3.464 8.298 561 2HG1 VAL 71 HG12 VAL 71 17.108 -4.424 8.338 562 3HG1 VAL 71 HG13 VAL 71 18.312 -4.603 9.615 563 1HG2 VAL 71 HG21 VAL 71 16.505 -4.109 11.321 564 2HG2 VAL 71 HG22 VAL 71 15.358 -3.960 9.991 565 3HG2 VAL 71 HG23 VAL 71 15.538 -2.644 11.151 566 H LYS 72 HN LYS 72 18.093 0.028 9.302 567 HA LYS 72 HA LYS 72 20.171 -0.072 7.548 568 1HB LYS 72 HB2 LYS 72 18.591 1.582 7.195 569 2HB LYS 72 HB1 LYS 72 18.675 2.156 8.838 570 1HG LYS 72 HG2 LYS 72 21.037 2.488 7.060 571 2HG LYS 72 HG1 LYS 72 19.633 3.539 6.864 572 1HD LYS 72 HD2 LYS 72 19.787 4.171 9.236 573 2HD LYS 72 HD1 LYS 72 21.149 3.089 9.437 574 1HE LYS 72 HE2 LYS 72 22.492 4.422 7.958 575 2HE LYS 72 HE1 LYS 72 21.114 5.470 7.600 576 1HZ LYS 72 HZ1 LYS 72 22.686 6.372 9.292 577 2HZ LYS 72 HZ2 LYS 72 22.201 5.124 10.350 578 3HZ LYS 72 HZ3 LYS 72 21.094 6.254 9.803 579 H ASP 73 HN ASP 73 20.403 0.819 10.996 580 HA ASP 73 HA ASP 73 22.956 1.959 10.653 581 1HB ASP 73 HB2 ASP 73 21.412 1.183 13.121 582 2HB ASP 73 HB1 ASP 73 22.949 2.027 13.119 583 H TYR 74 HN TYR 74 21.759 -1.273 11.182 584 HA TYR 74 HA TYR 74 24.421 -2.158 12.015 585 1HB TYR 74 HB2 TYR 74 21.784 -3.596 12.027 586 2HB TYR 74 HB1 TYR 74 23.308 -4.208 12.615 587 HD1 TYR 74 HD1 TYR 74 20.316 -2.491 13.394 588 HD2 TYR 74 HD2 TYR 74 24.330 -2.991 14.676 589 HE1 TYR 74 HE1 TYR 74 19.690 -1.722 15.627 590 HE2 TYR 74 HE2 TYR 74 23.706 -2.216 16.933 591 HH TYR 74 HH TYR 74 20.381 -1.825 17.854 592 H ARG 75 HN ARG 75 22.698 -1.749 9.142 593 HA ARG 75 HA ARG 75 22.585 -4.297 8.115 594 1HB ARG 75 HB2 ARG 75 21.856 -3.277 6.186 595 2HB ARG 75 HB1 ARG 75 21.320 -2.219 7.455 596 1HG ARG 75 HG2 ARG 75 23.247 -0.733 7.012 597 2HG ARG 75 HG1 ARG 75 23.690 -1.760 5.651 598 1HD ARG 75 HD2 ARG 75 21.200 -0.078 5.963 599 2HD ARG 75 HD1 ARG 75 22.469 0.091 4.758 600 HE ARG 75 HE ARG 75 20.251 -1.772 4.779 601 1HH1 ARG 75 HH11 ARG 75 23.295 -0.902 3.192 602 2HH1 ARG 75 HH12 ARG 75 22.905 -1.735 1.756 603 1HH2 ARG 75 HH21 ARG 75 19.731 -2.780 2.942 604 2HH2 ARG 75 HH22 ARG 75 20.773 -2.866 1.578 605 H SER 76 HN SER 76 23.899 -5.442 6.770 606 HA SER 76 HA SER 76 26.649 -4.651 6.566 607 1HB SER 76 HB2 SER 76 25.180 -7.165 5.751 608 2HB SER 76 HB1 SER 76 26.930 -6.954 5.821 609 HG SER 76 HG SER 76 26.072 -6.221 8.151 610 HA PRO 77 HA PRO 77 25.626 -3.239 2.437 611 1HB PRO 77 HB2 PRO 77 27.945 -2.125 1.818 612 2HB PRO 77 HB1 PRO 77 26.938 -1.460 3.110 613 1HG PRO 77 HG2 PRO 77 29.367 -3.192 3.310 614 2HG PRO 77 HG1 PRO 77 28.918 -1.781 4.284 615 1HD PRO 77 HD2 PRO 77 28.507 -4.416 5.045 616 2HD PRO 77 HD1 PRO 77 27.617 -3.017 5.680 617 H VAL 78 HN VAL 78 26.731 -3.229 0.282 618 HA VAL 78 HA VAL 78 27.116 -4.319 -1.544 619 HB VAL 78 HB VAL 78 29.248 -3.499 -1.164 620 1HG1 VAL 78 HG11 VAL 78 29.977 -6.064 0.271 621 2HG1 VAL 78 HG12 VAL 78 29.832 -4.463 0.995 622 3HG1 VAL 78 HG13 VAL 78 31.124 -4.793 -0.157 623 1HG2 VAL 78 HG21 VAL 78 29.431 -6.274 -2.319 624 2HG2 VAL 78 HG22 VAL 78 30.657 -5.026 -2.540 625 3HG2 VAL 78 HG23 VAL 78 29.030 -4.786 -3.175 626 H SER 79 HN SER 79 25.661 -5.584 -1.819 627 HA SER 79 HA SER 79 24.557 -7.499 -2.373 628 1HB SER 79 HB2 SER 79 27.379 -8.431 -2.858 629 2HB SER 79 HB1 SER 79 25.928 -9.202 -3.506 630 HG SER 79 HG SER 79 27.292 -7.277 -4.566 631 H ASN 80 HN ASN 80 25.129 -7.334 0.398 632 HA ASN 80 HA ASN 80 25.494 -10.168 1.143 633 1HB ASN 80 HB2 ASN 80 26.830 -8.504 2.434 634 2HB ASN 80 HB1 ASN 80 25.344 -7.744 2.973 635 1HD2 ASN 80 HD21 ASN 80 27.517 -8.947 4.550 636 2HD2 ASN 80 HD22 ASN 80 26.769 -10.165 5.511 637 H LEU 81 HN LEU 81 23.337 -7.520 2.219 638 HA LEU 81 HA LEU 81 21.345 -9.393 2.893 639 1HB LEU 81 HB2 LEU 81 21.788 -6.496 3.163 640 2HB LEU 81 HB1 LEU 81 20.406 -7.344 3.784 641 HG LEU 81 HG LEU 81 23.283 -7.644 4.675 642 1HD1 LEU 81 HD11 LEU 81 22.498 -6.776 6.810 643 2HD1 LEU 81 HD12 LEU 81 20.882 -6.574 6.139 644 3HD1 LEU 81 HD13 LEU 81 22.227 -5.624 5.504 645 1HD2 LEU 81 HD21 LEU 81 22.435 -9.168 6.407 646 2HD2 LEU 81 HD22 LEU 81 22.192 -9.804 4.786 647 3HD2 LEU 81 HD23 LEU 81 20.833 -9.100 5.670 648 H ALA 82 HN ALA 82 19.119 -8.254 2.471 649 HA ALA 82 HA ALA 82 17.442 -7.769 1.088 650 1HB ALA 82 HB1 ALA 82 18.591 -5.581 0.921 651 2HB ALA 82 HB2 ALA 82 17.676 -5.993 -0.526 652 3HB ALA 82 HB3 ALA 82 19.433 -6.165 -0.518 653 H GLY 83 HN GLY 83 16.957 -9.748 0.382 654 1HA GLY 83 HA2 GLY 83 16.407 -10.638 -1.888 655 2HA GLY 83 HA1 GLY 83 18.156 -10.642 -2.145 656 H ALA 84 HN ALA 84 19.114 -11.414 0.155 657 HA ALA 84 HA ALA 84 18.346 -14.201 0.376 658 1HB ALA 84 HB1 ALA 84 20.727 -13.652 0.126 659 2HB ALA 84 HB2 ALA 84 20.419 -14.400 1.696 660 3HB ALA 84 HB3 ALA 84 20.650 -12.658 1.579 661 H VAL 85 HN VAL 85 17.986 -15.141 2.492 662 HA VAL 85 HA VAL 85 16.398 -13.366 4.120 663 HB VAL 85 HB VAL 85 16.933 -16.327 4.441 664 1HG1 VAL 85 HG11 VAL 85 16.224 -15.316 6.524 665 2HG1 VAL 85 HG12 VAL 85 14.928 -16.325 5.876 666 3HG1 VAL 85 HG13 VAL 85 14.845 -14.570 5.722 667 1HG2 VAL 85 HG21 VAL 85 14.699 -16.662 3.471 668 2HG2 VAL 85 HG22 VAL 85 15.805 -15.892 2.335 669 3HG2 VAL 85 HG23 VAL 85 14.581 -14.928 3.170 670 H THR 86 HN THR 86 16.956 -12.658 6.041 671 HA THR 86 HA THR 86 19.664 -13.203 6.939 672 HB THR 86 HB THR 86 17.756 -10.978 7.691 673 HG1 THR 86 HG1 THR 86 18.176 -10.789 5.544 674 1HG2 THR 86 HG21 THR 86 19.822 -9.841 8.401 675 2HG2 THR 86 HG22 THR 86 20.761 -11.260 7.935 676 3HG2 THR 86 HG23 THR 86 19.593 -11.362 9.259 677 H THR 87 HN THR 87 19.866 -14.481 8.687 678 HA THR 87 HA THR 87 17.444 -15.088 10.199 679 HB THR 87 HB THR 87 20.031 -16.637 9.971 680 HG1 THR 87 HG1 THR 87 18.277 -16.263 8.195 681 1HG2 THR 87 HG21 THR 87 17.312 -17.410 11.069 682 2HG2 THR 87 HG22 THR 87 18.754 -17.105 12.036 683 3HG2 THR 87 HG23 THR 87 18.707 -18.479 10.934 684 H MET 88 HN MET 88 17.305 -14.111 12.088 685 HA MET 88 HA MET 88 19.712 -13.260 13.519 686 1HB MET 88 HB2 MET 88 16.848 -12.472 13.538 687 2HB MET 88 HB1 MET 88 17.733 -12.342 15.039 688 1HG MET 88 HG2 MET 88 17.549 -10.232 13.733 689 2HG MET 88 HG1 MET 88 19.187 -10.690 14.141 690 1HE MET 88 HE1 MET 88 20.885 -11.232 10.760 691 2HE MET 88 HE2 MET 88 20.415 -12.460 11.909 692 3HE MET 88 HE3 MET 88 21.063 -10.920 12.486 693 H HIS 89 HN HIS 89 20.328 -14.102 15.322 694 HA HIS 89 HA HIS 89 19.065 -16.596 16.080 695 1HB HIS 89 HB2 HIS 89 21.535 -16.348 15.720 696 2HB HIS 89 HB1 HIS 89 21.591 -15.322 17.142 697 HD1 HIS 89 HD1 HIS 89 22.572 -16.632 18.982 698 HD2 HIS 89 HD2 HIS 89 20.080 -18.953 16.620 699 HE1 HIS 89 HE1 HIS 89 22.588 -18.920 20.024 700 HE2 HIS 89 HE2 HIS 89 21.481 -20.316 18.257 701 H VAL 90 HN VAL 90 17.766 -16.677 17.680 702 HA VAL 90 HA VAL 90 17.546 -14.371 19.517 703 HB VAL 90 HB VAL 90 15.430 -16.391 18.717 704 1HG1 VAL 90 HG11 VAL 90 13.868 -14.917 19.897 705 2HG1 VAL 90 HG12 VAL 90 15.224 -13.904 20.402 706 3HG1 VAL 90 HG13 VAL 90 15.104 -15.565 20.976 707 1HG2 VAL 90 HG21 VAL 90 15.926 -14.907 16.862 708 2HG2 VAL 90 HG22 VAL 90 15.751 -13.502 17.915 709 3HG2 VAL 90 HG23 VAL 90 14.351 -14.508 17.554 710 H ILE 91 HN ILE 91 17.801 -14.535 21.434 711 HA ILE 91 HA ILE 91 17.936 -17.158 22.717 712 HB ILE 91 HB ILE 91 19.618 -14.718 23.016 713 1HG1 ILE 91 HG12 ILE 91 20.333 -17.590 22.411 714 2HG1 ILE 91 HG11 ILE 91 20.393 -16.221 21.307 715 1HG2 ILE 91 HG21 ILE 91 20.758 -15.848 24.974 716 2HG2 ILE 91 HG22 ILE 91 19.557 -17.135 24.878 717 3HG2 ILE 91 HG23 ILE 91 19.059 -15.496 25.303 718 1HD1 ILE 91 HD11 ILE 91 22.154 -16.658 23.714 719 2HD1 ILE 91 HD12 ILE 91 22.223 -15.266 22.639 720 3HD1 ILE 91 HD13 ILE 91 22.614 -16.873 22.025 721 H ILE 92 HN ILE 92 16.737 -17.383 24.439 722 HA ILE 92 HA ILE 92 14.987 -15.127 25.068 723 HB ILE 92 HB ILE 92 14.577 -18.094 25.441 724 1HG1 ILE 92 HG12 ILE 92 14.508 -17.471 23.075 725 2HG1 ILE 92 HG11 ILE 92 12.904 -17.912 23.638 726 1HG2 ILE 92 HG21 ILE 92 12.270 -17.547 26.006 727 2HG2 ILE 92 HG22 ILE 92 12.667 -15.824 25.902 728 3HG2 ILE 92 HG23 ILE 92 13.423 -16.831 27.142 729 1HD1 ILE 92 HD11 ILE 92 13.939 -15.116 23.176 730 2HD1 ILE 92 HD12 ILE 92 12.345 -15.517 23.803 731 3HD1 ILE 92 HD13 ILE 92 12.793 -16.004 22.167 732 H GLN 93 HN GLN 93 15.100 -14.251 27.044 733 HA GLN 93 HA GLN 93 16.105 -15.930 29.244 734 1HB GLN 93 HB2 GLN 93 16.037 -12.906 29.021 735 2HB GLN 93 HB1 GLN 93 16.493 -13.784 30.465 736 1HG GLN 93 HG2 GLN 93 18.401 -14.737 29.246 737 2HG GLN 93 HG1 GLN 93 17.945 -13.780 27.835 738 1HE2 GLN 93 HE21 GLN 93 20.358 -13.751 29.462 739 2HE2 GLN 93 HE22 GLN 93 20.561 -12.130 30.010 740 H ALA 94 HN ALA 94 14.353 -16.743 30.147 741 HA ALA 94 HA ALA 94 11.981 -15.060 30.335 742 1HB ALA 94 HB1 ALA 94 12.293 -18.018 30.874 743 2HB ALA 94 HB2 ALA 94 11.653 -17.307 29.394 744 3HB ALA 94 HB3 ALA 94 10.779 -17.119 30.914 745 HA PRO 95 HA PRO 95 13.038 -14.243 34.574 746 1HB PRO 95 HB2 PRO 95 10.125 -13.812 34.850 747 2HB PRO 95 HB1 PRO 95 11.450 -12.723 35.261 748 1HG PRO 95 HG2 PRO 95 9.933 -12.275 33.102 749 2HG PRO 95 HG1 PRO 95 11.674 -11.947 33.092 750 1HD PRO 95 HD2 PRO 95 10.173 -14.229 31.881 751 2HD PRO 95 HD1 PRO 95 11.604 -13.352 31.293 752 H VAL 96 HN VAL 96 12.964 -15.463 36.381 753 HA VAL 96 HA VAL 96 11.957 -18.100 36.252 754 HB VAL 96 HB VAL 96 12.908 -16.561 38.656 755 1HG1 VAL 96 HG11 VAL 96 13.323 -18.770 39.676 756 2HG1 VAL 96 HG12 VAL 96 12.610 -19.541 38.259 757 3HG1 VAL 96 HG13 VAL 96 11.613 -18.530 39.309 758 1HG2 VAL 96 HG21 VAL 96 15.060 -17.699 38.299 759 2HG2 VAL 96 HG22 VAL 96 14.623 -16.688 36.925 760 3HG2 VAL 96 HG23 VAL 96 14.415 -18.436 36.838 761 H THR 97 HN THR 97 10.842 -15.175 37.844 762 HA THR 97 HA THR 97 8.302 -16.464 38.046 763 HB THR 97 HB THR 97 9.175 -16.843 40.208 764 HG1 THR 97 HG1 THR 97 7.717 -15.489 41.521 765 1HG2 THR 97 HG21 THR 97 10.940 -15.179 40.304 766 2HG2 THR 97 HG22 THR 97 9.912 -15.036 41.737 767 3HG2 THR 97 HG23 THR 97 9.743 -13.886 40.412 768 H GLU 98 HN GLU 98 7.423 -15.275 36.442 769 HA GLU 98 HA GLU 98 6.351 -12.775 37.150 770 1HB GLU 98 HB2 GLU 98 8.601 -12.009 36.342 771 2HB GLU 98 HB1 GLU 98 8.262 -12.765 34.793 772 1HG GLU 98 HG2 GLU 98 6.466 -11.220 34.369 773 2HG GLU 98 HG1 GLU 98 6.627 -10.538 35.987 774 H LYS 99 HN LYS 99 4.425 -13.481 36.772 775 HA LYS 99 HA LYS 99 2.555 -14.156 35.808 776 1HB LYS 99 HB2 LYS 99 3.045 -12.476 34.057 777 2HB LYS 99 HB1 LYS 99 3.931 -13.690 33.149 778 1HG LYS 99 HG2 LYS 99 1.859 -14.989 32.877 779 2HG LYS 99 HG1 LYS 99 0.978 -13.755 33.778 780 1HD LYS 99 HD2 LYS 99 1.620 -12.090 32.072 781 2HD LYS 99 HD1 LYS 99 2.435 -13.362 31.169 782 1HE LYS 99 HE2 LYS 99 -0.515 -13.247 31.799 783 2HE LYS 99 HE1 LYS 99 0.216 -12.876 30.244 784 1HZ LYS 99 HZ1 LYS 99 -0.636 -15.105 30.171 785 2HZ LYS 99 HZ2 LYS 99 0.024 -15.494 31.608 786 3HZ LYS 99 HZ3 LYS 99 1.041 -15.304 30.280 787 H GLU 100 HN GLU 100 2.325 -16.175 36.428 788 HA GLU 100 HA GLU 100 3.493 -18.200 34.730 789 1HB GLU 100 HB2 GLU 100 3.032 -19.790 36.720 790 2HB GLU 100 HB1 GLU 100 4.410 -18.717 36.792 791 1HG GLU 100 HG2 GLU 100 3.319 -18.806 38.940 792 2HG GLU 100 HG1 GLU 100 3.111 -17.207 38.255 793 H LYS 101 HN LYS 101 0.738 -16.684 35.095 794 HA LYS 101 HA LYS 101 -0.832 -19.025 34.425 795 1HB LYS 101 HB2 LYS 101 -2.835 -17.618 34.778 796 2HB LYS 101 HB1 LYS 101 -1.855 -17.768 36.223 797 1HG LYS 101 HG2 LYS 101 -0.940 -15.508 35.803 798 2HG LYS 101 HG1 LYS 101 -1.968 -15.380 34.380 799 1HD LYS 101 HD2 LYS 101 -2.930 -15.727 37.223 800 2HD LYS 101 HD1 LYS 101 -2.960 -14.226 36.303 801 1HE LYS 101 HE2 LYS 101 -4.506 -15.241 34.697 802 2HE LYS 101 HE1 LYS 101 -4.437 -16.761 35.584 803 1HZ LYS 101 HZ1 LYS 101 -5.495 -14.194 36.638 804 2HZ LYS 101 HZ2 LYS 101 -5.394 -15.636 37.496 805 3HZ LYS 101 HZ3 LYS 101 -6.403 -15.533 36.165 Start of MODEL 6 1 H GLU 1 HT1 GLU 1 -1.689 -2.793 -3.258 2 HA GLU 1 HA GLU 1 -0.172 -4.046 -4.547 3 1HB GLU 1 HB2 GLU 1 -1.954 -4.476 -6.364 4 2HB GLU 1 HB1 GLU 1 -1.607 -2.865 -6.945 5 1HG GLU 1 HG2 GLU 1 0.351 -5.169 -6.854 6 2HG GLU 1 HG1 GLU 1 -0.501 -4.598 -8.280 7 H ALA 2 HN ALA 2 1.432 -2.757 -3.886 8 HA ALA 2 HA ALA 2 1.694 -0.106 -5.108 9 1HB ALA 2 HB1 ALA 2 2.253 -0.803 -2.218 10 2HB ALA 2 HB2 ALA 2 0.916 0.194 -2.793 11 3HB ALA 2 HB3 ALA 2 2.577 0.754 -2.979 12 H GLU 3 HN GLU 3 3.747 0.393 -5.748 13 HA GLU 3 HA GLU 3 5.513 -1.456 -6.600 14 1HB GLU 3 HB2 GLU 3 6.262 1.311 -5.649 15 2HB GLU 3 HB1 GLU 3 7.293 0.291 -6.617 16 1HG GLU 3 HG2 GLU 3 6.300 1.945 -8.025 17 2HG GLU 3 HG1 GLU 3 5.588 0.391 -8.436 18 H VAL 4 HN VAL 4 6.406 -2.989 -5.550 19 HA VAL 4 HA VAL 4 7.012 -2.857 -2.789 20 HB VAL 4 HB VAL 4 6.271 -4.890 -3.803 21 1HG1 VAL 4 HG11 VAL 4 8.903 -4.950 -5.276 22 2HG1 VAL 4 HG12 VAL 4 7.297 -4.803 -5.992 23 3HG1 VAL 4 HG13 VAL 4 7.781 -6.305 -5.201 24 1HG2 VAL 4 HG21 VAL 4 7.482 -5.153 -1.755 25 2HG2 VAL 4 HG22 VAL 4 9.020 -5.130 -2.608 26 3HG2 VAL 4 HG23 VAL 4 7.920 -6.495 -2.816 27 H HIS 5 HN HIS 5 8.797 -2.701 -1.802 28 HA HIS 5 HA HIS 5 11.153 -1.629 -3.235 29 1HB HIS 5 HB2 HIS 5 10.562 -1.720 -0.259 30 2HB HIS 5 HB1 HIS 5 12.022 -1.044 -0.952 31 HD1 HIS 5 HD1 HIS 5 11.948 1.428 -1.344 32 HD2 HIS 5 HD2 HIS 5 8.142 -0.230 -1.111 33 HE1 HIS 5 HE1 HIS 5 10.371 3.358 -1.381 34 HE2 HIS 5 HE2 HIS 5 8.156 2.327 -0.842 35 H ASN 6 HN ASN 6 13.321 -2.355 -2.045 36 HA ASN 6 HA ASN 6 13.290 -5.259 -2.108 37 1HB ASN 6 HB2 ASN 6 15.575 -3.268 -1.973 38 2HB ASN 6 HB1 ASN 6 15.809 -5.002 -1.877 39 1HD2 ASN 6 HD21 ASN 6 17.091 -4.970 -3.721 40 2HD2 ASN 6 HD22 ASN 6 16.419 -4.770 -5.298 41 H GLN 7 HN GLN 7 12.417 -6.006 -0.114 42 HA GLN 7 HA GLN 7 13.621 -4.828 2.200 43 1HB GLN 7 HB2 GLN 7 11.468 -6.876 1.907 44 2HB GLN 7 HB1 GLN 7 12.094 -6.331 3.445 45 1HG GLN 7 HG2 GLN 7 10.097 -5.164 3.207 46 2HG GLN 7 HG1 GLN 7 11.309 -4.000 2.689 47 1HE2 GLN 7 HE21 GLN 7 9.839 -2.869 1.506 48 2HE2 GLN 7 HE22 GLN 7 9.147 -3.482 0.049 49 H LEU 8 HN LEU 8 14.491 -6.150 3.755 50 HA LEU 8 HA LEU 8 15.726 -8.519 2.615 51 1HB LEU 8 HB2 LEU 8 16.534 -6.830 4.976 52 2HB LEU 8 HB1 LEU 8 17.307 -8.323 4.546 53 HG LEU 8 HG LEU 8 18.011 -7.307 2.352 54 1HD1 LEU 8 HD11 LEU 8 16.406 -5.578 2.066 55 2HD1 LEU 8 HD12 LEU 8 18.019 -4.850 2.117 56 3HD1 LEU 8 HD13 LEU 8 16.953 -4.763 3.521 57 1HD2 LEU 8 HD21 LEU 8 19.814 -5.931 3.258 58 2HD2 LEU 8 HD22 LEU 8 19.577 -7.410 4.190 59 3HD2 LEU 8 HD23 LEU 8 18.979 -5.870 4.811 60 H GLU 9 HN GLU 9 15.306 -10.409 3.521 61 HA GLU 9 HA GLU 9 12.984 -10.295 5.220 62 1HB GLU 9 HB2 GLU 9 14.060 -12.606 3.669 63 2HB GLU 9 HB1 GLU 9 12.531 -12.541 4.516 64 1HG GLU 9 HG2 GLU 9 11.771 -10.683 3.074 65 2HG GLU 9 HG1 GLU 9 13.269 -10.804 2.161 66 H ILE 10 HN ILE 10 13.003 -10.807 7.127 67 HA ILE 10 HA ILE 10 15.467 -11.923 8.309 68 HB ILE 10 HB ILE 10 13.382 -10.183 9.682 69 1HG1 ILE 10 HG12 ILE 10 16.186 -9.473 8.745 70 2HG1 ILE 10 HG11 ILE 10 14.706 -8.965 7.943 71 1HG2 ILE 10 HG21 ILE 10 14.495 -11.686 11.234 72 2HG2 ILE 10 HG22 ILE 10 15.036 -10.028 11.495 73 3HG2 ILE 10 HG23 ILE 10 16.071 -11.169 10.637 74 1HD1 ILE 10 HD11 ILE 10 15.559 -8.211 10.733 75 2HD1 ILE 10 HD12 ILE 10 14.091 -7.673 9.917 76 3HD1 ILE 10 HD13 ILE 10 15.670 -7.192 9.299 77 H LYS 11 HN LYS 11 15.352 -13.653 9.485 78 HA LYS 11 HA LYS 11 12.709 -14.599 10.312 79 1HB LYS 11 HB2 LYS 11 13.397 -16.910 10.102 80 2HB LYS 11 HB1 LYS 11 13.523 -16.110 8.552 81 1HG LYS 11 HG2 LYS 11 15.951 -15.987 8.803 82 2HG LYS 11 HG1 LYS 11 15.823 -16.709 10.409 83 1HD LYS 11 HD2 LYS 11 15.008 -18.036 7.812 84 2HD LYS 11 HD1 LYS 11 16.480 -18.375 8.719 85 1HE LYS 11 HE2 LYS 11 15.096 -19.111 10.636 86 2HE LYS 11 HE1 LYS 11 13.647 -18.805 9.689 87 1HZ LYS 11 HZ1 LYS 11 15.741 -20.812 9.048 88 2HZ LYS 11 HZ2 LYS 11 14.428 -20.466 8.090 89 3HZ LYS 11 HZ3 LYS 11 14.183 -21.115 9.638 90 H PHE 12 HN PHE 12 12.578 -15.521 12.328 91 HA PHE 12 HA PHE 12 14.714 -14.696 14.131 92 1HB PHE 12 HB2 PHE 12 11.930 -15.728 14.732 93 2HB PHE 12 HB1 PHE 12 13.070 -15.106 15.912 94 HD1 PHE 12 HD1 PHE 12 13.544 -12.703 16.030 95 HD2 PHE 12 HD2 PHE 12 10.652 -14.256 13.320 96 HE1 PHE 12 HE1 PHE 12 12.614 -10.448 15.729 97 HE2 PHE 12 HE2 PHE 12 9.720 -12.004 13.013 98 HZ PHE 12 HZ PHE 12 10.701 -10.095 14.217 99 H ARG 13 HN ARG 13 16.178 -16.174 14.663 100 HA ARG 13 HA ARG 13 15.436 -19.016 14.516 101 1HB ARG 13 HB2 ARG 13 17.443 -18.000 13.218 102 2HB ARG 13 HB1 ARG 13 18.212 -17.830 14.781 103 1HG ARG 13 HG2 ARG 13 17.397 -20.413 13.433 104 2HG ARG 13 HG1 ARG 13 19.029 -19.793 13.620 105 1HD ARG 13 HD2 ARG 13 18.784 -20.017 16.073 106 2HD ARG 13 HD1 ARG 13 17.179 -20.704 15.829 107 HE ARG 13 HE ARG 13 19.741 -21.907 15.162 108 1HH1 ARG 13 HH11 ARG 13 16.195 -22.242 15.306 109 2HH1 ARG 13 HH12 ARG 13 16.233 -23.931 15.118 110 1HH2 ARG 13 HH21 ARG 13 19.754 -24.194 14.978 111 2HH2 ARG 13 HH22 ARG 13 18.305 -25.087 14.940 112 H LEU 14 HN LEU 14 14.781 -19.677 16.499 113 HA LEU 14 HA LEU 14 15.571 -18.229 18.842 114 1HB LEU 14 HB2 LEU 14 13.833 -20.666 18.510 115 2HB LEU 14 HB1 LEU 14 14.114 -19.848 20.021 116 HG LEU 14 HG LEU 14 11.979 -19.274 19.274 117 1HD1 LEU 14 HD11 LEU 14 12.045 -16.855 19.064 118 2HD1 LEU 14 HD12 LEU 14 13.761 -16.942 18.707 119 3HD1 LEU 14 HD13 LEU 14 13.163 -17.453 20.293 120 1HD2 LEU 14 HD21 LEU 14 12.106 -19.813 16.919 121 2HD2 LEU 14 HD22 LEU 14 13.145 -18.417 16.626 122 3HD2 LEU 14 HD23 LEU 14 11.472 -18.182 17.128 123 H THR 15 HN THR 15 16.841 -18.896 20.435 124 HA THR 15 HA THR 15 18.888 -20.776 20.124 125 HB THR 15 HB THR 15 18.920 -18.846 21.576 126 HG1 THR 15 HG1 THR 15 19.182 -21.135 23.262 127 1HG2 THR 15 HG21 THR 15 16.656 -18.894 22.418 128 2HG2 THR 15 HG22 THR 15 17.787 -18.827 23.758 129 3HG2 THR 15 HG23 THR 15 16.995 -20.353 23.348 130 H ASP 16 HN ASP 16 15.752 -21.119 20.849 131 HA ASP 16 HA ASP 16 15.660 -23.506 22.494 132 1HB ASP 16 HB2 ASP 16 13.828 -21.889 22.515 133 2HB ASP 16 HB1 ASP 16 13.570 -22.113 20.795 134 H GLY 17 HN GLY 17 16.362 -22.923 19.253 135 1HA GLY 17 HA2 GLY 17 17.054 -24.547 17.711 136 2HA GLY 17 HA1 GLY 17 16.147 -25.758 18.610 137 H SER 18 HN SER 18 14.250 -23.184 18.363 138 HA SER 18 HA SER 18 12.785 -24.273 16.088 139 1HB SER 18 HB2 SER 18 11.961 -22.252 18.195 140 2HB SER 18 HB1 SER 18 10.900 -22.996 16.996 141 HG SER 18 HG SER 18 11.830 -24.023 19.398 142 H ASP 19 HN ASP 19 11.819 -22.540 14.545 143 HA ASP 19 HA ASP 19 13.068 -20.014 14.677 144 1HB ASP 19 HB2 ASP 19 13.726 -20.124 12.382 145 2HB ASP 19 HB1 ASP 19 14.775 -21.154 13.357 146 H ILE 20 HN ILE 20 12.101 -18.550 13.291 147 HA ILE 20 HA ILE 20 9.328 -19.248 12.598 148 HB ILE 20 HB ILE 20 10.574 -16.541 13.213 149 1HG1 ILE 20 HG12 ILE 20 8.641 -18.220 14.834 150 2HG1 ILE 20 HG11 ILE 20 10.350 -18.007 15.186 151 1HG2 ILE 20 HG21 ILE 20 8.277 -15.662 13.174 152 2HG2 ILE 20 HG22 ILE 20 7.682 -17.246 12.678 153 3HG2 ILE 20 HG23 ILE 20 8.737 -16.328 11.605 154 1HD1 ILE 20 HD11 ILE 20 9.961 -15.626 15.598 155 2HD1 ILE 20 HD12 ILE 20 8.938 -16.631 16.627 156 3HD1 ILE 20 HD13 ILE 20 8.258 -15.841 15.205 157 H GLY 21 HN GLY 21 8.579 -18.827 10.557 158 1HA GLY 21 HA2 GLY 21 10.397 -18.839 8.420 159 2HA GLY 21 HA1 GLY 21 8.672 -18.530 8.268 160 HA PRO 22 HA PRO 22 11.710 -14.680 8.143 161 1HB PRO 22 HB2 PRO 22 12.320 -14.612 5.459 162 2HB PRO 22 HB1 PRO 22 13.382 -15.244 6.711 163 1HG PRO 22 HG2 PRO 22 11.568 -16.717 4.849 164 2HG PRO 22 HG1 PRO 22 13.178 -17.164 5.442 165 1HD PRO 22 HD2 PRO 22 10.925 -18.271 6.416 166 2HD PRO 22 HD1 PRO 22 12.353 -17.985 7.430 167 H LYS 23 HN LYS 23 10.951 -12.749 7.699 168 HA LYS 23 HA LYS 23 8.603 -12.454 5.919 169 1HB LYS 23 HB2 LYS 23 9.234 -10.898 8.431 170 2HB LYS 23 HB1 LYS 23 7.808 -10.720 7.424 171 1HG LYS 23 HG2 LYS 23 7.044 -12.860 8.013 172 2HG LYS 23 HG1 LYS 23 8.617 -13.153 8.790 173 1HD LYS 23 HD2 LYS 23 8.119 -11.352 10.411 174 2HD LYS 23 HD1 LYS 23 6.550 -11.110 9.646 175 1HE LYS 23 HE2 LYS 23 7.478 -13.597 11.086 176 2HE LYS 23 HE1 LYS 23 6.351 -12.399 11.706 177 1HZ LYS 23 HZ1 LYS 23 5.171 -14.234 10.945 178 2HZ LYS 23 HZ2 LYS 23 5.903 -14.281 9.446 179 3HZ LYS 23 HZ3 LYS 23 4.841 -13.011 9.837 180 H ALA 24 HN ALA 24 8.489 -10.308 5.222 181 HA ALA 24 HA ALA 24 11.192 -9.368 4.462 182 1HB ALA 24 HB1 ALA 24 9.559 -9.688 2.617 183 2HB ALA 24 HB2 ALA 24 10.187 -8.051 2.664 184 3HB ALA 24 HB3 ALA 24 8.571 -8.390 3.286 185 H PHE 25 HN PHE 25 12.181 -7.759 5.442 186 HA PHE 25 HA PHE 25 10.549 -5.672 6.728 187 1HB PHE 25 HB2 PHE 25 13.189 -6.786 7.696 188 2HB PHE 25 HB1 PHE 25 12.275 -5.498 8.442 189 HD1 PHE 25 HD1 PHE 25 12.257 -9.086 7.661 190 HD2 PHE 25 HD2 PHE 25 10.694 -6.003 10.120 191 HE1 PHE 25 HE1 PHE 25 11.313 -10.773 9.151 192 HE2 PHE 25 HE2 PHE 25 9.727 -7.703 11.621 193 HZ PHE 25 HZ PHE 25 10.090 -10.130 11.099 194 HA PRO 26 HA PRO 26 13.326 -3.082 4.262 195 1HB PRO 26 HB2 PRO 26 12.615 -1.224 6.485 196 2HB PRO 26 HB1 PRO 26 12.623 -0.872 4.769 197 1HG PRO 26 HG2 PRO 26 10.315 -1.236 5.984 198 2HG PRO 26 HG1 PRO 26 10.586 -2.045 4.425 199 1HD PRO 26 HD2 PRO 26 10.713 -3.198 7.192 200 2HD PRO 26 HD1 PRO 26 10.020 -3.885 5.701 201 H ASP 27 HN ASP 27 15.437 -2.391 4.639 202 HA ASP 27 HA ASP 27 16.769 -3.568 6.866 203 1HB ASP 27 HB2 ASP 27 17.763 -3.376 4.606 204 2HB ASP 27 HB1 ASP 27 17.770 -1.629 4.787 205 H ALA 28 HN ALA 28 15.362 -0.548 6.210 206 HA ALA 28 HA ALA 28 16.733 0.929 8.279 207 1HB ALA 28 HB1 ALA 28 15.928 2.051 6.259 208 2HB ALA 28 HB2 ALA 28 15.193 2.735 7.714 209 3HB ALA 28 HB3 ALA 28 14.270 1.634 6.693 210 H THR 29 HN THR 29 14.635 -1.509 8.552 211 HA THR 29 HA THR 29 12.673 -0.527 10.354 212 HB THR 29 HB THR 29 13.744 -3.355 10.046 213 HG1 THR 29 HG1 THR 29 12.848 -3.055 8.221 214 1HG2 THR 29 HG21 THR 29 12.481 -3.047 12.154 215 2HG2 THR 29 HG22 THR 29 11.608 -4.072 11.013 216 3HG2 THR 29 HG23 THR 29 11.125 -2.393 11.231 217 H THR 30 HN THR 30 12.660 -0.373 12.515 218 HA THR 30 HA THR 30 15.132 -0.181 13.919 219 HB THR 30 HB THR 30 13.679 0.340 15.880 220 HG1 THR 30 HG1 THR 30 11.534 0.024 14.019 221 1HG2 THR 30 HG21 THR 30 12.735 2.434 14.976 222 2HG2 THR 30 HG22 THR 30 12.988 1.830 13.338 223 3HG2 THR 30 HG23 THR 30 14.371 2.148 14.385 224 H VAL 31 HN VAL 31 15.931 -1.549 15.541 225 HA VAL 31 HA VAL 31 15.174 -4.292 15.441 226 HB VAL 31 HB VAL 31 16.977 -2.768 17.346 227 1HG1 VAL 31 HG11 VAL 31 16.167 -4.887 18.397 228 2HG1 VAL 31 HG12 VAL 31 17.886 -4.974 18.013 229 3HG1 VAL 31 HG13 VAL 31 16.708 -5.779 16.974 230 1HG2 VAL 31 HG21 VAL 31 18.792 -3.788 16.062 231 2HG2 VAL 31 HG22 VAL 31 17.756 -2.770 15.064 232 3HG2 VAL 31 HG23 VAL 31 17.605 -4.527 14.986 233 H SER 32 HN SER 32 14.145 -1.643 17.437 234 HA SER 32 HA SER 32 12.790 -3.083 19.401 235 1HB SER 32 HB2 SER 32 11.964 -0.474 18.089 236 2HB SER 32 HB1 SER 32 11.356 -1.091 19.626 237 HG SER 32 HG SER 32 13.672 0.223 19.059 238 H ALA 33 HN ALA 33 11.803 -2.228 16.067 239 HA ALA 33 HA ALA 33 9.160 -3.187 16.263 240 1HB ALA 33 HB1 ALA 33 9.893 -1.648 14.495 241 2HB ALA 33 HB2 ALA 33 9.115 -3.088 13.835 242 3HB ALA 33 HB3 ALA 33 10.869 -2.936 13.787 243 H LEU 34 HN LEU 34 12.203 -4.788 15.562 244 HA LEU 34 HA LEU 34 11.227 -7.241 14.672 245 1HB LEU 34 HB2 LEU 34 13.684 -6.369 16.109 246 2HB LEU 34 HB1 LEU 34 13.407 -8.075 16.007 247 HG LEU 34 HG LEU 34 14.958 -7.329 14.361 248 1HD1 LEU 34 HD11 LEU 34 13.896 -8.250 12.323 249 2HD1 LEU 34 HD12 LEU 34 12.322 -8.126 13.102 250 3HD1 LEU 34 HD13 LEU 34 13.546 -9.213 13.755 251 1HD2 LEU 34 HD21 LEU 34 14.315 -5.864 12.478 252 2HD2 LEU 34 HD22 LEU 34 14.195 -5.010 14.016 253 3HD2 LEU 34 HD23 LEU 34 12.747 -5.613 13.227 254 H LYS 35 HN LYS 35 11.736 -6.032 17.958 255 HA LYS 35 HA LYS 35 10.881 -8.442 19.137 256 1HB LYS 35 HB2 LYS 35 11.195 -5.691 20.305 257 2HB LYS 35 HB1 LYS 35 10.817 -7.127 21.249 258 1HG LYS 35 HG2 LYS 35 12.892 -8.155 20.522 259 2HG LYS 35 HG1 LYS 35 13.311 -6.725 19.592 260 1HD LYS 35 HD2 LYS 35 13.227 -5.424 21.741 261 2HD LYS 35 HD1 LYS 35 12.952 -6.952 22.581 262 1HE LYS 35 HE2 LYS 35 15.094 -7.785 21.651 263 2HE LYS 35 HE1 LYS 35 15.375 -6.184 20.972 264 1HZ LYS 35 HZ1 LYS 35 15.083 -6.845 23.844 265 2HZ LYS 35 HZ2 LYS 35 15.272 -5.288 23.263 266 3HZ LYS 35 HZ3 LYS 35 16.511 -6.427 23.068 267 H GLU 36 HN GLU 36 9.315 -5.426 18.328 268 HA GLU 36 HA GLU 36 6.830 -5.900 19.511 269 1HB GLU 36 HB2 GLU 36 7.487 -4.421 16.964 270 2HB GLU 36 HB1 GLU 36 5.951 -4.322 17.805 271 1HG GLU 36 HG2 GLU 36 8.613 -3.508 18.946 272 2HG GLU 36 HG1 GLU 36 7.402 -2.417 18.276 273 H THR 37 HN THR 37 8.173 -6.951 16.466 274 HA THR 37 HA THR 37 5.792 -8.192 15.543 275 HB THR 37 HB THR 37 8.669 -8.586 14.684 276 HG1 THR 37 HG1 THR 37 8.050 -6.514 14.248 277 1HG2 THR 37 HG21 THR 37 7.706 -9.558 12.613 278 2HG2 THR 37 HG22 THR 37 6.087 -9.393 13.285 279 3HG2 THR 37 HG23 THR 37 7.226 -10.511 14.016 280 H VAL 38 HN VAL 38 8.693 -9.327 17.283 281 HA VAL 38 HA VAL 38 8.125 -12.060 17.016 282 HB VAL 38 HB VAL 38 10.320 -10.960 17.749 283 1HG1 VAL 38 HG11 VAL 38 9.529 -9.706 19.638 284 2HG1 VAL 38 HG12 VAL 38 10.864 -10.768 20.065 285 3HG1 VAL 38 HG13 VAL 38 9.212 -11.203 20.513 286 1HG2 VAL 38 HG21 VAL 38 11.104 -12.921 18.973 287 2HG2 VAL 38 HG22 VAL 38 10.148 -13.347 17.553 288 3HG2 VAL 38 HG23 VAL 38 9.434 -13.459 19.174 289 H ILE 39 HN ILE 39 7.267 -9.765 19.486 290 HA ILE 39 HA ILE 39 6.021 -11.560 21.295 291 HB ILE 39 HB ILE 39 5.290 -8.646 20.816 292 1HG1 ILE 39 HG12 ILE 39 7.184 -9.934 22.793 293 2HG1 ILE 39 HG11 ILE 39 7.625 -8.916 21.434 294 1HG2 ILE 39 HG21 ILE 39 3.497 -9.809 22.007 295 2HG2 ILE 39 HG22 ILE 39 4.329 -8.694 23.088 296 3HG2 ILE 39 HG23 ILE 39 4.659 -10.422 23.184 297 1HD1 ILE 39 HD11 ILE 39 6.565 -7.000 22.487 298 2HD1 ILE 39 HD12 ILE 39 7.746 -7.757 23.574 299 3HD1 ILE 39 HD13 ILE 39 6.027 -8.038 23.815 300 H SER 40 HN SER 40 4.777 -9.874 18.509 301 HA SER 40 HA SER 40 2.062 -10.678 18.870 302 1HB SER 40 HB2 SER 40 3.461 -9.632 16.409 303 2HB SER 40 HB1 SER 40 1.719 -9.637 16.702 304 HG SER 40 HG SER 40 3.690 -7.962 17.659 305 H GLU 41 HN GLU 41 4.857 -11.929 17.141 306 HA GLU 41 HA GLU 41 3.403 -13.795 15.566 307 1HB GLU 41 HB2 GLU 41 5.331 -12.598 14.753 308 2HB GLU 41 HB1 GLU 41 6.313 -13.235 16.050 309 1HG GLU 41 HG2 GLU 41 6.740 -14.188 13.929 310 2HG GLU 41 HG1 GLU 41 6.249 -15.406 15.101 311 H TRP 42 HN TRP 42 5.267 -13.853 18.570 312 HA TRP 42 HA TRP 42 5.591 -16.649 18.779 313 1HB TRP 42 HB2 TRP 42 6.813 -14.786 20.070 314 2HB TRP 42 HB1 TRP 42 5.375 -14.676 21.071 315 HD1 TRP 42 HD1 TRP 42 5.239 -16.368 23.094 316 HE1 TRP 42 HE1 TRP 42 6.774 -18.306 23.921 317 HE3 TRP 42 HE3 TRP 42 8.355 -16.721 19.069 318 HZ2 TRP 42 HZ2 TRP 42 8.947 -19.794 22.933 319 HZ3 TRP 42 HZ3 TRP 42 10.134 -18.416 19.094 320 HH2 TRP 42 HH2 TRP 42 10.412 -19.922 20.983 321 HA PRO 43 HA PRO 43 1.582 -18.457 19.630 322 1HB PRO 43 HB2 PRO 43 3.009 -19.285 22.121 323 2HB PRO 43 HB1 PRO 43 1.936 -20.241 21.094 324 1HG PRO 43 HG2 PRO 43 4.622 -20.420 20.920 325 2HG PRO 43 HG1 PRO 43 3.572 -20.619 19.511 326 1HD PRO 43 HD2 PRO 43 5.444 -18.458 20.130 327 2HD PRO 43 HD1 PRO 43 4.619 -18.814 18.601 328 H ARG 44 HN ARG 44 -0.051 -17.276 20.259 329 HA ARG 44 HA ARG 44 0.163 -15.107 22.072 330 1HB ARG 44 HB2 ARG 44 -2.175 -14.708 21.647 331 2HB ARG 44 HB1 ARG 44 -1.375 -15.117 20.138 332 1HG ARG 44 HG2 ARG 44 -2.238 -17.397 20.315 333 2HG ARG 44 HG1 ARG 44 -3.075 -16.961 21.804 334 1HD ARG 44 HD2 ARG 44 -4.635 -16.894 19.997 335 2HD ARG 44 HD1 ARG 44 -4.316 -15.238 20.506 336 HE ARG 44 HE ARG 44 -2.623 -16.095 18.400 337 1HH1 ARG 44 HH11 ARG 44 -5.863 -14.817 19.092 338 2HH1 ARG 44 HH12 ARG 44 -6.084 -14.159 17.536 339 1HH2 ARG 44 HH21 ARG 44 -2.963 -15.202 16.276 340 2HH2 ARG 44 HH22 ARG 44 -4.406 -14.377 15.905 341 H GLU 45 HN GLU 45 -0.811 -18.366 22.450 342 HA GLU 45 HA GLU 45 -2.318 -17.924 24.862 343 1HB GLU 45 HB2 GLU 45 -2.482 -20.349 25.015 344 2HB GLU 45 HB1 GLU 45 -2.878 -19.786 23.399 345 1HG GLU 45 HG2 GLU 45 -0.696 -20.478 22.595 346 2HG GLU 45 HG1 GLU 45 -0.230 -20.938 24.227 347 H LYS 46 HN LYS 46 1.026 -18.233 24.188 348 HA LYS 46 HA LYS 46 1.761 -19.518 26.566 349 1HB LYS 46 HB2 LYS 46 3.211 -18.048 24.409 350 2HB LYS 46 HB1 LYS 46 4.017 -18.643 25.844 351 1HG LYS 46 HG2 LYS 46 2.483 -20.348 23.881 352 2HG LYS 46 HG1 LYS 46 4.241 -20.168 23.905 353 1HD LYS 46 HD2 LYS 46 4.267 -21.064 26.203 354 2HD LYS 46 HD1 LYS 46 2.521 -21.276 26.116 355 1HE LYS 46 HE2 LYS 46 2.807 -22.850 24.269 356 2HE LYS 46 HE1 LYS 46 4.554 -22.636 24.350 357 1HZ LYS 46 HZ1 LYS 46 2.836 -23.738 26.517 358 2HZ LYS 46 HZ2 LYS 46 4.492 -23.535 26.638 359 3HZ LYS 46 HZ3 LYS 46 3.868 -24.632 25.545 360 H GLU 47 HN GLU 47 2.620 -18.695 28.375 361 HA GLU 47 HA GLU 47 3.133 -15.947 28.605 362 1HB GLU 47 HB2 GLU 47 0.826 -16.011 29.337 363 2HB GLU 47 HB1 GLU 47 1.163 -17.341 30.464 364 1HG GLU 47 HG2 GLU 47 2.668 -15.781 31.692 365 2HG GLU 47 HG1 GLU 47 2.179 -14.502 30.588 366 H ASN 48 HN ASN 48 4.434 -15.620 30.383 367 HA ASN 48 HA ASN 48 6.290 -16.058 31.678 368 1HB ASN 48 HB2 ASN 48 4.634 -17.367 33.060 369 2HB ASN 48 HB1 ASN 48 4.998 -18.784 32.093 370 1HD2 ASN 48 HD21 ASN 48 5.735 -19.992 33.747 371 2HD2 ASN 48 HD22 ASN 48 7.203 -19.691 34.606 372 H GLY 49 HN GLY 49 6.051 -16.804 28.781 373 1HA GLY 49 HA2 GLY 49 8.327 -18.622 28.701 374 2HA GLY 49 HA1 GLY 49 7.037 -18.624 27.496 375 HA PRO 50 HA PRO 50 10.438 -15.804 25.925 376 1HB PRO 50 HB2 PRO 50 9.818 -17.420 23.535 377 2HB PRO 50 HB1 PRO 50 11.391 -17.079 24.216 378 1HG PRO 50 HG2 PRO 50 10.431 -19.501 24.441 379 2HG PRO 50 HG1 PRO 50 11.139 -18.748 25.882 380 1HD PRO 50 HD2 PRO 50 8.249 -18.926 25.109 381 2HD PRO 50 HD1 PRO 50 9.029 -19.398 26.642 382 H LYS 51 HN LYS 51 7.875 -14.940 26.208 383 HA LYS 51 HA LYS 51 6.825 -14.422 23.507 384 1HB LYS 51 HB2 LYS 51 5.233 -15.383 25.098 385 2HB LYS 51 HB1 LYS 51 5.431 -13.988 26.142 386 1HG LYS 51 HG2 LYS 51 4.485 -12.542 24.411 387 2HG LYS 51 HG1 LYS 51 4.299 -13.935 23.347 388 1HD LYS 51 HD2 LYS 51 2.773 -14.961 24.966 389 2HD LYS 51 HD1 LYS 51 2.961 -13.568 26.030 390 1HE LYS 51 HE2 LYS 51 2.028 -12.123 24.268 391 2HE LYS 51 HE1 LYS 51 1.818 -13.538 23.243 392 1HZ LYS 51 HZ1 LYS 51 -0.237 -12.910 24.386 393 2HZ LYS 51 HZ2 LYS 51 0.487 -13.133 25.876 394 3HZ LYS 51 HZ3 LYS 51 0.240 -14.442 24.868 395 H THR 52 HN THR 52 7.895 -12.547 26.343 396 HA THR 52 HA THR 52 7.174 -10.233 24.818 397 HB THR 52 HB THR 52 7.359 -8.903 26.972 398 HG1 THR 52 HG1 THR 52 8.537 -10.717 28.081 399 1HG2 THR 52 HG21 THR 52 5.150 -9.662 27.737 400 2HG2 THR 52 HG22 THR 52 5.322 -11.116 26.760 401 3HG2 THR 52 HG23 THR 52 5.233 -9.538 25.981 402 H VAL 53 HN VAL 53 8.418 -8.207 25.565 403 HA VAL 53 HA VAL 53 10.712 -8.264 23.913 404 HB VAL 53 HB VAL 53 9.141 -6.398 23.905 405 1HG1 VAL 53 HG11 VAL 53 8.442 -6.387 26.207 406 2HG1 VAL 53 HG12 VAL 53 9.009 -4.788 25.736 407 3HG1 VAL 53 HG13 VAL 53 10.037 -5.833 26.717 408 1HG2 VAL 53 HG21 VAL 53 10.712 -4.498 24.068 409 2HG2 VAL 53 HG22 VAL 53 11.375 -5.861 23.187 410 3HG2 VAL 53 HG23 VAL 53 11.883 -5.562 24.854 411 H LYS 54 HN LYS 54 10.242 -8.388 27.316 412 HA LYS 54 HA LYS 54 12.641 -7.189 28.214 413 1HB LYS 54 HB2 LYS 54 10.840 -9.202 29.563 414 2HB LYS 54 HB1 LYS 54 12.029 -8.176 30.356 415 1HG LYS 54 HG2 LYS 54 10.777 -6.205 29.835 416 2HG LYS 54 HG1 LYS 54 9.667 -7.126 28.818 417 1HD LYS 54 HD2 LYS 54 8.943 -8.391 30.809 418 2HD LYS 54 HD1 LYS 54 10.013 -7.402 31.804 419 1HE LYS 54 HE2 LYS 54 8.787 -5.418 31.254 420 2HE LYS 54 HE1 LYS 54 7.788 -6.295 30.100 421 1HZ LYS 54 HZ1 LYS 54 7.830 -6.739 33.042 422 2HZ LYS 54 HZ2 LYS 54 6.892 -7.586 31.939 423 3HZ LYS 54 HZ3 LYS 54 6.623 -5.954 32.166 424 H GLU 55 HN GLU 55 11.660 -10.441 27.456 425 HA GLU 55 HA GLU 55 14.327 -11.363 28.213 426 1HB GLU 55 HB2 GLU 55 13.331 -13.665 28.283 427 2HB GLU 55 HB1 GLU 55 12.831 -12.538 29.525 428 1HG GLU 55 HG2 GLU 55 11.190 -13.110 27.070 429 2HG GLU 55 HG1 GLU 55 11.131 -14.045 28.569 430 H VAL 56 HN VAL 56 13.283 -10.324 25.497 431 HA VAL 56 HA VAL 56 14.452 -12.538 23.952 432 HB VAL 56 HB VAL 56 12.316 -10.573 23.047 433 1HG1 VAL 56 HG11 VAL 56 13.754 -12.689 21.461 434 2HG1 VAL 56 HG12 VAL 56 13.878 -10.944 21.208 435 3HG1 VAL 56 HG13 VAL 56 12.355 -11.783 20.898 436 1HG2 VAL 56 HG21 VAL 56 12.300 -13.581 23.322 437 2HG2 VAL 56 HG22 VAL 56 10.969 -12.594 22.714 438 3HG2 VAL 56 HG23 VAL 56 11.486 -12.437 24.391 439 H LYS 57 HN LYS 57 16.444 -12.116 23.187 440 HA LYS 57 HA LYS 57 17.073 -9.383 22.312 441 1HB LYS 57 HB2 LYS 57 18.783 -11.427 23.656 442 2HB LYS 57 HB1 LYS 57 19.528 -10.319 22.526 443 1HG LYS 57 HG2 LYS 57 19.769 -9.551 24.827 444 2HG LYS 57 HG1 LYS 57 18.791 -8.430 23.893 445 1HD LYS 57 HD2 LYS 57 16.773 -9.380 24.882 446 2HD LYS 57 HD1 LYS 57 17.757 -10.529 25.784 447 1HE LYS 57 HE2 LYS 57 18.873 -8.654 26.919 448 2HE LYS 57 HE1 LYS 57 17.842 -7.539 26.027 449 1HZ LYS 57 HZ1 LYS 57 17.048 -8.018 28.288 450 2HZ LYS 57 HZ2 LYS 57 16.776 -9.633 27.835 451 3HZ LYS 57 HZ3 LYS 57 15.928 -8.395 27.106 452 H LEU 58 HN LEU 58 18.057 -9.045 20.366 453 HA LEU 58 HA LEU 58 18.081 -11.333 18.520 454 1HB LEU 58 HB2 LEU 58 17.968 -8.356 17.918 455 2HB LEU 58 HB1 LEU 58 18.125 -9.597 16.702 456 HG LEU 58 HG LEU 58 15.883 -8.799 16.659 457 1HD1 LEU 58 HD11 LEU 58 14.578 -10.792 17.111 458 2HD1 LEU 58 HD12 LEU 58 15.924 -11.453 18.035 459 3HD1 LEU 58 HD13 LEU 58 16.107 -11.158 16.304 460 1HD2 LEU 58 HD21 LEU 58 15.741 -7.798 18.876 461 2HD2 LEU 58 HD22 LEU 58 15.719 -9.400 19.613 462 3HD2 LEU 58 HD23 LEU 58 14.375 -8.879 18.598 463 H ILE 59 HN ILE 59 19.985 -12.084 17.884 464 HA ILE 59 HA ILE 59 22.363 -10.307 17.912 465 HB ILE 59 HB ILE 59 22.234 -13.312 18.362 466 1HG1 ILE 59 HG12 ILE 59 22.979 -11.059 20.246 467 2HG1 ILE 59 HG11 ILE 59 21.537 -12.059 20.341 468 1HG2 ILE 59 HG21 ILE 59 24.633 -11.477 18.281 469 2HG2 ILE 59 HG22 ILE 59 24.213 -12.700 17.082 470 3HG2 ILE 59 HG23 ILE 59 24.667 -13.188 18.715 471 1HD1 ILE 59 HD11 ILE 59 22.937 -14.011 20.805 472 2HD1 ILE 59 HD12 ILE 59 23.183 -12.726 21.988 473 3HD1 ILE 59 HD13 ILE 59 24.377 -12.995 20.716 474 H SER 60 HN SER 60 23.109 -9.825 16.049 475 HA SER 60 HA SER 60 22.713 -11.701 13.840 476 1HB SER 60 HB2 SER 60 22.639 -8.686 13.734 477 2HB SER 60 HB1 SER 60 22.455 -9.777 12.362 478 HG SER 60 HG SER 60 20.831 -10.323 14.471 479 H ALA 61 HN ALA 61 24.601 -12.398 13.089 480 HA ALA 61 HA ALA 61 26.759 -12.578 12.458 481 1HB ALA 61 HB1 ALA 61 27.969 -10.596 11.692 482 2HB ALA 61 HB2 ALA 61 26.804 -9.550 12.500 483 3HB ALA 61 HB3 ALA 61 26.298 -10.539 11.131 484 H GLY 62 HN GLY 62 25.934 -12.222 15.274 485 1HA GLY 62 HA2 GLY 62 27.214 -12.761 17.181 486 2HA GLY 62 HA1 GLY 62 28.634 -12.101 16.380 487 H LYS 63 HN LYS 63 25.952 -9.923 16.100 488 HA LYS 63 HA LYS 63 27.115 -8.287 18.165 489 1HB LYS 63 HB2 LYS 63 25.301 -7.729 15.847 490 2HB LYS 63 HB1 LYS 63 25.842 -6.557 17.015 491 1HG LYS 63 HG2 LYS 63 28.168 -6.916 16.209 492 2HG LYS 63 HG1 LYS 63 27.524 -8.022 14.986 493 1HD LYS 63 HD2 LYS 63 26.105 -6.211 14.110 494 2HD LYS 63 HD1 LYS 63 26.779 -5.117 15.313 495 1HE LYS 63 HE2 LYS 63 27.842 -4.751 13.180 496 2HE LYS 63 HE1 LYS 63 29.002 -5.439 14.311 497 1HZ LYS 63 HZ1 LYS 63 29.126 -6.399 12.123 498 2HZ LYS 63 HZ2 LYS 63 27.540 -6.963 12.232 499 3HZ LYS 63 HZ3 LYS 63 28.736 -7.568 13.271 500 H VAL 64 HN VAL 64 25.884 -8.008 19.975 501 HA VAL 64 HA VAL 64 23.161 -8.955 20.018 502 HB VAL 64 HB VAL 64 24.623 -7.287 22.086 503 1HG1 VAL 64 HG11 VAL 64 22.215 -7.274 22.355 504 2HG1 VAL 64 HG12 VAL 64 22.972 -8.180 23.666 505 3HG1 VAL 64 HG13 VAL 64 22.178 -9.038 22.346 506 1HG2 VAL 64 HG21 VAL 64 25.089 -9.389 23.287 507 2HG2 VAL 64 HG22 VAL 64 25.862 -9.362 21.702 508 3HG2 VAL 64 HG23 VAL 64 24.389 -10.298 21.949 509 H LEU 65 HN LEU 65 21.584 -7.759 19.221 510 HA LEU 65 HA LEU 65 22.211 -5.157 18.280 511 1HB LEU 65 HB2 LEU 65 19.626 -6.661 18.148 512 2HB LEU 65 HB1 LEU 65 20.061 -5.225 17.251 513 HG LEU 65 HG LEU 65 21.256 -7.962 16.965 514 1HD1 LEU 65 HD11 LEU 65 19.549 -6.325 15.100 515 2HD1 LEU 65 HD12 LEU 65 19.050 -7.758 15.993 516 3HD1 LEU 65 HD13 LEU 65 20.266 -7.891 14.724 517 1HD2 LEU 65 HD21 LEU 65 21.940 -5.429 15.475 518 2HD2 LEU 65 HD22 LEU 65 22.523 -7.042 15.070 519 3HD2 LEU 65 HD23 LEU 65 22.986 -6.297 16.598 520 H GLU 66 HN GLU 66 21.752 -3.349 19.097 521 HA GLU 66 HA GLU 66 20.220 -2.982 21.495 522 1HB GLU 66 HB2 GLU 66 22.150 -1.596 21.182 523 2HB GLU 66 HB1 GLU 66 21.667 -1.176 19.551 524 1HG GLU 66 HG2 GLU 66 21.412 0.683 21.116 525 2HG GLU 66 HG1 GLU 66 19.881 0.203 20.400 526 H ASN 67 HN ASN 67 18.107 -2.522 21.509 527 HA ASN 67 HA ASN 67 16.651 -2.778 19.114 528 1HB ASN 67 HB2 ASN 67 14.615 -2.472 20.402 529 2HB ASN 67 HB1 ASN 67 15.711 -3.541 21.261 530 1HD2 ASN 67 HD21 ASN 67 14.077 -0.524 21.242 531 2HD2 ASN 67 HD22 ASN 67 14.445 -0.046 22.844 532 H SER 68 HN SER 68 17.926 -0.110 20.811 533 HA SER 68 HA SER 68 16.221 1.910 19.753 534 1HB SER 68 HB2 SER 68 18.995 2.221 20.913 535 2HB SER 68 HB1 SER 68 17.745 3.462 20.786 536 HG SER 68 HG SER 68 17.805 1.153 22.408 537 H LYS 69 HN LYS 69 18.396 0.039 18.122 538 HA LYS 69 HA LYS 69 19.052 2.158 16.269 539 1HB LYS 69 HB2 LYS 69 20.468 -0.383 16.944 540 2HB LYS 69 HB1 LYS 69 20.769 0.498 15.471 541 1HG LYS 69 HG2 LYS 69 21.487 2.448 16.770 542 2HG LYS 69 HG1 LYS 69 21.156 1.571 18.266 543 1HD LYS 69 HD2 LYS 69 22.850 -0.062 17.742 544 2HD LYS 69 HD1 LYS 69 23.105 0.658 16.154 545 1HE LYS 69 HE2 LYS 69 24.864 1.288 17.749 546 2HE LYS 69 HE1 LYS 69 23.955 2.681 17.176 547 1HZ LYS 69 HZ1 LYS 69 22.720 2.686 19.244 548 2HZ LYS 69 HZ2 LYS 69 24.375 2.782 19.506 549 3HZ LYS 69 HZ3 LYS 69 23.582 1.324 19.784 550 H THR 70 HN THR 70 19.256 1.300 13.922 551 HA THR 70 HA THR 70 16.973 -0.402 13.447 552 HB THR 70 HB THR 70 17.099 0.522 11.199 553 HG1 THR 70 HG1 THR 70 19.317 1.966 12.232 554 1HG2 THR 70 HG21 THR 70 16.345 2.818 11.691 555 2HG2 THR 70 HG22 THR 70 16.974 2.647 13.330 556 3HG2 THR 70 HG23 THR 70 15.640 1.629 12.781 557 H VAL 71 HN VAL 71 17.310 -1.838 11.473 558 HA VAL 71 HA VAL 71 19.542 -3.501 11.915 559 HB VAL 71 HB VAL 71 17.872 -3.327 9.377 560 1HG1 VAL 71 HG11 VAL 71 19.903 -4.632 9.081 561 2HG1 VAL 71 HG12 VAL 71 18.484 -5.677 9.051 562 3HG1 VAL 71 HG13 VAL 71 19.498 -5.608 10.494 563 1HG2 VAL 71 HG21 VAL 71 16.431 -3.626 11.317 564 2HG2 VAL 71 HG22 VAL 71 17.405 -4.997 11.850 565 3HG2 VAL 71 HG23 VAL 71 16.480 -5.102 10.354 566 H LYS 72 HN LYS 72 18.898 -0.907 9.733 567 HA LYS 72 HA LYS 72 20.916 -0.857 7.925 568 1HB LYS 72 HB2 LYS 72 19.014 0.648 8.019 569 2HB LYS 72 HB1 LYS 72 19.724 1.458 9.397 570 1HG LYS 72 HG2 LYS 72 19.950 2.748 7.420 571 2HG LYS 72 HG1 LYS 72 21.569 2.271 7.951 572 1HD LYS 72 HD2 LYS 72 20.024 0.771 5.830 573 2HD LYS 72 HD1 LYS 72 20.968 2.198 5.423 574 1HE LYS 72 HE2 LYS 72 22.980 1.151 6.030 575 2HE LYS 72 HE1 LYS 72 22.193 -0.187 6.834 576 1HZ LYS 72 HZ1 LYS 72 22.996 -0.827 4.632 577 2HZ LYS 72 HZ2 LYS 72 22.049 0.370 3.914 578 3HZ LYS 72 HZ3 LYS 72 21.332 -0.899 4.781 579 H ASP 73 HN ASP 73 20.988 0.159 11.328 580 HA ASP 73 HA ASP 73 23.386 1.560 11.305 581 1HB ASP 73 HB2 ASP 73 21.723 0.280 13.421 582 2HB ASP 73 HB1 ASP 73 23.227 1.033 13.863 583 H TYR 74 HN TYR 74 22.735 -1.875 11.482 584 HA TYR 74 HA TYR 74 25.428 -2.420 12.445 585 1HB TYR 74 HB2 TYR 74 23.108 -4.276 11.935 586 2HB TYR 74 HB1 TYR 74 24.620 -4.672 12.740 587 HD1 TYR 74 HD1 TYR 74 21.365 -3.173 13.069 588 HD2 TYR 74 HD2 TYR 74 25.119 -3.703 14.973 589 HE1 TYR 74 HE1 TYR 74 20.376 -2.462 15.186 590 HE2 TYR 74 HE2 TYR 74 24.130 -2.992 17.110 591 HH TYR 74 HH TYR 74 20.719 -2.576 17.495 592 H ARG 75 HN ARG 75 23.895 -1.916 9.532 593 HA ARG 75 HA ARG 75 25.015 -4.059 8.057 594 1HB ARG 75 HB2 ARG 75 23.522 -1.578 7.411 595 2HB ARG 75 HB1 ARG 75 24.081 -2.722 6.221 596 1HG ARG 75 HG2 ARG 75 22.150 -3.305 8.443 597 2HG ARG 75 HG1 ARG 75 21.693 -2.960 6.780 598 1HD ARG 75 HD2 ARG 75 23.068 -4.947 6.100 599 2HD ARG 75 HD1 ARG 75 23.235 -5.326 7.820 600 HE ARG 75 HE ARG 75 20.554 -4.879 7.072 601 1HH1 ARG 75 HH11 ARG 75 23.099 -7.294 6.950 602 2HH1 ARG 75 HH12 ARG 75 22.087 -8.653 6.888 603 1HH2 ARG 75 HH21 ARG 75 19.102 -6.708 7.003 604 2HH2 ARG 75 HH22 ARG 75 19.694 -8.314 6.911 605 H SER 76 HN SER 76 26.729 -3.877 6.725 606 HA SER 76 HA SER 76 28.079 -1.333 6.518 607 1HB SER 76 HB2 SER 76 29.001 -4.189 6.130 608 2HB SER 76 HB1 SER 76 30.008 -2.752 5.946 609 HG SER 76 HG SER 76 29.250 -2.302 8.178 610 HA PRO 77 HA PRO 77 26.251 -1.289 2.495 611 1HB PRO 77 HB2 PRO 77 28.248 0.049 1.135 612 2HB PRO 77 HB1 PRO 77 26.859 0.735 1.993 613 1HG PRO 77 HG2 PRO 77 29.704 0.486 2.879 614 2HG PRO 77 HG1 PRO 77 28.524 1.747 3.268 615 1HD PRO 77 HD2 PRO 77 29.227 -0.223 5.012 616 2HD PRO 77 HD1 PRO 77 27.623 0.541 4.998 617 H VAL 78 HN VAL 78 26.161 -3.130 1.655 618 HA VAL 78 HA VAL 78 28.402 -4.076 0.009 619 HB VAL 78 HB VAL 78 26.531 -5.853 1.529 620 1HG1 VAL 78 HG11 VAL 78 27.957 -7.725 0.697 621 2HG1 VAL 78 HG12 VAL 78 28.866 -6.560 -0.266 622 3HG1 VAL 78 HG13 VAL 78 27.162 -6.848 -0.611 623 1HG2 VAL 78 HG21 VAL 78 29.479 -5.381 1.939 624 2HG2 VAL 78 HG22 VAL 78 28.535 -6.608 2.778 625 3HG2 VAL 78 HG23 VAL 78 28.179 -4.897 3.028 626 H SER 79 HN SER 79 25.195 -5.113 0.457 627 HA SER 79 HA SER 79 24.213 -4.109 -2.046 628 1HB SER 79 HB2 SER 79 24.721 -7.099 -1.848 629 2HB SER 79 HB1 SER 79 23.798 -6.322 -3.128 630 HG SER 79 HG SER 79 26.139 -5.088 -2.875 631 H ASN 80 HN ASN 80 21.999 -4.089 -2.071 632 HA ASN 80 HA ASN 80 20.628 -5.574 0.055 633 1HB ASN 80 HB2 ASN 80 19.969 -2.826 -1.037 634 2HB ASN 80 HB1 ASN 80 18.908 -3.743 0.026 635 1HD2 ASN 80 HD21 ASN 80 21.891 -2.018 -0.221 636 2HD2 ASN 80 HD22 ASN 80 22.190 -1.848 1.474 637 H LEU 81 HN LEU 81 19.982 -7.381 -1.091 638 HA LEU 81 HA LEU 81 18.867 -7.118 -3.629 639 1HB LEU 81 HB2 LEU 81 19.311 -9.326 -1.726 640 2HB LEU 81 HB1 LEU 81 18.747 -9.489 -3.347 641 HG LEU 81 HG LEU 81 20.996 -10.157 -3.447 642 1HD1 LEU 81 HD11 LEU 81 20.981 -7.313 -4.346 643 2HD1 LEU 81 HD12 LEU 81 20.474 -8.730 -5.262 644 3HD1 LEU 81 HD13 LEU 81 22.168 -8.534 -4.805 645 1HD2 LEU 81 HD21 LEU 81 21.774 -7.726 -1.829 646 2HD2 LEU 81 HD22 LEU 81 22.896 -8.906 -2.508 647 3HD2 LEU 81 HD23 LEU 81 21.751 -9.397 -1.262 648 H ALA 82 HN ALA 82 16.843 -8.478 -3.901 649 HA ALA 82 HA ALA 82 14.970 -7.715 -1.911 650 1HB ALA 82 HB1 ALA 82 13.263 -8.134 -3.643 651 2HB ALA 82 HB2 ALA 82 14.544 -8.601 -4.761 652 3HB ALA 82 HB3 ALA 82 14.460 -6.943 -4.159 653 H GLY 83 HN GLY 83 15.238 -9.261 -0.532 654 1HA GLY 83 HA2 GLY 83 14.114 -11.410 0.117 655 2HA GLY 83 HA1 GLY 83 14.691 -12.042 -1.416 656 H ALA 84 HN ALA 84 16.774 -9.996 0.423 657 HA ALA 84 HA ALA 84 18.672 -12.112 0.792 658 1HB ALA 84 HB1 ALA 84 18.652 -9.271 1.847 659 2HB ALA 84 HB2 ALA 84 19.433 -9.812 0.358 660 3HB ALA 84 HB3 ALA 84 20.023 -10.378 1.919 661 H VAL 85 HN VAL 85 18.541 -13.520 2.411 662 HA VAL 85 HA VAL 85 16.620 -13.006 4.504 663 HB VAL 85 HB VAL 85 18.256 -15.479 4.032 664 1HG1 VAL 85 HG11 VAL 85 15.759 -15.067 5.672 665 2HG1 VAL 85 HG12 VAL 85 17.382 -15.373 6.285 666 3HG1 VAL 85 HG13 VAL 85 16.531 -16.626 5.374 667 1HG2 VAL 85 HG21 VAL 85 16.252 -16.433 2.941 668 2HG2 VAL 85 HG22 VAL 85 16.886 -15.033 2.067 669 3HG2 VAL 85 HG23 VAL 85 15.456 -14.866 3.083 670 H THR 86 HN THR 86 17.139 -12.323 6.326 671 HA THR 86 HA THR 86 19.897 -12.535 7.306 672 HB THR 86 HB THR 86 17.747 -10.528 8.070 673 HG1 THR 86 HG1 THR 86 19.222 -10.586 5.947 674 1HG2 THR 86 HG21 THR 86 19.560 -9.360 9.266 675 2HG2 THR 86 HG22 THR 86 20.680 -10.648 8.828 676 3HG2 THR 86 HG23 THR 86 19.327 -10.986 9.911 677 H THR 87 HN THR 87 20.104 -14.033 8.835 678 HA THR 87 HA THR 87 17.731 -14.935 10.250 679 HB THR 87 HB THR 87 20.525 -16.105 10.129 680 HG1 THR 87 HG1 THR 87 19.387 -16.052 8.116 681 1HG2 THR 87 HG21 THR 87 19.434 -18.152 10.964 682 2HG2 THR 87 HG22 THR 87 17.894 -17.300 11.041 683 3HG2 THR 87 HG23 THR 87 19.218 -16.818 12.099 684 H MET 88 HN MET 88 17.398 -14.029 12.207 685 HA MET 88 HA MET 88 19.725 -13.005 13.637 686 1HB MET 88 HB2 MET 88 16.787 -12.416 14.011 687 2HB MET 88 HB1 MET 88 18.050 -11.832 15.086 688 1HG MET 88 HG2 MET 88 19.077 -10.642 13.201 689 2HG MET 88 HG1 MET 88 17.767 -11.194 12.162 690 1HE MET 88 HE1 MET 88 17.450 -8.630 11.486 691 2HE MET 88 HE2 MET 88 18.682 -8.107 12.638 692 3HE MET 88 HE3 MET 88 17.091 -7.351 12.645 693 H HIS 89 HN HIS 89 20.403 -13.881 15.422 694 HA HIS 89 HA HIS 89 19.077 -16.321 16.261 695 1HB HIS 89 HB2 HIS 89 21.732 -15.111 17.092 696 2HB HIS 89 HB1 HIS 89 21.107 -16.644 17.686 697 HD1 HIS 89 HD1 HIS 89 21.675 -18.690 16.315 698 HD2 HIS 89 HD2 HIS 89 22.318 -15.153 14.220 699 HE1 HIS 89 HE1 HIS 89 22.753 -19.367 14.177 700 HE2 HIS 89 HE2 HIS 89 23.408 -17.213 13.094 701 H VAL 90 HN VAL 90 17.809 -16.392 17.926 702 HA VAL 90 HA VAL 90 17.589 -13.972 19.606 703 HB VAL 90 HB VAL 90 15.552 -16.138 19.144 704 1HG1 VAL 90 HG11 VAL 90 15.254 -14.931 21.206 705 2HG1 VAL 90 HG12 VAL 90 13.977 -14.498 20.064 706 3HG1 VAL 90 HG13 VAL 90 15.332 -13.399 20.341 707 1HG2 VAL 90 HG21 VAL 90 15.928 -15.046 17.019 708 2HG2 VAL 90 HG22 VAL 90 15.759 -13.462 17.771 709 3HG2 VAL 90 HG23 VAL 90 14.368 -14.541 17.672 710 H ILE 91 HN ILE 91 18.235 -14.018 21.396 711 HA ILE 91 HA ILE 91 18.644 -16.518 22.876 712 HB ILE 91 HB ILE 91 19.638 -13.733 23.138 713 1HG1 ILE 91 HG12 ILE 91 20.775 -14.918 21.398 714 2HG1 ILE 91 HG11 ILE 91 21.895 -14.708 22.736 715 1HG2 ILE 91 HG21 ILE 91 21.088 -14.553 25.057 716 2HG2 ILE 91 HG22 ILE 91 20.260 -16.106 24.962 717 3HG2 ILE 91 HG23 ILE 91 19.365 -14.660 25.422 718 1HD1 ILE 91 HD11 ILE 91 22.117 -16.911 21.756 719 2HD1 ILE 91 HD12 ILE 91 20.410 -17.237 22.028 720 3HD1 ILE 91 HD13 ILE 91 21.500 -17.045 23.403 721 H ILE 92 HN ILE 92 17.408 -17.009 24.469 722 HA ILE 92 HA ILE 92 15.303 -15.122 25.221 723 HB ILE 92 HB ILE 92 15.371 -18.139 25.370 724 1HG1 ILE 92 HG12 ILE 92 15.207 -17.394 23.040 725 2HG1 ILE 92 HG11 ILE 92 13.693 -18.116 23.559 726 1HG2 ILE 92 HG21 ILE 92 14.021 -17.215 27.122 727 2HG2 ILE 92 HG22 ILE 92 13.006 -18.004 25.909 728 3HG2 ILE 92 HG23 ILE 92 13.124 -16.241 25.951 729 1HD1 ILE 92 HD11 ILE 92 14.284 -15.180 23.199 730 2HD1 ILE 92 HD12 ILE 92 12.804 -15.812 23.885 731 3HD1 ILE 92 HD13 ILE 92 13.221 -16.195 22.211 732 H GLN 93 HN GLN 93 15.213 -14.465 27.303 733 HA GLN 93 HA GLN 93 16.955 -15.682 29.230 734 1HB GLN 93 HB2 GLN 93 15.280 -13.162 29.370 735 2HB GLN 93 HB1 GLN 93 16.176 -13.812 30.721 736 1HG GLN 93 HG2 GLN 93 17.398 -11.983 29.814 737 2HG GLN 93 HG1 GLN 93 18.260 -13.457 29.410 738 1HE2 GLN 93 HE21 GLN 93 18.424 -14.045 27.291 739 2HE2 GLN 93 HE22 GLN 93 17.955 -13.011 25.981 740 H ALA 94 HN ALA 94 16.179 -16.663 30.828 741 HA ALA 94 HA ALA 94 13.597 -17.843 30.832 742 1HB ALA 94 HB1 ALA 94 14.084 -18.620 33.135 743 2HB ALA 94 HB2 ALA 94 15.485 -17.552 33.184 744 3HB ALA 94 HB3 ALA 94 15.443 -18.900 32.047 745 HA PRO 95 HA PRO 95 11.493 -14.116 32.073 746 1HB PRO 95 HB2 PRO 95 9.143 -15.873 32.391 747 2HB PRO 95 HB1 PRO 95 9.355 -14.460 31.356 748 1HG PRO 95 HG2 PRO 95 9.321 -16.914 30.322 749 2HG PRO 95 HG1 PRO 95 10.417 -15.673 29.692 750 1HD PRO 95 HD2 PRO 95 10.999 -17.948 31.549 751 2HD PRO 95 HD1 PRO 95 11.914 -17.339 30.145 752 H VAL 96 HN VAL 96 10.483 -13.188 33.884 753 HA VAL 96 HA VAL 96 11.077 -14.483 36.362 754 HB VAL 96 HB VAL 96 9.628 -11.887 35.886 755 1HG1 VAL 96 HG11 VAL 96 10.903 -12.983 38.402 756 2HG1 VAL 96 HG12 VAL 96 9.176 -12.785 38.114 757 3HG1 VAL 96 HG13 VAL 96 10.215 -11.367 38.244 758 1HG2 VAL 96 HG21 VAL 96 11.783 -10.797 36.452 759 2HG2 VAL 96 HG22 VAL 96 11.861 -11.763 34.980 760 3HG2 VAL 96 HG23 VAL 96 12.543 -12.390 36.480 761 H THR 97 HN THR 97 9.837 -16.194 36.595 762 HA THR 97 HA THR 97 7.111 -16.360 35.995 763 HB THR 97 HB THR 97 8.814 -18.034 37.849 764 HG1 THR 97 HG1 THR 97 8.454 -17.889 35.069 765 1HG2 THR 97 HG21 THR 97 7.169 -19.815 37.370 766 2HG2 THR 97 HG22 THR 97 6.234 -18.687 36.392 767 3HG2 THR 97 HG23 THR 97 6.386 -18.430 38.131 768 H GLU 98 HN GLU 98 5.679 -15.142 37.002 769 HA GLU 98 HA GLU 98 5.530 -15.223 39.898 770 1HB GLU 98 HB2 GLU 98 6.715 -13.115 39.224 771 2HB GLU 98 HB1 GLU 98 5.302 -12.676 38.281 772 1HG GLU 98 HG2 GLU 98 3.954 -12.684 40.335 773 2HG GLU 98 HG1 GLU 98 5.412 -13.054 41.260 774 H LYS 99 HN LYS 99 3.476 -15.525 40.483 775 HA LYS 99 HA LYS 99 1.372 -16.162 40.363 776 1HB LYS 99 HB2 LYS 99 0.788 -13.870 39.608 777 2HB LYS 99 HB1 LYS 99 1.124 -14.333 37.947 778 1HG LYS 99 HG2 LYS 99 -0.719 -15.933 37.994 779 2HG LYS 99 HG1 LYS 99 -1.051 -15.513 39.670 780 1HD LYS 99 HD2 LYS 99 -1.583 -13.234 39.006 781 2HD LYS 99 HD1 LYS 99 -1.203 -13.634 37.328 782 1HE LYS 99 HE2 LYS 99 -3.002 -15.312 37.334 783 2HE LYS 99 HE1 LYS 99 -3.382 -14.890 38.997 784 1HZ LYS 99 HZ1 LYS 99 -3.975 -12.662 38.267 785 2HZ LYS 99 HZ2 LYS 99 -4.870 -13.790 37.424 786 3HZ LYS 99 HZ3 LYS 99 -3.545 -13.038 36.690 787 H GLU 100 HN GLU 100 1.420 -18.194 40.018 788 HA GLU 100 HA GLU 100 2.386 -19.277 37.551 789 1HB GLU 100 HB2 GLU 100 3.040 -20.251 39.670 790 2HB GLU 100 HB1 GLU 100 1.365 -20.617 40.044 791 1HG GLU 100 HG2 GLU 100 1.288 -22.167 38.171 792 2HG GLU 100 HG1 GLU 100 2.962 -21.781 37.778 793 H LYS 101 HN LYS 101 1.046 -19.122 35.912 794 HA LYS 101 HA LYS 101 -0.625 -19.473 34.516 795 1HB LYS 101 HB2 LYS 101 -1.143 -21.826 36.311 796 2HB LYS 101 HB1 LYS 101 -1.918 -21.593 34.749 797 1HG LYS 101 HG2 LYS 101 0.297 -21.612 33.680 798 2HG LYS 101 HG1 LYS 101 1.032 -21.909 35.257 799 1HD LYS 101 HD2 LYS 101 -0.191 -23.988 35.451 800 2HD LYS 101 HD1 LYS 101 -0.990 -23.685 33.907 801 1HE LYS 101 HE2 LYS 101 1.218 -23.694 32.804 802 2HE LYS 101 HE1 LYS 101 1.966 -24.077 34.349 803 1HZ LYS 101 HZ1 LYS 101 0.705 -26.137 34.412 804 2HZ LYS 101 HZ2 LYS 101 1.613 -26.068 32.991 805 3HZ LYS 101 HZ3 LYS 101 -0.037 -25.757 32.953 Start of MODEL 7 1 H GLU 1 HT1 GLU 1 2.452 -12.846 0.671 2 HA GLU 1 HA GLU 1 3.175 -11.977 -1.493 3 1HB GLU 1 HB2 GLU 1 0.358 -13.047 -1.309 4 2HB GLU 1 HB1 GLU 1 1.217 -12.863 -2.830 5 1HG GLU 1 HG2 GLU 1 2.070 -14.586 -0.515 6 2HG GLU 1 HG1 GLU 1 1.351 -15.147 -2.024 7 H ALA 2 HN ALA 2 2.717 -10.784 -3.338 8 HA ALA 2 HA ALA 2 2.325 -8.875 -4.440 9 1HB ALA 2 HB1 ALA 2 0.017 -8.087 -4.544 10 2HB ALA 2 HB2 ALA 2 -0.355 -8.972 -3.063 11 3HB ALA 2 HB3 ALA 2 0.050 -9.853 -4.536 12 H GLU 3 HN GLU 3 3.580 -8.697 -2.049 13 HA GLU 3 HA GLU 3 2.655 -6.221 -0.983 14 1HB GLU 3 HB2 GLU 3 4.155 -6.560 0.942 15 2HB GLU 3 HB1 GLU 3 3.085 -7.929 0.707 16 1HG GLU 3 HG2 GLU 3 5.972 -7.842 -0.163 17 2HG GLU 3 HG1 GLU 3 5.415 -8.511 1.361 18 H VAL 4 HN VAL 4 4.511 -4.682 -0.367 19 HA VAL 4 HA VAL 4 6.164 -4.298 -2.678 20 HB VAL 4 HB VAL 4 6.389 -2.985 -0.056 21 1HG1 VAL 4 HG11 VAL 4 8.288 -2.559 -1.490 22 2HG1 VAL 4 HG12 VAL 4 7.365 -1.068 -1.347 23 3HG1 VAL 4 HG13 VAL 4 7.227 -2.053 -2.806 24 1HG2 VAL 4 HG21 VAL 4 4.611 -2.153 -2.341 25 2HG2 VAL 4 HG22 VAL 4 4.933 -1.135 -0.942 26 3HG2 VAL 4 HG23 VAL 4 4.096 -2.672 -0.739 27 H HIS 5 HN HIS 5 7.636 -5.583 -2.852 28 HA HIS 5 HA HIS 5 9.490 -6.082 -0.662 29 1HB HIS 5 HB2 HIS 5 9.902 -8.398 -1.410 30 2HB HIS 5 HB1 HIS 5 8.247 -8.153 -0.893 31 HD1 HIS 5 HD1 HIS 5 6.478 -9.054 -2.484 32 HD2 HIS 5 HD2 HIS 5 10.168 -8.529 -4.346 33 HE1 HIS 5 HE1 HIS 5 6.236 -10.032 -4.747 34 HE2 HIS 5 HE2 HIS 5 8.549 -10.019 -5.684 35 H ASN 6 HN ASN 6 11.561 -5.971 -1.050 36 HA ASN 6 HA ASN 6 12.949 -5.841 -3.462 37 1HB ASN 6 HB2 ASN 6 11.515 -3.845 -3.944 38 2HB ASN 6 HB1 ASN 6 12.007 -3.141 -2.417 39 1HD2 ASN 6 HD21 ASN 6 12.976 -3.918 -5.645 40 2HD2 ASN 6 HD22 ASN 6 14.389 -2.930 -5.684 41 H GLN 7 HN GLN 7 12.266 -4.673 -0.331 42 HA GLN 7 HA GLN 7 14.903 -4.162 0.583 43 1HB GLN 7 HB2 GLN 7 13.667 -4.071 2.769 44 2HB GLN 7 HB1 GLN 7 13.020 -2.998 1.537 45 1HG GLN 7 HG2 GLN 7 11.391 -4.983 1.024 46 2HG GLN 7 HG1 GLN 7 11.959 -5.543 2.592 47 1HE2 GLN 7 HE21 GLN 7 10.237 -3.008 0.930 48 2HE2 GLN 7 HE22 GLN 7 9.405 -2.413 2.302 49 H LEU 8 HN LEU 8 15.142 -5.544 2.961 50 HA LEU 8 HA LEU 8 15.390 -8.225 1.862 51 1HB LEU 8 HB2 LEU 8 17.100 -6.828 3.864 52 2HB LEU 8 HB1 LEU 8 17.120 -8.555 3.696 53 HG LEU 8 HG LEU 8 17.790 -8.249 1.279 54 1HD1 LEU 8 HD11 LEU 8 18.756 -6.150 0.558 55 2HD1 LEU 8 HD12 LEU 8 18.252 -5.392 2.065 56 3HD1 LEU 8 HD13 LEU 8 17.035 -5.976 0.924 57 1HD2 LEU 8 HD21 LEU 8 19.424 -8.847 2.954 58 2HD2 LEU 8 HD22 LEU 8 19.666 -7.146 3.357 59 3HD2 LEU 8 HD23 LEU 8 20.133 -7.752 1.769 60 H GLU 9 HN GLU 9 14.819 -10.022 2.908 61 HA GLU 9 HA GLU 9 12.830 -9.544 4.944 62 1HB GLU 9 HB2 GLU 9 13.520 -12.074 3.451 63 2HB GLU 9 HB1 GLU 9 12.321 -11.954 4.699 64 1HG GLU 9 HG2 GLU 9 11.227 -11.974 2.569 65 2HG GLU 9 HG1 GLU 9 11.022 -10.391 3.295 66 H ILE 10 HN ILE 10 12.893 -10.231 6.895 67 HA ILE 10 HA ILE 10 15.283 -11.650 7.881 68 HB ILE 10 HB ILE 10 13.687 -9.482 9.312 69 1HG1 ILE 10 HG12 ILE 10 16.570 -9.485 8.364 70 2HG1 ILE 10 HG11 ILE 10 15.264 -8.600 7.594 71 1HG2 ILE 10 HG21 ILE 10 16.018 -11.069 10.335 72 2HG2 ILE 10 HG22 ILE 10 14.341 -11.163 10.884 73 3HG2 ILE 10 HG23 ILE 10 15.270 -9.684 11.135 74 1HD1 ILE 10 HD11 ILE 10 16.349 -8.142 10.368 75 2HD1 ILE 10 HD12 ILE 10 15.014 -7.250 9.636 76 3HD1 ILE 10 HD13 ILE 10 16.635 -7.131 8.952 77 H LYS 11 HN LYS 11 14.884 -13.303 9.175 78 HA LYS 11 HA LYS 11 12.131 -13.661 10.094 79 1HB LYS 11 HB2 LYS 11 12.296 -16.089 9.891 80 2HB LYS 11 HB1 LYS 11 12.556 -15.330 8.336 81 1HG LYS 11 HG2 LYS 11 14.949 -15.721 8.539 82 2HG LYS 11 HG1 LYS 11 14.700 -16.428 10.141 83 1HD LYS 11 HD2 LYS 11 13.263 -18.151 9.148 84 2HD LYS 11 HD1 LYS 11 13.539 -17.457 7.552 85 1HE LYS 11 HE2 LYS 11 15.929 -17.936 7.770 86 2HE LYS 11 HE1 LYS 11 15.639 -18.627 9.368 87 1HZ LYS 11 HZ1 LYS 11 14.242 -20.302 8.347 88 2HZ LYS 11 HZ2 LYS 11 15.765 -20.334 7.612 89 3HZ LYS 11 HZ3 LYS 11 14.471 -19.612 6.838 90 H PHE 12 HN PHE 12 11.894 -14.649 12.114 91 HA PHE 12 HA PHE 12 14.225 -14.150 13.813 92 1HB PHE 12 HB2 PHE 12 11.312 -14.396 14.567 93 2HB PHE 12 HB1 PHE 12 12.627 -13.964 15.648 94 HD1 PHE 12 HD1 PHE 12 13.824 -11.804 15.287 95 HD2 PHE 12 HD2 PHE 12 10.226 -12.790 13.250 96 HE1 PHE 12 HE1 PHE 12 13.472 -9.433 14.768 97 HE2 PHE 12 HE2 PHE 12 9.866 -10.417 12.721 98 HZ PHE 12 HZ PHE 12 11.493 -8.733 13.480 99 H ARG 13 HN ARG 13 15.289 -15.908 14.451 100 HA ARG 13 HA ARG 13 13.691 -18.318 14.779 101 1HB ARG 13 HB2 ARG 13 15.414 -18.704 13.133 102 2HB ARG 13 HB1 ARG 13 16.652 -18.091 14.226 103 1HG ARG 13 HG2 ARG 13 16.297 -19.949 15.734 104 2HG ARG 13 HG1 ARG 13 14.967 -20.531 14.747 105 1HD ARG 13 HD2 ARG 13 17.816 -20.288 13.803 106 2HD ARG 13 HD1 ARG 13 17.080 -21.773 14.413 107 HE ARG 13 HE ARG 13 15.549 -20.611 12.310 108 1HH1 ARG 13 HH11 ARG 13 18.375 -22.620 12.943 109 2HH1 ARG 13 HH12 ARG 13 18.308 -23.404 11.428 110 1HH2 ARG 13 HH21 ARG 13 15.409 -21.683 10.384 111 2HH2 ARG 13 HH22 ARG 13 16.565 -22.867 9.894 112 H LEU 14 HN LEU 14 13.385 -19.048 16.633 113 HA LEU 14 HA LEU 14 14.467 -17.739 18.936 114 1HB LEU 14 HB2 LEU 14 12.713 -20.190 18.737 115 2HB LEU 14 HB1 LEU 14 13.080 -19.340 20.213 116 HG LEU 14 HG LEU 14 10.909 -18.708 19.685 117 1HD1 LEU 14 HD11 LEU 14 10.942 -16.352 19.225 118 2HD1 LEU 14 HD12 LEU 14 12.565 -16.499 18.585 119 3HD1 LEU 14 HD13 LEU 14 12.277 -16.801 20.296 120 1HD2 LEU 14 HD21 LEU 14 10.736 -19.521 17.406 121 2HD2 LEU 14 HD22 LEU 14 11.732 -18.184 16.832 122 3HD2 LEU 14 HD23 LEU 14 10.139 -17.867 17.522 123 H THR 15 HN THR 15 15.562 -18.924 20.657 124 HA THR 15 HA THR 15 17.806 -20.339 19.738 125 HB THR 15 HB THR 15 17.678 -18.983 21.763 126 HG1 THR 15 HG1 THR 15 18.511 -21.699 22.283 127 1HG2 THR 15 HG21 THR 15 16.829 -19.976 23.882 128 2HG2 THR 15 HG22 THR 15 16.204 -21.334 22.946 129 3HG2 THR 15 HG23 THR 15 15.563 -19.716 22.682 130 H ASP 16 HN ASP 16 14.739 -21.341 20.496 131 HA ASP 16 HA ASP 16 15.265 -24.122 21.113 132 1HB ASP 16 HB2 ASP 16 12.687 -22.776 20.287 133 2HB ASP 16 HB1 ASP 16 12.819 -24.437 20.838 134 H GLY 17 HN GLY 17 15.344 -22.371 18.250 135 1HA GLY 17 HA2 GLY 17 16.008 -23.294 16.195 136 2HA GLY 17 HA1 GLY 17 15.417 -24.858 16.736 137 H SER 18 HN SER 18 13.234 -22.353 17.298 138 HA SER 18 HA SER 18 11.582 -23.281 15.088 139 1HB SER 18 HB2 SER 18 10.932 -21.496 17.443 140 2HB SER 18 HB1 SER 18 9.763 -22.207 16.321 141 HG SER 18 HG SER 18 10.208 -23.290 18.432 142 H ASP 19 HN ASP 19 10.696 -21.747 13.537 143 HA ASP 19 HA ASP 19 12.147 -19.203 13.459 144 1HB ASP 19 HB2 ASP 19 11.145 -20.932 11.196 145 2HB ASP 19 HB1 ASP 19 11.784 -19.316 11.011 146 H ILE 20 HN ILE 20 10.979 -17.450 12.932 147 HA ILE 20 HA ILE 20 8.065 -17.756 12.778 148 HB ILE 20 HB ILE 20 9.741 -15.282 13.397 149 1HG1 ILE 20 HG12 ILE 20 8.025 -16.980 15.237 150 2HG1 ILE 20 HG11 ILE 20 9.782 -16.926 15.229 151 1HG2 ILE 20 HG21 ILE 20 7.656 -14.687 12.277 152 2HG2 ILE 20 HG22 ILE 20 7.602 -14.192 13.966 153 3HG2 ILE 20 HG23 ILE 20 6.738 -15.636 13.445 154 1HD1 ILE 20 HD11 ILE 20 9.705 -14.581 15.939 155 2HD1 ILE 20 HD12 ILE 20 8.854 -15.633 17.068 156 3HD1 ILE 20 HD13 ILE 20 7.943 -14.645 15.929 157 H GLY 21 HN GLY 21 7.025 -17.032 10.969 158 1HA GLY 21 HA2 GLY 21 8.193 -17.166 8.524 159 2HA GLY 21 HA1 GLY 21 6.694 -16.311 8.818 160 HA PRO 22 HA PRO 22 10.726 -13.611 8.113 161 1HB PRO 22 HB2 PRO 22 10.964 -13.699 5.369 162 2HB PRO 22 HB1 PRO 22 11.956 -14.633 6.483 163 1HG PRO 22 HG2 PRO 22 9.545 -15.475 4.936 164 2HG PRO 22 HG1 PRO 22 11.023 -16.386 5.294 165 1HD PRO 22 HD2 PRO 22 8.729 -16.811 6.605 166 2HD PRO 22 HD1 PRO 22 10.305 -16.953 7.417 167 H LYS 23 HN LYS 23 10.552 -11.532 7.579 168 HA LYS 23 HA LYS 23 8.136 -10.616 6.182 169 1HB LYS 23 HB2 LYS 23 7.930 -10.520 8.699 170 2HB LYS 23 HB1 LYS 23 9.329 -9.471 8.728 171 1HG LYS 23 HG2 LYS 23 8.069 -7.794 7.437 172 2HG LYS 23 HG1 LYS 23 6.661 -8.856 7.470 173 1HD LYS 23 HD2 LYS 23 6.760 -8.810 9.965 174 2HD LYS 23 HD1 LYS 23 8.066 -7.638 9.843 175 1HE LYS 23 HE2 LYS 23 5.980 -6.483 10.260 176 2HE LYS 23 HE1 LYS 23 6.552 -6.110 8.634 177 1HZ LYS 23 HZ1 LYS 23 4.428 -8.090 9.299 178 2HZ LYS 23 HZ2 LYS 23 4.954 -7.718 7.755 179 3HZ LYS 23 HZ3 LYS 23 4.178 -6.549 8.677 180 H ALA 24 HN ALA 24 8.544 -8.383 5.324 181 HA ALA 24 HA ALA 24 11.300 -8.207 4.455 182 1HB ALA 24 HB1 ALA 24 10.433 -6.584 2.782 183 2HB ALA 24 HB2 ALA 24 8.885 -6.590 3.606 184 3HB ALA 24 HB3 ALA 24 9.459 -8.051 2.815 185 H PHE 25 HN PHE 25 12.771 -6.730 5.210 186 HA PHE 25 HA PHE 25 11.779 -4.474 6.800 187 1HB PHE 25 HB2 PHE 25 14.151 -6.219 7.447 188 2HB PHE 25 HB1 PHE 25 13.666 -4.778 8.309 189 HD1 PHE 25 HD1 PHE 25 12.740 -8.227 7.504 190 HD2 PHE 25 HD2 PHE 25 12.086 -4.922 10.066 191 HE1 PHE 25 HE1 PHE 25 11.527 -9.677 9.034 192 HE2 PHE 25 HE2 PHE 25 10.846 -6.384 11.620 193 HZ PHE 25 HZ PHE 25 10.607 -8.819 11.055 194 HA PRO 26 HA PRO 26 14.776 -2.418 4.100 195 1HB PRO 26 HB2 PRO 26 14.071 -0.294 6.056 196 2HB PRO 26 HB1 PRO 26 14.154 -0.133 4.316 197 1HG PRO 26 HG2 PRO 26 11.799 -0.245 5.485 198 2HG PRO 26 HG1 PRO 26 12.066 -1.249 4.042 199 1HD PRO 26 HD2 PRO 26 12.126 -2.059 6.930 200 2HD PRO 26 HD1 PRO 26 11.357 -2.866 5.540 201 H ASP 27 HN ASP 27 16.980 -1.789 4.622 202 HA ASP 27 HA ASP 27 18.129 -2.620 7.061 203 1HB ASP 27 HB2 ASP 27 19.223 -0.639 5.027 204 2HB ASP 27 HB1 ASP 27 20.161 -1.394 6.308 205 H ALA 28 HN ALA 28 16.558 0.257 6.106 206 HA ALA 28 HA ALA 28 17.577 1.949 8.194 207 1HB ALA 28 HB1 ALA 28 15.972 3.579 7.391 208 2HB ALA 28 HB2 ALA 28 15.203 2.355 6.383 209 3HB ALA 28 HB3 ALA 28 16.855 2.872 6.039 210 H THR 29 HN THR 29 15.585 -0.622 8.414 211 HA THR 29 HA THR 29 13.515 0.348 10.140 212 HB THR 29 HB THR 29 14.725 -2.439 10.000 213 HG1 THR 29 HG1 THR 29 13.947 -2.200 8.090 214 1HG2 THR 29 HG21 THR 29 12.553 -3.191 10.899 215 2HG2 THR 29 HG22 THR 29 12.025 -1.515 11.019 216 3HG2 THR 29 HG23 THR 29 13.359 -2.091 12.016 217 H THR 30 HN THR 30 13.506 0.418 12.452 218 HA THR 30 HA THR 30 16.150 0.496 13.589 219 HB THR 30 HB THR 30 15.086 1.518 15.511 220 HG1 THR 30 HG1 THR 30 12.624 1.822 14.227 221 1HG2 THR 30 HG21 THR 30 15.777 2.951 13.680 222 2HG2 THR 30 HG22 THR 30 14.279 3.583 14.376 223 3HG2 THR 30 HG23 THR 30 14.244 2.672 12.866 224 H VAL 31 HN VAL 31 16.520 -0.501 15.721 225 HA VAL 31 HA VAL 31 15.653 -3.204 15.774 226 HB VAL 31 HB VAL 31 17.117 -1.600 17.897 227 1HG1 VAL 31 HG11 VAL 31 17.789 -3.764 18.838 228 2HG1 VAL 31 HG12 VAL 31 16.821 -4.602 17.628 229 3HG1 VAL 31 HG13 VAL 31 16.033 -3.604 18.848 230 1HG2 VAL 31 HG21 VAL 31 19.126 -2.711 17.026 231 2HG2 VAL 31 HG22 VAL 31 18.333 -1.722 15.799 232 3HG2 VAL 31 HG23 VAL 31 18.145 -3.477 15.774 233 H SER 32 HN SER 32 14.548 -0.263 17.257 234 HA SER 32 HA SER 32 12.880 -1.379 19.204 235 1HB SER 32 HB2 SER 32 13.396 1.052 19.085 236 2HB SER 32 HB1 SER 32 12.479 1.163 17.588 237 HG SER 32 HG SER 32 11.167 0.013 19.718 238 H ALA 33 HN ALA 33 12.264 -0.480 15.804 239 HA ALA 33 HA ALA 33 9.604 -1.452 15.780 240 1HB ALA 33 HB1 ALA 33 11.475 -1.011 13.456 241 2HB ALA 33 HB2 ALA 33 10.456 0.217 14.204 242 3HB ALA 33 HB3 ALA 33 9.716 -1.156 13.384 243 H LEU 34 HN LEU 34 12.748 -2.989 15.267 244 HA LEU 34 HA LEU 34 11.923 -5.298 14.037 245 1HB LEU 34 HB2 LEU 34 14.201 -4.415 14.161 246 2HB LEU 34 HB1 LEU 34 14.157 -4.561 15.902 247 HG LEU 34 HG LEU 34 14.061 -6.860 15.750 248 1HD1 LEU 34 HD11 LEU 34 12.988 -7.162 13.524 249 2HD1 LEU 34 HD12 LEU 34 14.534 -8.016 13.511 250 3HD1 LEU 34 HD13 LEU 34 14.391 -6.439 12.738 251 1HD2 LEU 34 HD21 LEU 34 16.349 -5.652 14.224 252 2HD2 LEU 34 HD22 LEU 34 16.383 -7.264 14.932 253 3HD2 LEU 34 HD23 LEU 34 16.203 -5.848 15.969 254 H LYS 35 HN LYS 35 12.353 -4.313 17.433 255 HA LYS 35 HA LYS 35 11.455 -6.737 18.567 256 1HB LYS 35 HB2 LYS 35 11.749 -3.966 19.665 257 2HB LYS 35 HB1 LYS 35 11.113 -5.288 20.627 258 1HG LYS 35 HG2 LYS 35 13.814 -5.284 19.309 259 2HG LYS 35 HG1 LYS 35 13.549 -4.850 20.992 260 1HD LYS 35 HD2 LYS 35 12.488 -7.118 21.280 261 2HD LYS 35 HD1 LYS 35 13.097 -7.514 19.672 262 1HE LYS 35 HE2 LYS 35 14.639 -8.299 21.364 263 2HE LYS 35 HE1 LYS 35 15.374 -6.996 20.424 264 1HZ LYS 35 HZ1 LYS 35 14.153 -6.721 23.131 265 2HZ LYS 35 HZ2 LYS 35 14.861 -5.461 22.264 266 3HZ LYS 35 HZ3 LYS 35 15.790 -6.744 22.796 267 H GLU 36 HN GLU 36 9.786 -3.700 17.770 268 HA GLU 36 HA GLU 36 7.301 -4.269 18.875 269 1HB GLU 36 HB2 GLU 36 7.902 -2.854 16.269 270 2HB GLU 36 HB1 GLU 36 6.373 -2.802 17.125 271 1HG GLU 36 HG2 GLU 36 8.995 -1.725 18.124 272 2HG GLU 36 HG1 GLU 36 7.662 -0.783 17.465 273 H THR 37 HN THR 37 8.677 -5.159 15.776 274 HA THR 37 HA THR 37 6.486 -6.528 14.722 275 HB THR 37 HB THR 37 9.446 -6.977 14.237 276 HG1 THR 37 HG1 THR 37 9.005 -4.915 13.633 277 1HG2 THR 37 HG21 THR 37 7.051 -7.710 12.531 278 2HG2 THR 37 HG22 THR 37 8.062 -8.853 13.414 279 3HG2 THR 37 HG23 THR 37 8.742 -7.923 12.078 280 H VAL 38 HN VAL 38 9.146 -7.610 16.804 281 HA VAL 38 HA VAL 38 8.538 -10.354 16.845 282 HB VAL 38 HB VAL 38 9.850 -8.636 18.984 283 1HG1 VAL 38 HG11 VAL 38 10.736 -10.685 19.890 284 2HG1 VAL 38 HG12 VAL 38 9.822 -11.647 18.724 285 3HG1 VAL 38 HG13 VAL 38 8.977 -10.697 19.960 286 1HG2 VAL 38 HG21 VAL 38 11.069 -8.673 16.879 287 2HG2 VAL 38 HG22 VAL 38 11.029 -10.440 16.886 288 3HG2 VAL 38 HG23 VAL 38 11.937 -9.575 18.125 289 H ILE 39 HN ILE 39 7.632 -7.740 19.016 290 HA ILE 39 HA ILE 39 6.063 -9.177 20.857 291 HB ILE 39 HB ILE 39 5.628 -6.299 19.964 292 1HG1 ILE 39 HG12 ILE 39 7.363 -7.385 22.197 293 2HG1 ILE 39 HG11 ILE 39 7.950 -6.742 20.672 294 1HG2 ILE 39 HG21 ILE 39 3.751 -7.167 21.286 295 2HG2 ILE 39 HG22 ILE 39 4.670 -5.971 22.213 296 3HG2 ILE 39 HG23 ILE 39 4.873 -7.683 22.550 297 1HD1 ILE 39 HD11 ILE 39 8.171 -5.126 22.468 298 2HD1 ILE 39 HD12 ILE 39 6.432 -5.198 22.759 299 3HD1 ILE 39 HD13 ILE 39 7.046 -4.553 21.235 300 H SER 40 HN SER 40 5.283 -7.875 17.734 301 HA SER 40 HA SER 40 2.469 -8.252 17.927 302 1HB SER 40 HB2 SER 40 4.221 -7.824 15.516 303 2HB SER 40 HB1 SER 40 2.462 -7.638 15.562 304 HG SER 40 HG SER 40 4.460 -6.066 16.824 305 H GLU 41 HN GLU 41 5.171 -10.223 16.569 306 HA GLU 41 HA GLU 41 3.380 -12.091 15.397 307 1HB GLU 41 HB2 GLU 41 6.358 -12.053 15.751 308 2HB GLU 41 HB1 GLU 41 5.456 -13.245 14.843 309 1HG GLU 41 HG2 GLU 41 5.652 -10.307 14.235 310 2HG GLU 41 HG1 GLU 41 6.445 -11.608 13.353 311 H TRP 42 HN TRP 42 5.126 -11.735 18.390 312 HA TRP 42 HA TRP 42 5.076 -14.515 19.053 313 1HB TRP 42 HB2 TRP 42 6.787 -12.795 19.822 314 2HB TRP 42 HB1 TRP 42 5.549 -12.151 20.881 315 HD1 TRP 42 HD1 TRP 42 5.386 -13.285 23.275 316 HE1 TRP 42 HE1 TRP 42 6.525 -15.227 24.380 317 HE3 TRP 42 HE3 TRP 42 7.633 -15.290 19.154 318 HZ2 TRP 42 HZ2 TRP 42 8.159 -17.462 23.610 319 HZ3 TRP 42 HZ3 TRP 42 8.950 -17.354 19.426 320 HH2 TRP 42 HH2 TRP 42 9.205 -18.408 21.611 321 HA PRO 43 HA PRO 43 0.768 -14.612 20.263 322 1HB PRO 43 HB2 PRO 43 1.857 -16.723 22.073 323 2HB PRO 43 HB1 PRO 43 0.436 -16.777 21.024 324 1HG PRO 43 HG2 PRO 43 2.632 -18.004 20.261 325 2HG PRO 43 HG1 PRO 43 1.722 -17.031 19.091 326 1HD PRO 43 HD2 PRO 43 4.265 -16.353 20.524 327 2HD PRO 43 HD1 PRO 43 3.780 -16.031 18.843 328 H ARG 44 HN ARG 44 -0.230 -13.380 21.660 329 HA ARG 44 HA ARG 44 0.987 -12.280 24.002 330 1HB ARG 44 HB2 ARG 44 -0.620 -11.019 22.650 331 2HB ARG 44 HB1 ARG 44 -1.851 -12.227 22.952 332 1HG ARG 44 HG2 ARG 44 -1.915 -11.617 25.296 333 2HG ARG 44 HG1 ARG 44 -0.611 -10.455 25.046 334 1HD ARG 44 HD2 ARG 44 -2.006 -9.183 23.517 335 2HD ARG 44 HD1 ARG 44 -3.293 -10.377 23.675 336 HE ARG 44 HE ARG 44 -3.022 -9.694 26.172 337 1HH1 ARG 44 HH11 ARG 44 -3.033 -7.536 23.319 338 2HH1 ARG 44 HH12 ARG 44 -3.762 -6.244 24.137 339 1HH2 ARG 44 HH21 ARG 44 -4.063 -7.870 27.276 340 2HH2 ARG 44 HH22 ARG 44 -4.365 -6.437 26.406 341 H GLU 45 HN GLU 45 -0.966 -14.925 23.226 342 HA GLU 45 HA GLU 45 -1.908 -15.598 25.875 343 1HB GLU 45 HB2 GLU 45 -2.865 -17.527 24.739 344 2HB GLU 45 HB1 GLU 45 -3.241 -16.033 23.883 345 1HG GLU 45 HG2 GLU 45 -1.316 -16.521 22.356 346 2HG GLU 45 HG1 GLU 45 -1.167 -18.071 23.158 347 H LYS 46 HN LYS 46 1.113 -15.734 24.624 348 HA LYS 46 HA LYS 46 2.046 -18.268 24.531 349 1HB LYS 46 HB2 LYS 46 4.188 -17.238 24.468 350 2HB LYS 46 HB1 LYS 46 3.098 -15.985 24.047 351 1HG LYS 46 HG2 LYS 46 4.170 -16.303 26.831 352 2HG LYS 46 HG1 LYS 46 4.869 -15.264 25.600 353 1HD LYS 46 HD2 LYS 46 2.783 -13.976 25.518 354 2HD LYS 46 HD1 LYS 46 2.078 -15.045 26.737 355 1HE LYS 46 HE2 LYS 46 4.554 -13.394 27.117 356 2HE LYS 46 HE1 LYS 46 2.946 -12.915 27.689 357 1HZ LYS 46 HZ1 LYS 46 2.976 -14.902 29.105 358 2HZ LYS 46 HZ2 LYS 46 4.257 -13.905 29.460 359 3HZ LYS 46 HZ3 LYS 46 4.516 -15.301 28.569 360 H GLU 47 HN GLU 47 3.480 -19.388 25.997 361 HA GLU 47 HA GLU 47 2.471 -19.901 28.579 362 1HB GLU 47 HB2 GLU 47 5.082 -20.705 27.262 363 2HB GLU 47 HB1 GLU 47 4.448 -21.390 28.740 364 1HG GLU 47 HG2 GLU 47 4.137 -22.917 26.904 365 2HG GLU 47 HG1 GLU 47 2.572 -22.355 27.458 366 H ASN 48 HN ASN 48 4.718 -20.221 30.025 367 HA ASN 48 HA ASN 48 5.412 -17.667 30.855 368 1HB ASN 48 HB2 ASN 48 6.502 -20.347 31.735 369 2HB ASN 48 HB1 ASN 48 7.135 -18.830 32.353 370 1HD2 ASN 48 HD21 ASN 48 4.370 -21.023 32.350 371 2HD2 ASN 48 HD22 ASN 48 3.602 -20.260 33.675 372 H GLY 49 HN GLY 49 6.013 -17.146 28.837 373 1HA GLY 49 HA2 GLY 49 8.914 -17.337 28.353 374 2HA GLY 49 HA1 GLY 49 7.786 -17.557 27.021 375 HA PRO 50 HA PRO 50 9.199 -13.022 27.325 376 1HB PRO 50 HB2 PRO 50 9.272 -13.627 24.423 377 2HB PRO 50 HB1 PRO 50 10.380 -12.672 25.405 378 1HG PRO 50 HG2 PRO 50 11.115 -15.073 24.649 379 2HG PRO 50 HG1 PRO 50 11.379 -14.590 26.337 380 1HD PRO 50 HD2 PRO 50 9.201 -16.303 25.190 381 2HD PRO 50 HD1 PRO 50 10.180 -16.563 26.649 382 H LYS 51 HN LYS 51 8.402 -11.190 25.805 383 HA LYS 51 HA LYS 51 5.965 -11.504 24.389 384 1HB LYS 51 HB2 LYS 51 5.061 -11.624 26.701 385 2HB LYS 51 HB1 LYS 51 5.808 -10.077 27.052 386 1HG LYS 51 HG2 LYS 51 4.422 -9.046 25.280 387 2HG LYS 51 HG1 LYS 51 3.614 -10.597 25.061 388 1HD LYS 51 HD2 LYS 51 2.850 -10.531 27.380 389 2HD LYS 51 HD1 LYS 51 3.676 -8.990 27.612 390 1HE LYS 51 HE2 LYS 51 2.273 -8.010 25.826 391 2HE LYS 51 HE1 LYS 51 1.415 -9.543 25.703 392 1HZ LYS 51 HZ1 LYS 51 1.537 -7.830 28.111 393 2HZ LYS 51 HZ2 LYS 51 0.705 -9.284 27.995 394 3HZ LYS 51 HZ3 LYS 51 0.229 -7.953 27.065 395 H THR 52 HN THR 52 7.381 -8.948 26.472 396 HA THR 52 HA THR 52 7.055 -7.119 24.305 397 HB THR 52 HB THR 52 7.547 -5.439 26.123 398 HG1 THR 52 HG1 THR 52 7.862 -6.193 28.115 399 1HG2 THR 52 HG21 THR 52 5.193 -7.308 26.462 400 2HG2 THR 52 HG22 THR 52 5.271 -5.943 25.346 401 3HG2 THR 52 HG23 THR 52 5.299 -5.664 27.090 402 H VAL 53 HN VAL 53 8.689 -5.260 24.388 403 HA VAL 53 HA VAL 53 10.889 -6.054 22.994 404 HB VAL 53 HB VAL 53 10.047 -3.816 22.766 405 1HG1 VAL 53 HG11 VAL 53 9.310 -3.390 25.012 406 2HG1 VAL 53 HG12 VAL 53 10.376 -2.089 24.466 407 3HG1 VAL 53 HG13 VAL 53 10.978 -3.318 25.578 408 1HG2 VAL 53 HG21 VAL 53 12.123 -2.478 22.908 409 2HG2 VAL 53 HG22 VAL 53 12.342 -4.058 22.174 410 3HG2 VAL 53 HG23 VAL 53 12.860 -3.787 23.842 411 H LYS 54 HN LYS 54 10.927 -5.155 26.460 412 HA LYS 54 HA LYS 54 13.769 -5.512 26.538 413 1HB LYS 54 HB2 LYS 54 12.516 -3.829 27.922 414 2HB LYS 54 HB1 LYS 54 11.888 -5.166 28.871 415 1HG LYS 54 HG2 LYS 54 13.749 -4.134 30.030 416 2HG LYS 54 HG1 LYS 54 14.194 -5.764 29.510 417 1HD LYS 54 HD2 LYS 54 15.417 -4.860 27.611 418 2HD LYS 54 HD1 LYS 54 14.897 -3.226 28.032 419 1HE LYS 54 HE2 LYS 54 16.114 -3.409 30.156 420 2HE LYS 54 HE1 LYS 54 16.640 -5.030 29.713 421 1HZ LYS 54 HZ1 LYS 54 18.327 -3.353 29.299 422 2HZ LYS 54 HZ2 LYS 54 17.337 -2.545 28.208 423 3HZ LYS 54 HZ3 LYS 54 17.895 -4.101 27.868 424 H GLU 55 HN GLU 55 11.036 -7.521 26.985 425 HA GLU 55 HA GLU 55 12.318 -9.437 28.702 426 1HB GLU 55 HB2 GLU 55 9.846 -9.822 26.999 427 2HB GLU 55 HB1 GLU 55 10.338 -10.795 28.376 428 1HG GLU 55 HG2 GLU 55 9.445 -7.915 28.453 429 2HG GLU 55 HG1 GLU 55 8.505 -9.311 28.959 430 H VAL 56 HN VAL 56 11.914 -8.921 25.315 431 HA VAL 56 HA VAL 56 13.043 -11.523 24.616 432 HB VAL 56 HB VAL 56 12.106 -9.261 22.831 433 1HG1 VAL 56 HG11 VAL 56 12.182 -10.925 21.027 434 2HG1 VAL 56 HG12 VAL 56 12.801 -12.111 22.167 435 3HG1 VAL 56 HG13 VAL 56 13.763 -10.693 21.769 436 1HG2 VAL 56 HG21 VAL 56 10.121 -10.632 22.405 437 2HG2 VAL 56 HG22 VAL 56 10.254 -10.235 24.121 438 3HG2 VAL 56 HG23 VAL 56 10.712 -11.839 23.543 439 H LYS 57 HN LYS 57 15.185 -11.749 24.154 440 HA LYS 57 HA LYS 57 16.717 -9.320 23.687 441 1HB LYS 57 HB2 LYS 57 17.497 -12.028 24.758 442 2HB LYS 57 HB1 LYS 57 18.706 -10.900 24.163 443 1HG LYS 57 HG2 LYS 57 18.558 -10.817 26.593 444 2HG LYS 57 HG1 LYS 57 18.012 -9.293 25.905 445 1HD LYS 57 HD2 LYS 57 15.678 -9.994 26.235 446 2HD LYS 57 HD1 LYS 57 16.236 -11.524 26.908 447 1HE LYS 57 HE2 LYS 57 17.335 -10.339 28.737 448 2HE LYS 57 HE1 LYS 57 16.843 -8.799 28.042 449 1HZ LYS 57 HZ1 LYS 57 14.931 -10.883 28.977 450 2HZ LYS 57 HZ2 LYS 57 14.579 -9.288 28.486 451 3HZ LYS 57 HZ3 LYS 57 15.448 -9.564 29.878 452 H LEU 58 HN LEU 58 17.496 -8.954 21.715 453 HA LEU 58 HA LEU 58 17.227 -11.129 19.755 454 1HB LEU 58 HB2 LEU 58 15.707 -9.088 19.572 455 2HB LEU 58 HB1 LEU 58 17.134 -8.131 19.281 456 HG LEU 58 HG LEU 58 15.892 -8.528 17.212 457 1HD1 LEU 58 HD11 LEU 58 17.619 -9.413 15.783 458 2HD1 LEU 58 HD12 LEU 58 18.433 -10.117 17.179 459 3HD1 LEU 58 HD13 LEU 58 18.318 -8.366 17.025 460 1HD2 LEU 58 HD21 LEU 58 15.638 -10.761 16.279 461 2HD2 LEU 58 HD22 LEU 58 14.798 -10.601 17.820 462 3HD2 LEU 58 HD23 LEU 58 16.339 -11.460 17.739 463 H ILE 59 HN ILE 59 19.107 -11.846 18.995 464 HA ILE 59 HA ILE 59 21.481 -10.096 19.049 465 HB ILE 59 HB ILE 59 21.273 -13.104 19.386 466 1HG1 ILE 59 HG12 ILE 59 22.229 -10.921 21.253 467 2HG1 ILE 59 HG11 ILE 59 20.761 -11.876 21.423 468 1HG2 ILE 59 HG21 ILE 59 23.753 -11.399 19.185 469 2HG2 ILE 59 HG22 ILE 59 23.197 -12.577 17.994 470 3HG2 ILE 59 HG23 ILE 59 23.714 -13.114 19.591 471 1HD1 ILE 59 HD11 ILE 59 23.587 -12.900 21.594 472 2HD1 ILE 59 HD12 ILE 59 22.133 -13.881 21.748 473 3HD1 ILE 59 HD13 ILE 59 22.488 -12.635 22.949 474 H SER 60 HN SER 60 22.370 -9.619 17.280 475 HA SER 60 HA SER 60 21.776 -11.220 14.912 476 1HB SER 60 HB2 SER 60 20.574 -9.049 14.849 477 2HB SER 60 HB1 SER 60 22.109 -8.213 15.068 478 HG SER 60 HG SER 60 21.773 -10.009 12.942 479 H ALA 61 HN ALA 61 23.582 -12.131 14.176 480 HA ALA 61 HA ALA 61 25.721 -12.554 13.602 481 1HB ALA 61 HB1 ALA 61 27.182 -10.696 12.961 482 2HB ALA 61 HB2 ALA 61 26.123 -9.557 13.789 483 3HB ALA 61 HB3 ALA 61 25.543 -10.422 12.367 484 H GLY 62 HN GLY 62 24.899 -12.262 16.427 485 1HA GLY 62 HA2 GLY 62 26.087 -13.067 18.314 486 2HA GLY 62 HA1 GLY 62 27.582 -12.539 17.567 487 H LYS 63 HN LYS 63 25.171 -10.047 17.426 488 HA LYS 63 HA LYS 63 26.326 -8.798 19.745 489 1HB LYS 63 HB2 LYS 63 25.409 -7.772 17.086 490 2HB LYS 63 HB1 LYS 63 25.581 -6.738 18.474 491 1HG LYS 63 HG2 LYS 63 27.523 -6.489 17.049 492 2HG LYS 63 HG1 LYS 63 28.035 -7.332 18.500 493 1HD LYS 63 HD2 LYS 63 27.883 -9.468 17.250 494 2HD LYS 63 HD1 LYS 63 27.432 -8.560 15.808 495 1HE LYS 63 HE2 LYS 63 29.807 -9.118 15.775 496 2HE LYS 63 HE1 LYS 63 29.575 -7.374 15.889 497 1HZ LYS 63 HZ1 LYS 63 30.205 -9.184 18.151 498 2HZ LYS 63 HZ2 LYS 63 30.030 -7.520 18.280 499 3HZ LYS 63 HZ3 LYS 63 31.302 -8.164 17.393 500 H VAL 64 HN VAL 64 24.841 -8.282 21.275 501 HA VAL 64 HA VAL 64 22.066 -8.704 20.705 502 HB VAL 64 HB VAL 64 22.918 -9.312 22.933 503 1HG1 VAL 64 HG11 VAL 64 23.423 -6.373 23.364 504 2HG1 VAL 64 HG12 VAL 64 24.643 -7.640 23.248 505 3HG1 VAL 64 HG13 VAL 64 23.522 -7.615 24.609 506 1HG2 VAL 64 HG21 VAL 64 20.911 -7.065 23.051 507 2HG2 VAL 64 HG22 VAL 64 21.175 -8.259 24.324 508 3HG2 VAL 64 HG23 VAL 64 20.569 -8.766 22.746 509 H LEU 65 HN LEU 65 20.642 -7.255 20.076 510 HA LEU 65 HA LEU 65 21.738 -4.719 19.333 511 1HB LEU 65 HB2 LEU 65 19.014 -5.859 18.819 512 2HB LEU 65 HB1 LEU 65 19.717 -4.437 18.083 513 HG LEU 65 HG LEU 65 20.508 -7.305 17.656 514 1HD1 LEU 65 HD11 LEU 65 18.570 -6.524 16.393 515 2HD1 LEU 65 HD12 LEU 65 19.945 -6.859 15.345 516 3HD1 LEU 65 HD13 LEU 65 19.534 -5.199 15.748 517 1HD2 LEU 65 HD21 LEU 65 21.895 -4.826 16.651 518 2HD2 LEU 65 HD22 LEU 65 22.239 -6.467 16.124 519 3HD2 LEU 65 HD23 LEU 65 22.550 -5.996 17.795 520 H GLU 66 HN GLU 66 20.905 -2.732 19.810 521 HA GLU 66 HA GLU 66 19.416 -2.511 22.339 522 1HB GLU 66 HB2 GLU 66 21.847 -1.587 21.981 523 2HB GLU 66 HB1 GLU 66 21.092 -0.402 20.937 524 1HG GLU 66 HG2 GLU 66 20.616 -0.750 23.897 525 2HG GLU 66 HG1 GLU 66 21.561 0.514 23.133 526 H ASN 67 HN ASN 67 17.559 -1.076 22.248 527 HA ASN 67 HA ASN 67 16.256 -1.325 19.747 528 1HB ASN 67 HB2 ASN 67 14.223 -0.501 20.679 529 2HB ASN 67 HB1 ASN 67 14.982 -1.523 21.872 530 1HD2 ASN 67 HD21 ASN 67 16.841 0.686 22.879 531 2HD2 ASN 67 HD22 ASN 67 15.760 1.739 23.678 532 H SER 68 HN SER 68 18.123 1.344 20.907 533 HA SER 68 HA SER 68 16.740 3.176 19.150 534 1HB SER 68 HB2 SER 68 19.282 3.621 20.724 535 2HB SER 68 HB1 SER 68 18.242 4.856 20.009 536 HG SER 68 HG SER 68 17.829 3.176 22.181 537 H LYS 69 HN LYS 69 18.845 0.744 18.599 538 HA LYS 69 HA LYS 69 20.495 2.096 16.672 539 1HB LYS 69 HB2 LYS 69 20.264 -0.725 17.613 540 2HB LYS 69 HB1 LYS 69 21.133 -0.334 16.156 541 1HG LYS 69 HG2 LYS 69 21.763 0.856 18.843 542 2HG LYS 69 HG1 LYS 69 22.591 -0.553 18.179 543 1HD LYS 69 HD2 LYS 69 23.192 0.822 16.184 544 2HD LYS 69 HD1 LYS 69 22.491 2.220 16.990 545 1HE LYS 69 HE2 LYS 69 24.114 2.028 18.774 546 2HE LYS 69 HE1 LYS 69 24.781 0.568 18.036 547 1HZ LYS 69 HZ1 LYS 69 26.118 2.485 17.470 548 2HZ LYS 69 HZ2 LYS 69 24.789 3.291 16.873 549 3HZ LYS 69 HZ3 LYS 69 25.352 1.913 16.075 550 H THR 70 HN THR 70 20.611 1.288 14.529 551 HA THR 70 HA THR 70 17.953 0.700 13.463 552 HB THR 70 HB THR 70 20.295 1.541 11.815 553 HG1 THR 70 HG1 THR 70 18.813 3.035 13.703 554 1HG2 THR 70 HG21 THR 70 17.346 2.090 11.700 555 2HG2 THR 70 HG22 THR 70 18.224 0.928 10.702 556 3HG2 THR 70 HG23 THR 70 18.509 2.664 10.503 557 H VAL 71 HN VAL 71 18.020 -0.905 11.596 558 HA VAL 71 HA VAL 71 19.557 -3.171 12.377 559 HB VAL 71 HB VAL 71 17.952 -2.752 9.814 560 1HG1 VAL 71 HG11 VAL 71 19.597 -4.550 9.595 561 2HG1 VAL 71 HG12 VAL 71 17.952 -5.186 9.605 562 3HG1 VAL 71 HG13 VAL 71 18.961 -5.320 11.048 563 1HG2 VAL 71 HG21 VAL 71 17.205 -4.126 12.396 564 2HG2 VAL 71 HG22 VAL 71 16.215 -4.070 10.938 565 3HG2 VAL 71 HG23 VAL 71 16.576 -2.583 11.819 566 H LYS 72 HN LYS 72 19.847 -0.763 9.891 567 HA LYS 72 HA LYS 72 21.849 -1.716 8.273 568 1HB LYS 72 HB2 LYS 72 20.586 0.370 7.876 569 2HB LYS 72 HB1 LYS 72 21.482 1.135 9.180 570 1HG LYS 72 HG2 LYS 72 23.566 0.851 7.924 571 2HG LYS 72 HG1 LYS 72 22.674 0.074 6.620 572 1HD LYS 72 HD2 LYS 72 23.121 2.396 6.065 573 2HD LYS 72 HD1 LYS 72 21.391 2.151 6.285 574 1HE LYS 72 HE2 LYS 72 21.508 3.091 8.511 575 2HE LYS 72 HE1 LYS 72 23.257 3.269 8.384 576 1HZ LYS 72 HZ1 LYS 72 22.153 5.352 7.989 577 2HZ LYS 72 HZ2 LYS 72 21.200 4.708 6.779 578 3HZ LYS 72 HZ3 LYS 72 22.861 4.861 6.546 579 H ASP 73 HN ASP 73 22.184 -0.371 11.512 580 HA ASP 73 HA ASP 73 24.923 0.272 11.513 581 1HB ASP 73 HB2 ASP 73 23.327 0.876 13.322 582 2HB ASP 73 HB1 ASP 73 23.287 -0.805 13.823 583 H TYR 74 HN TYR 74 23.261 -2.787 12.122 584 HA TYR 74 HA TYR 74 25.822 -4.113 12.478 585 1HB TYR 74 HB2 TYR 74 23.009 -4.963 13.153 586 2HB TYR 74 HB1 TYR 74 24.449 -5.938 13.402 587 HD1 TYR 74 HD1 TYR 74 26.025 -5.400 15.183 588 HD2 TYR 74 HD2 TYR 74 22.549 -3.026 14.573 589 HE1 TYR 74 HE1 TYR 74 26.354 -4.360 17.385 590 HE2 TYR 74 HE2 TYR 74 22.869 -1.979 16.770 591 HH TYR 74 HH TYR 74 23.974 -2.486 18.915 592 H ARG 75 HN ARG 75 23.953 -3.322 10.017 593 HA ARG 75 HA ARG 75 24.016 -5.884 8.645 594 1HB ARG 75 HB2 ARG 75 22.350 -3.580 8.706 595 2HB ARG 75 HB1 ARG 75 22.758 -4.028 7.057 596 1HG ARG 75 HG2 ARG 75 21.614 -5.954 9.077 597 2HG ARG 75 HG1 ARG 75 20.635 -4.963 7.985 598 1HD ARG 75 HD2 ARG 75 22.769 -6.896 7.095 599 2HD ARG 75 HD1 ARG 75 21.033 -7.237 7.087 600 HE ARG 75 HE ARG 75 21.188 -4.924 5.681 601 1HH1 ARG 75 HH11 ARG 75 22.810 -8.037 5.259 602 2HH1 ARG 75 HH12 ARG 75 23.028 -7.840 3.594 603 1HH2 ARG 75 HH21 ARG 75 21.448 -4.641 3.536 604 2HH2 ARG 75 HH22 ARG 75 22.190 -5.794 2.511 605 H SER 76 HN SER 76 25.851 -6.108 7.666 606 HA SER 76 HA SER 76 26.900 -3.872 6.111 607 1HB SER 76 HB2 SER 76 28.523 -5.094 7.579 608 2HB SER 76 HB1 SER 76 28.142 -6.578 6.707 609 HG SER 76 HG SER 76 29.123 -4.269 5.375 610 HA PRO 77 HA PRO 77 24.856 -6.182 2.880 611 1HB PRO 77 HB2 PRO 77 24.861 -4.278 1.013 612 2HB PRO 77 HB1 PRO 77 23.816 -4.226 2.433 613 1HG PRO 77 HG2 PRO 77 26.221 -2.615 1.810 614 2HG PRO 77 HG1 PRO 77 24.860 -2.231 2.874 615 1HD PRO 77 HD2 PRO 77 27.440 -3.232 3.612 616 2HD PRO 77 HD1 PRO 77 26.046 -2.890 4.660 617 H VAL 78 HN VAL 78 25.524 -7.524 1.353 618 HA VAL 78 HA VAL 78 28.216 -7.401 0.346 619 HB VAL 78 HB VAL 78 27.095 -9.603 0.775 620 1HG1 VAL 78 HG11 VAL 78 25.394 -8.947 -1.617 621 2HG1 VAL 78 HG12 VAL 78 24.843 -9.093 0.047 622 3HG1 VAL 78 HG13 VAL 78 25.460 -10.512 -0.806 623 1HG2 VAL 78 HG21 VAL 78 27.843 -10.761 -1.268 624 2HG2 VAL 78 HG22 VAL 78 29.012 -9.563 -0.710 625 3HG2 VAL 78 HG23 VAL 78 27.973 -9.202 -2.085 626 H SER 79 HN SER 79 25.165 -6.518 -0.566 627 HA SER 79 HA SER 79 26.001 -4.829 -2.702 628 1HB SER 79 HB2 SER 79 25.550 -7.018 -3.874 629 2HB SER 79 HB1 SER 79 23.944 -7.041 -3.141 630 HG SER 79 HG SER 79 23.281 -5.734 -4.602 631 H ASN 80 HN ASN 80 23.960 -3.470 -3.215 632 HA ASN 80 HA ASN 80 22.865 -2.618 -0.767 633 1HB ASN 80 HB2 ASN 80 21.931 -1.975 -3.570 634 2HB ASN 80 HB1 ASN 80 21.307 -1.201 -2.127 635 1HD2 ASN 80 HD21 ASN 80 21.965 0.819 -2.688 636 2HD2 ASN 80 HD22 ASN 80 23.621 1.296 -2.762 637 H LEU 81 HN LEU 81 21.109 -4.226 -3.472 638 HA LEU 81 HA LEU 81 19.193 -5.083 -1.577 639 1HB LEU 81 HB2 LEU 81 19.416 -5.170 -4.511 640 2HB LEU 81 HB1 LEU 81 18.065 -5.646 -3.555 641 HG LEU 81 HG LEU 81 19.067 -2.806 -3.845 642 1HD1 LEU 81 HD11 LEU 81 17.930 -3.589 -5.833 643 2HD1 LEU 81 HD12 LEU 81 16.959 -2.378 -4.993 644 3HD1 LEU 81 HD13 LEU 81 16.545 -4.090 -4.863 645 1HD2 LEU 81 HD21 LEU 81 16.688 -3.860 -2.301 646 2HD2 LEU 81 HD22 LEU 81 17.075 -2.159 -2.556 647 3HD2 LEU 81 HD23 LEU 81 18.159 -3.173 -1.608 648 H ALA 82 HN ALA 82 18.553 -7.394 -2.027 649 HA ALA 82 HA ALA 82 20.150 -9.231 -3.286 650 1HB ALA 82 HB1 ALA 82 21.882 -8.641 -1.638 651 2HB ALA 82 HB2 ALA 82 21.292 -10.282 -1.371 652 3HB ALA 82 HB3 ALA 82 20.750 -8.973 -0.326 653 H GLY 83 HN GLY 83 18.865 -10.882 -3.470 654 1HA GLY 83 HA2 GLY 83 16.463 -11.180 -1.916 655 2HA GLY 83 HA1 GLY 83 17.014 -12.261 -3.193 656 H ALA 84 HN ALA 84 18.260 -11.228 -0.126 657 HA ALA 84 HA ALA 84 18.802 -14.029 0.604 658 1HB ALA 84 HB1 ALA 84 20.538 -13.126 2.100 659 2HB ALA 84 HB2 ALA 84 20.139 -11.495 1.565 660 3HB ALA 84 HB3 ALA 84 20.816 -12.652 0.424 661 H VAL 85 HN VAL 85 18.334 -14.638 2.781 662 HA VAL 85 HA VAL 85 16.466 -12.835 4.142 663 HB VAL 85 HB VAL 85 16.664 -15.851 4.391 664 1HG1 VAL 85 HG11 VAL 85 14.625 -13.936 5.523 665 2HG1 VAL 85 HG12 VAL 85 15.854 -14.813 6.429 666 3HG1 VAL 85 HG13 VAL 85 14.548 -15.696 5.637 667 1HG2 VAL 85 HG21 VAL 85 15.783 -15.262 2.197 668 2HG2 VAL 85 HG22 VAL 85 14.592 -14.199 2.941 669 3HG2 VAL 85 HG23 VAL 85 14.501 -15.941 3.201 670 H THR 86 HN THR 86 17.027 -12.237 6.129 671 HA THR 86 HA THR 86 19.548 -13.324 7.135 672 HB THR 86 HB THR 86 18.187 -10.714 7.910 673 HG1 THR 86 HG1 THR 86 19.255 -11.232 5.686 674 1HG2 THR 86 HG21 THR 86 19.712 -11.627 9.632 675 2HG2 THR 86 HG22 THR 86 20.371 -10.166 8.897 676 3HG2 THR 86 HG23 THR 86 20.988 -11.745 8.422 677 H THR 87 HN THR 87 19.569 -14.426 9.033 678 HA THR 87 HA THR 87 16.986 -14.688 10.380 679 HB THR 87 HB THR 87 19.399 -16.511 10.545 680 HG1 THR 87 HG1 THR 87 18.286 -16.413 8.465 681 1HG2 THR 87 HG21 THR 87 17.798 -18.098 11.553 682 2HG2 THR 87 HG22 THR 87 16.539 -16.870 11.474 683 3HG2 THR 87 HG23 THR 87 17.949 -16.627 12.509 684 H MET 88 HN MET 88 16.802 -13.585 12.197 685 HA MET 88 HA MET 88 19.184 -12.945 13.744 686 1HB MET 88 HB2 MET 88 16.407 -11.806 13.706 687 2HB MET 88 HB1 MET 88 17.402 -11.617 15.136 688 1HG MET 88 HG2 MET 88 17.489 -9.654 13.679 689 2HG MET 88 HG1 MET 88 19.064 -10.406 13.867 690 1HE MET 88 HE1 MET 88 18.331 -8.199 11.717 691 2HE MET 88 HE2 MET 88 19.136 -8.842 10.287 692 3HE MET 88 HE3 MET 88 19.936 -8.915 11.860 693 H HIS 89 HN HIS 89 19.418 -13.503 15.871 694 HA HIS 89 HA HIS 89 17.923 -15.928 16.498 695 1HB HIS 89 HB2 HIS 89 20.589 -14.957 17.547 696 2HB HIS 89 HB1 HIS 89 19.806 -16.459 18.018 697 HD1 HIS 89 HD1 HIS 89 20.087 -18.451 16.457 698 HD2 HIS 89 HD2 HIS 89 21.574 -14.921 14.868 699 HE1 HIS 89 HE1 HIS 89 21.308 -19.113 14.365 700 HE2 HIS 89 HE2 HIS 89 22.444 -16.999 13.634 701 H VAL 90 HN VAL 90 16.526 -15.927 18.025 702 HA VAL 90 HA VAL 90 16.421 -13.653 19.898 703 HB VAL 90 HB VAL 90 14.314 -15.729 19.293 704 1HG1 VAL 90 HG11 VAL 90 14.083 -14.725 21.487 705 2HG1 VAL 90 HG12 VAL 90 12.788 -14.171 20.421 706 3HG1 VAL 90 HG13 VAL 90 14.157 -13.115 20.772 707 1HG2 VAL 90 HG21 VAL 90 14.531 -12.915 18.229 708 2HG2 VAL 90 HG22 VAL 90 13.151 -13.988 17.997 709 3HG2 VAL 90 HG23 VAL 90 14.717 -14.399 17.297 710 H ILE 91 HN ILE 91 16.867 -13.811 21.781 711 HA ILE 91 HA ILE 91 17.563 -16.394 22.944 712 HB ILE 91 HB ILE 91 18.110 -13.553 23.605 713 1HG1 ILE 91 HG12 ILE 91 19.412 -14.258 21.750 714 2HG1 ILE 91 HG11 ILE 91 20.484 -14.123 23.140 715 1HG2 ILE 91 HG21 ILE 91 19.646 -14.398 25.428 716 2HG2 ILE 91 HG22 ILE 91 19.107 -16.038 25.071 717 3HG2 ILE 91 HG23 ILE 91 17.966 -14.861 25.716 718 1HD1 ILE 91 HD11 ILE 91 19.371 -16.688 22.000 719 2HD1 ILE 91 HD12 ILE 91 20.409 -16.550 23.415 720 3HD1 ILE 91 HD13 ILE 91 21.017 -16.075 21.827 721 H ILE 92 HN ILE 92 16.285 -17.283 24.252 722 HA ILE 92 HA ILE 92 13.900 -15.879 25.003 723 HB ILE 92 HB ILE 92 14.642 -18.794 25.215 724 1HG1 ILE 92 HG12 ILE 92 14.288 -18.017 22.910 725 2HG1 ILE 92 HG11 ILE 92 13.019 -19.127 23.411 726 1HG2 ILE 92 HG21 ILE 92 12.028 -17.441 25.828 727 2HG2 ILE 92 HG22 ILE 92 13.119 -18.193 26.996 728 3HG2 ILE 92 HG23 ILE 92 12.291 -19.190 25.789 729 1HD1 ILE 92 HD11 ILE 92 12.081 -17.320 22.144 730 2HD1 ILE 92 HD12 ILE 92 12.829 -16.126 23.199 731 3HD1 ILE 92 HD13 ILE 92 11.550 -17.176 23.819 732 H GLN 93 HN GLN 93 14.332 -14.620 26.652 733 HA GLN 93 HA GLN 93 15.003 -16.018 29.118 734 1HB GLN 93 HB2 GLN 93 15.172 -13.065 28.446 735 2HB GLN 93 HB1 GLN 93 15.413 -13.730 30.058 736 1HG GLN 93 HG2 GLN 93 17.319 -15.007 29.257 737 2HG GLN 93 HG1 GLN 93 17.088 -14.346 27.639 738 1HE2 GLN 93 HE21 GLN 93 19.106 -13.425 27.635 739 2HE2 GLN 93 HE22 GLN 93 19.487 -12.028 28.577 740 H ALA 94 HN ALA 94 13.305 -16.519 30.113 741 HA ALA 94 HA ALA 94 10.791 -15.448 29.149 742 1HB ALA 94 HB1 ALA 94 9.841 -17.470 30.087 743 2HB ALA 94 HB2 ALA 94 11.433 -17.932 30.693 744 3HB ALA 94 HB3 ALA 94 11.152 -17.805 28.956 745 HA PRO 95 HA PRO 95 9.997 -13.533 33.187 746 1HB PRO 95 HB2 PRO 95 7.396 -13.296 31.958 747 2HB PRO 95 HB1 PRO 95 8.370 -12.025 32.680 748 1HG PRO 95 HG2 PRO 95 8.034 -12.145 29.982 749 2HG PRO 95 HG1 PRO 95 9.544 -11.584 30.716 750 1HD PRO 95 HD2 PRO 95 8.903 -14.190 29.441 751 2HD PRO 95 HD1 PRO 95 10.431 -13.285 29.475 752 H VAL 96 HN VAL 96 9.424 -14.935 34.618 753 HA VAL 96 HA VAL 96 7.531 -17.006 33.815 754 HB VAL 96 HB VAL 96 9.731 -17.894 33.333 755 1HG1 VAL 96 HG11 VAL 96 11.356 -18.410 35.097 756 2HG1 VAL 96 HG12 VAL 96 10.360 -17.522 36.250 757 3HG1 VAL 96 HG13 VAL 96 11.095 -16.677 34.887 758 1HG2 VAL 96 HG21 VAL 96 8.468 -19.241 35.710 759 2HG2 VAL 96 HG22 VAL 96 9.610 -20.006 34.605 760 3HG2 VAL 96 HG23 VAL 96 8.023 -19.498 34.026 761 H THR 97 HN THR 97 6.052 -17.426 35.149 762 HA THR 97 HA THR 97 6.353 -16.894 37.980 763 HB THR 97 HB THR 97 3.993 -17.968 36.361 764 HG1 THR 97 HG1 THR 97 5.054 -15.545 36.370 765 1HG2 THR 97 HG21 THR 97 2.650 -17.233 38.290 766 2HG2 THR 97 HG22 THR 97 4.118 -16.698 39.108 767 3HG2 THR 97 HG23 THR 97 3.867 -18.414 38.769 768 H GLU 98 HN GLU 98 7.733 -18.486 38.595 769 HA GLU 98 HA GLU 98 7.976 -20.752 37.001 770 1HB GLU 98 HB2 GLU 98 9.882 -19.607 37.813 771 2HB GLU 98 HB1 GLU 98 9.500 -20.028 39.474 772 1HG GLU 98 HG2 GLU 98 9.903 -22.350 39.037 773 2HG GLU 98 HG1 GLU 98 10.084 -22.040 37.311 774 H LYS 99 HN LYS 99 6.493 -21.944 36.928 775 HA LYS 99 HA LYS 99 6.462 -24.272 38.285 776 1HB LYS 99 HB2 LYS 99 5.166 -23.055 40.072 777 2HB LYS 99 HB1 LYS 99 3.978 -22.592 38.863 778 1HG LYS 99 HG2 LYS 99 3.429 -24.957 38.487 779 2HG LYS 99 HG1 LYS 99 4.610 -25.418 39.710 780 1HD LYS 99 HD2 LYS 99 2.169 -23.711 40.191 781 2HD LYS 99 HD1 LYS 99 2.292 -25.431 40.548 782 1HE LYS 99 HE2 LYS 99 4.125 -24.959 42.115 783 2HE LYS 99 HE1 LYS 99 3.967 -23.240 41.770 784 1HZ LYS 99 HZ1 LYS 99 2.827 -23.876 43.825 785 2HZ LYS 99 HZ2 LYS 99 1.848 -24.945 42.976 786 3HZ LYS 99 HZ3 LYS 99 1.731 -23.287 42.687 787 H GLU 100 HN GLU 100 6.762 -24.708 36.151 788 HA GLU 100 HA GLU 100 4.391 -24.701 34.479 789 1HB GLU 100 HB2 GLU 100 5.485 -22.571 33.944 790 2HB GLU 100 HB1 GLU 100 7.000 -23.399 33.664 791 1HG GLU 100 HG2 GLU 100 5.979 -22.764 31.561 792 2HG GLU 100 HG1 GLU 100 6.023 -24.517 31.711 793 H LYS 101 HN LYS 101 7.755 -25.627 35.009 794 HA LYS 101 HA LYS 101 7.236 -28.167 33.734 795 1HB LYS 101 HB2 LYS 101 8.353 -26.754 32.049 796 2HB LYS 101 HB1 LYS 101 9.643 -26.414 33.193 797 1HG LYS 101 HG2 LYS 101 10.230 -28.788 33.225 798 2HG LYS 101 HG1 LYS 101 8.953 -29.108 32.051 799 1HD LYS 101 HD2 LYS 101 10.050 -27.651 30.439 800 2HD LYS 101 HD1 LYS 101 11.316 -27.291 31.614 801 1HE LYS 101 HE2 LYS 101 12.051 -28.972 30.018 802 2HE LYS 101 HE1 LYS 101 11.969 -29.645 31.642 803 1HZ LYS 101 HZ1 LYS 101 11.067 -31.138 29.984 804 2HZ LYS 101 HZ2 LYS 101 9.914 -29.994 29.525 805 3HZ LYS 101 HZ3 LYS 101 9.866 -30.672 31.064 Start of MODEL 8 1 H GLU 1 HT1 GLU 1 1.435 0.401 1.556 2 HA GLU 1 HA GLU 1 2.109 -2.131 0.248 3 1HB GLU 1 HB2 GLU 1 -0.196 -0.214 -0.241 4 2HB GLU 1 HB1 GLU 1 0.274 -1.482 -1.354 5 1HG GLU 1 HG2 GLU 1 -1.645 -2.188 -0.071 6 2HG GLU 1 HG1 GLU 1 -0.250 -3.160 0.372 7 H ALA 2 HN ALA 2 2.554 -1.777 -2.049 8 HA ALA 2 HA ALA 2 3.712 -0.930 -3.711 9 1HB ALA 2 HB1 ALA 2 3.715 1.456 -4.202 10 2HB ALA 2 HB2 ALA 2 3.143 1.808 -2.570 11 3HB ALA 2 HB3 ALA 2 2.102 0.941 -3.702 12 H GLU 3 HN GLU 3 5.770 -1.156 -3.961 13 HA GLU 3 HA GLU 3 7.563 0.305 -2.394 14 1HB GLU 3 HB2 GLU 3 8.840 -1.796 -1.705 15 2HB GLU 3 HB1 GLU 3 7.345 -1.465 -0.845 16 1HG GLU 3 HG2 GLU 3 6.183 -3.097 -2.227 17 2HG GLU 3 HG1 GLU 3 7.664 -3.420 -3.113 18 H VAL 4 HN VAL 4 8.933 1.059 -3.759 19 HA VAL 4 HA VAL 4 9.360 -0.298 -6.304 20 HB VAL 4 HB VAL 4 10.279 2.476 -5.473 21 1HG1 VAL 4 HG11 VAL 4 10.083 1.266 -8.231 22 2HG1 VAL 4 HG12 VAL 4 11.568 1.609 -7.346 23 3HG1 VAL 4 HG13 VAL 4 10.527 2.934 -7.867 24 1HG2 VAL 4 HG21 VAL 4 8.382 3.345 -6.769 25 2HG2 VAL 4 HG22 VAL 4 7.855 2.350 -5.409 26 3HG2 VAL 4 HG23 VAL 4 7.832 1.692 -7.044 27 H HIS 5 HN HIS 5 10.691 0.165 -3.473 28 HA HIS 5 HA HIS 5 13.408 -0.703 -4.296 29 1HB HIS 5 HB2 HIS 5 13.269 1.537 -3.101 30 2HB HIS 5 HB1 HIS 5 12.636 0.683 -1.702 31 HD1 HIS 5 HD1 HIS 5 14.344 -0.190 -0.082 32 HD2 HIS 5 HD2 HIS 5 15.989 0.788 -3.764 33 HE1 HIS 5 HE1 HIS 5 16.829 -0.411 0.205 34 HE2 HIS 5 HE2 HIS 5 17.738 0.594 -1.930 35 H ASN 6 HN ASN 6 14.200 -2.619 -3.268 36 HA ASN 6 HA ASN 6 12.031 -4.126 -2.038 37 1HB ASN 6 HB2 ASN 6 13.549 -4.959 -4.020 38 2HB ASN 6 HB1 ASN 6 14.722 -5.285 -2.750 39 1HD2 ASN 6 HD21 ASN 6 13.369 -7.147 -4.541 40 2HD2 ASN 6 HD22 ASN 6 12.515 -8.257 -3.537 41 H GLN 7 HN GLN 7 12.760 -5.692 -0.279 42 HA GLN 7 HA GLN 7 14.168 -4.172 1.778 43 1HB GLN 7 HB2 GLN 7 11.900 -6.134 1.931 44 2HB GLN 7 HB1 GLN 7 12.617 -5.294 3.297 45 1HG GLN 7 HG2 GLN 7 11.794 -3.185 2.475 46 2HG GLN 7 HG1 GLN 7 11.191 -3.957 1.007 47 1HE2 GLN 7 HE21 GLN 7 9.068 -3.315 1.396 48 2HE2 GLN 7 HE22 GLN 7 8.140 -4.025 2.659 49 H LEU 8 HN LEU 8 14.814 -5.963 3.606 50 HA LEU 8 HA LEU 8 15.858 -8.237 2.133 51 1HB LEU 8 HB2 LEU 8 17.441 -8.568 3.950 52 2HB LEU 8 HB1 LEU 8 17.710 -7.052 3.125 53 HG LEU 8 HG LEU 8 16.342 -7.290 5.835 54 1HD1 LEU 8 HD11 LEU 8 18.506 -6.644 6.789 55 2HD1 LEU 8 HD12 LEU 8 19.241 -6.711 5.188 56 3HD1 LEU 8 HD13 LEU 8 18.631 -8.185 5.941 57 1HD2 LEU 8 HD21 LEU 8 16.948 -4.937 6.046 58 2HD2 LEU 8 HD22 LEU 8 15.946 -5.174 4.617 59 3HD2 LEU 8 HD23 LEU 8 17.691 -4.966 4.452 60 H GLU 9 HN GLU 9 15.432 -10.323 2.808 61 HA GLU 9 HA GLU 9 13.189 -10.460 4.624 62 1HB GLU 9 HB2 GLU 9 14.346 -12.684 2.956 63 2HB GLU 9 HB1 GLU 9 12.873 -12.686 3.862 64 1HG GLU 9 HG2 GLU 9 11.883 -10.967 2.458 65 2HG GLU 9 HG1 GLU 9 13.364 -10.885 1.507 66 H ILE 10 HN ILE 10 13.256 -11.225 6.501 67 HA ILE 10 HA ILE 10 15.753 -12.430 7.508 68 HB ILE 10 HB ILE 10 13.818 -10.640 9.043 69 1HG1 ILE 10 HG12 ILE 10 16.628 -10.036 8.046 70 2HG1 ILE 10 HG11 ILE 10 15.154 -9.398 7.331 71 1HG2 ILE 10 HG21 ILE 10 16.473 -11.818 9.861 72 2HG2 ILE 10 HG22 ILE 10 14.883 -12.284 10.472 73 3HG2 ILE 10 HG23 ILE 10 15.519 -10.670 10.804 74 1HD1 ILE 10 HD11 ILE 10 14.686 -8.201 9.405 75 2HD1 ILE 10 HD12 ILE 10 16.262 -7.763 8.744 76 3HD1 ILE 10 HD13 ILE 10 16.154 -8.864 10.119 77 H LYS 11 HN LYS 11 15.529 -14.216 8.636 78 HA LYS 11 HA LYS 11 12.833 -15.004 9.479 79 1HB LYS 11 HB2 LYS 11 13.384 -17.372 9.164 80 2HB LYS 11 HB1 LYS 11 13.531 -16.496 7.659 81 1HG LYS 11 HG2 LYS 11 15.975 -16.465 7.938 82 2HG LYS 11 HG1 LYS 11 15.790 -17.379 9.440 83 1HD LYS 11 HD2 LYS 11 14.731 -19.204 8.207 84 2HD LYS 11 HD1 LYS 11 14.899 -18.298 6.706 85 1HE LYS 11 HE2 LYS 11 17.345 -18.316 7.005 86 2HE LYS 11 HE1 LYS 11 17.134 -19.273 8.469 87 1HZ LYS 11 HZ1 LYS 11 16.132 -21.034 7.092 88 2HZ LYS 11 HZ2 LYS 11 17.688 -20.670 6.637 89 3HZ LYS 11 HZ3 LYS 11 16.411 -20.102 5.706 90 H PHE 12 HN PHE 12 12.690 -16.047 11.478 91 HA PHE 12 HA PHE 12 14.886 -15.310 13.277 92 1HB PHE 12 HB2 PHE 12 12.026 -16.055 13.916 93 2HB PHE 12 HB1 PHE 12 13.222 -15.455 15.051 94 HD1 PHE 12 HD1 PHE 12 10.723 -14.603 12.616 95 HD2 PHE 12 HD2 PHE 12 14.036 -13.100 14.817 96 HE1 PHE 12 HE1 PHE 12 9.971 -12.308 12.163 97 HE2 PHE 12 HE2 PHE 12 13.292 -10.799 14.368 98 HZ PHE 12 HZ PHE 12 11.257 -10.401 13.043 99 H ARG 13 HN ARG 13 16.169 -16.934 13.979 100 HA ARG 13 HA ARG 13 14.898 -19.542 14.279 101 1HB ARG 13 HB2 ARG 13 16.494 -19.726 12.448 102 2HB ARG 13 HB1 ARG 13 17.754 -19.008 13.434 103 1HG ARG 13 HG2 ARG 13 17.866 -20.930 14.851 104 2HG ARG 13 HG1 ARG 13 16.417 -21.614 14.129 105 1HD ARG 13 HD2 ARG 13 18.934 -21.083 12.565 106 2HD ARG 13 HD1 ARG 13 18.601 -22.622 13.362 107 HE ARG 13 HE ARG 13 16.397 -22.316 11.911 108 1HH1 ARG 13 HH11 ARG 13 19.756 -21.851 10.885 109 2HH1 ARG 13 HH12 ARG 13 19.476 -22.422 9.308 110 1HH2 ARG 13 HH21 ARG 13 16.042 -23.100 9.789 111 2HH2 ARG 13 HH22 ARG 13 17.316 -23.163 8.655 112 H LEU 14 HN LEU 14 14.825 -20.347 16.145 113 HA LEU 14 HA LEU 14 15.685 -18.828 18.416 114 1HB LEU 14 HB2 LEU 14 14.482 -21.573 18.301 115 2HB LEU 14 HB1 LEU 14 14.519 -20.533 19.695 116 HG LEU 14 HG LEU 14 12.775 -20.301 17.232 117 1HD1 LEU 14 HD11 LEU 14 12.080 -20.539 20.082 118 2HD1 LEU 14 HD12 LEU 14 12.076 -21.807 18.860 119 3HD1 LEU 14 HD13 LEU 14 10.994 -20.428 18.688 120 1HD2 LEU 14 HD21 LEU 14 13.548 -18.053 17.651 121 2HD2 LEU 14 HD22 LEU 14 13.217 -18.205 19.359 122 3HD2 LEU 14 HD23 LEU 14 11.881 -18.207 18.202 123 H THR 15 HN THR 15 16.685 -20.051 20.317 124 HA THR 15 HA THR 15 19.163 -21.196 19.645 125 HB THR 15 HB THR 15 19.163 -21.643 22.170 126 HG1 THR 15 HG1 THR 15 17.522 -20.615 23.310 127 1HG2 THR 15 HG21 THR 15 20.249 -19.678 21.161 128 2HG2 THR 15 HG22 THR 15 19.480 -19.247 22.690 129 3HG2 THR 15 HG23 THR 15 18.708 -18.822 21.165 130 H ASP 16 HN ASP 16 16.044 -22.419 20.051 131 HA ASP 16 HA ASP 16 16.712 -25.165 20.643 132 1HB ASP 16 HB2 ASP 16 14.156 -23.944 19.558 133 2HB ASP 16 HB1 ASP 16 14.342 -25.629 20.010 134 H GLY 17 HN GLY 17 17.069 -23.237 17.985 135 1HA GLY 17 HA2 GLY 17 17.940 -23.816 15.920 136 2HA GLY 17 HA1 GLY 17 17.573 -25.501 16.261 137 H SER 18 HN SER 18 14.858 -23.706 16.948 138 HA SER 18 HA SER 18 13.666 -24.588 14.505 139 1HB SER 18 HB2 SER 18 11.566 -23.856 15.748 140 2HB SER 18 HB1 SER 18 12.452 -25.217 16.435 141 HG SER 18 HG SER 18 11.722 -23.364 17.802 142 H ASP 19 HN ASP 19 12.858 -23.206 12.933 143 HA ASP 19 HA ASP 19 13.300 -20.404 13.474 144 1HB ASP 19 HB2 ASP 19 13.754 -20.156 11.063 145 2HB ASP 19 HB1 ASP 19 15.003 -21.036 11.949 146 H ILE 20 HN ILE 20 12.100 -18.954 12.414 147 HA ILE 20 HA ILE 20 9.332 -19.779 11.880 148 HB ILE 20 HB ILE 20 10.474 -17.073 12.685 149 1HG1 ILE 20 HG12 ILE 20 8.875 -19.062 14.321 150 2HG1 ILE 20 HG11 ILE 20 10.593 -18.736 14.503 151 1HG2 ILE 20 HG21 ILE 20 8.129 -16.386 13.020 152 2HG2 ILE 20 HG22 ILE 20 7.597 -17.942 12.372 153 3HG2 ILE 20 HG23 ILE 20 8.470 -16.810 11.342 154 1HD1 ILE 20 HD11 ILE 20 10.075 -16.440 15.186 155 2HD1 ILE 20 HD12 ILE 20 9.295 -17.626 16.230 156 3HD1 ILE 20 HD13 ILE 20 8.354 -16.779 15.000 157 H GLY 21 HN GLY 21 8.383 -19.126 9.984 158 1HA GLY 21 HA2 GLY 21 9.809 -18.952 7.652 159 2HA GLY 21 HA1 GLY 21 8.154 -18.397 7.814 160 HA PRO 22 HA PRO 22 11.581 -14.944 7.430 161 1HB PRO 22 HB2 PRO 22 12.006 -14.864 4.737 162 2HB PRO 22 HB1 PRO 22 13.040 -15.743 5.861 163 1HG PRO 22 HG2 PRO 22 10.862 -16.754 4.094 164 2HG PRO 22 HG1 PRO 22 12.427 -17.485 4.501 165 1HD PRO 22 HD2 PRO 22 10.101 -18.288 5.630 166 2HD PRO 22 HD1 PRO 22 11.656 -18.346 6.484 167 H LYS 23 HN LYS 23 11.067 -12.914 6.933 168 HA LYS 23 HA LYS 23 8.797 -12.374 5.150 169 1HB LYS 23 HB2 LYS 23 8.008 -12.366 7.581 170 2HB LYS 23 HB1 LYS 23 9.128 -11.042 7.866 171 1HG LYS 23 HG2 LYS 23 7.923 -9.688 6.183 172 2HG LYS 23 HG1 LYS 23 6.780 -11.009 5.965 173 1HD LYS 23 HD2 LYS 23 5.784 -9.406 7.405 174 2HD LYS 23 HD1 LYS 23 6.210 -10.795 8.400 175 1HE LYS 23 HE2 LYS 23 6.780 -8.784 9.585 176 2HE LYS 23 HE1 LYS 23 8.281 -9.552 9.080 177 1HZ LYS 23 HZ1 LYS 23 6.956 -7.295 7.672 178 2HZ LYS 23 HZ2 LYS 23 8.461 -7.885 7.245 179 3HZ LYS 23 HZ3 LYS 23 8.221 -7.105 8.714 180 H ALA 24 HN ALA 24 8.865 -9.991 4.520 181 HA ALA 24 HA ALA 24 11.643 -9.254 4.209 182 1HB ALA 24 HB1 ALA 24 9.136 -8.001 3.076 183 2HB ALA 24 HB2 ALA 24 10.142 -9.200 2.265 184 3HB ALA 24 HB3 ALA 24 10.795 -7.604 2.628 185 H PHE 25 HN PHE 25 12.599 -7.585 5.204 186 HA PHE 25 HA PHE 25 10.972 -5.744 6.802 187 1HB PHE 25 HB2 PHE 25 13.644 -6.933 7.581 188 2HB PHE 25 HB1 PHE 25 12.727 -5.755 8.492 189 HD1 PHE 25 HD1 PHE 25 11.101 -6.471 10.063 190 HD2 PHE 25 HD2 PHE 25 12.770 -9.218 7.299 191 HE1 PHE 25 HE1 PHE 25 10.124 -8.351 11.324 192 HE2 PHE 25 HE2 PHE 25 11.801 -11.079 8.540 193 HZ PHE 25 HZ PHE 25 10.529 -10.698 10.505 194 HA PRO 26 HA PRO 26 13.698 -2.974 4.478 195 1HB PRO 26 HB2 PRO 26 12.551 -1.019 6.373 196 2HB PRO 26 HB1 PRO 26 12.597 -0.915 4.624 197 1HG PRO 26 HG2 PRO 26 10.316 -1.445 5.857 198 2HG PRO 26 HG1 PRO 26 10.739 -2.365 4.400 199 1HD PRO 26 HD2 PRO 26 11.009 -3.181 7.278 200 2HD PRO 26 HD1 PRO 26 10.350 -4.095 5.894 201 H ASP 27 HN ASP 27 15.634 -1.931 4.993 202 HA ASP 27 HA ASP 27 17.099 -2.595 7.299 203 1HB ASP 27 HB2 ASP 27 17.533 -0.194 5.497 204 2HB ASP 27 HB1 ASP 27 18.720 -0.897 6.581 205 H ALA 28 HN ALA 28 14.919 -0.017 6.615 206 HA ALA 28 HA ALA 28 15.803 1.750 8.697 207 1HB ALA 28 HB1 ALA 28 13.935 3.144 8.024 208 2HB ALA 28 HB2 ALA 28 13.316 1.844 7.002 209 3HB ALA 28 HB3 ALA 28 14.860 2.609 6.621 210 H THR 29 HN THR 29 13.943 -1.046 8.742 211 HA THR 29 HA THR 29 12.015 -0.199 10.661 212 HB THR 29 HB THR 29 12.921 -2.970 9.823 213 HG1 THR 29 HG1 THR 29 11.307 -1.057 8.823 214 1HG2 THR 29 HG21 THR 29 10.468 -2.141 11.398 215 2HG2 THR 29 HG22 THR 29 11.854 -3.008 12.060 216 3HG2 THR 29 HG23 THR 29 10.831 -3.776 10.843 217 H THR 30 HN THR 30 12.060 -0.310 12.849 218 HA THR 30 HA THR 30 14.637 -0.390 14.038 219 HB THR 30 HB THR 30 13.440 0.132 16.137 220 HG1 THR 30 HG1 THR 30 11.043 0.476 14.776 221 1HG2 THR 30 HG21 THR 30 12.575 1.804 13.767 222 2HG2 THR 30 HG22 THR 30 14.094 1.968 14.644 223 3HG2 THR 30 HG23 THR 30 12.567 2.334 15.447 224 H VAL 31 HN VAL 31 15.169 -1.713 15.844 225 HA VAL 31 HA VAL 31 14.487 -4.448 15.588 226 HB VAL 31 HB VAL 31 15.863 -2.999 17.874 227 1HG1 VAL 31 HG11 VAL 31 16.785 -5.192 18.472 228 2HG1 VAL 31 HG12 VAL 31 15.857 -5.947 17.181 229 3HG1 VAL 31 HG13 VAL 31 15.023 -5.217 18.550 230 1HG2 VAL 31 HG21 VAL 31 17.036 -4.475 15.524 231 2HG2 VAL 31 HG22 VAL 31 17.934 -3.636 16.810 232 3HG2 VAL 31 HG23 VAL 31 16.938 -2.729 15.692 233 H SER 32 HN SER 32 13.231 -1.787 17.403 234 HA SER 32 HA SER 32 11.692 -3.183 19.274 235 1HB SER 32 HB2 SER 32 12.117 -0.707 19.290 236 2HB SER 32 HB1 SER 32 11.041 -0.551 17.905 237 HG SER 32 HG SER 32 10.378 -0.374 20.325 238 H ALA 33 HN ALA 33 10.927 -1.990 15.970 239 HA ALA 33 HA ALA 33 8.360 -3.177 15.870 240 1HB ALA 33 HB1 ALA 33 8.413 -2.635 13.486 241 2HB ALA 33 HB2 ALA 33 10.144 -2.302 13.601 242 3HB ALA 33 HB3 ALA 33 8.992 -1.281 14.458 243 H LEU 34 HN LEU 34 11.602 -4.376 15.157 244 HA LEU 34 HA LEU 34 10.939 -6.627 13.713 245 1HB LEU 34 HB2 LEU 34 13.158 -5.606 13.891 246 2HB LEU 34 HB1 LEU 34 13.149 -5.916 15.615 247 HG LEU 34 HG LEU 34 13.135 -8.181 15.238 248 1HD1 LEU 34 HD11 LEU 34 13.498 -7.475 12.289 249 2HD1 LEU 34 HD12 LEU 34 12.126 -8.335 12.983 250 3HD1 LEU 34 HD13 LEU 34 13.710 -9.108 12.918 251 1HD2 LEU 34 HD21 LEU 34 15.499 -8.419 14.425 252 2HD2 LEU 34 HD22 LEU 34 15.236 -7.157 15.625 253 3HD2 LEU 34 HD23 LEU 34 15.417 -6.731 13.923 254 H LYS 35 HN LYS 35 11.323 -5.912 17.161 255 HA LYS 35 HA LYS 35 10.610 -8.480 18.067 256 1HB LYS 35 HB2 LYS 35 10.764 -5.806 19.442 257 2HB LYS 35 HB1 LYS 35 10.263 -7.271 20.284 258 1HG LYS 35 HG2 LYS 35 12.291 -8.308 19.919 259 2HG LYS 35 HG1 LYS 35 12.894 -7.017 18.829 260 1HD LYS 35 HD2 LYS 35 12.967 -5.566 20.753 261 2HD LYS 35 HD1 LYS 35 12.303 -6.835 21.800 262 1HE LYS 35 HE2 LYS 35 14.337 -8.179 21.130 263 2HE LYS 35 HE1 LYS 35 14.962 -6.690 20.417 264 1HZ LYS 35 HZ1 LYS 35 14.199 -7.075 23.256 265 2HZ LYS 35 HZ2 LYS 35 14.795 -5.642 22.653 266 3HZ LYS 35 HZ3 LYS 35 15.771 -7.009 22.681 267 H GLU 36 HN GLU 36 8.722 -5.538 17.466 268 HA GLU 36 HA GLU 36 6.229 -6.333 18.415 269 1HB GLU 36 HB2 GLU 36 6.894 -4.780 15.911 270 2HB GLU 36 HB1 GLU 36 5.301 -4.887 16.629 271 1HG GLU 36 HG2 GLU 36 7.709 -3.705 17.983 272 2HG GLU 36 HG1 GLU 36 6.485 -2.777 17.118 273 H THR 37 HN THR 37 7.894 -7.089 15.440 274 HA THR 37 HA THR 37 5.861 -8.457 14.076 275 HB THR 37 HB THR 37 8.851 -8.967 13.983 276 HG1 THR 37 HG1 THR 37 8.152 -6.745 13.534 277 1HG2 THR 37 HG21 THR 37 7.527 -10.750 12.906 278 2HG2 THR 37 HG22 THR 37 8.407 -9.811 11.702 279 3HG2 THR 37 HG23 THR 37 6.683 -9.549 11.939 280 H VAL 38 HN VAL 38 8.369 -9.551 16.321 281 HA VAL 38 HA VAL 38 7.726 -12.280 16.295 282 HB VAL 38 HB VAL 38 8.960 -10.682 18.563 283 1HG1 VAL 38 HG11 VAL 38 9.876 -12.830 19.310 284 2HG1 VAL 38 HG12 VAL 38 9.016 -13.648 18.008 285 3HG1 VAL 38 HG13 VAL 38 8.114 -12.850 19.294 286 1HG2 VAL 38 HG21 VAL 38 10.252 -10.457 16.502 287 2HG2 VAL 38 HG22 VAL 38 10.284 -12.210 16.317 288 3HG2 VAL 38 HG23 VAL 38 11.120 -11.449 17.672 289 H ILE 39 HN ILE 39 6.708 -9.632 18.394 290 HA ILE 39 HA ILE 39 5.104 -11.085 20.187 291 HB ILE 39 HB ILE 39 4.575 -8.252 19.220 292 1HG1 ILE 39 HG12 ILE 39 6.334 -9.257 21.448 293 2HG1 ILE 39 HG11 ILE 39 6.889 -8.547 19.948 294 1HG2 ILE 39 HG21 ILE 39 3.868 -9.644 21.817 295 2HG2 ILE 39 HG22 ILE 39 2.732 -9.200 20.541 296 3HG2 ILE 39 HG23 ILE 39 3.573 -7.946 21.452 297 1HD1 ILE 39 HD11 ILE 39 5.867 -6.420 20.540 298 2HD1 ILE 39 HD12 ILE 39 7.011 -6.965 21.770 299 3HD1 ILE 39 HD13 ILE 39 5.277 -7.125 22.049 300 H SER 40 HN SER 40 4.410 -9.853 16.999 301 HA SER 40 HA SER 40 1.613 -10.422 17.097 302 1HB SER 40 HB2 SER 40 3.408 -9.827 14.745 303 2HB SER 40 HB1 SER 40 1.642 -9.800 14.732 304 HG SER 40 HG SER 40 3.431 -8.094 16.110 305 H GLU 41 HN GLU 41 4.477 -12.140 15.775 306 HA GLU 41 HA GLU 41 2.808 -14.190 14.666 307 1HB GLU 41 HB2 GLU 41 5.645 -13.400 14.456 308 2HB GLU 41 HB1 GLU 41 5.243 -15.069 14.134 309 1HG GLU 41 HG2 GLU 41 5.344 -13.714 12.084 310 2HG GLU 41 HG1 GLU 41 3.751 -14.388 12.325 311 H TRP 42 HN TRP 42 4.869 -13.813 17.445 312 HA TRP 42 HA TRP 42 4.859 -16.632 18.079 313 1HB TRP 42 HB2 TRP 42 6.727 -14.953 18.622 314 2HB TRP 42 HB1 TRP 42 5.630 -14.250 19.792 315 HD1 TRP 42 HD1 TRP 42 5.322 -15.629 22.152 316 HE1 TRP 42 HE1 TRP 42 6.701 -17.457 23.208 317 HE3 TRP 42 HE3 TRP 42 7.974 -17.020 18.015 318 HZ2 TRP 42 HZ2 TRP 42 8.708 -19.368 22.343 319 HZ3 TRP 42 HZ3 TRP 42 9.585 -18.848 18.200 320 HH2 TRP 42 HH2 TRP 42 9.964 -19.995 20.272 321 HA PRO 43 HA PRO 43 0.978 -16.240 20.228 322 1HB PRO 43 HB2 PRO 43 2.000 -18.086 22.258 323 2HB PRO 43 HB1 PRO 43 0.599 -18.275 21.217 324 1HG PRO 43 HG2 PRO 43 2.870 -19.703 20.859 325 2HG PRO 43 HG1 PRO 43 1.835 -19.217 19.509 326 1HD PRO 43 HD2 PRO 43 4.443 -18.089 20.403 327 2HD PRO 43 HD1 PRO 43 3.765 -18.244 18.768 328 H ARG 44 HN ARG 44 0.989 -14.290 21.135 329 HA ARG 44 HA ARG 44 2.747 -13.477 23.199 330 1HB ARG 44 HB2 ARG 44 1.241 -11.482 23.411 331 2HB ARG 44 HB1 ARG 44 1.811 -11.777 21.779 332 1HG ARG 44 HG2 ARG 44 -0.353 -12.839 21.255 333 2HG ARG 44 HG1 ARG 44 -0.910 -12.438 22.878 334 1HD ARG 44 HD2 ARG 44 -1.679 -10.802 21.232 335 2HD ARG 44 HD1 ARG 44 -0.597 -10.066 22.412 336 HE ARG 44 HE ARG 44 0.935 -10.879 20.235 337 1HH1 ARG 44 HH11 ARG 44 -1.684 -8.560 20.835 338 2HH1 ARG 44 HH12 ARG 44 -1.123 -7.414 19.708 339 1HH2 ARG 44 HH21 ARG 44 1.693 -9.308 18.689 340 2HH2 ARG 44 HH22 ARG 44 0.846 -7.847 18.455 341 H GLU 45 HN GLU 45 -0.125 -15.182 23.101 342 HA GLU 45 HA GLU 45 -0.901 -14.916 25.837 343 1HB GLU 45 HB2 GLU 45 -1.630 -16.881 23.674 344 2HB GLU 45 HB1 GLU 45 -2.413 -16.791 25.246 345 1HG GLU 45 HG2 GLU 45 -3.278 -14.636 24.798 346 2HG GLU 45 HG1 GLU 45 -2.283 -14.462 23.354 347 H LYS 46 HN LYS 46 1.725 -16.461 24.389 348 HA LYS 46 HA LYS 46 1.768 -18.822 26.034 349 1HB LYS 46 HB2 LYS 46 2.901 -18.779 23.762 350 2HB LYS 46 HB1 LYS 46 3.972 -17.567 24.401 351 1HG LYS 46 HG2 LYS 46 4.919 -19.080 25.983 352 2HG LYS 46 HG1 LYS 46 3.767 -20.335 25.549 353 1HD LYS 46 HD2 LYS 46 4.721 -20.379 23.271 354 2HD LYS 46 HD1 LYS 46 5.902 -19.161 23.763 355 1HE LYS 46 HE2 LYS 46 6.783 -20.677 25.460 356 2HE LYS 46 HE1 LYS 46 5.567 -21.874 25.028 357 1HZ LYS 46 HZ1 LYS 46 6.574 -22.006 22.819 358 2HZ LYS 46 HZ2 LYS 46 7.623 -22.444 24.033 359 3HZ LYS 46 HZ3 LYS 46 7.811 -20.950 23.288 360 H GLU 47 HN GLU 47 2.301 -18.731 28.151 361 HA GLU 47 HA GLU 47 4.094 -16.665 28.901 362 1HB GLU 47 HB2 GLU 47 3.585 -17.260 31.250 363 2HB GLU 47 HB1 GLU 47 2.155 -16.795 30.350 364 1HG GLU 47 HG2 GLU 47 1.500 -19.109 30.157 365 2HG GLU 47 HG1 GLU 47 2.995 -19.621 30.943 366 H ASN 48 HN ASN 48 5.774 -17.454 30.613 367 HA ASN 48 HA ASN 48 7.614 -18.666 31.092 368 1HB ASN 48 HB2 ASN 48 5.978 -20.467 31.690 369 2HB ASN 48 HB1 ASN 48 6.003 -21.032 30.029 370 1HD2 ASN 48 HD21 ASN 48 6.661 -23.063 30.609 371 2HD2 ASN 48 HD22 ASN 48 8.242 -23.434 31.156 372 H GLY 49 HN GLY 49 6.992 -17.569 28.334 373 1HA GLY 49 HA2 GLY 49 9.488 -18.432 27.200 374 2HA GLY 49 HA1 GLY 49 8.050 -18.718 26.214 375 HA PRO 50 HA PRO 50 9.589 -14.335 25.365 376 1HB PRO 50 HB2 PRO 50 8.833 -15.374 22.675 377 2HB PRO 50 HB1 PRO 50 10.207 -14.362 23.125 378 1HG PRO 50 HG2 PRO 50 10.591 -16.902 22.586 379 2HG PRO 50 HG1 PRO 50 11.406 -16.179 23.986 380 1HD PRO 50 HD2 PRO 50 8.962 -17.916 23.913 381 2HD PRO 50 HD1 PRO 50 10.341 -17.977 25.027 382 H LYS 51 HN LYS 51 8.238 -12.618 24.585 383 HA LYS 51 HA LYS 51 5.545 -13.151 23.738 384 1HB LYS 51 HB2 LYS 51 5.329 -13.472 26.158 385 2HB LYS 51 HB1 LYS 51 6.045 -11.892 26.445 386 1HG LYS 51 HG2 LYS 51 4.111 -10.881 25.219 387 2HG LYS 51 HG1 LYS 51 3.411 -12.488 25.121 388 1HD LYS 51 HD2 LYS 51 3.382 -12.658 27.549 389 2HD LYS 51 HD1 LYS 51 4.103 -11.055 27.678 390 1HE LYS 51 HE2 LYS 51 2.158 -10.076 26.592 391 2HE LYS 51 HE1 LYS 51 1.440 -11.675 26.410 392 1HZ LYS 51 HZ1 LYS 51 2.066 -10.363 29.001 393 2HZ LYS 51 HZ2 LYS 51 1.280 -11.854 28.816 394 3HZ LYS 51 HZ3 LYS 51 0.556 -10.436 28.281 395 H THR 52 HN THR 52 7.479 -10.635 25.410 396 HA THR 52 HA THR 52 6.754 -8.877 23.265 397 HB THR 52 HB THR 52 6.822 -6.982 24.898 398 HG1 THR 52 HG1 THR 52 7.602 -8.903 26.601 399 1HG2 THR 52 HG21 THR 52 4.569 -7.346 25.784 400 2HG2 THR 52 HG22 THR 52 4.714 -9.061 25.443 401 3HG2 THR 52 HG23 THR 52 4.688 -7.899 24.110 402 H VAL 53 HN VAL 53 8.119 -6.868 23.535 403 HA VAL 53 HA VAL 53 10.545 -7.246 22.343 404 HB VAL 53 HB VAL 53 9.622 -4.915 23.986 405 1HG1 VAL 53 HG11 VAL 53 11.038 -3.450 22.720 406 2HG1 VAL 53 HG12 VAL 53 11.618 -4.802 21.789 407 3HG1 VAL 53 HG13 VAL 53 12.004 -4.702 23.519 408 1HG2 VAL 53 HG21 VAL 53 7.987 -5.374 22.339 409 2HG2 VAL 53 HG22 VAL 53 9.214 -5.482 21.075 410 3HG2 VAL 53 HG23 VAL 53 8.870 -3.933 21.840 411 H LYS 54 HN LYS 54 9.762 -7.083 25.734 412 HA LYS 54 HA LYS 54 12.370 -6.506 26.702 413 1HB LYS 54 HB2 LYS 54 9.945 -7.567 28.142 414 2HB LYS 54 HB1 LYS 54 11.423 -7.022 28.917 415 1HG LYS 54 HG2 LYS 54 11.057 -4.773 28.021 416 2HG LYS 54 HG1 LYS 54 9.564 -5.325 27.264 417 1HD LYS 54 HD2 LYS 54 8.649 -5.878 29.459 418 2HD LYS 54 HD1 LYS 54 10.157 -5.368 30.219 419 1HE LYS 54 HE2 LYS 54 9.813 -3.098 29.345 420 2HE LYS 54 HE1 LYS 54 8.290 -3.612 28.623 421 1HZ LYS 54 HZ1 LYS 54 7.929 -2.496 30.722 422 2HZ LYS 54 HZ2 LYS 54 8.923 -3.555 31.524 423 3HZ LYS 54 HZ3 LYS 54 7.460 -4.106 30.868 424 H GLU 55 HN GLU 55 10.521 -9.468 26.188 425 HA GLU 55 HA GLU 55 12.858 -10.794 27.315 426 1HB GLU 55 HB2 GLU 55 11.536 -12.883 27.691 427 2HB GLU 55 HB1 GLU 55 11.145 -11.511 28.695 428 1HG GLU 55 HG2 GLU 55 9.573 -12.287 26.265 429 2HG GLU 55 HG1 GLU 55 9.286 -12.895 27.906 430 H VAL 56 HN VAL 56 11.548 -10.369 24.344 431 HA VAL 56 HA VAL 56 12.946 -12.752 23.432 432 HB VAL 56 HB VAL 56 10.804 -12.354 22.275 433 1HG1 VAL 56 HG11 VAL 56 11.992 -9.752 21.351 434 2HG1 VAL 56 HG12 VAL 56 10.636 -9.947 22.463 435 3HG1 VAL 56 HG13 VAL 56 10.473 -10.439 20.776 436 1HG2 VAL 56 HG21 VAL 56 11.605 -12.394 19.920 437 2HG2 VAL 56 HG22 VAL 56 12.507 -13.459 20.989 438 3HG2 VAL 56 HG23 VAL 56 13.197 -11.914 20.504 439 H LYS 57 HN LYS 57 15.047 -12.694 22.784 440 HA LYS 57 HA LYS 57 16.135 -10.052 22.218 441 1HB LYS 57 HB2 LYS 57 17.462 -12.457 23.444 442 2HB LYS 57 HB1 LYS 57 18.290 -10.975 22.997 443 1HG LYS 57 HG2 LYS 57 16.134 -11.278 25.087 444 2HG LYS 57 HG1 LYS 57 17.849 -11.045 25.401 445 1HD LYS 57 HD2 LYS 57 17.707 -8.840 24.260 446 2HD LYS 57 HD1 LYS 57 15.973 -9.086 24.062 447 1HE LYS 57 HE2 LYS 57 16.355 -7.676 25.979 448 2HE LYS 57 HE1 LYS 57 15.760 -9.237 26.528 449 1HZ LYS 57 HZ1 LYS 57 18.054 -9.855 27.106 450 2HZ LYS 57 HZ2 LYS 57 17.640 -8.424 27.875 451 3HZ LYS 57 HZ3 LYS 57 18.602 -8.392 26.511 452 H LEU 58 HN LEU 58 17.225 -9.722 20.373 453 HA LEU 58 HA LEU 58 17.394 -11.964 18.486 454 1HB LEU 58 HB2 LEU 58 17.207 -8.988 17.959 455 2HB LEU 58 HB1 LEU 58 17.525 -10.169 16.718 456 HG LEU 58 HG LEU 58 15.247 -9.514 16.543 457 1HD1 LEU 58 HD11 LEU 58 14.057 -11.597 16.817 458 2HD1 LEU 58 HD12 LEU 58 15.377 -12.212 17.810 459 3HD1 LEU 58 HD13 LEU 58 15.657 -11.825 16.108 460 1HD2 LEU 58 HD21 LEU 58 13.608 -9.770 18.342 461 2HD2 LEU 58 HD22 LEU 58 14.874 -8.625 18.785 462 3HD2 LEU 58 HD23 LEU 58 14.890 -10.260 19.448 463 H ILE 59 HN ILE 59 19.225 -12.474 17.531 464 HA ILE 59 HA ILE 59 21.716 -10.975 18.107 465 HB ILE 59 HB ILE 59 21.173 -13.950 18.130 466 1HG1 ILE 59 HG12 ILE 59 20.686 -12.540 20.171 467 2HG1 ILE 59 HG11 ILE 59 21.755 -13.936 20.449 468 1HG2 ILE 59 HG21 ILE 59 23.259 -13.586 16.981 469 2HG2 ILE 59 HG22 ILE 59 23.565 -14.289 18.572 470 3HG2 ILE 59 HG23 ILE 59 23.842 -12.568 18.295 471 1HD1 ILE 59 HD11 ILE 59 22.446 -11.964 21.667 472 2HD1 ILE 59 HD12 ILE 59 22.504 -11.031 20.166 473 3HD1 ILE 59 HD13 ILE 59 23.634 -12.352 20.427 474 H SER 60 HN SER 60 22.565 -10.246 16.289 475 HA SER 60 HA SER 60 22.399 -11.903 13.882 476 1HB SER 60 HB2 SER 60 22.623 -9.786 12.598 477 2HB SER 60 HB1 SER 60 21.151 -9.809 13.569 478 HG SER 60 HG SER 60 23.602 -8.562 14.265 479 H ALA 61 HN ALA 61 24.307 -12.757 13.425 480 HA ALA 61 HA ALA 61 26.528 -13.148 13.219 481 1HB ALA 61 HB1 ALA 61 26.805 -10.141 13.421 482 2HB ALA 61 HB2 ALA 61 26.536 -11.044 11.927 483 3HB ALA 61 HB3 ALA 61 28.036 -11.253 12.831 484 H GLY 62 HN GLY 62 25.237 -12.876 15.869 485 1HA GLY 62 HA2 GLY 62 26.131 -13.608 17.938 486 2HA GLY 62 HA1 GLY 62 27.701 -12.981 17.455 487 H LYS 63 HN LYS 63 25.450 -10.576 16.729 488 HA LYS 63 HA LYS 63 26.128 -9.198 19.149 489 1HB LYS 63 HB2 LYS 63 25.422 -8.361 16.363 490 2HB LYS 63 HB1 LYS 63 25.390 -7.243 17.698 491 1HG LYS 63 HG2 LYS 63 27.458 -6.999 16.438 492 2HG LYS 63 HG1 LYS 63 27.823 -7.643 18.034 493 1HD LYS 63 HD2 LYS 63 27.997 -9.893 17.062 494 2HD LYS 63 HD1 LYS 63 27.628 -9.236 15.471 495 1HE LYS 63 HE2 LYS 63 30.029 -9.596 15.786 496 2HE LYS 63 HE1 LYS 63 29.650 -7.896 15.524 497 1HZ LYS 63 HZ1 LYS 63 30.185 -9.157 18.172 498 2HZ LYS 63 HZ2 LYS 63 29.818 -7.537 17.911 499 3HZ LYS 63 HZ3 LYS 63 31.248 -8.165 17.315 500 H VAL 64 HN VAL 64 24.507 -8.495 20.454 501 HA VAL 64 HA VAL 64 21.800 -9.286 19.787 502 HB VAL 64 HB VAL 64 22.725 -9.666 22.089 503 1HG1 VAL 64 HG11 VAL 64 24.071 -7.719 22.392 504 2HG1 VAL 64 HG12 VAL 64 22.869 -7.804 23.683 505 3HG1 VAL 64 HG13 VAL 64 22.648 -6.685 22.340 506 1HG2 VAL 64 HG21 VAL 64 20.731 -8.882 23.338 507 2HG2 VAL 64 HG22 VAL 64 20.337 -9.652 21.804 508 3HG2 VAL 64 HG23 VAL 64 20.288 -7.896 21.941 509 H LEU 65 HN LEU 65 20.165 -7.883 19.311 510 HA LEU 65 HA LEU 65 21.008 -5.199 18.629 511 1HB LEU 65 HB2 LEU 65 18.580 -6.793 17.849 512 2HB LEU 65 HB1 LEU 65 18.902 -5.153 17.363 513 HG LEU 65 HG LEU 65 20.974 -6.038 16.185 514 1HD1 LEU 65 HD11 LEU 65 19.652 -8.689 16.682 515 2HD1 LEU 65 HD12 LEU 65 21.194 -8.146 17.342 516 3HD1 LEU 65 HD13 LEU 65 21.020 -8.398 15.606 517 1HD2 LEU 65 HD21 LEU 65 19.720 -6.863 14.249 518 2HD2 LEU 65 HD22 LEU 65 18.983 -5.428 14.953 519 3HD2 LEU 65 HD23 LEU 65 18.280 -7.020 15.254 520 H GLU 66 HN GLU 66 20.499 -3.584 19.971 521 HA GLU 66 HA GLU 66 18.589 -3.793 22.074 522 1HB GLU 66 HB2 GLU 66 20.024 -1.424 20.872 523 2HB GLU 66 HB1 GLU 66 18.952 -1.280 22.249 524 1HG GLU 66 HG2 GLU 66 21.302 -1.283 22.902 525 2HG GLU 66 HG1 GLU 66 20.455 -2.676 23.565 526 H ASN 67 HN ASN 67 16.595 -2.637 22.265 527 HA ASN 67 HA ASN 67 15.017 -2.892 19.917 528 1HB ASN 67 HB2 ASN 67 13.106 -2.056 21.206 529 2HB ASN 67 HB1 ASN 67 13.998 -3.267 22.113 530 1HD2 ASN 67 HD21 ASN 67 15.040 -2.648 24.042 531 2HD2 ASN 67 HD22 ASN 67 14.776 -1.104 24.739 532 H SER 68 HN SER 68 16.717 -0.174 21.181 533 HA SER 68 HA SER 68 15.213 1.731 19.601 534 1HB SER 68 HB2 SER 68 17.696 2.099 21.280 535 2HB SER 68 HB1 SER 68 16.696 3.390 20.606 536 HG SER 68 HG SER 68 14.948 2.102 21.802 537 H LYS 69 HN LYS 69 17.337 -0.523 18.701 538 HA LYS 69 HA LYS 69 18.906 1.107 16.900 539 1HB LYS 69 HB2 LYS 69 18.860 -1.826 17.546 540 2HB LYS 69 HB1 LYS 69 19.899 -1.099 16.346 541 1HG LYS 69 HG2 LYS 69 19.910 -0.301 19.232 542 2HG LYS 69 HG1 LYS 69 21.002 -1.531 18.601 543 1HD LYS 69 HD2 LYS 69 21.795 0.201 16.957 544 2HD LYS 69 HD1 LYS 69 20.814 1.375 17.836 545 1HE LYS 69 HE2 LYS 69 22.106 0.968 19.854 546 2HE LYS 69 HE1 LYS 69 23.031 -0.280 19.020 547 1HZ LYS 69 HZ1 LYS 69 22.970 2.583 18.272 548 2HZ LYS 69 HZ2 LYS 69 23.861 1.388 17.499 549 3HZ LYS 69 HZ3 LYS 69 24.239 1.826 19.080 550 H THR 70 HN THR 70 18.982 0.331 14.571 551 HA THR 70 HA THR 70 16.399 -0.578 13.664 552 HB THR 70 HB THR 70 17.236 0.467 11.559 553 HG1 THR 70 HG1 THR 70 18.924 2.214 12.242 554 1HG2 THR 70 HG21 THR 70 16.910 2.309 13.936 555 2HG2 THR 70 HG22 THR 70 15.601 1.641 12.962 556 3HG2 THR 70 HG23 THR 70 16.729 2.795 12.251 557 H VAL 71 HN VAL 71 16.612 -1.890 11.596 558 HA VAL 71 HA VAL 71 18.459 -4.006 11.903 559 HB VAL 71 HB VAL 71 17.006 -3.119 9.373 560 1HG1 VAL 71 HG11 VAL 71 17.272 -5.446 8.620 561 2HG1 VAL 71 HG12 VAL 71 18.211 -5.796 10.067 562 3HG1 VAL 71 HG13 VAL 71 18.830 -4.654 8.871 563 1HG2 VAL 71 HG21 VAL 71 16.171 -5.128 11.467 564 2HG2 VAL 71 HG22 VAL 71 15.318 -4.813 9.960 565 3HG2 VAL 71 HG23 VAL 71 15.434 -3.551 11.187 566 H LYS 72 HN LYS 72 18.410 -1.068 10.075 567 HA LYS 72 HA LYS 72 20.638 -1.185 8.464 568 1HB LYS 72 HB2 LYS 72 18.970 0.577 8.379 569 2HB LYS 72 HB1 LYS 72 19.475 1.154 9.955 570 1HG LYS 72 HG2 LYS 72 21.683 1.712 9.007 571 2HG LYS 72 HG1 LYS 72 21.096 1.210 7.419 572 1HD LYS 72 HD2 LYS 72 19.345 2.882 7.518 573 2HD LYS 72 HD1 LYS 72 19.882 3.376 9.123 574 1HE LYS 72 HE2 LYS 72 22.065 4.011 8.156 575 2HE LYS 72 HE1 LYS 72 21.452 3.582 6.559 576 1HZ LYS 72 HZ1 LYS 72 19.750 5.286 6.798 577 2HZ LYS 72 HZ2 LYS 72 21.304 5.942 6.985 578 3HZ LYS 72 HZ3 LYS 72 20.351 5.670 8.339 579 H ASP 73 HN ASP 73 20.448 -0.451 11.933 580 HA ASP 73 HA ASP 73 23.027 0.707 12.151 581 1HB ASP 73 HB2 ASP 73 21.196 0.986 13.853 582 2HB ASP 73 HB1 ASP 73 21.505 -0.665 14.378 583 H TYR 74 HN TYR 74 21.926 -2.633 12.366 584 HA TYR 74 HA TYR 74 24.651 -3.458 12.885 585 1HB TYR 74 HB2 TYR 74 22.018 -4.876 13.153 586 2HB TYR 74 HB1 TYR 74 23.548 -5.750 13.174 587 HD1 TYR 74 HD1 TYR 74 25.101 -5.489 15.009 588 HD2 TYR 74 HD2 TYR 74 21.413 -3.377 15.001 589 HE1 TYR 74 HE1 TYR 74 25.442 -4.905 17.364 590 HE2 TYR 74 HE2 TYR 74 21.736 -2.795 17.361 591 HH TYR 74 HH TYR 74 23.057 -3.561 19.389 592 H ARG 75 HN ARG 75 22.971 -2.684 10.316 593 HA ARG 75 HA ARG 75 23.957 -4.784 8.599 594 1HB ARG 75 HB2 ARG 75 21.855 -2.749 8.543 595 2HB ARG 75 HB1 ARG 75 22.680 -2.997 7.015 596 1HG ARG 75 HG2 ARG 75 21.458 -5.243 8.620 597 2HG ARG 75 HG1 ARG 75 20.557 -4.332 7.402 598 1HD ARG 75 HD2 ARG 75 23.135 -5.815 6.883 599 2HD ARG 75 HD1 ARG 75 21.520 -6.418 6.483 600 HE ARG 75 HE ARG 75 21.306 -4.317 5.142 601 1HH1 ARG 75 HH11 ARG 75 24.431 -5.984 5.484 602 2HH1 ARG 75 HH12 ARG 75 25.108 -5.277 4.103 603 1HH2 ARG 75 HH21 ARG 75 22.234 -3.405 3.256 604 2HH2 ARG 75 HH22 ARG 75 23.828 -3.746 2.766 605 H SER 76 HN SER 76 25.322 -4.224 6.831 606 HA SER 76 HA SER 76 26.990 -1.977 7.386 607 1HB SER 76 HB2 SER 76 28.333 -3.120 5.541 608 2HB SER 76 HB1 SER 76 28.131 -4.027 7.037 609 HG SER 76 HG SER 76 27.761 -5.263 5.152 610 HA PRO 77 HA PRO 77 25.549 0.716 4.113 611 1HB PRO 77 HB2 PRO 77 28.191 0.466 2.767 612 2HB PRO 77 HB1 PRO 77 27.314 1.924 3.248 613 1HG PRO 77 HG2 PRO 77 29.403 1.133 4.661 614 2HG PRO 77 HG1 PRO 77 27.943 1.723 5.478 615 1HD PRO 77 HD2 PRO 77 28.895 -1.081 5.100 616 2HD PRO 77 HD1 PRO 77 28.157 -0.325 6.529 617 H VAL 78 HN VAL 78 25.264 0.916 1.752 618 HA VAL 78 HA VAL 78 24.232 0.208 0.002 619 HB VAL 78 HB VAL 78 26.457 -0.144 -0.941 620 1HG1 VAL 78 HG11 VAL 78 27.478 -2.357 -1.193 621 2HG1 VAL 78 HG12 VAL 78 26.235 -3.039 -0.141 622 3HG1 VAL 78 HG13 VAL 78 27.380 -1.860 0.498 623 1HG2 VAL 78 HG21 VAL 78 24.590 -0.488 -2.402 624 2HG2 VAL 78 HG22 VAL 78 24.461 -2.173 -1.900 625 3HG2 VAL 78 HG23 VAL 78 25.866 -1.634 -2.816 626 H SER 79 HN SER 79 22.415 -0.452 -0.074 627 HA SER 79 HA SER 79 21.463 -2.492 1.566 628 1HB SER 79 HB2 SER 79 20.093 -1.108 -0.740 629 2HB SER 79 HB1 SER 79 19.292 -2.085 0.497 630 HG SER 79 HG SER 79 20.578 -0.557 1.938 631 H ASN 80 HN ASN 80 21.727 -4.494 1.350 632 HA ASN 80 HA ASN 80 22.278 -5.735 -1.208 633 1HB ASN 80 HB2 ASN 80 23.887 -6.077 0.583 634 2HB ASN 80 HB1 ASN 80 22.617 -6.615 1.665 635 1HD2 ASN 80 HD21 ASN 80 21.899 -8.688 1.520 636 2HD2 ASN 80 HD22 ASN 80 22.664 -9.888 0.558 637 H LEU 81 HN LEU 81 20.709 -7.079 -2.210 638 HA LEU 81 HA LEU 81 18.177 -7.176 -1.176 639 1HB LEU 81 HB2 LEU 81 19.603 -8.531 -3.366 640 2HB LEU 81 HB1 LEU 81 17.891 -8.539 -3.122 641 HG LEU 81 HG LEU 81 19.517 -6.063 -3.742 642 1HD1 LEU 81 HD11 LEU 81 19.388 -7.566 -5.648 643 2HD1 LEU 81 HD12 LEU 81 18.409 -6.123 -5.911 644 3HD1 LEU 81 HD13 LEU 81 17.634 -7.646 -5.480 645 1HD2 LEU 81 HD21 LEU 81 17.343 -4.979 -4.033 646 2HD2 LEU 81 HD22 LEU 81 17.540 -5.567 -2.385 647 3HD2 LEU 81 HD23 LEU 81 16.530 -6.458 -3.527 648 H ALA 82 HN ALA 82 17.081 -9.307 -1.189 649 HA ALA 82 HA ALA 82 18.496 -10.949 0.610 650 1HB ALA 82 HB1 ALA 82 16.250 -10.278 1.214 651 2HB ALA 82 HB2 ALA 82 16.373 -12.041 1.109 652 3HB ALA 82 HB3 ALA 82 15.604 -11.128 -0.187 653 H GLY 83 HN GLY 83 19.920 -11.712 -0.986 654 1HA GLY 83 HA2 GLY 83 18.949 -13.723 -2.852 655 2HA GLY 83 HA1 GLY 83 20.647 -13.327 -2.540 656 H ALA 84 HN ALA 84 20.513 -13.401 0.223 657 HA ALA 84 HA ALA 84 20.071 -16.224 0.813 658 1HB ALA 84 HB1 ALA 84 22.420 -15.539 1.033 659 2HB ALA 84 HB2 ALA 84 21.727 -15.849 2.626 660 3HB ALA 84 HB3 ALA 84 21.942 -14.192 2.064 661 H VAL 85 HN VAL 85 18.970 -16.586 2.811 662 HA VAL 85 HA VAL 85 17.235 -14.363 3.494 663 HB VAL 85 HB VAL 85 17.248 -17.142 4.692 664 1HG1 VAL 85 HG11 VAL 85 14.938 -16.632 5.314 665 2HG1 VAL 85 HG12 VAL 85 15.109 -15.023 4.620 666 3HG1 VAL 85 HG13 VAL 85 16.074 -15.483 6.025 667 1HG2 VAL 85 HG21 VAL 85 15.406 -17.680 3.137 668 2HG2 VAL 85 HG22 VAL 85 16.911 -17.330 2.291 669 3HG2 VAL 85 HG23 VAL 85 15.635 -16.116 2.356 670 H THR 86 HN THR 86 17.427 -13.191 5.362 671 HA THR 86 HA THR 86 19.965 -13.476 6.657 672 HB THR 86 HB THR 86 17.727 -11.474 7.089 673 HG1 THR 86 HG1 THR 86 19.160 -11.806 5.018 674 1HG2 THR 86 HG21 THR 86 19.301 -11.605 8.997 675 2HG2 THR 86 HG22 THR 86 19.479 -10.079 8.129 676 3HG2 THR 86 HG23 THR 86 20.655 -11.373 7.889 677 H THR 87 HN THR 87 20.230 -14.706 8.363 678 HA THR 87 HA THR 87 17.865 -15.624 9.785 679 HB THR 87 HB THR 87 20.686 -16.722 9.789 680 HG1 THR 87 HG1 THR 87 19.512 -16.745 7.748 681 1HG2 THR 87 HG21 THR 87 18.045 -17.914 10.692 682 2HG2 THR 87 HG22 THR 87 19.347 -17.375 11.754 683 3HG2 THR 87 HG23 THR 87 19.596 -18.753 10.682 684 H MET 88 HN MET 88 17.463 -14.609 11.653 685 HA MET 88 HA MET 88 19.749 -13.667 13.213 686 1HB MET 88 HB2 MET 88 16.854 -12.803 13.304 687 2HB MET 88 HB1 MET 88 18.032 -12.345 14.521 688 1HG MET 88 HG2 MET 88 19.368 -11.240 12.789 689 2HG MET 88 HG1 MET 88 18.148 -11.676 11.591 690 1HE MET 88 HE1 MET 88 17.731 -7.785 12.051 691 2HE MET 88 HE2 MET 88 18.116 -9.082 10.917 692 3HE MET 88 HE3 MET 88 19.243 -8.676 12.209 693 H HIS 89 HN HIS 89 20.010 -14.311 15.266 694 HA HIS 89 HA HIS 89 18.563 -16.759 15.870 695 1HB HIS 89 HB2 HIS 89 21.117 -15.665 17.073 696 2HB HIS 89 HB1 HIS 89 20.357 -17.182 17.537 697 HD1 HIS 89 HD1 HIS 89 23.224 -16.489 16.000 698 HD2 HIS 89 HD2 HIS 89 19.833 -18.387 14.537 699 HE1 HIS 89 HE1 HIS 89 24.004 -17.874 14.083 700 HE2 HIS 89 HE2 HIS 89 22.015 -19.262 13.498 701 H VAL 90 HN VAL 90 17.281 -16.966 17.513 702 HA VAL 90 HA VAL 90 16.790 -14.577 19.198 703 HB VAL 90 HB VAL 90 14.923 -16.865 18.595 704 1HG1 VAL 90 HG11 VAL 90 14.422 -14.178 19.848 705 2HG1 VAL 90 HG12 VAL 90 14.442 -15.738 20.670 706 3HG1 VAL 90 HG13 VAL 90 13.187 -15.382 19.483 707 1HG2 VAL 90 HG21 VAL 90 15.316 -15.692 16.511 708 2HG2 VAL 90 HG22 VAL 90 14.982 -14.148 17.289 709 3HG2 VAL 90 HG23 VAL 90 13.693 -15.338 17.106 710 H ILE 91 HN ILE 91 17.043 -14.655 21.122 711 HA ILE 91 HA ILE 91 17.840 -17.153 22.399 712 HB ILE 91 HB ILE 91 18.077 -14.276 23.068 713 1HG1 ILE 91 HG12 ILE 91 20.174 -16.362 22.475 714 2HG1 ILE 91 HG11 ILE 91 19.695 -15.004 21.469 715 1HG2 ILE 91 HG21 ILE 91 19.353 -14.979 25.153 716 2HG2 ILE 91 HG22 ILE 91 18.936 -16.655 24.793 717 3HG2 ILE 91 HG23 ILE 91 17.668 -15.499 25.192 718 1HD1 ILE 91 HD11 ILE 91 21.077 -14.816 24.139 719 2HD1 ILE 91 HD12 ILE 91 20.611 -13.456 23.115 720 3HD1 ILE 91 HD13 ILE 91 21.827 -14.608 22.556 721 H ILE 92 HN ILE 92 16.511 -18.153 23.530 722 HA ILE 92 HA ILE 92 13.922 -17.012 24.073 723 HB ILE 92 HB ILE 92 14.994 -19.810 24.478 724 1HG1 ILE 92 HG12 ILE 92 14.844 -19.191 22.109 725 2HG1 ILE 92 HG11 ILE 92 13.659 -20.427 22.519 726 1HG2 ILE 92 HG21 ILE 92 12.187 -18.782 24.701 727 2HG2 ILE 92 HG22 ILE 92 13.212 -19.338 26.027 728 3HG2 ILE 92 HG23 ILE 92 12.661 -20.483 24.792 729 1HD1 ILE 92 HD11 ILE 92 13.138 -17.485 22.114 730 2HD1 ILE 92 HD12 ILE 92 11.953 -18.662 22.665 731 3HD1 ILE 92 HD13 ILE 92 12.647 -18.821 21.060 732 H GLN 93 HN GLN 93 13.869 -15.791 25.838 733 HA GLN 93 HA GLN 93 14.599 -17.165 28.242 734 1HB GLN 93 HB2 GLN 93 15.387 -15.037 29.252 735 2HB GLN 93 HB1 GLN 93 16.369 -15.587 27.902 736 1HG GLN 93 HG2 GLN 93 15.447 -13.924 26.464 737 2HG GLN 93 HG1 GLN 93 14.268 -13.453 27.689 738 1HE2 GLN 93 HE21 GLN 93 17.622 -13.355 26.765 739 2HE2 GLN 93 HE22 GLN 93 18.087 -12.130 27.883 740 H ALA 94 HN ALA 94 13.057 -17.251 29.570 741 HA ALA 94 HA ALA 94 10.531 -16.056 28.882 742 1HB ALA 94 HB1 ALA 94 11.319 -17.898 31.140 743 2HB ALA 94 HB2 ALA 94 10.652 -18.391 29.583 744 3HB ALA 94 HB3 ALA 94 9.672 -17.448 30.702 745 HA PRO 95 HA PRO 95 10.817 -12.825 31.980 746 1HB PRO 95 HB2 PRO 95 8.040 -13.261 32.685 747 2HB PRO 95 HB1 PRO 95 8.759 -11.840 31.935 748 1HG PRO 95 HG2 PRO 95 7.080 -13.530 30.596 749 2HG PRO 95 HG1 PRO 95 8.343 -12.576 29.808 750 1HD PRO 95 HD2 PRO 95 8.286 -15.468 30.474 751 2HD PRO 95 HD1 PRO 95 9.067 -14.632 29.120 752 H VAL 96 HN VAL 96 11.422 -13.078 34.054 753 HA VAL 96 HA VAL 96 10.984 -15.688 35.126 754 HB VAL 96 HB VAL 96 12.648 -13.472 36.284 755 1HG1 VAL 96 HG11 VAL 96 11.992 -15.062 37.990 756 2HG1 VAL 96 HG12 VAL 96 13.710 -15.262 37.626 757 3HG1 VAL 96 HG13 VAL 96 12.532 -16.407 36.985 758 1HG2 VAL 96 HG21 VAL 96 14.572 -14.722 35.399 759 2HG2 VAL 96 HG22 VAL 96 13.488 -14.176 34.116 760 3HG2 VAL 96 HG23 VAL 96 13.464 -15.861 34.635 761 H THR 97 HN THR 97 8.743 -15.514 35.445 762 HA THR 97 HA THR 97 7.885 -13.926 37.615 763 HB THR 97 HB THR 97 5.774 -15.320 37.171 764 HG1 THR 97 HG1 THR 97 5.714 -16.373 35.160 765 1HG2 THR 97 HG21 THR 97 6.866 -13.573 34.955 766 2HG2 THR 97 HG22 THR 97 6.038 -12.998 36.400 767 3HG2 THR 97 HG23 THR 97 5.166 -13.962 35.205 768 H GLU 98 HN GLU 98 9.274 -14.669 39.129 769 HA GLU 98 HA GLU 98 9.292 -17.484 39.826 770 1HB GLU 98 HB2 GLU 98 11.408 -16.310 39.566 771 2HB GLU 98 HB1 GLU 98 10.927 -15.151 40.791 772 1HG GLU 98 HG2 GLU 98 10.876 -16.971 42.437 773 2HG GLU 98 HG1 GLU 98 11.443 -18.077 41.189 774 H LYS 99 HN LYS 99 8.620 -18.244 41.735 775 HA LYS 99 HA LYS 99 7.554 -18.508 43.628 776 1HB LYS 99 HB2 LYS 99 8.962 -16.811 44.644 777 2HB LYS 99 HB1 LYS 99 7.923 -15.526 44.047 778 1HG LYS 99 HG2 LYS 99 6.116 -16.278 45.496 779 2HG LYS 99 HG1 LYS 99 7.092 -17.639 46.044 780 1HD LYS 99 HD2 LYS 99 7.779 -14.720 46.452 781 2HD LYS 99 HD1 LYS 99 7.066 -15.772 47.676 782 1HE LYS 99 HE2 LYS 99 9.040 -17.223 47.568 783 2HE LYS 99 HE1 LYS 99 9.751 -16.168 46.349 784 1HZ LYS 99 HZ1 LYS 99 9.786 -14.385 48.003 785 2HZ LYS 99 HZ2 LYS 99 10.651 -15.732 48.525 786 3HZ LYS 99 HZ3 LYS 99 9.117 -15.423 49.151 787 H GLU 100 HN GLU 100 5.639 -19.151 43.585 788 HA GLU 100 HA GLU 100 3.667 -18.174 41.882 789 1HB GLU 100 HB2 GLU 100 3.465 -20.013 44.264 790 2HB GLU 100 HB1 GLU 100 2.197 -19.771 43.067 791 1HG GLU 100 HG2 GLU 100 3.541 -20.693 41.335 792 2HG GLU 100 HG1 GLU 100 4.955 -20.724 42.380 793 H LYS 101 HN LYS 101 2.457 -16.484 42.063 794 HA LYS 101 HA LYS 101 1.942 -15.484 44.704 795 1HB LYS 101 HB2 LYS 101 1.483 -13.217 43.447 796 2HB LYS 101 HB1 LYS 101 3.108 -13.710 43.860 797 1HG LYS 101 HG2 LYS 101 3.092 -12.764 41.641 798 2HG LYS 101 HG1 LYS 101 3.434 -14.482 41.538 799 1HD LYS 101 HD2 LYS 101 1.109 -14.888 40.862 800 2HD LYS 101 HD1 LYS 101 0.778 -13.158 40.975 801 1HE LYS 101 HE2 LYS 101 2.435 -12.715 39.256 802 2HE LYS 101 HE1 LYS 101 2.806 -14.435 39.138 803 1HZ LYS 101 HZ1 LYS 101 0.522 -14.812 38.415 804 2HZ LYS 101 HZ2 LYS 101 1.311 -13.746 37.378 805 3HZ LYS 101 HZ3 LYS 101 0.199 -13.163 38.498 Start of MODEL 9 1 H GLU 1 HT1 GLU 1 9.102 -13.629 1.764 2 HA GLU 1 HA GLU 1 8.416 -14.111 -1.027 3 1HB GLU 1 HB2 GLU 1 6.830 -15.171 0.637 4 2HB GLU 1 HB1 GLU 1 6.609 -13.603 1.369 5 1HG GLU 1 HG2 GLU 1 5.876 -14.173 -1.497 6 2HG GLU 1 HG1 GLU 1 4.777 -14.465 -0.160 7 H ALA 2 HN ALA 2 9.512 -12.403 -1.841 8 HA ALA 2 HA ALA 2 8.529 -9.787 -1.330 9 1HB ALA 2 HB1 ALA 2 10.661 -8.817 -0.604 10 2HB ALA 2 HB2 ALA 2 11.376 -10.428 -0.549 11 3HB ALA 2 HB3 ALA 2 10.078 -10.003 0.565 12 H GLU 3 HN GLU 3 9.949 -8.183 -2.681 13 HA GLU 3 HA GLU 3 11.109 -9.393 -5.012 14 1HB GLU 3 HB2 GLU 3 8.989 -7.241 -4.975 15 2HB GLU 3 HB1 GLU 3 9.795 -7.860 -6.401 16 1HG GLU 3 HG2 GLU 3 8.698 -9.963 -6.176 17 2HG GLU 3 HG1 GLU 3 8.016 -9.500 -4.619 18 H VAL 4 HN VAL 4 11.600 -7.118 -6.328 19 HA VAL 4 HA VAL 4 13.354 -5.556 -4.715 20 HB VAL 4 HB VAL 4 12.182 -4.945 -7.475 21 1HG1 VAL 4 HG11 VAL 4 14.551 -3.692 -6.091 22 2HG1 VAL 4 HG12 VAL 4 13.005 -2.902 -6.403 23 3HG1 VAL 4 HG13 VAL 4 14.043 -3.374 -7.749 24 1HG2 VAL 4 HG21 VAL 4 14.845 -6.100 -6.698 25 2HG2 VAL 4 HG22 VAL 4 14.321 -5.738 -8.343 26 3HG2 VAL 4 HG23 VAL 4 13.504 -6.990 -7.404 27 H HIS 5 HN HIS 5 12.994 -3.231 -4.156 28 HA HIS 5 HA HIS 5 11.914 -1.595 -3.206 29 1HB HIS 5 HB2 HIS 5 9.316 -2.742 -4.288 30 2HB HIS 5 HB1 HIS 5 9.549 -1.216 -3.428 31 HD1 HIS 5 HD1 HIS 5 9.968 -2.805 -6.779 32 HD2 HIS 5 HD2 HIS 5 10.728 0.847 -4.944 33 HE1 HIS 5 HE1 HIS 5 10.462 -1.209 -8.637 34 HE2 HIS 5 HE2 HIS 5 10.452 1.021 -7.477 35 H ASN 6 HN ASN 6 11.497 -4.786 -2.541 36 HA ASN 6 HA ASN 6 10.474 -4.201 0.135 37 1HB ASN 6 HB2 ASN 6 11.106 -6.862 -1.189 38 2HB ASN 6 HB1 ASN 6 10.433 -6.672 0.425 39 1HD2 ASN 6 HD21 ASN 6 8.195 -6.109 0.629 40 2HD2 ASN 6 HD22 ASN 6 7.152 -6.218 -0.725 41 H GLN 7 HN GLN 7 11.871 -4.145 1.804 42 HA GLN 7 HA GLN 7 14.623 -3.985 1.138 43 1HB GLN 7 HB2 GLN 7 13.248 -3.668 3.780 44 2HB GLN 7 HB1 GLN 7 14.939 -3.318 3.480 45 1HG GLN 7 HG2 GLN 7 13.738 -1.233 3.504 46 2HG GLN 7 HG1 GLN 7 14.223 -1.563 1.851 47 1HE2 GLN 7 HE21 GLN 7 12.660 -0.317 0.958 48 2HE2 GLN 7 HE22 GLN 7 10.981 -0.686 0.971 49 H LEU 8 HN LEU 8 14.028 -5.298 4.133 50 HA LEU 8 HA LEU 8 15.340 -7.779 3.208 51 1HB LEU 8 HB2 LEU 8 15.667 -6.381 5.833 52 2HB LEU 8 HB1 LEU 8 16.259 -7.966 5.479 53 HG LEU 8 HG LEU 8 17.729 -6.905 3.687 54 1HD1 LEU 8 HD11 LEU 8 18.253 -4.530 3.908 55 2HD1 LEU 8 HD12 LEU 8 16.943 -4.354 5.076 56 3HD1 LEU 8 HD13 LEU 8 16.584 -4.801 3.408 57 1HD2 LEU 8 HD21 LEU 8 18.189 -6.107 6.549 58 2HD2 LEU 8 HD22 LEU 8 19.421 -6.185 5.285 59 3HD2 LEU 8 HD23 LEU 8 18.607 -7.653 5.814 60 H GLU 9 HN GLU 9 14.473 -9.691 3.846 61 HA GLU 9 HA GLU 9 12.152 -9.529 5.603 62 1HB GLU 9 HB2 GLU 9 13.131 -11.911 4.029 63 2HB GLU 9 HB1 GLU 9 11.712 -11.804 5.011 64 1HG GLU 9 HG2 GLU 9 10.785 -10.104 3.479 65 2HG GLU 9 HG1 GLU 9 12.174 -10.367 2.419 66 H ILE 10 HN ILE 10 12.212 -10.450 7.513 67 HA ILE 10 HA ILE 10 14.698 -11.861 8.207 68 HB ILE 10 HB ILE 10 13.151 -10.009 10.036 69 1HG1 ILE 10 HG12 ILE 10 15.887 -9.629 8.772 70 2HG1 ILE 10 HG11 ILE 10 14.423 -8.798 8.269 71 1HG2 ILE 10 HG21 ILE 10 15.025 -10.344 11.604 72 2HG2 ILE 10 HG22 ILE 10 15.734 -11.510 10.487 73 3HG2 ILE 10 HG23 ILE 10 14.181 -11.852 11.246 74 1HD1 ILE 10 HD11 ILE 10 15.757 -8.574 10.948 75 2HD1 ILE 10 HD12 ILE 10 14.302 -7.712 10.441 76 3HD1 ILE 10 HD13 ILE 10 15.844 -7.388 9.643 77 H LYS 11 HN LYS 11 14.412 -13.714 9.079 78 HA LYS 11 HA LYS 11 11.801 -14.253 10.271 79 1HB LYS 11 HB2 LYS 11 11.932 -16.632 9.800 80 2HB LYS 11 HB1 LYS 11 12.126 -15.746 8.310 81 1HG LYS 11 HG2 LYS 11 14.483 -16.256 8.261 82 2HG LYS 11 HG1 LYS 11 14.384 -16.972 9.881 83 1HD LYS 11 HD2 LYS 11 12.775 -18.640 9.030 84 2HD LYS 11 HD1 LYS 11 12.941 -17.959 7.420 85 1HE LYS 11 HE2 LYS 11 15.180 -19.205 9.019 86 2HE LYS 11 HE1 LYS 11 14.261 -20.033 7.771 87 1HZ LYS 11 HZ1 LYS 11 16.060 -17.695 7.409 88 2HZ LYS 11 HZ2 LYS 11 15.072 -18.353 6.195 89 3HZ LYS 11 HZ3 LYS 11 16.293 -19.269 6.858 90 H PHE 12 HN PHE 12 11.886 -15.774 12.114 91 HA PHE 12 HA PHE 12 14.334 -15.169 13.626 92 1HB PHE 12 HB2 PHE 12 11.539 -15.545 14.710 93 2HB PHE 12 HB1 PHE 12 12.963 -15.050 15.602 94 HD1 PHE 12 HD1 PHE 12 10.178 -13.938 13.635 95 HD2 PHE 12 HD2 PHE 12 14.054 -12.854 15.011 96 HE1 PHE 12 HE1 PHE 12 9.683 -11.589 13.145 97 HE2 PHE 12 HE2 PHE 12 13.565 -10.499 14.530 98 HZ PHE 12 HZ PHE 12 11.381 -9.858 13.596 99 H ARG 13 HN ARG 13 15.423 -16.863 14.436 100 HA ARG 13 HA ARG 13 13.995 -19.421 14.557 101 1HB ARG 13 HB2 ARG 13 15.637 -19.530 12.763 102 2HB ARG 13 HB1 ARG 13 16.902 -18.960 13.840 103 1HG ARG 13 HG2 ARG 13 16.656 -21.002 15.190 104 2HG ARG 13 HG1 ARG 13 15.420 -21.572 14.076 105 1HD ARG 13 HD2 ARG 13 18.247 -20.918 13.269 106 2HD ARG 13 HD1 ARG 13 17.694 -22.535 13.697 107 HE ARG 13 HE ARG 13 16.003 -21.615 11.724 108 1HH1 ARG 13 HH11 ARG 13 19.471 -22.216 12.004 109 2HH1 ARG 13 HH12 ARG 13 19.662 -22.761 10.402 110 1HH2 ARG 13 HH21 ARG 13 16.255 -22.377 9.522 111 2HH2 ARG 13 HH22 ARG 13 17.789 -22.851 8.962 112 H LEU 14 HN LEU 14 13.941 -20.377 16.417 113 HA LEU 14 HA LEU 14 15.383 -19.256 18.691 114 1HB LEU 14 HB2 LEU 14 13.216 -21.363 18.535 115 2HB LEU 14 HB1 LEU 14 13.976 -20.866 20.019 116 HG LEU 14 HG LEU 14 12.995 -18.581 19.713 117 1HD1 LEU 14 HD11 LEU 14 12.711 -18.552 17.301 118 2HD1 LEU 14 HD12 LEU 14 11.184 -18.240 18.126 119 3HD1 LEU 14 HD13 LEU 14 11.494 -19.823 17.416 120 1HD2 LEU 14 HD21 LEU 14 11.901 -20.191 21.135 121 2HD2 LEU 14 HD22 LEU 14 11.082 -20.893 19.743 122 3HD2 LEU 14 HD23 LEU 14 10.688 -19.255 20.252 123 H THR 15 HN THR 15 16.255 -20.943 20.301 124 HA THR 15 HA THR 15 18.296 -22.376 19.038 125 HB THR 15 HB THR 15 18.731 -23.247 21.347 126 HG1 THR 15 HG1 THR 15 17.140 -23.176 22.659 127 1HG2 THR 15 HG21 THR 15 18.309 -20.263 21.094 128 2HG2 THR 15 HG22 THR 15 19.741 -21.147 20.566 129 3HG2 THR 15 HG23 THR 15 19.344 -21.051 22.283 130 H ASP 16 HN ASP 16 15.129 -23.263 19.922 131 HA ASP 16 HA ASP 16 15.536 -26.124 19.967 132 1HB ASP 16 HB2 ASP 16 12.941 -24.590 19.663 133 2HB ASP 16 HB1 ASP 16 13.095 -26.298 20.036 134 H GLY 17 HN GLY 17 15.581 -23.901 17.521 135 1HA GLY 17 HA2 GLY 17 15.796 -24.336 15.259 136 2HA GLY 17 HA1 GLY 17 15.106 -25.939 15.509 137 H SER 18 HN SER 18 13.266 -23.800 17.141 138 HA SER 18 HA SER 18 11.036 -23.988 15.398 139 1HB SER 18 HB2 SER 18 11.449 -22.149 17.758 140 2HB SER 18 HB1 SER 18 9.924 -22.773 17.132 141 HG SER 18 HG SER 18 10.647 -24.886 17.742 142 H ASP 19 HN ASP 19 10.495 -22.505 13.772 143 HA ASP 19 HA ASP 19 11.932 -19.983 13.840 144 1HB ASP 19 HB2 ASP 19 11.760 -19.929 11.449 145 2HB ASP 19 HB1 ASP 19 12.679 -21.344 11.960 146 H ILE 20 HN ILE 20 10.895 -18.224 13.224 147 HA ILE 20 HA ILE 20 7.962 -18.317 13.172 148 HB ILE 20 HB ILE 20 9.800 -15.984 13.852 149 1HG1 ILE 20 HG12 ILE 20 8.112 -17.694 15.700 150 2HG1 ILE 20 HG11 ILE 20 9.868 -17.736 15.588 151 1HG2 ILE 20 HG21 ILE 20 7.753 -14.841 14.597 152 2HG2 ILE 20 HG22 ILE 20 6.797 -16.233 14.097 153 3HG2 ILE 20 HG23 ILE 20 7.657 -15.279 12.889 154 1HD1 ILE 20 HD11 ILE 20 8.201 -15.401 16.509 155 2HD1 ILE 20 HD12 ILE 20 9.960 -15.428 16.405 156 3HD1 ILE 20 HD13 ILE 20 9.126 -16.493 17.541 157 H GLY 21 HN GLY 21 6.958 -17.290 11.457 158 1HA GLY 21 HA2 GLY 21 8.059 -17.502 8.975 159 2HA GLY 21 HA1 GLY 21 6.640 -16.558 9.345 160 HA PRO 22 HA PRO 22 10.427 -13.799 8.447 161 1HB PRO 22 HB2 PRO 22 10.447 -14.069 5.604 162 2HB PRO 22 HB1 PRO 22 11.721 -14.518 6.724 163 1HG PRO 22 HG2 PRO 22 10.220 -16.317 5.233 164 2HG PRO 22 HG1 PRO 22 11.114 -16.728 6.699 165 1HD PRO 22 HD2 PRO 22 8.210 -16.208 6.322 166 2HD PRO 22 HD1 PRO 22 9.042 -17.341 7.410 167 H LYS 23 HN LYS 23 10.022 -11.758 8.116 168 HA LYS 23 HA LYS 23 7.824 -10.956 6.340 169 1HB LYS 23 HB2 LYS 23 8.298 -9.875 9.125 170 2HB LYS 23 HB1 LYS 23 7.238 -9.126 7.939 171 1HG LYS 23 HG2 LYS 23 5.860 -11.084 7.887 172 2HG LYS 23 HG1 LYS 23 7.006 -11.877 8.968 173 1HD LYS 23 HD2 LYS 23 5.025 -11.114 10.230 174 2HD LYS 23 HD1 LYS 23 6.445 -10.202 10.725 175 1HE LYS 23 HE2 LYS 23 5.777 -8.325 9.331 176 2HE LYS 23 HE1 LYS 23 4.405 -9.243 8.710 177 1HZ LYS 23 HZ1 LYS 23 3.501 -9.278 10.975 178 2HZ LYS 23 HZ2 LYS 23 3.659 -7.742 10.378 179 3HZ LYS 23 HZ3 LYS 23 4.750 -8.277 11.528 180 H ALA 24 HN ALA 24 7.968 -8.753 5.846 181 HA ALA 24 HA ALA 24 10.774 -8.136 5.246 182 1HB ALA 24 HB1 ALA 24 8.318 -6.720 4.209 183 2HB ALA 24 HB2 ALA 24 9.186 -8.005 3.367 184 3HB ALA 24 HB3 ALA 24 9.970 -6.453 3.666 185 H PHE 25 HN PHE 25 11.913 -6.804 6.356 186 HA PHE 25 HA PHE 25 10.581 -4.763 7.971 187 1HB PHE 25 HB2 PHE 25 13.243 -6.134 8.424 188 2HB PHE 25 HB1 PHE 25 12.547 -4.882 9.439 189 HD1 PHE 25 HD1 PHE 25 10.986 -5.437 11.139 190 HD2 PHE 25 HD2 PHE 25 12.164 -8.339 8.287 191 HE1 PHE 25 HE1 PHE 25 9.923 -7.205 12.484 192 HE2 PHE 25 HE2 PHE 25 11.110 -10.095 9.618 193 HZ PHE 25 HZ PHE 25 10.021 -9.574 11.677 194 HA PRO 26 HA PRO 26 12.814 -2.234 5.056 195 1HB PRO 26 HB2 PRO 26 11.624 -0.171 6.827 196 2HB PRO 26 HB1 PRO 26 11.586 -0.239 5.077 197 1HG PRO 26 HG2 PRO 26 9.418 -0.847 6.460 198 2HG PRO 26 HG1 PRO 26 9.874 -1.877 5.087 199 1HD PRO 26 HD2 PRO 26 10.311 -2.337 8.018 200 2HD PRO 26 HD1 PRO 26 9.727 -3.462 6.762 201 H ASP 27 HN ASP 27 14.687 -0.918 5.235 202 HA ASP 27 HA ASP 27 16.491 -1.091 7.303 203 1HB ASP 27 HB2 ASP 27 16.151 1.213 5.386 204 2HB ASP 27 HB1 ASP 27 17.557 0.913 6.373 205 H ALA 28 HN ALA 28 13.822 1.139 6.891 206 HA ALA 28 HA ALA 28 14.713 2.985 8.898 207 1HB ALA 28 HB1 ALA 28 13.378 3.730 6.980 208 2HB ALA 28 HB2 ALA 28 12.601 4.127 8.514 209 3HB ALA 28 HB3 ALA 28 12.020 2.764 7.559 210 H THR 29 HN THR 29 13.300 -0.034 9.076 211 HA THR 29 HA THR 29 11.684 0.497 11.396 212 HB THR 29 HB THR 29 12.571 -2.093 10.080 213 HG1 THR 29 HG1 THR 29 10.730 -0.299 9.514 214 1HG2 THR 29 HG21 THR 29 10.863 -3.210 11.458 215 2HG2 THR 29 HG22 THR 29 10.521 -1.686 12.277 216 3HG2 THR 29 HG23 THR 29 12.093 -2.467 12.481 217 H THR 30 HN THR 30 12.258 0.078 13.545 218 HA THR 30 HA THR 30 15.094 0.009 13.927 219 HB THR 30 HB THR 30 14.542 0.552 16.299 220 HG1 THR 30 HG1 THR 30 12.160 1.346 16.341 221 1HG2 THR 30 HG21 THR 30 13.777 2.844 15.837 222 2HG2 THR 30 HG22 THR 30 13.292 2.353 14.215 223 3HG2 THR 30 HG23 THR 30 14.998 2.335 14.669 224 H VAL 31 HN VAL 31 16.017 -1.300 15.638 225 HA VAL 31 HA VAL 31 15.216 -4.015 15.460 226 HB VAL 31 HB VAL 31 17.138 -2.638 17.354 227 1HG1 VAL 31 HG11 VAL 31 16.925 -5.594 16.660 228 2HG1 VAL 31 HG12 VAL 31 16.393 -4.890 18.179 229 3HG1 VAL 31 HG13 VAL 31 18.105 -4.875 17.758 230 1HG2 VAL 31 HG21 VAL 31 17.635 -4.099 14.767 231 2HG2 VAL 31 HG22 VAL 31 18.889 -3.462 15.838 232 3HG2 VAL 31 HG23 VAL 31 17.768 -2.363 15.043 233 H SER 32 HN SER 32 14.435 -1.422 17.637 234 HA SER 32 HA SER 32 13.200 -2.980 19.642 235 1HB SER 32 HB2 SER 32 12.528 -0.159 18.730 236 2HB SER 32 HB1 SER 32 11.936 -0.907 20.213 237 HG SER 32 HG SER 32 14.657 -0.470 19.540 238 H ALA 33 HN ALA 33 11.943 -1.488 16.637 239 HA ALA 33 HA ALA 33 9.322 -2.511 16.923 240 1HB ALA 33 HB1 ALA 33 9.023 -1.852 14.589 241 2HB ALA 33 HB2 ALA 33 10.769 -1.626 14.429 242 3HB ALA 33 HB3 ALA 33 9.838 -0.583 15.504 243 H LEU 34 HN LEU 34 12.304 -3.868 15.678 244 HA LEU 34 HA LEU 34 11.307 -6.013 14.265 245 1HB LEU 34 HB2 LEU 34 13.583 -5.189 14.113 246 2HB LEU 34 HB1 LEU 34 13.808 -5.445 15.829 247 HG LEU 34 HG LEU 34 13.675 -7.716 15.550 248 1HD1 LEU 34 HD11 LEU 34 13.808 -8.751 13.217 249 2HD1 LEU 34 HD12 LEU 34 13.560 -7.135 12.562 250 3HD1 LEU 34 HD13 LEU 34 12.289 -7.902 13.510 251 1HD2 LEU 34 HD21 LEU 34 15.735 -6.398 13.809 252 2HD2 LEU 34 HD22 LEU 34 15.838 -8.076 14.329 253 3HD2 LEU 34 HD23 LEU 34 15.838 -6.785 15.528 254 H LYS 35 HN LYS 35 12.292 -5.534 17.652 255 HA LYS 35 HA LYS 35 11.514 -8.092 18.536 256 1HB LYS 35 HB2 LYS 35 12.051 -5.517 20.016 257 2HB LYS 35 HB1 LYS 35 11.616 -7.013 20.839 258 1HG LYS 35 HG2 LYS 35 13.478 -8.104 20.101 259 2HG LYS 35 HG1 LYS 35 13.984 -6.794 18.977 260 1HD LYS 35 HD2 LYS 35 14.393 -5.455 21.017 261 2HD LYS 35 HD1 LYS 35 13.936 -6.859 22.008 262 1HE LYS 35 HE2 LYS 35 15.797 -8.085 20.879 263 2HE LYS 35 HE1 LYS 35 16.272 -6.558 20.133 264 1HZ LYS 35 HZ1 LYS 35 17.551 -6.962 22.121 265 2HZ LYS 35 HZ2 LYS 35 16.170 -7.173 23.029 266 3HZ LYS 35 HZ3 LYS 35 16.542 -5.645 22.451 267 H GLU 36 HN GLU 36 9.793 -5.011 18.358 268 HA GLU 36 HA GLU 36 7.433 -5.692 19.660 269 1HB GLU 36 HB2 GLU 36 7.788 -4.015 17.169 270 2HB GLU 36 HB1 GLU 36 6.333 -4.081 18.136 271 1HG GLU 36 HG2 GLU 36 9.004 -3.056 19.065 272 2HG GLU 36 HG1 GLU 36 7.642 -2.062 18.555 273 H THR 37 HN THR 37 8.465 -6.286 16.351 274 HA THR 37 HA THR 37 6.111 -7.447 15.353 275 HB THR 37 HB THR 37 8.978 -8.044 14.531 276 HG1 THR 37 HG1 THR 37 8.313 -5.774 14.425 277 1HG2 THR 37 HG21 THR 37 7.374 -9.682 13.646 278 2HG2 THR 37 HG22 THR 37 7.989 -8.653 12.352 279 3HG2 THR 37 HG23 THR 37 6.376 -8.377 13.007 280 H VAL 38 HN VAL 38 8.874 -8.832 17.048 281 HA VAL 38 HA VAL 38 8.157 -11.553 16.864 282 HB VAL 38 HB VAL 38 9.666 -10.184 19.122 283 1HG1 VAL 38 HG11 VAL 38 8.896 -12.403 19.755 284 2HG1 VAL 38 HG12 VAL 38 10.647 -12.385 19.556 285 3HG1 VAL 38 HG13 VAL 38 9.628 -13.089 18.303 286 1HG2 VAL 38 HG21 VAL 38 11.711 -10.869 17.946 287 2HG2 VAL 38 HG22 VAL 38 10.737 -9.768 16.971 288 3HG2 VAL 38 HG23 VAL 38 10.730 -11.494 16.619 289 H ILE 39 HN ILE 39 7.552 -9.115 19.343 290 HA ILE 39 HA ILE 39 6.082 -10.621 21.198 291 HB ILE 39 HB ILE 39 5.663 -7.690 20.509 292 1HG1 ILE 39 HG12 ILE 39 7.540 -8.944 22.510 293 2HG1 ILE 39 HG11 ILE 39 8.015 -8.197 20.990 294 1HG2 ILE 39 HG21 ILE 39 5.079 -9.223 23.046 295 2HG2 ILE 39 HG22 ILE 39 3.869 -8.503 21.965 296 3HG2 ILE 39 HG23 ILE 39 4.990 -7.481 22.882 297 1HD1 ILE 39 HD11 ILE 39 6.690 -6.809 23.299 298 2HD1 ILE 39 HD12 ILE 39 7.185 -6.050 21.781 299 3HD1 ILE 39 HD13 ILE 39 8.397 -6.742 22.870 300 H SER 40 HN SER 40 5.061 -8.923 18.309 301 HA SER 40 HA SER 40 2.292 -9.136 18.652 302 1HB SER 40 HB2 SER 40 3.227 -7.540 17.107 303 2HB SER 40 HB1 SER 40 3.944 -8.828 16.145 304 HG SER 40 HG SER 40 1.979 -9.432 15.441 305 H GLU 41 HN GLU 41 4.608 -11.382 17.057 306 HA GLU 41 HA GLU 41 2.414 -12.978 16.148 307 1HB GLU 41 HB2 GLU 41 5.377 -13.206 15.774 308 2HB GLU 41 HB1 GLU 41 4.139 -14.140 14.956 309 1HG GLU 41 HG2 GLU 41 4.583 -11.171 14.723 310 2HG GLU 41 HG1 GLU 41 4.946 -12.377 13.492 311 H TRP 42 HN TRP 42 4.641 -12.825 18.722 312 HA TRP 42 HA TRP 42 4.893 -15.575 19.349 313 1HB TRP 42 HB2 TRP 42 6.314 -13.572 20.131 314 2HB TRP 42 HB1 TRP 42 5.021 -13.238 21.265 315 HD1 TRP 42 HD1 TRP 42 4.837 -14.894 23.420 316 HE1 TRP 42 HE1 TRP 42 6.543 -16.532 24.436 317 HE3 TRP 42 HE3 TRP 42 8.101 -15.242 19.492 318 HZ2 TRP 42 HZ2 TRP 42 8.924 -17.824 23.667 319 HZ3 TRP 42 HZ3 TRP 42 10.067 -16.703 19.725 320 HH2 TRP 42 HH2 TRP 42 10.460 -17.963 21.779 321 HA PRO 43 HA PRO 43 0.712 -16.450 20.784 322 1HB PRO 43 HB2 PRO 43 2.281 -17.963 22.845 323 2HB PRO 43 HB1 PRO 43 0.875 -18.490 21.924 324 1HG PRO 43 HG2 PRO 43 3.266 -19.328 21.213 325 2HG PRO 43 HG1 PRO 43 2.116 -18.804 19.970 326 1HD PRO 43 HD2 PRO 43 4.523 -17.387 21.030 327 2HD PRO 43 HD1 PRO 43 3.845 -17.407 19.387 328 H ARG 44 HN ARG 44 -0.419 -15.042 21.954 329 HA ARG 44 HA ARG 44 0.784 -13.367 23.951 330 1HB ARG 44 HB2 ARG 44 -1.414 -12.337 24.168 331 2HB ARG 44 HB1 ARG 44 -1.054 -12.577 22.463 332 1HG ARG 44 HG2 ARG 44 -2.462 -14.560 22.425 333 2HG ARG 44 HG1 ARG 44 -2.777 -14.384 24.142 334 1HD ARG 44 HD2 ARG 44 -3.816 -12.169 23.637 335 2HD ARG 44 HD1 ARG 44 -3.624 -12.537 21.920 336 HE ARG 44 HE ARG 44 -4.960 -14.571 23.438 337 1HH1 ARG 44 HH11 ARG 44 -5.398 -11.703 21.434 338 2HH1 ARG 44 HH12 ARG 44 -7.042 -12.015 21.119 339 1HH2 ARG 44 HH21 ARG 44 -7.215 -14.972 23.027 340 2HH2 ARG 44 HH22 ARG 44 -8.117 -13.894 22.060 341 H GLU 45 HN GLU 45 -1.054 -16.231 23.922 342 HA GLU 45 HA GLU 45 -1.878 -16.129 26.691 343 1HB GLU 45 HB2 GLU 45 -3.296 -16.909 24.812 344 2HB GLU 45 HB1 GLU 45 -2.200 -18.252 24.582 345 1HG GLU 45 HG2 GLU 45 -2.796 -19.104 26.783 346 2HG GLU 45 HG1 GLU 45 -3.887 -17.734 27.014 347 H LYS 46 HN LYS 46 1.030 -16.759 25.300 348 HA LYS 46 HA LYS 46 1.843 -19.257 26.034 349 1HB LYS 46 HB2 LYS 46 3.988 -18.489 25.473 350 2HB LYS 46 HB1 LYS 46 2.944 -17.416 24.613 351 1HG LYS 46 HG2 LYS 46 4.337 -16.737 27.202 352 2HG LYS 46 HG1 LYS 46 4.823 -16.214 25.597 353 1HD LYS 46 HD2 LYS 46 2.755 -14.942 25.370 354 2HD LYS 46 HD1 LYS 46 2.201 -15.540 26.931 355 1HE LYS 46 HE2 LYS 46 4.591 -13.791 26.411 356 2HE LYS 46 HE1 LYS 46 3.074 -13.303 27.166 357 1HZ LYS 46 HZ1 LYS 46 5.068 -15.220 28.263 358 2HZ LYS 46 HZ2 LYS 46 3.578 -14.937 28.964 359 3HZ LYS 46 HZ3 LYS 46 4.706 -13.702 28.875 360 H GLU 47 HN GLU 47 2.645 -20.140 27.949 361 HA GLU 47 HA GLU 47 2.951 -18.292 30.068 362 1HB GLU 47 HB2 GLU 47 1.868 -21.069 30.300 363 2HB GLU 47 HB1 GLU 47 2.280 -20.047 31.645 364 1HG GLU 47 HG2 GLU 47 0.645 -18.354 30.910 365 2HG GLU 47 HG1 GLU 47 0.152 -19.418 29.599 366 H ASN 48 HN ASN 48 4.570 -18.628 31.372 367 HA ASN 48 HA ASN 48 6.768 -18.996 31.889 368 1HB ASN 48 HB2 ASN 48 6.187 -21.748 30.756 369 2HB ASN 48 HB1 ASN 48 7.716 -21.318 31.515 370 1HD2 ASN 48 HD21 ASN 48 7.747 -20.870 33.670 371 2HD2 ASN 48 HD22 ASN 48 6.534 -21.389 34.777 372 H GLY 49 HN GLY 49 5.917 -17.983 29.236 373 1HA GLY 49 HA2 GLY 49 8.430 -18.517 27.842 374 2HA GLY 49 HA1 GLY 49 6.881 -18.430 27.011 375 HA PRO 50 HA PRO 50 9.426 -14.187 27.440 376 1HB PRO 50 HB2 PRO 50 9.108 -14.898 24.561 377 2HB PRO 50 HB1 PRO 50 10.344 -13.889 25.306 378 1HG PRO 50 HG2 PRO 50 10.945 -16.364 24.737 379 2HG PRO 50 HG1 PRO 50 11.368 -15.724 26.341 380 1HD PRO 50 HD2 PRO 50 9.200 -17.634 25.600 381 2HD PRO 50 HD1 PRO 50 10.172 -17.525 27.078 382 H LYS 51 HN LYS 51 8.521 -12.189 26.853 383 HA LYS 51 HA LYS 51 5.946 -12.271 25.473 384 1HB LYS 51 HB2 LYS 51 5.442 -12.127 27.884 385 2HB LYS 51 HB1 LYS 51 6.483 -10.713 28.011 386 1HG LYS 51 HG2 LYS 51 4.990 -9.533 26.395 387 2HG LYS 51 HG1 LYS 51 3.925 -10.930 26.442 388 1HD LYS 51 HD2 LYS 51 3.547 -10.592 28.825 389 2HD LYS 51 HD1 LYS 51 4.675 -9.232 28.822 390 1HE LYS 51 HE2 LYS 51 3.227 -8.068 27.196 391 2HE LYS 51 HE1 LYS 51 2.081 -9.397 27.280 392 1HZ LYS 51 HZ1 LYS 51 2.851 -7.613 29.529 393 2HZ LYS 51 HZ2 LYS 51 1.792 -8.911 29.648 394 3HZ LYS 51 HZ3 LYS 51 1.392 -7.588 28.675 395 H THR 52 HN THR 52 8.512 -10.157 26.795 396 HA THR 52 HA THR 52 7.798 -8.325 24.668 397 HB THR 52 HB THR 52 8.538 -6.528 26.040 398 HG1 THR 52 HG1 THR 52 9.164 -8.635 27.867 399 1HG2 THR 52 HG21 THR 52 6.641 -6.508 27.610 400 2HG2 THR 52 HG22 THR 52 6.430 -8.236 27.346 401 3HG2 THR 52 HG23 THR 52 6.183 -7.103 26.012 402 H VAL 53 HN VAL 53 9.474 -6.667 24.377 403 HA VAL 53 HA VAL 53 11.662 -7.375 22.905 404 HB VAL 53 HB VAL 53 11.324 -4.923 24.620 405 1HG1 VAL 53 HG11 VAL 53 13.572 -5.022 23.792 406 2HG1 VAL 53 HG12 VAL 53 12.650 -3.676 23.128 407 3HG1 VAL 53 HG13 VAL 53 12.927 -5.108 22.145 408 1HG2 VAL 53 HG21 VAL 53 10.333 -5.426 21.838 409 2HG2 VAL 53 HG22 VAL 53 10.386 -3.850 22.613 410 3HG2 VAL 53 HG23 VAL 53 9.373 -5.115 23.292 411 H LYS 54 HN LYS 54 11.383 -7.202 26.395 412 HA LYS 54 HA LYS 54 14.137 -6.813 26.954 413 1HB LYS 54 HB2 LYS 54 12.288 -5.976 28.353 414 2HB LYS 54 HB1 LYS 54 11.800 -7.625 28.675 415 1HG LYS 54 HG2 LYS 54 13.937 -7.998 29.808 416 2HG LYS 54 HG1 LYS 54 14.361 -6.304 29.533 417 1HD LYS 54 HD2 LYS 54 12.346 -5.614 30.748 418 2HD LYS 54 HD1 LYS 54 11.962 -7.307 31.062 419 1HE LYS 54 HE2 LYS 54 12.995 -6.321 33.002 420 2HE LYS 54 HE1 LYS 54 14.073 -7.519 32.291 421 1HZ LYS 54 HZ1 LYS 54 15.333 -5.701 31.261 422 2HZ LYS 54 HZ2 LYS 54 15.260 -5.506 32.913 423 3HZ LYS 54 HZ3 LYS 54 14.264 -4.580 31.923 424 H GLU 55 HN GLU 55 12.003 -9.498 26.402 425 HA GLU 55 HA GLU 55 13.855 -11.362 27.673 426 1HB GLU 55 HB2 GLU 55 11.127 -11.835 26.477 427 2HB GLU 55 HB1 GLU 55 12.134 -13.097 27.148 428 1HG GLU 55 HG2 GLU 55 10.473 -12.514 28.759 429 2HG GLU 55 HG1 GLU 55 12.041 -11.904 29.321 430 H VAL 56 HN VAL 56 13.463 -10.032 24.677 431 HA VAL 56 HA VAL 56 14.360 -12.477 23.286 432 HB VAL 56 HB VAL 56 12.739 -10.171 22.170 433 1HG1 VAL 56 HG11 VAL 56 13.593 -12.734 20.851 434 2HG1 VAL 56 HG12 VAL 56 14.238 -11.128 20.498 435 3HG1 VAL 56 HG13 VAL 56 12.554 -11.503 20.129 436 1HG2 VAL 56 HG21 VAL 56 11.400 -11.590 23.631 437 2HG2 VAL 56 HG22 VAL 56 11.929 -13.024 22.754 438 3HG2 VAL 56 HG23 VAL 56 10.921 -11.826 21.950 439 H LYS 57 HN LYS 57 16.452 -12.355 22.572 440 HA LYS 57 HA LYS 57 17.373 -9.747 21.661 441 1HB LYS 57 HB2 LYS 57 18.940 -12.076 22.731 442 2HB LYS 57 HB1 LYS 57 19.668 -10.730 21.877 443 1HG LYS 57 HG2 LYS 57 18.734 -9.234 23.658 444 2HG LYS 57 HG1 LYS 57 18.246 -10.695 24.523 445 1HD LYS 57 HD2 LYS 57 20.560 -11.459 24.584 446 2HD LYS 57 HD1 LYS 57 21.066 -10.039 23.672 447 1HE LYS 57 HE2 LYS 57 21.545 -9.713 26.015 448 2HE LYS 57 HE1 LYS 57 20.264 -8.610 25.516 449 1HZ LYS 57 HZ1 LYS 57 19.907 -11.169 26.950 450 2HZ LYS 57 HZ2 LYS 57 18.649 -10.108 26.484 451 3HZ LYS 57 HZ3 LYS 57 19.788 -9.624 27.621 452 H LEU 58 HN LEU 58 18.382 -9.607 19.677 453 HA LEU 58 HA LEU 58 18.050 -11.956 17.952 454 1HB LEU 58 HB2 LEU 58 17.947 -9.020 17.207 455 2HB LEU 58 HB1 LEU 58 17.992 -10.311 16.036 456 HG LEU 58 HG LEU 58 15.762 -9.536 16.143 457 1HD1 LEU 58 HD11 LEU 58 15.924 -12.086 17.698 458 2HD1 LEU 58 HD12 LEU 58 15.951 -11.908 15.943 459 3HD1 LEU 58 HD13 LEU 58 14.500 -11.478 16.855 460 1HD2 LEU 58 HD21 LEU 58 15.820 -8.368 18.271 461 2HD2 LEU 58 HD22 LEU 58 15.857 -9.908 19.132 462 3HD2 LEU 58 HD23 LEU 58 14.431 -9.452 18.196 463 H ILE 59 HN ILE 59 19.848 -12.861 17.292 464 HA ILE 59 HA ILE 59 22.299 -11.248 17.121 465 HB ILE 59 HB ILE 59 21.904 -14.186 17.788 466 1HG1 ILE 59 HG12 ILE 59 23.216 -13.716 19.782 467 2HG1 ILE 59 HG11 ILE 59 23.350 -12.016 19.335 468 1HG2 ILE 59 HG21 ILE 59 24.340 -14.442 17.825 469 2HG2 ILE 59 HG22 ILE 59 24.507 -12.803 17.195 470 3HG2 ILE 59 HG23 ILE 59 23.725 -14.045 16.219 471 1HD1 ILE 59 HD11 ILE 59 20.858 -13.529 20.124 472 2HD1 ILE 59 HD12 ILE 59 20.913 -11.823 19.677 473 3HD1 ILE 59 HD13 ILE 59 21.747 -12.384 21.126 474 H SER 60 HN SER 60 23.156 -10.997 15.194 475 HA SER 60 HA SER 60 22.747 -13.035 13.176 476 1HB SER 60 HB2 SER 60 22.561 -11.217 11.485 477 2HB SER 60 HB1 SER 60 21.181 -11.281 12.583 478 HG SER 60 HG SER 60 23.361 -9.591 13.175 479 H ALA 61 HN ALA 61 24.587 -13.590 12.215 480 HA ALA 61 HA ALA 61 26.763 -13.754 11.658 481 1HB ALA 61 HB1 ALA 61 28.056 -11.726 11.163 482 2HB ALA 61 HB2 ALA 61 26.856 -10.747 12.006 483 3HB ALA 61 HB3 ALA 61 26.419 -11.587 10.518 484 H GLY 62 HN GLY 62 25.787 -13.661 14.443 485 1HA GLY 62 HA2 GLY 62 26.801 -14.263 16.451 486 2HA GLY 62 HA1 GLY 62 28.361 -13.882 15.730 487 H LYS 63 HN LYS 63 25.924 -11.457 15.457 488 HA LYS 63 HA LYS 63 27.138 -10.014 17.682 489 1HB LYS 63 HB2 LYS 63 28.024 -9.218 15.519 490 2HB LYS 63 HB1 LYS 63 26.389 -8.929 14.959 491 1HG LYS 63 HG2 LYS 63 26.103 -7.216 16.690 492 2HG LYS 63 HG1 LYS 63 27.753 -7.507 17.237 493 1HD LYS 63 HD2 LYS 63 28.599 -6.855 15.023 494 2HD LYS 63 HD1 LYS 63 26.947 -6.562 14.486 495 1HE LYS 63 HE2 LYS 63 26.698 -4.845 16.215 496 2HE LYS 63 HE1 LYS 63 28.360 -5.123 16.724 497 1HZ LYS 63 HZ1 LYS 63 29.118 -4.377 14.537 498 2HZ LYS 63 HZ2 LYS 63 28.142 -3.206 15.267 499 3HZ LYS 63 HZ3 LYS 63 27.515 -4.164 14.048 500 H VAL 64 HN VAL 64 25.718 -9.051 19.005 501 HA VAL 64 HA VAL 64 22.905 -9.618 18.691 502 HB VAL 64 HB VAL 64 24.280 -7.978 20.841 503 1HG1 VAL 64 HG11 VAL 64 22.325 -8.538 22.219 504 2HG1 VAL 64 HG12 VAL 64 21.605 -9.357 20.836 505 3HG1 VAL 64 HG13 VAL 64 21.897 -7.622 20.775 506 1HG2 VAL 64 HG21 VAL 64 24.327 -9.976 22.226 507 2HG2 VAL 64 HG22 VAL 64 25.251 -10.253 20.747 508 3HG2 VAL 64 HG23 VAL 64 23.627 -10.923 20.924 509 H LEU 65 HN LEU 65 21.370 -8.161 17.995 510 HA LEU 65 HA LEU 65 22.264 -5.587 17.111 511 1HB LEU 65 HB2 LEU 65 19.562 -6.908 17.056 512 2HB LEU 65 HB1 LEU 65 19.885 -5.309 16.450 513 HG LEU 65 HG LEU 65 21.479 -6.390 14.805 514 1HD1 LEU 65 HD11 LEU 65 20.112 -8.908 15.702 515 2HD1 LEU 65 HD12 LEU 65 21.816 -8.506 15.909 516 3HD1 LEU 65 HD13 LEU 65 21.155 -8.737 14.291 517 1HD2 LEU 65 HD21 LEU 65 18.562 -7.093 14.664 518 2HD2 LEU 65 HD22 LEU 65 19.690 -7.072 13.307 519 3HD2 LEU 65 HD23 LEU 65 19.307 -5.577 14.158 520 H GLU 66 HN GLU 66 22.206 -3.821 18.339 521 HA GLU 66 HA GLU 66 20.943 -3.728 20.880 522 1HB GLU 66 HB2 GLU 66 22.881 -2.308 20.320 523 2HB GLU 66 HB1 GLU 66 21.933 -1.502 19.076 524 1HG GLU 66 HG2 GLU 66 20.393 -0.706 20.850 525 2HG GLU 66 HG1 GLU 66 21.484 -1.409 22.044 526 H ASN 67 HN ASN 67 18.830 -3.170 21.307 527 HA ASN 67 HA ASN 67 17.070 -3.097 19.117 528 1HB ASN 67 HB2 ASN 67 15.192 -2.769 20.676 529 2HB ASN 67 HB1 ASN 67 16.259 -4.056 21.194 530 1HD2 ASN 67 HD21 ASN 67 15.030 -0.859 21.888 531 2HD2 ASN 67 HD22 ASN 67 15.658 -0.803 23.494 532 H SER 68 HN SER 68 18.671 -0.604 20.763 533 HA SER 68 HA SER 68 16.854 1.443 19.943 534 1HB SER 68 HB2 SER 68 19.566 1.635 21.249 535 2HB SER 68 HB1 SER 68 18.408 2.955 21.048 536 HG SER 68 HG SER 68 16.919 1.719 22.246 537 H LYS 69 HN LYS 69 18.969 -0.300 18.147 538 HA LYS 69 HA LYS 69 19.733 1.954 16.498 539 1HB LYS 69 HB2 LYS 69 20.454 -0.964 16.456 540 2HB LYS 69 HB1 LYS 69 20.903 0.160 15.208 541 1HG LYS 69 HG2 LYS 69 21.769 0.502 18.085 542 2HG LYS 69 HG1 LYS 69 22.689 -0.452 16.928 543 1HD LYS 69 HD2 LYS 69 23.738 1.686 16.979 544 2HD LYS 69 HD1 LYS 69 22.802 1.662 15.496 545 1HE LYS 69 HE2 LYS 69 22.672 3.784 16.596 546 2HE LYS 69 HE1 LYS 69 21.074 3.106 16.604 547 1HZ LYS 69 HZ1 LYS 69 21.654 2.351 18.993 548 2HZ LYS 69 HZ2 LYS 69 21.496 3.997 18.754 549 3HZ LYS 69 HZ3 LYS 69 23.017 3.311 18.829 550 H THR 70 HN THR 70 19.384 1.703 14.177 551 HA THR 70 HA THR 70 16.732 0.619 13.687 552 HB THR 70 HB THR 70 18.322 2.315 11.793 553 HG1 THR 70 HG1 THR 70 18.371 3.533 13.562 554 1HG2 THR 70 HG21 THR 70 16.104 3.165 11.154 555 2HG2 THR 70 HG22 THR 70 15.365 2.128 12.375 556 3HG2 THR 70 HG23 THR 70 16.206 1.415 11.000 557 H VAL 71 HN VAL 71 16.566 -0.476 11.392 558 HA VAL 71 HA VAL 71 18.562 -2.474 11.213 559 HB VAL 71 HB VAL 71 16.433 -1.680 9.182 560 1HG1 VAL 71 HG11 VAL 71 16.813 -3.890 8.144 561 2HG1 VAL 71 HG12 VAL 71 18.144 -4.180 9.264 562 3HG1 VAL 71 HG13 VAL 71 18.266 -2.894 8.066 563 1HG2 VAL 71 HG21 VAL 71 16.524 -3.934 11.185 564 2HG2 VAL 71 HG22 VAL 71 15.241 -3.661 10.007 565 3HG2 VAL 71 HG23 VAL 71 15.524 -2.485 11.290 566 H LYS 72 HN LYS 72 18.021 0.516 9.531 567 HA LYS 72 HA LYS 72 19.992 0.307 7.554 568 1HB LYS 72 HB2 LYS 72 18.136 2.059 7.724 569 2HB LYS 72 HB1 LYS 72 19.106 2.817 8.951 570 1HG LYS 72 HG2 LYS 72 20.869 3.295 7.406 571 2HG LYS 72 HG1 LYS 72 20.047 2.390 6.134 572 1HD LYS 72 HD2 LYS 72 18.163 3.969 6.247 573 2HD LYS 72 HD1 LYS 72 19.019 4.889 7.483 574 1HE LYS 72 HE2 LYS 72 19.272 5.922 5.287 575 2HE LYS 72 HE1 LYS 72 20.819 5.345 5.900 576 1HZ LYS 72 HZ1 LYS 72 20.617 3.398 4.444 577 2HZ LYS 72 HZ2 LYS 72 20.542 4.810 3.567 578 3HZ LYS 72 HZ3 LYS 72 19.133 3.956 3.866 579 H ASP 73 HN ASP 73 20.243 1.260 10.999 580 HA ASP 73 HA ASP 73 22.854 2.317 10.780 581 1HB ASP 73 HB2 ASP 73 21.234 1.386 13.131 582 2HB ASP 73 HB1 ASP 73 22.832 2.083 13.248 583 H TYR 74 HN TYR 74 21.429 -0.764 11.434 584 HA TYR 74 HA TYR 74 23.799 -1.857 12.575 585 1HB TYR 74 HB2 TYR 74 21.517 -2.612 13.193 586 2HB TYR 74 HB1 TYR 74 21.335 -3.293 11.584 587 HD1 TYR 74 HD1 TYR 74 22.339 -5.408 11.022 588 HD2 TYR 74 HD2 TYR 74 23.134 -3.579 14.780 589 HE1 TYR 74 HE1 TYR 74 23.345 -7.499 11.822 590 HE2 TYR 74 HE2 TYR 74 24.140 -5.653 15.594 591 HH TYR 74 HH TYR 74 24.034 -8.103 15.080 592 H ARG 75 HN ARG 75 22.373 -1.812 9.271 593 HA ARG 75 HA ARG 75 23.995 -3.863 8.354 594 1HB ARG 75 HB2 ARG 75 22.552 -1.704 6.848 595 2HB ARG 75 HB1 ARG 75 23.252 -3.173 6.203 596 1HG ARG 75 HG2 ARG 75 21.618 -4.367 7.856 597 2HG ARG 75 HG1 ARG 75 20.805 -2.816 7.852 598 1HD ARG 75 HD2 ARG 75 21.378 -4.498 5.417 599 2HD ARG 75 HD1 ARG 75 19.824 -4.294 6.210 600 HE ARG 75 HE ARG 75 19.814 -1.987 5.456 601 1HH1 ARG 75 HH11 ARG 75 22.238 -4.066 3.901 602 2HH1 ARG 75 HH12 ARG 75 22.305 -3.085 2.503 603 1HH2 ARG 75 HH21 ARG 75 19.907 -0.808 3.597 604 2HH2 ARG 75 HH22 ARG 75 20.971 -1.178 2.287 605 H SER 76 HN SER 76 25.782 -3.758 7.072 606 HA SER 76 HA SER 76 27.423 -1.432 7.415 607 1HB SER 76 HB2 SER 76 29.133 -3.080 6.508 608 2HB SER 76 HB1 SER 76 28.401 -3.493 8.057 609 HG SER 76 HG SER 76 27.687 -4.498 5.503 610 HA PRO 77 HA PRO 77 27.027 0.351 3.312 611 1HB PRO 77 HB2 PRO 77 30.000 0.033 3.290 612 2HB PRO 77 HB1 PRO 77 29.021 1.434 2.842 613 1HG PRO 77 HG2 PRO 77 30.220 1.386 5.185 614 2HG PRO 77 HG1 PRO 77 28.556 1.984 5.054 615 1HD PRO 77 HD2 PRO 77 29.556 -0.604 6.138 616 2HD PRO 77 HD1 PRO 77 28.165 0.382 6.645 617 H VAL 78 HN VAL 78 27.438 -0.033 1.097 618 HA VAL 78 HA VAL 78 26.976 -1.318 -0.584 619 HB VAL 78 HB VAL 78 29.268 -1.038 -0.984 620 1HG1 VAL 78 HG11 VAL 78 31.017 -2.756 -0.480 621 2HG1 VAL 78 HG12 VAL 78 29.819 -3.631 0.474 622 3HG1 VAL 78 HG13 VAL 78 30.327 -2.017 0.967 623 1HG2 VAL 78 HG21 VAL 78 29.743 -2.941 -2.528 624 2HG2 VAL 78 HG22 VAL 78 28.106 -2.291 -2.653 625 3HG2 VAL 78 HG23 VAL 78 28.392 -3.800 -1.789 626 H SER 79 HN SER 79 25.326 -2.036 0.126 627 HA SER 79 HA SER 79 24.784 -4.796 -0.114 628 1HB SER 79 HB2 SER 79 25.743 -4.812 2.219 629 2HB SER 79 HB1 SER 79 24.527 -3.636 2.691 630 HG SER 79 HG SER 79 24.043 -6.221 1.680 631 H ASN 80 HN ASN 80 22.819 -4.616 -1.133 632 HA ASN 80 HA ASN 80 21.029 -2.540 -0.133 633 1HB ASN 80 HB2 ASN 80 20.331 -1.975 -2.424 634 2HB ASN 80 HB1 ASN 80 22.030 -1.641 -2.163 635 1HD2 ASN 80 HD21 ASN 80 20.649 -1.989 -4.634 636 2HD2 ASN 80 HD22 ASN 80 21.371 -3.335 -5.441 637 H LEU 81 HN LEU 81 18.679 -2.829 -0.859 638 HA LEU 81 HA LEU 81 17.856 -5.295 -0.145 639 1HB LEU 81 HB2 LEU 81 15.780 -4.439 -0.592 640 2HB LEU 81 HB1 LEU 81 16.638 -3.362 0.464 641 HG LEU 81 HG LEU 81 15.909 -2.969 -2.466 642 1HD1 LEU 81 HD11 LEU 81 14.980 -1.539 0.009 643 2HD1 LEU 81 HD12 LEU 81 14.045 -2.697 -0.937 644 3HD1 LEU 81 HD13 LEU 81 14.494 -1.143 -1.635 645 1HD2 LEU 81 HD21 LEU 81 16.768 -0.653 -2.255 646 2HD2 LEU 81 HD22 LEU 81 18.037 -1.846 -2.102 647 3HD2 LEU 81 HD23 LEU 81 17.404 -1.047 -0.655 648 H ALA 82 HN ALA 82 16.240 -6.336 -1.254 649 HA ALA 82 HA ALA 82 15.638 -6.492 -3.941 650 1HB ALA 82 HB1 ALA 82 18.026 -6.940 -4.369 651 2HB ALA 82 HB2 ALA 82 17.077 -8.387 -4.711 652 3HB ALA 82 HB3 ALA 82 17.996 -8.269 -3.211 653 H GLY 83 HN GLY 83 14.647 -6.928 -1.211 654 1HA GLY 83 HA2 GLY 83 13.393 -8.388 -0.004 655 2HA GLY 83 HA1 GLY 83 13.316 -9.396 -1.452 656 H ALA 84 HN ALA 84 15.949 -8.344 0.644 657 HA ALA 84 HA ALA 84 17.251 -10.892 0.341 658 1HB ALA 84 HB1 ALA 84 18.539 -8.815 0.372 659 2HB ALA 84 HB2 ALA 84 19.027 -9.896 1.679 660 3HB ALA 84 HB3 ALA 84 17.997 -8.508 2.021 661 H VAL 85 HN VAL 85 16.980 -12.580 1.624 662 HA VAL 85 HA VAL 85 15.387 -12.263 4.019 663 HB VAL 85 HB VAL 85 16.541 -14.799 2.857 664 1HG1 VAL 85 HG11 VAL 85 14.332 -14.404 4.876 665 2HG1 VAL 85 HG12 VAL 85 15.943 -15.031 5.202 666 3HG1 VAL 85 HG13 VAL 85 14.827 -15.955 4.194 667 1HG2 VAL 85 HG21 VAL 85 15.048 -13.757 1.242 668 2HG2 VAL 85 HG22 VAL 85 13.794 -13.615 2.475 669 3HG2 VAL 85 HG23 VAL 85 14.302 -15.207 1.915 670 H THR 86 HN THR 86 16.139 -12.236 5.952 671 HA THR 86 HA THR 86 18.931 -12.977 6.480 672 HB THR 86 HB THR 86 17.321 -10.769 7.796 673 HG1 THR 86 HG1 THR 86 17.757 -10.220 5.691 674 1HG2 THR 86 HG21 THR 86 19.508 -10.063 8.698 675 2HG2 THR 86 HG22 THR 86 20.282 -11.423 7.887 676 3HG2 THR 86 HG23 THR 86 19.136 -11.716 9.191 677 H THR 87 HN THR 87 19.147 -14.331 8.249 678 HA THR 87 HA THR 87 16.675 -14.951 9.676 679 HB THR 87 HB THR 87 19.095 -16.719 9.236 680 HG1 THR 87 HG1 THR 87 17.998 -16.411 7.322 681 1HG2 THR 87 HG21 THR 87 16.337 -17.304 10.355 682 2HG2 THR 87 HG22 THR 87 17.826 -17.237 11.296 683 3HG2 THR 87 HG23 THR 87 17.601 -18.499 10.086 684 H MET 88 HN MET 88 16.669 -14.250 11.706 685 HA MET 88 HA MET 88 19.269 -13.797 12.932 686 1HB MET 88 HB2 MET 88 16.608 -12.520 13.554 687 2HB MET 88 HB1 MET 88 18.067 -12.277 14.509 688 1HG MET 88 HG2 MET 88 19.203 -11.379 12.548 689 2HG MET 88 HG1 MET 88 17.743 -11.608 11.598 690 1HE MET 88 HE1 MET 88 18.046 -7.741 11.909 691 2HE MET 88 HE2 MET 88 17.935 -9.116 10.809 692 3HE MET 88 HE3 MET 88 19.378 -8.890 11.797 693 H HIS 89 HN HIS 89 19.800 -14.610 14.803 694 HA HIS 89 HA HIS 89 18.252 -16.938 15.596 695 1HB HIS 89 HB2 HIS 89 21.014 -16.024 16.462 696 2HB HIS 89 HB1 HIS 89 20.252 -17.551 16.896 697 HD1 HIS 89 HD1 HIS 89 20.525 -19.462 15.264 698 HD2 HIS 89 HD2 HIS 89 21.720 -15.824 13.677 699 HE1 HIS 89 HE1 HIS 89 21.639 -20.001 13.073 700 HE2 HIS 89 HE2 HIS 89 21.974 -17.757 12.022 701 H VAL 90 HN VAL 90 17.049 -16.933 17.339 702 HA VAL 90 HA VAL 90 16.991 -14.487 18.943 703 HB VAL 90 HB VAL 90 15.016 -16.776 18.844 704 1HG1 VAL 90 HG11 VAL 90 14.808 -14.015 20.006 705 2HG1 VAL 90 HG12 VAL 90 14.912 -15.519 20.919 706 3HG1 VAL 90 HG13 VAL 90 13.488 -15.181 19.932 707 1HG2 VAL 90 HG21 VAL 90 13.596 -15.299 17.522 708 2HG2 VAL 90 HG22 VAL 90 15.101 -15.686 16.680 709 3HG2 VAL 90 HG23 VAL 90 14.896 -14.107 17.448 710 H ILE 91 HN ILE 91 17.742 -14.360 20.714 711 HA ILE 91 HA ILE 91 18.366 -16.742 22.295 712 HB ILE 91 HB ILE 91 19.431 -13.979 22.147 713 1HG1 ILE 91 HG12 ILE 91 20.450 -15.531 20.627 714 2HG1 ILE 91 HG11 ILE 91 21.635 -15.085 21.850 715 1HG2 ILE 91 HG21 ILE 91 20.900 -14.440 24.127 716 2HG2 ILE 91 HG22 ILE 91 20.052 -15.965 24.363 717 3HG2 ILE 91 HG23 ILE 91 19.188 -14.440 24.559 718 1HD1 ILE 91 HD11 ILE 91 21.199 -17.224 22.995 719 2HD1 ILE 91 HD12 ILE 91 21.786 -17.430 21.349 720 3HD1 ILE 91 HD13 ILE 91 20.079 -17.672 21.702 721 H ILE 92 HN ILE 92 17.051 -17.223 23.748 722 HA ILE 92 HA ILE 92 15.061 -15.319 24.576 723 HB ILE 92 HB ILE 92 15.299 -18.305 24.970 724 1HG1 ILE 92 HG12 ILE 92 13.113 -18.352 23.675 725 2HG1 ILE 92 HG11 ILE 92 13.365 -16.652 23.331 726 1HG2 ILE 92 HG21 ILE 92 13.074 -18.273 25.994 727 2HG2 ILE 92 HG22 ILE 92 13.180 -16.504 26.034 728 3HG2 ILE 92 HG23 ILE 92 14.333 -17.475 26.946 729 1HD1 ILE 92 HD11 ILE 92 15.146 -18.924 22.477 730 2HD1 ILE 92 HD12 ILE 92 15.426 -17.217 22.143 731 3HD1 ILE 92 HD13 ILE 92 14.018 -18.028 21.457 732 H GLN 93 HN GLN 93 15.062 -14.362 26.465 733 HA GLN 93 HA GLN 93 16.944 -15.146 28.489 734 1HB GLN 93 HB2 GLN 93 14.980 -12.849 28.331 735 2HB GLN 93 HB1 GLN 93 16.165 -13.081 29.598 736 1HG GLN 93 HG2 GLN 93 16.724 -12.492 26.708 737 2HG GLN 93 HG1 GLN 93 16.922 -11.391 28.075 738 1HE2 GLN 93 HE21 GLN 93 18.628 -11.754 29.538 739 2HE2 GLN 93 HE22 GLN 93 19.975 -12.746 29.089 740 H ALA 94 HN ALA 94 16.269 -16.332 29.986 741 HA ALA 94 HA ALA 94 13.768 -17.655 29.954 742 1HB ALA 94 HB1 ALA 94 14.436 -18.709 32.066 743 2HB ALA 94 HB2 ALA 94 15.739 -17.535 32.243 744 3HB ALA 94 HB3 ALA 94 15.775 -18.694 30.915 745 HA PRO 95 HA PRO 95 11.596 -14.352 31.967 746 1HB PRO 95 HB2 PRO 95 9.115 -15.229 31.499 747 2HB PRO 95 HB1 PRO 95 10.121 -14.529 30.228 748 1HG PRO 95 HG2 PRO 95 9.511 -17.395 30.803 749 2HG PRO 95 HG1 PRO 95 9.660 -16.575 29.241 750 1HD PRO 95 HD2 PRO 95 11.638 -18.108 30.403 751 2HD PRO 95 HD1 PRO 95 11.923 -16.841 29.190 752 H VAL 96 HN VAL 96 10.517 -14.044 33.814 753 HA VAL 96 HA VAL 96 10.122 -16.379 35.542 754 HB VAL 96 HB VAL 96 10.476 -13.488 36.307 755 1HG1 VAL 96 HG11 VAL 96 10.721 -14.334 38.615 756 2HG1 VAL 96 HG12 VAL 96 10.378 -15.966 38.038 757 3HG1 VAL 96 HG13 VAL 96 9.139 -14.714 37.933 758 1HG2 VAL 96 HG21 VAL 96 12.447 -15.759 36.495 759 2HG2 VAL 96 HG22 VAL 96 12.689 -14.148 37.172 760 3HG2 VAL 96 HG23 VAL 96 12.560 -14.362 35.426 761 H THR 97 HN THR 97 8.025 -16.843 35.941 762 HA THR 97 HA THR 97 6.221 -14.654 35.530 763 HB THR 97 HB THR 97 5.800 -16.226 33.746 764 HG1 THR 97 HG1 THR 97 3.988 -15.363 35.218 765 1HG2 THR 97 HG21 THR 97 5.439 -18.357 35.861 766 2HG2 THR 97 HG22 THR 97 6.745 -18.268 34.673 767 3HG2 THR 97 HG23 THR 97 5.092 -18.563 34.144 768 H GLU 98 HN GLU 98 6.066 -13.907 37.392 769 HA GLU 98 HA GLU 98 5.953 -15.454 39.749 770 1HB GLU 98 HB2 GLU 98 6.915 -13.246 39.582 771 2HB GLU 98 HB1 GLU 98 5.347 -12.558 39.199 772 1HG GLU 98 HG2 GLU 98 4.523 -13.115 41.411 773 2HG GLU 98 HG1 GLU 98 6.045 -13.922 41.800 774 H LYS 99 HN LYS 99 4.216 -16.132 40.850 775 HA LYS 99 HA LYS 99 2.252 -17.079 41.071 776 1HB LYS 99 HB2 LYS 99 1.330 -14.736 41.280 777 2HB LYS 99 HB1 LYS 99 1.080 -14.717 39.542 778 1HG LYS 99 HG2 LYS 99 -0.483 -16.608 39.769 779 2HG LYS 99 HG1 LYS 99 -0.263 -16.550 41.515 780 1HD LYS 99 HD2 LYS 99 -1.080 -14.215 41.495 781 2HD LYS 99 HD1 LYS 99 -1.393 -14.382 39.768 782 1HE LYS 99 HE2 LYS 99 -3.451 -14.744 41.024 783 2HE LYS 99 HE1 LYS 99 -2.943 -16.231 40.230 784 1HZ LYS 99 HZ1 LYS 99 -3.649 -16.632 42.512 785 2HZ LYS 99 HZ2 LYS 99 -2.465 -15.575 43.087 786 3HZ LYS 99 HZ3 LYS 99 -2.017 -16.996 42.321 787 H GLU 100 HN GLU 100 3.184 -18.615 39.766 788 HA GLU 100 HA GLU 100 2.745 -18.616 36.926 789 1HB GLU 100 HB2 GLU 100 4.866 -19.370 37.960 790 2HB GLU 100 HB1 GLU 100 4.005 -20.676 38.750 791 1HG GLU 100 HG2 GLU 100 3.459 -21.605 36.537 792 2HG GLU 100 HG1 GLU 100 4.389 -20.311 35.783 793 H LYS 101 HN LYS 101 1.834 -20.592 35.946 794 HA LYS 101 HA LYS 101 -0.651 -21.298 37.196 795 1HB LYS 101 HB2 LYS 101 -0.342 -20.747 34.753 796 2HB LYS 101 HB1 LYS 101 0.574 -22.230 34.601 797 1HG LYS 101 HG2 LYS 101 -1.704 -22.486 33.792 798 2HG LYS 101 HG1 LYS 101 -1.398 -23.528 35.180 799 1HD LYS 101 HD2 LYS 101 -3.620 -22.378 35.237 800 2HD LYS 101 HD1 LYS 101 -2.616 -22.068 36.644 801 1HE LYS 101 HE2 LYS 101 -3.763 -20.027 35.829 802 2HE LYS 101 HE1 LYS 101 -2.014 -19.878 35.777 803 1HZ LYS 101 HZ1 LYS 101 -3.148 -18.997 33.826 804 2HZ LYS 101 HZ2 LYS 101 -3.684 -20.539 33.392 805 3HZ LYS 101 HZ3 LYS 101 -2.033 -20.178 33.430 Start of MODEL 10 1 H GLU 1 HT1 GLU 1 -2.561 -8.666 2.279 2 HA GLU 1 HA GLU 1 -0.679 -7.375 4.132 3 1HB GLU 1 HB2 GLU 1 -2.562 -8.610 5.189 4 2HB GLU 1 HB1 GLU 1 -2.138 -10.028 4.258 5 1HG GLU 1 HG2 GLU 1 -1.383 -10.240 6.532 6 2HG GLU 1 HG1 GLU 1 -0.002 -10.162 5.444 7 H ALA 2 HN ALA 2 1.098 -7.331 2.772 8 HA ALA 2 HA ALA 2 2.603 -9.639 2.354 9 1HB ALA 2 HB1 ALA 2 0.987 -10.109 0.563 10 2HB ALA 2 HB2 ALA 2 2.590 -9.765 -0.087 11 3HB ALA 2 HB3 ALA 2 1.329 -8.534 -0.155 12 H GLU 3 HN GLU 3 4.654 -8.954 2.275 13 HA GLU 3 HA GLU 3 5.145 -6.196 2.029 14 1HB GLU 3 HB2 GLU 3 6.923 -8.521 2.737 15 2HB GLU 3 HB1 GLU 3 7.532 -6.895 2.504 16 1HG GLU 3 HG2 GLU 3 7.196 -7.489 4.881 17 2HG GLU 3 HG1 GLU 3 6.272 -6.082 4.382 18 H VAL 4 HN VAL 4 6.513 -5.237 0.510 19 HA VAL 4 HA VAL 4 6.680 -6.616 -2.034 20 HB VAL 4 HB VAL 4 7.547 -3.804 -1.330 21 1HG1 VAL 4 HG11 VAL 4 7.041 -5.058 -4.023 22 2HG1 VAL 4 HG12 VAL 4 8.606 -4.609 -3.354 23 3HG1 VAL 4 HG13 VAL 4 7.425 -3.358 -3.743 24 1HG2 VAL 4 HG21 VAL 4 4.938 -4.749 -2.521 25 2HG2 VAL 4 HG22 VAL 4 5.417 -3.063 -2.338 26 3HG2 VAL 4 HG23 VAL 4 5.163 -4.068 -0.911 27 H HIS 5 HN HIS 5 8.562 -7.071 -3.070 28 HA HIS 5 HA HIS 5 10.794 -7.519 -1.315 29 1HB HIS 5 HB2 HIS 5 10.374 -8.413 -4.180 30 2HB HIS 5 HB1 HIS 5 11.789 -8.810 -3.215 31 HD1 HIS 5 HD1 HIS 5 8.250 -9.795 -3.778 32 HD2 HIS 5 HD2 HIS 5 11.284 -10.607 -1.057 33 HE1 HIS 5 HE1 HIS 5 7.479 -11.787 -2.484 34 HE2 HIS 5 HE2 HIS 5 9.253 -12.153 -0.741 35 H ASN 6 HN ASN 6 11.586 -5.656 -0.921 36 HA ASN 6 HA ASN 6 13.451 -4.548 -2.847 37 1HB ASN 6 HB2 ASN 6 11.445 -3.122 -3.173 38 2HB ASN 6 HB1 ASN 6 11.392 -2.808 -1.441 39 1HD2 ASN 6 HD21 ASN 6 11.635 -0.618 -1.664 40 2HD2 ASN 6 HD22 ASN 6 13.107 0.134 -2.168 41 H GLN 7 HN GLN 7 11.948 -4.398 0.320 42 HA GLN 7 HA GLN 7 14.248 -3.497 1.711 43 1HB GLN 7 HB2 GLN 7 11.710 -4.849 2.660 44 2HB GLN 7 HB1 GLN 7 12.951 -4.246 3.737 45 1HG GLN 7 HG2 GLN 7 11.101 -2.725 3.663 46 2HG GLN 7 HG1 GLN 7 12.494 -1.963 2.909 47 1HE2 GLN 7 HE21 GLN 7 9.361 -3.320 2.418 48 2HE2 GLN 7 HE22 GLN 7 9.094 -2.677 0.848 49 H LEU 8 HN LEU 8 14.753 -5.128 3.784 50 HA LEU 8 HA LEU 8 15.720 -7.478 2.388 51 1HB LEU 8 HB2 LEU 8 16.615 -6.257 4.989 52 2HB LEU 8 HB1 LEU 8 17.238 -7.741 4.331 53 HG LEU 8 HG LEU 8 18.038 -6.421 2.318 54 1HD1 LEU 8 HD11 LEU 8 17.452 -4.039 4.055 55 2HD1 LEU 8 HD12 LEU 8 16.671 -4.442 2.527 56 3HD1 LEU 8 HD13 LEU 8 18.382 -4.018 2.556 57 1HD2 LEU 8 HD21 LEU 8 20.028 -5.559 3.450 58 2HD2 LEU 8 HD22 LEU 8 19.564 -7.159 4.031 59 3HD2 LEU 8 HD23 LEU 8 19.202 -5.732 4.999 60 H GLU 9 HN GLU 9 15.230 -9.487 3.027 61 HA GLU 9 HA GLU 9 12.911 -9.636 4.769 62 1HB GLU 9 HB2 GLU 9 14.111 -11.774 3.043 63 2HB GLU 9 HB1 GLU 9 12.592 -11.825 3.884 64 1HG GLU 9 HG2 GLU 9 11.681 -10.043 2.518 65 2HG GLU 9 HG1 GLU 9 13.209 -9.911 1.649 66 H ILE 10 HN ILE 10 12.995 -10.453 6.636 67 HA ILE 10 HA ILE 10 15.512 -11.735 7.459 68 HB ILE 10 HB ILE 10 13.635 -10.090 9.177 69 1HG1 ILE 10 HG12 ILE 10 16.444 -9.462 8.212 70 2HG1 ILE 10 HG11 ILE 10 14.990 -8.731 7.557 71 1HG2 ILE 10 HG21 ILE 10 15.367 -10.306 10.920 72 2HG2 ILE 10 HG22 ILE 10 16.283 -11.373 9.863 73 3HG2 ILE 10 HG23 ILE 10 14.697 -11.870 10.452 74 1HD1 ILE 10 HD11 ILE 10 14.553 -7.712 9.747 75 2HD1 ILE 10 HD12 ILE 10 16.125 -7.236 9.098 76 3HD1 ILE 10 HD13 ILE 10 16.024 -8.455 10.371 77 H LYS 11 HN LYS 11 15.363 -13.631 8.355 78 HA LYS 11 HA LYS 11 12.736 -14.436 9.237 79 1HB LYS 11 HB2 LYS 11 13.418 -16.829 8.978 80 2HB LYS 11 HB1 LYS 11 13.316 -15.957 7.459 81 1HG LYS 11 HG2 LYS 11 15.633 -16.001 7.167 82 2HG LYS 11 HG1 LYS 11 15.934 -16.344 8.875 83 1HD LYS 11 HD2 LYS 11 16.272 -18.329 7.441 84 2HD LYS 11 HD1 LYS 11 15.003 -18.568 8.634 85 1HE LYS 11 HE2 LYS 11 13.346 -18.002 6.836 86 2HE LYS 11 HE1 LYS 11 14.687 -18.011 5.688 87 1HZ LYS 11 HZ1 LYS 11 13.578 -20.129 5.707 88 2HZ LYS 11 HZ2 LYS 11 13.762 -20.277 7.362 89 3HZ LYS 11 HZ3 LYS 11 15.124 -20.337 6.352 90 H PHE 12 HN PHE 12 12.646 -15.243 11.311 91 HA PHE 12 HA PHE 12 15.024 -14.781 12.920 92 1HB PHE 12 HB2 PHE 12 12.159 -15.289 13.735 93 2HB PHE 12 HB1 PHE 12 13.471 -14.876 14.829 94 HD1 PHE 12 HD1 PHE 12 10.825 -13.623 12.864 95 HD2 PHE 12 HD2 PHE 12 14.691 -12.630 14.335 96 HE1 PHE 12 HE1 PHE 12 10.339 -11.238 12.520 97 HE2 PHE 12 HE2 PHE 12 14.215 -10.245 13.993 98 HZ PHE 12 HZ PHE 12 12.041 -9.542 13.088 99 H ARG 13 HN ARG 13 16.267 -16.503 13.393 100 HA ARG 13 HA ARG 13 14.942 -19.089 13.379 101 1HB ARG 13 HB2 ARG 13 17.874 -18.590 12.966 102 2HB ARG 13 HB1 ARG 13 16.985 -20.084 12.748 103 1HG ARG 13 HG2 ARG 13 15.671 -18.784 10.946 104 2HG ARG 13 HG1 ARG 13 17.005 -17.646 11.031 105 1HD ARG 13 HD2 ARG 13 17.559 -19.153 9.288 106 2HD ARG 13 HD1 ARG 13 18.538 -19.633 10.682 107 HE ARG 13 HE ARG 13 16.052 -21.011 10.568 108 1HH1 ARG 13 HH11 ARG 13 19.386 -21.136 9.348 109 2HH1 ARG 13 HH12 ARG 13 19.256 -22.763 8.891 110 1HH2 ARG 13 HH21 ARG 13 15.900 -23.157 9.934 111 2HH2 ARG 13 HH22 ARG 13 17.236 -23.963 9.236 112 H LEU 14 HN LEU 14 14.965 -20.244 15.114 113 HA LEU 14 HA LEU 14 16.151 -19.196 17.511 114 1HB LEU 14 HB2 LEU 14 14.329 -21.501 16.920 115 2HB LEU 14 HB1 LEU 14 14.949 -21.184 18.515 116 HG LEU 14 HG LEU 14 12.746 -20.411 18.414 117 1HD1 LEU 14 HD11 LEU 14 12.957 -18.002 18.896 118 2HD1 LEU 14 HD12 LEU 14 14.591 -18.055 18.239 119 3HD1 LEU 14 HD13 LEU 14 14.190 -18.994 19.677 120 1HD2 LEU 14 HD21 LEU 14 13.451 -18.797 15.958 121 2HD2 LEU 14 HD22 LEU 14 11.915 -18.702 16.822 122 3HD2 LEU 14 HD23 LEU 14 12.382 -20.200 16.025 123 H THR 15 HN THR 15 17.166 -20.834 19.018 124 HA THR 15 HA THR 15 19.432 -21.890 17.751 125 HB THR 15 HB THR 15 19.832 -22.725 20.169 126 HG1 THR 15 HG1 THR 15 18.091 -22.515 21.320 127 1HG2 THR 15 HG21 THR 15 20.935 -20.756 19.182 128 2HG2 THR 15 HG22 THR 15 20.499 -20.455 20.865 129 3HG2 THR 15 HG23 THR 15 19.519 -19.775 19.565 130 H ASP 16 HN ASP 16 16.404 -23.205 18.457 131 HA ASP 16 HA ASP 16 17.222 -25.985 18.511 132 1HB ASP 16 HB2 ASP 16 14.500 -24.707 18.317 133 2HB ASP 16 HB1 ASP 16 14.740 -26.446 18.248 134 H GLY 17 HN GLY 17 17.138 -23.820 16.086 135 1HA GLY 17 HA2 GLY 17 17.575 -24.261 13.829 136 2HA GLY 17 HA1 GLY 17 17.104 -25.938 14.094 137 H SER 18 HN SER 18 14.837 -24.076 15.473 138 HA SER 18 HA SER 18 12.977 -24.407 13.284 139 1HB SER 18 HB2 SER 18 12.602 -23.343 16.095 140 2HB SER 18 HB1 SER 18 11.326 -23.803 14.965 141 HG SER 18 HG SER 18 11.698 -25.826 15.293 142 H ASP 19 HN ASP 19 12.281 -22.609 12.031 143 HA ASP 19 HA ASP 19 13.030 -20.067 13.092 144 1HB ASP 19 HB2 ASP 19 13.589 -19.336 10.840 145 2HB ASP 19 HB1 ASP 19 14.749 -20.471 11.538 146 H ILE 20 HN ILE 20 12.029 -18.324 11.991 147 HA ILE 20 HA ILE 20 9.201 -18.934 11.560 148 HB ILE 20 HB ILE 20 10.592 -16.345 12.367 149 1HG1 ILE 20 HG12 ILE 20 8.917 -18.249 14.028 150 2HG1 ILE 20 HG11 ILE 20 10.660 -18.052 14.135 151 1HG2 ILE 20 HG21 ILE 20 8.541 -15.896 11.121 152 2HG2 ILE 20 HG22 ILE 20 8.359 -15.459 12.818 153 3HG2 ILE 20 HG23 ILE 20 7.637 -16.948 12.216 154 1HD1 ILE 20 HD11 ILE 20 8.599 -15.952 14.790 155 2HD1 ILE 20 HD12 ILE 20 10.345 -15.747 14.905 156 3HD1 ILE 20 HD13 ILE 20 9.526 -16.903 15.951 157 H GLY 21 HN GLY 21 8.253 -18.258 9.696 158 1HA GLY 21 HA2 GLY 21 9.633 -18.129 7.327 159 2HA GLY 21 HA1 GLY 21 8.000 -17.529 7.546 160 HA PRO 22 HA PRO 22 11.342 -14.088 7.219 161 1HB PRO 22 HB2 PRO 22 11.977 -13.956 4.594 162 2HB PRO 22 HB1 PRO 22 12.900 -14.878 5.779 163 1HG PRO 22 HG2 PRO 22 10.935 -15.819 3.746 164 2HG PRO 22 HG1 PRO 22 12.395 -16.620 4.342 165 1HD PRO 22 HD2 PRO 22 9.828 -17.244 5.141 166 2HD PRO 22 HD1 PRO 22 11.292 -17.588 6.077 167 H LYS 23 HN LYS 23 10.749 -12.159 6.905 168 HA LYS 23 HA LYS 23 8.815 -11.442 4.816 169 1HB LYS 23 HB2 LYS 23 8.494 -10.615 7.720 170 2HB LYS 23 HB1 LYS 23 7.830 -9.647 6.422 171 1HG LYS 23 HG2 LYS 23 6.048 -10.942 7.189 172 2HG LYS 23 HG1 LYS 23 6.556 -11.712 5.703 173 1HD LYS 23 HD2 LYS 23 6.120 -13.459 7.260 174 2HD LYS 23 HD1 LYS 23 7.875 -13.318 7.139 175 1HE LYS 23 HE2 LYS 23 7.966 -12.079 9.209 176 2HE LYS 23 HE1 LYS 23 6.204 -12.058 9.310 177 1HZ LYS 23 HZ1 LYS 23 7.950 -14.469 9.496 178 2HZ LYS 23 HZ2 LYS 23 6.280 -14.479 9.352 179 3HZ LYS 23 HZ3 LYS 23 6.931 -13.822 10.717 180 H ALA 24 HN ALA 24 8.796 -9.013 4.426 181 HA ALA 24 HA ALA 24 11.620 -8.315 4.355 182 1HB ALA 24 HB1 ALA 24 11.078 -6.720 2.661 183 2HB ALA 24 HB2 ALA 24 9.369 -6.864 3.007 184 3HB ALA 24 HB3 ALA 24 10.228 -8.220 2.268 185 H PHE 25 HN PHE 25 12.533 -6.963 5.640 186 HA PHE 25 HA PHE 25 10.910 -5.044 7.181 187 1HB PHE 25 HB2 PHE 25 13.526 -6.356 7.967 188 2HB PHE 25 HB1 PHE 25 12.594 -5.238 8.934 189 HD1 PHE 25 HD1 PHE 25 12.517 -8.576 7.405 190 HD2 PHE 25 HD2 PHE 25 11.046 -6.083 10.494 191 HE1 PHE 25 HE1 PHE 25 11.518 -10.524 8.476 192 HE2 PHE 25 HE2 PHE 25 10.025 -8.045 11.577 193 HZ PHE 25 HZ PHE 25 10.308 -10.309 10.507 194 HA PRO 26 HA PRO 26 13.769 -2.271 5.062 195 1HB PRO 26 HB2 PRO 26 12.839 -0.445 7.196 196 2HB PRO 26 HB1 PRO 26 12.875 -0.149 5.468 197 1HG PRO 26 HG2 PRO 26 10.566 -0.613 6.726 198 2HG PRO 26 HG1 PRO 26 10.857 -1.321 5.127 199 1HD PRO 26 HD2 PRO 26 10.997 -2.601 7.824 200 2HD PRO 26 HD1 PRO 26 10.369 -3.253 6.290 201 H ASP 27 HN ASP 27 15.844 -1.616 5.657 202 HA ASP 27 HA ASP 27 16.905 -2.567 8.123 203 1HB ASP 27 HB2 ASP 27 19.047 -1.631 7.393 204 2HB ASP 27 HB1 ASP 27 18.269 -2.516 6.085 205 H ALA 28 HN ALA 28 15.407 0.221 7.172 206 HA ALA 28 HA ALA 28 16.470 1.997 9.178 207 1HB ALA 28 HB1 ALA 28 14.015 2.299 7.446 208 2HB ALA 28 HB2 ALA 28 15.630 2.880 7.048 209 3HB ALA 28 HB3 ALA 28 14.756 3.569 8.416 210 H THR 29 HN THR 29 14.524 -0.626 9.428 211 HA THR 29 HA THR 29 12.559 0.333 11.291 212 HB THR 29 HB THR 29 13.530 -2.505 10.802 213 HG1 THR 29 HG1 THR 29 12.699 -2.120 8.985 214 1HG2 THR 29 HG21 THR 29 10.929 -1.475 11.976 215 2HG2 THR 29 HG22 THR 29 12.225 -2.254 12.883 216 3HG2 THR 29 HG23 THR 29 11.326 -3.169 11.677 217 H THR 30 HN THR 30 12.688 0.279 13.546 218 HA THR 30 HA THR 30 15.339 0.190 14.587 219 HB THR 30 HB THR 30 14.330 0.951 16.655 220 HG1 THR 30 HG1 THR 30 11.832 1.449 15.757 221 1HG2 THR 30 HG21 THR 30 14.889 2.600 14.937 222 2HG2 THR 30 HG22 THR 30 13.456 3.103 15.833 223 3HG2 THR 30 HG23 THR 30 13.290 2.410 14.219 224 H VAL 31 HN VAL 31 15.853 -1.032 16.532 225 HA VAL 31 HA VAL 31 15.142 -3.743 16.295 226 HB VAL 31 HB VAL 31 16.556 -2.327 18.574 227 1HG1 VAL 31 HG11 VAL 31 17.416 -4.544 19.191 228 2HG1 VAL 31 HG12 VAL 31 16.445 -5.282 17.920 229 3HG1 VAL 31 HG13 VAL 31 15.656 -4.503 19.292 230 1HG2 VAL 31 HG21 VAL 31 17.644 -3.854 16.213 231 2HG2 VAL 31 HG22 VAL 31 18.600 -3.122 17.511 232 3HG2 VAL 31 HG23 VAL 31 17.668 -2.104 16.420 233 H SER 32 HN SER 32 13.862 -1.113 18.144 234 HA SER 32 HA SER 32 12.420 -2.541 20.075 235 1HB SER 32 HB2 SER 32 11.724 0.086 18.729 236 2HB SER 32 HB1 SER 32 10.961 -0.538 20.192 237 HG SER 32 HG SER 32 13.773 -0.054 19.978 238 H ALA 33 HN ALA 33 11.464 -1.461 16.811 239 HA ALA 33 HA ALA 33 8.908 -2.747 16.949 240 1HB ALA 33 HB1 ALA 33 8.710 -2.107 14.589 241 2HB ALA 33 HB2 ALA 33 10.414 -1.656 14.564 242 3HB ALA 33 HB3 ALA 33 9.277 -0.756 15.567 243 H LEU 34 HN LEU 34 12.146 -3.687 15.772 244 HA LEU 34 HA LEU 34 11.456 -5.860 14.253 245 1HB LEU 34 HB2 LEU 34 13.623 -4.736 14.280 246 2HB LEU 34 HB1 LEU 34 13.803 -5.164 15.968 247 HG LEU 34 HG LEU 34 13.885 -7.400 15.448 248 1HD1 LEU 34 HD11 LEU 34 13.867 -6.508 12.526 249 2HD1 LEU 34 HD12 LEU 34 12.620 -7.471 13.313 250 3HD1 LEU 34 HD13 LEU 34 14.218 -8.162 13.030 251 1HD2 LEU 34 HD21 LEU 34 16.142 -7.435 14.369 252 2HD2 LEU 34 HD22 LEU 34 15.950 -6.249 15.659 253 3HD2 LEU 34 HD23 LEU 34 15.903 -5.734 13.972 254 H LYS 35 HN LYS 35 12.314 -5.484 17.676 255 HA LYS 35 HA LYS 35 12.110 -8.177 18.468 256 1HB LYS 35 HB2 LYS 35 13.171 -6.283 19.735 257 2HB LYS 35 HB1 LYS 35 11.562 -5.720 20.112 258 1HG LYS 35 HG2 LYS 35 12.263 -6.935 22.018 259 2HG LYS 35 HG1 LYS 35 11.121 -7.968 21.163 260 1HD LYS 35 HD2 LYS 35 13.000 -9.285 21.884 261 2HD LYS 35 HD1 LYS 35 13.041 -9.154 20.126 262 1HE LYS 35 HE2 LYS 35 15.257 -8.849 21.125 263 2HE LYS 35 HE1 LYS 35 14.746 -7.385 20.288 264 1HZ LYS 35 HZ1 LYS 35 14.125 -6.460 22.484 265 2HZ LYS 35 HZ2 LYS 35 15.740 -6.895 22.447 266 3HZ LYS 35 HZ3 LYS 35 14.623 -7.896 23.209 267 H GLU 36 HN GLU 36 9.796 -5.433 18.518 268 HA GLU 36 HA GLU 36 7.673 -6.474 19.816 269 1HB GLU 36 HB2 GLU 36 8.333 -4.166 18.998 270 2HB GLU 36 HB1 GLU 36 7.792 -4.665 17.420 271 1HG GLU 36 HG2 GLU 36 6.157 -4.415 19.873 272 2HG GLU 36 HG1 GLU 36 6.357 -3.233 18.590 273 H THR 37 HN THR 37 8.648 -6.672 16.417 274 HA THR 37 HA THR 37 6.371 -7.961 15.416 275 HB THR 37 HB THR 37 9.218 -8.139 14.377 276 HG1 THR 37 HG1 THR 37 8.515 -5.971 14.559 277 1HG2 THR 37 HG21 THR 37 8.118 -8.551 12.196 278 2HG2 THR 37 HG22 THR 37 6.545 -8.513 12.994 279 3HG2 THR 37 HG23 THR 37 7.698 -9.792 13.377 280 H VAL 38 HN VAL 38 9.428 -9.221 16.736 281 HA VAL 38 HA VAL 38 8.965 -11.966 16.335 282 HB VAL 38 HB VAL 38 10.489 -10.644 18.612 283 1HG1 VAL 38 HG11 VAL 38 11.692 -12.765 18.817 284 2HG1 VAL 38 HG12 VAL 38 10.651 -13.480 17.584 285 3HG1 VAL 38 HG13 VAL 38 9.968 -12.965 19.130 286 1HG2 VAL 38 HG21 VAL 38 11.461 -11.701 15.971 287 2HG2 VAL 38 HG22 VAL 38 12.487 -11.075 17.262 288 3HG2 VAL 38 HG23 VAL 38 11.359 -9.999 16.428 289 H ILE 39 HN ILE 39 8.104 -9.805 18.959 290 HA ILE 39 HA ILE 39 7.031 -11.719 20.739 291 HB ILE 39 HB ILE 39 6.099 -8.833 20.505 292 1HG1 ILE 39 HG12 ILE 39 8.522 -8.794 20.619 293 2HG1 ILE 39 HG11 ILE 39 7.843 -8.276 22.155 294 1HG2 ILE 39 HG21 ILE 39 4.736 -10.163 22.035 295 2HG2 ILE 39 HG22 ILE 39 5.732 -9.027 22.964 296 3HG2 ILE 39 HG23 ILE 39 6.188 -10.713 22.871 297 1HD1 ILE 39 HD11 ILE 39 8.967 -10.991 21.562 298 2HD1 ILE 39 HD12 ILE 39 8.339 -10.428 23.124 299 3HD1 ILE 39 HD13 ILE 39 9.778 -9.679 22.414 300 H SER 40 HN SER 40 5.656 -10.011 18.006 301 HA SER 40 HA SER 40 2.967 -10.877 18.500 302 1HB SER 40 HB2 SER 40 3.476 -8.790 17.255 303 2HB SER 40 HB1 SER 40 4.215 -9.745 15.978 304 HG SER 40 HG SER 40 2.151 -10.718 15.639 305 H GLU 41 HN GLU 41 5.673 -11.998 16.431 306 HA GLU 41 HA GLU 41 4.218 -13.914 15.010 307 1HB GLU 41 HB2 GLU 41 7.141 -13.461 15.489 308 2HB GLU 41 HB1 GLU 41 6.499 -14.691 14.417 309 1HG GLU 41 HG2 GLU 41 6.032 -11.730 14.151 310 2HG GLU 41 HG1 GLU 41 7.193 -12.669 13.213 311 H TRP 42 HN TRP 42 6.220 -14.026 17.903 312 HA TRP 42 HA TRP 42 5.933 -16.879 18.128 313 1HB TRP 42 HB2 TRP 42 7.965 -15.578 18.903 314 2HB TRP 42 HB1 TRP 42 6.955 -14.861 20.148 315 HD1 TRP 42 HD1 TRP 42 5.914 -16.731 22.000 316 HE1 TRP 42 HE1 TRP 42 7.081 -18.795 22.980 317 HE3 TRP 42 HE3 TRP 42 9.539 -17.336 18.465 318 HZ2 TRP 42 HZ2 TRP 42 9.257 -20.477 22.326 319 HZ3 TRP 42 HZ3 TRP 42 11.114 -19.199 18.715 320 HH2 TRP 42 HH2 TRP 42 10.979 -20.732 20.602 321 HA PRO 43 HA PRO 43 1.871 -16.548 19.963 322 1HB PRO 43 HB2 PRO 43 2.874 -18.962 21.387 323 2HB PRO 43 HB1 PRO 43 1.315 -18.719 20.595 324 1HG PRO 43 HG2 PRO 43 3.189 -20.149 19.387 325 2HG PRO 43 HG1 PRO 43 2.248 -18.975 18.448 326 1HD PRO 43 HD2 PRO 43 5.050 -18.777 19.457 327 2HD PRO 43 HD1 PRO 43 4.339 -18.187 17.937 328 H ARG 44 HN ARG 44 1.720 -14.952 21.403 329 HA ARG 44 HA ARG 44 3.361 -14.550 23.662 330 1HB ARG 44 HB2 ARG 44 0.625 -13.441 23.065 331 2HB ARG 44 HB1 ARG 44 1.648 -12.890 24.377 332 1HG ARG 44 HG2 ARG 44 3.353 -12.232 22.697 333 2HG ARG 44 HG1 ARG 44 2.211 -12.672 21.425 334 1HD ARG 44 HD2 ARG 44 2.158 -10.273 21.887 335 2HD ARG 44 HD1 ARG 44 0.613 -11.034 22.285 336 HE ARG 44 HE ARG 44 2.247 -11.036 24.541 337 1HH1 ARG 44 HH11 ARG 44 0.473 -8.685 22.588 338 2HH1 ARG 44 HH12 ARG 44 0.185 -7.622 23.889 339 1HH2 ARG 44 HH21 ARG 44 1.867 -9.574 26.325 340 2HH2 ARG 44 HH22 ARG 44 0.990 -8.149 26.071 341 H GLU 45 HN GLU 45 0.654 -16.479 23.146 342 HA GLU 45 HA GLU 45 -0.250 -16.766 25.812 343 1HB GLU 45 HB2 GLU 45 -0.559 -18.559 23.411 344 2HB GLU 45 HB1 GLU 45 -1.464 -18.718 24.918 345 1HG GLU 45 HG2 GLU 45 -2.489 -16.582 24.607 346 2HG GLU 45 HG1 GLU 45 -1.481 -16.253 23.203 347 H LYS 46 HN LYS 46 2.523 -17.979 24.147 348 HA LYS 46 HA LYS 46 2.959 -20.233 25.789 349 1HB LYS 46 HB2 LYS 46 4.530 -18.637 23.832 350 2HB LYS 46 HB1 LYS 46 5.314 -19.874 24.772 351 1HG LYS 46 HG2 LYS 46 3.815 -21.544 23.818 352 2HG LYS 46 HG1 LYS 46 2.972 -20.285 22.913 353 1HD LYS 46 HD2 LYS 46 4.973 -19.793 21.660 354 2HD LYS 46 HD1 LYS 46 5.912 -20.907 22.642 355 1HE LYS 46 HE2 LYS 46 3.600 -21.672 20.866 356 2HE LYS 46 HE1 LYS 46 5.302 -21.845 20.439 357 1HZ LYS 46 HZ1 LYS 46 5.567 -23.345 22.306 358 2HZ LYS 46 HZ2 LYS 46 4.436 -23.915 21.224 359 3HZ LYS 46 HZ3 LYS 46 3.922 -23.227 22.687 360 H GLU 47 HN GLU 47 4.100 -20.281 27.679 361 HA GLU 47 HA GLU 47 5.244 -17.802 28.486 362 1HB GLU 47 HB2 GLU 47 3.137 -17.979 29.568 363 2HB GLU 47 HB1 GLU 47 3.493 -19.593 30.187 364 1HG GLU 47 HG2 GLU 47 5.132 -18.631 31.684 365 2HG GLU 47 HG1 GLU 47 4.887 -17.035 30.969 366 H ASN 48 HN ASN 48 6.845 -18.077 30.175 367 HA ASN 48 HA ASN 48 8.860 -18.859 30.847 368 1HB ASN 48 HB2 ASN 48 7.485 -21.541 30.619 369 2HB ASN 48 HB1 ASN 48 9.168 -21.417 31.111 370 1HD2 ASN 48 HD21 ASN 48 8.690 -22.257 33.145 371 2HD2 ASN 48 HD22 ASN 48 7.869 -21.349 34.346 372 H GLY 49 HN GLY 49 8.029 -18.689 27.975 373 1HA GLY 49 HA2 GLY 49 10.636 -19.583 27.000 374 2HA GLY 49 HA1 GLY 49 9.182 -19.564 25.985 375 HA PRO 50 HA PRO 50 9.914 -15.176 25.552 376 1HB PRO 50 HB2 PRO 50 7.720 -14.423 24.388 377 2HB PRO 50 HB1 PRO 50 8.629 -15.735 23.623 378 1HG PRO 50 HG2 PRO 50 6.209 -15.920 25.394 379 2HG PRO 50 HG1 PRO 50 6.513 -16.741 23.852 380 1HD PRO 50 HD2 PRO 50 6.984 -17.855 26.348 381 2HD PRO 50 HD1 PRO 50 7.759 -18.381 24.839 382 H LYS 51 HN LYS 51 8.380 -13.113 25.915 383 HA LYS 51 HA LYS 51 6.371 -13.269 27.846 384 1HB LYS 51 HB2 LYS 51 8.239 -13.545 29.423 385 2HB LYS 51 HB1 LYS 51 9.015 -12.106 28.795 386 1HG LYS 51 HG2 LYS 51 7.948 -11.689 30.955 387 2HG LYS 51 HG1 LYS 51 7.208 -10.724 29.684 388 1HD LYS 51 HD2 LYS 51 5.356 -12.328 29.555 389 2HD LYS 51 HD1 LYS 51 6.116 -13.304 30.818 390 1HE LYS 51 HE2 LYS 51 5.904 -11.476 32.395 391 2HE LYS 51 HE1 LYS 51 5.236 -10.439 31.138 392 1HZ LYS 51 HZ1 LYS 51 3.334 -11.953 30.995 393 2HZ LYS 51 HZ2 LYS 51 3.505 -11.279 32.513 394 3HZ LYS 51 HZ3 LYS 51 3.950 -12.897 32.248 395 H THR 52 HN THR 52 8.711 -10.638 27.511 396 HA THR 52 HA THR 52 6.795 -9.286 25.823 397 HB THR 52 HB THR 52 7.316 -7.210 27.010 398 HG1 THR 52 HG1 THR 52 8.002 -7.718 29.347 399 1HG2 THR 52 HG21 THR 52 5.780 -7.620 28.902 400 2HG2 THR 52 HG22 THR 52 5.939 -9.357 28.631 401 3HG2 THR 52 HG23 THR 52 5.203 -8.332 27.397 402 H VAL 53 HN VAL 53 7.840 -7.171 25.022 403 HA VAL 53 HA VAL 53 9.894 -7.661 23.244 404 HB VAL 53 HB VAL 53 9.171 -5.004 24.533 405 1HG1 VAL 53 HG11 VAL 53 9.972 -3.970 22.472 406 2HG1 VAL 53 HG12 VAL 53 10.448 -5.560 21.871 407 3HG1 VAL 53 HG13 VAL 53 11.250 -4.878 23.286 408 1HG2 VAL 53 HG21 VAL 53 8.025 -6.283 22.053 409 2HG2 VAL 53 HG22 VAL 53 7.630 -4.680 22.663 410 3HG2 VAL 53 HG23 VAL 53 7.198 -6.109 23.601 411 H LYS 54 HN LYS 54 10.030 -6.315 26.473 412 HA LYS 54 HA LYS 54 12.731 -5.585 26.681 413 1HB LYS 54 HB2 LYS 54 11.034 -4.766 28.146 414 2HB LYS 54 HB1 LYS 54 10.648 -6.389 28.686 415 1HG LYS 54 HG2 LYS 54 12.932 -6.494 29.689 416 2HG LYS 54 HG1 LYS 54 13.111 -4.778 29.285 417 1HD LYS 54 HD2 LYS 54 11.164 -4.225 30.604 418 2HD LYS 54 HD1 LYS 54 10.875 -5.927 30.950 419 1HE LYS 54 HE2 LYS 54 13.048 -6.024 32.099 420 2HE LYS 54 HE1 LYS 54 13.253 -4.297 31.809 421 1HZ LYS 54 HZ1 LYS 54 11.077 -5.557 33.369 422 2HZ LYS 54 HZ2 LYS 54 11.223 -3.903 33.105 423 3HZ LYS 54 HZ3 LYS 54 12.389 -4.728 34.022 424 H GLU 55 HN GLU 55 11.066 -8.616 27.322 425 HA GLU 55 HA GLU 55 13.254 -9.743 28.846 426 1HB GLU 55 HB2 GLU 55 10.680 -11.000 27.943 427 2HB GLU 55 HB1 GLU 55 11.813 -11.690 29.096 428 1HG GLU 55 HG2 GLU 55 10.267 -9.129 29.463 429 2HG GLU 55 HG1 GLU 55 9.881 -10.679 30.202 430 H VAL 56 HN VAL 56 12.208 -9.879 25.577 431 HA VAL 56 HA VAL 56 13.689 -12.351 25.091 432 HB VAL 56 HB VAL 56 11.947 -10.727 23.201 433 1HG1 VAL 56 HG11 VAL 56 13.637 -11.993 21.980 434 2HG1 VAL 56 HG12 VAL 56 12.036 -12.685 21.721 435 3HG1 VAL 56 HG13 VAL 56 13.168 -13.466 22.829 436 1HG2 VAL 56 HG21 VAL 56 10.656 -11.737 25.001 437 2HG2 VAL 56 HG22 VAL 56 11.380 -13.308 24.660 438 3HG2 VAL 56 HG23 VAL 56 10.319 -12.550 23.473 439 H LYS 57 HN LYS 57 15.589 -12.447 23.882 440 HA LYS 57 HA LYS 57 16.781 -9.854 23.301 441 1HB LYS 57 HB2 LYS 57 18.034 -12.522 23.885 442 2HB LYS 57 HB1 LYS 57 18.923 -11.064 23.464 443 1HG LYS 57 HG2 LYS 57 18.062 -9.968 25.473 444 2HG LYS 57 HG1 LYS 57 17.165 -11.430 25.876 445 1HD LYS 57 HD2 LYS 57 19.260 -12.673 26.023 446 2HD LYS 57 HD1 LYS 57 20.158 -11.204 25.629 447 1HE LYS 57 HE2 LYS 57 19.287 -10.125 27.631 448 2HE LYS 57 HE1 LYS 57 18.358 -11.575 28.008 449 1HZ LYS 57 HZ1 LYS 57 20.474 -12.786 28.224 450 2HZ LYS 57 HZ2 LYS 57 20.357 -11.528 29.303 451 3HZ LYS 57 HZ3 LYS 57 21.319 -11.361 27.936 452 H LEU 58 HN LEU 58 17.816 -9.500 21.373 453 HA LEU 58 HA LEU 58 17.310 -11.460 19.251 454 1HB LEU 58 HB2 LEU 58 15.826 -9.408 19.261 455 2HB LEU 58 HB1 LEU 58 17.252 -8.423 19.069 456 HG LEU 58 HG LEU 58 15.954 -8.643 16.991 457 1HD1 LEU 58 HD11 LEU 58 17.734 -9.288 15.494 458 2HD1 LEU 58 HD12 LEU 58 18.592 -10.050 16.837 459 3HD1 LEU 58 HD13 LEU 58 18.332 -8.307 16.834 460 1HD2 LEU 58 HD21 LEU 58 16.581 -11.584 17.201 461 2HD2 LEU 58 HD22 LEU 58 15.804 -10.781 15.838 462 3HD2 LEU 58 HD23 LEU 58 14.996 -10.837 17.404 463 H ILE 59 HN ILE 59 19.152 -12.068 18.140 464 HA ILE 59 HA ILE 59 21.610 -10.430 18.335 465 HB ILE 59 HB ILE 59 21.376 -13.374 19.009 466 1HG1 ILE 59 HG12 ILE 59 22.283 -10.990 20.637 467 2HG1 ILE 59 HG11 ILE 59 20.863 -11.985 20.921 468 1HG2 ILE 59 HG21 ILE 59 23.811 -13.392 19.261 469 2HG2 ILE 59 HG22 ILE 59 23.875 -11.746 18.630 470 3HG2 ILE 59 HG23 ILE 59 23.305 -13.060 17.604 471 1HD1 ILE 59 HD11 ILE 59 22.571 -12.539 22.527 472 2HD1 ILE 59 HD12 ILE 59 23.742 -12.762 21.242 473 3HD1 ILE 59 HD13 ILE 59 22.422 -13.904 21.406 474 H SER 60 HN SER 60 22.553 -10.112 16.528 475 HA SER 60 HA SER 60 22.365 -12.139 14.433 476 1HB SER 60 HB2 SER 60 22.394 -10.292 12.790 477 2HB SER 60 HB1 SER 60 20.939 -10.230 13.790 478 HG SER 60 HG SER 60 23.253 -8.795 14.485 479 H ALA 61 HN ALA 61 24.332 -12.761 13.767 480 HA ALA 61 HA ALA 61 26.576 -12.925 13.489 481 1HB ALA 61 HB1 ALA 61 26.561 -9.907 13.726 482 2HB ALA 61 HB2 ALA 61 26.341 -10.814 12.229 483 3HB ALA 61 HB3 ALA 61 27.882 -10.880 13.085 484 H GLY 62 HN GLY 62 25.296 -12.777 16.148 485 1HA GLY 62 HA2 GLY 62 26.122 -13.339 18.256 486 2HA GLY 62 HA1 GLY 62 27.730 -12.896 17.709 487 H LYS 63 HN LYS 63 25.454 -10.396 17.019 488 HA LYS 63 HA LYS 63 26.465 -8.904 19.273 489 1HB LYS 63 HB2 LYS 63 25.588 -8.252 16.506 490 2HB LYS 63 HB1 LYS 63 25.359 -7.060 17.746 491 1HG LYS 63 HG2 LYS 63 27.370 -6.582 16.435 492 2HG LYS 63 HG1 LYS 63 27.820 -6.973 18.079 493 1HD LYS 63 HD2 LYS 63 27.888 -9.074 15.925 494 2HD LYS 63 HD1 LYS 63 29.202 -7.913 16.076 495 1HE LYS 63 HE2 LYS 63 29.594 -8.657 18.368 496 2HE LYS 63 HE1 LYS 63 28.239 -9.778 18.244 497 1HZ LYS 63 HZ1 LYS 63 30.351 -10.903 17.886 498 2HZ LYS 63 HZ2 LYS 63 30.690 -9.897 16.555 499 3HZ LYS 63 HZ3 LYS 63 29.401 -10.947 16.500 500 H VAL 64 HN VAL 64 25.015 -7.967 20.628 501 HA VAL 64 HA VAL 64 22.270 -8.903 20.482 502 HB VAL 64 HB VAL 64 23.612 -7.221 22.614 503 1HG1 VAL 64 HG11 VAL 64 21.194 -7.022 22.645 504 2HG1 VAL 64 HG12 VAL 64 21.746 -7.933 24.052 505 3HG1 VAL 64 HG13 VAL 64 21.028 -8.777 22.680 506 1HG2 VAL 64 HG21 VAL 64 24.727 -9.378 22.444 507 2HG2 VAL 64 HG22 VAL 64 23.177 -10.211 22.572 508 3HG2 VAL 64 HG23 VAL 64 23.796 -9.283 23.938 509 H LEU 65 HN LEU 65 20.755 -7.679 19.587 510 HA LEU 65 HA LEU 65 21.432 -5.005 18.935 511 1HB LEU 65 HB2 LEU 65 19.065 -6.718 18.259 512 2HB LEU 65 HB1 LEU 65 19.136 -5.024 17.849 513 HG LEU 65 HG LEU 65 21.247 -5.538 16.565 514 1HD1 LEU 65 HD11 LEU 65 20.406 -8.384 16.953 515 2HD1 LEU 65 HD12 LEU 65 21.868 -7.609 17.554 516 3HD1 LEU 65 HD13 LEU 65 21.627 -7.811 15.819 517 1HD2 LEU 65 HD21 LEU 65 20.065 -6.441 14.602 518 2HD2 LEU 65 HD22 LEU 65 19.196 -5.134 15.392 519 3HD2 LEU 65 HD23 LEU 65 18.669 -6.798 15.620 520 H GLU 66 HN GLU 66 21.158 -3.452 20.162 521 HA GLU 66 HA GLU 66 19.628 -3.554 22.580 522 1HB GLU 66 HB2 GLU 66 21.930 -2.421 21.955 523 2HB GLU 66 HB1 GLU 66 20.926 -1.133 21.333 524 1HG GLU 66 HG2 GLU 66 20.975 -2.109 24.173 525 2HG GLU 66 HG1 GLU 66 21.801 -0.682 23.565 526 H ASN 67 HN ASN 67 17.716 -2.158 22.933 527 HA ASN 67 HA ASN 67 16.005 -2.302 20.681 528 1HB ASN 67 HB2 ASN 67 14.197 -1.570 22.060 529 2HB ASN 67 HB1 ASN 67 15.217 -2.599 23.047 530 1HD2 ASN 67 HD21 ASN 67 13.268 -0.660 23.849 531 2HD2 ASN 67 HD22 ASN 67 14.081 0.510 24.822 532 H SER 68 HN SER 68 17.899 0.298 21.910 533 HA SER 68 HA SER 68 16.384 2.323 20.521 534 1HB SER 68 HB2 SER 68 19.066 2.520 21.902 535 2HB SER 68 HB1 SER 68 18.022 3.864 21.438 536 HG SER 68 HG SER 68 17.446 1.810 23.299 537 H LYS 69 HN LYS 69 18.333 -0.015 19.390 538 HA LYS 69 HA LYS 69 19.831 1.583 17.512 539 1HB LYS 69 HB2 LYS 69 19.754 -1.328 18.189 540 2HB LYS 69 HB1 LYS 69 20.600 -0.718 16.786 541 1HG LYS 69 HG2 LYS 69 21.152 0.141 19.616 542 2HG LYS 69 HG1 LYS 69 22.076 -1.092 18.743 543 1HD LYS 69 HD2 LYS 69 22.576 0.592 17.001 544 2HD LYS 69 HD1 LYS 69 21.741 1.795 17.977 545 1HE LYS 69 HE2 LYS 69 23.347 1.536 19.740 546 2HE LYS 69 HE1 LYS 69 24.142 0.225 18.866 547 1HZ LYS 69 HZ1 LYS 69 24.665 1.738 17.114 548 2HZ LYS 69 HZ2 LYS 69 25.313 2.314 18.573 549 3HZ LYS 69 HZ3 LYS 69 23.929 3.029 17.919 550 H THR 70 HN THR 70 19.827 0.888 15.273 551 HA THR 70 HA THR 70 17.145 0.145 14.348 552 HB THR 70 HB THR 70 19.249 1.489 12.698 553 HG1 THR 70 HG1 THR 70 17.663 2.596 14.785 554 1HG2 THR 70 HG21 THR 70 17.264 0.664 11.583 555 2HG2 THR 70 HG22 THR 70 17.283 2.431 11.544 556 3HG2 THR 70 HG23 THR 70 16.250 1.577 12.698 557 H VAL 71 HN VAL 71 17.278 -1.187 12.268 558 HA VAL 71 HA VAL 71 19.044 -3.396 12.622 559 HB VAL 71 HB VAL 71 17.459 -2.644 10.134 560 1HG1 VAL 71 HG11 VAL 71 19.226 -4.243 9.600 561 2HG1 VAL 71 HG12 VAL 71 17.647 -5.022 9.506 562 3HG1 VAL 71 HG13 VAL 71 18.683 -5.299 10.904 563 1HG2 VAL 71 HG21 VAL 71 16.016 -2.946 12.073 564 2HG2 VAL 71 HG22 VAL 71 16.762 -4.510 12.398 565 3HG2 VAL 71 HG23 VAL 71 15.805 -4.279 10.935 566 H LYS 72 HN LYS 72 19.037 -0.675 10.484 567 HA LYS 72 HA LYS 72 21.149 -1.094 8.798 568 1HB LYS 72 HB2 LYS 72 19.591 0.764 8.654 569 2HB LYS 72 HB1 LYS 72 20.271 1.446 10.122 570 1HG LYS 72 HG2 LYS 72 22.401 1.795 8.975 571 2HG LYS 72 HG1 LYS 72 21.718 1.109 7.501 572 1HD LYS 72 HD2 LYS 72 21.677 3.538 7.407 573 2HD LYS 72 HD1 LYS 72 20.034 2.899 7.461 574 1HE LYS 72 HE2 LYS 72 19.942 3.387 9.873 575 2HE LYS 72 HE1 LYS 72 21.582 4.032 9.796 576 1HZ LYS 72 HZ1 LYS 72 19.936 5.774 9.725 577 2HZ LYS 72 HZ2 LYS 72 19.203 5.081 8.395 578 3HZ LYS 72 HZ3 LYS 72 20.766 5.718 8.253 579 H ASP 73 HN ASP 73 21.283 -0.181 12.208 580 HA ASP 73 HA ASP 73 23.921 0.885 12.140 581 1HB ASP 73 HB2 ASP 73 22.304 1.459 13.909 582 2HB ASP 73 HB1 ASP 73 22.412 -0.180 14.532 583 H TYR 74 HN TYR 74 22.688 -2.353 12.630 584 HA TYR 74 HA TYR 74 25.395 -3.251 13.195 585 1HB TYR 74 HB2 TYR 74 22.728 -4.600 13.437 586 2HB TYR 74 HB1 TYR 74 24.241 -5.474 13.535 587 HD1 TYR 74 HD1 TYR 74 21.793 -3.621 15.352 588 HD2 TYR 74 HD2 TYR 74 25.902 -4.704 15.347 589 HE1 TYR 74 HE1 TYR 74 21.916 -3.154 17.764 590 HE2 TYR 74 HE2 TYR 74 26.039 -4.242 17.753 591 HH TYR 74 HH TYR 74 23.452 -4.026 19.700 592 H ARG 75 HN ARG 75 23.277 -2.891 10.558 593 HA ARG 75 HA ARG 75 23.928 -5.263 9.209 594 1HB ARG 75 HB2 ARG 75 21.797 -4.019 9.000 595 2HB ARG 75 HB1 ARG 75 22.683 -2.717 8.211 596 1HG ARG 75 HG2 ARG 75 23.440 -4.237 6.556 597 2HG ARG 75 HG1 ARG 75 22.508 -5.526 7.342 598 1HD ARG 75 HD2 ARG 75 21.191 -4.738 5.470 599 2HD ARG 75 HD1 ARG 75 20.472 -4.158 6.971 600 HE ARG 75 HE ARG 75 21.355 -1.977 6.501 601 1HH1 ARG 75 HH11 ARG 75 21.664 -4.247 3.821 602 2HH1 ARG 75 HH12 ARG 75 21.548 -3.094 2.586 603 1HH2 ARG 75 HH21 ARG 75 21.168 -0.311 4.778 604 2HH2 ARG 75 HH22 ARG 75 21.233 -0.791 3.164 605 H SER 76 HN SER 76 25.425 -5.536 7.618 606 HA SER 76 HA SER 76 27.452 -3.565 7.296 607 1HB SER 76 HB2 SER 76 27.044 -6.296 6.065 608 2HB SER 76 HB1 SER 76 28.530 -5.348 6.023 609 HG SER 76 HG SER 76 28.763 -5.578 8.169 610 HA PRO 77 HA PRO 77 25.759 -2.039 3.370 611 1HB PRO 77 HB2 PRO 77 28.502 -1.814 2.322 612 2HB PRO 77 HB1 PRO 77 27.354 -0.525 2.688 613 1HG PRO 77 HG2 PRO 77 29.534 -0.895 4.197 614 2HG PRO 77 HG1 PRO 77 27.986 -0.421 4.919 615 1HD PRO 77 HD2 PRO 77 29.231 -3.148 4.761 616 2HD PRO 77 HD1 PRO 77 28.498 -2.323 6.158 617 H VAL 78 HN VAL 78 26.993 -2.291 0.826 618 HA VAL 78 HA VAL 78 27.276 -3.553 -0.942 619 HB VAL 78 HB VAL 78 27.836 -5.558 1.088 620 1HG1 VAL 78 HG11 VAL 78 28.885 -6.993 -0.801 621 2HG1 VAL 78 HG12 VAL 78 28.270 -5.801 -1.948 622 3HG1 VAL 78 HG13 VAL 78 27.146 -6.775 -1.004 623 1HG2 VAL 78 HG21 VAL 78 29.684 -4.024 -0.711 624 2HG2 VAL 78 HG22 VAL 78 30.232 -5.313 0.362 625 3HG2 VAL 78 HG23 VAL 78 29.486 -3.864 1.033 626 H SER 79 HN SER 79 25.406 -5.101 1.398 627 HA SER 79 HA SER 79 23.719 -6.486 -0.477 628 1HB SER 79 HB2 SER 79 23.242 -5.944 2.461 629 2HB SER 79 HB1 SER 79 22.308 -7.060 1.467 630 HG SER 79 HG SER 79 24.795 -7.343 2.599 631 H ASN 80 HN ASN 80 22.725 -5.170 -1.875 632 HA ASN 80 HA ASN 80 20.800 -3.228 -0.794 633 1HB ASN 80 HB2 ASN 80 22.578 -2.792 -3.207 634 2HB ASN 80 HB1 ASN 80 21.256 -1.748 -2.721 635 1HD2 ASN 80 HD21 ASN 80 24.520 -2.690 -2.134 636 2HD2 ASN 80 HD22 ASN 80 24.896 -1.468 -0.976 637 H LEU 81 HN LEU 81 20.670 -6.136 -1.952 638 HA LEU 81 HA LEU 81 19.465 -5.974 -4.402 639 1HB LEU 81 HB2 LEU 81 19.401 -7.905 -2.186 640 2HB LEU 81 HB1 LEU 81 18.821 -8.192 -3.783 641 HG LEU 81 HG LEU 81 21.719 -7.677 -3.089 642 1HD1 LEU 81 HD11 LEU 81 20.333 -10.228 -3.908 643 2HD1 LEU 81 HD12 LEU 81 20.970 -9.860 -2.304 644 3HD1 LEU 81 HD13 LEU 81 22.069 -10.029 -3.673 645 1HD2 LEU 81 HD21 LEU 81 20.425 -8.433 -5.712 646 2HD2 LEU 81 HD22 LEU 81 22.157 -8.319 -5.422 647 3HD2 LEU 81 HD23 LEU 81 21.155 -6.872 -5.329 648 H ALA 82 HN ALA 82 17.227 -6.832 -4.612 649 HA ALA 82 HA ALA 82 15.529 -5.378 -2.860 650 1HB ALA 82 HB1 ALA 82 13.837 -5.528 -4.674 651 2HB ALA 82 HB2 ALA 82 15.016 -6.408 -5.650 652 3HB ALA 82 HB3 ALA 82 15.326 -4.737 -5.187 653 H GLY 83 HN GLY 83 15.383 -6.807 -1.295 654 1HA GLY 83 HA2 GLY 83 13.996 -8.461 -0.262 655 2HA GLY 83 HA1 GLY 83 13.815 -9.235 -1.838 656 H ALA 84 HN ALA 84 16.459 -8.321 0.331 657 HA ALA 84 HA ALA 84 17.812 -10.833 -0.332 658 1HB ALA 84 HB1 ALA 84 19.766 -9.828 0.790 659 2HB ALA 84 HB2 ALA 84 18.806 -8.397 1.170 660 3HB ALA 84 HB3 ALA 84 19.167 -8.801 -0.508 661 H VAL 85 HN VAL 85 17.791 -12.453 1.103 662 HA VAL 85 HA VAL 85 16.322 -11.992 3.546 663 HB VAL 85 HB VAL 85 17.420 -14.611 2.514 664 1HG1 VAL 85 HG11 VAL 85 15.282 -14.034 4.563 665 2HG1 VAL 85 HG12 VAL 85 16.896 -14.649 4.894 666 3HG1 VAL 85 HG13 VAL 85 15.742 -15.639 3.996 667 1HG2 VAL 85 HG21 VAL 85 15.163 -15.065 1.674 668 2HG2 VAL 85 HG22 VAL 85 15.879 -13.662 0.881 669 3HG2 VAL 85 HG23 VAL 85 14.659 -13.443 2.136 670 H THR 86 HN THR 86 17.120 -11.920 5.448 671 HA THR 86 HA THR 86 19.962 -12.501 5.919 672 HB THR 86 HB THR 86 18.161 -10.491 7.318 673 HG1 THR 86 HG1 THR 86 19.159 -10.266 5.008 674 1HG2 THR 86 HG21 THR 86 19.964 -11.388 8.752 675 2HG2 THR 86 HG22 THR 86 20.237 -9.694 8.364 676 3HG2 THR 86 HG23 THR 86 21.152 -10.948 7.525 677 H THR 87 HN THR 87 20.368 -13.900 7.600 678 HA THR 87 HA THR 87 18.092 -15.024 8.993 679 HB THR 87 HB THR 87 20.975 -15.883 8.712 680 HG1 THR 87 HG1 THR 87 19.304 -16.195 6.996 681 1HG2 THR 87 HG21 THR 87 20.365 -17.917 9.948 682 2HG2 THR 87 HG22 THR 87 18.755 -17.257 10.221 683 3HG2 THR 87 HG23 THR 87 20.156 -16.484 10.964 684 H MET 88 HN MET 88 17.615 -14.343 10.943 685 HA MET 88 HA MET 88 19.687 -13.048 12.541 686 1HB MET 88 HB2 MET 88 18.107 -11.466 11.595 687 2HB MET 88 HB1 MET 88 16.763 -12.392 12.224 688 1HG MET 88 HG2 MET 88 17.379 -11.829 14.472 689 2HG MET 88 HG1 MET 88 18.835 -11.015 13.901 690 1HE MET 88 HE1 MET 88 17.438 -7.910 12.025 691 2HE MET 88 HE2 MET 88 17.897 -9.451 11.317 692 3HE MET 88 HE3 MET 88 18.879 -8.743 12.603 693 H HIS 89 HN HIS 89 19.647 -13.562 14.795 694 HA HIS 89 HA HIS 89 18.113 -15.985 15.303 695 1HB HIS 89 HB2 HIS 89 20.734 -15.057 16.477 696 2HB HIS 89 HB1 HIS 89 19.846 -16.476 17.026 697 HD1 HIS 89 HD1 HIS 89 22.322 -15.390 14.522 698 HD2 HIS 89 HD2 HIS 89 19.604 -18.512 14.980 699 HE1 HIS 89 HE1 HIS 89 23.002 -17.127 12.867 700 HE2 HIS 89 HE2 HIS 89 21.447 -19.073 13.290 701 H VAL 90 HN VAL 90 16.853 -16.175 16.987 702 HA VAL 90 HA VAL 90 16.577 -13.868 18.819 703 HB VAL 90 HB VAL 90 14.531 -16.006 18.111 704 1HG1 VAL 90 HG11 VAL 90 14.252 -13.499 19.769 705 2HG1 VAL 90 HG12 VAL 90 14.282 -15.149 20.386 706 3HG1 VAL 90 HG13 VAL 90 12.948 -14.613 19.364 707 1HG2 VAL 90 HG21 VAL 90 13.298 -14.244 16.959 708 2HG2 VAL 90 HG22 VAL 90 14.899 -14.491 16.242 709 3HG2 VAL 90 HG23 VAL 90 14.607 -13.112 17.298 710 H ILE 91 HN ILE 91 16.884 -14.114 20.785 711 HA ILE 91 HA ILE 91 17.705 -16.764 21.691 712 HB ILE 91 HB ILE 91 18.448 -14.000 22.440 713 1HG1 ILE 91 HG12 ILE 91 19.611 -14.720 20.484 714 2HG1 ILE 91 HG11 ILE 91 20.746 -14.692 21.832 715 1HG2 ILE 91 HG21 ILE 91 18.333 -15.357 24.498 716 2HG2 ILE 91 HG22 ILE 91 20.015 -14.988 24.135 717 3HG2 ILE 91 HG23 ILE 91 19.366 -16.590 23.774 718 1HD1 ILE 91 HD11 ILE 91 20.582 -17.126 22.017 719 2HD1 ILE 91 HD12 ILE 91 21.104 -16.625 20.411 720 3HD1 ILE 91 HD13 ILE 91 19.448 -17.156 20.664 721 H ILE 92 HN ILE 92 16.371 -17.704 22.853 722 HA ILE 92 HA ILE 92 14.294 -16.234 24.216 723 HB ILE 92 HB ILE 92 14.683 -19.189 23.734 724 1HG1 ILE 92 HG12 ILE 92 14.152 -17.965 21.685 725 2HG1 ILE 92 HG11 ILE 92 12.801 -18.986 22.163 726 1HG2 ILE 92 HG21 ILE 92 12.396 -19.480 24.548 727 2HG2 ILE 92 HG22 ILE 92 12.351 -17.764 24.970 728 3HG2 ILE 92 HG23 ILE 92 13.483 -18.845 25.789 729 1HD1 ILE 92 HD11 ILE 92 12.032 -16.831 21.357 730 2HD1 ILE 92 HD12 ILE 92 13.010 -16.000 22.559 731 3HD1 ILE 92 HD13 ILE 92 11.655 -17.008 23.070 732 H GLN 93 HN GLN 93 14.888 -15.516 26.123 733 HA GLN 93 HA GLN 93 16.228 -17.353 27.946 734 1HB GLN 93 HB2 GLN 93 16.139 -14.324 27.939 735 2HB GLN 93 HB1 GLN 93 16.777 -15.280 29.268 736 1HG GLN 93 HG2 GLN 93 17.842 -15.276 26.456 737 2HG GLN 93 HG1 GLN 93 18.545 -14.399 27.815 738 1HE2 GLN 93 HE21 GLN 93 19.696 -16.510 26.137 739 2HE2 GLN 93 HE22 GLN 93 20.166 -17.777 27.198 740 H ALA 94 HN ALA 94 14.837 -18.257 29.149 741 HA ALA 94 HA ALA 94 12.152 -17.374 29.419 742 1HB ALA 94 HB1 ALA 94 11.880 -19.311 30.865 743 2HB ALA 94 HB2 ALA 94 13.627 -19.527 30.921 744 3HB ALA 94 HB3 ALA 94 12.761 -19.738 29.400 745 HA PRO 95 HA PRO 95 13.187 -14.825 32.956 746 1HB PRO 95 HB2 PRO 95 10.946 -13.360 32.960 747 2HB PRO 95 HB1 PRO 95 12.243 -13.087 31.796 748 1HG PRO 95 HG2 PRO 95 9.615 -14.442 31.427 749 2HG PRO 95 HG1 PRO 95 10.531 -13.444 30.286 750 1HD PRO 95 HD2 PRO 95 10.445 -16.229 30.307 751 2HD PRO 95 HD1 PRO 95 11.669 -15.239 29.489 752 H VAL 96 HN VAL 96 12.434 -14.677 35.067 753 HA VAL 96 HA VAL 96 10.595 -16.799 35.818 754 HB VAL 96 HB VAL 96 12.280 -15.032 37.580 755 1HG1 VAL 96 HG11 VAL 96 10.826 -17.609 38.203 756 2HG1 VAL 96 HG12 VAL 96 10.367 -16.001 38.752 757 3HG1 VAL 96 HG13 VAL 96 11.867 -16.732 39.325 758 1HG2 VAL 96 HG21 VAL 96 12.845 -17.833 36.611 759 2HG2 VAL 96 HG22 VAL 96 13.806 -16.958 37.804 760 3HG2 VAL 96 HG23 VAL 96 13.711 -16.372 36.142 761 H THR 97 HN THR 97 8.495 -16.225 35.872 762 HA THR 97 HA THR 97 7.747 -13.822 37.189 763 HB THR 97 HB THR 97 7.943 -13.089 34.847 764 HG1 THR 97 HG1 THR 97 5.181 -13.460 35.515 765 1HG2 THR 97 HG21 THR 97 7.710 -15.244 33.704 766 2HG2 THR 97 HG22 THR 97 6.531 -14.090 33.070 767 3HG2 THR 97 HG23 THR 97 6.022 -15.341 34.203 768 H GLU 98 HN GLU 98 5.548 -13.945 37.739 769 HA GLU 98 HA GLU 98 4.624 -16.691 37.950 770 1HB GLU 98 HB2 GLU 98 5.195 -15.477 39.924 771 2HB GLU 98 HB1 GLU 98 4.119 -14.166 39.525 772 1HG GLU 98 HG2 GLU 98 2.195 -15.682 39.833 773 2HG GLU 98 HG1 GLU 98 3.310 -16.987 40.252 774 H LYS 99 HN LYS 99 1.991 -16.540 38.085 775 HA LYS 99 HA LYS 99 1.280 -15.826 35.540 776 1HB LYS 99 HB2 LYS 99 0.156 -17.616 36.690 777 2HB LYS 99 HB1 LYS 99 -0.526 -16.486 37.854 778 1HG LYS 99 HG2 LYS 99 -1.875 -15.458 36.174 779 2HG LYS 99 HG1 LYS 99 -1.092 -16.387 34.903 780 1HD LYS 99 HD2 LYS 99 -2.783 -17.536 37.129 781 2HD LYS 99 HD1 LYS 99 -3.306 -17.282 35.464 782 1HE LYS 99 HE2 LYS 99 -1.483 -18.804 34.713 783 2HE LYS 99 HE1 LYS 99 -1.101 -19.123 36.398 784 1HZ LYS 99 HZ1 LYS 99 -3.345 -20.005 36.678 785 2HZ LYS 99 HZ2 LYS 99 -2.491 -20.839 35.499 786 3HZ LYS 99 HZ3 LYS 99 -3.657 -19.708 35.045 787 H GLU 100 HN GLU 100 0.651 -14.034 34.654 788 HA GLU 100 HA GLU 100 -0.140 -11.799 36.321 789 1HB GLU 100 HB2 GLU 100 2.227 -11.683 35.845 790 2HB GLU 100 HB1 GLU 100 1.921 -11.950 34.144 791 1HG GLU 100 HG2 GLU 100 0.797 -9.777 34.029 792 2HG GLU 100 HG1 GLU 100 1.172 -9.521 35.739 793 H LYS 101 HN LYS 101 -2.076 -11.126 35.575 794 HA LYS 101 HA LYS 101 -3.764 -10.473 34.255 795 1HB LYS 101 HB2 LYS 101 -2.141 -9.201 32.979 796 2HB LYS 101 HB1 LYS 101 -1.710 -10.615 32.036 797 1HG LYS 101 HG2 LYS 101 -3.992 -10.644 31.104 798 2HG LYS 101 HG1 LYS 101 -4.357 -9.173 32.008 799 1HD LYS 101 HD2 LYS 101 -2.594 -7.991 30.820 800 2HD LYS 101 HD1 LYS 101 -2.178 -9.472 29.952 801 1HE LYS 101 HE2 LYS 101 -4.418 -9.507 28.975 802 2HE LYS 101 HE1 LYS 101 -4.805 -8.012 29.814 803 1HZ LYS 101 HZ1 LYS 101 -4.158 -7.613 27.532 804 2HZ LYS 101 HZ2 LYS 101 -2.637 -8.309 27.795 805 3HZ LYS 101 HZ3 LYS 101 -3.077 -6.895 28.594 Start of MODEL 11 1 H GLU 1 HT1 GLU 1 2.908 -3.991 -3.561 2 HA GLU 1 HA GLU 1 4.969 -4.507 -5.596 3 1HB GLU 1 HB2 GLU 1 5.128 -4.099 -2.612 4 2HB GLU 1 HB1 GLU 1 6.451 -4.700 -3.591 5 1HG GLU 1 HG2 GLU 1 5.148 -2.003 -3.860 6 2HG GLU 1 HG1 GLU 1 6.698 -2.335 -3.083 7 H ALA 2 HN ALA 2 4.691 -6.564 -6.237 8 HA ALA 2 HA ALA 2 3.859 -8.615 -4.392 9 1HB ALA 2 HB1 ALA 2 4.314 -10.144 -6.294 10 2HB ALA 2 HB2 ALA 2 4.971 -8.788 -7.212 11 3HB ALA 2 HB3 ALA 2 3.262 -8.814 -6.775 12 H GLU 3 HN GLU 3 5.260 -8.908 -2.830 13 HA GLU 3 HA GLU 3 7.098 -9.206 -1.622 14 1HB GLU 3 HB2 GLU 3 7.754 -11.087 -3.077 15 2HB GLU 3 HB1 GLU 3 8.471 -9.966 -4.228 16 1HG GLU 3 HG2 GLU 3 10.071 -9.239 -2.484 17 2HG GLU 3 HG1 GLU 3 9.391 -10.441 -1.397 18 H VAL 4 HN VAL 4 7.537 -7.286 -0.834 19 HA VAL 4 HA VAL 4 8.765 -5.401 -2.538 20 HB VAL 4 HB VAL 4 7.320 -4.486 -1.064 21 1HG1 VAL 4 HG11 VAL 4 7.640 -4.461 1.461 22 2HG1 VAL 4 HG12 VAL 4 8.995 -5.564 1.237 23 3HG1 VAL 4 HG13 VAL 4 7.364 -6.082 0.819 24 1HG2 VAL 4 HG21 VAL 4 8.687 -2.733 0.112 25 2HG2 VAL 4 HG22 VAL 4 9.100 -3.024 -1.576 26 3HG2 VAL 4 HG23 VAL 4 10.112 -3.693 -0.296 27 H HIS 5 HN HIS 5 10.423 -5.848 -3.154 28 HA HIS 5 HA HIS 5 12.442 -7.383 -1.709 29 1HB HIS 5 HB2 HIS 5 11.733 -7.730 -4.159 30 2HB HIS 5 HB1 HIS 5 12.744 -6.344 -4.534 31 HD1 HIS 5 HD1 HIS 5 12.800 -9.971 -3.854 32 HD2 HIS 5 HD2 HIS 5 15.572 -6.870 -4.151 33 HE1 HIS 5 HE1 HIS 5 15.020 -11.075 -4.079 34 HE2 HIS 5 HE2 HIS 5 16.582 -9.204 -4.630 35 H ASN 6 HN ASN 6 11.697 -4.225 -2.006 36 HA ASN 6 HA ASN 6 14.322 -3.040 -1.949 37 1HB ASN 6 HB2 ASN 6 11.650 -1.884 -1.075 38 2HB ASN 6 HB1 ASN 6 13.149 -0.974 -1.132 39 1HD2 ASN 6 HD21 ASN 6 10.512 -2.290 -2.964 40 2HD2 ASN 6 HD22 ASN 6 10.934 -1.567 -4.457 41 H GLN 7 HN GLN 7 12.285 -4.660 0.289 42 HA GLN 7 HA GLN 7 13.764 -3.644 2.552 43 1HB GLN 7 HB2 GLN 7 11.251 -5.268 2.302 44 2HB GLN 7 HB1 GLN 7 11.974 -4.765 3.820 45 1HG GLN 7 HG2 GLN 7 11.575 -2.439 3.292 46 2HG GLN 7 HG1 GLN 7 10.961 -2.880 1.701 47 1HE2 GLN 7 HE21 GLN 7 9.012 -1.861 2.159 48 2HE2 GLN 7 HE22 GLN 7 7.831 -2.567 3.205 49 H LEU 8 HN LEU 8 14.388 -5.366 4.094 50 HA LEU 8 HA LEU 8 15.214 -7.728 2.616 51 1HB LEU 8 HB2 LEU 8 16.852 -8.108 4.409 52 2HB LEU 8 HB1 LEU 8 17.185 -6.673 3.467 53 HG LEU 8 HG LEU 8 15.912 -6.603 6.229 54 1HD1 LEU 8 HD11 LEU 8 18.113 -7.696 6.340 55 2HD1 LEU 8 HD12 LEU 8 18.163 -6.088 7.063 56 3HD1 LEU 8 HD13 LEU 8 18.828 -6.349 5.453 57 1HD2 LEU 8 HD21 LEU 8 15.662 -4.551 4.860 58 2HD2 LEU 8 HD22 LEU 8 17.403 -4.525 4.608 59 3HD2 LEU 8 HD23 LEU 8 16.748 -4.302 6.229 60 H GLU 9 HN GLU 9 14.756 -9.791 3.356 61 HA GLU 9 HA GLU 9 12.522 -9.794 5.194 62 1HB GLU 9 HB2 GLU 9 13.675 -12.124 3.654 63 2HB GLU 9 HB1 GLU 9 12.197 -12.060 4.549 64 1HG GLU 9 HG2 GLU 9 11.215 -10.482 3.042 65 2HG GLU 9 HG1 GLU 9 12.720 -10.379 2.127 66 H ILE 10 HN ILE 10 12.563 -10.665 7.096 67 HA ILE 10 HA ILE 10 15.069 -11.928 7.991 68 HB ILE 10 HB ILE 10 13.372 -10.011 9.635 69 1HG1 ILE 10 HG12 ILE 10 16.134 -9.595 8.421 70 2HG1 ILE 10 HG11 ILE 10 14.651 -8.856 7.841 71 1HG2 ILE 10 HG21 ILE 10 16.005 -11.354 10.280 72 2HG2 ILE 10 HG22 ILE 10 14.439 -11.726 10.999 73 3HG2 ILE 10 HG23 ILE 10 15.191 -10.157 11.289 74 1HD1 ILE 10 HD11 ILE 10 14.439 -7.641 9.944 75 2HD1 ILE 10 HD12 ILE 10 15.976 -7.303 9.142 76 3HD1 ILE 10 HD13 ILE 10 15.924 -8.394 10.528 77 H LYS 11 HN LYS 11 14.813 -13.704 9.178 78 HA LYS 11 HA LYS 11 12.151 -14.251 10.192 79 1HB LYS 11 HB2 LYS 11 12.542 -16.675 9.964 80 2HB LYS 11 HB1 LYS 11 12.537 -15.862 8.415 81 1HG LYS 11 HG2 LYS 11 14.836 -16.161 8.124 82 2HG LYS 11 HG1 LYS 11 15.101 -16.470 9.843 83 1HD LYS 11 HD2 LYS 11 15.233 -18.526 8.477 84 2HD LYS 11 HD1 LYS 11 13.962 -18.596 9.690 85 1HE LYS 11 HE2 LYS 11 12.328 -17.976 7.918 86 2HE LYS 11 HE1 LYS 11 13.633 -18.069 6.735 87 1HZ LYS 11 HZ1 LYS 11 12.656 -20.291 8.451 88 2HZ LYS 11 HZ2 LYS 11 13.934 -20.412 7.361 89 3HZ LYS 11 HZ3 LYS 11 12.374 -20.130 6.799 90 H PHE 12 HN PHE 12 12.166 -15.380 12.212 91 HA PHE 12 HA PHE 12 14.605 -14.804 13.720 92 1HB PHE 12 HB2 PHE 12 11.817 -15.348 14.759 93 2HB PHE 12 HB1 PHE 12 13.185 -14.709 15.673 94 HD1 PHE 12 HD1 PHE 12 14.220 -12.509 14.761 95 HD2 PHE 12 HD2 PHE 12 10.293 -13.861 13.845 96 HE1 PHE 12 HE1 PHE 12 13.578 -10.220 14.143 97 HE2 PHE 12 HE2 PHE 12 9.641 -11.572 13.224 98 HZ PHE 12 HZ PHE 12 11.289 -9.748 13.370 99 H ARG 13 HN ARG 13 15.850 -16.489 14.199 100 HA ARG 13 HA ARG 13 14.612 -19.120 14.056 101 1HB ARG 13 HB2 ARG 13 16.415 -18.436 12.373 102 2HB ARG 13 HB1 ARG 13 17.545 -18.477 13.712 103 1HG ARG 13 HG2 ARG 13 15.900 -20.856 12.863 104 2HG ARG 13 HG1 ARG 13 17.486 -20.495 12.205 105 1HD ARG 13 HD2 ARG 13 16.918 -20.930 15.130 106 2HD ARG 13 HD1 ARG 13 17.436 -22.204 14.028 107 HE ARG 13 HE ARG 13 19.178 -19.958 13.963 108 1HH1 ARG 13 HH11 ARG 13 18.369 -22.735 15.962 109 2HH1 ARG 13 HH12 ARG 13 19.962 -23.042 16.503 110 1HH2 ARG 13 HH21 ARG 13 21.359 -20.315 14.690 111 2HH2 ARG 13 HH22 ARG 13 21.720 -21.597 15.758 112 H LEU 14 HN LEU 14 14.280 -19.972 15.864 113 HA LEU 14 HA LEU 14 15.228 -19.106 18.419 114 1HB LEU 14 HB2 LEU 14 13.747 -21.576 17.480 115 2HB LEU 14 HB1 LEU 14 14.148 -21.311 19.143 116 HG LEU 14 HG LEU 14 11.796 -20.902 18.676 117 1HD1 LEU 14 HD11 LEU 14 13.280 -18.429 19.403 118 2HD1 LEU 14 HD12 LEU 14 12.766 -19.733 20.478 119 3HD1 LEU 14 HD13 LEU 14 11.569 -18.720 19.679 120 1HD2 LEU 14 HD21 LEU 14 11.895 -20.131 16.364 121 2HD2 LEU 14 HD22 LEU 14 12.711 -18.652 16.888 122 3HD2 LEU 14 HD23 LEU 14 11.048 -18.970 17.393 123 H THR 15 HN THR 15 16.550 -20.085 19.773 124 HA THR 15 HA THR 15 18.817 -21.414 18.804 125 HB THR 15 HB THR 15 17.753 -21.254 21.560 126 HG1 THR 15 HG1 THR 15 18.035 -19.105 20.626 127 1HG2 THR 15 HG21 THR 15 20.516 -21.546 20.504 128 2HG2 THR 15 HG22 THR 15 19.553 -22.802 21.307 129 3HG2 THR 15 HG23 THR 15 20.122 -21.379 22.227 130 H ASP 16 HN ASP 16 15.713 -22.455 19.747 131 HA ASP 16 HA ASP 16 16.358 -25.176 20.458 132 1HB ASP 16 HB2 ASP 16 13.678 -23.961 19.750 133 2HB ASP 16 HB1 ASP 16 13.933 -25.535 20.496 134 H GLY 17 HN GLY 17 16.258 -23.553 17.572 135 1HA GLY 17 HA2 GLY 17 16.830 -24.563 15.509 136 2HA GLY 17 HA1 GLY 17 16.147 -26.079 16.086 137 H SER 18 HN SER 18 14.018 -23.717 16.851 138 HA SER 18 HA SER 18 12.355 -24.278 14.522 139 1HB SER 18 HB2 SER 18 11.374 -24.527 16.810 140 2HB SER 18 HB1 SER 18 11.717 -22.831 17.122 141 HG SER 18 HG SER 18 9.885 -22.427 16.261 142 H ASP 19 HN ASP 19 11.334 -22.379 13.370 143 HA ASP 19 HA ASP 19 12.577 -19.878 13.957 144 1HB ASP 19 HB2 ASP 19 12.882 -19.470 11.591 145 2HB ASP 19 HB1 ASP 19 13.999 -20.712 12.162 146 H ILE 20 HN ILE 20 11.447 -18.160 12.994 147 HA ILE 20 HA ILE 20 8.580 -18.742 12.690 148 HB ILE 20 HB ILE 20 9.972 -16.124 13.402 149 1HG1 ILE 20 HG12 ILE 20 8.378 -18.017 15.158 150 2HG1 ILE 20 HG11 ILE 20 10.118 -17.780 15.217 151 1HG2 ILE 20 HG21 ILE 20 7.024 -16.789 13.339 152 2HG2 ILE 20 HG22 ILE 20 7.878 -15.734 12.213 153 3HG2 ILE 20 HG23 ILE 20 7.722 -15.271 13.907 154 1HD1 ILE 20 HD11 ILE 20 8.021 -15.715 15.875 155 2HD1 ILE 20 HD12 ILE 20 9.764 -15.457 15.946 156 3HD1 ILE 20 HD13 ILE 20 8.993 -16.614 17.035 157 H GLY 21 HN GLY 21 7.520 -18.014 10.855 158 1HA GLY 21 HA2 GLY 21 8.793 -17.999 8.436 159 2HA GLY 21 HA1 GLY 21 7.214 -17.288 8.709 160 HA PRO 22 HA PRO 22 10.767 -14.095 8.090 161 1HB PRO 22 HB2 PRO 22 11.216 -14.040 5.438 162 2HB PRO 22 HB1 PRO 22 12.113 -15.089 6.535 163 1HG PRO 22 HG2 PRO 22 9.848 -15.743 4.707 164 2HG PRO 22 HG1 PRO 22 11.282 -16.703 5.111 165 1HD PRO 22 HD2 PRO 22 8.787 -17.108 6.199 166 2HD PRO 22 HD1 PRO 22 10.309 -17.584 6.976 167 H LYS 23 HN LYS 23 10.404 -12.084 7.651 168 HA LYS 23 HA LYS 23 8.115 -11.299 5.958 169 1HB LYS 23 HB2 LYS 23 8.739 -10.188 8.703 170 2HB LYS 23 HB1 LYS 23 7.800 -9.307 7.528 171 1HG LYS 23 HG2 LYS 23 6.351 -10.268 9.088 172 2HG LYS 23 HG1 LYS 23 6.130 -11.113 7.575 173 1HD LYS 23 HD2 LYS 23 7.423 -12.999 8.350 174 2HD LYS 23 HD1 LYS 23 7.832 -12.150 9.843 175 1HE LYS 23 HE2 LYS 23 5.549 -12.157 10.533 176 2HE LYS 23 HE1 LYS 23 5.031 -12.864 9.000 177 1HZ LYS 23 HZ1 LYS 23 5.219 -14.432 10.922 178 2HZ LYS 23 HZ2 LYS 23 6.922 -14.279 10.819 179 3HZ LYS 23 HZ3 LYS 23 6.040 -14.876 9.531 180 H ALA 24 HN ALA 24 8.280 -9.042 5.308 181 HA ALA 24 HA ALA 24 11.077 -8.443 4.759 182 1HB ALA 24 HB1 ALA 24 8.596 -7.108 3.636 183 2HB ALA 24 HB2 ALA 24 9.486 -8.416 2.862 184 3HB ALA 24 HB3 ALA 24 10.252 -6.851 3.075 185 H PHE 25 HN PHE 25 12.152 -6.982 5.837 186 HA PHE 25 HA PHE 25 10.665 -4.992 7.408 187 1HB PHE 25 HB2 PHE 25 13.324 -6.283 8.061 188 2HB PHE 25 HB1 PHE 25 12.507 -5.060 9.012 189 HD1 PHE 25 HD1 PHE 25 12.258 -8.528 7.802 190 HD2 PHE 25 HD2 PHE 25 10.999 -5.703 10.704 191 HE1 PHE 25 HE1 PHE 25 11.263 -10.330 9.101 192 HE2 PHE 25 HE2 PHE 25 9.986 -7.521 12.019 193 HZ PHE 25 HZ PHE 25 10.153 -9.876 11.173 194 HA PRO 26 HA PRO 26 13.286 -2.348 4.856 195 1HB PRO 26 HB2 PRO 26 12.349 -0.356 6.832 196 2HB PRO 26 HB1 PRO 26 12.289 -0.235 5.086 197 1HG PRO 26 HG2 PRO 26 10.072 -0.672 6.510 198 2HG PRO 26 HG1 PRO 26 10.318 -1.510 4.965 199 1HD PRO 26 HD2 PRO 26 10.626 -2.539 7.754 200 2HD PRO 26 HD1 PRO 26 9.973 -3.345 6.308 201 H ASP 27 HN ASP 27 15.310 -1.489 5.326 202 HA ASP 27 HA ASP 27 16.499 -2.255 7.744 203 1HB ASP 27 HB2 ASP 27 18.550 -1.010 6.933 204 2HB ASP 27 HB1 ASP 27 17.859 -2.214 5.850 205 H ALA 28 HN ALA 28 14.853 0.496 6.861 206 HA ALA 28 HA ALA 28 15.958 2.249 8.870 207 1HB ALA 28 HB1 ALA 28 13.382 2.537 7.319 208 2HB ALA 28 HB2 ALA 28 14.956 3.164 6.827 209 3HB ALA 28 HB3 ALA 28 14.164 3.799 8.270 210 H THR 29 HN THR 29 13.965 -0.377 9.070 211 HA THR 29 HA THR 29 12.146 0.426 11.118 212 HB THR 29 HB THR 29 13.212 -2.340 10.465 213 HG1 THR 29 HG1 THR 29 12.293 -1.914 8.708 214 1HG2 THR 29 HG21 THR 29 12.002 -2.226 12.605 215 2HG2 THR 29 HG22 THR 29 11.091 -3.140 11.403 216 3HG2 THR 29 HG23 THR 29 10.625 -1.486 11.788 217 H THR 30 HN THR 30 12.415 0.251 13.373 218 HA THR 30 HA THR 30 15.101 0.193 14.281 219 HB THR 30 HB THR 30 14.043 0.495 16.540 220 HG1 THR 30 HG1 THR 30 11.684 1.303 15.995 221 1HG2 THR 30 HG21 THR 30 13.271 2.455 14.370 222 2HG2 THR 30 HG22 THR 30 14.822 2.394 15.205 223 3HG2 THR 30 HG23 THR 30 13.365 2.824 16.092 224 H VAL 31 HN VAL 31 15.946 -1.243 15.841 225 HA VAL 31 HA VAL 31 15.202 -3.933 15.480 226 HB VAL 31 HB VAL 31 17.075 -2.588 17.445 227 1HG1 VAL 31 HG11 VAL 31 17.993 -4.835 17.928 228 2HG1 VAL 31 HG12 VAL 31 16.790 -5.565 16.870 229 3HG1 VAL 31 HG13 VAL 31 16.284 -4.789 18.367 230 1HG2 VAL 31 HG21 VAL 31 18.831 -3.533 16.015 231 2HG2 VAL 31 HG22 VAL 31 17.761 -2.433 15.143 232 3HG2 VAL 31 HG23 VAL 31 17.589 -4.175 14.939 233 H SER 32 HN SER 32 14.225 -1.485 17.808 234 HA SER 32 HA SER 32 12.911 -3.093 19.670 235 1HB SER 32 HB2 SER 32 11.994 -0.427 18.538 236 2HB SER 32 HB1 SER 32 11.411 -1.163 20.027 237 HG SER 32 HG SER 32 12.980 -0.115 20.917 238 H ALA 33 HN ALA 33 11.732 -1.789 16.560 239 HA ALA 33 HA ALA 33 9.205 -3.046 16.729 240 1HB ALA 33 HB1 ALA 33 9.614 -1.066 15.346 241 2HB ALA 33 HB2 ALA 33 8.937 -2.392 14.399 242 3HB ALA 33 HB3 ALA 33 10.659 -2.021 14.297 243 H LEU 34 HN LEU 34 12.359 -4.092 15.533 244 HA LEU 34 HA LEU 34 11.581 -6.256 14.034 245 1HB LEU 34 HB2 LEU 34 13.768 -5.212 13.951 246 2HB LEU 34 HB1 LEU 34 14.004 -5.532 15.655 247 HG LEU 34 HG LEU 34 14.126 -7.785 15.283 248 1HD1 LEU 34 HD11 LEU 34 12.710 -8.037 13.250 249 2HD1 LEU 34 HD12 LEU 34 14.306 -8.698 12.883 250 3HD1 LEU 34 HD13 LEU 34 13.864 -7.092 12.312 251 1HD2 LEU 34 HD21 LEU 34 16.287 -7.878 14.040 252 2HD2 LEU 34 HD22 LEU 34 16.172 -6.582 15.227 253 3HD2 LEU 34 HD23 LEU 34 15.986 -6.224 13.508 254 H LYS 35 HN LYS 35 12.494 -5.866 17.450 255 HA LYS 35 HA LYS 35 12.013 -8.561 18.166 256 1HB LYS 35 HB2 LYS 35 12.222 -6.078 19.851 257 2HB LYS 35 HB1 LYS 35 12.171 -7.725 20.481 258 1HG LYS 35 HG2 LYS 35 14.182 -8.278 19.401 259 2HG LYS 35 HG1 LYS 35 14.235 -6.738 18.543 260 1HD LYS 35 HD2 LYS 35 15.819 -6.621 20.375 261 2HD LYS 35 HD1 LYS 35 14.426 -5.641 20.822 262 1HE LYS 35 HE2 LYS 35 13.556 -7.481 22.187 263 2HE LYS 35 HE1 LYS 35 14.913 -8.482 21.692 264 1HZ LYS 35 HZ1 LYS 35 15.271 -7.600 23.850 265 2HZ LYS 35 HZ2 LYS 35 15.089 -6.011 23.371 266 3HZ LYS 35 HZ3 LYS 35 16.410 -6.925 22.824 267 H GLU 36 HN GLU 36 10.037 -5.649 18.289 268 HA GLU 36 HA GLU 36 7.858 -6.782 19.636 269 1HB GLU 36 HB2 GLU 36 7.996 -4.515 17.652 270 2HB GLU 36 HB1 GLU 36 6.536 -4.943 18.524 271 1HG GLU 36 HG2 GLU 36 9.115 -4.220 19.892 272 2HG GLU 36 HG1 GLU 36 7.870 -3.044 19.493 273 H THR 37 HN THR 37 8.798 -6.874 16.264 274 HA THR 37 HA THR 37 6.413 -8.039 15.296 275 HB THR 37 HB THR 37 9.246 -8.345 14.216 276 HG1 THR 37 HG1 THR 37 8.576 -6.174 14.256 277 1HG2 THR 37 HG21 THR 37 8.151 -8.891 12.073 278 2HG2 THR 37 HG22 THR 37 6.573 -8.788 12.858 279 3HG2 THR 37 HG23 THR 37 7.715 -10.044 13.334 280 H VAL 38 HN VAL 38 9.347 -9.349 16.722 281 HA VAL 38 HA VAL 38 8.861 -12.113 16.513 282 HB VAL 38 HB VAL 38 10.132 -10.643 18.857 283 1HG1 VAL 38 HG11 VAL 38 10.476 -13.499 17.975 284 2HG1 VAL 38 HG12 VAL 38 9.660 -12.926 19.439 285 3HG1 VAL 38 HG13 VAL 38 11.398 -12.670 19.231 286 1HG2 VAL 38 HG21 VAL 38 11.450 -11.719 16.379 287 2HG2 VAL 38 HG22 VAL 38 12.285 -11.037 17.771 288 3HG2 VAL 38 HG23 VAL 38 11.229 -10.021 16.788 289 H ILE 39 HN ILE 39 8.001 -9.749 18.972 290 HA ILE 39 HA ILE 39 6.585 -11.435 20.725 291 HB ILE 39 HB ILE 39 6.228 -8.441 20.326 292 1HG1 ILE 39 HG12 ILE 39 8.554 -8.922 20.712 293 2HG1 ILE 39 HG11 ILE 39 7.868 -8.210 22.165 294 1HG2 ILE 39 HG21 ILE 39 5.601 -10.198 22.695 295 2HG2 ILE 39 HG22 ILE 39 4.437 -9.302 21.703 296 3HG2 ILE 39 HG23 ILE 39 5.596 -8.443 22.721 297 1HD1 ILE 39 HD11 ILE 39 9.356 -10.001 22.705 298 2HD1 ILE 39 HD12 ILE 39 8.441 -11.118 21.690 299 3HD1 ILE 39 HD13 ILE 39 7.706 -10.444 23.153 300 H SER 40 HN SER 40 5.592 -9.633 17.916 301 HA SER 40 HA SER 40 2.795 -9.905 18.249 302 1HB SER 40 HB2 SER 40 4.384 -9.545 15.698 303 2HB SER 40 HB1 SER 40 2.655 -9.248 15.890 304 HG SER 40 HG SER 40 4.784 -7.903 17.208 305 H GLU 41 HN GLU 41 5.261 -11.978 16.754 306 HA GLU 41 HA GLU 41 3.336 -13.818 15.722 307 1HB GLU 41 HB2 GLU 41 6.319 -13.675 15.770 308 2HB GLU 41 HB1 GLU 41 5.386 -14.960 15.025 309 1HG GLU 41 HG2 GLU 41 5.259 -12.040 14.273 310 2HG GLU 41 HG1 GLU 41 6.168 -13.263 13.393 311 H TRP 42 HN TRP 42 4.646 -13.236 18.648 312 HA TRP 42 HA TRP 42 4.961 -16.049 19.416 313 1HB TRP 42 HB2 TRP 42 6.707 -14.199 19.901 314 2HB TRP 42 HB1 TRP 42 5.568 -13.640 21.118 315 HD1 TRP 42 HD1 TRP 42 5.314 -15.220 23.369 316 HE1 TRP 42 HE1 TRP 42 6.863 -16.994 24.331 317 HE3 TRP 42 HE3 TRP 42 8.176 -16.032 19.225 318 HZ2 TRP 42 HZ2 TRP 42 9.081 -18.621 23.371 319 HZ3 TRP 42 HZ3 TRP 42 9.950 -17.693 19.318 320 HH2 TRP 42 HH2 TRP 42 10.389 -18.966 21.370 321 HA PRO 43 HA PRO 43 1.023 -15.550 21.573 322 1HB PRO 43 HB2 PRO 43 1.847 -17.784 23.274 323 2HB PRO 43 HB1 PRO 43 0.491 -17.701 22.156 324 1HG PRO 43 HG2 PRO 43 2.672 -19.226 21.670 325 2HG PRO 43 HG1 PRO 43 1.760 -18.446 20.368 326 1HD PRO 43 HD2 PRO 43 4.374 -17.630 21.591 327 2HD PRO 43 HD1 PRO 43 3.823 -17.579 19.907 328 H ARG 44 HN ARG 44 1.111 -13.770 22.894 329 HA ARG 44 HA ARG 44 2.902 -13.598 25.130 330 1HB ARG 44 HB2 ARG 44 0.495 -11.877 24.477 331 2HB ARG 44 HB1 ARG 44 1.519 -11.607 25.868 332 1HG ARG 44 HG2 ARG 44 2.152 -10.053 24.203 333 2HG ARG 44 HG1 ARG 44 3.428 -11.262 24.286 334 1HD ARG 44 HD2 ARG 44 2.929 -10.706 21.984 335 2HD ARG 44 HD1 ARG 44 2.463 -12.372 22.323 336 HE ARG 44 HE ARG 44 0.249 -10.802 22.792 337 1HH1 ARG 44 HH11 ARG 44 2.300 -11.633 20.064 338 2HH1 ARG 44 HH12 ARG 44 1.083 -11.496 18.882 339 1HH2 ARG 44 HH21 ARG 44 -1.450 -10.552 21.213 340 2HH2 ARG 44 HH22 ARG 44 -1.137 -10.826 19.571 341 H GLU 45 HN GLU 45 -0.144 -14.894 24.568 342 HA GLU 45 HA GLU 45 -1.186 -15.034 27.188 343 1HB GLU 45 HB2 GLU 45 -2.572 -16.875 26.347 344 2HB GLU 45 HB1 GLU 45 -2.557 -15.519 25.228 345 1HG GLU 45 HG2 GLU 45 -1.015 -16.663 23.778 346 2HG GLU 45 HG1 GLU 45 -0.842 -17.974 24.939 347 H LYS 46 HN LYS 46 1.446 -16.613 25.690 348 HA LYS 46 HA LYS 46 1.511 -19.097 26.910 349 1HB LYS 46 HB2 LYS 46 3.008 -18.423 25.007 350 2HB LYS 46 HB1 LYS 46 3.793 -17.330 26.096 351 1HG LYS 46 HG2 LYS 46 5.094 -19.355 25.750 352 2HG LYS 46 HG1 LYS 46 4.667 -19.100 27.442 353 1HD LYS 46 HD2 LYS 46 2.862 -20.744 27.212 354 2HD LYS 46 HD1 LYS 46 3.311 -20.996 25.520 355 1HE LYS 46 HE2 LYS 46 5.073 -21.517 27.921 356 2HE LYS 46 HE1 LYS 46 4.229 -22.750 26.988 357 1HZ LYS 46 HZ1 LYS 46 5.530 -22.134 25.061 358 2HZ LYS 46 HZ2 LYS 46 6.549 -22.555 26.332 359 3HZ LYS 46 HZ3 LYS 46 6.324 -20.930 25.936 360 H GLU 47 HN GLU 47 1.426 -19.429 29.034 361 HA GLU 47 HA GLU 47 2.566 -17.638 30.877 362 1HB GLU 47 HB2 GLU 47 1.883 -20.500 31.319 363 2HB GLU 47 HB1 GLU 47 2.030 -19.264 32.531 364 1HG GLU 47 HG2 GLU 47 0.065 -18.102 31.711 365 2HG GLU 47 HG1 GLU 47 -0.143 -19.315 30.446 366 H ASN 48 HN ASN 48 4.552 -17.785 31.590 367 HA ASN 48 HA ASN 48 6.770 -18.164 31.564 368 1HB ASN 48 HB2 ASN 48 6.288 -20.162 32.878 369 2HB ASN 48 HB1 ASN 48 5.863 -21.059 31.435 370 1HD2 ASN 48 HD21 ASN 48 7.330 -22.647 32.069 371 2HD2 ASN 48 HD22 ASN 48 9.032 -22.446 31.874 372 H GLY 49 HN GLY 49 6.448 -16.960 29.460 373 1HA GLY 49 HA2 GLY 49 8.250 -17.989 27.648 374 2HA GLY 49 HA1 GLY 49 6.597 -18.003 27.021 375 HA PRO 50 HA PRO 50 8.852 -13.631 27.046 376 1HB PRO 50 HB2 PRO 50 8.482 -14.319 24.174 377 2HB PRO 50 HB1 PRO 50 9.708 -13.294 24.919 378 1HG PRO 50 HG2 PRO 50 10.322 -15.725 24.233 379 2HG PRO 50 HG1 PRO 50 10.853 -15.124 25.821 380 1HD PRO 50 HD2 PRO 50 8.655 -17.024 25.139 381 2HD PRO 50 HD1 PRO 50 9.742 -17.008 26.543 382 H LYS 51 HN LYS 51 7.149 -12.476 27.686 383 HA LYS 51 HA LYS 51 4.829 -12.319 25.919 384 1HB LYS 51 HB2 LYS 51 5.193 -11.194 28.692 385 2HB LYS 51 HB1 LYS 51 3.725 -11.081 27.738 386 1HG LYS 51 HG2 LYS 51 3.533 -13.521 27.730 387 2HG LYS 51 HG1 LYS 51 5.001 -13.635 28.702 388 1HD LYS 51 HD2 LYS 51 3.893 -12.362 30.491 389 2HD LYS 51 HD1 LYS 51 2.440 -12.268 29.497 390 1HE LYS 51 HE2 LYS 51 2.238 -14.690 29.518 391 2HE LYS 51 HE1 LYS 51 3.707 -14.820 30.478 392 1HZ LYS 51 HZ1 LYS 51 1.225 -13.441 31.347 393 2HZ LYS 51 HZ2 LYS 51 2.609 -13.640 32.277 394 3HZ LYS 51 HZ3 LYS 51 1.697 -14.979 31.831 395 H THR 52 HN THR 52 7.565 -10.408 26.954 396 HA THR 52 HA THR 52 6.593 -8.306 25.177 397 HB THR 52 HB THR 52 7.561 -6.595 26.574 398 HG1 THR 52 HG1 THR 52 8.021 -8.812 28.334 399 1HG2 THR 52 HG21 THR 52 5.866 -6.619 28.393 400 2HG2 THR 52 HG22 THR 52 5.537 -8.310 28.029 401 3HG2 THR 52 HG23 THR 52 5.184 -7.064 26.831 402 H VAL 53 HN VAL 53 8.379 -6.719 24.670 403 HA VAL 53 HA VAL 53 10.481 -8.007 23.301 404 HB VAL 53 HB VAL 53 9.602 -5.995 22.364 405 1HG1 VAL 53 HG11 VAL 53 8.799 -4.898 24.404 406 2HG1 VAL 53 HG12 VAL 53 9.797 -3.782 23.473 407 3HG1 VAL 53 HG13 VAL 53 10.458 -4.577 24.901 408 1HG2 VAL 53 HG21 VAL 53 11.956 -6.271 21.930 409 2HG2 VAL 53 HG22 VAL 53 12.367 -5.406 23.407 410 3HG2 VAL 53 HG23 VAL 53 11.580 -4.555 22.073 411 H LYS 54 HN LYS 54 10.293 -6.543 26.417 412 HA LYS 54 HA LYS 54 12.995 -6.040 26.992 413 1HB LYS 54 HB2 LYS 54 11.186 -5.168 28.345 414 2HB LYS 54 HB1 LYS 54 10.714 -6.792 28.813 415 1HG LYS 54 HG2 LYS 54 12.902 -7.061 29.933 416 2HG LYS 54 HG1 LYS 54 13.268 -5.380 29.538 417 1HD LYS 54 HD2 LYS 54 11.349 -4.644 30.832 418 2HD LYS 54 HD1 LYS 54 10.930 -6.319 31.192 419 1HE LYS 54 HE2 LYS 54 13.062 -6.606 32.343 420 2HE LYS 54 HE1 LYS 54 13.480 -4.932 31.980 421 1HZ LYS 54 HZ1 LYS 54 11.220 -5.837 33.692 422 2HZ LYS 54 HZ2 LYS 54 11.560 -4.237 33.282 423 3HZ LYS 54 HZ3 LYS 54 12.648 -5.098 34.203 424 H GLU 55 HN GLU 55 11.136 -8.965 27.071 425 HA GLU 55 HA GLU 55 13.250 -10.284 28.591 426 1HB GLU 55 HB2 GLU 55 11.571 -12.089 28.932 427 2HB GLU 55 HB1 GLU 55 11.077 -10.516 29.545 428 1HG GLU 55 HG2 GLU 55 9.903 -10.253 27.286 429 2HG GLU 55 HG1 GLU 55 10.106 -11.996 27.154 430 H VAL 56 HN VAL 56 12.869 -9.709 25.524 431 HA VAL 56 HA VAL 56 13.739 -12.376 24.624 432 HB VAL 56 HB VAL 56 12.453 -10.145 23.000 433 1HG1 VAL 56 HG11 VAL 56 12.458 -11.721 21.127 434 2HG1 VAL 56 HG12 VAL 56 13.340 -12.893 22.110 435 3HG1 VAL 56 HG13 VAL 56 14.099 -11.365 21.666 436 1HG2 VAL 56 HG21 VAL 56 10.868 -11.312 24.411 437 2HG2 VAL 56 HG22 VAL 56 11.440 -12.862 23.786 438 3HG2 VAL 56 HG23 VAL 56 10.613 -11.731 22.713 439 H LYS 57 HN LYS 57 15.786 -12.540 23.757 440 HA LYS 57 HA LYS 57 17.198 -10.042 23.270 441 1HB LYS 57 HB2 LYS 57 18.214 -12.710 24.245 442 2HB LYS 57 HB1 LYS 57 19.250 -11.365 23.788 443 1HG LYS 57 HG2 LYS 57 18.254 -9.995 25.573 444 2HG LYS 57 HG1 LYS 57 17.210 -11.341 26.019 445 1HD LYS 57 HD2 LYS 57 19.161 -12.674 26.613 446 2HD LYS 57 HD1 LYS 57 20.228 -11.365 26.104 447 1HE LYS 57 HE2 LYS 57 19.985 -11.382 28.533 448 2HE LYS 57 HE1 LYS 57 19.287 -9.918 27.853 449 1HZ LYS 57 HZ1 LYS 57 17.059 -10.947 28.112 450 2HZ LYS 57 HZ2 LYS 57 17.875 -10.799 29.533 451 3HZ LYS 57 HZ3 LYS 57 17.769 -12.309 28.827 452 H LEU 58 HN LEU 58 17.773 -9.686 21.199 453 HA LEU 58 HA LEU 58 17.528 -11.921 19.315 454 1HB LEU 58 HB2 LEU 58 15.923 -9.954 19.155 455 2HB LEU 58 HB1 LEU 58 17.286 -8.927 18.808 456 HG LEU 58 HG LEU 58 15.967 -9.438 16.781 457 1HD1 LEU 58 HD11 LEU 58 18.334 -9.027 16.500 458 2HD1 LEU 58 HD12 LEU 58 17.722 -10.168 15.301 459 3HD1 LEU 58 HD13 LEU 58 18.666 -10.749 16.673 460 1HD2 LEU 58 HD21 LEU 58 15.910 -11.695 15.863 461 2HD2 LEU 58 HD22 LEU 58 15.108 -11.616 17.434 462 3HD2 LEU 58 HD23 LEU 58 16.725 -12.309 17.300 463 H ILE 59 HN ILE 59 19.368 -12.571 18.329 464 HA ILE 59 HA ILE 59 21.762 -10.835 18.398 465 HB ILE 59 HB ILE 59 21.556 -13.821 18.876 466 1HG1 ILE 59 HG12 ILE 59 22.353 -11.573 20.722 467 2HG1 ILE 59 HG11 ILE 59 20.857 -12.493 20.812 468 1HG2 ILE 59 HG21 ILE 59 23.563 -13.278 17.619 469 2HG2 ILE 59 HG22 ILE 59 23.974 -13.743 19.273 470 3HG2 ILE 59 HG23 ILE 59 23.989 -12.045 18.803 471 1HD1 ILE 59 HD11 ILE 59 23.643 -13.531 21.255 472 2HD1 ILE 59 HD12 ILE 59 22.172 -14.503 21.296 473 3HD1 ILE 59 HD13 ILE 59 22.420 -13.230 22.493 474 H SER 60 HN SER 60 22.720 -10.551 16.509 475 HA SER 60 HA SER 60 22.249 -12.520 14.437 476 1HB SER 60 HB2 SER 60 22.166 -10.616 12.804 477 2HB SER 60 HB1 SER 60 20.760 -10.715 13.877 478 HG SER 60 HG SER 60 21.466 -9.021 14.967 479 H ALA 61 HN ALA 61 24.020 -13.160 13.448 480 HA ALA 61 HA ALA 61 26.155 -13.447 12.848 481 1HB ALA 61 HB1 ALA 61 26.487 -10.466 13.283 482 2HB ALA 61 HB2 ALA 61 25.941 -11.218 11.786 483 3HB ALA 61 HB3 ALA 61 27.577 -11.513 12.372 484 H GLY 62 HN GLY 62 25.238 -13.352 15.663 485 1HA GLY 62 HA2 GLY 62 26.318 -14.189 17.579 486 2HA GLY 62 HA1 GLY 62 27.863 -13.767 16.853 487 H LYS 63 HN LYS 63 25.442 -11.291 16.849 488 HA LYS 63 HA LYS 63 26.654 -10.098 19.214 489 1HB LYS 63 HB2 LYS 63 27.723 -9.157 17.214 490 2HB LYS 63 HB1 LYS 63 26.146 -8.732 16.566 491 1HG LYS 63 HG2 LYS 63 25.810 -7.137 18.355 492 2HG LYS 63 HG1 LYS 63 27.344 -7.608 19.091 493 1HD LYS 63 HD2 LYS 63 28.521 -6.874 17.071 494 2HD LYS 63 HD1 LYS 63 26.982 -6.363 16.374 495 1HE LYS 63 HE2 LYS 63 26.683 -4.749 18.147 496 2HE LYS 63 HE1 LYS 63 28.154 -5.307 18.940 497 1HZ LYS 63 HZ1 LYS 63 28.025 -4.059 16.253 498 2HZ LYS 63 HZ2 LYS 63 29.428 -4.539 17.033 499 3HZ LYS 63 HZ3 LYS 63 28.503 -3.277 17.653 500 H VAL 64 HN VAL 64 25.189 -9.260 20.571 501 HA VAL 64 HA VAL 64 22.406 -9.562 19.960 502 HB VAL 64 HB VAL 64 23.239 -9.992 22.251 503 1HG1 VAL 64 HG11 VAL 64 24.992 -8.360 22.420 504 2HG1 VAL 64 HG12 VAL 64 23.855 -8.148 23.755 505 3HG1 VAL 64 HG13 VAL 64 23.818 -7.047 22.379 506 1HG2 VAL 64 HG21 VAL 64 21.515 -8.772 23.519 507 2HG2 VAL 64 HG22 VAL 64 20.895 -9.417 21.999 508 3HG2 VAL 64 HG23 VAL 64 21.276 -7.701 22.138 509 H LEU 65 HN LEU 65 20.911 -8.015 19.408 510 HA LEU 65 HA LEU 65 22.142 -5.598 18.447 511 1HB LEU 65 HB2 LEU 65 19.396 -6.694 18.003 512 2HB LEU 65 HB1 LEU 65 20.085 -5.275 17.254 513 HG LEU 65 HG LEU 65 20.847 -8.142 16.828 514 1HD1 LEU 65 HD11 LEU 65 20.196 -7.691 14.515 515 2HD1 LEU 65 HD12 LEU 65 19.824 -6.028 14.948 516 3HD1 LEU 65 HD13 LEU 65 18.864 -7.337 15.621 517 1HD2 LEU 65 HD21 LEU 65 22.541 -7.327 15.248 518 2HD2 LEU 65 HD22 LEU 65 22.896 -6.844 16.901 519 3HD2 LEU 65 HD23 LEU 65 22.223 -5.672 15.765 520 H GLU 66 HN GLU 66 21.747 -3.690 19.120 521 HA GLU 66 HA GLU 66 20.254 -3.227 21.521 522 1HB GLU 66 HB2 GLU 66 22.305 -2.006 21.222 523 2HB GLU 66 HB1 GLU 66 21.815 -1.462 19.631 524 1HG GLU 66 HG2 GLU 66 21.739 0.309 21.356 525 2HG GLU 66 HG1 GLU 66 20.191 0.022 20.572 526 H ASN 67 HN ASN 67 18.162 -2.907 21.530 527 HA ASN 67 HA ASN 67 16.711 -2.825 19.168 528 1HB ASN 67 HB2 ASN 67 14.648 -2.507 20.516 529 2HB ASN 67 HB1 ASN 67 15.640 -3.851 21.036 530 1HD2 ASN 67 HD21 ASN 67 16.191 -0.432 21.900 531 2HD2 ASN 67 HD22 ASN 67 15.833 -0.678 23.567 532 H SER 68 HN SER 68 18.062 -0.281 20.939 533 HA SER 68 HA SER 68 16.269 1.768 20.087 534 1HB SER 68 HB2 SER 68 19.095 2.060 21.109 535 2HB SER 68 HB1 SER 68 17.817 3.280 21.143 536 HG SER 68 HG SER 68 18.122 0.931 22.621 537 H LYS 69 HN LYS 69 18.618 0.048 18.462 538 HA LYS 69 HA LYS 69 19.316 2.188 16.638 539 1HB LYS 69 HB2 LYS 69 20.332 -0.625 16.937 540 2HB LYS 69 HB1 LYS 69 20.910 0.548 15.767 541 1HG LYS 69 HG2 LYS 69 21.667 1.990 17.610 542 2HG LYS 69 HG1 LYS 69 21.103 0.781 18.766 543 1HD LYS 69 HD2 LYS 69 22.651 -0.853 17.735 544 2HD LYS 69 HD1 LYS 69 23.253 0.428 16.687 545 1HE LYS 69 HE2 LYS 69 23.378 0.408 19.705 546 2HE LYS 69 HE1 LYS 69 24.722 0.082 18.614 547 1HZ LYS 69 HZ1 LYS 69 23.239 2.649 18.816 548 2HZ LYS 69 HZ2 LYS 69 24.557 2.339 17.797 549 3HZ LYS 69 HZ3 LYS 69 24.757 2.328 19.465 550 H THR 70 HN THR 70 19.305 1.487 14.229 551 HA THR 70 HA THR 70 16.824 0.119 13.738 552 HB THR 70 HB THR 70 17.058 1.137 11.521 553 HG1 THR 70 HG1 THR 70 19.413 2.281 12.646 554 1HG2 THR 70 HG21 THR 70 15.727 2.305 13.189 555 2HG2 THR 70 HG22 THR 70 16.571 3.473 12.172 556 3HG2 THR 70 HG23 THR 70 17.171 3.118 13.794 557 H VAL 71 HN VAL 71 16.891 -1.139 11.644 558 HA VAL 71 HA VAL 71 18.902 -3.126 11.814 559 HB VAL 71 HB VAL 71 16.995 -2.505 9.539 560 1HG1 VAL 71 HG11 VAL 71 18.518 -5.054 10.130 561 2HG1 VAL 71 HG12 VAL 71 18.827 -3.949 8.790 562 3HG1 VAL 71 HG13 VAL 71 17.317 -4.859 8.853 563 1HG2 VAL 71 HG21 VAL 71 15.791 -2.943 11.598 564 2HG2 VAL 71 HG22 VAL 71 16.693 -4.437 11.837 565 3HG2 VAL 71 HG23 VAL 71 15.577 -4.290 10.479 566 H LYS 72 HN LYS 72 18.479 -0.217 10.001 567 HA LYS 72 HA LYS 72 20.431 -0.354 8.033 568 1HB LYS 72 HB2 LYS 72 18.613 1.350 8.302 569 2HB LYS 72 HB1 LYS 72 19.543 2.068 9.598 570 1HG LYS 72 HG2 LYS 72 20.527 1.838 6.757 571 2HG LYS 72 HG1 LYS 72 19.642 3.220 7.374 572 1HD LYS 72 HD2 LYS 72 21.454 3.591 9.026 573 2HD LYS 72 HD1 LYS 72 22.316 2.206 8.362 574 1HE LYS 72 HE2 LYS 72 23.258 4.231 7.456 575 2HE LYS 72 HE1 LYS 72 22.405 3.370 6.178 576 1HZ LYS 72 HZ1 LYS 72 21.357 5.689 7.704 577 2HZ LYS 72 HZ2 LYS 72 20.524 4.888 6.481 578 3HZ LYS 72 HZ3 LYS 72 21.938 5.736 6.121 579 H ASP 73 HN ASP 73 20.677 0.437 11.498 580 HA ASP 73 HA ASP 73 23.264 1.443 11.462 581 1HB ASP 73 HB2 ASP 73 21.559 0.206 13.595 582 2HB ASP 73 HB1 ASP 73 23.174 0.750 13.951 583 H TYR 74 HN TYR 74 22.056 -1.839 11.377 584 HA TYR 74 HA TYR 74 24.769 -2.857 11.754 585 1HB TYR 74 HB2 TYR 74 22.076 -4.188 11.962 586 2HB TYR 74 HB1 TYR 74 23.612 -5.020 12.096 587 HD1 TYR 74 HD1 TYR 74 25.106 -4.501 14.054 588 HD2 TYR 74 HD2 TYR 74 21.126 -3.017 13.802 589 HE1 TYR 74 HE1 TYR 74 25.121 -4.067 16.474 590 HE2 TYR 74 HE2 TYR 74 21.132 -2.578 16.225 591 HH TYR 74 HH TYR 74 23.991 -2.689 18.088 592 H ARG 75 HN ARG 75 22.887 -1.836 9.282 593 HA ARG 75 HA ARG 75 23.072 -4.071 7.519 594 1HB ARG 75 HB2 ARG 75 21.128 -2.705 7.698 595 2HB ARG 75 HB1 ARG 75 22.076 -1.264 7.380 596 1HG ARG 75 HG2 ARG 75 20.781 -1.805 5.560 597 2HG ARG 75 HG1 ARG 75 22.479 -2.069 5.133 598 1HD ARG 75 HD2 ARG 75 22.212 -4.457 5.292 599 2HD ARG 75 HD1 ARG 75 20.604 -4.292 5.996 600 HE ARG 75 HE ARG 75 20.529 -3.047 3.536 601 1HH1 ARG 75 HH11 ARG 75 21.311 -6.354 4.513 602 2HH1 ARG 75 HH12 ARG 75 20.399 -7.098 3.290 603 1HH2 ARG 75 HH21 ARG 75 19.267 -4.056 1.835 604 2HH2 ARG 75 HH22 ARG 75 19.197 -5.760 1.721 605 H SER 76 HN SER 76 25.098 -4.331 6.714 606 HA SER 76 HA SER 76 26.720 -2.051 6.189 607 1HB SER 76 HB2 SER 76 28.287 -3.899 5.343 608 2HB SER 76 HB1 SER 76 27.927 -3.872 7.074 609 HG SER 76 HG SER 76 27.213 -5.785 6.842 610 HA PRO 77 HA PRO 77 25.192 -1.530 2.080 611 1HB PRO 77 HB2 PRO 77 27.847 -0.681 1.285 612 2HB PRO 77 HB1 PRO 77 26.354 0.248 1.256 613 1HG PRO 77 HG2 PRO 77 28.295 0.780 3.053 614 2HG PRO 77 HG1 PRO 77 26.578 0.962 3.443 615 1HD PRO 77 HD2 PRO 77 28.481 -1.198 4.223 616 2HD PRO 77 HD1 PRO 77 27.131 -0.473 5.126 617 H VAL 78 HN VAL 78 24.899 -3.237 0.954 618 HA VAL 78 HA VAL 78 27.145 -4.953 0.156 619 HB VAL 78 HB VAL 78 25.142 -5.938 1.272 620 1HG1 VAL 78 HG11 VAL 78 23.378 -4.616 0.430 621 2HG1 VAL 78 HG12 VAL 78 23.071 -6.295 -0.017 622 3HG1 VAL 78 HG13 VAL 78 23.676 -5.159 -1.222 623 1HG2 VAL 78 HG21 VAL 78 24.860 -7.878 -0.241 624 2HG2 VAL 78 HG22 VAL 78 26.545 -7.398 -0.050 625 3HG2 VAL 78 HG23 VAL 78 25.665 -6.962 -1.516 626 H SER 79 HN SER 79 25.648 -2.372 -0.809 627 HA SER 79 HA SER 79 25.543 -1.122 -2.643 628 1HB SER 79 HB2 SER 79 26.912 -3.409 -4.093 629 2HB SER 79 HB1 SER 79 26.668 -1.784 -4.738 630 HG SER 79 HG SER 79 28.385 -2.686 -2.737 631 H ASN 80 HN ASN 80 23.797 -0.620 -3.628 632 HA ASN 80 HA ASN 80 21.766 -0.669 -4.614 633 1HB ASN 80 HB2 ASN 80 22.993 -2.044 -6.389 634 2HB ASN 80 HB1 ASN 80 22.457 -3.493 -5.551 635 1HD2 ASN 80 HD21 ASN 80 21.313 -4.230 -7.318 636 2HD2 ASN 80 HD22 ASN 80 19.870 -3.493 -7.872 637 H LEU 81 HN LEU 81 19.461 -2.320 -4.516 638 HA LEU 81 HA LEU 81 19.253 -2.737 -1.825 639 1HB LEU 81 HB2 LEU 81 17.178 -3.556 -2.354 640 2HB LEU 81 HB1 LEU 81 17.337 -1.958 -3.015 641 HG LEU 81 HG LEU 81 17.314 -4.616 -4.515 642 1HD1 LEU 81 HD11 LEU 81 15.143 -3.871 -5.369 643 2HD1 LEU 81 HD12 LEU 81 15.218 -2.459 -4.306 644 3HD1 LEU 81 HD13 LEU 81 15.148 -4.085 -3.623 645 1HD2 LEU 81 HD21 LEU 81 17.324 -1.803 -5.614 646 2HD2 LEU 81 HD22 LEU 81 17.037 -3.259 -6.555 647 3HD2 LEU 81 HD23 LEU 81 18.608 -3.007 -5.805 648 H ALA 82 HN ALA 82 18.213 -4.752 -1.137 649 HA ALA 82 HA ALA 82 19.076 -7.135 -2.350 650 1HB ALA 82 HB1 ALA 82 20.510 -7.902 -0.502 651 2HB ALA 82 HB2 ALA 82 20.364 -6.315 0.257 652 3HB ALA 82 HB3 ALA 82 21.178 -6.478 -1.299 653 H GLY 83 HN GLY 83 17.404 -8.295 -2.062 654 1HA GLY 83 HA2 GLY 83 15.871 -8.088 0.447 655 2HA GLY 83 HA1 GLY 83 15.149 -8.477 -1.113 656 H ALA 84 HN ALA 84 17.693 -9.602 1.021 657 HA ALA 84 HA ALA 84 17.068 -12.346 0.232 658 1HB ALA 84 HB1 ALA 84 19.534 -11.240 1.575 659 2HB ALA 84 HB2 ALA 84 19.399 -11.661 -0.134 660 3HB ALA 84 HB3 ALA 84 19.287 -12.918 1.100 661 H VAL 85 HN VAL 85 17.041 -13.955 1.973 662 HA VAL 85 HA VAL 85 15.688 -12.780 4.228 663 HB VAL 85 HB VAL 85 14.646 -14.720 3.244 664 1HG1 VAL 85 HG11 VAL 85 15.640 -16.990 3.429 665 2HG1 VAL 85 HG12 VAL 85 17.122 -16.257 4.038 666 3HG1 VAL 85 HG13 VAL 85 16.586 -15.922 2.394 667 1HG2 VAL 85 HG21 VAL 85 14.303 -16.105 5.268 668 2HG2 VAL 85 HG22 VAL 85 14.249 -14.374 5.599 669 3HG2 VAL 85 HG23 VAL 85 15.688 -15.305 6.012 670 H THR 86 HN THR 86 16.465 -12.425 6.008 671 HA THR 86 HA THR 86 19.204 -13.198 6.648 672 HB THR 86 HB THR 86 17.435 -11.126 7.955 673 HG1 THR 86 HG1 THR 86 17.738 -10.595 5.798 674 1HG2 THR 86 HG21 THR 86 20.441 -11.506 7.923 675 2HG2 THR 86 HG22 THR 86 19.381 -11.856 9.285 676 3HG2 THR 86 HG23 THR 86 19.585 -10.195 8.731 677 H THR 87 HN THR 87 19.492 -14.677 8.178 678 HA THR 87 HA THR 87 17.232 -15.550 9.780 679 HB THR 87 HB THR 87 19.985 -16.766 9.385 680 HG1 THR 87 HG1 THR 87 19.043 -17.026 7.456 681 1HG2 THR 87 HG21 THR 87 17.430 -17.934 10.501 682 2HG2 THR 87 HG22 THR 87 18.849 -17.487 11.448 683 3HG2 THR 87 HG23 THR 87 18.947 -18.806 10.280 684 H MET 88 HN MET 88 17.110 -14.662 11.798 685 HA MET 88 HA MET 88 19.635 -13.872 13.040 686 1HB MET 88 HB2 MET 88 16.888 -12.676 13.423 687 2HB MET 88 HB1 MET 88 18.277 -12.283 14.431 688 1HG MET 88 HG2 MET 88 19.473 -11.475 12.440 689 2HG MET 88 HG1 MET 88 18.059 -11.838 11.462 690 1HE MET 88 HE1 MET 88 19.567 -9.002 11.596 691 2HE MET 88 HE2 MET 88 18.179 -7.911 11.584 692 3HE MET 88 HE3 MET 88 18.192 -9.334 10.546 693 H HIS 89 HN HIS 89 20.075 -14.422 15.103 694 HA HIS 89 HA HIS 89 18.802 -16.885 15.941 695 1HB HIS 89 HB2 HIS 89 21.236 -16.717 15.701 696 2HB HIS 89 HB1 HIS 89 21.279 -15.452 16.915 697 HD1 HIS 89 HD1 HIS 89 21.710 -16.245 19.237 698 HD2 HIS 89 HD2 HIS 89 20.361 -19.291 16.771 699 HE1 HIS 89 HE1 HIS 89 21.907 -18.345 20.591 700 HE2 HIS 89 HE2 HIS 89 21.503 -20.142 18.896 701 H VAL 90 HN VAL 90 17.387 -16.911 17.514 702 HA VAL 90 HA VAL 90 17.308 -14.615 19.404 703 HB VAL 90 HB VAL 90 15.291 -15.008 17.782 704 1HG1 VAL 90 HG11 VAL 90 15.099 -17.235 17.767 705 2HG1 VAL 90 HG12 VAL 90 13.630 -16.546 18.479 706 3HG1 VAL 90 HG13 VAL 90 14.863 -17.291 19.513 707 1HG2 VAL 90 HG21 VAL 90 13.647 -14.398 19.493 708 2HG2 VAL 90 HG22 VAL 90 15.147 -13.494 19.701 709 3HG2 VAL 90 HG23 VAL 90 14.790 -14.862 20.751 710 H ILE 91 HN ILE 91 17.354 -14.840 21.378 711 HA ILE 91 HA ILE 91 17.519 -17.553 22.429 712 HB ILE 91 HB ILE 91 18.873 -15.028 23.176 713 1HG1 ILE 91 HG12 ILE 91 19.929 -17.729 22.348 714 2HG1 ILE 91 HG11 ILE 91 20.027 -16.214 21.463 715 1HG2 ILE 91 HG21 ILE 91 19.894 -16.290 25.148 716 2HG2 ILE 91 HG22 ILE 91 18.844 -17.652 24.760 717 3HG2 ILE 91 HG23 ILE 91 18.143 -16.122 25.290 718 1HD1 ILE 91 HD11 ILE 91 21.465 -16.887 24.020 719 2HD1 ILE 91 HD12 ILE 91 21.546 -15.339 23.190 720 3HD1 ILE 91 HD13 ILE 91 22.180 -16.791 22.410 721 H ILE 92 HN ILE 92 15.998 -18.112 23.627 722 HA ILE 92 HA ILE 92 14.087 -16.144 24.577 723 HB ILE 92 HB ILE 92 13.907 -19.136 24.266 724 1HG1 ILE 92 HG12 ILE 92 13.987 -18.041 22.121 725 2HG1 ILE 92 HG11 ILE 92 12.348 -18.602 22.420 726 1HG2 ILE 92 HG21 ILE 92 11.774 -17.180 25.059 727 2HG2 ILE 92 HG22 ILE 92 12.507 -18.418 26.084 728 3HG2 ILE 92 HG23 ILE 92 11.517 -18.891 24.697 729 1HD1 ILE 92 HD11 ILE 92 12.370 -16.413 21.376 730 2HD1 ILE 92 HD12 ILE 92 13.331 -15.760 22.696 731 3HD1 ILE 92 HD13 ILE 92 11.682 -16.320 22.994 732 H GLN 93 HN GLN 93 14.028 -15.613 26.626 733 HA GLN 93 HA GLN 93 15.026 -17.456 28.625 734 1HB GLN 93 HB2 GLN 93 15.591 -14.512 28.314 735 2HB GLN 93 HB1 GLN 93 15.854 -15.378 29.821 736 1HG GLN 93 HG2 GLN 93 17.495 -16.779 28.804 737 2HG GLN 93 HG1 GLN 93 17.134 -16.125 27.211 738 1HE2 GLN 93 HE21 GLN 93 19.271 -15.570 26.957 739 2HE2 GLN 93 HE22 GLN 93 20.007 -14.240 27.749 740 H ALA 94 HN ALA 94 13.560 -17.821 30.044 741 HA ALA 94 HA ALA 94 11.001 -16.681 29.973 742 1HB ALA 94 HB1 ALA 94 12.298 -18.296 32.168 743 2HB ALA 94 HB2 ALA 94 11.405 -18.944 30.792 744 3HB ALA 94 HB3 ALA 94 10.571 -17.980 32.011 745 HA PRO 95 HA PRO 95 11.537 -12.921 32.259 746 1HB PRO 95 HB2 PRO 95 9.006 -12.617 33.176 747 2HB PRO 95 HB1 PRO 95 9.446 -12.342 31.483 748 1HG PRO 95 HG2 PRO 95 8.265 -14.791 32.758 749 2HG PRO 95 HG1 PRO 95 7.745 -13.959 31.280 750 1HD PRO 95 HD2 PRO 95 9.236 -16.138 31.137 751 2HD PRO 95 HD1 PRO 95 9.548 -14.768 30.047 752 H VAL 96 HN VAL 96 11.000 -11.971 34.440 753 HA VAL 96 HA VAL 96 11.766 -13.752 36.533 754 HB VAL 96 HB VAL 96 10.744 -10.925 36.704 755 1HG1 VAL 96 HG11 VAL 96 12.304 -12.562 38.716 756 2HG1 VAL 96 HG12 VAL 96 10.614 -12.091 38.846 757 3HG1 VAL 96 HG13 VAL 96 11.877 -10.860 38.906 758 1HG2 VAL 96 HG21 VAL 96 13.586 -11.924 36.571 759 2HG2 VAL 96 HG22 VAL 96 13.113 -10.250 36.859 760 3HG2 VAL 96 HG23 VAL 96 12.731 -11.024 35.320 761 H THR 97 HN THR 97 10.466 -14.941 37.700 762 HA THR 97 HA THR 97 8.698 -15.997 38.442 763 HB THR 97 HB THR 97 7.420 -13.311 38.165 764 HG1 THR 97 HG1 THR 97 9.006 -14.527 40.073 765 1HG2 THR 97 HG21 THR 97 6.449 -15.726 39.734 766 2HG2 THR 97 HG22 THR 97 5.662 -15.019 38.321 767 3HG2 THR 97 HG23 THR 97 5.729 -14.121 39.836 768 H GLU 98 HN GLU 98 8.711 -17.285 36.646 769 HA GLU 98 HA GLU 98 6.955 -16.541 34.476 770 1HB GLU 98 HB2 GLU 98 7.980 -18.423 33.253 771 2HB GLU 98 HB1 GLU 98 9.168 -17.256 33.791 772 1HG GLU 98 HG2 GLU 98 8.617 -19.861 35.213 773 2HG GLU 98 HG1 GLU 98 9.822 -19.676 33.949 774 H LYS 99 HN LYS 99 4.952 -17.138 34.605 775 HA LYS 99 HA LYS 99 3.035 -18.200 35.108 776 1HB LYS 99 HB2 LYS 99 3.815 -19.820 33.469 777 2HB LYS 99 HB1 LYS 99 4.766 -20.640 34.689 778 1HG LYS 99 HG2 LYS 99 2.749 -21.364 35.830 779 2HG LYS 99 HG1 LYS 99 1.754 -20.476 34.675 780 1HD LYS 99 HD2 LYS 99 2.527 -21.883 32.866 781 2HD LYS 99 HD1 LYS 99 3.641 -22.713 33.951 782 1HE LYS 99 HE2 LYS 99 1.606 -24.025 33.520 783 2HE LYS 99 HE1 LYS 99 1.795 -23.610 35.219 784 1HZ LYS 99 HZ1 LYS 99 0.134 -21.899 34.990 785 2HZ LYS 99 HZ2 LYS 99 -0.487 -23.338 34.429 786 3HZ LYS 99 HZ3 LYS 99 -0.017 -22.156 33.326 787 H GLU 100 HN GLU 100 2.633 -17.517 37.113 788 HA GLU 100 HA GLU 100 3.872 -18.656 39.396 789 1HB GLU 100 HB2 GLU 100 2.987 -16.344 39.313 790 2HB GLU 100 HB1 GLU 100 1.357 -16.996 39.214 791 1HG GLU 100 HG2 GLU 100 1.655 -18.025 41.400 792 2HG GLU 100 HG1 GLU 100 3.284 -17.354 41.480 793 H LYS 101 HN LYS 101 0.745 -19.028 37.836 794 HA LYS 101 HA LYS 101 0.295 -21.389 39.507 795 1HB LYS 101 HB2 LYS 101 -1.299 -19.476 39.905 796 2HB LYS 101 HB1 LYS 101 -1.836 -19.625 38.247 797 1HG LYS 101 HG2 LYS 101 -2.077 -21.889 40.239 798 2HG LYS 101 HG1 LYS 101 -3.306 -20.654 40.074 799 1HD LYS 101 HD2 LYS 101 -2.376 -22.431 37.814 800 2HD LYS 101 HD1 LYS 101 -3.769 -22.787 38.837 801 1HE LYS 101 HE2 LYS 101 -4.767 -20.615 38.135 802 2HE LYS 101 HE1 LYS 101 -3.399 -20.375 37.051 803 1HZ LYS 101 HZ1 LYS 101 -5.358 -22.600 36.897 804 2HZ LYS 101 HZ2 LYS 101 -4.082 -22.348 35.812 805 3HZ LYS 101 HZ3 LYS 101 -5.338 -21.251 35.902 Start of MODEL 12 1 H GLU 1 HT1 GLU 1 -3.128 -9.769 2.617 2 HA GLU 1 HA GLU 1 -1.544 -8.327 4.647 3 1HB GLU 1 HB2 GLU 1 -0.806 -10.796 3.044 4 2HB GLU 1 HB1 GLU 1 0.259 -9.954 4.136 5 1HG GLU 1 HG2 GLU 1 -0.437 -11.902 5.250 6 2HG GLU 1 HG1 GLU 1 -1.356 -10.590 5.981 7 H ALA 2 HN ALA 2 0.392 -7.445 3.764 8 HA ALA 2 HA ALA 2 0.334 -7.120 0.867 9 1HB ALA 2 HB1 ALA 2 1.266 -4.856 1.150 10 2HB ALA 2 HB2 ALA 2 1.163 -5.031 2.902 11 3HB ALA 2 HB3 ALA 2 -0.309 -4.994 1.930 12 H GLU 3 HN GLU 3 1.673 -8.896 0.711 13 HA GLU 3 HA GLU 3 4.088 -8.880 2.133 14 1HB GLU 3 HB2 GLU 3 2.742 -10.943 1.753 15 2HB GLU 3 HB1 GLU 3 3.066 -10.822 0.044 16 1HG GLU 3 HG2 GLU 3 5.223 -11.199 2.109 17 2HG GLU 3 HG1 GLU 3 4.375 -12.540 1.368 18 H VAL 4 HN VAL 4 5.256 -7.224 1.414 19 HA VAL 4 HA VAL 4 5.859 -6.979 -1.437 20 HB VAL 4 HB VAL 4 6.493 -5.071 0.821 21 1HG1 VAL 4 HG11 VAL 4 7.990 -4.797 -1.067 22 2HG1 VAL 4 HG12 VAL 4 6.899 -3.413 -0.954 23 3HG1 VAL 4 HG13 VAL 4 6.613 -4.667 -2.158 24 1HG2 VAL 4 HG21 VAL 4 4.225 -4.956 -1.166 25 2HG2 VAL 4 HG22 VAL 4 4.648 -3.674 -0.031 26 3HG2 VAL 4 HG23 VAL 4 4.086 -5.233 0.570 27 H HIS 5 HN HIS 5 7.938 -7.148 -2.085 28 HA HIS 5 HA HIS 5 9.893 -7.754 -0.060 29 1HB HIS 5 HB2 HIS 5 10.748 -9.771 -1.361 30 2HB HIS 5 HB1 HIS 5 9.240 -9.965 -0.483 31 HD1 HIS 5 HD1 HIS 5 10.729 -10.354 -3.807 32 HD2 HIS 5 HD2 HIS 5 6.908 -9.959 -2.231 33 HE1 HIS 5 HE1 HIS 5 9.174 -11.140 -5.603 34 HE2 HIS 5 HE2 HIS 5 6.901 -11.135 -4.505 35 H ASN 6 HN ASN 6 10.594 -5.742 -0.516 36 HA ASN 6 HA ASN 6 12.686 -5.796 -2.591 37 1HB ASN 6 HB2 ASN 6 11.029 -3.369 -1.851 38 2HB ASN 6 HB1 ASN 6 12.426 -3.349 -2.917 39 1HD2 ASN 6 HD21 ASN 6 12.225 -4.284 -4.977 40 2HD2 ASN 6 HD22 ASN 6 10.683 -4.559 -5.684 41 H GLN 7 HN GLN 7 12.031 -5.941 0.528 42 HA GLN 7 HA GLN 7 14.292 -4.331 1.333 43 1HB GLN 7 HB2 GLN 7 11.794 -5.108 2.829 44 2HB GLN 7 HB1 GLN 7 13.193 -4.359 3.578 45 1HG GLN 7 HG2 GLN 7 11.486 -3.140 1.405 46 2HG GLN 7 HG1 GLN 7 11.411 -2.746 3.122 47 1HE2 GLN 7 HE21 GLN 7 13.272 -2.398 0.176 48 2HE2 GLN 7 HE22 GLN 7 14.297 -1.160 0.789 49 H LEU 8 HN LEU 8 14.692 -5.574 3.857 50 HA LEU 8 HA LEU 8 15.661 -8.080 2.740 51 1HB LEU 8 HB2 LEU 8 16.483 -6.654 5.230 52 2HB LEU 8 HB1 LEU 8 17.108 -8.193 4.736 53 HG LEU 8 HG LEU 8 17.954 -7.058 2.620 54 1HD1 LEU 8 HD11 LEU 8 16.636 -5.036 2.684 55 2HD1 LEU 8 HD12 LEU 8 18.358 -4.656 2.703 56 3HD1 LEU 8 HD13 LEU 8 17.416 -4.550 4.191 57 1HD2 LEU 8 HD21 LEU 8 19.435 -7.727 4.393 58 2HD2 LEU 8 HD22 LEU 8 19.077 -6.241 5.270 59 3HD2 LEU 8 HD23 LEU 8 19.952 -6.171 3.741 60 H GLU 9 HN GLU 9 15.055 -9.962 3.358 61 HA GLU 9 HA GLU 9 12.869 -10.051 5.255 62 1HB GLU 9 HB2 GLU 9 13.784 -12.153 3.335 63 2HB GLU 9 HB1 GLU 9 12.377 -12.206 4.347 64 1HG GLU 9 HG2 GLU 9 11.312 -10.399 3.245 65 2HG GLU 9 HG1 GLU 9 12.757 -10.047 2.304 66 H ILE 10 HN ILE 10 12.989 -10.881 7.055 67 HA ILE 10 HA ILE 10 15.301 -12.545 7.820 68 HB ILE 10 HB ILE 10 14.056 -10.348 9.526 69 1HG1 ILE 10 HG12 ILE 10 16.796 -10.458 8.225 70 2HG1 ILE 10 HG11 ILE 10 15.464 -9.467 7.655 71 1HG2 ILE 10 HG21 ILE 10 16.412 -12.148 10.075 72 2HG2 ILE 10 HG22 ILE 10 14.839 -12.203 10.879 73 3HG2 ILE 10 HG23 ILE 10 15.890 -10.800 11.083 74 1HD1 ILE 10 HD11 ILE 10 17.064 -8.151 8.909 75 2HD1 ILE 10 HD12 ILE 10 16.882 -9.219 10.301 76 3HD1 ILE 10 HD13 ILE 10 15.527 -8.219 9.775 77 H LYS 11 HN LYS 11 14.813 -14.217 9.146 78 HA LYS 11 HA LYS 11 12.080 -14.285 10.193 79 1HB LYS 11 HB2 LYS 11 12.021 -16.708 10.097 80 2HB LYS 11 HB1 LYS 11 12.423 -16.088 8.505 81 1HG LYS 11 HG2 LYS 11 14.639 -16.793 8.744 82 2HG LYS 11 HG1 LYS 11 14.397 -17.199 10.456 83 1HD LYS 11 HD2 LYS 11 12.635 -18.805 9.744 84 2HD LYS 11 HD1 LYS 11 13.069 -18.456 8.074 85 1HE LYS 11 HE2 LYS 11 15.319 -19.331 8.475 86 2HE LYS 11 HE1 LYS 11 14.911 -19.610 10.163 87 1HZ LYS 11 HZ1 LYS 11 13.637 -20.934 7.829 88 2HZ LYS 11 HZ2 LYS 11 13.159 -21.138 9.423 89 3HZ LYS 11 HZ3 LYS 11 14.704 -21.644 8.934 90 H PHE 12 HN PHE 12 11.811 -15.111 12.307 91 HA PHE 12 HA PHE 12 14.201 -14.648 13.920 92 1HB PHE 12 HB2 PHE 12 11.297 -14.811 14.723 93 2HB PHE 12 HB1 PHE 12 12.628 -14.488 15.823 94 HD1 PHE 12 HD1 PHE 12 14.121 -12.440 15.175 95 HD2 PHE 12 HD2 PHE 12 10.144 -13.050 13.800 96 HE1 PHE 12 HE1 PHE 12 13.913 -10.034 14.732 97 HE2 PHE 12 HE2 PHE 12 9.928 -10.642 13.345 98 HZ PHE 12 HZ PHE 12 11.825 -9.130 13.819 99 H ARG 13 HN ARG 13 15.237 -16.250 14.914 100 HA ARG 13 HA ARG 13 13.832 -18.807 15.126 101 1HB ARG 13 HB2 ARG 13 15.771 -19.015 13.689 102 2HB ARG 13 HB1 ARG 13 16.803 -18.291 14.920 103 1HG ARG 13 HG2 ARG 13 16.437 -20.185 16.383 104 2HG ARG 13 HG1 ARG 13 15.327 -20.898 15.214 105 1HD ARG 13 HD2 ARG 13 17.122 -21.121 13.616 106 2HD ARG 13 HD1 ARG 13 18.243 -20.329 14.726 107 HE ARG 13 HE ARG 13 17.673 -22.271 16.257 108 1HH1 ARG 13 HH11 ARG 13 17.778 -22.589 12.730 109 2HH1 ARG 13 HH12 ARG 13 18.210 -24.226 12.756 110 1HH2 ARG 13 HH21 ARG 13 18.269 -24.503 16.274 111 2HH2 ARG 13 HH22 ARG 13 18.483 -25.348 14.799 112 H LEU 14 HN LEU 14 13.365 -19.515 17.019 113 HA LEU 14 HA LEU 14 14.122 -18.044 19.363 114 1HB LEU 14 HB2 LEU 14 12.365 -20.473 18.981 115 2HB LEU 14 HB1 LEU 14 12.660 -19.738 20.535 116 HG LEU 14 HG LEU 14 11.533 -17.655 19.707 117 1HD1 LEU 14 HD11 LEU 14 10.143 -17.743 17.709 118 2HD1 LEU 14 HD12 LEU 14 10.808 -19.327 17.311 119 3HD1 LEU 14 HD13 LEU 14 11.853 -17.909 17.312 120 1HD2 LEU 14 HD21 LEU 14 10.323 -19.284 21.030 121 2HD2 LEU 14 HD22 LEU 14 9.904 -20.181 19.569 122 3HD2 LEU 14 HD23 LEU 14 9.265 -18.558 19.820 123 H THR 15 HN THR 15 14.674 -19.431 21.379 124 HA THR 15 HA THR 15 17.173 -20.621 20.902 125 HB THR 15 HB THR 15 16.993 -21.027 23.414 126 HG1 THR 15 HG1 THR 15 14.945 -20.935 23.989 127 1HG2 THR 15 HG21 THR 15 16.594 -18.222 22.354 128 2HG2 THR 15 HG22 THR 15 18.137 -19.067 22.451 129 3HG2 THR 15 HG23 THR 15 17.271 -18.635 23.926 130 H ASP 16 HN ASP 16 13.983 -21.824 21.158 131 HA ASP 16 HA ASP 16 14.769 -24.498 21.891 132 1HB ASP 16 HB2 ASP 16 12.082 -23.378 21.095 133 2HB ASP 16 HB1 ASP 16 12.345 -25.059 21.538 134 H GLY 17 HN GLY 17 15.120 -22.909 19.105 135 1HA GLY 17 HA2 GLY 17 15.939 -23.873 17.120 136 2HA GLY 17 HA1 GLY 17 15.261 -25.417 17.622 137 H SER 18 HN SER 18 12.947 -23.091 18.059 138 HA SER 18 HA SER 18 11.563 -23.854 15.663 139 1HB SER 18 HB2 SER 18 9.724 -22.582 16.920 140 2HB SER 18 HB1 SER 18 10.310 -24.074 17.666 141 HG SER 18 HG SER 18 10.170 -22.238 19.139 142 H ASP 19 HN ASP 19 10.972 -22.295 14.037 143 HA ASP 19 HA ASP 19 11.937 -19.640 14.546 144 1HB ASP 19 HB2 ASP 19 12.607 -19.510 12.201 145 2HB ASP 19 HB1 ASP 19 13.620 -20.619 13.126 146 H ILE 20 HN ILE 20 10.971 -18.041 13.312 147 HA ILE 20 HA ILE 20 8.140 -18.612 12.724 148 HB ILE 20 HB ILE 20 9.496 -15.964 13.395 149 1HG1 ILE 20 HG12 ILE 20 7.704 -17.707 15.115 150 2HG1 ILE 20 HG11 ILE 20 9.437 -17.505 15.318 151 1HG2 ILE 20 HG21 ILE 20 7.528 -15.649 11.980 152 2HG2 ILE 20 HG22 ILE 20 7.215 -15.063 13.612 153 3HG2 ILE 20 HG23 ILE 20 6.554 -16.615 13.089 154 1HD1 ILE 20 HD11 ILE 20 7.358 -15.341 15.624 155 2HD1 ILE 20 HD12 ILE 20 9.096 -15.135 15.838 156 3HD1 ILE 20 HD13 ILE 20 8.189 -16.178 16.936 157 H GLY 21 HN GLY 21 7.306 -17.992 10.753 158 1HA GLY 21 HA2 GLY 21 8.812 -18.117 8.474 159 2HA GLY 21 HA1 GLY 21 7.224 -17.381 8.557 160 HA PRO 22 HA PRO 22 11.006 -14.349 8.038 161 1HB PRO 22 HB2 PRO 22 11.438 -14.404 5.366 162 2HB PRO 22 HB1 PRO 22 12.332 -15.392 6.514 163 1HG PRO 22 HG2 PRO 22 10.003 -16.149 4.793 164 2HG PRO 22 HG1 PRO 22 11.477 -17.066 5.148 165 1HD PRO 22 HD2 PRO 22 9.139 -17.579 6.381 166 2HD PRO 22 HD1 PRO 22 10.704 -17.762 7.204 167 H LYS 23 HN LYS 23 10.756 -12.285 7.493 168 HA LYS 23 HA LYS 23 8.548 -11.465 5.768 169 1HB LYS 23 HB2 LYS 23 9.003 -10.492 8.574 170 2HB LYS 23 HB1 LYS 23 8.035 -9.635 7.385 171 1HG LYS 23 HG2 LYS 23 6.551 -11.527 7.219 172 2HG LYS 23 HG1 LYS 23 7.585 -12.386 8.367 173 1HD LYS 23 HD2 LYS 23 5.572 -11.418 9.475 174 2HD LYS 23 HD1 LYS 23 7.066 -10.704 10.087 175 1HE LYS 23 HE2 LYS 23 6.762 -8.774 8.643 176 2HE LYS 23 HE1 LYS 23 5.316 -9.500 7.941 177 1HZ LYS 23 HZ1 LYS 23 4.295 -9.383 10.135 178 2HZ LYS 23 HZ2 LYS 23 4.752 -7.877 9.545 179 3HZ LYS 23 HZ3 LYS 23 5.663 -8.599 10.755 180 H ALA 24 HN ALA 24 8.691 -9.242 5.335 181 HA ALA 24 HA ALA 24 11.503 -8.584 4.807 182 1HB ALA 24 HB1 ALA 24 9.042 -7.211 3.713 183 2HB ALA 24 HB2 ALA 24 9.975 -8.458 2.883 184 3HB ALA 24 HB3 ALA 24 10.705 -6.892 3.231 185 H PHE 25 HN PHE 25 12.584 -7.246 5.982 186 HA PHE 25 HA PHE 25 11.179 -5.245 7.597 187 1HB PHE 25 HB2 PHE 25 13.892 -6.513 8.030 188 2HB PHE 25 HB1 PHE 25 13.130 -5.326 9.067 189 HD1 PHE 25 HD1 PHE 25 12.932 -8.760 7.823 190 HD2 PHE 25 HD2 PHE 25 11.640 -6.003 10.768 191 HE1 PHE 25 HE1 PHE 25 12.009 -10.602 9.124 192 HE2 PHE 25 HE2 PHE 25 10.706 -7.866 12.082 193 HZ PHE 25 HZ PHE 25 10.926 -10.197 11.212 194 HA PRO 26 HA PRO 26 13.490 -2.575 4.831 195 1HB PRO 26 HB2 PRO 26 12.740 -0.631 6.958 196 2HB PRO 26 HB1 PRO 26 12.556 -0.438 5.223 197 1HG PRO 26 HG2 PRO 26 10.429 -0.942 6.734 198 2HG PRO 26 HG1 PRO 26 10.612 -1.791 5.185 199 1HD PRO 26 HD2 PRO 26 11.130 -2.794 7.959 200 2HD PRO 26 HD1 PRO 26 10.377 -3.622 6.574 201 H ASP 27 HN ASP 27 15.557 -1.726 5.003 202 HA ASP 27 HA ASP 27 17.139 -2.633 7.148 203 1HB ASP 27 HB2 ASP 27 19.014 -1.467 6.026 204 2HB ASP 27 HB1 ASP 27 18.078 -2.451 4.913 205 H ALA 28 HN ALA 28 15.626 0.416 6.483 206 HA ALA 28 HA ALA 28 17.176 1.845 8.443 207 1HB ALA 28 HB1 ALA 28 14.672 2.699 7.013 208 2HB ALA 28 HB2 ALA 28 16.320 2.951 6.435 209 3HB ALA 28 HB3 ALA 28 15.772 3.737 7.918 210 H THR 29 HN THR 29 14.860 -0.406 8.875 211 HA THR 29 HA THR 29 13.205 0.787 10.846 212 HB THR 29 HB THR 29 13.920 -2.125 10.416 213 HG1 THR 29 HG1 THR 29 12.866 -1.893 8.704 214 1HG2 THR 29 HG21 THR 29 11.504 -0.861 11.742 215 2HG2 THR 29 HG22 THR 29 12.800 -1.715 12.577 216 3HG2 THR 29 HG23 THR 29 11.740 -2.587 11.469 217 H THR 30 HN THR 30 13.499 0.883 13.090 218 HA THR 30 HA THR 30 16.176 0.517 14.043 219 HB THR 30 HB THR 30 15.252 1.397 16.179 220 HG1 THR 30 HG1 THR 30 13.038 2.254 15.926 221 1HG2 THR 30 HG21 THR 30 14.503 3.004 13.728 222 2HG2 THR 30 HG22 THR 30 16.099 2.954 14.482 223 3HG2 THR 30 HG23 THR 30 14.738 3.658 15.351 224 H VAL 31 HN VAL 31 16.707 -0.782 15.892 225 HA VAL 31 HA VAL 31 15.593 -3.366 15.832 226 HB VAL 31 HB VAL 31 17.449 -2.080 17.864 227 1HG1 VAL 31 HG11 VAL 31 16.806 -5.017 17.498 228 2HG1 VAL 31 HG12 VAL 31 16.294 -4.022 18.857 229 3HG1 VAL 31 HG13 VAL 31 18.007 -4.346 18.602 230 1HG2 VAL 31 HG21 VAL 31 18.337 -2.199 15.605 231 2HG2 VAL 31 HG22 VAL 31 18.003 -3.931 15.547 232 3HG2 VAL 31 HG23 VAL 31 19.198 -3.294 16.681 233 H SER 32 HN SER 32 14.855 -0.548 17.714 234 HA SER 32 HA SER 32 13.313 -1.803 19.707 235 1HB SER 32 HB2 SER 32 14.112 0.584 19.779 236 2HB SER 32 HB1 SER 32 12.946 0.968 18.522 237 HG SER 32 HG SER 32 12.596 0.753 21.177 238 H ALA 33 HN ALA 33 12.492 -0.465 16.482 239 HA ALA 33 HA ALA 33 9.735 -1.198 16.591 240 1HB ALA 33 HB1 ALA 33 11.474 -0.598 14.193 241 2HB ALA 33 HB2 ALA 33 10.577 0.597 15.128 242 3HB ALA 33 HB3 ALA 33 9.711 -0.636 14.211 243 H LEU 34 HN LEU 34 12.698 -2.858 15.658 244 HA LEU 34 HA LEU 34 11.653 -4.965 14.245 245 1HB LEU 34 HB2 LEU 34 13.997 -4.369 14.307 246 2HB LEU 34 HB1 LEU 34 14.011 -4.573 16.045 247 HG LEU 34 HG LEU 34 13.653 -6.840 15.821 248 1HD1 LEU 34 HD11 LEU 34 13.947 -7.978 13.559 249 2HD1 LEU 34 HD12 LEU 34 13.950 -6.377 12.821 250 3HD1 LEU 34 HD13 LEU 34 12.504 -6.965 13.638 251 1HD2 LEU 34 HD21 LEU 34 15.883 -7.468 14.966 252 2HD2 LEU 34 HD22 LEU 34 15.889 -6.062 16.028 253 3HD2 LEU 34 HD23 LEU 34 16.034 -5.851 14.279 254 H LYS 35 HN LYS 35 12.269 -4.422 17.708 255 HA LYS 35 HA LYS 35 11.268 -6.920 18.525 256 1HB LYS 35 HB2 LYS 35 11.678 -4.357 20.007 257 2HB LYS 35 HB1 LYS 35 11.138 -5.846 20.780 258 1HG LYS 35 HG2 LYS 35 13.188 -6.945 20.075 259 2HG LYS 35 HG1 LYS 35 13.736 -5.454 19.310 260 1HD LYS 35 HD2 LYS 35 13.723 -4.334 21.470 261 2HD LYS 35 HD1 LYS 35 13.099 -5.794 22.238 262 1HE LYS 35 HE2 LYS 35 15.144 -6.982 21.578 263 2HE LYS 35 HE1 LYS 35 15.761 -5.496 20.855 264 1HZ LYS 35 HZ1 LYS 35 15.711 -4.449 22.992 265 2HZ LYS 35 HZ2 LYS 35 16.626 -5.867 23.132 266 3HZ LYS 35 HZ3 LYS 35 15.043 -5.806 23.713 267 H GLU 36 HN GLU 36 9.737 -3.738 18.153 268 HA GLU 36 HA GLU 36 7.213 -4.429 19.121 269 1HB GLU 36 HB2 GLU 36 8.037 -2.562 16.906 270 2HB GLU 36 HB1 GLU 36 6.382 -2.682 17.447 271 1HG GLU 36 HG2 GLU 36 8.731 -1.822 19.130 272 2HG GLU 36 HG1 GLU 36 7.540 -0.750 18.397 273 H THR 37 HN THR 37 8.739 -5.021 16.024 274 HA THR 37 HA THR 37 6.505 -6.157 14.734 275 HB THR 37 HB THR 37 9.467 -6.627 14.253 276 HG1 THR 37 HG1 THR 37 8.804 -4.421 13.963 277 1HG2 THR 37 HG21 THR 37 8.094 -8.394 13.217 278 2HG2 THR 37 HG22 THR 37 8.772 -7.327 11.981 279 3HG2 THR 37 HG23 THR 37 7.090 -7.163 12.454 280 H VAL 38 HN VAL 38 9.061 -7.496 16.771 281 HA VAL 38 HA VAL 38 8.358 -10.202 16.484 282 HB VAL 38 HB VAL 38 9.567 -8.875 18.941 283 1HG1 VAL 38 HG11 VAL 38 8.662 -11.074 19.442 284 2HG1 VAL 38 HG12 VAL 38 10.424 -11.134 19.456 285 3HG1 VAL 38 HG13 VAL 38 9.534 -11.767 18.076 286 1HG2 VAL 38 HG21 VAL 38 10.926 -10.217 16.604 287 2HG2 VAL 38 HG22 VAL 38 11.735 -9.598 18.044 288 3HG2 VAL 38 HG23 VAL 38 10.921 -8.489 16.940 289 H ILE 39 HN ILE 39 7.320 -7.725 18.779 290 HA ILE 39 HA ILE 39 5.587 -9.243 20.383 291 HB ILE 39 HB ILE 39 5.145 -6.368 19.501 292 1HG1 ILE 39 HG12 ILE 39 6.663 -7.444 21.887 293 2HG1 ILE 39 HG11 ILE 39 7.370 -6.671 20.479 294 1HG2 ILE 39 HG21 ILE 39 3.919 -6.125 21.623 295 2HG2 ILE 39 HG22 ILE 39 4.142 -7.837 21.945 296 3HG2 ILE 39 HG23 ILE 39 3.159 -7.322 20.567 297 1HD1 ILE 39 HD11 ILE 39 7.259 -5.143 22.362 298 2HD1 ILE 39 HD12 ILE 39 5.516 -5.366 22.452 299 3HD1 ILE 39 HD13 ILE 39 6.230 -4.580 21.042 300 H SER 40 HN SER 40 5.113 -7.828 17.241 301 HA SER 40 HA SER 40 2.326 -8.247 17.124 302 1HB SER 40 HB2 SER 40 3.458 -6.516 15.780 303 2HB SER 40 HB1 SER 40 4.279 -7.773 14.865 304 HG SER 40 HG SER 40 2.369 -8.334 13.901 305 H GLU 41 HN GLU 41 5.166 -10.171 16.079 306 HA GLU 41 HA GLU 41 3.534 -12.045 14.678 307 1HB GLU 41 HB2 GLU 41 6.466 -12.013 15.314 308 2HB GLU 41 HB1 GLU 41 5.641 -13.083 14.202 309 1HG GLU 41 HG2 GLU 41 6.020 -10.109 13.917 310 2HG GLU 41 HG1 GLU 41 6.808 -11.365 12.973 311 H TRP 42 HN TRP 42 5.236 -11.778 17.736 312 HA TRP 42 HA TRP 42 5.492 -14.476 18.428 313 1HB TRP 42 HB2 TRP 42 6.650 -12.441 19.414 314 2HB TRP 42 HB1 TRP 42 5.171 -12.132 20.300 315 HD1 TRP 42 HD1 TRP 42 4.719 -13.718 22.496 316 HE1 TRP 42 HE1 TRP 42 6.287 -15.216 23.826 317 HE3 TRP 42 HE3 TRP 42 8.538 -14.110 19.103 318 HZ2 TRP 42 HZ2 TRP 42 8.790 -16.482 23.474 319 HZ3 TRP 42 HZ3 TRP 42 10.473 -15.499 19.686 320 HH2 TRP 42 HH2 TRP 42 10.596 -16.655 21.820 321 HA PRO 43 HA PRO 43 1.268 -15.424 19.643 322 1HB PRO 43 HB2 PRO 43 2.596 -17.389 21.409 323 2HB PRO 43 HB1 PRO 43 1.334 -17.670 20.220 324 1HG PRO 43 HG2 PRO 43 3.843 -18.437 19.742 325 2HG PRO 43 HG1 PRO 43 2.853 -17.735 18.446 326 1HD PRO 43 HD2 PRO 43 5.022 -16.457 20.073 327 2HD PRO 43 HD1 PRO 43 4.661 -16.307 18.334 328 H ARG 44 HN ARG 44 0.516 -13.930 20.900 329 HA ARG 44 HA ARG 44 1.856 -12.888 23.195 330 1HB ARG 44 HB2 ARG 44 -0.960 -12.363 22.226 331 2HB ARG 44 HB1 ARG 44 -0.006 -11.330 23.295 332 1HG ARG 44 HG2 ARG 44 1.583 -10.887 21.555 333 2HG ARG 44 HG1 ARG 44 0.797 -12.035 20.485 334 1HD ARG 44 HD2 ARG 44 -1.247 -10.556 20.613 335 2HD ARG 44 HD1 ARG 44 -0.230 -9.361 21.424 336 HE ARG 44 HE ARG 44 1.087 -10.191 19.141 337 1HH1 ARG 44 HH11 ARG 44 -1.704 -8.208 20.012 338 2HH1 ARG 44 HH12 ARG 44 -1.816 -7.437 18.508 339 1HH2 ARG 44 HH21 ARG 44 0.875 -9.175 17.017 340 2HH2 ARG 44 HH22 ARG 44 -0.334 -7.994 16.776 341 H GLU 45 HN GLU 45 -0.480 -15.282 22.623 342 HA GLU 45 HA GLU 45 -1.527 -15.453 25.285 343 1HB GLU 45 HB2 GLU 45 -2.816 -16.095 23.294 344 2HB GLU 45 HB1 GLU 45 -1.623 -17.321 22.927 345 1HG GLU 45 HG2 GLU 45 -2.255 -18.563 24.907 346 2HG GLU 45 HG1 GLU 45 -3.423 -17.305 25.337 347 H LYS 46 HN LYS 46 1.408 -16.372 23.827 348 HA LYS 46 HA LYS 46 1.875 -18.900 25.021 349 1HB LYS 46 HB2 LYS 46 3.238 -17.712 23.091 350 2HB LYS 46 HB1 LYS 46 4.020 -16.930 24.416 351 1HG LYS 46 HG2 LYS 46 4.716 -19.000 25.395 352 2HG LYS 46 HG1 LYS 46 3.916 -19.900 24.114 353 1HD LYS 46 HD2 LYS 46 5.406 -18.781 22.479 354 2HD LYS 46 HD1 LYS 46 6.247 -18.018 23.836 355 1HE LYS 46 HE2 LYS 46 5.979 -20.972 23.315 356 2HE LYS 46 HE1 LYS 46 7.440 -20.003 23.142 357 1HZ LYS 46 HZ1 LYS 46 7.404 -19.585 25.526 358 2HZ LYS 46 HZ2 LYS 46 7.431 -21.232 25.177 359 3HZ LYS 46 HZ3 LYS 46 6.005 -20.536 25.710 360 H GLU 47 HN GLU 47 2.609 -19.446 27.017 361 HA GLU 47 HA GLU 47 3.253 -17.306 28.784 362 1HB GLU 47 HB2 GLU 47 2.837 -18.892 30.620 363 2HB GLU 47 HB1 GLU 47 1.436 -18.760 29.576 364 1HG GLU 47 HG2 GLU 47 3.445 -21.014 29.485 365 2HG GLU 47 HG1 GLU 47 1.915 -21.071 30.349 366 H ASN 48 HN ASN 48 4.943 -18.195 30.531 367 HA ASN 48 HA ASN 48 7.087 -18.703 30.974 368 1HB ASN 48 HB2 ASN 48 6.480 -21.034 29.152 369 2HB ASN 48 HB1 ASN 48 7.971 -20.889 30.065 370 1HD2 ASN 48 HD21 ASN 48 7.592 -22.723 31.227 371 2HD2 ASN 48 HD22 ASN 48 6.374 -22.858 32.433 372 H GLY 49 HN GLY 49 6.481 -17.064 28.544 373 1HA GLY 49 HA2 GLY 49 9.184 -16.914 27.662 374 2HA GLY 49 HA1 GLY 49 8.007 -17.355 26.427 375 HA PRO 50 HA PRO 50 8.530 -12.575 26.968 376 1HB PRO 50 HB2 PRO 50 8.855 -13.313 24.108 377 2HB PRO 50 HB1 PRO 50 9.528 -11.936 24.967 378 1HG PRO 50 HG2 PRO 50 11.069 -14.000 24.546 379 2HG PRO 50 HG1 PRO 50 11.020 -13.328 26.191 380 1HD PRO 50 HD2 PRO 50 9.728 -15.806 25.128 381 2HD PRO 50 HD1 PRO 50 10.473 -15.488 26.709 382 H LYS 51 HN LYS 51 7.476 -11.043 25.443 383 HA LYS 51 HA LYS 51 5.248 -11.707 23.816 384 1HB LYS 51 HB2 LYS 51 4.179 -11.995 26.059 385 2HB LYS 51 HB1 LYS 51 4.646 -10.345 26.458 386 1HG LYS 51 HG2 LYS 51 3.333 -9.573 24.477 387 2HG LYS 51 HG1 LYS 51 2.747 -11.222 24.295 388 1HD LYS 51 HD2 LYS 51 2.387 -9.465 26.700 389 2HD LYS 51 HD1 LYS 51 1.161 -9.779 25.465 390 1HE LYS 51 HE2 LYS 51 1.239 -12.180 26.082 391 2HE LYS 51 HE1 LYS 51 2.383 -11.792 27.365 392 1HZ LYS 51 HZ1 LYS 51 -0.386 -10.764 27.141 393 2HZ LYS 51 HZ2 LYS 51 0.687 -10.343 28.344 394 3HZ LYS 51 HZ3 LYS 51 0.130 -11.934 28.239 395 H THR 52 HN THR 52 6.857 -9.357 25.905 396 HA THR 52 HA THR 52 6.284 -7.323 23.920 397 HB THR 52 HB THR 52 6.626 -5.694 25.717 398 HG1 THR 52 HG1 THR 52 6.580 -7.982 27.437 399 1HG2 THR 52 HG21 THR 52 4.381 -6.463 25.190 400 2HG2 THR 52 HG22 THR 52 4.520 -6.221 26.934 401 3HG2 THR 52 HG23 THR 52 4.579 -7.847 26.259 402 H VAL 53 HN VAL 53 7.881 -5.464 24.093 403 HA VAL 53 HA VAL 53 10.191 -6.185 22.739 404 HB VAL 53 HB VAL 53 9.100 -4.089 22.276 405 1HG1 VAL 53 HG11 VAL 53 8.131 -3.640 24.427 406 2HG1 VAL 53 HG12 VAL 53 9.048 -2.236 23.870 407 3HG1 VAL 53 HG13 VAL 53 9.723 -3.303 25.107 408 1HG2 VAL 53 HG21 VAL 53 11.727 -3.456 23.601 409 2HG2 VAL 53 HG22 VAL 53 10.923 -2.470 22.377 410 3HG2 VAL 53 HG23 VAL 53 11.544 -4.071 21.965 411 H LYS 54 HN LYS 54 9.739 -5.455 26.122 412 HA LYS 54 HA LYS 54 12.467 -4.978 26.702 413 1HB LYS 54 HB2 LYS 54 10.652 -4.130 28.081 414 2HB LYS 54 HB1 LYS 54 10.181 -5.766 28.514 415 1HG LYS 54 HG2 LYS 54 11.381 -4.731 30.331 416 2HG LYS 54 HG1 LYS 54 12.345 -6.044 29.657 417 1HD LYS 54 HD2 LYS 54 13.658 -4.422 28.379 418 2HD LYS 54 HD1 LYS 54 12.694 -3.107 29.054 419 1HE LYS 54 HE2 LYS 54 13.440 -3.734 31.302 420 2HE LYS 54 HE1 LYS 54 14.404 -5.034 30.611 421 1HZ LYS 54 HZ1 LYS 54 15.771 -3.152 31.058 422 2HZ LYS 54 HZ2 LYS 54 14.766 -2.135 30.163 423 3HZ LYS 54 HZ3 LYS 54 15.667 -3.319 29.379 424 H GLU 55 HN GLU 55 10.592 -7.877 26.370 425 HA GLU 55 HA GLU 55 12.563 -9.388 27.941 426 1HB GLU 55 HB2 GLU 55 9.906 -10.323 26.878 427 2HB GLU 55 HB1 GLU 55 10.958 -11.208 27.974 428 1HG GLU 55 HG2 GLU 55 9.523 -8.625 28.555 429 2HG GLU 55 HG1 GLU 55 9.123 -10.212 29.191 430 H VAL 56 HN VAL 56 11.992 -8.699 24.726 431 HA VAL 56 HA VAL 56 13.025 -11.281 23.731 432 HB VAL 56 HB VAL 56 11.901 -8.895 22.222 433 1HG1 VAL 56 HG11 VAL 56 13.554 -10.170 20.929 434 2HG1 VAL 56 HG12 VAL 56 11.942 -10.278 20.260 435 3HG1 VAL 56 HG13 VAL 56 12.603 -11.641 21.176 436 1HG2 VAL 56 HG21 VAL 56 10.666 -11.587 22.810 437 2HG2 VAL 56 HG22 VAL 56 9.961 -10.338 21.785 438 3HG2 VAL 56 HG23 VAL 56 10.179 -10.042 23.508 439 H LYS 57 HN LYS 57 15.183 -11.439 23.245 440 HA LYS 57 HA LYS 57 16.562 -8.968 22.596 441 1HB LYS 57 HB2 LYS 57 17.588 -11.445 23.970 442 2HB LYS 57 HB1 LYS 57 18.646 -10.204 23.318 443 1HG LYS 57 HG2 LYS 57 18.457 -9.816 25.663 444 2HG LYS 57 HG1 LYS 57 17.478 -8.586 24.872 445 1HD LYS 57 HD2 LYS 57 15.476 -10.013 25.296 446 2HD LYS 57 HD1 LYS 57 16.509 -11.097 26.226 447 1HE LYS 57 HE2 LYS 57 15.958 -8.191 26.797 448 2HE LYS 57 HE1 LYS 57 15.362 -9.575 27.712 449 1HZ LYS 57 HZ1 LYS 57 17.227 -8.595 28.830 450 2HZ LYS 57 HZ2 LYS 57 18.184 -8.702 27.453 451 3HZ LYS 57 HZ3 LYS 57 17.682 -10.117 28.244 452 H LEU 58 HN LEU 58 17.642 -8.863 20.699 453 HA LEU 58 HA LEU 58 17.422 -11.212 18.960 454 1HB LEU 58 HB2 LEU 58 17.744 -8.288 18.236 455 2HB LEU 58 HB1 LEU 58 17.826 -9.583 17.066 456 HG LEU 58 HG LEU 58 15.678 -8.545 16.883 457 1HD1 LEU 58 HD11 LEU 58 14.165 -10.372 17.301 458 2HD1 LEU 58 HD12 LEU 58 15.368 -11.139 18.330 459 3HD1 LEU 58 HD13 LEU 58 15.687 -10.928 16.606 460 1HD2 LEU 58 HD21 LEU 58 15.539 -7.476 19.065 461 2HD2 LEU 58 HD22 LEU 58 15.316 -9.047 19.831 462 3HD2 LEU 58 HD23 LEU 58 14.084 -8.419 18.733 463 H ILE 59 HN ILE 59 19.143 -12.130 18.024 464 HA ILE 59 HA ILE 59 21.805 -11.048 18.632 465 HB ILE 59 HB ILE 59 20.770 -13.874 18.677 466 1HG1 ILE 59 HG12 ILE 59 20.663 -12.418 20.706 467 2HG1 ILE 59 HG11 ILE 59 21.568 -13.930 20.929 468 1HG2 ILE 59 HG21 ILE 59 23.068 -14.669 18.995 469 2HG2 ILE 59 HG22 ILE 59 23.668 -13.045 18.641 470 3HG2 ILE 59 HG23 ILE 59 22.810 -13.961 17.400 471 1HD1 ILE 59 HD11 ILE 59 23.630 -12.623 20.652 472 2HD1 ILE 59 HD12 ILE 59 22.656 -12.110 22.021 473 3HD1 ILE 59 HD13 ILE 59 22.663 -11.152 20.536 474 H SER 60 HN SER 60 22.988 -10.620 16.975 475 HA SER 60 HA SER 60 22.854 -12.300 14.610 476 1HB SER 60 HB2 SER 60 21.547 -10.218 14.120 477 2HB SER 60 HB1 SER 60 22.969 -9.262 14.549 478 HG SER 60 HG SER 60 23.974 -9.906 12.779 479 H ALA 61 HN ALA 61 24.877 -12.966 14.139 480 HA ALA 61 HA ALA 61 27.114 -13.245 14.207 481 1HB ALA 61 HB1 ALA 61 27.210 -10.248 14.676 482 2HB ALA 61 HB2 ALA 61 27.169 -11.034 13.098 483 3HB ALA 61 HB3 ALA 61 28.562 -11.257 14.155 484 H GLY 62 HN GLY 62 25.471 -13.352 16.629 485 1HA GLY 62 HA2 GLY 62 25.885 -13.997 18.821 486 2HA GLY 62 HA1 GLY 62 27.588 -13.652 18.561 487 H LYS 63 HN LYS 63 25.649 -11.060 17.647 488 HA LYS 63 HA LYS 63 26.316 -9.686 20.132 489 1HB LYS 63 HB2 LYS 63 27.485 -8.828 18.171 490 2HB LYS 63 HB1 LYS 63 25.957 -8.612 17.333 491 1HG LYS 63 HG2 LYS 63 26.802 -6.497 18.149 492 2HG LYS 63 HG1 LYS 63 25.300 -6.917 18.972 493 1HD LYS 63 HD2 LYS 63 26.567 -7.720 20.892 494 2HD LYS 63 HD1 LYS 63 28.083 -7.320 20.086 495 1HE LYS 63 HE2 LYS 63 25.903 -5.405 20.894 496 2HE LYS 63 HE1 LYS 63 27.468 -5.603 21.680 497 1HZ LYS 63 HZ1 LYS 63 28.525 -4.870 19.597 498 2HZ LYS 63 HZ2 LYS 63 27.518 -3.716 20.275 499 3HZ LYS 63 HZ3 LYS 63 26.993 -4.577 18.929 500 H VAL 64 HN VAL 64 24.701 -8.931 21.325 501 HA VAL 64 HA VAL 64 21.962 -9.248 20.599 502 HB VAL 64 HB VAL 64 23.119 -7.516 22.807 503 1HG1 VAL 64 HG11 VAL 64 20.395 -8.760 22.506 504 2HG1 VAL 64 HG12 VAL 64 20.794 -7.054 22.337 505 3HG1 VAL 64 HG13 VAL 64 20.955 -7.844 23.907 506 1HG2 VAL 64 HG21 VAL 64 23.930 -9.816 23.045 507 2HG2 VAL 64 HG22 VAL 64 22.260 -10.402 22.996 508 3HG2 VAL 64 HG23 VAL 64 22.803 -9.391 24.330 509 H LEU 65 HN LEU 65 20.864 -7.888 19.300 510 HA LEU 65 HA LEU 65 21.975 -5.505 18.300 511 1HB LEU 65 HB2 LEU 65 19.237 -6.707 18.063 512 2HB LEU 65 HB1 LEU 65 19.633 -5.163 17.361 513 HG LEU 65 HG LEU 65 21.366 -6.311 15.965 514 1HD1 LEU 65 HD11 LEU 65 20.132 -8.816 17.048 515 2HD1 LEU 65 HD12 LEU 65 21.785 -8.254 17.309 516 3HD1 LEU 65 HD13 LEU 65 21.253 -8.719 15.694 517 1HD2 LEU 65 HD21 LEU 65 18.539 -7.299 15.660 518 2HD2 LEU 65 HD22 LEU 65 19.776 -7.326 14.407 519 3HD2 LEU 65 HD23 LEU 65 19.197 -5.785 15.038 520 H GLU 66 HN GLU 66 21.796 -3.493 18.874 521 HA GLU 66 HA GLU 66 20.429 -2.893 21.360 522 1HB GLU 66 HB2 GLU 66 22.737 -2.120 21.025 523 2HB GLU 66 HB1 GLU 66 22.211 -1.134 19.672 524 1HG GLU 66 HG2 GLU 66 22.514 0.169 21.736 525 2HG GLU 66 HG1 GLU 66 20.854 0.230 21.136 526 H ASN 67 HN ASN 67 18.764 -1.661 21.605 527 HA ASN 67 HA ASN 67 16.752 -1.568 19.662 528 1HB ASN 67 HB2 ASN 67 16.981 0.061 22.188 529 2HB ASN 67 HB1 ASN 67 15.510 -0.192 21.257 530 1HD2 ASN 67 HD21 ASN 67 16.174 -0.858 24.022 531 2HD2 ASN 67 HD22 ASN 67 15.889 -2.549 24.180 532 H SER 68 HN SER 68 19.147 0.777 20.537 533 HA SER 68 HA SER 68 17.863 3.032 19.400 534 1HB SER 68 HB2 SER 68 20.739 2.638 20.169 535 2HB SER 68 HB1 SER 68 19.959 4.185 19.841 536 HG SER 68 HG SER 68 18.424 3.060 21.574 537 H LYS 69 HN LYS 69 19.744 0.561 18.043 538 HA LYS 69 HA LYS 69 20.412 2.268 15.831 539 1HB LYS 69 HB2 LYS 69 21.458 -0.412 16.616 540 2HB LYS 69 HB1 LYS 69 21.851 0.396 15.110 541 1HG LYS 69 HG2 LYS 69 22.677 2.337 16.511 542 2HG LYS 69 HG1 LYS 69 22.504 1.282 17.911 543 1HD LYS 69 HD2 LYS 69 24.240 0.752 15.499 544 2HD LYS 69 HD1 LYS 69 24.806 1.316 17.064 545 1HE LYS 69 HE2 LYS 69 24.055 -0.760 18.092 546 2HE LYS 69 HE1 LYS 69 23.432 -1.310 16.535 547 1HZ LYS 69 HZ1 LYS 69 25.633 -2.244 16.980 548 2HZ LYS 69 HZ2 LYS 69 26.269 -0.698 17.130 549 3HZ LYS 69 HZ3 LYS 69 25.654 -1.211 15.638 550 H THR 70 HN THR 70 20.376 1.243 13.660 551 HA THR 70 HA THR 70 17.759 0.199 13.200 552 HB THR 70 HB THR 70 18.451 0.640 10.843 553 HG1 THR 70 HG1 THR 70 20.538 2.178 11.902 554 1HG2 THR 70 HG21 THR 70 18.259 3.092 11.040 555 2HG2 THR 70 HG22 THR 70 18.598 2.970 12.766 556 3HG2 THR 70 HG23 THR 70 17.121 2.269 12.105 557 H VAL 71 HN VAL 71 17.505 -1.509 11.625 558 HA VAL 71 HA VAL 71 19.056 -3.818 12.185 559 HB VAL 71 HB VAL 71 17.204 -3.305 9.817 560 1HG1 VAL 71 HG11 VAL 71 18.588 -5.259 9.465 561 2HG1 VAL 71 HG12 VAL 71 16.914 -5.737 9.750 562 3HG1 VAL 71 HG13 VAL 71 18.110 -5.913 11.032 563 1HG2 VAL 71 HG21 VAL 71 16.567 -4.479 12.523 564 2HG2 VAL 71 HG22 VAL 71 15.455 -4.391 11.155 565 3HG2 VAL 71 HG23 VAL 71 16.039 -2.910 11.912 566 H LYS 72 HN LYS 72 19.138 -1.329 9.841 567 HA LYS 72 HA LYS 72 20.740 -2.230 7.782 568 1HB LYS 72 HB2 LYS 72 19.441 -0.126 7.948 569 2HB LYS 72 HB1 LYS 72 20.664 0.505 9.024 570 1HG LYS 72 HG2 LYS 72 22.306 0.314 7.200 571 2HG LYS 72 HG1 LYS 72 21.006 -0.256 6.148 572 1HD LYS 72 HD2 LYS 72 19.753 1.816 6.614 573 2HD LYS 72 HD1 LYS 72 21.131 2.411 7.535 574 1HE LYS 72 HE2 LYS 72 21.114 3.322 5.276 575 2HE LYS 72 HE1 LYS 72 22.517 2.279 5.529 576 1HZ LYS 72 HZ1 LYS 72 21.493 0.554 4.338 577 2HZ LYS 72 HZ2 LYS 72 21.306 1.936 3.378 578 3HZ LYS 72 HZ3 LYS 72 20.007 1.327 4.311 579 H ASP 73 HN ASP 73 21.600 -1.055 10.991 580 HA ASP 73 HA ASP 73 24.339 -0.539 10.492 581 1HB ASP 73 HB2 ASP 73 23.102 0.406 12.426 582 2HB ASP 73 HB1 ASP 73 23.011 -1.200 13.133 583 H TYR 74 HN TYR 74 22.590 -3.423 11.319 584 HA TYR 74 HA TYR 74 25.023 -4.905 11.860 585 1HB TYR 74 HB2 TYR 74 22.100 -5.655 11.985 586 2HB TYR 74 HB1 TYR 74 23.418 -6.757 12.355 587 HD1 TYR 74 HD1 TYR 74 21.783 -3.599 13.413 588 HD2 TYR 74 HD2 TYR 74 24.452 -6.732 14.493 589 HE1 TYR 74 HE1 TYR 74 21.804 -2.772 15.724 590 HE2 TYR 74 HE2 TYR 74 24.483 -5.906 16.816 591 HH TYR 74 HH TYR 74 24.041 -3.885 18.087 592 H ARG 75 HN ARG 75 23.011 -4.142 9.241 593 HA ARG 75 HA ARG 75 23.594 -6.492 7.691 594 1HB ARG 75 HB2 ARG 75 21.804 -4.163 7.594 595 2HB ARG 75 HB1 ARG 75 22.332 -4.801 6.062 596 1HG ARG 75 HG2 ARG 75 20.119 -5.621 6.799 597 2HG ARG 75 HG1 ARG 75 21.298 -6.906 6.532 598 1HD ARG 75 HD2 ARG 75 20.681 -5.786 9.249 599 2HD ARG 75 HD1 ARG 75 19.729 -7.089 8.541 600 HE ARG 75 HE ARG 75 22.484 -7.706 8.476 601 1HH1 ARG 75 HH11 ARG 75 19.787 -7.489 10.716 602 2HH1 ARG 75 HH12 ARG 75 20.367 -8.688 11.782 603 1HH2 ARG 75 HH21 ARG 75 23.299 -9.295 9.850 604 2HH2 ARG 75 HH22 ARG 75 22.507 -9.749 11.286 605 H SER 76 HN SER 76 23.978 -5.743 5.320 606 HA SER 76 HA SER 76 26.432 -4.219 5.187 607 1HB SER 76 HB2 SER 76 26.248 -6.425 4.054 608 2HB SER 76 HB1 SER 76 24.875 -5.830 3.136 609 HG SER 76 HG SER 76 26.171 -4.683 1.876 610 HA PRO 77 HA PRO 77 24.271 -0.572 3.669 611 1HB PRO 77 HB2 PRO 77 26.110 0.272 1.789 612 2HB PRO 77 HB1 PRO 77 26.244 0.596 3.521 613 1HG PRO 77 HG2 PRO 77 27.550 -1.546 1.890 614 2HG PRO 77 HG1 PRO 77 28.244 -0.539 3.173 615 1HD PRO 77 HD2 PRO 77 27.514 -3.056 3.644 616 2HD PRO 77 HD1 PRO 77 27.250 -1.785 4.857 617 H VAL 78 HN VAL 78 23.647 0.423 1.444 618 HA VAL 78 HA VAL 78 22.353 -1.644 -0.033 619 HB VAL 78 HB VAL 78 22.574 1.251 -0.764 620 1HG1 VAL 78 HG11 VAL 78 20.445 0.880 -2.003 621 2HG1 VAL 78 HG12 VAL 78 20.539 -0.828 -1.582 622 3HG1 VAL 78 HG13 VAL 78 21.772 -0.107 -2.616 623 1HG2 VAL 78 HG21 VAL 78 20.408 1.585 0.352 624 2HG2 VAL 78 HG22 VAL 78 21.652 1.037 1.480 625 3HG2 VAL 78 HG23 VAL 78 20.440 -0.095 0.881 626 H SER 79 HN SER 79 25.125 0.163 -0.408 627 HA SER 79 HA SER 79 25.709 -0.650 -3.104 628 1HB SER 79 HB2 SER 79 26.691 1.438 -2.100 629 2HB SER 79 HB1 SER 79 27.620 0.430 -0.996 630 HG SER 79 HG SER 79 28.159 1.151 -3.507 631 H ASN 80 HN ASN 80 25.932 -2.712 -3.472 632 HA ASN 80 HA ASN 80 26.426 -4.878 -3.383 633 1HB ASN 80 HB2 ASN 80 28.823 -4.231 -3.183 634 2HB ASN 80 HB1 ASN 80 28.648 -4.116 -1.437 635 1HD2 ASN 80 HD21 ASN 80 28.553 -6.012 -0.227 636 2HD2 ASN 80 HD22 ASN 80 28.978 -7.556 -0.860 637 H LEU 81 HN LEU 81 24.400 -5.194 -2.566 638 HA LEU 81 HA LEU 81 24.274 -5.714 0.285 639 1HB LEU 81 HB2 LEU 81 22.914 -3.950 -0.397 640 2HB LEU 81 HB1 LEU 81 22.212 -4.906 -1.716 641 HG LEU 81 HG LEU 81 21.200 -6.301 0.076 642 1HD1 LEU 81 HD11 LEU 81 21.047 -5.332 2.354 643 2HD1 LEU 81 HD12 LEU 81 22.194 -4.081 1.873 644 3HD1 LEU 81 HD13 LEU 81 22.694 -5.770 1.912 645 1HD2 LEU 81 HD21 LEU 81 19.874 -4.645 -1.051 646 2HD2 LEU 81 HD22 LEU 81 20.455 -3.385 0.029 647 3HD2 LEU 81 HD23 LEU 81 19.426 -4.677 0.652 648 H ALA 82 HN ALA 82 22.500 -7.296 0.642 649 HA ALA 82 HA ALA 82 22.351 -9.364 -1.301 650 1HB ALA 82 HB1 ALA 82 23.020 -11.139 0.289 651 2HB ALA 82 HB2 ALA 82 23.399 -9.897 1.482 652 3HB ALA 82 HB3 ALA 82 24.327 -9.994 -0.015 653 H GLY 83 HN GLY 83 20.204 -9.327 -1.485 654 1HA GLY 83 HA2 GLY 83 18.449 -8.928 0.795 655 2HA GLY 83 HA1 GLY 83 17.961 -9.113 -0.883 656 H ALA 84 HN ALA 84 19.875 -11.119 1.196 657 HA ALA 84 HA ALA 84 18.470 -13.506 0.390 658 1HB ALA 84 HB1 ALA 84 20.913 -13.541 0.603 659 2HB ALA 84 HB2 ALA 84 20.166 -14.669 1.733 660 3HB ALA 84 HB3 ALA 84 20.770 -13.116 2.307 661 H VAL 85 HN VAL 85 17.554 -14.976 1.991 662 HA VAL 85 HA VAL 85 16.079 -13.450 3.953 663 HB VAL 85 HB VAL 85 16.028 -16.420 3.413 664 1HG1 VAL 85 HG11 VAL 85 13.824 -16.364 4.516 665 2HG1 VAL 85 HG12 VAL 85 14.053 -14.643 4.841 666 3HG1 VAL 85 HG13 VAL 85 15.122 -15.829 5.587 667 1HG2 VAL 85 HG21 VAL 85 14.222 -14.273 2.291 668 2HG2 VAL 85 HG22 VAL 85 13.992 -16.007 2.082 669 3HG2 VAL 85 HG23 VAL 85 15.410 -15.216 1.390 670 H THR 86 HN THR 86 16.693 -13.278 5.880 671 HA THR 86 HA THR 86 19.116 -14.701 6.760 672 HB THR 86 HB THR 86 18.115 -11.938 7.475 673 HG1 THR 86 HG1 THR 86 18.718 -12.179 5.250 674 1HG2 THR 86 HG21 THR 86 19.631 -12.952 9.152 675 2HG2 THR 86 HG22 THR 86 20.405 -11.605 8.317 676 3HG2 THR 86 HG23 THR 86 20.813 -13.262 7.879 677 H THR 87 HN THR 87 18.976 -15.714 8.774 678 HA THR 87 HA THR 87 16.624 -15.000 10.284 679 HB THR 87 HB THR 87 16.407 -17.242 9.493 680 HG1 THR 87 HG1 THR 87 15.872 -16.612 11.772 681 1HG2 THR 87 HG21 THR 87 17.864 -19.038 10.178 682 2HG2 THR 87 HG22 THR 87 18.952 -17.869 10.953 683 3HG2 THR 87 HG23 THR 87 18.718 -17.847 9.190 684 H MET 88 HN MET 88 16.893 -14.118 12.113 685 HA MET 88 HA MET 88 19.566 -14.136 13.278 686 1HB MET 88 HB2 MET 88 17.283 -12.226 13.824 687 2HB MET 88 HB1 MET 88 18.867 -12.150 14.574 688 1HG MET 88 HG2 MET 88 19.838 -11.814 12.297 689 2HG MET 88 HG1 MET 88 18.194 -11.692 11.679 690 1HE MET 88 HE1 MET 88 16.830 -10.147 14.246 691 2HE MET 88 HE2 MET 88 16.445 -9.753 12.568 692 3HE MET 88 HE3 MET 88 16.952 -8.486 13.674 693 H HIS 89 HN HIS 89 19.843 -14.623 15.375 694 HA HIS 89 HA HIS 89 17.845 -16.475 16.349 695 1HB HIS 89 HB2 HIS 89 20.648 -15.879 17.319 696 2HB HIS 89 HB1 HIS 89 19.574 -17.045 18.083 697 HD1 HIS 89 HD1 HIS 89 20.035 -19.356 17.349 698 HD2 HIS 89 HD2 HIS 89 20.910 -16.615 14.364 699 HE1 HIS 89 HE1 HIS 89 20.899 -20.708 15.420 700 HE2 HIS 89 HE2 HIS 89 21.034 -19.044 13.557 701 H VAL 90 HN VAL 90 16.798 -16.303 18.268 702 HA VAL 90 HA VAL 90 16.829 -13.621 19.528 703 HB VAL 90 HB VAL 90 14.515 -15.558 19.303 704 1HG1 VAL 90 HG11 VAL 90 14.596 -12.666 20.119 705 2HG1 VAL 90 HG12 VAL 90 14.386 -14.048 21.189 706 3HG1 VAL 90 HG13 VAL 90 13.142 -13.657 19.998 707 1HG2 VAL 90 HG21 VAL 90 15.030 -13.129 17.591 708 2HG2 VAL 90 HG22 VAL 90 13.523 -14.035 17.641 709 3HG2 VAL 90 HG23 VAL 90 14.999 -14.811 17.057 710 H ILE 91 HN ILE 91 17.033 -13.524 21.503 711 HA ILE 91 HA ILE 91 17.450 -16.006 22.945 712 HB ILE 91 HB ILE 91 18.235 -13.197 23.351 713 1HG1 ILE 91 HG12 ILE 91 19.814 -15.742 23.091 714 2HG1 ILE 91 HG11 ILE 91 19.703 -14.408 21.948 715 1HG2 ILE 91 HG21 ILE 91 18.551 -15.456 25.391 716 2HG2 ILE 91 HG22 ILE 91 17.520 -14.038 25.565 717 3HG2 ILE 91 HG23 ILE 91 19.276 -13.853 25.573 718 1HD1 ILE 91 HD11 ILE 91 20.888 -12.969 23.513 719 2HD1 ILE 91 HD12 ILE 91 21.823 -14.412 23.101 720 3HD1 ILE 91 HD13 ILE 91 21.002 -14.309 24.661 721 H ILE 92 HN ILE 92 15.903 -16.729 23.960 722 HA ILE 92 HA ILE 92 13.667 -15.081 24.673 723 HB ILE 92 HB ILE 92 14.056 -18.065 24.484 724 1HG1 ILE 92 HG12 ILE 92 12.086 -17.958 23.000 725 2HG1 ILE 92 HG11 ILE 92 11.979 -16.228 23.284 726 1HG2 ILE 92 HG21 ILE 92 11.682 -16.738 25.748 727 2HG2 ILE 92 HG22 ILE 92 12.885 -17.727 26.570 728 3HG2 ILE 92 HG23 ILE 92 11.826 -18.455 25.358 729 1HD1 ILE 92 HD11 ILE 92 14.097 -15.920 22.176 730 2HD1 ILE 92 HD12 ILE 92 12.939 -16.720 21.119 731 3HD1 ILE 92 HD13 ILE 92 14.235 -17.654 21.887 732 H GLN 93 HN GLN 93 14.009 -13.998 26.444 733 HA GLN 93 HA GLN 93 14.639 -15.577 28.804 734 1HB GLN 93 HB2 GLN 93 15.011 -12.607 28.339 735 2HB GLN 93 HB1 GLN 93 15.249 -13.418 29.883 736 1HG GLN 93 HG2 GLN 93 17.033 -14.765 28.877 737 2HG GLN 93 HG1 GLN 93 16.806 -13.890 27.364 738 1HE2 GLN 93 HE21 GLN 93 17.910 -13.712 30.606 739 2HE2 GLN 93 HE22 GLN 93 18.796 -12.241 30.456 740 H ALA 94 HN ALA 94 12.914 -16.050 29.779 741 HA ALA 94 HA ALA 94 10.435 -14.872 29.101 742 1HB ALA 94 HB1 ALA 94 10.665 -17.252 29.524 743 2HB ALA 94 HB2 ALA 94 9.479 -16.525 30.606 744 3HB ALA 94 HB3 ALA 94 11.092 -16.919 31.201 745 HA PRO 95 HA PRO 95 9.870 -11.964 32.615 746 1HB PRO 95 HB2 PRO 95 7.071 -12.766 32.485 747 2HB PRO 95 HB1 PRO 95 7.768 -11.188 32.123 748 1HG PRO 95 HG2 PRO 95 6.683 -12.723 30.230 749 2HG PRO 95 HG1 PRO 95 8.094 -11.711 29.897 750 1HD PRO 95 HD2 PRO 95 7.935 -14.640 30.413 751 2HD PRO 95 HD1 PRO 95 8.908 -13.735 29.232 752 H VAL 96 HN VAL 96 7.958 -12.210 34.372 753 HA VAL 96 HA VAL 96 8.893 -14.125 36.209 754 HB VAL 96 HB VAL 96 6.198 -12.769 36.199 755 1HG1 VAL 96 HG11 VAL 96 6.141 -14.757 37.645 756 2HG1 VAL 96 HG12 VAL 96 6.124 -13.292 38.632 757 3HG1 VAL 96 HG13 VAL 96 7.611 -14.222 38.457 758 1HG2 VAL 96 HG21 VAL 96 8.740 -12.090 37.663 759 2HG2 VAL 96 HG22 VAL 96 7.208 -11.240 37.846 760 3HG2 VAL 96 HG23 VAL 96 8.060 -11.200 36.304 761 H THR 97 HN THR 97 6.345 -14.311 33.802 762 HA THR 97 HA THR 97 5.593 -16.932 34.545 763 HB THR 97 HB THR 97 3.988 -15.656 33.209 764 HG1 THR 97 HG1 THR 97 3.860 -17.868 32.864 765 1HG2 THR 97 HG21 THR 97 5.536 -14.275 31.867 766 2HG2 THR 97 HG22 THR 97 4.371 -15.097 30.833 767 3HG2 THR 97 HG23 THR 97 6.017 -15.709 30.959 768 H GLU 98 HN GLU 98 7.263 -18.124 34.832 769 HA GLU 98 HA GLU 98 8.443 -19.493 32.636 770 1HB GLU 98 HB2 GLU 98 9.947 -17.454 32.981 771 2HB GLU 98 HB1 GLU 98 10.193 -17.975 34.624 772 1HG GLU 98 HG2 GLU 98 11.054 -19.520 32.169 773 2HG GLU 98 HG1 GLU 98 12.091 -18.465 33.112 774 H LYS 99 HN LYS 99 7.945 -21.495 33.407 775 HA LYS 99 HA LYS 99 8.113 -21.901 36.205 776 1HB LYS 99 HB2 LYS 99 5.937 -20.900 35.748 777 2HB LYS 99 HB1 LYS 99 5.590 -22.138 34.567 778 1HG LYS 99 HG2 LYS 99 5.563 -23.786 36.359 779 2HG LYS 99 HG1 LYS 99 5.847 -22.511 37.547 780 1HD LYS 99 HD2 LYS 99 3.791 -21.397 36.835 781 2HD LYS 99 HD1 LYS 99 3.512 -22.662 35.643 782 1HE LYS 99 HE2 LYS 99 3.377 -24.311 37.468 783 2HE LYS 99 HE1 LYS 99 3.611 -23.007 38.632 784 1HZ LYS 99 HZ1 LYS 99 1.555 -21.990 37.833 785 2HZ LYS 99 HZ2 LYS 99 1.267 -23.533 38.411 786 3HZ LYS 99 HZ3 LYS 99 1.314 -23.252 36.750 787 H GLU 100 HN GLU 100 7.324 -24.302 36.582 788 HA GLU 100 HA GLU 100 9.039 -26.158 35.859 789 1HB GLU 100 HB2 GLU 100 7.371 -27.878 36.421 790 2HB GLU 100 HB1 GLU 100 7.406 -26.539 37.560 791 1HG GLU 100 HG2 GLU 100 5.408 -25.592 36.394 792 2HG GLU 100 HG1 GLU 100 5.371 -27.035 35.398 793 H LYS 101 HN LYS 101 6.181 -25.567 33.814 794 HA LYS 101 HA LYS 101 7.448 -27.319 31.843 795 1HB LYS 101 HB2 LYS 101 5.444 -28.419 32.707 796 2HB LYS 101 HB1 LYS 101 4.481 -26.992 32.356 797 1HG LYS 101 HG2 LYS 101 4.097 -28.716 30.685 798 2HG LYS 101 HG1 LYS 101 4.882 -27.314 29.961 799 1HD LYS 101 HD2 LYS 101 7.044 -28.480 30.079 800 2HD LYS 101 HD1 LYS 101 6.242 -29.885 30.784 801 1HE LYS 101 HE2 LYS 101 4.880 -30.115 28.774 802 2HE LYS 101 HE1 LYS 101 5.663 -28.704 28.074 803 1HZ LYS 101 HZ1 LYS 101 6.981 -31.277 28.762 804 2HZ LYS 101 HZ2 LYS 101 7.787 -29.939 28.168 805 3HZ LYS 101 HZ3 LYS 101 6.638 -30.715 27.212 Start of MODEL 13 1 H GLU 1 HT1 GLU 1 3.269 -12.711 7.321 2 HA GLU 1 HA GLU 1 4.340 -14.147 5.745 3 1HB GLU 1 HB2 GLU 1 1.742 -14.007 4.202 4 2HB GLU 1 HB1 GLU 1 3.173 -14.951 3.817 5 1HG GLU 1 HG2 GLU 1 1.223 -15.428 6.060 6 2HG GLU 1 HG1 GLU 1 1.471 -16.424 4.632 7 H ALA 2 HN ALA 2 5.632 -12.804 4.572 8 HA ALA 2 HA ALA 2 4.461 -10.622 3.108 9 1HB ALA 2 HB1 ALA 2 5.669 -8.853 4.252 10 2HB ALA 2 HB2 ALA 2 6.312 -10.020 5.408 11 3HB ALA 2 HB3 ALA 2 4.581 -9.689 5.359 12 H GLU 3 HN GLU 3 5.441 -11.040 1.228 13 HA GLU 3 HA GLU 3 8.286 -10.937 1.246 14 1HB GLU 3 HB2 GLU 3 6.531 -12.540 -0.632 15 2HB GLU 3 HB1 GLU 3 8.266 -12.353 -0.816 16 1HG GLU 3 HG2 GLU 3 8.632 -13.508 1.290 17 2HG GLU 3 HG1 GLU 3 6.889 -13.649 1.521 18 H VAL 4 HN VAL 4 8.520 -8.825 0.704 19 HA VAL 4 HA VAL 4 7.031 -7.774 -1.623 20 HB VAL 4 HB VAL 4 7.859 -6.224 0.831 21 1HG1 VAL 4 HG11 VAL 4 6.060 -5.421 -1.428 22 2HG1 VAL 4 HG12 VAL 4 7.700 -4.849 -1.136 23 3HG1 VAL 4 HG13 VAL 4 6.409 -4.444 -0.002 24 1HG2 VAL 4 HG21 VAL 4 6.119 -7.781 1.504 25 2HG2 VAL 4 HG22 VAL 4 5.097 -7.254 0.168 26 3HG2 VAL 4 HG23 VAL 4 5.476 -6.140 1.482 27 H HIS 5 HN HIS 5 8.300 -6.535 -2.993 28 HA HIS 5 HA HIS 5 11.116 -6.516 -2.273 29 1HB HIS 5 HB2 HIS 5 11.745 -6.123 -4.646 30 2HB HIS 5 HB1 HIS 5 10.800 -7.584 -4.464 31 HD1 HIS 5 HD1 HIS 5 10.911 -4.330 -6.212 32 HD2 HIS 5 HD2 HIS 5 8.162 -7.393 -5.659 33 HE1 HIS 5 HE1 HIS 5 9.158 -3.980 -7.948 34 HE2 HIS 5 HE2 HIS 5 7.393 -5.665 -7.421 35 H ASN 6 HN ASN 6 10.975 -4.981 -0.837 36 HA ASN 6 HA ASN 6 11.543 -2.335 -1.659 37 1HB ASN 6 HB2 ASN 6 9.107 -2.178 -2.000 38 2HB ASN 6 HB1 ASN 6 8.832 -2.775 -0.368 39 1HD2 ASN 6 HD21 ASN 6 9.932 -0.101 -2.280 40 2HD2 ASN 6 HD22 ASN 6 9.830 1.092 -1.044 41 H GLN 7 HN GLN 7 10.140 -4.251 0.926 42 HA GLN 7 HA GLN 7 12.042 -3.108 2.777 43 1HB GLN 7 HB2 GLN 7 9.617 -4.849 3.146 44 2HB GLN 7 HB1 GLN 7 10.654 -4.322 4.468 45 1HG GLN 7 HG2 GLN 7 10.057 -1.998 3.999 46 2HG GLN 7 HG1 GLN 7 9.045 -2.526 2.658 47 1HE2 GLN 7 HE21 GLN 7 7.192 -1.620 3.589 48 2HE2 GLN 7 HE22 GLN 7 6.428 -2.322 4.950 49 H LEU 8 HN LEU 8 13.057 -4.812 4.242 50 HA LEU 8 HA LEU 8 13.882 -7.028 2.516 51 1HB LEU 8 HB2 LEU 8 15.336 -5.604 4.717 52 2HB LEU 8 HB1 LEU 8 15.905 -7.069 3.986 53 HG LEU 8 HG LEU 8 16.142 -5.881 1.805 54 1HD1 LEU 8 HD11 LEU 8 14.497 -4.111 2.086 55 2HD1 LEU 8 HD12 LEU 8 16.087 -3.441 1.715 56 3HD1 LEU 8 HD13 LEU 8 15.474 -3.392 3.366 57 1HD2 LEU 8 HD21 LEU 8 18.034 -6.121 3.289 58 2HD2 LEU 8 HD22 LEU 8 17.606 -4.613 4.100 59 3HD2 LEU 8 HD23 LEU 8 18.106 -4.597 2.406 60 H GLU 9 HN GLU 9 13.888 -9.104 3.338 61 HA GLU 9 HA GLU 9 12.070 -9.373 5.555 62 1HB GLU 9 HB2 GLU 9 13.134 -11.551 3.765 63 2HB GLU 9 HB1 GLU 9 11.900 -11.701 4.988 64 1HG GLU 9 HG2 GLU 9 10.687 -11.646 3.013 65 2HG GLU 9 HG1 GLU 9 10.591 -9.983 3.575 66 H ILE 10 HN ILE 10 12.358 -10.386 7.357 67 HA ILE 10 HA ILE 10 15.004 -11.499 7.991 68 HB ILE 10 HB ILE 10 13.183 -9.947 9.891 69 1HG1 ILE 10 HG12 ILE 10 15.928 -9.236 8.836 70 2HG1 ILE 10 HG11 ILE 10 14.442 -8.497 8.284 71 1HG2 ILE 10 HG21 ILE 10 14.963 -10.194 11.529 72 2HG2 ILE 10 HG22 ILE 10 15.865 -11.208 10.396 73 3HG2 ILE 10 HG23 ILE 10 14.309 -11.756 11.027 74 1HD1 ILE 10 HD11 ILE 10 15.614 -7.075 9.849 75 2HD1 ILE 10 HD12 ILE 10 15.572 -8.350 11.071 76 3HD1 ILE 10 HD13 ILE 10 14.074 -7.596 10.529 77 H LYS 11 HN LYS 11 14.893 -13.449 8.894 78 HA LYS 11 HA LYS 11 12.285 -14.294 9.877 79 1HB LYS 11 HB2 LYS 11 12.756 -16.646 9.368 80 2HB LYS 11 HB1 LYS 11 12.780 -15.673 7.915 81 1HG LYS 11 HG2 LYS 11 15.081 -15.924 7.642 82 2HG LYS 11 HG1 LYS 11 15.323 -16.359 9.338 83 1HD LYS 11 HD2 LYS 11 15.523 -18.318 7.846 84 2HD LYS 11 HD1 LYS 11 14.199 -18.486 8.992 85 1HE LYS 11 HE2 LYS 11 12.648 -17.730 7.181 86 2HE LYS 11 HE1 LYS 11 14.012 -17.778 6.061 87 1HZ LYS 11 HZ1 LYS 11 12.775 -19.824 5.917 88 2HZ LYS 11 HZ2 LYS 11 12.834 -20.044 7.568 89 3HZ LYS 11 HZ3 LYS 11 14.256 -20.168 6.649 90 H PHE 12 HN PHE 12 12.279 -15.447 11.795 91 HA PHE 12 HA PHE 12 14.724 -15.037 13.351 92 1HB PHE 12 HB2 PHE 12 11.891 -15.480 14.303 93 2HB PHE 12 HB1 PHE 12 13.275 -15.046 15.298 94 HD1 PHE 12 HD1 PHE 12 14.462 -12.828 14.684 95 HD2 PHE 12 HD2 PHE 12 10.499 -13.815 13.503 96 HE1 PHE 12 HE1 PHE 12 13.972 -10.448 14.350 97 HE2 PHE 12 HE2 PHE 12 10.000 -11.437 13.165 98 HZ PHE 12 HZ PHE 12 11.746 -9.741 13.590 99 H ARG 13 HN ARG 13 15.851 -16.834 13.858 100 HA ARG 13 HA ARG 13 14.299 -19.306 13.907 101 1HB ARG 13 HB2 ARG 13 15.893 -19.215 11.963 102 2HB ARG 13 HB1 ARG 13 17.217 -19.179 13.127 103 1HG ARG 13 HG2 ARG 13 16.607 -21.334 13.981 104 2HG ARG 13 HG1 ARG 13 15.157 -21.371 12.994 105 1HD ARG 13 HD2 ARG 13 16.681 -21.262 10.976 106 2HD ARG 13 HD1 ARG 13 18.026 -21.543 12.088 107 HE ARG 13 HE ARG 13 16.240 -23.505 12.677 108 1HH1 ARG 13 HH11 ARG 13 17.998 -22.595 9.727 109 2HH1 ARG 13 HH12 ARG 13 17.843 -24.140 9.036 110 1HH2 ARG 13 HH21 ARG 13 16.060 -25.582 11.709 111 2HH2 ARG 13 HH22 ARG 13 16.742 -25.869 10.167 112 H LEU 14 HN LEU 14 14.123 -20.197 15.692 113 HA LEU 14 HA LEU 14 15.414 -19.250 18.038 114 1HB LEU 14 HB2 LEU 14 13.625 -21.637 17.554 115 2HB LEU 14 HB1 LEU 14 14.201 -21.178 19.131 116 HG LEU 14 HG LEU 14 12.909 -19.035 18.915 117 1HD1 LEU 14 HD11 LEU 14 11.175 -18.841 17.214 118 2HD1 LEU 14 HD12 LEU 14 11.784 -20.296 16.421 119 3HD1 LEU 14 HD13 LEU 14 12.788 -18.848 16.501 120 1HD2 LEU 14 HD21 LEU 14 11.328 -21.581 18.623 121 2HD2 LEU 14 HD22 LEU 14 10.717 -20.062 19.275 122 3HD2 LEU 14 HD23 LEU 14 11.996 -20.932 20.119 123 H THR 15 HN THR 15 16.735 -20.430 19.438 124 HA THR 15 HA THR 15 18.885 -21.829 18.336 125 HB THR 15 HB THR 15 18.954 -20.627 20.402 126 HG1 THR 15 HG1 THR 15 19.507 -23.411 20.812 127 1HG2 THR 15 HG21 THR 15 16.811 -21.147 21.364 128 2HG2 THR 15 HG22 THR 15 18.066 -21.595 22.521 129 3HG2 THR 15 HG23 THR 15 17.263 -22.839 21.563 130 H ASP 16 HN ASP 16 15.874 -22.839 19.169 131 HA ASP 16 HA ASP 16 16.371 -25.641 19.649 132 1HB ASP 16 HB2 ASP 16 13.801 -24.184 19.014 133 2HB ASP 16 HB1 ASP 16 13.883 -25.895 19.409 134 H GLY 17 HN GLY 17 16.425 -23.784 16.874 135 1HA GLY 17 HA2 GLY 17 17.135 -24.647 14.817 136 2HA GLY 17 HA1 GLY 17 16.487 -26.212 15.275 137 H SER 18 HN SER 18 14.217 -23.947 15.995 138 HA SER 18 HA SER 18 12.752 -24.538 13.518 139 1HB SER 18 HB2 SER 18 11.741 -23.509 16.178 140 2HB SER 18 HB1 SER 18 10.757 -24.068 14.823 141 HG SER 18 HG SER 18 11.271 -25.547 16.674 142 H ASP 19 HN ASP 19 11.955 -22.783 12.203 143 HA ASP 19 HA ASP 19 12.818 -20.164 13.119 144 1HB ASP 19 HB2 ASP 19 13.209 -19.559 10.879 145 2HB ASP 19 HB1 ASP 19 14.084 -21.061 11.142 146 H ILE 20 HN ILE 20 11.629 -18.449 12.281 147 HA ILE 20 HA ILE 20 8.764 -18.985 11.975 148 HB ILE 20 HB ILE 20 10.260 -16.455 12.781 149 1HG1 ILE 20 HG12 ILE 20 8.538 -18.313 14.447 150 2HG1 ILE 20 HG11 ILE 20 10.288 -18.168 14.543 151 1HG2 ILE 20 HG21 ILE 20 8.058 -15.486 13.282 152 2HG2 ILE 20 HG22 ILE 20 7.285 -16.938 12.641 153 3HG2 ILE 20 HG23 ILE 20 8.223 -15.896 11.573 154 1HD1 ILE 20 HD11 ILE 20 9.198 -16.999 16.378 155 2HD1 ILE 20 HD12 ILE 20 8.290 -16.016 15.232 156 3HD1 ILE 20 HD13 ILE 20 10.042 -15.857 15.332 157 H GLY 21 HN GLY 21 7.745 -18.189 10.151 158 1HA GLY 21 HA2 GLY 21 9.136 -18.013 7.772 159 2HA GLY 21 HA1 GLY 21 7.496 -17.428 8.025 160 HA PRO 22 HA PRO 22 10.909 -14.023 7.852 161 1HB PRO 22 HB2 PRO 22 11.130 -13.547 5.186 162 2HB PRO 22 HB1 PRO 22 12.240 -14.558 6.107 163 1HG PRO 22 HG2 PRO 22 9.994 -15.359 4.311 164 2HG PRO 22 HG1 PRO 22 11.556 -16.152 4.574 165 1HD PRO 22 HD2 PRO 22 9.207 -17.008 5.685 166 2HD PRO 22 HD1 PRO 22 10.800 -17.298 6.411 167 H LYS 23 HN LYS 23 10.273 -12.073 7.930 168 HA LYS 23 HA LYS 23 7.750 -11.265 6.633 169 1HB LYS 23 HB2 LYS 23 7.634 -11.664 9.142 170 2HB LYS 23 HB1 LYS 23 8.829 -10.401 9.337 171 1HG LYS 23 HG2 LYS 23 7.218 -8.783 8.365 172 2HG LYS 23 HG1 LYS 23 6.016 -10.076 8.280 173 1HD LYS 23 HD2 LYS 23 6.236 -10.407 10.725 174 2HD LYS 23 HD1 LYS 23 7.375 -9.069 10.783 175 1HE LYS 23 HE2 LYS 23 5.248 -8.254 11.496 176 2HE LYS 23 HE1 LYS 23 5.560 -7.592 9.898 177 1HZ LYS 23 HZ1 LYS 23 3.299 -8.344 10.105 178 2HZ LYS 23 HZ2 LYS 23 3.782 -9.880 10.544 179 3HZ LYS 23 HZ3 LYS 23 4.090 -9.316 8.974 180 H ALA 24 HN ALA 24 7.818 -8.956 6.018 181 HA ALA 24 HA ALA 24 10.543 -8.206 5.393 182 1HB ALA 24 HB1 ALA 24 9.586 -6.635 3.845 183 2HB ALA 24 HB2 ALA 24 7.965 -6.963 4.466 184 3HB ALA 24 HB3 ALA 24 8.855 -8.222 3.611 185 H PHE 25 HN PHE 25 11.657 -6.645 6.348 186 HA PHE 25 HA PHE 25 10.240 -4.727 8.072 187 1HB PHE 25 HB2 PHE 25 12.954 -5.966 8.565 188 2HB PHE 25 HB1 PHE 25 12.141 -4.800 9.590 189 HD1 PHE 25 HD1 PHE 25 10.571 -5.535 11.236 190 HD2 PHE 25 HD2 PHE 25 12.111 -8.235 8.352 191 HE1 PHE 25 HE1 PHE 25 9.680 -7.439 12.522 192 HE2 PHE 25 HE2 PHE 25 11.223 -10.117 9.617 193 HZ PHE 25 HZ PHE 25 10.054 -9.773 11.650 194 HA PRO 26 HA PRO 26 12.706 -1.877 5.573 195 1HB PRO 26 HB2 PRO 26 12.027 -0.027 7.774 196 2HB PRO 26 HB1 PRO 26 11.748 0.197 6.055 197 1HG PRO 26 HG2 PRO 26 9.716 -0.320 7.690 198 2HG PRO 26 HG1 PRO 26 9.787 -1.103 6.098 199 1HD PRO 26 HD2 PRO 26 10.501 -2.227 8.787 200 2HD PRO 26 HD1 PRO 26 9.583 -2.965 7.450 201 H ASP 27 HN ASP 27 14.794 -0.992 5.843 202 HA ASP 27 HA ASP 27 16.363 -1.992 7.999 203 1HB ASP 27 HB2 ASP 27 17.046 0.006 5.843 204 2HB ASP 27 HB1 ASP 27 18.203 -0.599 7.016 205 H ALA 28 HN ALA 28 14.642 0.888 7.459 206 HA ALA 28 HA ALA 28 16.087 2.501 9.338 207 1HB ALA 28 HB1 ALA 28 13.406 2.931 8.059 208 2HB ALA 28 HB2 ALA 28 14.952 3.462 7.409 209 3HB ALA 28 HB3 ALA 28 14.347 4.143 8.925 210 H THR 29 HN THR 29 13.956 -0.008 9.738 211 HA THR 29 HA THR 29 12.436 1.051 11.919 212 HB THR 29 HB THR 29 12.835 -1.774 10.903 213 HG1 THR 29 HG1 THR 29 11.441 0.313 9.990 214 1HG2 THR 29 HG21 THR 29 12.092 -1.767 13.259 215 2HG2 THR 29 HG22 THR 29 10.811 -2.336 12.188 216 3HG2 THR 29 HG23 THR 29 10.760 -0.693 12.831 217 H THR 30 HN THR 30 12.911 0.812 14.104 218 HA THR 30 HA THR 30 15.628 0.168 14.629 219 HB THR 30 HB THR 30 15.097 0.853 16.974 220 HG1 THR 30 HG1 THR 30 13.046 0.880 17.473 221 1HG2 THR 30 HG21 THR 30 14.314 2.788 14.788 222 2HG2 THR 30 HG22 THR 30 15.956 2.465 15.352 223 3HG2 THR 30 HG23 THR 30 14.785 3.229 16.426 224 H VAL 31 HN VAL 31 16.315 -1.292 16.354 225 HA VAL 31 HA VAL 31 15.267 -3.871 16.021 226 HB VAL 31 HB VAL 31 17.073 -2.844 18.232 227 1HG1 VAL 31 HG11 VAL 31 16.625 -5.673 17.274 228 2HG1 VAL 31 HG12 VAL 31 16.088 -5.002 18.814 229 3HG1 VAL 31 HG13 VAL 31 17.811 -5.162 18.475 230 1HG2 VAL 31 HG21 VAL 31 18.014 -2.403 16.068 231 2HG2 VAL 31 HG22 VAL 31 17.685 -4.038 15.541 232 3HG2 VAL 31 HG23 VAL 31 18.892 -3.745 16.807 233 H SER 32 HN SER 32 14.551 -1.385 18.370 234 HA SER 32 HA SER 32 13.186 -2.907 20.246 235 1HB SER 32 HB2 SER 32 11.971 -0.753 20.702 236 2HB SER 32 HB1 SER 32 13.727 -0.607 20.685 237 HG SER 32 HG SER 32 12.020 0.764 19.337 238 H ALA 33 HN ALA 33 12.062 -1.439 17.235 239 HA ALA 33 HA ALA 33 9.387 -2.426 17.511 240 1HB ALA 33 HB1 ALA 33 9.880 -0.301 16.355 241 2HB ALA 33 HB2 ALA 33 9.022 -1.427 15.310 242 3HB ALA 33 HB3 ALA 33 10.758 -1.187 15.112 243 H LEU 34 HN LEU 34 12.382 -3.675 16.151 244 HA LEU 34 HA LEU 34 11.310 -5.609 14.466 245 1HB LEU 34 HB2 LEU 34 13.617 -4.905 14.359 246 2HB LEU 34 HB1 LEU 34 13.823 -5.255 16.063 247 HG LEU 34 HG LEU 34 13.712 -7.528 15.698 248 1HD1 LEU 34 HD11 LEU 34 13.688 -8.470 13.335 249 2HD1 LEU 34 HD12 LEU 34 13.449 -6.832 12.734 250 3HD1 LEU 34 HD13 LEU 34 12.200 -7.599 13.709 251 1HD2 LEU 34 HD21 LEU 34 15.642 -6.169 13.844 252 2HD2 LEU 34 HD22 LEU 34 15.792 -7.838 14.395 253 3HD2 LEU 34 HD23 LEU 34 15.855 -6.516 15.560 254 H LYS 35 HN LYS 35 12.254 -5.436 17.817 255 HA LYS 35 HA LYS 35 11.626 -8.115 18.467 256 1HB LYS 35 HB2 LYS 35 12.113 -5.711 20.181 257 2HB LYS 35 HB1 LYS 35 11.962 -7.361 20.787 258 1HG LYS 35 HG2 LYS 35 13.853 -8.042 19.467 259 2HG LYS 35 HG1 LYS 35 14.005 -6.444 18.761 260 1HD LYS 35 HD2 LYS 35 15.707 -6.686 20.453 261 2HD LYS 35 HD1 LYS 35 14.485 -5.594 21.101 262 1HE LYS 35 HE2 LYS 35 13.516 -7.433 22.380 263 2HE LYS 35 HE1 LYS 35 14.683 -8.543 21.677 264 1HZ LYS 35 HZ1 LYS 35 15.427 -6.208 23.375 265 2HZ LYS 35 HZ2 LYS 35 16.453 -7.427 22.794 266 3HZ LYS 35 HZ3 LYS 35 15.255 -7.797 23.902 267 H GLU 36 HN GLU 36 9.858 -5.103 18.636 268 HA GLU 36 HA GLU 36 7.716 -6.075 20.168 269 1HB GLU 36 HB2 GLU 36 6.520 -4.116 19.557 270 2HB GLU 36 HB1 GLU 36 8.201 -3.646 19.665 271 1HG GLU 36 HG2 GLU 36 7.318 -2.484 17.944 272 2HG GLU 36 HG1 GLU 36 8.122 -3.831 17.124 273 H THR 37 HN THR 37 8.400 -6.117 16.846 274 HA THR 37 HA THR 37 6.026 -7.334 15.921 275 HB THR 37 HB THR 37 8.801 -7.498 14.718 276 HG1 THR 37 HG1 THR 37 7.085 -5.475 14.997 277 1HG2 THR 37 HG21 THR 37 7.304 -9.222 13.829 278 2HG2 THR 37 HG22 THR 37 7.607 -7.974 12.616 279 3HG2 THR 37 HG23 THR 37 6.083 -7.997 13.504 280 H VAL 38 HN VAL 38 9.038 -8.676 17.169 281 HA VAL 38 HA VAL 38 8.524 -11.374 16.632 282 HB VAL 38 HB VAL 38 10.019 -10.245 19.027 283 1HG1 VAL 38 HG11 VAL 38 9.453 -12.584 19.339 284 2HG1 VAL 38 HG12 VAL 38 11.185 -12.405 19.034 285 3HG1 VAL 38 HG13 VAL 38 10.121 -12.973 17.752 286 1HG2 VAL 38 HG21 VAL 38 10.946 -9.438 16.919 287 2HG2 VAL 38 HG22 VAL 38 11.065 -11.097 16.329 288 3HG2 VAL 38 HG23 VAL 38 12.044 -10.576 17.700 289 H ILE 39 HN ILE 39 7.559 -9.298 19.290 290 HA ILE 39 HA ILE 39 6.373 -11.166 20.994 291 HB ILE 39 HB ILE 39 5.305 -8.354 20.511 292 1HG1 ILE 39 HG12 ILE 39 7.554 -9.235 22.346 293 2HG1 ILE 39 HG11 ILE 39 7.739 -8.268 20.892 294 1HG2 ILE 39 HG21 ILE 39 4.614 -8.486 22.869 295 2HG2 ILE 39 HG22 ILE 39 5.283 -10.099 22.984 296 3HG2 ILE 39 HG23 ILE 39 3.890 -9.800 21.933 297 1HD1 ILE 39 HD11 ILE 39 6.276 -7.474 23.389 298 2HD1 ILE 39 HD12 ILE 39 6.422 -6.478 21.939 299 3HD1 ILE 39 HD13 ILE 39 7.860 -6.895 22.880 300 H SER 40 HN SER 40 5.047 -9.438 18.213 301 HA SER 40 HA SER 40 2.448 -10.578 18.509 302 1HB SER 40 HB2 SER 40 1.958 -9.503 16.296 303 2HB SER 40 HB1 SER 40 2.572 -8.394 17.518 304 HG SER 40 HG SER 40 4.659 -9.379 16.160 305 H GLU 41 HN GLU 41 5.349 -11.701 16.863 306 HA GLU 41 HA GLU 41 3.879 -13.505 15.187 307 1HB GLU 41 HB2 GLU 41 6.793 -12.936 15.614 308 2HB GLU 41 HB1 GLU 41 6.166 -14.129 14.497 309 1HG GLU 41 HG2 GLU 41 5.638 -11.164 14.392 310 2HG GLU 41 HG1 GLU 41 6.774 -12.042 13.368 311 H TRP 42 HN TRP 42 5.193 -13.433 18.312 312 HA TRP 42 HA TRP 42 6.099 -16.136 18.467 313 1HB TRP 42 HB2 TRP 42 6.757 -13.997 19.849 314 2HB TRP 42 HB1 TRP 42 5.369 -14.439 20.829 315 HD1 TRP 42 HD1 TRP 42 5.778 -16.352 22.648 316 HE1 TRP 42 HE1 TRP 42 7.831 -17.723 23.310 317 HE3 TRP 42 HE3 TRP 42 8.810 -15.203 18.694 318 HZ2 TRP 42 HZ2 TRP 42 10.396 -18.299 22.248 319 HZ3 TRP 42 HZ3 TRP 42 11.045 -16.219 18.590 320 HH2 TRP 42 HH2 TRP 42 11.815 -17.734 20.333 321 HA PRO 43 HA PRO 43 2.233 -18.296 18.947 322 1HB PRO 43 HB2 PRO 43 3.733 -19.604 21.178 323 2HB PRO 43 HB1 PRO 43 2.743 -20.345 19.910 324 1HG PRO 43 HG2 PRO 43 5.384 -20.376 19.710 325 2HG PRO 43 HG1 PRO 43 4.381 -20.053 18.283 326 1HD PRO 43 HD2 PRO 43 6.029 -18.178 19.901 327 2HD PRO 43 HD1 PRO 43 5.649 -18.155 18.168 328 H ARG 44 HN ARG 44 0.587 -17.262 19.817 329 HA ARG 44 HA ARG 44 0.565 -15.689 22.158 330 1HB ARG 44 HB2 ARG 44 -1.776 -16.929 20.718 331 2HB ARG 44 HB1 ARG 44 -1.887 -15.657 21.910 332 1HG ARG 44 HG2 ARG 44 -0.626 -14.165 20.401 333 2HG ARG 44 HG1 ARG 44 -0.587 -15.467 19.202 334 1HD ARG 44 HD2 ARG 44 -3.036 -15.500 19.160 335 2HD ARG 44 HD1 ARG 44 -3.074 -14.205 20.347 336 HE ARG 44 HE ARG 44 -1.563 -13.416 18.114 337 1HH1 ARG 44 HH11 ARG 44 -4.909 -14.025 19.055 338 2HH1 ARG 44 HH12 ARG 44 -5.600 -12.956 17.932 339 1HH2 ARG 44 HH21 ARG 44 -2.496 -11.882 16.558 340 2HH2 ARG 44 HH22 ARG 44 -4.183 -11.696 16.486 341 H GLU 45 HN GLU 45 0.030 -19.019 21.659 342 HA GLU 45 HA GLU 45 -1.532 -19.606 23.959 343 1HB GLU 45 HB2 GLU 45 -1.412 -21.062 21.990 344 2HB GLU 45 HB1 GLU 45 0.279 -21.378 22.333 345 1HG GLU 45 HG2 GLU 45 -0.412 -22.381 24.499 346 2HG GLU 45 HG1 GLU 45 -2.090 -22.187 23.996 347 H LYS 46 HN LYS 46 1.945 -19.184 23.424 348 HA LYS 46 HA LYS 46 2.547 -20.576 25.810 349 1HB LYS 46 HB2 LYS 46 4.094 -19.482 23.553 350 2HB LYS 46 HB1 LYS 46 4.919 -19.704 25.070 351 1HG LYS 46 HG2 LYS 46 5.265 -21.631 23.609 352 2HG LYS 46 HG1 LYS 46 4.309 -22.115 25.000 353 1HD LYS 46 HD2 LYS 46 2.274 -21.976 23.619 354 2HD LYS 46 HD1 LYS 46 3.257 -21.497 22.233 355 1HE LYS 46 HE2 LYS 46 4.477 -23.617 22.377 356 2HE LYS 46 HE1 LYS 46 3.488 -24.093 23.750 357 1HZ LYS 46 HZ1 LYS 46 2.722 -25.071 21.671 358 2HZ LYS 46 HZ2 LYS 46 2.464 -23.541 21.016 359 3HZ LYS 46 HZ3 LYS 46 1.531 -24.068 22.310 360 H GLU 47 HN GLU 47 1.459 -19.192 27.262 361 HA GLU 47 HA GLU 47 2.626 -16.660 27.633 362 1HB GLU 47 HB2 GLU 47 0.806 -18.206 29.483 363 2HB GLU 47 HB1 GLU 47 1.292 -16.539 29.713 364 1HG GLU 47 HG2 GLU 47 0.233 -15.936 27.585 365 2HG GLU 47 HG1 GLU 47 -0.342 -17.593 27.413 366 H ASN 48 HN ASN 48 3.876 -16.124 29.494 367 HA ASN 48 HA ASN 48 5.743 -16.354 30.751 368 1HB ASN 48 HB2 ASN 48 4.818 -19.219 31.140 369 2HB ASN 48 HB1 ASN 48 6.237 -18.550 31.931 370 1HD2 ASN 48 HD21 ASN 48 2.803 -18.574 31.776 371 2HD2 ASN 48 HD22 ASN 48 2.522 -17.732 33.251 372 H GLY 49 HN GLY 49 5.547 -17.142 27.842 373 1HA GLY 49 HA2 GLY 49 8.124 -18.465 27.661 374 2HA GLY 49 HA1 GLY 49 6.939 -18.328 26.357 375 HA PRO 50 HA PRO 50 10.211 -14.859 26.099 376 1HB PRO 50 HB2 PRO 50 10.721 -16.147 23.498 377 2HB PRO 50 HB1 PRO 50 11.870 -15.628 24.717 378 1HG PRO 50 HG2 PRO 50 11.400 -18.192 24.300 379 2HG PRO 50 HG1 PRO 50 11.627 -17.590 25.958 380 1HD PRO 50 HD2 PRO 50 9.101 -18.254 24.492 381 2HD PRO 50 HD1 PRO 50 9.579 -18.673 26.151 382 H LYS 51 HN LYS 51 7.641 -14.298 25.727 383 HA LYS 51 HA LYS 51 7.071 -13.655 22.950 384 1HB LYS 51 HB2 LYS 51 5.575 -13.049 25.473 385 2HB LYS 51 HB1 LYS 51 5.034 -12.521 23.893 386 1HG LYS 51 HG2 LYS 51 4.773 -14.788 23.167 387 2HG LYS 51 HG1 LYS 51 5.427 -15.407 24.695 388 1HD LYS 51 HD2 LYS 51 2.912 -13.758 24.371 389 2HD LYS 51 HD1 LYS 51 2.966 -15.511 24.597 390 1HE LYS 51 HE2 LYS 51 4.083 -15.188 26.755 391 2HE LYS 51 HE1 LYS 51 4.016 -13.449 26.532 392 1HZ LYS 51 HZ1 LYS 51 2.312 -14.308 27.967 393 2HZ LYS 51 HZ2 LYS 51 1.613 -15.172 26.651 394 3HZ LYS 51 HZ3 LYS 51 1.675 -13.502 26.632 395 H THR 52 HN THR 52 7.771 -11.849 25.919 396 HA THR 52 HA THR 52 7.348 -9.395 24.550 397 HB THR 52 HB THR 52 7.973 -8.321 26.666 398 HG1 THR 52 HG1 THR 52 7.995 -10.916 27.829 399 1HG2 THR 52 HG21 THR 52 6.015 -9.130 27.934 400 2HG2 THR 52 HG22 THR 52 5.926 -10.530 26.863 401 3HG2 THR 52 HG23 THR 52 5.656 -8.911 26.221 402 H VAL 53 HN VAL 53 8.808 -7.634 24.673 403 HA VAL 53 HA VAL 53 11.101 -8.054 23.149 404 HB VAL 53 HB VAL 53 9.833 -5.974 23.076 405 1HG1 VAL 53 HG11 VAL 53 10.867 -5.423 25.852 406 2HG1 VAL 53 HG12 VAL 53 9.198 -5.758 25.399 407 3HG1 VAL 53 HG13 VAL 53 9.980 -4.277 24.848 408 1HG2 VAL 53 HG21 VAL 53 12.673 -5.495 23.974 409 2HG2 VAL 53 HG22 VAL 53 11.666 -4.325 23.126 410 3HG2 VAL 53 HG23 VAL 53 12.130 -5.827 22.329 411 H LYS 54 HN LYS 54 10.702 -7.932 26.568 412 HA LYS 54 HA LYS 54 13.388 -7.370 27.288 413 1HB LYS 54 HB2 LYS 54 11.177 -8.721 28.821 414 2HB LYS 54 HB1 LYS 54 12.716 -8.206 29.488 415 1HG LYS 54 HG2 LYS 54 12.160 -5.892 29.046 416 2HG LYS 54 HG1 LYS 54 10.657 -6.383 28.266 417 1HD LYS 54 HD2 LYS 54 10.291 -5.629 30.591 418 2HD LYS 54 HD1 LYS 54 9.833 -7.313 30.356 419 1HE LYS 54 HE2 LYS 54 11.955 -8.033 31.349 420 2HE LYS 54 HE1 LYS 54 12.439 -6.349 31.555 421 1HZ LYS 54 HZ1 LYS 54 10.115 -7.670 32.853 422 2HZ LYS 54 HZ2 LYS 54 10.576 -6.066 33.073 423 3HZ LYS 54 HZ3 LYS 54 11.578 -7.310 33.594 424 H GLU 55 HN GLU 55 11.619 -10.278 26.457 425 HA GLU 55 HA GLU 55 13.619 -11.955 27.778 426 1HB GLU 55 HB2 GLU 55 10.999 -12.761 26.546 427 2HB GLU 55 HB1 GLU 55 11.990 -13.695 27.659 428 1HG GLU 55 HG2 GLU 55 10.582 -11.115 28.291 429 2HG GLU 55 HG1 GLU 55 10.027 -12.706 28.766 430 H VAL 56 HN VAL 56 12.814 -10.871 24.673 431 HA VAL 56 HA VAL 56 13.868 -13.263 23.371 432 HB VAL 56 HB VAL 56 12.850 -10.726 22.064 433 1HG1 VAL 56 HG11 VAL 56 12.720 -12.033 20.040 434 2HG1 VAL 56 HG12 VAL 56 13.263 -13.467 20.900 435 3HG1 VAL 56 HG13 VAL 56 14.359 -12.104 20.690 436 1HG2 VAL 56 HG21 VAL 56 11.395 -13.319 22.566 437 2HG2 VAL 56 HG22 VAL 56 10.787 -11.969 21.611 438 3HG2 VAL 56 HG23 VAL 56 11.067 -11.770 23.341 439 H LYS 57 HN LYS 57 15.946 -13.388 22.691 440 HA LYS 57 HA LYS 57 17.476 -10.906 22.446 441 1HB LYS 57 HB2 LYS 57 18.358 -13.730 22.976 442 2HB LYS 57 HB1 LYS 57 19.447 -12.369 22.740 443 1HG LYS 57 HG2 LYS 57 18.504 -11.310 24.744 444 2HG LYS 57 HG1 LYS 57 17.448 -12.707 24.966 445 1HD LYS 57 HD2 LYS 57 19.415 -14.150 25.200 446 2HD LYS 57 HD1 LYS 57 20.465 -12.747 24.979 447 1HE LYS 57 HE2 LYS 57 19.505 -11.718 26.972 448 2HE LYS 57 HE1 LYS 57 18.463 -13.122 27.201 449 1HZ LYS 57 HZ1 LYS 57 21.427 -13.119 27.283 450 2HZ LYS 57 HZ2 LYS 57 20.464 -14.479 27.468 451 3HZ LYS 57 HZ3 LYS 57 20.394 -13.244 28.612 452 H LEU 58 HN LEU 58 17.880 -10.334 20.399 453 HA LEU 58 HA LEU 58 17.739 -12.374 18.294 454 1HB LEU 58 HB2 LEU 58 17.694 -9.337 18.099 455 2HB LEU 58 HB1 LEU 58 17.732 -10.396 16.714 456 HG LEU 58 HG LEU 58 15.476 -9.520 16.995 457 1HD1 LEU 58 HD11 LEU 58 14.209 -11.567 17.154 458 2HD1 LEU 58 HD12 LEU 58 15.600 -12.382 17.865 459 3HD1 LEU 58 HD13 LEU 58 15.680 -11.795 16.202 460 1HD2 LEU 58 HD21 LEU 58 15.589 -10.716 19.752 461 2HD2 LEU 58 HD22 LEU 58 14.171 -9.992 19.005 462 3HD2 LEU 58 HD23 LEU 58 15.599 -8.999 19.367 463 H ILE 59 HN ILE 59 19.590 -13.178 17.575 464 HA ILE 59 HA ILE 59 22.018 -11.532 17.726 465 HB ILE 59 HB ILE 59 21.623 -14.538 17.747 466 1HG1 ILE 59 HG12 ILE 59 22.997 -14.504 19.770 467 2HG1 ILE 59 HG11 ILE 59 23.145 -12.752 19.687 468 1HG2 ILE 59 HG21 ILE 59 24.240 -13.110 17.342 469 2HG2 ILE 59 HG22 ILE 59 23.403 -14.132 16.178 470 3HG2 ILE 59 HG23 ILE 59 24.056 -14.835 17.657 471 1HD1 ILE 59 HD11 ILE 59 20.729 -12.595 20.097 472 2HD1 ILE 59 HD12 ILE 59 21.555 -13.472 21.386 473 3HD1 ILE 59 HD13 ILE 59 20.633 -14.350 20.163 474 H SER 60 HN SER 60 22.751 -10.738 15.937 475 HA SER 60 HA SER 60 22.305 -12.214 13.468 476 1HB SER 60 HB2 SER 60 20.749 -10.226 13.584 477 2HB SER 60 HB1 SER 60 22.166 -9.193 13.732 478 HG SER 60 HG SER 60 21.978 -10.997 11.598 479 H ALA 61 HN ALA 61 24.127 -12.489 12.353 480 HA ALA 61 HA ALA 61 26.261 -12.437 11.700 481 1HB ALA 61 HB1 ALA 61 27.532 -10.331 11.742 482 2HB ALA 61 HB2 ALA 61 26.355 -9.640 12.858 483 3HB ALA 61 HB3 ALA 61 25.872 -10.050 11.214 484 H GLY 62 HN GLY 62 25.392 -13.052 14.482 485 1HA GLY 62 HA2 GLY 62 26.583 -14.313 16.094 486 2HA GLY 62 HA1 GLY 62 28.067 -13.561 15.524 487 H LYS 63 HN LYS 63 25.622 -11.264 16.045 488 HA LYS 63 HA LYS 63 26.598 -10.776 18.740 489 1HB LYS 63 HB2 LYS 63 27.916 -9.448 17.148 490 2HB LYS 63 HB1 LYS 63 26.446 -8.759 16.494 491 1HG LYS 63 HG2 LYS 63 26.013 -7.649 18.621 492 2HG LYS 63 HG1 LYS 63 27.472 -8.377 19.303 493 1HD LYS 63 HD2 LYS 63 28.822 -7.249 17.593 494 2HD LYS 63 HD1 LYS 63 27.363 -6.498 16.946 495 1HE LYS 63 HE2 LYS 63 28.477 -6.116 19.721 496 2HE LYS 63 HE1 LYS 63 28.613 -4.969 18.390 497 1HZ LYS 63 HZ1 LYS 63 26.178 -4.811 18.381 498 2HZ LYS 63 HZ2 LYS 63 26.854 -4.341 19.849 499 3HZ LYS 63 HZ3 LYS 63 26.107 -5.837 19.724 500 H VAL 64 HN VAL 64 25.055 -9.926 20.100 501 HA VAL 64 HA VAL 64 22.344 -10.108 19.203 502 HB VAL 64 HB VAL 64 22.958 -10.902 21.465 503 1HG1 VAL 64 HG11 VAL 64 24.688 -9.312 22.054 504 2HG1 VAL 64 HG12 VAL 64 23.437 -9.349 23.294 505 3HG1 VAL 64 HG13 VAL 64 23.493 -8.019 22.138 506 1HG2 VAL 64 HG21 VAL 64 21.020 -8.589 21.536 507 2HG2 VAL 64 HG22 VAL 64 21.124 -9.866 22.748 508 3HG2 VAL 64 HG23 VAL 64 20.644 -10.255 21.098 509 H LEU 65 HN LEU 65 20.949 -8.490 18.712 510 HA LEU 65 HA LEU 65 22.137 -5.893 18.651 511 1HB LEU 65 HB2 LEU 65 20.136 -5.339 17.188 512 2HB LEU 65 HB1 LEU 65 21.475 -6.214 16.480 513 HG LEU 65 HG LEU 65 18.870 -7.526 17.359 514 1HD1 LEU 65 HD11 LEU 65 18.471 -5.812 15.631 515 2HD1 LEU 65 HD12 LEU 65 18.272 -7.441 14.984 516 3HD1 LEU 65 HD13 LEU 65 19.739 -6.527 14.636 517 1HD2 LEU 65 HD21 LEU 65 21.049 -8.362 15.453 518 2HD2 LEU 65 HD22 LEU 65 19.591 -9.274 15.828 519 3HD2 LEU 65 HD23 LEU 65 20.815 -9.017 17.072 520 H GLU 66 HN GLU 66 21.590 -4.295 19.759 521 HA GLU 66 HA GLU 66 19.705 -4.636 21.898 522 1HB GLU 66 HB2 GLU 66 21.922 -3.663 22.252 523 2HB GLU 66 HB1 GLU 66 21.532 -2.351 21.158 524 1HG GLU 66 HG2 GLU 66 19.752 -1.635 22.692 525 2HG GLU 66 HG1 GLU 66 20.203 -2.942 23.784 526 H ASN 67 HN ASN 67 17.982 -3.281 22.332 527 HA ASN 67 HA ASN 67 16.137 -2.624 20.400 528 1HB ASN 67 HB2 ASN 67 16.495 -1.431 23.147 529 2HB ASN 67 HB1 ASN 67 15.067 -1.212 22.163 530 1HD2 ASN 67 HD21 ASN 67 13.862 -2.115 23.834 531 2HD2 ASN 67 HD22 ASN 67 13.818 -3.814 24.136 532 H SER 68 HN SER 68 18.767 -0.647 21.622 533 HA SER 68 HA SER 68 17.728 1.842 20.677 534 1HB SER 68 HB2 SER 68 20.500 1.159 21.643 535 2HB SER 68 HB1 SER 68 19.801 2.777 21.507 536 HG SER 68 HG SER 68 19.739 1.164 23.528 537 H LYS 69 HN LYS 69 19.191 -0.677 19.066 538 HA LYS 69 HA LYS 69 20.518 1.054 17.181 539 1HB LYS 69 HB2 LYS 69 20.600 -1.919 17.573 540 2HB LYS 69 HB1 LYS 69 21.415 -1.063 16.274 541 1HG LYS 69 HG2 LYS 69 22.674 0.229 17.959 542 2HG LYS 69 HG1 LYS 69 21.898 -0.719 19.224 543 1HD LYS 69 HD2 LYS 69 22.896 -2.753 18.295 544 2HD LYS 69 HD1 LYS 69 23.674 -1.787 17.038 545 1HE LYS 69 HE2 LYS 69 24.131 -1.531 20.010 546 2HE LYS 69 HE1 LYS 69 25.230 -2.279 18.862 547 1HZ LYS 69 HZ1 LYS 69 24.423 0.582 18.873 548 2HZ LYS 69 HZ2 LYS 69 25.487 -0.114 17.770 549 3HZ LYS 69 HZ3 LYS 69 25.897 -0.028 19.394 550 H THR 70 HN THR 70 20.280 0.297 14.788 551 HA THR 70 HA THR 70 17.414 0.056 14.385 552 HB THR 70 HB THR 70 19.432 1.004 12.366 553 HG1 THR 70 HG1 THR 70 19.790 2.376 14.026 554 1HG2 THR 70 HG21 THR 70 17.514 2.325 11.558 555 2HG2 THR 70 HG22 THR 70 16.539 1.681 12.883 556 3HG2 THR 70 HG23 THR 70 17.135 0.604 11.621 557 H VAL 71 HN VAL 71 16.933 -1.157 12.191 558 HA VAL 71 HA VAL 71 18.238 -3.694 12.338 559 HB VAL 71 HB VAL 71 16.238 -2.634 10.292 560 1HG1 VAL 71 HG11 VAL 71 17.538 -4.469 9.361 561 2HG1 VAL 71 HG12 VAL 71 15.874 -4.962 9.665 562 3HG1 VAL 71 HG13 VAL 71 17.164 -5.466 10.766 563 1HG2 VAL 71 HG21 VAL 71 15.872 -4.445 12.672 564 2HG2 VAL 71 HG22 VAL 71 14.617 -4.011 11.513 565 3HG2 VAL 71 HG23 VAL 71 15.332 -2.772 12.547 566 H LYS 72 HN LYS 72 18.446 -0.909 10.303 567 HA LYS 72 HA LYS 72 19.988 -1.806 8.171 568 1HB LYS 72 HB2 LYS 72 18.871 0.466 8.486 569 2HB LYS 72 HB1 LYS 72 20.199 0.867 9.536 570 1HG LYS 72 HG2 LYS 72 21.779 0.667 7.733 571 2HG LYS 72 HG1 LYS 72 20.499 0.147 6.633 572 1HD LYS 72 HD2 LYS 72 19.351 2.293 7.011 573 2HD LYS 72 HD1 LYS 72 20.686 2.808 8.034 574 1HE LYS 72 HE2 LYS 72 22.218 2.577 6.122 575 2HE LYS 72 HE1 LYS 72 20.860 2.095 5.110 576 1HZ LYS 72 HZ1 LYS 72 21.111 4.698 6.503 577 2HZ LYS 72 HZ2 LYS 72 19.839 4.245 5.506 578 3HZ LYS 72 HZ3 LYS 72 21.390 4.461 4.860 579 H ASP 73 HN ASP 73 20.937 -0.911 11.492 580 HA ASP 73 HA ASP 73 23.649 -0.635 11.249 581 1HB ASP 73 HB2 ASP 73 21.862 -1.608 13.435 582 2HB ASP 73 HB1 ASP 73 23.584 -1.590 13.682 583 H TYR 74 HN TYR 74 21.716 -3.590 11.471 584 HA TYR 74 HA TYR 74 24.171 -5.053 11.478 585 1HB TYR 74 HB2 TYR 74 21.380 -5.831 12.188 586 2HB TYR 74 HB1 TYR 74 22.609 -7.055 11.865 587 HD1 TYR 74 HD1 TYR 74 24.169 -7.643 13.527 588 HD2 TYR 74 HD2 TYR 74 21.909 -4.069 13.994 589 HE1 TYR 74 HE1 TYR 74 25.095 -7.362 15.779 590 HE2 TYR 74 HE2 TYR 74 22.826 -3.782 16.257 591 HH TYR 74 HH TYR 74 23.823 -5.184 18.036 592 H ARG 75 HN ARG 75 21.880 -4.058 9.167 593 HA ARG 75 HA ARG 75 22.474 -6.145 7.345 594 1HB ARG 75 HB2 ARG 75 21.011 -3.607 7.337 595 2HB ARG 75 HB1 ARG 75 21.785 -4.002 5.823 596 1HG ARG 75 HG2 ARG 75 19.543 -4.767 5.749 597 2HG ARG 75 HG1 ARG 75 20.587 -6.183 5.881 598 1HD ARG 75 HD2 ARG 75 20.084 -6.230 8.309 599 2HD ARG 75 HD1 ARG 75 18.974 -4.878 8.054 600 HE ARG 75 HE ARG 75 18.608 -7.650 7.267 601 1HH1 ARG 75 HH11 ARG 75 17.427 -4.317 6.750 602 2HH1 ARG 75 HH12 ARG 75 15.821 -4.769 6.482 603 1HH2 ARG 75 HH21 ARG 75 16.363 -8.264 6.805 604 2HH2 ARG 75 HH22 ARG 75 15.190 -7.069 6.501 605 H SER 76 HN SER 76 23.655 -5.667 5.335 606 HA SER 76 HA SER 76 26.209 -4.588 5.932 607 1HB SER 76 HB2 SER 76 25.799 -6.538 4.389 608 2HB SER 76 HB1 SER 76 25.032 -5.426 3.260 609 HG SER 76 HG SER 76 27.711 -5.278 4.172 610 HA PRO 77 HA PRO 77 25.548 -0.249 4.939 611 1HB PRO 77 HB2 PRO 77 28.075 -0.501 3.371 612 2HB PRO 77 HB1 PRO 77 27.635 0.688 4.604 613 1HG PRO 77 HG2 PRO 77 29.300 -1.264 5.214 614 2HG PRO 77 HG1 PRO 77 28.030 -0.792 6.358 615 1HD PRO 77 HD2 PRO 77 28.152 -3.160 4.535 616 2HD PRO 77 HD1 PRO 77 27.546 -3.044 6.206 617 H VAL 78 HN VAL 78 25.504 1.276 3.032 618 HA VAL 78 HA VAL 78 24.046 -0.006 0.936 619 HB VAL 78 HB VAL 78 24.883 2.826 1.117 620 1HG1 VAL 78 HG11 VAL 78 22.668 1.536 -0.516 621 2HG1 VAL 78 HG12 VAL 78 24.152 2.251 -1.146 622 3HG1 VAL 78 HG13 VAL 78 22.924 3.278 -0.408 623 1HG2 VAL 78 HG21 VAL 78 22.316 1.569 2.081 624 2HG2 VAL 78 HG22 VAL 78 22.607 3.310 2.023 625 3HG2 VAL 78 HG23 VAL 78 23.584 2.284 3.075 626 H SER 79 HN SER 79 25.674 -1.236 0.365 627 HA SER 79 HA SER 79 26.920 -0.459 -2.117 628 1HB SER 79 HB2 SER 79 28.650 0.111 -0.339 629 2HB SER 79 HB1 SER 79 28.622 -1.576 0.160 630 HG SER 79 HG SER 79 29.487 -0.463 -2.282 631 H ASN 80 HN ASN 80 24.854 -2.041 -1.019 632 HA ASN 80 HA ASN 80 25.459 -4.693 -2.084 633 1HB ASN 80 HB2 ASN 80 25.739 -4.779 0.434 634 2HB ASN 80 HB1 ASN 80 24.072 -4.239 0.587 635 1HD2 ASN 80 HD21 ASN 80 23.351 -6.079 1.624 636 2HD2 ASN 80 HD22 ASN 80 23.250 -7.624 0.858 637 H LEU 81 HN LEU 81 23.279 -5.773 -2.749 638 HA LEU 81 HA LEU 81 21.560 -4.008 -3.880 639 1HB LEU 81 HB2 LEU 81 20.950 -6.757 -3.060 640 2HB LEU 81 HB1 LEU 81 20.402 -5.814 -4.381 641 HG LEU 81 HG LEU 81 23.242 -6.825 -4.286 642 1HD1 LEU 81 HD11 LEU 81 22.580 -8.376 -6.044 643 2HD1 LEU 81 HD12 LEU 81 20.904 -7.855 -5.880 644 3HD1 LEU 81 HD13 LEU 81 21.704 -8.689 -4.548 645 1HD2 LEU 81 HD21 LEU 81 21.651 -5.487 -6.482 646 2HD2 LEU 81 HD22 LEU 81 23.292 -6.116 -6.629 647 3HD2 LEU 81 HD23 LEU 81 22.966 -4.761 -5.553 648 H ALA 82 HN ALA 82 19.486 -3.567 -3.287 649 HA ALA 82 HA ALA 82 19.078 -3.508 -0.477 650 1HB ALA 82 HB1 ALA 82 17.369 -2.197 -2.594 651 2HB ALA 82 HB2 ALA 82 18.683 -1.431 -1.702 652 3HB ALA 82 HB3 ALA 82 17.225 -1.943 -0.854 653 H GLY 83 HN GLY 83 18.801 -5.786 -0.429 654 1HA GLY 83 HA2 GLY 83 16.117 -6.600 -0.086 655 2HA GLY 83 HA1 GLY 83 16.709 -7.217 -1.622 656 H ALA 84 HN ALA 84 18.262 -6.740 1.478 657 HA ALA 84 HA ALA 84 19.423 -9.373 1.253 658 1HB ALA 84 HB1 ALA 84 20.894 -7.489 1.779 659 2HB ALA 84 HB2 ALA 84 20.870 -8.662 3.096 660 3HB ALA 84 HB3 ALA 84 19.956 -7.160 3.233 661 H VAL 85 HN VAL 85 18.435 -11.004 2.149 662 HA VAL 85 HA VAL 85 16.469 -10.610 4.235 663 HB VAL 85 HB VAL 85 17.409 -13.170 2.881 664 1HG1 VAL 85 HG11 VAL 85 15.374 -14.195 3.796 665 2HG1 VAL 85 HG12 VAL 85 15.002 -12.693 4.646 666 3HG1 VAL 85 HG13 VAL 85 16.435 -13.618 5.084 667 1HG2 VAL 85 HG21 VAL 85 14.970 -11.471 2.385 668 2HG2 VAL 85 HG22 VAL 85 15.285 -13.033 1.639 669 3HG2 VAL 85 HG23 VAL 85 16.350 -11.665 1.307 670 H THR 86 HN THR 86 16.733 -11.259 6.317 671 HA THR 86 HA THR 86 19.468 -12.058 7.048 672 HB THR 86 HB THR 86 17.676 -10.138 8.552 673 HG1 THR 86 HG1 THR 86 19.573 -9.856 6.552 674 1HG2 THR 86 HG21 THR 86 19.726 -9.646 9.830 675 2HG2 THR 86 HG22 THR 86 20.605 -10.845 8.887 676 3HG2 THR 86 HG23 THR 86 19.302 -11.353 9.963 677 H THR 87 HN THR 87 19.527 -13.898 8.230 678 HA THR 87 HA THR 87 17.119 -14.762 9.609 679 HB THR 87 HB THR 87 19.755 -16.197 9.127 680 HG1 THR 87 HG1 THR 87 18.215 -15.762 7.322 681 1HG2 THR 87 HG21 THR 87 17.140 -17.240 10.257 682 2HG2 THR 87 HG22 THR 87 18.622 -16.979 11.169 683 3HG2 THR 87 HG23 THR 87 18.570 -18.215 9.915 684 H MET 88 HN MET 88 16.946 -14.216 11.674 685 HA MET 88 HA MET 88 19.415 -13.630 13.109 686 1HB MET 88 HB2 MET 88 16.606 -12.662 13.639 687 2HB MET 88 HB1 MET 88 17.964 -12.370 14.722 688 1HG MET 88 HG2 MET 88 19.126 -11.200 12.906 689 2HG MET 88 HG1 MET 88 17.733 -11.460 11.869 690 1HE MET 88 HE1 MET 88 17.744 -8.858 11.358 691 2HE MET 88 HE2 MET 88 19.104 -8.619 12.456 692 3HE MET 88 HE3 MET 88 17.659 -7.616 12.606 693 H HIS 89 HN HIS 89 19.912 -14.616 14.901 694 HA HIS 89 HA HIS 89 18.449 -17.087 15.356 695 1HB HIS 89 HB2 HIS 89 21.165 -16.195 16.367 696 2HB HIS 89 HB1 HIS 89 20.447 -17.776 16.661 697 HD1 HIS 89 HD1 HIS 89 22.866 -16.284 14.527 698 HD2 HIS 89 HD2 HIS 89 19.772 -18.999 13.914 699 HE1 HIS 89 HE1 HIS 89 23.388 -17.432 12.389 700 HE2 HIS 89 HE2 HIS 89 21.698 -19.270 12.247 701 H VAL 90 HN VAL 90 17.168 -17.338 16.983 702 HA VAL 90 HA VAL 90 17.073 -15.236 19.056 703 HB VAL 90 HB VAL 90 14.967 -17.295 18.346 704 1HG1 VAL 90 HG11 VAL 90 14.825 -14.848 20.089 705 2HG1 VAL 90 HG12 VAL 90 14.812 -16.523 20.640 706 3HG1 VAL 90 HG13 VAL 90 13.467 -15.898 19.688 707 1HG2 VAL 90 HG21 VAL 90 13.727 -15.448 17.311 708 2HG2 VAL 90 HG22 VAL 90 15.249 -15.772 16.477 709 3HG2 VAL 90 HG23 VAL 90 15.113 -14.388 17.564 710 H ILE 91 HN ILE 91 17.750 -15.533 20.811 711 HA ILE 91 HA ILE 91 18.276 -18.218 21.820 712 HB ILE 91 HB ILE 91 19.108 -15.472 22.585 713 1HG1 ILE 91 HG12 ILE 91 20.285 -16.263 20.669 714 2HG1 ILE 91 HG11 ILE 91 21.423 -16.217 22.014 715 1HG2 ILE 91 HG21 ILE 91 20.608 -16.521 24.340 716 2HG2 ILE 91 HG22 ILE 91 19.887 -18.085 23.963 717 3HG2 ILE 91 HG23 ILE 91 18.896 -16.807 24.664 718 1HD1 ILE 91 HD11 ILE 91 21.138 -18.652 22.256 719 2HD1 ILE 91 HD12 ILE 91 21.765 -18.183 20.677 720 3HD1 ILE 91 HD13 ILE 91 20.075 -18.650 20.847 721 H ILE 92 HN ILE 92 17.158 -19.006 23.403 722 HA ILE 92 HA ILE 92 14.701 -17.635 23.995 723 HB ILE 92 HB ILE 92 15.626 -20.460 24.494 724 1HG1 ILE 92 HG12 ILE 92 15.350 -19.975 22.135 725 2HG1 ILE 92 HG11 ILE 92 14.058 -21.043 22.673 726 1HG2 ILE 92 HG21 ILE 92 13.294 -20.991 25.014 727 2HG2 ILE 92 HG22 ILE 92 12.907 -19.269 24.927 728 3HG2 ILE 92 HG23 ILE 92 14.012 -19.861 26.168 729 1HD1 ILE 92 HD11 ILE 92 13.851 -18.073 22.188 730 2HD1 ILE 92 HD12 ILE 92 12.546 -19.115 22.751 731 3HD1 ILE 92 HD13 ILE 92 13.237 -19.355 21.146 732 H GLN 93 HN GLN 93 14.605 -16.382 25.727 733 HA GLN 93 HA GLN 93 15.852 -17.358 28.157 734 1HB GLN 93 HB2 GLN 93 16.738 -15.192 27.324 735 2HB GLN 93 HB1 GLN 93 15.106 -14.540 27.335 736 1HG GLN 93 HG2 GLN 93 15.000 -14.754 29.729 737 2HG GLN 93 HG1 GLN 93 16.589 -15.533 29.731 738 1HE2 GLN 93 HE21 GLN 93 17.471 -13.956 31.062 739 2HE2 GLN 93 HE22 GLN 93 17.836 -12.377 30.489 740 H ALA 94 HN ALA 94 14.358 -18.301 29.323 741 HA ALA 94 HA ALA 94 11.568 -17.712 28.898 742 1HB ALA 94 HB1 ALA 94 11.138 -19.655 30.320 743 2HB ALA 94 HB2 ALA 94 12.861 -19.767 30.687 744 3HB ALA 94 HB3 ALA 94 12.292 -20.037 29.043 745 HA PRO 95 HA PRO 95 11.212 -14.575 32.065 746 1HB PRO 95 HB2 PRO 95 8.478 -15.750 32.103 747 2HB PRO 95 HB1 PRO 95 8.967 -14.058 32.017 748 1HG PRO 95 HG2 PRO 95 8.104 -15.362 29.860 749 2HG PRO 95 HG1 PRO 95 9.391 -14.154 29.767 750 1HD PRO 95 HD2 PRO 95 9.546 -17.095 29.535 751 2HD PRO 95 HD1 PRO 95 10.611 -15.848 28.858 752 H VAL 96 HN VAL 96 10.969 -14.463 34.271 753 HA VAL 96 HA VAL 96 11.308 -16.873 35.774 754 HB VAL 96 HB VAL 96 10.674 -14.118 36.786 755 1HG1 VAL 96 HG11 VAL 96 12.054 -16.433 38.133 756 2HG1 VAL 96 HG12 VAL 96 10.439 -15.819 38.478 757 3HG1 VAL 96 HG13 VAL 96 11.852 -14.823 38.830 758 1HG2 VAL 96 HG21 VAL 96 13.390 -15.275 36.163 759 2HG2 VAL 96 HG22 VAL 96 13.113 -13.755 37.012 760 3HG2 VAL 96 HG23 VAL 96 12.600 -13.935 35.335 761 H THR 97 HN THR 97 8.885 -14.310 35.659 762 HA THR 97 HA THR 97 6.784 -16.190 35.853 763 HB THR 97 HB THR 97 7.289 -15.934 38.185 764 HG1 THR 97 HG1 THR 97 4.958 -15.593 37.240 765 1HG2 THR 97 HG21 THR 97 6.957 -12.947 37.830 766 2HG2 THR 97 HG22 THR 97 8.452 -13.798 38.218 767 3HG2 THR 97 HG23 THR 97 7.130 -13.758 39.387 768 H GLU 98 HN GLU 98 5.599 -15.548 34.152 769 HA GLU 98 HA GLU 98 5.451 -12.729 33.539 770 1HB GLU 98 HB2 GLU 98 5.800 -14.315 31.691 771 2HB GLU 98 HB1 GLU 98 4.304 -15.138 32.110 772 1HG GLU 98 HG2 GLU 98 3.037 -13.159 31.529 773 2HG GLU 98 HG1 GLU 98 4.528 -12.296 31.156 774 H LYS 99 HN LYS 99 4.269 -11.833 35.056 775 HA LYS 99 HA LYS 99 1.522 -12.051 35.070 776 1HB LYS 99 HB2 LYS 99 2.303 -14.164 36.335 777 2HB LYS 99 HB1 LYS 99 2.948 -13.098 37.549 778 1HG LYS 99 HG2 LYS 99 0.022 -13.212 36.839 779 2HG LYS 99 HG1 LYS 99 0.759 -14.252 38.041 780 1HD LYS 99 HD2 LYS 99 1.428 -12.209 39.292 781 2HD LYS 99 HD1 LYS 99 0.534 -11.246 38.103 782 1HE LYS 99 HE2 LYS 99 -1.511 -12.405 38.632 783 2HE LYS 99 HE1 LYS 99 -0.655 -13.485 39.728 784 1HZ LYS 99 HZ1 LYS 99 -1.014 -10.560 40.076 785 2HZ LYS 99 HZ2 LYS 99 -0.157 -11.563 41.118 786 3HZ LYS 99 HZ3 LYS 99 -1.820 -11.773 40.935 787 H GLU 100 HN GLU 100 1.635 -9.854 34.880 788 HA GLU 100 HA GLU 100 3.645 -8.257 36.011 789 1HB GLU 100 HB2 GLU 100 0.976 -7.289 34.989 790 2HB GLU 100 HB1 GLU 100 2.397 -6.306 35.270 791 1HG GLU 100 HG2 GLU 100 2.292 -6.601 32.951 792 2HG GLU 100 HG1 GLU 100 3.528 -7.736 33.485 793 H LYS 101 HN LYS 101 0.196 -8.207 36.792 794 HA LYS 101 HA LYS 101 0.900 -6.860 39.286 795 1HB LYS 101 HB2 LYS 101 -1.800 -7.223 37.990 796 2HB LYS 101 HB1 LYS 101 -1.449 -6.234 39.398 797 1HG LYS 101 HG2 LYS 101 -0.030 -4.788 38.017 798 2HG LYS 101 HG1 LYS 101 -0.432 -5.765 36.602 799 1HD LYS 101 HD2 LYS 101 -2.808 -5.218 36.934 800 2HD LYS 101 HD1 LYS 101 -2.363 -4.200 38.304 801 1HE LYS 101 HE2 LYS 101 -0.969 -2.834 36.768 802 2HE LYS 101 HE1 LYS 101 -1.544 -3.826 35.433 803 1HZ LYS 101 HZ1 LYS 101 -3.254 -2.204 37.213 804 2HZ LYS 101 HZ2 LYS 101 -3.807 -3.115 35.927 805 3HZ LYS 101 HZ3 LYS 101 -2.831 -1.766 35.652 Start of MODEL 14 1 H GLU 1 HT1 GLU 1 -0.408 -15.809 -1.086 2 HA GLU 1 HA GLU 1 1.864 -15.910 0.779 3 1HB GLU 1 HB2 GLU 1 1.421 -17.319 -1.872 4 2HB GLU 1 HB1 GLU 1 2.967 -17.250 -1.060 5 1HG GLU 1 HG2 GLU 1 1.997 -19.396 -0.669 6 2HG GLU 1 HG1 GLU 1 1.932 -18.500 0.842 7 H ALA 2 HN ALA 2 2.885 -13.970 0.620 8 HA ALA 2 HA ALA 2 3.478 -13.064 -2.046 9 1HB ALA 2 HB1 ALA 2 2.799 -10.762 -1.604 10 2HB ALA 2 HB2 ALA 2 2.201 -11.228 -0.016 11 3HB ALA 2 HB3 ALA 2 1.418 -11.851 -1.470 12 H GLU 3 HN GLU 3 5.584 -13.815 -1.466 13 HA GLU 3 HA GLU 3 6.775 -12.268 0.557 14 1HB GLU 3 HB2 GLU 3 8.840 -13.679 0.226 15 2HB GLU 3 HB1 GLU 3 7.429 -14.549 0.788 16 1HG GLU 3 HG2 GLU 3 8.403 -14.516 -2.072 17 2HG GLU 3 HG1 GLU 3 8.836 -15.745 -0.893 18 H VAL 4 HN VAL 4 6.967 -10.299 -0.221 19 HA VAL 4 HA VAL 4 8.414 -9.909 -2.744 20 HB VAL 4 HB VAL 4 7.034 -7.826 -1.086 21 1HG1 VAL 4 HG11 VAL 4 7.060 -6.464 -3.143 22 2HG1 VAL 4 HG12 VAL 4 7.952 -7.751 -3.950 23 3HG1 VAL 4 HG13 VAL 4 8.676 -6.904 -2.584 24 1HG2 VAL 4 HG21 VAL 4 5.334 -9.416 -1.774 25 2HG2 VAL 4 HG22 VAL 4 5.888 -9.323 -3.448 26 3HG2 VAL 4 HG23 VAL 4 5.140 -7.919 -2.685 27 H HIS 5 HN HIS 5 10.354 -9.171 -2.649 28 HA HIS 5 HA HIS 5 11.287 -8.034 -0.169 29 1HB HIS 5 HB2 HIS 5 13.457 -9.316 -0.235 30 2HB HIS 5 HB1 HIS 5 12.023 -10.241 0.171 31 HD1 HIS 5 HD1 HIS 5 14.911 -10.241 -2.008 32 HD2 HIS 5 HD2 HIS 5 11.110 -11.900 -2.062 33 HE1 HIS 5 HE1 HIS 5 15.020 -12.136 -3.662 34 HE2 HIS 5 HE2 HIS 5 12.768 -13.261 -3.457 35 H ASN 6 HN ASN 6 11.097 -6.151 -1.117 36 HA ASN 6 HA ASN 6 13.363 -5.445 -2.825 37 1HB ASN 6 HB2 ASN 6 10.823 -3.887 -2.178 38 2HB ASN 6 HB1 ASN 6 12.167 -3.221 -3.097 39 1HD2 ASN 6 HD21 ASN 6 10.918 -2.910 -4.946 40 2HD2 ASN 6 HD22 ASN 6 10.357 -4.221 -5.915 41 H GLN 7 HN GLN 7 11.825 -5.093 0.232 42 HA GLN 7 HA GLN 7 14.048 -3.603 1.303 43 1HB GLN 7 HB2 GLN 7 11.557 -4.681 2.676 44 2HB GLN 7 HB1 GLN 7 12.743 -3.616 3.387 45 1HG GLN 7 HG2 GLN 7 10.989 -2.182 2.949 46 2HG GLN 7 HG1 GLN 7 11.994 -1.960 1.525 47 1HE2 GLN 7 HE21 GLN 7 9.159 -1.490 1.929 48 2HE2 GLN 7 HE22 GLN 7 8.320 -2.435 0.758 49 H LEU 8 HN LEU 8 14.291 -4.881 3.801 50 HA LEU 8 HA LEU 8 15.313 -7.447 2.909 51 1HB LEU 8 HB2 LEU 8 15.718 -5.976 5.497 52 2HB LEU 8 HB1 LEU 8 16.425 -7.508 5.107 53 HG LEU 8 HG LEU 8 17.724 -6.410 3.259 54 1HD1 LEU 8 HD11 LEU 8 16.721 -3.850 4.486 55 2HD1 LEU 8 HD12 LEU 8 16.349 -4.455 2.873 56 3HD1 LEU 8 HD13 LEU 8 18.000 -3.987 3.280 57 1HD2 LEU 8 HD21 LEU 8 18.171 -5.340 6.037 58 2HD2 LEU 8 HD22 LEU 8 19.366 -5.359 4.740 59 3HD2 LEU 8 HD23 LEU 8 18.755 -6.877 5.397 60 H GLU 9 HN GLU 9 14.416 -9.300 3.551 61 HA GLU 9 HA GLU 9 12.045 -9.052 5.201 62 1HB GLU 9 HB2 GLU 9 13.054 -11.537 3.851 63 2HB GLU 9 HB1 GLU 9 11.546 -11.299 4.652 64 1HG GLU 9 HG2 GLU 9 10.844 -9.645 3.007 65 2HG GLU 9 HG1 GLU 9 12.359 -9.897 2.133 66 H ILE 10 HN ILE 10 12.049 -9.542 7.160 67 HA ILE 10 HA ILE 10 14.355 -11.004 8.237 68 HB ILE 10 HB ILE 10 12.528 -9.080 9.671 69 1HG1 ILE 10 HG12 ILE 10 15.484 -8.906 9.019 70 2HG1 ILE 10 HG11 ILE 10 14.225 -8.007 8.193 71 1HG2 ILE 10 HG21 ILE 10 13.971 -9.386 11.636 72 2HG2 ILE 10 HG22 ILE 10 14.807 -10.688 10.780 73 3HG2 ILE 10 HG23 ILE 10 13.101 -10.853 11.181 74 1HD1 ILE 10 HD11 ILE 10 13.729 -6.827 10.295 75 2HD1 ILE 10 HD12 ILE 10 15.402 -6.603 9.784 76 3HD1 ILE 10 HD13 ILE 10 15.022 -7.725 11.090 77 H LYS 11 HN LYS 11 14.056 -12.801 8.933 78 HA LYS 11 HA LYS 11 11.417 -13.588 9.896 79 1HB LYS 11 HB2 LYS 11 11.826 -15.914 9.204 80 2HB LYS 11 HB1 LYS 11 11.835 -14.832 7.837 81 1HG LYS 11 HG2 LYS 11 14.391 -14.905 8.030 82 2HG LYS 11 HG1 LYS 11 14.141 -16.272 9.122 83 1HD LYS 11 HD2 LYS 11 13.205 -16.069 6.255 84 2HD LYS 11 HD1 LYS 11 14.522 -17.083 6.840 85 1HE LYS 11 HE2 LYS 11 11.602 -17.334 7.585 86 2HE LYS 11 HE1 LYS 11 12.438 -18.309 6.385 87 1HZ LYS 11 HZ1 LYS 11 12.172 -19.378 8.511 88 2HZ LYS 11 HZ2 LYS 11 13.174 -18.226 9.262 89 3HZ LYS 11 HZ3 LYS 11 13.786 -19.251 8.072 90 H PHE 12 HN PHE 12 11.344 -14.600 11.852 91 HA PHE 12 HA PHE 12 13.780 -14.309 13.427 92 1HB PHE 12 HB2 PHE 12 10.922 -14.797 14.291 93 2HB PHE 12 HB1 PHE 12 12.274 -14.487 15.366 94 HD1 PHE 12 HD1 PHE 12 9.750 -13.019 13.233 95 HD2 PHE 12 HD2 PHE 12 13.375 -12.259 15.327 96 HE1 PHE 12 HE1 PHE 12 9.324 -10.599 13.087 97 HE2 PHE 12 HE2 PHE 12 12.956 -9.846 15.186 98 HZ PHE 12 HZ PHE 12 10.947 -9.004 14.077 99 H ARG 13 HN ARG 13 14.957 -16.061 13.920 100 HA ARG 13 HA ARG 13 13.554 -18.616 13.867 101 1HB ARG 13 HB2 ARG 13 15.044 -18.398 11.944 102 2HB ARG 13 HB1 ARG 13 16.394 -18.064 13.016 103 1HG ARG 13 HG2 ARG 13 16.286 -20.290 13.919 104 2HG ARG 13 HG1 ARG 13 14.830 -20.635 12.985 105 1HD ARG 13 HD2 ARG 13 16.074 -20.319 10.917 106 2HD ARG 13 HD1 ARG 13 17.529 -19.958 11.839 107 HE ARG 13 HE ARG 13 17.331 -22.245 12.735 108 1HH1 ARG 13 HH11 ARG 13 15.874 -21.467 9.558 109 2HH1 ARG 13 HH12 ARG 13 16.090 -23.036 8.952 110 1HH2 ARG 13 HH21 ARG 13 17.599 -24.417 11.812 111 2HH2 ARG 13 HH22 ARG 13 17.057 -24.716 10.217 112 H LEU 14 HN LEU 14 13.646 -19.794 15.542 113 HA LEU 14 HA LEU 14 14.825 -18.785 17.965 114 1HB LEU 14 HB2 LEU 14 13.264 -21.292 17.421 115 2HB LEU 14 HB1 LEU 14 13.629 -20.632 18.997 116 HG LEU 14 HG LEU 14 11.812 -19.418 16.916 117 1HD1 LEU 14 HD11 LEU 14 11.243 -20.596 19.618 118 2HD1 LEU 14 HD12 LEU 14 10.858 -21.329 18.064 119 3HD1 LEU 14 HD13 LEU 14 10.068 -19.830 18.550 120 1HD2 LEU 14 HD21 LEU 14 12.539 -18.426 19.654 121 2HD2 LEU 14 HD22 LEU 14 11.339 -17.705 18.578 122 3HD2 LEU 14 HD23 LEU 14 13.042 -17.692 18.133 123 H THR 15 HN THR 15 15.937 -20.355 19.441 124 HA THR 15 HA THR 15 18.239 -21.419 18.241 125 HB THR 15 HB THR 15 18.617 -22.339 20.567 126 HG1 THR 15 HG1 THR 15 17.175 -21.570 22.150 127 1HG2 THR 15 HG21 THR 15 17.942 -19.398 20.328 128 2HG2 THR 15 HG22 THR 15 19.473 -20.140 19.864 129 3HG2 THR 15 HG23 THR 15 18.983 -20.119 21.555 130 H ASP 16 HN ASP 16 15.178 -22.689 18.827 131 HA ASP 16 HA ASP 16 15.947 -25.484 18.785 132 1HB ASP 16 HB2 ASP 16 13.207 -24.240 18.523 133 2HB ASP 16 HB1 ASP 16 13.519 -25.961 18.681 134 H GLY 17 HN GLY 17 15.702 -23.132 16.474 135 1HA GLY 17 HA2 GLY 17 16.141 -23.412 14.201 136 2HA GLY 17 HA1 GLY 17 15.717 -25.111 14.342 137 H SER 18 HN SER 18 13.398 -23.416 15.885 138 HA SER 18 HA SER 18 11.487 -23.704 13.757 139 1HB SER 18 HB2 SER 18 11.260 -22.560 16.536 140 2HB SER 18 HB1 SER 18 9.909 -23.048 15.506 141 HG SER 18 HG SER 18 10.645 -25.151 15.607 142 H ASP 19 HN ASP 19 10.686 -21.946 12.513 143 HA ASP 19 HA ASP 19 11.785 -19.353 13.231 144 1HB ASP 19 HB2 ASP 19 11.859 -18.865 10.895 145 2HB ASP 19 HB1 ASP 19 12.956 -20.185 11.202 146 H ILE 20 HN ILE 20 10.612 -17.597 12.570 147 HA ILE 20 HA ILE 20 7.714 -18.011 12.340 148 HB ILE 20 HB ILE 20 9.294 -15.544 13.182 149 1HG1 ILE 20 HG12 ILE 20 7.644 -17.460 14.857 150 2HG1 ILE 20 HG11 ILE 20 9.397 -17.340 14.862 151 1HG2 ILE 20 HG21 ILE 20 7.122 -14.594 13.843 152 2HG2 ILE 20 HG22 ILE 20 6.310 -16.011 13.179 153 3HG2 ILE 20 HG23 ILE 20 7.199 -14.926 12.112 154 1HD1 ILE 20 HD11 ILE 20 7.475 -15.197 15.749 155 2HD1 ILE 20 HD12 ILE 20 9.235 -15.071 15.769 156 3HD1 ILE 20 HD13 ILE 20 8.422 -16.247 16.801 157 H GLY 21 HN GLY 21 6.656 -17.105 10.616 158 1HA GLY 21 HA2 GLY 21 7.837 -16.923 8.152 159 2HA GLY 21 HA1 GLY 21 6.290 -16.193 8.550 160 HA PRO 22 HA PRO 22 10.038 -13.114 8.041 161 1HB PRO 22 HB2 PRO 22 10.253 -12.979 5.312 162 2HB PRO 22 HB1 PRO 22 11.366 -13.877 6.320 163 1HG PRO 22 HG2 PRO 22 9.114 -14.815 4.646 164 2HG PRO 22 HG1 PRO 22 10.598 -15.665 5.112 165 1HD PRO 22 HD2 PRO 22 8.111 -16.142 6.147 166 2HD PRO 22 HD1 PRO 22 9.632 -16.523 6.979 167 H LYS 23 HN LYS 23 9.690 -11.048 7.725 168 HA LYS 23 HA LYS 23 7.437 -10.165 6.040 169 1HB LYS 23 HB2 LYS 23 8.245 -8.969 8.706 170 2HB LYS 23 HB1 LYS 23 7.207 -8.161 7.559 171 1HG LYS 23 HG2 LYS 23 5.841 -8.997 9.200 172 2HG LYS 23 HG1 LYS 23 5.617 -10.067 7.833 173 1HD LYS 23 HD2 LYS 23 7.060 -11.744 8.843 174 2HD LYS 23 HD1 LYS 23 7.388 -10.664 10.203 175 1HE LYS 23 HE2 LYS 23 5.041 -10.712 10.833 176 2HE LYS 23 HE1 LYS 23 4.670 -11.741 9.454 177 1HZ LYS 23 HZ1 LYS 23 6.017 -13.471 10.401 178 2HZ LYS 23 HZ2 LYS 23 4.883 -12.958 11.565 179 3HZ LYS 23 HZ3 LYS 23 6.480 -12.480 11.684 180 H ALA 24 HN ALA 24 7.741 -7.932 5.366 181 HA ALA 24 HA ALA 24 10.543 -7.577 4.624 182 1HB ALA 24 HB1 ALA 24 9.725 -5.929 3.009 183 2HB ALA 24 HB2 ALA 24 8.096 -6.088 3.661 184 3HB ALA 24 HB3 ALA 24 8.854 -7.453 2.843 185 H PHE 25 HN PHE 25 11.821 -6.236 5.668 186 HA PHE 25 HA PHE 25 10.667 -3.951 7.115 187 1HB PHE 25 HB2 PHE 25 13.061 -5.620 7.924 188 2HB PHE 25 HB1 PHE 25 12.436 -4.218 8.766 189 HD1 PHE 25 HD1 PHE 25 11.669 -7.679 7.800 190 HD2 PHE 25 HD2 PHE 25 10.832 -4.495 10.469 191 HE1 PHE 25 HE1 PHE 25 10.416 -9.221 9.226 192 HE2 PHE 25 HE2 PHE 25 9.560 -6.046 11.909 193 HZ PHE 25 HZ PHE 25 9.390 -8.455 11.244 194 HA PRO 26 HA PRO 26 13.734 -1.783 4.536 195 1HB PRO 26 HB2 PRO 26 13.242 0.108 6.791 196 2HB PRO 26 HB1 PRO 26 13.334 0.483 5.079 197 1HG PRO 26 HG2 PRO 26 10.976 0.400 6.238 198 2HG PRO 26 HG1 PRO 26 11.174 -0.415 4.675 199 1HD PRO 26 HD2 PRO 26 11.071 -1.611 7.421 200 2HD PRO 26 HD1 PRO 26 10.354 -2.197 5.902 201 H ASP 27 HN ASP 27 15.988 -1.445 4.904 202 HA ASP 27 HA ASP 27 17.156 -2.629 7.206 203 1HB ASP 27 HB2 ASP 27 19.327 -1.788 6.368 204 2HB ASP 27 HB1 ASP 27 18.388 -2.528 5.080 205 H ALA 28 HN ALA 28 16.003 0.472 6.515 206 HA ALA 28 HA ALA 28 17.424 1.855 8.610 207 1HB ALA 28 HB1 ALA 28 15.032 2.727 6.994 208 2HB ALA 28 HB2 ALA 28 16.724 3.041 6.590 209 3HB ALA 28 HB3 ALA 28 16.012 3.761 8.032 210 H THR 29 HN THR 29 15.178 -0.443 8.874 211 HA THR 29 HA THR 29 13.237 0.658 10.612 212 HB THR 29 HB THR 29 14.200 -2.210 10.350 213 HG1 THR 29 HG1 THR 29 13.284 -1.890 8.531 214 1HG2 THR 29 HG21 THR 29 11.644 -1.156 11.601 215 2HG2 THR 29 HG22 THR 29 12.993 -1.858 12.484 216 3HG2 THR 29 HG23 THR 29 12.056 -2.855 11.371 217 H THR 30 HN THR 30 13.256 0.967 12.760 218 HA THR 30 HA THR 30 15.757 0.669 14.112 219 HB THR 30 HB THR 30 14.662 2.759 14.543 220 HG1 THR 30 HG1 THR 30 15.430 2.517 16.441 221 1HG2 THR 30 HG21 THR 30 12.443 2.889 15.615 222 2HG2 THR 30 HG22 THR 30 12.285 1.126 15.410 223 3HG2 THR 30 HG23 THR 30 12.440 2.185 14.001 224 H VAL 31 HN VAL 31 16.135 -0.580 15.934 225 HA VAL 31 HA VAL 31 14.898 -3.097 15.967 226 HB VAL 31 HB VAL 31 16.629 -1.810 18.112 227 1HG1 VAL 31 HG11 VAL 31 15.980 -4.729 17.644 228 2HG1 VAL 31 HG12 VAL 31 15.393 -3.744 18.983 229 3HG1 VAL 31 HG13 VAL 31 17.114 -4.100 18.840 230 1HG2 VAL 31 HG21 VAL 31 17.702 -1.913 15.922 231 2HG2 VAL 31 HG22 VAL 31 17.375 -3.644 15.831 232 3HG2 VAL 31 HG23 VAL 31 18.463 -3.003 17.072 233 H SER 32 HN SER 32 14.149 -0.148 17.597 234 HA SER 32 HA SER 32 12.542 -1.020 19.679 235 1HB SER 32 HB2 SER 32 12.097 1.362 17.866 236 2HB SER 32 HB1 SER 32 11.376 1.130 19.459 237 HG SER 32 HG SER 32 14.057 0.817 19.586 238 H ALA 33 HN ALA 33 11.681 -0.517 16.251 239 HA ALA 33 HA ALA 33 8.949 -1.374 16.602 240 1HB ALA 33 HB1 ALA 33 9.568 0.302 14.905 241 2HB ALA 33 HB2 ALA 33 8.786 -1.104 14.182 242 3HB ALA 33 HB3 ALA 33 10.536 -0.914 14.072 243 H LEU 34 HN LEU 34 12.025 -2.923 15.837 244 HA LEU 34 HA LEU 34 10.993 -5.192 14.667 245 1HB LEU 34 HB2 LEU 34 13.303 -4.361 14.449 246 2HB LEU 34 HB1 LEU 34 13.498 -4.540 16.180 247 HG LEU 34 HG LEU 34 13.418 -6.806 16.054 248 1HD1 LEU 34 HD11 LEU 34 13.344 -8.019 13.805 249 2HD1 LEU 34 HD12 LEU 34 13.091 -6.455 13.028 250 3HD1 LEU 34 HD13 LEU 34 11.864 -7.109 14.112 251 1HD2 LEU 34 HD21 LEU 34 15.481 -7.257 14.742 252 2HD2 LEU 34 HD22 LEU 34 15.559 -5.813 15.754 253 3HD2 LEU 34 HD23 LEU 34 15.301 -5.661 14.017 254 H LYS 35 HN LYS 35 11.853 -4.179 17.963 255 HA LYS 35 HA LYS 35 11.204 -6.517 19.374 256 1HB LYS 35 HB2 LYS 35 11.000 -3.622 20.179 257 2HB LYS 35 HB1 LYS 35 10.786 -4.965 21.282 258 1HG LYS 35 HG2 LYS 35 13.319 -4.454 19.736 259 2HG LYS 35 HG1 LYS 35 12.988 -3.854 21.364 260 1HD LYS 35 HD2 LYS 35 12.702 -6.187 22.125 261 2HD LYS 35 HD1 LYS 35 13.154 -6.735 20.509 262 1HE LYS 35 HE2 LYS 35 15.333 -5.767 20.702 263 2HE LYS 35 HE1 LYS 35 14.898 -4.954 22.201 264 1HZ LYS 35 HZ1 LYS 35 14.735 -7.116 23.286 265 2HZ LYS 35 HZ2 LYS 35 16.239 -6.925 22.590 266 3HZ LYS 35 HZ3 LYS 35 15.121 -7.917 21.864 267 H GLU 36 HN GLU 36 9.238 -3.697 18.464 268 HA GLU 36 HA GLU 36 6.844 -4.401 19.676 269 1HB GLU 36 HB2 GLU 36 7.333 -2.932 17.087 270 2HB GLU 36 HB1 GLU 36 5.780 -2.982 17.891 271 1HG GLU 36 HG2 GLU 36 8.314 -1.796 18.993 272 2HG GLU 36 HG1 GLU 36 6.943 -0.903 18.336 273 H THR 37 HN THR 37 8.136 -5.275 16.535 274 HA THR 37 HA THR 37 5.927 -6.797 15.679 275 HB THR 37 HB THR 37 8.841 -6.991 14.855 276 HG1 THR 37 HG1 THR 37 8.175 -4.927 14.403 277 1HG2 THR 37 HG21 THR 37 7.498 -8.925 14.135 278 2HG2 THR 37 HG22 THR 37 7.944 -7.921 12.753 279 3HG2 THR 37 HG23 THR 37 6.308 -7.841 13.415 280 H VAL 38 HN VAL 38 8.870 -7.585 17.456 281 HA VAL 38 HA VAL 38 8.682 -10.370 17.547 282 HB VAL 38 HB VAL 38 9.931 -8.355 19.452 283 1HG1 VAL 38 HG11 VAL 38 9.349 -10.378 20.719 284 2HG1 VAL 38 HG12 VAL 38 11.074 -10.115 20.549 285 3HG1 VAL 38 HG13 VAL 38 10.274 -11.357 19.559 286 1HG2 VAL 38 HG21 VAL 38 10.971 -8.548 17.267 287 2HG2 VAL 38 HG22 VAL 38 11.116 -10.292 17.480 288 3HG2 VAL 38 HG23 VAL 38 12.025 -9.199 18.523 289 H ILE 39 HN ILE 39 7.589 -7.951 19.823 290 HA ILE 39 HA ILE 39 6.445 -9.746 21.687 291 HB ILE 39 HB ILE 39 5.690 -6.820 21.274 292 1HG1 ILE 39 HG12 ILE 39 7.839 -8.087 22.987 293 2HG1 ILE 39 HG11 ILE 39 8.099 -7.085 21.569 294 1HG2 ILE 39 HG21 ILE 39 5.039 -6.871 23.637 295 2HG2 ILE 39 HG22 ILE 39 5.498 -8.552 23.746 296 3HG2 ILE 39 HG23 ILE 39 4.111 -8.085 22.739 297 1HD1 ILE 39 HD11 ILE 39 6.867 -6.203 24.163 298 2HD1 ILE 39 HD12 ILE 39 7.180 -5.165 22.759 299 3HD1 ILE 39 HD13 ILE 39 8.517 -5.910 23.637 300 H SER 40 HN SER 40 5.146 -8.158 18.878 301 HA SER 40 HA SER 40 2.432 -8.917 19.342 302 1HB SER 40 HB2 SER 40 3.763 -7.931 16.819 303 2HB SER 40 HB1 SER 40 2.022 -8.015 17.111 304 HG SER 40 HG SER 40 3.941 -6.282 18.138 305 H GLU 41 HN GLU 41 5.104 -10.302 17.364 306 HA GLU 41 HA GLU 41 3.381 -12.179 16.159 307 1HB GLU 41 HB2 GLU 41 6.297 -11.637 16.085 308 2HB GLU 41 HB1 GLU 41 5.597 -13.045 15.310 309 1HG GLU 41 HG2 GLU 41 4.875 -10.173 14.752 310 2HG GLU 41 HG1 GLU 41 5.884 -11.201 13.731 311 H TRP 42 HN TRP 42 5.386 -12.178 18.999 312 HA TRP 42 HA TRP 42 5.670 -14.995 19.141 313 1HB TRP 42 HB2 TRP 42 7.006 -13.164 20.381 314 2HB TRP 42 HB1 TRP 42 5.644 -13.094 21.484 315 HD1 TRP 42 HD1 TRP 42 5.988 -14.606 23.607 316 HE1 TRP 42 HE1 TRP 42 7.468 -16.658 24.157 317 HE3 TRP 42 HE3 TRP 42 7.941 -15.456 18.984 318 HZ2 TRP 42 HZ2 TRP 42 9.152 -18.447 22.774 319 HZ3 TRP 42 HZ3 TRP 42 9.443 -17.352 18.662 320 HH2 TRP 42 HH2 TRP 42 10.050 -18.819 20.513 321 HA PRO 43 HA PRO 43 1.462 -16.272 19.768 322 1HB PRO 43 HB2 PRO 43 2.881 -17.985 21.767 323 2HB PRO 43 HB1 PRO 43 1.583 -18.431 20.650 324 1HG PRO 43 HG2 PRO 43 4.094 -19.016 20.038 325 2HG PRO 43 HG1 PRO 43 2.999 -18.396 18.792 326 1HD PRO 43 HD2 PRO 43 5.266 -17.042 20.145 327 2HD PRO 43 HD1 PRO 43 4.575 -16.762 18.535 328 H ARG 44 HN ARG 44 0.032 -15.225 20.836 329 HA ARG 44 HA ARG 44 0.537 -13.657 23.143 330 1HB ARG 44 HB2 ARG 44 -1.082 -13.087 21.371 331 2HB ARG 44 HB1 ARG 44 -2.090 -14.430 21.879 332 1HG ARG 44 HG2 ARG 44 -2.410 -13.346 24.055 333 2HG ARG 44 HG1 ARG 44 -1.413 -11.995 23.513 334 1HD ARG 44 HD2 ARG 44 -4.011 -12.906 22.287 335 2HD ARG 44 HD1 ARG 44 -3.774 -11.467 23.274 336 HE ARG 44 HE ARG 44 -2.038 -11.448 21.030 337 1HH1 ARG 44 HH11 ARG 44 -5.404 -10.907 21.923 338 2HH1 ARG 44 HH12 ARG 44 -5.719 -9.844 20.633 339 1HH2 ARG 44 HH21 ARG 44 -2.474 -10.024 19.251 340 2HH2 ARG 44 HH22 ARG 44 -4.029 -9.342 19.077 341 H GLU 45 HN GLU 45 -0.604 -16.818 22.628 342 HA GLU 45 HA GLU 45 -1.926 -17.345 25.079 343 1HB GLU 45 HB2 GLU 45 -2.146 -18.717 23.052 344 2HB GLU 45 HB1 GLU 45 -0.469 -19.210 23.206 345 1HG GLU 45 HG2 GLU 45 -1.033 -20.270 25.375 346 2HG GLU 45 HG1 GLU 45 -2.723 -19.858 25.092 347 H LYS 46 HN LYS 46 1.507 -17.120 24.211 348 HA LYS 46 HA LYS 46 2.295 -18.733 26.370 349 1HB LYS 46 HB2 LYS 46 3.745 -17.181 24.281 350 2HB LYS 46 HB1 LYS 46 4.561 -18.094 25.531 351 1HG LYS 46 HG2 LYS 46 3.409 -20.121 24.756 352 2HG LYS 46 HG1 LYS 46 2.660 -19.189 23.463 353 1HD LYS 46 HD2 LYS 46 4.921 -18.699 22.588 354 2HD LYS 46 HD1 LYS 46 5.603 -19.703 23.870 355 1HE LYS 46 HE2 LYS 46 3.708 -20.609 21.699 356 2HE LYS 46 HE1 LYS 46 5.424 -20.992 21.813 357 1HZ LYS 46 HZ1 LYS 46 4.959 -22.201 23.877 358 2HZ LYS 46 HZ2 LYS 46 4.083 -22.818 22.592 359 3HZ LYS 46 HZ3 LYS 46 3.308 -21.880 23.730 360 H GLU 47 HN GLU 47 1.497 -17.641 28.142 361 HA GLU 47 HA GLU 47 2.466 -15.057 28.732 362 1HB GLU 47 HB2 GLU 47 1.142 -17.069 30.544 363 2HB GLU 47 HB1 GLU 47 1.386 -15.375 30.905 364 1HG GLU 47 HG2 GLU 47 -0.101 -14.756 29.065 365 2HG GLU 47 HG1 GLU 47 -0.377 -16.466 28.722 366 H ASN 48 HN ASN 48 3.965 -14.675 30.463 367 HA ASN 48 HA ASN 48 5.934 -14.930 31.599 368 1HB ASN 48 HB2 ASN 48 4.535 -16.508 32.990 369 2HB ASN 48 HB1 ASN 48 5.056 -17.825 31.951 370 1HD2 ASN 48 HD21 ASN 48 6.007 -18.941 33.641 371 2HD2 ASN 48 HD22 ASN 48 7.467 -18.435 34.389 372 H GLY 49 HN GLY 49 5.664 -15.587 28.715 373 1HA GLY 49 HA2 GLY 49 7.960 -17.370 28.373 374 2HA GLY 49 HA1 GLY 49 6.769 -16.993 27.127 375 HA PRO 50 HA PRO 50 10.441 -14.068 26.801 376 1HB PRO 50 HB2 PRO 50 11.477 -14.953 24.451 377 2HB PRO 50 HB1 PRO 50 11.842 -15.693 26.024 378 1HG PRO 50 HG2 PRO 50 9.852 -16.608 24.011 379 2HG PRO 50 HG1 PRO 50 11.141 -17.536 24.803 380 1HD PRO 50 HD2 PRO 50 8.611 -17.577 25.675 381 2HD PRO 50 HD1 PRO 50 9.984 -17.668 26.799 382 H LYS 51 HN LYS 51 8.628 -12.625 26.520 383 HA LYS 51 HA LYS 51 7.741 -12.448 23.723 384 1HB LYS 51 HB2 LYS 51 6.091 -13.420 25.333 385 2HB LYS 51 HB1 LYS 51 6.072 -11.878 26.157 386 1HG LYS 51 HG2 LYS 51 5.175 -10.799 24.173 387 2HG LYS 51 HG1 LYS 51 5.251 -12.330 23.295 388 1HD LYS 51 HD2 LYS 51 3.732 -13.322 24.985 389 2HD LYS 51 HD1 LYS 51 3.584 -11.735 25.737 390 1HE LYS 51 HE2 LYS 51 2.782 -12.479 22.930 391 2HE LYS 51 HE1 LYS 51 1.694 -12.186 24.282 392 1HZ LYS 51 HZ1 LYS 51 1.809 -10.261 22.867 393 2HZ LYS 51 HZ2 LYS 51 3.466 -10.176 22.991 394 3HZ LYS 51 HZ3 LYS 51 2.492 -9.888 24.352 395 H THR 52 HN THR 52 8.771 -10.665 26.582 396 HA THR 52 HA THR 52 8.078 -8.203 25.239 397 HB THR 52 HB THR 52 8.574 -7.039 27.294 398 HG1 THR 52 HG1 THR 52 8.882 -9.536 28.603 399 1HG2 THR 52 HG21 THR 52 6.805 -9.453 27.700 400 2HG2 THR 52 HG22 THR 52 6.333 -7.915 26.979 401 3HG2 THR 52 HG23 THR 52 6.769 -7.992 28.686 402 H VAL 53 HN VAL 53 9.710 -6.329 25.755 403 HA VAL 53 HA VAL 53 11.681 -6.548 23.838 404 HB VAL 53 HB VAL 53 11.519 -4.518 26.079 405 1HG1 VAL 53 HG11 VAL 53 13.730 -4.476 25.095 406 2HG1 VAL 53 HG12 VAL 53 12.826 -3.034 24.634 407 3HG1 VAL 53 HG13 VAL 53 13.031 -4.354 23.481 408 1HG2 VAL 53 HG21 VAL 53 10.435 -4.451 23.266 409 2HG2 VAL 53 HG22 VAL 53 10.448 -3.092 24.378 410 3HG2 VAL 53 HG23 VAL 53 9.494 -4.526 24.760 411 H LYS 54 HN LYS 54 12.072 -6.769 27.344 412 HA LYS 54 HA LYS 54 14.947 -6.720 27.152 413 1HB LYS 54 HB2 LYS 54 13.398 -7.564 29.605 414 2HB LYS 54 HB1 LYS 54 15.050 -7.037 29.524 415 1HG LYS 54 HG2 LYS 54 13.952 -5.210 30.456 416 2HG LYS 54 HG1 LYS 54 14.089 -4.763 28.755 417 1HD LYS 54 HD2 LYS 54 11.868 -4.227 29.613 418 2HD LYS 54 HD1 LYS 54 11.751 -5.502 28.402 419 1HE LYS 54 HE2 LYS 54 11.597 -7.192 30.197 420 2HE LYS 54 HE1 LYS 54 11.753 -5.914 31.402 421 1HZ LYS 54 HZ1 LYS 54 9.649 -5.016 30.621 422 2HZ LYS 54 HZ2 LYS 54 9.500 -6.588 31.149 423 3HZ LYS 54 HZ3 LYS 54 9.497 -6.266 29.490 424 H GLU 55 HN GLU 55 12.516 -9.155 27.225 425 HA GLU 55 HA GLU 55 14.293 -11.180 28.268 426 1HB GLU 55 HB2 GLU 55 11.513 -11.541 27.173 427 2HB GLU 55 HB1 GLU 55 12.395 -12.632 28.231 428 1HG GLU 55 HG2 GLU 55 11.334 -9.898 28.925 429 2HG GLU 55 HG1 GLU 55 10.737 -11.441 29.512 430 H VAL 56 HN VAL 56 12.981 -10.219 25.194 431 HA VAL 56 HA VAL 56 14.116 -12.563 23.876 432 HB VAL 56 HB VAL 56 12.615 -10.233 22.674 433 1HG1 VAL 56 HG11 VAL 56 13.296 -12.937 21.570 434 2HG1 VAL 56 HG12 VAL 56 14.000 -11.400 21.070 435 3HG1 VAL 56 HG13 VAL 56 12.296 -11.739 20.755 436 1HG2 VAL 56 HG21 VAL 56 10.678 -11.726 22.589 437 2HG2 VAL 56 HG22 VAL 56 11.197 -11.417 24.248 438 3HG2 VAL 56 HG23 VAL 56 11.592 -12.949 23.469 439 H LYS 57 HN LYS 57 16.206 -12.420 23.305 440 HA LYS 57 HA LYS 57 17.225 -9.795 22.593 441 1HB LYS 57 HB2 LYS 57 18.607 -12.325 23.435 442 2HB LYS 57 HB1 LYS 57 19.474 -10.939 22.783 443 1HG LYS 57 HG2 LYS 57 18.687 -9.559 24.604 444 2HG LYS 57 HG1 LYS 57 17.715 -10.895 25.224 445 1HD LYS 57 HD2 LYS 57 19.711 -12.173 25.685 446 2HD LYS 57 HD1 LYS 57 20.710 -10.922 24.941 447 1HE LYS 57 HE2 LYS 57 20.092 -9.343 26.650 448 2HE LYS 57 HE1 LYS 57 18.951 -10.490 27.347 449 1HZ LYS 57 HZ1 LYS 57 21.103 -10.324 28.518 450 2HZ LYS 57 HZ2 LYS 57 21.876 -11.049 27.197 451 3HZ LYS 57 HZ3 LYS 57 20.658 -11.855 28.047 452 H LEU 58 HN LEU 58 17.759 -9.304 20.602 453 HA LEU 58 HA LEU 58 17.233 -11.353 18.587 454 1HB LEU 58 HB2 LEU 58 15.928 -9.118 18.803 455 2HB LEU 58 HB1 LEU 58 17.380 -8.352 18.221 456 HG LEU 58 HG LEU 58 15.708 -8.576 16.455 457 1HD1 LEU 58 HD11 LEU 58 17.066 -9.635 14.744 458 2HD1 LEU 58 HD12 LEU 58 17.971 -10.503 15.975 459 3HD1 LEU 58 HD13 LEU 58 18.127 -8.758 15.856 460 1HD2 LEU 58 HD21 LEU 58 14.540 -10.523 17.294 461 2HD2 LEU 58 HD22 LEU 58 15.933 -11.546 16.931 462 3HD2 LEU 58 HD23 LEU 58 15.044 -10.772 15.623 463 H ILE 59 HN ILE 59 18.950 -12.142 17.523 464 HA ILE 59 HA ILE 59 21.556 -10.739 17.621 465 HB ILE 59 HB ILE 59 20.809 -13.651 17.716 466 1HG1 ILE 59 HG12 ILE 59 20.880 -12.230 19.800 467 2HG1 ILE 59 HG11 ILE 59 21.899 -13.693 19.851 468 1HG2 ILE 59 HG21 ILE 59 23.191 -14.209 17.646 469 2HG2 ILE 59 HG22 ILE 59 23.564 -12.522 17.286 470 3HG2 ILE 59 HG23 ILE 59 22.629 -13.479 16.141 471 1HD1 ILE 59 HD11 ILE 59 22.724 -10.830 19.414 472 2HD1 ILE 59 HD12 ILE 59 23.805 -12.219 19.358 473 3HD1 ILE 59 HD13 ILE 59 22.980 -11.813 20.856 474 H SER 60 HN SER 60 22.295 -10.040 15.814 475 HA SER 60 HA SER 60 21.797 -11.565 13.359 476 1HB SER 60 HB2 SER 60 22.016 -9.429 12.139 477 2HB SER 60 HB1 SER 60 20.653 -9.381 13.262 478 HG SER 60 HG SER 60 23.062 -8.547 14.291 479 H ALA 61 HN ALA 61 23.621 -12.499 12.734 480 HA ALA 61 HA ALA 61 25.777 -13.016 12.340 481 1HB ALA 61 HB1 ALA 61 25.820 -10.853 11.135 482 2HB ALA 61 HB2 ALA 61 27.383 -11.222 11.861 483 3HB ALA 61 HB3 ALA 61 26.312 -10.050 12.625 484 H GLY 62 HN GLY 62 24.708 -12.627 15.086 485 1HA GLY 62 HA2 GLY 62 25.670 -13.549 17.080 486 2HA GLY 62 HA1 GLY 62 27.254 -13.065 16.494 487 H LYS 63 HN LYS 63 25.213 -10.412 15.993 488 HA LYS 63 HA LYS 63 26.167 -9.219 18.426 489 1HB LYS 63 HB2 LYS 63 25.388 -8.131 15.738 490 2HB LYS 63 HB1 LYS 63 25.677 -7.140 17.142 491 1HG LYS 63 HG2 LYS 63 27.632 -7.066 15.764 492 2HG LYS 63 HG1 LYS 63 28.041 -8.048 17.166 493 1HD LYS 63 HD2 LYS 63 27.614 -10.073 15.799 494 2HD LYS 63 HD1 LYS 63 27.304 -9.032 14.407 495 1HE LYS 63 HE2 LYS 63 29.897 -9.256 15.945 496 2HE LYS 63 HE1 LYS 63 29.560 -9.912 14.348 497 1HZ LYS 63 HZ1 LYS 63 29.610 -7.015 15.044 498 2HZ LYS 63 HZ2 LYS 63 29.288 -7.636 13.520 499 3HZ LYS 63 HZ3 LYS 63 30.795 -7.850 14.198 500 H VAL 64 HN VAL 64 24.719 -8.270 19.771 501 HA VAL 64 HA VAL 64 21.950 -8.957 19.506 502 HB VAL 64 HB VAL 64 23.287 -7.086 21.492 503 1HG1 VAL 64 HG11 VAL 64 21.349 -7.536 22.930 504 2HG1 VAL 64 HG12 VAL 64 20.625 -8.488 21.631 505 3HG1 VAL 64 HG13 VAL 64 20.895 -6.759 21.411 506 1HG2 VAL 64 HG21 VAL 64 24.285 -9.315 21.621 507 2HG2 VAL 64 HG22 VAL 64 22.676 -10.022 21.800 508 3HG2 VAL 64 HG23 VAL 64 23.319 -8.967 23.055 509 H LEU 65 HN LEU 65 20.463 -7.665 18.465 510 HA LEU 65 HA LEU 65 21.227 -5.065 17.614 511 1HB LEU 65 HB2 LEU 65 18.615 -6.538 17.442 512 2HB LEU 65 HB1 LEU 65 18.864 -4.930 16.809 513 HG LEU 65 HG LEU 65 20.153 -7.480 15.865 514 1HD1 LEU 65 HD11 LEU 65 18.983 -7.007 13.783 515 2HD1 LEU 65 HD12 LEU 65 18.376 -5.501 14.453 516 3HD1 LEU 65 HD13 LEU 65 17.803 -7.024 15.102 517 1HD2 LEU 65 HD21 LEU 65 20.636 -4.653 14.952 518 2HD2 LEU 65 HD22 LEU 65 21.224 -6.106 14.144 519 3HD2 LEU 65 HD23 LEU 65 21.798 -5.711 15.759 520 H GLU 66 HN GLU 66 21.298 -3.508 18.864 521 HA GLU 66 HA GLU 66 19.995 -3.472 21.400 522 1HB GLU 66 HB2 GLU 66 21.672 -1.383 20.016 523 2HB GLU 66 HB1 GLU 66 21.160 -1.316 21.697 524 1HG GLU 66 HG2 GLU 66 22.420 -3.349 22.172 525 2HG GLU 66 HG1 GLU 66 22.905 -3.448 20.482 526 H ASN 67 HN ASN 67 18.287 -2.364 22.042 527 HA ASN 67 HA ASN 67 16.177 -1.982 20.329 528 1HB ASN 67 HB2 ASN 67 15.975 -2.418 22.727 529 2HB ASN 67 HB1 ASN 67 16.531 -0.789 23.080 530 1HD2 ASN 67 HD21 ASN 67 14.659 -0.282 24.175 531 2HD2 ASN 67 HD22 ASN 67 13.141 -0.045 23.379 532 H SER 68 HN SER 68 18.492 0.515 21.335 533 HA SER 68 HA SER 68 16.729 2.557 20.263 534 1HB SER 68 HB2 SER 68 19.367 2.874 21.690 535 2HB SER 68 HB1 SER 68 18.288 4.179 21.200 536 HG SER 68 HG SER 68 16.973 2.267 22.558 537 H LYS 69 HN LYS 69 18.797 0.603 18.643 538 HA LYS 69 HA LYS 69 19.498 2.772 16.871 539 1HB LYS 69 HB2 LYS 69 21.283 1.274 16.090 540 2HB LYS 69 HB1 LYS 69 21.568 1.987 17.685 541 1HG LYS 69 HG2 LYS 69 20.769 -0.209 18.613 542 2HG LYS 69 HG1 LYS 69 20.731 -0.823 16.965 543 1HD LYS 69 HD2 LYS 69 22.799 -1.468 18.134 544 2HD LYS 69 HD1 LYS 69 23.138 -0.436 16.742 545 1HE LYS 69 HE2 LYS 69 23.453 1.466 18.212 546 2HE LYS 69 HE1 LYS 69 22.971 0.498 19.607 547 1HZ LYS 69 HZ1 LYS 69 24.894 -0.848 19.351 548 2HZ LYS 69 HZ2 LYS 69 25.398 0.759 19.370 549 3HZ LYS 69 HZ3 LYS 69 25.336 -0.078 17.920 550 H THR 70 HN THR 70 19.784 1.968 14.487 551 HA THR 70 HA THR 70 17.484 0.354 13.944 552 HB THR 70 HB THR 70 17.619 1.366 11.778 553 HG1 THR 70 HG1 THR 70 19.200 2.886 11.306 554 1HG2 THR 70 HG21 THR 70 17.156 3.724 12.383 555 2HG2 THR 70 HG22 THR 70 17.813 3.408 13.990 556 3HG2 THR 70 HG23 THR 70 16.357 2.573 13.451 557 H VAL 71 HN VAL 71 17.703 -1.022 11.920 558 HA VAL 71 HA VAL 71 19.768 -2.921 12.322 559 HB VAL 71 HB VAL 71 17.991 -2.558 9.878 560 1HG1 VAL 71 HG11 VAL 71 19.883 -4.014 9.412 561 2HG1 VAL 71 HG12 VAL 71 18.386 -4.947 9.461 562 3HG1 VAL 71 HG13 VAL 71 19.499 -4.993 10.827 563 1HG2 VAL 71 HG21 VAL 71 16.528 -4.249 10.903 564 2HG2 VAL 71 HG22 VAL 71 16.651 -2.798 11.899 565 3HG2 VAL 71 HG23 VAL 71 17.551 -4.250 12.340 566 H LYS 72 HN LYS 72 19.363 -0.238 10.219 567 HA LYS 72 HA LYS 72 21.361 -0.563 8.343 568 1HB LYS 72 HB2 LYS 72 19.537 1.092 8.237 569 2HB LYS 72 HB1 LYS 72 20.282 1.975 9.552 570 1HG LYS 72 HG2 LYS 72 21.698 1.531 6.941 571 2HG LYS 72 HG1 LYS 72 20.545 2.839 7.158 572 1HD LYS 72 HD2 LYS 72 21.925 3.710 9.006 573 2HD LYS 72 HD1 LYS 72 23.054 2.376 8.784 574 1HE LYS 72 HE2 LYS 72 23.555 3.178 6.522 575 2HE LYS 72 HE1 LYS 72 22.414 4.506 6.743 576 1HZ LYS 72 HZ1 LYS 72 24.872 4.084 8.368 577 2HZ LYS 72 HZ2 LYS 72 23.789 5.353 8.531 578 3HZ LYS 72 HZ3 LYS 72 24.701 5.219 7.141 579 H ASP 73 HN ASP 73 21.602 0.508 11.673 580 HA ASP 73 HA ASP 73 24.159 1.707 11.511 581 1HB ASP 73 HB2 ASP 73 22.593 1.938 13.469 582 2HB ASP 73 HB1 ASP 73 22.990 0.284 13.917 583 H TYR 74 HN TYR 74 23.143 -1.634 12.031 584 HA TYR 74 HA TYR 74 25.873 -2.550 12.276 585 1HB TYR 74 HB2 TYR 74 23.218 -3.934 12.340 586 2HB TYR 74 HB1 TYR 74 24.715 -4.827 12.213 587 HD1 TYR 74 HD1 TYR 74 22.501 -2.964 14.422 588 HD2 TYR 74 HD2 TYR 74 26.295 -4.841 14.087 589 HE1 TYR 74 HE1 TYR 74 22.682 -3.035 16.873 590 HE2 TYR 74 HE2 TYR 74 26.493 -4.910 16.524 591 HH TYR 74 HH TYR 74 23.923 -4.451 18.589 592 H ARG 75 HN ARG 75 23.408 -2.256 9.735 593 HA ARG 75 HA ARG 75 24.468 -4.258 8.131 594 1HB ARG 75 HB2 ARG 75 22.176 -3.419 8.348 595 2HB ARG 75 HB1 ARG 75 22.667 -1.959 7.493 596 1HG ARG 75 HG2 ARG 75 21.623 -3.362 6.027 597 2HG ARG 75 HG1 ARG 75 23.379 -3.405 5.664 598 1HD ARG 75 HD2 ARG 75 23.589 -5.532 6.873 599 2HD ARG 75 HD1 ARG 75 21.887 -5.458 7.318 600 HE ARG 75 HE ARG 75 22.309 -5.484 4.499 601 1HH1 ARG 75 HH11 ARG 75 21.977 -7.513 7.390 602 2HH1 ARG 75 HH12 ARG 75 21.600 -8.917 6.516 603 1HH2 ARG 75 HH21 ARG 75 21.777 -7.399 3.333 604 2HH2 ARG 75 HH22 ARG 75 21.486 -8.877 4.164 605 H SER 76 HN SER 76 26.504 -3.907 7.464 606 HA SER 76 HA SER 76 27.294 -1.316 6.445 607 1HB SER 76 HB2 SER 76 28.874 -3.829 6.977 608 2HB SER 76 HB1 SER 76 29.518 -2.253 6.522 609 HG SER 76 HG SER 76 28.019 -1.749 8.540 610 HA PRO 77 HA PRO 77 26.842 -3.026 2.340 611 1HB PRO 77 HB2 PRO 77 28.707 -1.162 1.237 612 2HB PRO 77 HB1 PRO 77 26.947 -1.182 1.086 613 1HG PRO 77 HG2 PRO 77 28.325 0.745 2.500 614 2HG PRO 77 HG1 PRO 77 26.653 0.283 2.837 615 1HD PRO 77 HD2 PRO 77 29.160 -0.529 4.237 616 2HD PRO 77 HD1 PRO 77 27.550 -0.168 4.904 617 H VAL 78 HN VAL 78 27.767 -4.832 2.082 618 HA VAL 78 HA VAL 78 30.641 -4.952 1.419 619 HB VAL 78 HB VAL 78 30.189 -6.066 3.605 620 1HG1 VAL 78 HG11 VAL 78 27.926 -6.790 3.269 621 2HG1 VAL 78 HG12 VAL 78 28.930 -8.171 3.706 622 3HG1 VAL 78 HG13 VAL 78 28.438 -7.930 2.028 623 1HG2 VAL 78 HG21 VAL 78 32.062 -6.878 2.289 624 2HG2 VAL 78 HG22 VAL 78 31.003 -7.985 1.421 625 3HG2 VAL 78 HG23 VAL 78 31.304 -8.223 3.141 626 H SER 79 HN SER 79 27.516 -5.509 0.585 627 HA SER 79 HA SER 79 28.125 -6.323 -2.075 628 1HB SER 79 HB2 SER 79 26.644 -8.362 -1.959 629 2HB SER 79 HB1 SER 79 28.159 -8.522 -1.068 630 HG SER 79 HG SER 79 25.907 -7.554 0.281 631 H ASN 80 HN ASN 80 26.872 -4.869 -3.090 632 HA ASN 80 HA ASN 80 24.538 -3.887 -1.748 633 1HB ASN 80 HB2 ASN 80 25.679 -3.085 -4.431 634 2HB ASN 80 HB1 ASN 80 24.231 -2.368 -3.735 635 1HD2 ASN 80 HD21 ASN 80 27.697 -2.554 -3.577 636 2HD2 ASN 80 HD22 ASN 80 27.889 -1.284 -2.427 637 H LEU 81 HN LEU 81 22.991 -5.423 -1.564 638 HA LEU 81 HA LEU 81 22.064 -6.795 -3.837 639 1HB LEU 81 HB2 LEU 81 21.532 -6.748 -0.938 640 2HB LEU 81 HB1 LEU 81 20.855 -7.891 -2.060 641 HG LEU 81 HG LEU 81 23.755 -7.638 -1.236 642 1HD1 LEU 81 HD11 LEU 81 22.384 -8.678 0.452 643 2HD1 LEU 81 HD12 LEU 81 23.467 -9.861 -0.282 644 3HD1 LEU 81 HD13 LEU 81 21.761 -9.831 -0.729 645 1HD2 LEU 81 HD21 LEU 81 23.637 -8.271 -3.583 646 2HD2 LEU 81 HD22 LEU 81 22.513 -9.569 -3.195 647 3HD2 LEU 81 HD23 LEU 81 24.175 -9.636 -2.604 648 H ALA 82 HN ALA 82 19.505 -6.946 -3.587 649 HA ALA 82 HA ALA 82 18.404 -4.479 -2.717 650 1HB ALA 82 HB1 ALA 82 17.874 -5.605 -5.470 651 2HB ALA 82 HB2 ALA 82 18.808 -4.158 -5.113 652 3HB ALA 82 HB3 ALA 82 17.077 -4.196 -4.772 653 H GLY 83 HN GLY 83 17.287 -5.361 -1.104 654 1HA GLY 83 HA2 GLY 83 15.437 -6.382 -0.172 655 2HA GLY 83 HA1 GLY 83 15.044 -7.052 -1.750 656 H ALA 84 HN ALA 84 17.237 -7.375 0.957 657 HA ALA 84 HA ALA 84 17.883 -10.110 0.147 658 1HB ALA 84 HB1 ALA 84 19.754 -8.625 0.683 659 2HB ALA 84 HB2 ALA 84 19.662 -9.954 1.839 660 3HB ALA 84 HB3 ALA 84 19.085 -8.352 2.290 661 H VAL 85 HN VAL 85 17.698 -11.831 1.675 662 HA VAL 85 HA VAL 85 15.578 -11.372 3.658 663 HB VAL 85 HB VAL 85 16.593 -14.008 2.564 664 1HG1 VAL 85 HG11 VAL 85 14.167 -13.407 4.260 665 2HG1 VAL 85 HG12 VAL 85 15.625 -14.246 4.780 666 3HG1 VAL 85 HG13 VAL 85 14.567 -14.982 3.575 667 1HG2 VAL 85 HG21 VAL 85 14.476 -14.099 1.295 668 2HG2 VAL 85 HG22 VAL 85 15.500 -12.756 0.794 669 3HG2 VAL 85 HG23 VAL 85 14.104 -12.463 1.831 670 H THR 86 HN THR 86 15.998 -11.625 5.766 671 HA THR 86 HA THR 86 18.730 -12.406 6.466 672 HB THR 86 HB THR 86 17.107 -10.163 7.708 673 HG1 THR 86 HG1 THR 86 17.962 -9.966 5.470 674 1HG2 THR 86 HG21 THR 86 18.752 -11.204 9.222 675 2HG2 THR 86 HG22 THR 86 19.263 -9.578 8.757 676 3HG2 THR 86 HG23 THR 86 20.002 -10.986 7.999 677 H THR 87 HN THR 87 18.812 -13.948 7.960 678 HA THR 87 HA THR 87 16.412 -14.682 9.421 679 HB THR 87 HB THR 87 19.068 -16.095 9.077 680 HG1 THR 87 HG1 THR 87 17.831 -16.107 7.207 681 1HG2 THR 87 HG21 THR 87 18.026 -16.663 11.226 682 2HG2 THR 87 HG22 THR 87 17.957 -18.037 10.120 683 3HG2 THR 87 HG23 THR 87 16.517 -17.056 10.400 684 H MET 88 HN MET 88 16.212 -13.905 11.411 685 HA MET 88 HA MET 88 18.608 -12.984 12.801 686 1HB MET 88 HB2 MET 88 15.686 -12.450 13.309 687 2HB MET 88 HB1 MET 88 16.996 -11.864 14.318 688 1HG MET 88 HG2 MET 88 16.602 -11.207 11.419 689 2HG MET 88 HG1 MET 88 16.159 -10.152 12.766 690 1HE MET 88 HE1 MET 88 19.193 -8.239 11.300 691 2HE MET 88 HE2 MET 88 17.540 -8.122 11.905 692 3HE MET 88 HE3 MET 88 17.878 -9.047 10.442 693 H HIS 89 HN HIS 89 19.229 -13.868 14.678 694 HA HIS 89 HA HIS 89 17.819 -16.301 15.419 695 1HB HIS 89 HB2 HIS 89 20.569 -15.314 16.176 696 2HB HIS 89 HB1 HIS 89 19.835 -16.751 16.872 697 HD1 HIS 89 HD1 HIS 89 22.213 -15.965 14.426 698 HD2 HIS 89 HD2 HIS 89 18.909 -18.480 14.482 699 HE1 HIS 89 HE1 HIS 89 22.619 -17.654 12.626 700 HE2 HIS 89 HE2 HIS 89 20.771 -19.335 12.955 701 H VAL 90 HN VAL 90 16.590 -16.396 17.053 702 HA VAL 90 HA VAL 90 16.493 -14.124 18.922 703 HB VAL 90 HB VAL 90 14.529 -16.390 18.527 704 1HG1 VAL 90 HG11 VAL 90 12.974 -14.951 19.758 705 2HG1 VAL 90 HG12 VAL 90 14.253 -13.753 19.939 706 3HG1 VAL 90 HG13 VAL 90 14.409 -15.327 20.717 707 1HG2 VAL 90 HG21 VAL 90 13.111 -14.783 17.327 708 2HG2 VAL 90 HG22 VAL 90 14.629 -15.090 16.481 709 3HG2 VAL 90 HG23 VAL 90 14.415 -13.596 17.397 710 H ILE 91 HN ILE 91 17.297 -14.230 20.696 711 HA ILE 91 HA ILE 91 18.111 -16.783 21.867 712 HB ILE 91 HB ILE 91 18.808 -13.937 22.279 713 1HG1 ILE 91 HG12 ILE 91 19.886 -14.797 20.343 714 2HG1 ILE 91 HG11 ILE 91 21.111 -14.606 21.589 715 1HG2 ILE 91 HG21 ILE 91 20.540 -14.696 23.961 716 2HG2 ILE 91 HG22 ILE 91 19.909 -16.332 23.812 717 3HG2 ILE 91 HG23 ILE 91 18.892 -15.059 24.485 718 1HD1 ILE 91 HD11 ILE 91 21.031 -17.012 22.020 719 2HD1 ILE 91 HD12 ILE 91 21.444 -16.652 20.346 720 3HD1 ILE 91 HD13 ILE 91 19.821 -17.202 20.750 721 H ILE 92 HN ILE 92 16.966 -17.612 23.312 722 HA ILE 92 HA ILE 92 14.920 -15.995 24.592 723 HB ILE 92 HB ILE 92 15.082 -18.983 24.162 724 1HG1 ILE 92 HG12 ILE 92 12.818 -18.649 23.114 725 2HG1 ILE 92 HG11 ILE 92 13.038 -16.919 23.306 726 1HG2 ILE 92 HG21 ILE 92 14.334 -18.681 26.396 727 2HG2 ILE 92 HG22 ILE 92 12.977 -19.223 25.391 728 3HG2 ILE 92 HG23 ILE 92 13.107 -17.523 25.878 729 1HD1 ILE 92 HD11 ILE 92 13.496 -17.570 21.069 730 2HD1 ILE 92 HD12 ILE 92 14.678 -18.771 21.612 731 3HD1 ILE 92 HD13 ILE 92 14.994 -17.048 21.839 732 H GLN 93 HN GLN 93 15.591 -15.181 26.424 733 HA GLN 93 HA GLN 93 16.788 -17.041 28.274 734 1HB GLN 93 HB2 GLN 93 16.829 -14.004 28.291 735 2HB GLN 93 HB1 GLN 93 17.495 -15.017 29.569 736 1HG GLN 93 HG2 GLN 93 19.007 -16.048 27.889 737 2HG GLN 93 HG1 GLN 93 18.415 -14.883 26.715 738 1HE2 GLN 93 HE21 GLN 93 21.066 -15.338 27.749 739 2HE2 GLN 93 HE22 GLN 93 21.611 -13.860 28.448 740 H ALA 94 HN ALA 94 15.500 -17.826 29.576 741 HA ALA 94 HA ALA 94 12.739 -17.342 29.434 742 1HB ALA 94 HB1 ALA 94 12.483 -19.092 31.089 743 2HB ALA 94 HB2 ALA 94 14.200 -19.001 31.479 744 3HB ALA 94 HB3 ALA 94 13.685 -19.542 29.882 745 HA PRO 95 HA PRO 95 12.318 -14.052 32.488 746 1HB PRO 95 HB2 PRO 95 9.472 -14.645 31.954 747 2HB PRO 95 HB1 PRO 95 10.330 -13.104 31.837 748 1HG PRO 95 HG2 PRO 95 9.552 -14.403 29.646 749 2HG PRO 95 HG1 PRO 95 11.108 -13.557 29.704 750 1HD PRO 95 HD2 PRO 95 10.532 -16.474 29.940 751 2HD PRO 95 HD1 PRO 95 11.837 -15.625 29.080 752 H VAL 96 HN VAL 96 11.731 -14.138 34.666 753 HA VAL 96 HA VAL 96 10.829 -16.773 35.486 754 HB VAL 96 HB VAL 96 13.013 -16.201 36.391 755 1HG1 VAL 96 HG11 VAL 96 11.658 -13.896 37.770 756 2HG1 VAL 96 HG12 VAL 96 12.849 -13.786 36.476 757 3HG1 VAL 96 HG13 VAL 96 13.315 -14.431 38.052 758 1HG2 VAL 96 HG21 VAL 96 11.568 -17.660 37.696 759 2HG2 VAL 96 HG22 VAL 96 10.874 -16.264 38.521 760 3HG2 VAL 96 HG23 VAL 96 12.569 -16.676 38.758 761 H THR 97 HN THR 97 8.944 -17.062 36.190 762 HA THR 97 HA THR 97 7.695 -15.334 38.076 763 HB THR 97 HB THR 97 6.339 -15.976 35.420 764 HG1 THR 97 HG1 THR 97 7.876 -13.999 36.035 765 1HG2 THR 97 HG21 THR 97 4.420 -14.726 36.322 766 2HG2 THR 97 HG22 THR 97 5.276 -14.527 37.853 767 3HG2 THR 97 HG23 THR 97 4.789 -16.134 37.319 768 H GLU 98 HN GLU 98 6.907 -16.718 39.550 769 HA GLU 98 HA GLU 98 6.749 -19.504 38.714 770 1HB GLU 98 HB2 GLU 98 8.365 -18.892 40.469 771 2HB GLU 98 HB1 GLU 98 7.038 -18.335 41.471 772 1HG GLU 98 HG2 GLU 98 6.137 -20.606 41.519 773 2HG GLU 98 HG1 GLU 98 7.484 -21.143 40.512 774 H LYS 99 HN LYS 99 4.718 -20.039 38.155 775 HA LYS 99 HA LYS 99 2.762 -19.911 40.113 776 1HB LYS 99 HB2 LYS 99 1.056 -18.902 38.609 777 2HB LYS 99 HB1 LYS 99 2.294 -17.760 39.110 778 1HG LYS 99 HG2 LYS 99 3.408 -18.070 36.917 779 2HG LYS 99 HG1 LYS 99 2.098 -19.150 36.439 780 1HD LYS 99 HD2 LYS 99 1.781 -16.237 37.198 781 2HD LYS 99 HD1 LYS 99 1.800 -16.860 35.552 782 1HE LYS 99 HE2 LYS 99 -0.199 -18.179 36.021 783 2HE LYS 99 HE1 LYS 99 -0.226 -17.582 37.683 784 1HZ LYS 99 HZ1 LYS 99 -0.544 -15.962 35.219 785 2HZ LYS 99 HZ2 LYS 99 -0.502 -15.336 36.769 786 3HZ LYS 99 HZ3 LYS 99 -1.768 -16.366 36.314 787 H GLU 100 HN GLU 100 1.288 -21.606 39.805 788 HA GLU 100 HA GLU 100 1.255 -22.979 37.318 789 1HB GLU 100 HB2 GLU 100 1.910 -25.181 38.299 790 2HB GLU 100 HB1 GLU 100 3.222 -24.025 38.199 791 1HG GLU 100 HG2 GLU 100 2.910 -23.529 40.605 792 2HG GLU 100 HG1 GLU 100 1.685 -24.798 40.669 793 H LYS 101 HN LYS 101 -0.815 -22.397 37.297 794 HA LYS 101 HA LYS 101 -2.643 -24.126 38.654 795 1HB LYS 101 HB2 LYS 101 -2.177 -22.207 40.271 796 2HB LYS 101 HB1 LYS 101 -2.807 -21.106 39.073 797 1HG LYS 101 HG2 LYS 101 -4.404 -23.318 40.385 798 2HG LYS 101 HG1 LYS 101 -4.379 -21.653 40.946 799 1HD LYS 101 HD2 LYS 101 -5.329 -22.600 38.243 800 2HD LYS 101 HD1 LYS 101 -6.375 -22.188 39.604 801 1HE LYS 101 HE2 LYS 101 -5.519 -19.881 39.545 802 2HE LYS 101 HE1 LYS 101 -4.476 -20.309 38.190 803 1HZ LYS 101 HZ1 LYS 101 -7.431 -20.375 38.200 804 2HZ LYS 101 HZ2 LYS 101 -6.462 -20.839 36.906 805 3HZ LYS 101 HZ3 LYS 101 -6.469 -19.230 37.420 Start of MODEL 15 1 H GLU 1 HT1 GLU 1 0.815 -8.663 -4.996 2 HA GLU 1 HA GLU 1 0.397 -6.636 -6.233 3 1HB GLU 1 HB2 GLU 1 2.796 -6.552 -4.392 4 2HB GLU 1 HB1 GLU 1 1.894 -5.140 -4.927 5 1HG GLU 1 HG2 GLU 1 0.752 -7.424 -3.346 6 2HG GLU 1 HG1 GLU 1 1.255 -5.871 -2.681 7 H ALA 2 HN ALA 2 1.178 -4.967 -7.559 8 HA ALA 2 HA ALA 2 3.048 -5.833 -9.520 9 1HB ALA 2 HB1 ALA 2 1.068 -4.495 -10.108 10 2HB ALA 2 HB2 ALA 2 2.555 -3.712 -10.636 11 3HB ALA 2 HB3 ALA 2 1.720 -3.137 -9.191 12 H GLU 3 HN GLU 3 5.051 -5.965 -8.899 13 HA GLU 3 HA GLU 3 7.150 -5.472 -8.332 14 1HB GLU 3 HB2 GLU 3 7.079 -3.554 -9.814 15 2HB GLU 3 HB1 GLU 3 6.293 -2.580 -8.579 16 1HG GLU 3 HG2 GLU 3 8.296 -2.734 -7.174 17 2HG GLU 3 HG1 GLU 3 9.083 -3.713 -8.403 18 H VAL 4 HN VAL 4 7.831 -6.055 -6.455 19 HA VAL 4 HA VAL 4 6.961 -4.500 -4.137 20 HB VAL 4 HB VAL 4 7.945 -7.344 -4.180 21 1HG1 VAL 4 HG11 VAL 4 7.142 -7.462 -1.856 22 2HG1 VAL 4 HG12 VAL 4 6.722 -5.753 -1.939 23 3HG1 VAL 4 HG13 VAL 4 8.408 -6.253 -2.075 24 1HG2 VAL 4 HG21 VAL 4 5.110 -6.350 -3.897 25 2HG2 VAL 4 HG22 VAL 4 5.618 -8.022 -3.678 26 3HG2 VAL 4 HG23 VAL 4 5.768 -7.257 -5.259 27 H HIS 5 HN HIS 5 8.483 -3.686 -2.944 28 HA HIS 5 HA HIS 5 11.301 -4.030 -3.738 29 1HB HIS 5 HB2 HIS 5 10.011 -1.874 -2.014 30 2HB HIS 5 HB1 HIS 5 11.719 -1.967 -2.389 31 HD1 HIS 5 HD1 HIS 5 8.431 -0.922 -3.809 32 HD2 HIS 5 HD2 HIS 5 12.409 -1.111 -5.005 33 HE1 HIS 5 HE1 HIS 5 8.575 0.451 -5.901 34 HE2 HIS 5 HE2 HIS 5 11.008 0.443 -6.521 35 H ASN 6 HN ASN 6 12.391 -5.440 -2.486 36 HA ASN 6 HA ASN 6 11.230 -6.116 0.072 37 1HB ASN 6 HB2 ASN 6 13.583 -7.373 -1.365 38 2HB ASN 6 HB1 ASN 6 13.009 -7.868 0.215 39 1HD2 ASN 6 HD21 ASN 6 12.494 -9.943 -0.395 40 2HD2 ASN 6 HD22 ASN 6 11.207 -10.316 -1.469 41 H GLN 7 HN GLN 7 11.800 -5.271 1.862 42 HA GLN 7 HA GLN 7 14.160 -3.675 2.149 43 1HB GLN 7 HB2 GLN 7 12.102 -4.642 4.166 44 2HB GLN 7 HB1 GLN 7 13.387 -3.512 4.525 45 1HG GLN 7 HG2 GLN 7 11.362 -2.273 4.271 46 2HG GLN 7 HG1 GLN 7 12.378 -1.932 2.880 47 1HE2 GLN 7 HE21 GLN 7 10.635 -1.275 1.641 48 2HE2 GLN 7 HE22 GLN 7 9.489 -2.397 1.015 49 H LEU 8 HN LEU 8 14.710 -4.704 4.970 50 HA LEU 8 HA LEU 8 16.256 -6.951 3.983 51 1HB LEU 8 HB2 LEU 8 16.380 -5.566 6.623 52 2HB LEU 8 HB1 LEU 8 17.413 -6.866 6.129 53 HG LEU 8 HG LEU 8 18.244 -5.352 4.251 54 1HD1 LEU 8 HD11 LEU 8 16.517 -3.665 4.284 55 2HD1 LEU 8 HD12 LEU 8 18.096 -2.943 4.589 56 3HD1 LEU 8 HD13 LEU 8 16.972 -3.201 5.924 57 1HD2 LEU 8 HD21 LEU 8 19.601 -5.907 6.164 58 2HD2 LEU 8 HD22 LEU 8 18.850 -4.616 7.101 59 3HD2 LEU 8 HD23 LEU 8 19.851 -4.226 5.704 60 H GLU 9 HN GLU 9 15.609 -8.835 4.276 61 HA GLU 9 HA GLU 9 13.284 -9.292 5.950 62 1HB GLU 9 HB2 GLU 9 14.591 -11.128 3.974 63 2HB GLU 9 HB1 GLU 9 13.053 -11.353 4.756 64 1HG GLU 9 HG2 GLU 9 12.076 -9.468 3.670 65 2HG GLU 9 HG1 GLU 9 13.616 -9.023 2.937 66 H ILE 10 HN ILE 10 13.356 -10.296 7.703 67 HA ILE 10 HA ILE 10 15.786 -11.774 8.469 68 HB ILE 10 HB ILE 10 14.107 -10.011 10.306 69 1HG1 ILE 10 HG12 ILE 10 16.914 -9.550 9.233 70 2HG1 ILE 10 HG11 ILE 10 15.481 -8.673 8.722 71 1HG2 ILE 10 HG21 ILE 10 16.650 -11.521 10.834 72 2HG2 ILE 10 HG22 ILE 10 15.043 -11.910 11.459 73 3HG2 ILE 10 HG23 ILE 10 15.848 -10.417 11.956 74 1HD1 ILE 10 HD11 ILE 10 16.684 -8.654 11.482 75 2HD1 ILE 10 HD12 ILE 10 15.248 -7.762 10.980 76 3HD1 ILE 10 HD13 ILE 10 16.818 -7.371 10.277 77 H LYS 11 HN LYS 11 15.406 -13.682 9.412 78 HA LYS 11 HA LYS 11 12.640 -14.275 10.127 79 1HB LYS 11 HB2 LYS 11 12.995 -16.614 9.641 80 2HB LYS 11 HB1 LYS 11 13.322 -15.662 8.207 81 1HG LYS 11 HG2 LYS 11 15.709 -15.934 8.540 82 2HG LYS 11 HG1 LYS 11 15.423 -16.792 10.054 83 1HD LYS 11 HD2 LYS 11 14.556 -17.705 7.300 84 2HD LYS 11 HD1 LYS 11 15.891 -18.368 8.251 85 1HE LYS 11 HE2 LYS 11 14.276 -19.031 10.005 86 2HE LYS 11 HE1 LYS 11 12.966 -18.421 9.005 87 1HZ LYS 11 HZ1 LYS 11 13.174 -20.761 8.844 88 2HZ LYS 11 HZ2 LYS 11 14.773 -20.661 8.303 89 3HZ LYS 11 HZ3 LYS 11 13.512 -20.074 7.335 90 H PHE 12 HN PHE 12 12.445 -15.712 12.007 91 HA PHE 12 HA PHE 12 14.661 -15.122 13.849 92 1HB PHE 12 HB2 PHE 12 11.740 -15.552 14.461 93 2HB PHE 12 HB1 PHE 12 12.993 -15.176 15.625 94 HD1 PHE 12 HD1 PHE 12 14.180 -12.958 15.434 95 HD2 PHE 12 HD2 PHE 12 10.613 -13.874 13.304 96 HE1 PHE 12 HE1 PHE 12 13.763 -10.562 15.112 97 HE2 PHE 12 HE2 PHE 12 10.188 -11.481 12.972 98 HZ PHE 12 HZ PHE 12 11.767 -9.817 13.878 99 H ARG 13 HN ARG 13 15.839 -16.901 14.343 100 HA ARG 13 HA ARG 13 14.283 -19.317 14.811 101 1HB ARG 13 HB2 ARG 13 15.770 -19.819 12.942 102 2HB ARG 13 HB1 ARG 13 17.147 -19.183 13.824 103 1HG ARG 13 HG2 ARG 13 17.097 -20.989 15.407 104 2HG ARG 13 HG1 ARG 13 15.557 -21.548 14.789 105 1HD ARG 13 HD2 ARG 13 18.057 -21.498 13.109 106 2HD ARG 13 HD1 ARG 13 17.609 -22.882 14.107 107 HE ARG 13 HE ARG 13 15.474 -22.073 12.412 108 1HH1 ARG 13 HH11 ARG 13 18.520 -23.887 12.332 109 2HH1 ARG 13 HH12 ARG 13 18.021 -24.902 11.074 110 1HH2 ARG 13 HH21 ARG 13 14.791 -23.490 10.745 111 2HH2 ARG 13 HH22 ARG 13 15.844 -24.675 10.127 112 H LEU 14 HN LEU 14 14.086 -19.891 16.711 113 HA LEU 14 HA LEU 14 15.404 -18.652 18.910 114 1HB LEU 14 HB2 LEU 14 13.729 -21.170 18.772 115 2HB LEU 14 HB1 LEU 14 14.285 -20.438 20.248 116 HG LEU 14 HG LEU 14 12.778 -18.477 19.818 117 1HD1 LEU 14 HD11 LEU 14 12.686 -18.555 17.381 118 2HD1 LEU 14 HD12 LEU 14 11.079 -18.594 18.104 119 3HD1 LEU 14 HD13 LEU 14 11.798 -20.075 17.467 120 1HD2 LEU 14 HD21 LEU 14 10.718 -19.654 20.238 121 2HD2 LEU 14 HD22 LEU 14 12.048 -20.324 21.184 122 3HD2 LEU 14 HD23 LEU 14 11.464 -21.175 19.750 123 H THR 15 HN THR 15 16.903 -19.616 20.324 124 HA THR 15 HA THR 15 18.854 -21.285 19.158 125 HB THR 15 HB THR 15 19.242 -19.700 20.967 126 HG1 THR 15 HG1 THR 15 19.934 -22.329 21.848 127 1HG2 THR 15 HG21 THR 15 17.311 -20.078 22.367 128 2HG2 THR 15 HG22 THR 15 18.767 -20.325 23.330 129 3HG2 THR 15 HG23 THR 15 17.855 -21.714 22.739 130 H ASP 16 HN ASP 16 15.961 -21.877 20.475 131 HA ASP 16 HA ASP 16 16.299 -24.572 21.453 132 1HB ASP 16 HB2 ASP 16 14.583 -23.061 22.382 133 2HB ASP 16 HB1 ASP 16 13.758 -23.049 20.833 134 H GLY 17 HN GLY 17 16.192 -23.319 18.339 135 1HA GLY 17 HA2 GLY 17 16.622 -24.712 16.489 136 2HA GLY 17 HA1 GLY 17 15.847 -26.038 17.333 137 H SER 18 HN SER 18 13.857 -23.346 17.518 138 HA SER 18 HA SER 18 12.376 -24.278 15.194 139 1HB SER 18 HB2 SER 18 10.454 -23.126 16.438 140 2HB SER 18 HB1 SER 18 11.082 -24.623 17.127 141 HG SER 18 HG SER 18 11.198 -23.439 18.819 142 H ASP 19 HN ASP 19 11.621 -22.733 13.620 143 HA ASP 19 HA ASP 19 12.554 -20.049 14.116 144 1HB ASP 19 HB2 ASP 19 13.208 -19.829 11.854 145 2HB ASP 19 HB1 ASP 19 14.181 -21.060 12.660 146 H ILE 20 HN ILE 20 11.585 -18.454 13.099 147 HA ILE 20 HA ILE 20 8.817 -18.887 12.240 148 HB ILE 20 HB ILE 20 10.240 -16.409 13.283 149 1HG1 ILE 20 HG12 ILE 20 8.181 -18.168 14.638 150 2HG1 ILE 20 HG11 ILE 20 9.894 -18.110 15.030 151 1HG2 ILE 20 HG21 ILE 20 7.329 -16.808 12.626 152 2HG2 ILE 20 HG22 ILE 20 8.473 -15.812 11.729 153 3HG2 ILE 20 HG23 ILE 20 8.020 -15.370 13.379 154 1HD1 ILE 20 HD11 ILE 20 9.639 -15.781 15.749 155 2HD1 ILE 20 HD12 ILE 20 8.567 -16.858 16.642 156 3HD1 ILE 20 HD13 ILE 20 7.924 -15.849 15.350 157 H GLY 21 HN GLY 21 8.220 -18.067 10.238 158 1HA GLY 21 HA2 GLY 21 10.107 -17.988 8.197 159 2HA GLY 21 HA1 GLY 21 8.452 -17.425 8.063 160 HA PRO 22 HA PRO 22 11.790 -13.965 7.992 161 1HB PRO 22 HB2 PRO 22 11.979 -13.564 5.329 162 2HB PRO 22 HB1 PRO 22 13.047 -14.639 6.226 163 1HG PRO 22 HG2 PRO 22 10.653 -15.329 4.569 164 2HG PRO 22 HG1 PRO 22 12.214 -16.160 4.672 165 1HD PRO 22 HD2 PRO 22 10.011 -17.030 5.975 166 2HD PRO 22 HD1 PRO 22 11.651 -17.250 6.622 167 H LYS 23 HN LYS 23 11.290 -11.898 7.812 168 HA LYS 23 HA LYS 23 8.790 -11.062 6.543 169 1HB LYS 23 HB2 LYS 23 8.482 -11.624 9.019 170 2HB LYS 23 HB1 LYS 23 9.689 -10.422 9.393 171 1HG LYS 23 HG2 LYS 23 7.054 -9.796 8.058 172 2HG LYS 23 HG1 LYS 23 7.296 -9.776 9.795 173 1HD LYS 23 HD2 LYS 23 8.970 -8.011 9.540 174 2HD LYS 23 HD1 LYS 23 8.764 -8.062 7.789 175 1HE LYS 23 HE2 LYS 23 6.393 -7.452 8.086 176 2HE LYS 23 HE1 LYS 23 6.673 -7.362 9.824 177 1HZ LYS 23 HZ1 LYS 23 8.067 -5.686 7.813 178 2HZ LYS 23 HZ2 LYS 23 8.166 -5.548 9.505 179 3HZ LYS 23 HZ3 LYS 23 6.727 -5.202 8.715 180 H ALA 24 HN ALA 24 8.966 -8.781 5.920 181 HA ALA 24 HA ALA 24 11.757 -8.036 5.529 182 1HB ALA 24 HB1 ALA 24 10.905 -6.414 3.927 183 2HB ALA 24 HB2 ALA 24 9.252 -6.781 4.416 184 3HB ALA 24 HB3 ALA 24 10.223 -8.008 3.607 185 H PHE 25 HN PHE 25 12.773 -6.652 6.795 186 HA PHE 25 HA PHE 25 11.192 -4.754 8.365 187 1HB PHE 25 HB2 PHE 25 13.952 -5.873 8.901 188 2HB PHE 25 HB1 PHE 25 13.077 -4.741 9.923 189 HD1 PHE 25 HD1 PHE 25 11.396 -5.502 11.430 190 HD2 PHE 25 HD2 PHE 25 13.195 -8.164 8.667 191 HE1 PHE 25 HE1 PHE 25 10.410 -7.419 12.621 192 HE2 PHE 25 HE2 PHE 25 12.211 -10.067 9.844 193 HZ PHE 25 HZ PHE 25 10.864 -9.735 11.775 194 HA PRO 26 HA PRO 26 13.212 -1.817 5.673 195 1HB PRO 26 HB2 PRO 26 11.970 -0.006 7.671 196 2HB PRO 26 HB1 PRO 26 11.885 0.092 5.920 197 1HG PRO 26 HG2 PRO 26 9.801 -0.760 7.328 198 2HG PRO 26 HG1 PRO 26 10.213 -1.566 5.805 199 1HD PRO 26 HD2 PRO 26 10.724 -2.437 8.620 200 2HD PRO 26 HD1 PRO 26 10.237 -3.399 7.206 201 H ASP 27 HN ASP 27 14.987 -0.488 5.913 202 HA ASP 27 HA ASP 27 16.807 -0.905 7.987 203 1HB ASP 27 HB2 ASP 27 18.119 0.956 7.028 204 2HB ASP 27 HB1 ASP 27 17.516 -0.121 5.779 205 H ALA 28 HN ALA 28 14.284 1.446 7.707 206 HA ALA 28 HA ALA 28 15.258 3.140 9.818 207 1HB ALA 28 HB1 ALA 28 12.552 3.107 8.490 208 2HB ALA 28 HB2 ALA 28 13.944 4.056 7.961 209 3HB ALA 28 HB3 ALA 28 13.193 4.386 9.521 210 H THR 29 HN THR 29 13.720 0.160 9.814 211 HA THR 29 HA THR 29 12.048 0.580 12.070 212 HB THR 29 HB THR 29 13.035 -1.964 10.753 213 HG1 THR 29 HG1 THR 29 11.184 -0.096 10.186 214 1HG2 THR 29 HG21 THR 29 10.769 -1.557 12.721 215 2HG2 THR 29 HG22 THR 29 12.291 -2.374 13.081 216 3HG2 THR 29 HG23 THR 29 11.171 -3.072 11.914 217 H THR 30 HN THR 30 12.514 0.318 14.195 218 HA THR 30 HA THR 30 15.247 0.169 14.977 219 HB THR 30 HB THR 30 14.303 0.451 17.264 220 HG1 THR 30 HG1 THR 30 11.783 1.124 16.410 221 1HG2 THR 30 HG21 THR 30 14.920 2.413 15.937 222 2HG2 THR 30 HG22 THR 30 13.480 2.759 16.891 223 3HG2 THR 30 HG23 THR 30 13.337 2.407 15.167 224 H VAL 31 HN VAL 31 16.073 -1.348 16.534 225 HA VAL 31 HA VAL 31 15.243 -4.051 16.283 226 HB VAL 31 HB VAL 31 17.010 -2.741 18.401 227 1HG1 VAL 31 HG11 VAL 31 16.191 -4.950 19.124 228 2HG1 VAL 31 HG12 VAL 31 17.923 -4.971 18.797 229 3HG1 VAL 31 HG13 VAL 31 16.803 -5.660 17.627 230 1HG2 VAL 31 HG21 VAL 31 17.886 -2.399 16.176 231 2HG2 VAL 31 HG22 VAL 31 17.717 -4.112 15.820 232 3HG2 VAL 31 HG23 VAL 31 18.885 -3.578 17.033 233 H SER 32 HN SER 32 14.339 -1.442 18.337 234 HA SER 32 HA SER 32 12.967 -2.826 20.357 235 1HB SER 32 HB2 SER 32 13.460 -0.321 20.270 236 2HB SER 32 HB1 SER 32 12.184 -0.185 19.067 237 HG SER 32 HG SER 32 11.810 0.171 21.439 238 H ALA 33 HN ALA 33 11.864 -1.583 17.190 239 HA ALA 33 HA ALA 33 9.298 -2.767 17.320 240 1HB ALA 33 HB1 ALA 33 10.841 -1.809 14.912 241 2HB ALA 33 HB2 ALA 33 9.789 -0.814 15.920 242 3HB ALA 33 HB3 ALA 33 9.108 -2.134 14.969 243 H LEU 34 HN LEU 34 12.445 -4.009 16.425 244 HA LEU 34 HA LEU 34 11.654 -6.121 14.855 245 1HB LEU 34 HB2 LEU 34 13.919 -5.239 14.946 246 2HB LEU 34 HB1 LEU 34 14.008 -5.618 16.655 247 HG LEU 34 HG LEU 34 13.868 -7.842 16.207 248 1HD1 LEU 34 HD11 LEU 34 14.052 -7.065 13.261 249 2HD1 LEU 34 HD12 LEU 34 12.695 -7.882 14.030 250 3HD1 LEU 34 HD13 LEU 34 14.229 -8.728 13.819 251 1HD2 LEU 34 HD21 LEU 34 16.150 -8.176 15.168 252 2HD2 LEU 34 HD22 LEU 34 16.033 -7.011 16.474 253 3HD2 LEU 34 HD23 LEU 34 16.123 -6.450 14.799 254 H LYS 35 HN LYS 35 12.133 -5.762 18.433 255 HA LYS 35 HA LYS 35 11.296 -8.418 18.892 256 1HB LYS 35 HB2 LYS 35 11.529 -6.093 20.782 257 2HB LYS 35 HB1 LYS 35 10.811 -7.608 21.282 258 1HG LYS 35 HG2 LYS 35 12.975 -7.885 22.007 259 2HG LYS 35 HG1 LYS 35 13.066 -8.626 20.419 260 1HD LYS 35 HD2 LYS 35 14.983 -7.281 20.599 261 2HD LYS 35 HD1 LYS 35 13.872 -6.331 19.609 262 1HE LYS 35 HE2 LYS 35 14.940 -4.947 21.298 263 2HE LYS 35 HE1 LYS 35 13.210 -5.052 21.600 264 1HZ LYS 35 HZ1 LYS 35 14.480 -5.333 23.658 265 2HZ LYS 35 HZ2 LYS 35 15.318 -6.620 23.026 266 3HZ LYS 35 HZ3 LYS 35 13.688 -6.772 23.326 267 H GLU 36 HN GLU 36 9.587 -5.373 18.632 268 HA GLU 36 HA GLU 36 7.093 -6.115 19.607 269 1HB GLU 36 HB2 GLU 36 7.749 -4.346 17.250 270 2HB GLU 36 HB1 GLU 36 6.184 -4.436 18.034 271 1HG GLU 36 HG2 GLU 36 8.737 -3.521 19.339 272 2HG GLU 36 HG1 GLU 36 7.469 -2.468 18.717 273 H THR 37 HN THR 37 8.590 -6.724 16.512 274 HA THR 37 HA THR 37 6.369 -7.815 15.176 275 HB THR 37 HB THR 37 9.302 -8.499 14.779 276 HG1 THR 37 HG1 THR 37 8.901 -6.225 14.610 277 1HG2 THR 37 HG21 THR 37 7.758 -10.033 13.620 278 2HG2 THR 37 HG22 THR 37 8.612 -9.012 12.462 279 3HG2 THR 37 HG23 THR 37 6.938 -8.657 12.883 280 H VAL 38 HN VAL 38 8.911 -9.290 17.164 281 HA VAL 38 HA VAL 38 8.086 -11.969 16.881 282 HB VAL 38 HB VAL 38 9.509 -10.702 19.246 283 1HG1 VAL 38 HG11 VAL 38 10.387 -12.959 19.674 284 2HG1 VAL 38 HG12 VAL 38 9.402 -13.585 18.351 285 3HG1 VAL 38 HG13 VAL 38 8.628 -12.905 19.782 286 1HG2 VAL 38 HG21 VAL 38 10.661 -11.982 16.767 287 2HG2 VAL 38 HG22 VAL 38 11.591 -11.445 18.163 288 3HG2 VAL 38 HG23 VAL 38 10.717 -10.268 17.180 289 H ILE 39 HN ILE 39 7.470 -9.551 19.373 290 HA ILE 39 HA ILE 39 5.864 -10.980 21.146 291 HB ILE 39 HB ILE 39 5.614 -8.039 20.428 292 1HG1 ILE 39 HG12 ILE 39 7.268 -9.338 22.592 293 2HG1 ILE 39 HG11 ILE 39 7.908 -8.732 21.066 294 1HG2 ILE 39 HG21 ILE 39 3.707 -8.809 21.758 295 2HG2 ILE 39 HG22 ILE 39 4.766 -7.778 22.738 296 3HG2 ILE 39 HG23 ILE 39 4.812 -9.516 22.939 297 1HD1 ILE 39 HD11 ILE 39 8.270 -7.153 22.869 298 2HD1 ILE 39 HD12 ILE 39 6.536 -7.095 23.180 299 3HD1 ILE 39 HD13 ILE 39 7.178 -6.480 21.659 300 H SER 40 HN SER 40 4.997 -9.365 18.149 301 HA SER 40 HA SER 40 2.188 -9.513 18.498 302 1HB SER 40 HB2 SER 40 3.807 -9.222 15.965 303 2HB SER 40 HB1 SER 40 2.075 -8.914 16.116 304 HG SER 40 HG SER 40 4.169 -7.533 17.476 305 H GLU 41 HN GLU 41 4.570 -11.670 16.923 306 HA GLU 41 HA GLU 41 2.588 -13.386 15.814 307 1HB GLU 41 HB2 GLU 41 5.583 -13.489 16.034 308 2HB GLU 41 HB1 GLU 41 4.607 -14.665 15.185 309 1HG GLU 41 HG2 GLU 41 4.728 -11.730 14.520 310 2HG GLU 41 HG1 GLU 41 5.657 -12.980 13.698 311 H TRP 42 HN TRP 42 4.808 -13.340 18.539 312 HA TRP 42 HA TRP 42 4.713 -16.064 19.198 313 1HB TRP 42 HB2 TRP 42 6.494 -14.421 19.799 314 2HB TRP 42 HB1 TRP 42 5.387 -13.695 20.944 315 HD1 TRP 42 HD1 TRP 42 5.156 -14.869 23.294 316 HE1 TRP 42 HE1 TRP 42 6.415 -16.769 24.421 317 HE3 TRP 42 HE3 TRP 42 7.572 -16.738 19.200 318 HZ2 TRP 42 HZ2 TRP 42 8.201 -18.877 23.657 319 HZ3 TRP 42 HZ3 TRP 42 9.034 -18.691 19.484 320 HH2 TRP 42 HH2 TRP 42 9.344 -19.731 21.652 321 HA PRO 43 HA PRO 43 0.713 -16.491 21.155 322 1HB PRO 43 HB2 PRO 43 2.259 -18.298 22.945 323 2HB PRO 43 HB1 PRO 43 0.741 -18.602 22.105 324 1HG PRO 43 HG2 PRO 43 2.989 -19.652 21.182 325 2HG PRO 43 HG1 PRO 43 1.800 -18.964 20.058 326 1HD PRO 43 HD2 PRO 43 4.402 -17.830 20.989 327 2HD PRO 43 HD1 PRO 43 3.619 -17.745 19.393 328 H ARG 44 HN ARG 44 -0.024 -14.970 22.410 329 HA ARG 44 HA ARG 44 1.316 -13.600 24.488 330 1HB ARG 44 HB2 ARG 44 -0.874 -12.632 25.021 331 2HB ARG 44 HB1 ARG 44 -0.623 -12.645 23.282 332 1HG ARG 44 HG2 ARG 44 -2.011 -14.634 23.078 333 2HG ARG 44 HG1 ARG 44 -2.232 -14.673 24.821 334 1HD ARG 44 HD2 ARG 44 -3.384 -12.494 24.682 335 2HD ARG 44 HD1 ARG 44 -3.193 -12.534 22.921 336 HE ARG 44 HE ARG 44 -4.347 -14.918 23.797 337 1HH1 ARG 44 HH11 ARG 44 -5.284 -11.539 23.335 338 2HH1 ARG 44 HH12 ARG 44 -6.938 -11.910 23.142 339 1HH2 ARG 44 HH21 ARG 44 -6.541 -15.393 23.546 340 2HH2 ARG 44 HH22 ARG 44 -7.696 -14.175 23.267 341 H GLU 45 HN GLU 45 -0.370 -16.554 24.388 342 HA GLU 45 HA GLU 45 -1.111 -16.723 27.165 343 1HB GLU 45 HB2 GLU 45 -2.422 -17.753 25.365 344 2HB GLU 45 HB1 GLU 45 -1.071 -18.803 24.984 345 1HG GLU 45 HG2 GLU 45 -1.274 -19.786 27.248 346 2HG GLU 45 HG1 GLU 45 -2.705 -18.793 27.509 347 H LYS 46 HN LYS 46 1.804 -17.201 25.487 348 HA LYS 46 HA LYS 46 2.676 -19.562 26.832 349 1HB LYS 46 HB2 LYS 46 3.523 -18.542 24.561 350 2HB LYS 46 HB1 LYS 46 4.534 -17.540 25.575 351 1HG LYS 46 HG2 LYS 46 4.592 -20.563 25.498 352 2HG LYS 46 HG1 LYS 46 5.739 -19.500 24.695 353 1HD LYS 46 HD2 LYS 46 6.505 -18.676 26.847 354 2HD LYS 46 HD1 LYS 46 5.276 -19.629 27.673 355 1HE LYS 46 HE2 LYS 46 6.317 -21.681 26.790 356 2HE LYS 46 HE1 LYS 46 7.582 -20.702 26.050 357 1HZ LYS 46 HZ1 LYS 46 8.217 -19.929 28.261 358 2HZ LYS 46 HZ2 LYS 46 8.295 -21.600 28.218 359 3HZ LYS 46 HZ3 LYS 46 7.005 -20.829 28.967 360 H GLU 47 HN GLU 47 2.949 -19.562 28.994 361 HA GLU 47 HA GLU 47 3.562 -17.278 30.495 362 1HB GLU 47 HB2 GLU 47 3.757 -20.152 31.280 363 2HB GLU 47 HB1 GLU 47 3.778 -18.802 32.364 364 1HG GLU 47 HG2 GLU 47 1.422 -19.477 30.620 365 2HG GLU 47 HG1 GLU 47 1.554 -19.886 32.327 366 H ASN 48 HN ASN 48 5.420 -16.715 31.298 367 HA ASN 48 HA ASN 48 7.658 -16.255 31.276 368 1HB ASN 48 HB2 ASN 48 7.795 -19.221 31.823 369 2HB ASN 48 HB1 ASN 48 9.211 -18.182 31.864 370 1HD2 ASN 48 HD21 ASN 48 7.664 -15.935 33.005 371 2HD2 ASN 48 HD22 ASN 48 7.417 -16.365 34.649 372 H GLY 49 HN GLY 49 7.707 -15.540 29.141 373 1HA GLY 49 HA2 GLY 49 9.812 -16.671 27.740 374 2HA GLY 49 HA1 GLY 49 8.296 -17.189 27.007 375 HA PRO 50 HA PRO 50 9.720 -13.148 24.909 376 1HB PRO 50 HB2 PRO 50 8.434 -14.971 22.944 377 2HB PRO 50 HB1 PRO 50 9.748 -13.868 22.630 378 1HG PRO 50 HG2 PRO 50 10.390 -16.312 22.917 379 2HG PRO 50 HG1 PRO 50 11.219 -15.184 24.016 380 1HD PRO 50 HD2 PRO 50 8.852 -16.940 24.578 381 2HD PRO 50 HD1 PRO 50 10.341 -16.755 25.527 382 H LYS 51 HN LYS 51 7.410 -13.307 26.409 383 HA LYS 51 HA LYS 51 5.176 -12.756 24.653 384 1HB LYS 51 HB2 LYS 51 4.891 -13.999 26.831 385 2HB LYS 51 HB1 LYS 51 5.270 -12.524 27.686 386 1HG LYS 51 HG2 LYS 51 2.916 -12.733 25.809 387 2HG LYS 51 HG1 LYS 51 2.800 -13.209 27.492 388 1HD LYS 51 HD2 LYS 51 3.577 -10.463 26.500 389 2HD LYS 51 HD1 LYS 51 1.962 -10.915 27.037 390 1HE LYS 51 HE2 LYS 51 4.478 -10.937 28.726 391 2HE LYS 51 HE1 LYS 51 3.172 -9.763 28.812 392 1HZ LYS 51 HZ1 LYS 51 2.967 -11.434 30.560 393 2HZ LYS 51 HZ2 LYS 51 2.914 -12.663 29.431 394 3HZ LYS 51 HZ3 LYS 51 1.670 -11.545 29.505 395 H THR 52 HN THR 52 7.537 -10.945 26.558 396 HA THR 52 HA THR 52 6.613 -8.673 25.057 397 HB THR 52 HB THR 52 7.214 -7.117 26.870 398 HG1 THR 52 HG1 THR 52 7.850 -9.466 28.211 399 1HG2 THR 52 HG21 THR 52 4.968 -9.021 27.509 400 2HG2 THR 52 HG22 THR 52 4.891 -7.618 26.445 401 3HG2 THR 52 HG23 THR 52 5.140 -7.398 28.176 402 H VAL 53 HN VAL 53 8.251 -6.834 25.362 403 HA VAL 53 HA VAL 53 10.301 -7.406 23.597 404 HB VAL 53 HB VAL 53 9.193 -5.238 23.777 405 1HG1 VAL 53 HG11 VAL 53 10.656 -4.901 26.374 406 2HG1 VAL 53 HG12 VAL 53 8.911 -5.035 26.148 407 3HG1 VAL 53 HG13 VAL 53 9.778 -3.626 25.532 408 1HG2 VAL 53 HG21 VAL 53 12.171 -5.034 24.228 409 2HG2 VAL 53 HG22 VAL 53 11.154 -3.761 23.556 410 3HG2 VAL 53 HG23 VAL 53 11.360 -5.280 22.683 411 H LYS 54 HN LYS 54 10.346 -7.472 27.063 412 HA LYS 54 HA LYS 54 13.156 -7.048 27.313 413 1HB LYS 54 HB2 LYS 54 11.570 -6.334 29.029 414 2HB LYS 54 HB1 LYS 54 11.104 -8.001 29.309 415 1HG LYS 54 HG2 LYS 54 13.385 -8.504 30.076 416 2HG LYS 54 HG1 LYS 54 13.837 -6.824 29.808 417 1HD LYS 54 HD2 LYS 54 11.710 -7.785 31.723 418 2HD LYS 54 HD1 LYS 54 13.342 -7.278 32.164 419 1HE LYS 54 HE2 LYS 54 12.868 -5.029 31.318 420 2HE LYS 54 HE1 LYS 54 11.244 -5.535 30.860 421 1HZ LYS 54 HZ1 LYS 54 11.224 -4.381 32.964 422 2HZ LYS 54 HZ2 LYS 54 12.333 -5.447 33.619 423 3HZ LYS 54 HZ3 LYS 54 10.797 -5.991 33.206 424 H GLU 55 HN GLU 55 11.067 -9.764 26.845 425 HA GLU 55 HA GLU 55 13.035 -11.613 27.939 426 1HB GLU 55 HB2 GLU 55 10.384 -12.192 26.642 427 2HB GLU 55 HB1 GLU 55 11.446 -13.414 27.311 428 1HG GLU 55 HG2 GLU 55 9.777 -13.066 28.911 429 2HG GLU 55 HG1 GLU 55 11.181 -12.193 29.517 430 H VAL 56 HN VAL 56 12.709 -10.123 25.048 431 HA VAL 56 HA VAL 56 13.676 -12.464 23.536 432 HB VAL 56 HB VAL 56 12.473 -9.939 22.399 433 1HG1 VAL 56 HG11 VAL 56 13.937 -11.076 20.840 434 2HG1 VAL 56 HG12 VAL 56 12.255 -11.226 20.331 435 3HG1 VAL 56 HG13 VAL 56 13.067 -12.589 21.101 436 1HG2 VAL 56 HG21 VAL 56 11.191 -12.607 22.885 437 2HG2 VAL 56 HG22 VAL 56 10.459 -11.301 21.949 438 3HG2 VAL 56 HG23 VAL 56 10.770 -11.088 23.675 439 H LYS 57 HN LYS 57 15.865 -12.409 23.282 440 HA LYS 57 HA LYS 57 17.023 -9.856 22.504 441 1HB LYS 57 HB2 LYS 57 18.288 -12.228 23.849 442 2HB LYS 57 HB1 LYS 57 19.206 -10.925 23.114 443 1HG LYS 57 HG2 LYS 57 18.065 -9.354 24.667 444 2HG LYS 57 HG1 LYS 57 17.331 -10.754 25.459 445 1HD LYS 57 HD2 LYS 57 19.543 -11.626 25.980 446 2HD LYS 57 HD1 LYS 57 20.289 -10.259 25.148 447 1HE LYS 57 HE2 LYS 57 19.182 -8.738 26.742 448 2HE LYS 57 HE1 LYS 57 18.540 -10.154 27.577 449 1HZ LYS 57 HZ1 LYS 57 20.513 -9.337 28.669 450 2HZ LYS 57 HZ2 LYS 57 21.398 -9.472 27.245 451 3HZ LYS 57 HZ3 LYS 57 20.832 -10.852 28.002 452 H LEU 58 HN LEU 58 18.238 -9.780 20.666 453 HA LEU 58 HA LEU 58 17.980 -12.145 18.966 454 1HB LEU 58 HB2 LEU 58 18.015 -9.230 18.155 455 2HB LEU 58 HB1 LEU 58 18.029 -10.566 17.039 456 HG LEU 58 HG LEU 58 15.840 -9.703 17.026 457 1HD1 LEU 58 HD11 LEU 58 15.795 -12.147 18.752 458 2HD1 LEU 58 HD12 LEU 58 15.866 -12.090 16.991 459 3HD1 LEU 58 HD13 LEU 58 14.435 -11.501 17.837 460 1HD2 LEU 58 HD21 LEU 58 15.834 -9.852 20.030 461 2HD2 LEU 58 HD22 LEU 58 14.461 -9.405 19.014 462 3HD2 LEU 58 HD23 LEU 58 15.908 -8.391 19.044 463 H ILE 59 HN ILE 59 19.762 -13.003 18.248 464 HA ILE 59 HA ILE 59 22.231 -11.413 18.358 465 HB ILE 59 HB ILE 59 21.897 -14.387 18.857 466 1HG1 ILE 59 HG12 ILE 59 22.890 -12.133 20.602 467 2HG1 ILE 59 HG11 ILE 59 21.374 -13.001 20.794 468 1HG2 ILE 59 HG21 ILE 59 23.888 -14.045 17.512 469 2HG2 ILE 59 HG22 ILE 59 24.332 -14.492 19.161 470 3HG2 ILE 59 HG23 ILE 59 24.463 -12.813 18.636 471 1HD1 ILE 59 HD11 ILE 59 22.638 -15.045 21.312 472 2HD1 ILE 59 HD12 ILE 59 23.015 -13.727 22.425 473 3HD1 ILE 59 HD13 ILE 59 24.141 -14.139 21.129 474 H SER 60 HN SER 60 23.171 -11.040 16.547 475 HA SER 60 HA SER 60 22.792 -12.899 14.334 476 1HB SER 60 HB2 SER 60 21.378 -10.966 13.909 477 2HB SER 60 HB1 SER 60 22.698 -9.852 14.200 478 HG SER 60 HG SER 60 23.244 -10.094 12.209 479 H ALA 61 HN ALA 61 24.638 -13.646 13.628 480 HA ALA 61 HA ALA 61 26.812 -13.959 13.136 481 1HB ALA 61 HB1 ALA 61 27.105 -10.964 13.423 482 2HB ALA 61 HB2 ALA 61 26.625 -11.798 11.947 483 3HB ALA 61 HB3 ALA 61 28.239 -12.049 12.618 484 H GLY 62 HN GLY 62 25.800 -13.849 15.879 485 1HA GLY 62 HA2 GLY 62 26.753 -14.528 17.890 486 2HA GLY 62 HA1 GLY 62 28.338 -14.226 17.189 487 H LYS 63 HN LYS 63 25.963 -11.721 17.053 488 HA LYS 63 HA LYS 63 27.101 -10.440 19.408 489 1HB LYS 63 HB2 LYS 63 28.246 -9.682 17.239 490 2HB LYS 63 HB1 LYS 63 26.698 -9.057 16.722 491 1HG LYS 63 HG2 LYS 63 28.184 -8.101 19.174 492 2HG LYS 63 HG1 LYS 63 28.307 -7.348 17.591 493 1HD LYS 63 HD2 LYS 63 25.941 -6.812 17.649 494 2HD LYS 63 HD1 LYS 63 25.768 -7.647 19.191 495 1HE LYS 63 HE2 LYS 63 27.314 -6.049 20.220 496 2HE LYS 63 HE1 LYS 63 27.475 -5.210 18.679 497 1HZ LYS 63 HZ1 LYS 63 24.940 -5.554 20.172 498 2HZ LYS 63 HZ2 LYS 63 25.141 -4.666 18.744 499 3HZ LYS 63 HZ3 LYS 63 25.863 -4.148 20.175 500 H VAL 64 HN VAL 64 25.497 -9.492 20.643 501 HA VAL 64 HA VAL 64 22.777 -9.833 19.695 502 HB VAL 64 HB VAL 64 23.317 -10.687 21.947 503 1HG1 VAL 64 HG11 VAL 64 23.698 -9.176 23.837 504 2HG1 VAL 64 HG12 VAL 64 23.858 -7.831 22.705 505 3HG1 VAL 64 HG13 VAL 64 25.009 -9.164 22.662 506 1HG2 VAL 64 HG21 VAL 64 21.437 -9.705 23.196 507 2HG2 VAL 64 HG22 VAL 64 21.012 -10.041 21.516 508 3HG2 VAL 64 HG23 VAL 64 21.362 -8.389 22.024 509 H LEU 65 HN LEU 65 21.411 -8.232 19.144 510 HA LEU 65 HA LEU 65 22.436 -5.558 19.374 511 1HB LEU 65 HB2 LEU 65 20.687 -5.035 17.645 512 2HB LEU 65 HB1 LEU 65 22.104 -5.892 17.077 513 HG LEU 65 HG LEU 65 19.391 -7.197 17.590 514 1HD1 LEU 65 HD11 LEU 65 20.622 -6.219 15.005 515 2HD1 LEU 65 HD12 LEU 65 19.252 -5.477 15.825 516 3HD1 LEU 65 HD13 LEU 65 19.106 -7.105 15.160 517 1HD2 LEU 65 HD21 LEU 65 21.806 -8.094 16.009 518 2HD2 LEU 65 HD22 LEU 65 20.284 -8.966 16.149 519 3HD2 LEU 65 HD23 LEU 65 21.312 -8.766 17.562 520 H GLU 66 HN GLU 66 21.323 -3.958 20.307 521 HA GLU 66 HA GLU 66 19.139 -4.870 22.024 522 1HB GLU 66 HB2 GLU 66 21.531 -3.762 22.685 523 2HB GLU 66 HB1 GLU 66 20.568 -2.309 22.519 524 1HG GLU 66 HG2 GLU 66 19.869 -4.608 24.345 525 2HG GLU 66 HG1 GLU 66 20.779 -3.194 24.841 526 H ASN 67 HN ASN 67 17.518 -3.108 22.524 527 HA ASN 67 HA ASN 67 16.067 -2.702 20.156 528 1HB ASN 67 HB2 ASN 67 14.295 -1.888 21.448 529 2HB ASN 67 HB1 ASN 67 15.136 -3.020 22.491 530 1HD2 ASN 67 HD21 ASN 67 16.402 -2.124 24.244 531 2HD2 ASN 67 HD22 ASN 67 16.015 -0.551 24.835 532 H SER 68 HN SER 68 18.330 -0.520 21.531 533 HA SER 68 HA SER 68 17.027 1.884 20.849 534 1HB SER 68 HB2 SER 68 19.930 1.418 21.462 535 2HB SER 68 HB1 SER 68 19.119 2.983 21.431 536 HG SER 68 HG SER 68 17.994 2.497 23.154 537 H LYS 69 HN LYS 69 19.089 -0.108 19.018 538 HA LYS 69 HA LYS 69 19.437 1.988 17.072 539 1HB LYS 69 HB2 LYS 69 20.947 0.343 15.981 540 2HB LYS 69 HB1 LYS 69 21.486 1.037 17.515 541 1HG LYS 69 HG2 LYS 69 20.890 -1.035 18.627 542 2HG LYS 69 HG1 LYS 69 20.254 -1.686 17.114 543 1HD LYS 69 HD2 LYS 69 22.515 -2.502 17.643 544 2HD LYS 69 HD1 LYS 69 22.449 -1.616 16.114 545 1HE LYS 69 HE2 LYS 69 23.340 0.370 17.299 546 2HE LYS 69 HE1 LYS 69 23.460 -0.593 18.774 547 1HZ LYS 69 HZ1 LYS 69 25.548 -0.466 17.606 548 2HZ LYS 69 HZ2 LYS 69 24.869 -1.125 16.214 549 3HZ LYS 69 HZ3 LYS 69 25.003 -2.052 17.625 550 H THR 70 HN THR 70 19.404 1.302 14.678 551 HA THR 70 HA THR 70 16.856 0.036 14.214 552 HB THR 70 HB THR 70 17.138 1.175 12.048 553 HG1 THR 70 HG1 THR 70 18.940 2.988 12.573 554 1HG2 THR 70 HG21 THR 70 16.716 3.458 12.898 555 2HG2 THR 70 HG22 THR 70 17.315 2.964 14.484 556 3HG2 THR 70 HG23 THR 70 15.838 2.249 13.835 557 H VAL 71 HN VAL 71 16.731 -1.055 12.063 558 HA VAL 71 HA VAL 71 18.597 -3.169 11.791 559 HB VAL 71 HB VAL 71 16.563 -2.135 9.764 560 1HG1 VAL 71 HG11 VAL 71 17.903 -4.834 9.940 561 2HG1 VAL 71 HG12 VAL 71 18.218 -3.586 8.736 562 3HG1 VAL 71 HG13 VAL 71 16.641 -4.376 8.792 563 1HG2 VAL 71 HG21 VAL 71 15.083 -3.893 10.623 564 2HG2 VAL 71 HG22 VAL 71 15.494 -2.722 11.870 565 3HG2 VAL 71 HG23 VAL 71 16.286 -4.300 11.846 566 H LYS 72 HN LYS 72 18.333 0.010 10.525 567 HA LYS 72 HA LYS 72 20.017 0.089 8.337 568 1HB LYS 72 HB2 LYS 72 18.616 1.947 9.042 569 2HB LYS 72 HB1 LYS 72 19.545 2.125 10.512 570 1HG LYS 72 HG2 LYS 72 21.499 2.791 9.157 571 2HG LYS 72 HG1 LYS 72 20.498 2.668 7.707 572 1HD LYS 72 HD2 LYS 72 18.997 4.369 8.545 573 2HD LYS 72 HD1 LYS 72 19.884 4.452 10.063 574 1HE LYS 72 HE2 LYS 72 21.868 5.203 8.820 575 2HE LYS 72 HE1 LYS 72 20.918 5.191 7.331 576 1HZ LYS 72 HZ1 LYS 72 20.376 6.881 9.726 577 2HZ LYS 72 HZ2 LYS 72 19.447 6.852 8.325 578 3HZ LYS 72 HZ3 LYS 72 21.031 7.411 8.269 579 H ASP 73 HN ASP 73 20.793 -0.051 11.755 580 HA ASP 73 HA ASP 73 23.493 0.759 11.515 581 1HB ASP 73 HB2 ASP 73 22.236 0.804 13.645 582 2HB ASP 73 HB1 ASP 73 22.266 -0.954 13.672 583 H TYR 74 HN TYR 74 21.942 -2.403 11.237 584 HA TYR 74 HA TYR 74 24.572 -3.581 10.891 585 1HB TYR 74 HB2 TYR 74 21.948 -4.800 11.666 586 2HB TYR 74 HB1 TYR 74 23.361 -5.745 11.220 587 HD1 TYR 74 HD1 TYR 74 25.486 -5.403 12.578 588 HD2 TYR 74 HD2 TYR 74 21.693 -3.987 13.858 589 HE1 TYR 74 HE1 TYR 74 26.340 -5.205 14.875 590 HE2 TYR 74 HE2 TYR 74 22.534 -3.793 16.142 591 HH TYR 74 HH TYR 74 25.841 -3.917 16.792 592 H ARG 75 HN ARG 75 22.366 -2.257 8.827 593 HA ARG 75 HA ARG 75 21.988 -4.360 7.057 594 1HB ARG 75 HB2 ARG 75 21.244 -2.695 5.572 595 2HB ARG 75 HB1 ARG 75 20.573 -2.341 7.149 596 1HG ARG 75 HG2 ARG 75 22.197 -0.562 7.448 597 2HG ARG 75 HG1 ARG 75 22.952 -0.974 5.908 598 1HD ARG 75 HD2 ARG 75 20.917 -0.386 4.724 599 2HD ARG 75 HD1 ARG 75 20.102 -0.031 6.245 600 HE ARG 75 HE ARG 75 22.335 1.516 6.256 601 1HH1 ARG 75 HH11 ARG 75 19.649 1.171 3.975 602 2HH1 ARG 75 HH12 ARG 75 19.614 2.813 3.539 603 1HH2 ARG 75 HH21 ARG 75 22.331 3.758 5.624 604 2HH2 ARG 75 HH22 ARG 75 21.172 4.326 4.499 605 H SER 76 HN SER 76 22.977 -4.627 5.049 606 HA SER 76 HA SER 76 25.773 -4.173 4.950 607 1HB SER 76 HB2 SER 76 23.800 -5.243 2.916 608 2HB SER 76 HB1 SER 76 25.555 -5.445 2.876 609 HG SER 76 HG SER 76 25.139 -6.347 5.113 610 HA PRO 77 HA PRO 77 25.804 -0.426 2.465 611 1HB PRO 77 HB2 PRO 77 27.214 -1.750 0.222 612 2HB PRO 77 HB1 PRO 77 27.717 -0.375 1.214 613 1HG PRO 77 HG2 PRO 77 28.884 -2.744 1.528 614 2HG PRO 77 HG1 PRO 77 28.507 -1.727 2.930 615 1HD PRO 77 HD2 PRO 77 27.008 -4.083 1.851 616 2HD PRO 77 HD1 PRO 77 27.435 -3.716 3.535 617 H VAL 78 HN VAL 78 25.308 0.462 0.197 618 HA VAL 78 HA VAL 78 22.761 -0.316 -0.600 619 HB VAL 78 HB VAL 78 23.671 1.948 -0.994 620 1HG1 VAL 78 HG11 VAL 78 25.148 2.409 -2.893 621 2HG1 VAL 78 HG12 VAL 78 25.326 0.673 -3.153 622 3HG1 VAL 78 HG13 VAL 78 25.910 1.406 -1.658 623 1HG2 VAL 78 HG21 VAL 78 21.707 1.298 -2.264 624 2HG2 VAL 78 HG22 VAL 78 22.722 0.602 -3.526 625 3HG2 VAL 78 HG23 VAL 78 22.739 2.342 -3.243 626 H SER 79 HN SER 79 25.730 -1.463 -1.538 627 HA SER 79 HA SER 79 24.674 -2.987 -3.778 628 1HB SER 79 HB2 SER 79 26.924 -1.924 -3.993 629 2HB SER 79 HB1 SER 79 27.488 -2.917 -2.653 630 HG SER 79 HG SER 79 26.314 -4.133 -4.895 631 H ASN 80 HN ASN 80 23.414 -4.580 -2.945 632 HA ASN 80 HA ASN 80 24.710 -6.651 -1.434 633 1HB ASN 80 HB2 ASN 80 23.003 -6.749 0.331 634 2HB ASN 80 HB1 ASN 80 23.794 -5.183 0.358 635 1HD2 ASN 80 HD21 ASN 80 21.216 -6.010 1.405 636 2HD2 ASN 80 HD22 ASN 80 20.043 -4.977 0.660 637 H LEU 81 HN LEU 81 22.544 -8.343 -0.942 638 HA LEU 81 HA LEU 81 21.883 -9.165 -3.477 639 1HB LEU 81 HB2 LEU 81 21.196 -9.891 -0.715 640 2HB LEU 81 HB1 LEU 81 20.709 -10.818 -2.108 641 HG LEU 81 HG LEU 81 23.544 -10.349 -1.154 642 1HD1 LEU 81 HD11 LEU 81 21.869 -12.851 -1.187 643 2HD1 LEU 81 HD12 LEU 81 22.326 -11.920 0.238 644 3HD1 LEU 81 HD13 LEU 81 23.564 -12.750 -0.709 645 1HD2 LEU 81 HD21 LEU 81 24.200 -11.936 -2.914 646 2HD2 LEU 81 HD22 LEU 81 23.488 -10.472 -3.584 647 3HD2 LEU 81 HD23 LEU 81 22.538 -11.957 -3.502 648 H ALA 82 HN ALA 82 19.424 -9.980 -3.579 649 HA ALA 82 HA ALA 82 17.654 -7.935 -2.722 650 1HB ALA 82 HB1 ALA 82 17.868 -8.933 -5.565 651 2HB ALA 82 HB2 ALA 82 18.273 -7.314 -4.999 652 3HB ALA 82 HB3 ALA 82 16.598 -7.870 -4.959 653 H GLY 83 HN GLY 83 16.439 -9.131 -1.450 654 1HA GLY 83 HA2 GLY 83 14.722 -10.725 -1.075 655 2HA GLY 83 HA1 GLY 83 15.302 -11.620 -2.486 656 H ALA 84 HN ALA 84 16.908 -10.326 0.350 657 HA ALA 84 HA ALA 84 18.205 -12.920 0.676 658 1HB ALA 84 HB1 ALA 84 19.162 -10.187 1.500 659 2HB ALA 84 HB2 ALA 84 19.730 -11.117 0.111 660 3HB ALA 84 HB3 ALA 84 20.029 -11.703 1.748 661 H VAL 85 HN VAL 85 17.880 -13.974 2.496 662 HA VAL 85 HA VAL 85 16.321 -12.646 4.564 663 HB VAL 85 HB VAL 85 16.805 -15.578 4.107 664 1HG1 VAL 85 HG11 VAL 85 15.012 -15.920 5.781 665 2HG1 VAL 85 HG12 VAL 85 15.020 -14.175 6.087 666 3HG1 VAL 85 HG13 VAL 85 16.447 -15.140 6.446 667 1HG2 VAL 85 HG21 VAL 85 15.399 -14.624 2.370 668 2HG2 VAL 85 HG22 VAL 85 14.336 -13.924 3.593 669 3HG2 VAL 85 HG23 VAL 85 14.445 -15.674 3.417 670 H THR 86 HN THR 86 17.172 -12.220 6.350 671 HA THR 86 HA THR 86 19.854 -13.145 7.060 672 HB THR 86 HB THR 86 18.109 -10.970 8.257 673 HG1 THR 86 HG1 THR 86 18.745 -10.429 6.190 674 1HG2 THR 86 HG21 THR 86 19.781 -11.849 9.853 675 2HG2 THR 86 HG22 THR 86 20.170 -10.200 9.362 676 3HG2 THR 86 HG23 THR 86 21.058 -11.555 8.670 677 H THR 87 HN THR 87 20.053 -14.650 8.680 678 HA THR 87 HA THR 87 17.593 -15.460 10.004 679 HB THR 87 HB THR 87 20.293 -16.847 9.922 680 HG1 THR 87 HG1 THR 87 19.665 -17.337 7.983 681 1HG2 THR 87 HG21 THR 87 19.028 -18.820 10.698 682 2HG2 THR 87 HG22 THR 87 17.558 -17.850 10.768 683 3HG2 THR 87 HG23 THR 87 18.898 -17.496 11.856 684 H MET 88 HN MET 88 17.208 -14.715 11.955 685 HA MET 88 HA MET 88 19.395 -13.592 13.543 686 1HB MET 88 HB2 MET 88 17.431 -12.174 12.922 687 2HB MET 88 HB1 MET 88 16.404 -13.286 13.794 688 1HG MET 88 HG2 MET 88 16.810 -11.385 15.158 689 2HG MET 88 HG1 MET 88 17.646 -12.773 15.851 690 1HE MET 88 HE1 MET 88 19.732 -9.374 13.525 691 2HE MET 88 HE2 MET 88 18.001 -9.416 13.857 692 3HE MET 88 HE3 MET 88 18.712 -10.570 12.731 693 H HIS 89 HN HIS 89 19.779 -14.380 15.593 694 HA HIS 89 HA HIS 89 18.453 -16.903 16.262 695 1HB HIS 89 HB2 HIS 89 20.942 -15.607 17.403 696 2HB HIS 89 HB1 HIS 89 20.289 -17.154 17.925 697 HD1 HIS 89 HD1 HIS 89 21.151 -19.140 16.730 698 HD2 HIS 89 HD2 HIS 89 21.818 -15.655 14.596 699 HE1 HIS 89 HE1 HIS 89 22.613 -19.800 14.790 700 HE2 HIS 89 HE2 HIS 89 22.658 -17.762 13.365 701 H VAL 90 HN VAL 90 16.969 -16.949 17.762 702 HA VAL 90 HA VAL 90 16.602 -14.565 19.472 703 HB VAL 90 HB VAL 90 14.639 -16.838 19.029 704 1HG1 VAL 90 HG11 VAL 90 14.304 -15.651 21.115 705 2HG1 VAL 90 HG12 VAL 90 12.994 -15.305 19.986 706 3HG1 VAL 90 HG13 VAL 90 14.272 -14.116 20.247 707 1HG2 VAL 90 HG21 VAL 90 14.993 -15.674 16.922 708 2HG2 VAL 90 HG22 VAL 90 14.698 -14.126 17.719 709 3HG2 VAL 90 HG23 VAL 90 13.401 -15.315 17.590 710 H ILE 91 HN ILE 91 17.210 -14.512 21.282 711 HA ILE 91 HA ILE 91 17.692 -16.930 22.866 712 HB ILE 91 HB ILE 91 18.605 -14.106 22.997 713 1HG1 ILE 91 HG12 ILE 91 19.804 -15.331 21.322 714 2HG1 ILE 91 HG11 ILE 91 20.891 -15.018 22.669 715 1HG2 ILE 91 HG21 ILE 91 20.046 -14.788 24.969 716 2HG2 ILE 91 HG22 ILE 91 19.275 -16.371 24.929 717 3HG2 ILE 91 HG23 ILE 91 18.320 -14.942 25.311 718 1HD1 ILE 91 HD11 ILE 91 19.507 -17.632 22.073 719 2HD1 ILE 91 HD12 ILE 91 20.582 -17.327 23.437 720 3HD1 ILE 91 HD13 ILE 91 21.207 -17.253 21.792 721 H ILE 92 HN ILE 92 16.237 -17.430 24.184 722 HA ILE 92 HA ILE 92 14.217 -15.508 24.973 723 HB ILE 92 HB ILE 92 14.365 -18.511 25.308 724 1HG1 ILE 92 HG12 ILE 92 12.287 -18.515 23.874 725 2HG1 ILE 92 HG11 ILE 92 12.524 -16.798 23.619 726 1HG2 ILE 92 HG21 ILE 92 12.105 -18.431 26.208 727 2HG2 ILE 92 HG22 ILE 92 12.242 -16.658 26.272 728 3HG2 ILE 92 HG23 ILE 92 13.326 -17.666 27.232 729 1HD1 ILE 92 HD11 ILE 92 13.255 -18.086 21.731 730 2HD1 ILE 92 HD12 ILE 92 14.381 -19.000 22.740 731 3HD1 ILE 92 HD13 ILE 92 14.621 -17.263 22.480 732 H GLN 93 HN GLN 93 14.372 -14.506 26.847 733 HA GLN 93 HA GLN 93 15.776 -15.878 28.997 734 1HB GLN 93 HB2 GLN 93 15.485 -12.918 28.494 735 2HB GLN 93 HB1 GLN 93 16.038 -13.578 30.027 736 1HG GLN 93 HG2 GLN 93 17.380 -14.011 27.363 737 2HG GLN 93 HG1 GLN 93 17.890 -12.839 28.575 738 1HE2 GLN 93 HE21 GLN 93 19.888 -13.795 28.813 739 2HE2 GLN 93 HE22 GLN 93 20.114 -15.311 29.609 740 H ALA 94 HN ALA 94 14.514 -16.736 30.295 741 HA ALA 94 HA ALA 94 11.739 -16.146 30.432 742 1HB ALA 94 HB1 ALA 94 11.637 -17.932 32.095 743 2HB ALA 94 HB2 ALA 94 13.397 -17.948 32.191 744 3HB ALA 94 HB3 ALA 94 12.594 -18.427 30.696 745 HA PRO 95 HA PRO 95 11.951 -12.909 33.541 746 1HB PRO 95 HB2 PRO 95 9.151 -13.695 34.020 747 2HB PRO 95 HB1 PRO 95 9.798 -12.117 33.576 748 1HG PRO 95 HG2 PRO 95 8.421 -13.624 31.829 749 2HG PRO 95 HG1 PRO 95 9.755 -12.579 31.318 750 1HD PRO 95 HD2 PRO 95 9.678 -15.538 31.645 751 2HD PRO 95 HD1 PRO 95 10.571 -14.535 30.483 752 H VAL 96 HN VAL 96 12.302 -13.004 35.698 753 HA VAL 96 HA VAL 96 12.447 -15.546 36.929 754 HB VAL 96 HB VAL 96 14.056 -13.801 37.535 755 1HG1 VAL 96 HG11 VAL 96 12.677 -11.829 37.370 756 2HG1 VAL 96 HG12 VAL 96 13.442 -11.911 38.960 757 3HG1 VAL 96 HG13 VAL 96 11.742 -12.344 38.777 758 1HG2 VAL 96 HG21 VAL 96 13.976 -14.009 39.997 759 2HG2 VAL 96 HG22 VAL 96 13.702 -15.537 39.164 760 3HG2 VAL 96 HG23 VAL 96 12.341 -14.660 39.857 761 H THR 97 HN THR 97 10.084 -12.991 37.018 762 HA THR 97 HA THR 97 8.318 -14.807 38.409 763 HB THR 97 HB THR 97 9.126 -13.270 40.152 764 HG1 THR 97 HG1 THR 97 6.838 -12.076 40.222 765 1HG2 THR 97 HG21 THR 97 9.784 -11.363 38.746 766 2HG2 THR 97 HG22 THR 97 8.692 -10.846 40.027 767 3HG2 THR 97 HG23 THR 97 8.090 -11.045 38.378 768 H GLU 98 HN GLU 98 6.182 -14.622 37.724 769 HA GLU 98 HA GLU 98 5.275 -12.537 36.001 770 1HB GLU 98 HB2 GLU 98 6.810 -13.816 34.473 771 2HB GLU 98 HB1 GLU 98 5.794 -15.226 34.720 772 1HG GLU 98 HG2 GLU 98 3.899 -13.946 33.802 773 2HG GLU 98 HG1 GLU 98 5.012 -12.638 33.428 774 H LYS 99 HN LYS 99 4.922 -16.062 36.418 775 HA LYS 99 HA LYS 99 2.677 -16.133 37.942 776 1HB LYS 99 HB2 LYS 99 1.476 -15.087 36.096 777 2HB LYS 99 HB1 LYS 99 2.052 -16.314 34.981 778 1HG LYS 99 HG2 LYS 99 0.730 -17.996 36.197 779 2HG LYS 99 HG1 LYS 99 0.134 -16.726 37.273 780 1HD LYS 99 HD2 LYS 99 -0.870 -15.563 35.389 781 2HD LYS 99 HD1 LYS 99 -0.204 -16.759 34.277 782 1HE LYS 99 HE2 LYS 99 -1.574 -18.492 35.355 783 2HE LYS 99 HE1 LYS 99 -2.233 -17.270 36.441 784 1HZ LYS 99 HZ1 LYS 99 -3.186 -16.142 34.568 785 2HZ LYS 99 HZ2 LYS 99 -3.705 -17.738 34.563 786 3HZ LYS 99 HZ3 LYS 99 -2.511 -17.234 33.487 787 H GLU 100 HN GLU 100 3.358 -17.776 34.869 788 HA GLU 100 HA GLU 100 4.049 -19.819 34.286 789 1HB GLU 100 HB2 GLU 100 5.956 -19.362 35.899 790 2HB GLU 100 HB1 GLU 100 5.034 -20.148 37.161 791 1HG GLU 100 HG2 GLU 100 5.970 -21.542 34.649 792 2HG GLU 100 HG1 GLU 100 6.935 -21.455 36.112 793 H LYS 101 HN LYS 101 2.208 -20.688 33.758 794 HA LYS 101 HA LYS 101 0.737 -22.244 35.742 795 1HB LYS 101 HB2 LYS 101 -0.422 -20.115 35.362 796 2HB LYS 101 HB1 LYS 101 -0.420 -20.399 33.631 797 1HG LYS 101 HG2 LYS 101 -2.626 -20.836 34.564 798 2HG LYS 101 HG1 LYS 101 -1.920 -22.336 33.974 799 1HD LYS 101 HD2 LYS 101 -1.343 -23.002 36.227 800 2HD LYS 101 HD1 LYS 101 -1.871 -21.438 36.854 801 1HE LYS 101 HE2 LYS 101 -3.544 -23.188 37.267 802 2HE LYS 101 HE1 LYS 101 -4.170 -21.934 36.207 803 1HZ LYS 101 HZ1 LYS 101 -3.154 -24.588 35.328 804 2HZ LYS 101 HZ2 LYS 101 -3.830 -23.433 34.308 805 3HZ LYS 101 HZ3 LYS 101 -4.762 -24.173 35.485 Start of MODEL 16 1 H GLU 1 HT1 GLU 1 2.928 -14.146 7.442 2 HA GLU 1 HA GLU 1 5.566 -12.890 7.383 3 1HB GLU 1 HB2 GLU 1 6.204 -14.846 5.987 4 2HB GLU 1 HB1 GLU 1 5.809 -15.283 7.640 5 1HG GLU 1 HG2 GLU 1 3.637 -16.093 6.925 6 2HG GLU 1 HG1 GLU 1 3.978 -15.603 5.266 7 H ALA 2 HN ALA 2 6.063 -11.805 5.576 8 HA ALA 2 HA ALA 2 4.614 -12.041 3.149 9 1HB ALA 2 HB1 ALA 2 2.983 -10.673 4.397 10 2HB ALA 2 HB2 ALA 2 3.696 -9.763 3.065 11 3HB ALA 2 HB3 ALA 2 4.236 -9.474 4.716 12 H GLU 3 HN GLU 3 6.584 -12.336 2.265 13 HA GLU 3 HA GLU 3 8.731 -10.630 2.719 14 1HB GLU 3 HB2 GLU 3 8.385 -12.513 0.389 15 2HB GLU 3 HB1 GLU 3 9.896 -11.867 0.996 16 1HG GLU 3 HG2 GLU 3 9.949 -13.996 1.846 17 2HG GLU 3 HG1 GLU 3 9.189 -13.143 3.184 18 H VAL 4 HN VAL 4 9.471 -8.894 1.459 19 HA VAL 4 HA VAL 4 7.725 -8.135 -0.754 20 HB VAL 4 HB VAL 4 9.450 -6.342 0.995 21 1HG1 VAL 4 HG11 VAL 4 8.494 -4.448 -0.235 22 2HG1 VAL 4 HG12 VAL 4 7.650 -5.576 -1.299 23 3HG1 VAL 4 HG13 VAL 4 9.413 -5.513 -1.306 24 1HG2 VAL 4 HG21 VAL 4 7.402 -7.082 2.090 25 2HG2 VAL 4 HG22 VAL 4 6.450 -6.526 0.714 26 3HG2 VAL 4 HG23 VAL 4 7.320 -5.360 1.715 27 H HIS 5 HN HIS 5 10.768 -8.708 0.237 28 HA HIS 5 HA HIS 5 12.749 -9.143 -0.677 29 1HB HIS 5 HB2 HIS 5 11.222 -9.548 -3.253 30 2HB HIS 5 HB1 HIS 5 12.917 -9.947 -2.961 31 HD1 HIS 5 HD1 HIS 5 13.047 -11.536 -0.524 32 HD2 HIS 5 HD2 HIS 5 9.733 -11.803 -3.023 33 HE1 HIS 5 HE1 HIS 5 12.013 -13.747 -0.024 34 HE2 HIS 5 HE2 HIS 5 10.176 -13.991 -1.712 35 H ASN 6 HN ASN 6 11.321 -6.431 -1.219 36 HA ASN 6 HA ASN 6 13.491 -5.274 -2.824 37 1HB ASN 6 HB2 ASN 6 10.871 -4.059 -1.890 38 2HB ASN 6 HB1 ASN 6 12.141 -3.103 -2.625 39 1HD2 ASN 6 HD21 ASN 6 9.752 -5.621 -3.196 40 2HD2 ASN 6 HD22 ASN 6 9.788 -5.510 -4.903 41 H GLN 7 HN GLN 7 12.003 -5.182 0.335 42 HA GLN 7 HA GLN 7 14.271 -3.762 1.421 43 1HB GLN 7 HB2 GLN 7 11.671 -4.750 2.651 44 2HB GLN 7 HB1 GLN 7 12.964 -4.042 3.590 45 1HG GLN 7 HG2 GLN 7 11.252 -2.405 3.265 46 2HG GLN 7 HG1 GLN 7 12.652 -1.920 2.319 47 1HE2 GLN 7 HE21 GLN 7 9.366 -3.016 2.259 48 2HE2 GLN 7 HE22 GLN 7 9.079 -2.691 0.600 49 H LEU 8 HN LEU 8 14.576 -5.164 3.862 50 HA LEU 8 HA LEU 8 15.252 -7.730 2.730 51 1HB LEU 8 HB2 LEU 8 16.782 -8.012 4.643 52 2HB LEU 8 HB1 LEU 8 17.289 -6.780 3.511 53 HG LEU 8 HG LEU 8 15.962 -6.164 6.178 54 1HD1 LEU 8 HD11 LEU 8 18.235 -5.741 7.004 55 2HD1 LEU 8 HD12 LEU 8 18.899 -6.294 5.469 56 3HD1 LEU 8 HD13 LEU 8 18.050 -7.429 6.524 57 1HD2 LEU 8 HD21 LEU 8 15.938 -4.346 4.501 58 2HD2 LEU 8 HD22 LEU 8 17.684 -4.504 4.323 59 3HD2 LEU 8 HD23 LEU 8 16.998 -3.974 5.855 60 H GLU 9 HN GLU 9 14.441 -9.551 3.487 61 HA GLU 9 HA GLU 9 12.419 -9.239 5.519 62 1HB GLU 9 HB2 GLU 9 13.108 -11.593 3.763 63 2HB GLU 9 HB1 GLU 9 11.968 -11.661 5.067 64 1HG GLU 9 HG2 GLU 9 10.795 -11.464 2.995 65 2HG GLU 9 HG1 GLU 9 10.558 -10.010 3.946 66 H ILE 10 HN ILE 10 12.455 -10.171 7.389 67 HA ILE 10 HA ILE 10 14.901 -11.618 8.168 68 HB ILE 10 HB ILE 10 13.435 -9.527 9.811 69 1HG1 ILE 10 HG12 ILE 10 16.248 -9.506 8.678 70 2HG1 ILE 10 HG11 ILE 10 14.904 -8.609 7.996 71 1HG2 ILE 10 HG21 ILE 10 14.199 -11.306 11.241 72 2HG2 ILE 10 HG22 ILE 10 15.157 -9.848 11.503 73 3HG2 ILE 10 HG23 ILE 10 15.828 -11.184 10.565 74 1HD1 ILE 10 HD11 ILE 10 14.768 -7.294 10.065 75 2HD1 ILE 10 HD12 ILE 10 16.347 -7.173 9.289 76 3HD1 ILE 10 HD13 ILE 10 16.140 -8.198 10.715 77 H LYS 11 HN LYS 11 14.575 -13.352 9.330 78 HA LYS 11 HA LYS 11 11.911 -13.737 10.434 79 1HB LYS 11 HB2 LYS 11 12.163 -16.182 10.294 80 2HB LYS 11 HB1 LYS 11 12.190 -15.423 8.715 81 1HG LYS 11 HG2 LYS 11 14.474 -15.880 8.425 82 2HG LYS 11 HG1 LYS 11 14.714 -16.187 10.150 83 1HD LYS 11 HD2 LYS 11 14.660 -18.274 8.786 84 2HD LYS 11 HD1 LYS 11 13.423 -18.216 10.035 85 1HE LYS 11 HE2 LYS 11 11.803 -17.450 8.289 86 2HE LYS 11 HE1 LYS 11 13.063 -17.717 7.080 87 1HZ LYS 11 HZ1 LYS 11 13.107 -20.049 7.719 88 2HZ LYS 11 HZ2 LYS 11 11.535 -19.600 7.283 89 3HZ LYS 11 HZ3 LYS 11 11.948 -19.759 8.910 90 H PHE 12 HN PHE 12 11.853 -14.830 12.459 91 HA PHE 12 HA PHE 12 14.303 -14.286 13.973 92 1HB PHE 12 HB2 PHE 12 11.447 -14.472 14.929 93 2HB PHE 12 HB1 PHE 12 12.844 -14.007 15.894 94 HD1 PHE 12 HD1 PHE 12 14.185 -11.968 15.029 95 HD2 PHE 12 HD2 PHE 12 10.174 -12.844 13.923 96 HE1 PHE 12 HE1 PHE 12 13.853 -9.619 14.391 97 HE2 PHE 12 HE2 PHE 12 9.832 -10.503 13.283 98 HZ PHE 12 HZ PHE 12 11.669 -8.886 13.513 99 H ARG 13 HN ARG 13 15.392 -16.057 14.554 100 HA ARG 13 HA ARG 13 13.816 -18.484 14.958 101 1HB ARG 13 HB2 ARG 13 15.294 -18.731 13.019 102 2HB ARG 13 HB1 ARG 13 16.663 -18.267 14.002 103 1HG ARG 13 HG2 ARG 13 16.554 -20.268 15.288 104 2HG ARG 13 HG1 ARG 13 15.002 -20.706 14.574 105 1HD ARG 13 HD2 ARG 13 17.566 -20.428 13.018 106 2HD ARG 13 HD1 ARG 13 16.955 -21.950 13.666 107 HE ARG 13 HE ARG 13 14.887 -21.396 12.256 108 1HH1 ARG 13 HH11 ARG 13 18.170 -20.465 11.249 109 2HH1 ARG 13 HH12 ARG 13 17.811 -20.659 9.595 110 1HH2 ARG 13 HH21 ARG 13 14.466 -21.666 10.068 111 2HH2 ARG 13 HH22 ARG 13 15.662 -21.360 8.886 112 H LEU 14 HN LEU 14 13.781 -19.352 16.802 113 HA LEU 14 HA LEU 14 15.090 -18.181 19.072 114 1HB LEU 14 HB2 LEU 14 13.490 -20.719 18.840 115 2HB LEU 14 HB1 LEU 14 13.907 -19.899 20.320 116 HG LEU 14 HG LEU 14 12.018 -18.877 18.196 117 1HD1 LEU 14 HD11 LEU 14 10.314 -19.248 19.853 118 2HD1 LEU 14 HD12 LEU 14 11.512 -19.899 20.972 119 3HD1 LEU 14 HD13 LEU 14 11.149 -20.753 19.472 120 1HD2 LEU 14 HD21 LEU 14 12.792 -17.718 20.865 121 2HD2 LEU 14 HD22 LEU 14 11.547 -17.089 19.787 122 3HD2 LEU 14 HD23 LEU 14 13.233 -17.068 19.290 123 H THR 15 HN THR 15 16.236 -19.562 20.631 124 HA THR 15 HA THR 15 18.329 -21.144 19.514 125 HB THR 15 HB THR 15 18.516 -19.789 21.559 126 HG1 THR 15 HG1 THR 15 19.897 -21.655 21.203 127 1HG2 THR 15 HG21 THR 15 17.634 -20.659 23.723 128 2HG2 THR 15 HG22 THR 15 16.750 -21.891 22.823 129 3HG2 THR 15 HG23 THR 15 16.374 -20.185 22.585 130 H ASP 16 HN ASP 16 15.237 -21.635 20.360 131 HA ASP 16 HA ASP 16 15.147 -24.436 21.088 132 1HB ASP 16 HB2 ASP 16 13.447 -22.862 21.855 133 2HB ASP 16 HB1 ASP 16 12.989 -22.498 20.203 134 H GLY 17 HN GLY 17 15.614 -22.823 18.167 135 1HA GLY 17 HA2 GLY 17 15.995 -23.767 16.070 136 2HA GLY 17 HA1 GLY 17 15.293 -25.272 16.647 137 H SER 18 HN SER 18 13.252 -22.881 17.472 138 HA SER 18 HA SER 18 11.554 -23.396 15.166 139 1HB SER 18 HB2 SER 18 10.940 -22.232 17.886 140 2HB SER 18 HB1 SER 18 9.747 -22.569 16.631 141 HG SER 18 HG SER 18 11.049 -24.317 18.365 142 H ASP 19 HN ASP 19 11.149 -21.756 13.693 143 HA ASP 19 HA ASP 19 11.897 -19.116 14.553 144 1HB ASP 19 HB2 ASP 19 12.439 -18.630 12.186 145 2HB ASP 19 HB1 ASP 19 13.574 -19.711 12.993 146 H ILE 20 HN ILE 20 10.946 -17.435 13.314 147 HA ILE 20 HA ILE 20 8.067 -17.926 13.002 148 HB ILE 20 HB ILE 20 9.582 -15.355 13.591 149 1HG1 ILE 20 HG12 ILE 20 7.865 -17.065 15.414 150 2HG1 ILE 20 HG11 ILE 20 9.619 -16.947 15.473 151 1HG2 ILE 20 HG21 ILE 20 6.601 -15.855 13.537 152 2HG2 ILE 20 HG22 ILE 20 7.517 -14.928 12.353 153 3HG2 ILE 20 HG23 ILE 20 7.392 -14.352 14.014 154 1HD1 ILE 20 HD11 ILE 20 9.426 -14.581 16.080 155 2HD1 ILE 20 HD12 ILE 20 8.589 -15.625 17.224 156 3HD1 ILE 20 HD13 ILE 20 7.668 -14.715 16.026 157 H GLY 21 HN GLY 21 7.033 -17.258 11.144 158 1HA GLY 21 HA2 GLY 21 8.288 -17.308 8.701 159 2HA GLY 21 HA1 GLY 21 6.716 -16.578 8.988 160 HA PRO 22 HA PRO 22 10.463 -13.538 8.365 161 1HB PRO 22 HB2 PRO 22 10.754 -13.365 5.701 162 2HB PRO 22 HB1 PRO 22 11.635 -14.523 6.697 163 1HG PRO 22 HG2 PRO 22 9.172 -14.962 5.045 164 2HG PRO 22 HG1 PRO 22 10.607 -15.991 5.195 165 1HD PRO 22 HD2 PRO 22 8.318 -16.497 6.538 166 2HD PRO 22 HD1 PRO 22 9.920 -16.873 7.206 167 H LYS 23 HN LYS 23 10.248 -11.443 8.032 168 HA LYS 23 HA LYS 23 7.914 -10.450 6.575 169 1HB LYS 23 HB2 LYS 23 8.807 -9.468 9.299 170 2HB LYS 23 HB1 LYS 23 7.548 -8.732 8.313 171 1HG LYS 23 HG2 LYS 23 6.241 -10.731 8.431 172 2HG LYS 23 HG1 LYS 23 7.571 -11.495 9.298 173 1HD LYS 23 HD2 LYS 23 5.814 -10.859 10.901 174 2HD LYS 23 HD1 LYS 23 7.231 -9.846 11.149 175 1HE LYS 23 HE2 LYS 23 6.193 -8.035 9.914 176 2HE LYS 23 HE1 LYS 23 4.800 -9.050 9.546 177 1HZ LYS 23 HZ1 LYS 23 4.384 -9.175 11.997 178 2HZ LYS 23 HZ2 LYS 23 4.244 -7.643 11.342 179 3HZ LYS 23 HZ3 LYS 23 5.589 -8.017 12.233 180 H ALA 24 HN ALA 24 8.176 -8.238 6.210 181 HA ALA 24 HA ALA 24 10.910 -7.815 5.223 182 1HB ALA 24 HB1 ALA 24 9.111 -7.669 3.569 183 2HB ALA 24 HB2 ALA 24 10.011 -6.161 3.688 184 3HB ALA 24 HB3 ALA 24 8.421 -6.302 4.444 185 H PHE 25 HN PHE 25 12.263 -6.428 6.098 186 HA PHE 25 HA PHE 25 11.187 -4.260 7.755 187 1HB PHE 25 HB2 PHE 25 13.715 -5.849 8.223 188 2HB PHE 25 HB1 PHE 25 13.124 -4.524 9.204 189 HD1 PHE 25 HD1 PHE 25 12.519 -7.971 8.164 190 HD2 PHE 25 HD2 PHE 25 11.539 -4.915 10.930 191 HE1 PHE 25 HE1 PHE 25 11.395 -9.620 9.561 192 HE2 PHE 25 HE2 PHE 25 10.404 -6.579 12.344 193 HZ PHE 25 HZ PHE 25 10.375 -8.982 11.604 194 HA PRO 26 HA PRO 26 13.731 -2.117 4.716 195 1HB PRO 26 HB2 PRO 26 13.028 0.100 6.553 196 2HB PRO 26 HB1 PRO 26 12.922 0.055 4.801 197 1HG PRO 26 HG2 PRO 26 10.728 -0.121 6.279 198 2HG PRO 26 HG1 PRO 26 10.899 -1.154 4.850 199 1HD PRO 26 HD2 PRO 26 11.263 -1.841 7.741 200 2HD PRO 26 HD1 PRO 26 10.505 -2.787 6.438 201 H ASP 27 HN ASP 27 15.806 -1.308 4.859 202 HA ASP 27 HA ASP 27 17.360 -1.942 7.101 203 1HB ASP 27 HB2 ASP 27 19.245 -0.825 5.923 204 2HB ASP 27 HB1 ASP 27 18.349 -1.942 4.904 205 H ALA 28 HN ALA 28 15.722 0.922 6.244 206 HA ALA 28 HA ALA 28 17.143 2.559 8.151 207 1HB ALA 28 HB1 ALA 28 16.240 3.542 6.095 208 2HB ALA 28 HB2 ALA 28 15.608 4.337 7.535 209 3HB ALA 28 HB3 ALA 28 14.605 3.188 6.652 210 H THR 29 HN THR 29 14.904 0.170 8.635 211 HA THR 29 HA THR 29 13.244 1.487 10.566 212 HB THR 29 HB THR 29 13.551 -1.446 9.875 213 HG1 THR 29 HG1 THR 29 12.459 0.647 8.680 214 1HG2 THR 29 HG21 THR 29 11.348 -0.038 11.416 215 2HG2 THR 29 HG22 THR 29 12.542 -1.127 12.122 216 3HG2 THR 29 HG23 THR 29 11.364 -1.742 10.961 217 H THR 30 HN THR 30 13.231 1.236 12.792 218 HA THR 30 HA THR 30 15.752 1.067 14.038 219 HB THR 30 HB THR 30 14.398 1.429 16.121 220 HG1 THR 30 HG1 THR 30 12.178 1.895 14.451 221 1HG2 THR 30 HG21 THR 30 13.867 3.290 13.795 222 2HG2 THR 30 HG22 THR 30 15.293 3.309 14.834 223 3HG2 THR 30 HG23 THR 30 13.711 3.713 15.501 224 H VAL 31 HN VAL 31 16.456 -0.396 15.653 225 HA VAL 31 HA VAL 31 15.654 -3.097 15.391 226 HB VAL 31 HB VAL 31 17.429 -1.737 17.451 227 1HG1 VAL 31 HG11 VAL 31 16.446 -3.842 18.336 228 2HG1 VAL 31 HG12 VAL 31 18.182 -3.923 18.133 229 3HG1 VAL 31 HG13 VAL 31 17.124 -4.713 16.956 230 1HG2 VAL 31 HG21 VAL 31 18.296 -1.677 15.180 231 2HG2 VAL 31 HG22 VAL 31 18.077 -3.420 15.032 232 3HG2 VAL 31 HG23 VAL 31 19.253 -2.773 16.176 233 H SER 32 HN SER 32 14.703 -0.477 17.500 234 HA SER 32 HA SER 32 13.389 -1.983 19.417 235 1HB SER 32 HB2 SER 32 11.970 0.157 19.618 236 2HB SER 32 HB1 SER 32 13.701 0.322 19.887 237 HG SER 32 HG SER 32 12.124 1.194 17.755 238 H ALA 33 HN ALA 33 12.199 -0.663 16.321 239 HA ALA 33 HA ALA 33 9.618 -1.806 16.519 240 1HB ALA 33 HB1 ALA 33 10.143 0.016 14.963 241 2HB ALA 33 HB2 ALA 33 9.452 -1.367 14.111 242 3HB ALA 33 HB3 ALA 33 11.187 -1.069 14.049 243 H LEU 34 HN LEU 34 12.732 -3.078 15.408 244 HA LEU 34 HA LEU 34 11.868 -5.327 14.100 245 1HB LEU 34 HB2 LEU 34 14.076 -4.366 13.891 246 2HB LEU 34 HB1 LEU 34 14.337 -4.554 15.612 247 HG LEU 34 HG LEU 34 14.325 -6.852 15.407 248 1HD1 LEU 34 HD11 LEU 34 14.168 -6.367 12.398 249 2HD1 LEU 34 HD12 LEU 34 12.942 -7.171 13.375 250 3HD1 LEU 34 HD13 LEU 34 14.506 -7.945 13.106 251 1HD2 LEU 34 HD21 LEU 34 16.429 -5.759 15.336 252 2HD2 LEU 34 HD22 LEU 34 16.300 -5.491 13.599 253 3HD2 LEU 34 HD23 LEU 34 16.511 -7.125 14.226 254 H LYS 35 HN LYS 35 12.839 -4.717 17.487 255 HA LYS 35 HA LYS 35 12.347 -7.381 18.336 256 1HB LYS 35 HB2 LYS 35 13.836 -5.812 19.549 257 2HB LYS 35 HB1 LYS 35 12.432 -4.890 20.025 258 1HG LYS 35 HG2 LYS 35 11.502 -6.744 21.266 259 2HG LYS 35 HG1 LYS 35 12.807 -7.794 20.738 260 1HD LYS 35 HD2 LYS 35 13.154 -5.339 22.450 261 2HD LYS 35 HD1 LYS 35 13.045 -6.989 23.070 262 1HE LYS 35 HE2 LYS 35 15.045 -7.554 21.689 263 2HE LYS 35 HE1 LYS 35 15.183 -5.845 21.278 264 1HZ LYS 35 HZ1 LYS 35 15.295 -6.978 24.019 265 2HZ LYS 35 HZ2 LYS 35 15.483 -5.341 23.643 266 3HZ LYS 35 HZ3 LYS 35 16.619 -6.463 23.126 267 H GLU 36 HN GLU 36 10.486 -4.416 18.485 268 HA GLU 36 HA GLU 36 8.222 -5.348 19.811 269 1HB GLU 36 HB2 GLU 36 8.441 -3.324 17.592 270 2HB GLU 36 HB1 GLU 36 6.978 -3.586 18.509 271 1HG GLU 36 HG2 GLU 36 9.616 -2.656 19.629 272 2HG GLU 36 HG1 GLU 36 8.236 -1.624 19.283 273 H THR 37 HN THR 37 9.204 -5.791 16.487 274 HA THR 37 HA THR 37 6.807 -6.920 15.558 275 HB THR 37 HB THR 37 9.647 -7.372 14.593 276 HG1 THR 37 HG1 THR 37 8.860 -5.198 14.445 277 1HG2 THR 37 HG21 THR 37 8.151 -9.171 13.838 278 2HG2 THR 37 HG22 THR 37 8.606 -8.126 12.486 279 3HG2 THR 37 HG23 THR 37 7.017 -7.969 13.227 280 H VAL 38 HN VAL 38 9.716 -8.363 17.024 281 HA VAL 38 HA VAL 38 9.026 -11.083 16.833 282 HB VAL 38 HB VAL 38 10.447 -9.795 19.183 283 1HG1 VAL 38 HG11 VAL 38 11.581 -11.961 19.415 284 2HG1 VAL 38 HG12 VAL 38 10.584 -12.602 18.109 285 3HG1 VAL 38 HG13 VAL 38 9.833 -12.081 19.617 286 1HG2 VAL 38 HG21 VAL 38 12.554 -10.234 18.008 287 2HG2 VAL 38 HG22 VAL 38 11.536 -9.096 17.124 288 3HG2 VAL 38 HG23 VAL 38 11.646 -10.776 16.600 289 H ILE 39 HN ILE 39 8.433 -8.701 19.317 290 HA ILE 39 HA ILE 39 7.058 -10.207 21.215 291 HB ILE 39 HB ILE 39 6.593 -7.284 20.540 292 1HG1 ILE 39 HG12 ILE 39 8.667 -8.554 22.345 293 2HG1 ILE 39 HG11 ILE 39 8.984 -7.768 20.807 294 1HG2 ILE 39 HG21 ILE 39 6.017 -7.074 22.934 295 2HG2 ILE 39 HG22 ILE 39 6.246 -8.803 23.137 296 3HG2 ILE 39 HG23 ILE 39 4.939 -8.207 22.112 297 1HD1 ILE 39 HD11 ILE 39 9.571 -6.344 22.660 298 2HD1 ILE 39 HD12 ILE 39 7.933 -6.481 23.296 299 3HD1 ILE 39 HD13 ILE 39 8.214 -5.641 21.777 300 H SER 40 HN SER 40 5.917 -8.506 18.365 301 HA SER 40 HA SER 40 3.153 -8.948 18.887 302 1HB SER 40 HB2 SER 40 4.563 -8.052 16.377 303 2HB SER 40 HB1 SER 40 2.821 -7.996 16.655 304 HG SER 40 HG SER 40 4.859 -6.597 18.036 305 H GLU 41 HN GLU 41 5.636 -10.633 16.908 306 HA GLU 41 HA GLU 41 3.745 -12.315 15.649 307 1HB GLU 41 HB2 GLU 41 6.737 -12.402 15.865 308 2HB GLU 41 HB1 GLU 41 5.746 -13.455 14.880 309 1HG GLU 41 HG2 GLU 41 6.012 -10.464 14.560 310 2HG GLU 41 HG1 GLU 41 6.801 -11.672 13.558 311 H TRP 42 HN TRP 42 5.214 -12.274 18.701 312 HA TRP 42 HA TRP 42 5.462 -15.073 19.171 313 1HB TRP 42 HB2 TRP 42 6.462 -13.036 20.505 314 2HB TRP 42 HB1 TRP 42 4.911 -13.018 21.323 315 HD1 TRP 42 HD1 TRP 42 4.885 -14.494 23.579 316 HE1 TRP 42 HE1 TRP 42 6.421 -16.322 24.540 317 HE3 TRP 42 HE3 TRP 42 7.906 -15.224 19.515 318 HZ2 TRP 42 HZ2 TRP 42 8.558 -17.933 23.643 319 HZ3 TRP 42 HZ3 TRP 42 9.631 -16.929 19.634 320 HH2 TRP 42 HH2 TRP 42 9.968 -18.263 21.644 321 HA PRO 43 HA PRO 43 1.115 -16.055 19.264 322 1HB PRO 43 HB2 PRO 43 1.976 -17.851 21.465 323 2HB PRO 43 HB1 PRO 43 0.974 -18.232 20.055 324 1HG PRO 43 HG2 PRO 43 3.505 -19.001 20.127 325 2HG PRO 43 HG1 PRO 43 2.823 -18.341 18.629 326 1HD PRO 43 HD2 PRO 43 4.667 -17.068 20.595 327 2HD PRO 43 HD1 PRO 43 4.595 -16.894 18.828 328 H ARG 44 HN ARG 44 -0.313 -14.820 20.170 329 HA ARG 44 HA ARG 44 0.106 -13.264 22.466 330 1HB ARG 44 HB2 ARG 44 -1.292 -12.590 20.581 331 2HB ARG 44 HB1 ARG 44 -2.431 -13.863 20.959 332 1HG ARG 44 HG2 ARG 44 -2.908 -12.740 23.110 333 2HG ARG 44 HG1 ARG 44 -1.823 -11.433 22.620 334 1HD ARG 44 HD2 ARG 44 -3.179 -11.028 20.637 335 2HD ARG 44 HD1 ARG 44 -4.244 -12.349 21.098 336 HE ARG 44 HE ARG 44 -4.013 -10.288 23.082 337 1HH1 ARG 44 HH11 ARG 44 -5.758 -11.384 20.211 338 2HH1 ARG 44 HH12 ARG 44 -7.116 -10.406 20.494 339 1HH2 ARG 44 HH21 ARG 44 -5.865 -8.949 23.474 340 2HH2 ARG 44 HH22 ARG 44 -7.188 -8.982 22.400 341 H GLU 45 HN GLU 45 -1.763 -16.138 21.935 342 HA GLU 45 HA GLU 45 -3.070 -16.264 24.449 343 1HB GLU 45 HB2 GLU 45 -3.850 -17.561 22.516 344 2HB GLU 45 HB1 GLU 45 -2.387 -18.529 22.569 345 1HG GLU 45 HG2 GLU 45 -3.031 -19.350 24.793 346 2HG GLU 45 HG1 GLU 45 -4.507 -18.397 24.700 347 H LYS 46 HN LYS 46 0.170 -17.126 23.495 348 HA LYS 46 HA LYS 46 0.706 -19.032 25.385 349 1HB LYS 46 HB2 LYS 46 2.303 -17.220 23.697 350 2HB LYS 46 HB1 LYS 46 3.134 -18.137 24.915 351 1HG LYS 46 HG2 LYS 46 1.413 -19.263 22.693 352 2HG LYS 46 HG1 LYS 46 3.186 -19.254 22.711 353 1HD LYS 46 HD2 LYS 46 3.145 -20.677 24.678 354 2HD LYS 46 HD1 LYS 46 1.385 -20.683 24.671 355 1HE LYS 46 HE2 LYS 46 1.457 -21.726 22.418 356 2HE LYS 46 HE1 LYS 46 3.214 -21.789 22.542 357 1HZ LYS 46 HZ1 LYS 46 2.249 -23.892 23.156 358 2HZ LYS 46 HZ2 LYS 46 1.262 -23.181 24.285 359 3HZ LYS 46 HZ3 LYS 46 2.940 -23.206 24.539 360 H GLU 47 HN GLU 47 2.362 -18.830 26.969 361 HA GLU 47 HA GLU 47 1.519 -17.613 29.238 362 1HB GLU 47 HB2 GLU 47 4.308 -18.389 28.474 363 2HB GLU 47 HB1 GLU 47 3.746 -18.074 30.103 364 1HG GLU 47 HG2 GLU 47 2.252 -19.959 29.977 365 2HG GLU 47 HG1 GLU 47 2.746 -20.263 28.306 366 H ASN 48 HN ASN 48 2.502 -16.017 30.536 367 HA ASN 48 HA ASN 48 3.346 -13.768 29.126 368 1HB ASN 48 HB2 ASN 48 2.965 -14.215 32.094 369 2HB ASN 48 HB1 ASN 48 3.444 -12.671 31.395 370 1HD2 ASN 48 HD21 ASN 48 1.109 -13.441 32.917 371 2HD2 ASN 48 HD22 ASN 48 -0.254 -12.971 31.956 372 H GLY 49 HN GLY 49 4.988 -14.920 28.350 373 1HA GLY 49 HA2 GLY 49 7.385 -15.278 30.053 374 2HA GLY 49 HA1 GLY 49 6.960 -16.263 28.684 375 HA PRO 50 HA PRO 50 10.004 -13.665 26.697 376 1HB PRO 50 HB2 PRO 50 9.436 -15.372 24.393 377 2HB PRO 50 HB1 PRO 50 10.933 -15.154 25.292 378 1HG PRO 50 HG2 PRO 50 9.553 -17.435 25.457 379 2HG PRO 50 HG1 PRO 50 10.379 -16.752 26.865 380 1HD PRO 50 HD2 PRO 50 7.488 -16.615 26.123 381 2HD PRO 50 HD1 PRO 50 8.283 -16.994 27.678 382 H LYS 51 HN LYS 51 7.598 -12.422 26.733 383 HA LYS 51 HA LYS 51 7.113 -11.842 23.904 384 1HB LYS 51 HB2 LYS 51 5.487 -10.876 26.248 385 2HB LYS 51 HB1 LYS 51 5.241 -10.337 24.603 386 1HG LYS 51 HG2 LYS 51 4.909 -12.734 24.024 387 2HG LYS 51 HG1 LYS 51 4.726 -13.058 25.770 388 1HD LYS 51 HD2 LYS 51 2.969 -11.270 25.785 389 2HD LYS 51 HD1 LYS 51 3.139 -11.150 24.047 390 1HE LYS 51 HE2 LYS 51 1.238 -12.515 24.421 391 2HE LYS 51 HE1 LYS 51 2.531 -13.598 23.926 392 1HZ LYS 51 HZ1 LYS 51 1.275 -14.476 25.809 393 2HZ LYS 51 HZ2 LYS 51 1.599 -13.096 26.670 394 3HZ LYS 51 HZ3 LYS 51 2.860 -14.160 26.329 395 H THR 52 HN THR 52 7.538 -9.833 26.832 396 HA THR 52 HA THR 52 7.860 -7.627 25.094 397 HB THR 52 HB THR 52 8.087 -6.343 27.241 398 HG1 THR 52 HG1 THR 52 8.521 -7.655 28.854 399 1HG2 THR 52 HG21 THR 52 5.678 -6.565 27.743 400 2HG2 THR 52 HG22 THR 52 5.631 -8.058 26.809 401 3HG2 THR 52 HG23 THR 52 5.978 -6.529 26.005 402 H VAL 53 HN VAL 53 9.480 -5.914 25.821 403 HA VAL 53 HA VAL 53 11.766 -6.483 24.490 404 HB VAL 53 HB VAL 53 10.979 -4.226 24.709 405 1HG1 VAL 53 HG11 VAL 53 11.752 -4.369 27.611 406 2HG1 VAL 53 HG12 VAL 53 10.114 -4.263 26.963 407 3HG1 VAL 53 HG13 VAL 53 11.233 -2.914 26.767 408 1HG2 VAL 53 HG21 VAL 53 13.366 -4.456 24.221 409 2HG2 VAL 53 HG22 VAL 53 13.725 -4.467 25.945 410 3HG2 VAL 53 HG23 VAL 53 13.069 -3.016 25.192 411 H LYS 54 HN LYS 54 11.440 -6.591 28.009 412 HA LYS 54 HA LYS 54 14.277 -6.916 28.374 413 1HB LYS 54 HB2 LYS 54 12.049 -7.332 30.371 414 2HB LYS 54 HB1 LYS 54 13.760 -7.236 30.743 415 1HG LYS 54 HG2 LYS 54 12.064 -5.011 29.625 416 2HG LYS 54 HG1 LYS 54 12.618 -5.163 31.290 417 1HD LYS 54 HD2 LYS 54 14.937 -4.949 30.527 418 2HD LYS 54 HD1 LYS 54 14.378 -4.835 28.854 419 1HE LYS 54 HE2 LYS 54 13.116 -2.809 29.424 420 2HE LYS 54 HE1 LYS 54 13.695 -2.923 31.082 421 1HZ LYS 54 HZ1 LYS 54 15.421 -2.545 28.696 422 2HZ LYS 54 HZ2 LYS 54 15.958 -2.535 30.291 423 3HZ LYS 54 HZ3 LYS 54 14.940 -1.332 29.737 424 H GLU 55 HN GLU 55 11.768 -9.062 27.543 425 HA GLU 55 HA GLU 55 13.042 -11.303 28.926 426 1HB GLU 55 HB2 GLU 55 10.538 -11.363 27.247 427 2HB GLU 55 HB1 GLU 55 11.074 -12.558 28.418 428 1HG GLU 55 HG2 GLU 55 10.053 -9.779 28.990 429 2HG GLU 55 HG1 GLU 55 9.237 -11.296 29.336 430 H VAL 56 HN VAL 56 13.229 -9.763 25.969 431 HA VAL 56 HA VAL 56 14.225 -12.177 24.683 432 HB VAL 56 HB VAL 56 11.987 -11.888 23.817 433 1HG1 VAL 56 HG11 VAL 56 12.786 -9.099 23.031 434 2HG1 VAL 56 HG12 VAL 56 11.637 -9.541 24.297 435 3HG1 VAL 56 HG13 VAL 56 11.265 -9.889 22.607 436 1HG2 VAL 56 HG21 VAL 56 12.430 -11.656 21.423 437 2HG2 VAL 56 HG22 VAL 56 13.646 -12.648 22.231 438 3HG2 VAL 56 HG23 VAL 56 14.017 -10.979 21.789 439 H LYS 57 HN LYS 57 16.193 -11.973 23.821 440 HA LYS 57 HA LYS 57 17.214 -9.292 23.264 441 1HB LYS 57 HB2 LYS 57 18.666 -11.846 23.971 442 2HB LYS 57 HB1 LYS 57 19.441 -10.331 23.530 443 1HG LYS 57 HG2 LYS 57 18.480 -9.272 25.516 444 2HG LYS 57 HG1 LYS 57 17.675 -10.781 25.934 445 1HD LYS 57 HD2 LYS 57 19.697 -10.506 27.263 446 2HD LYS 57 HD1 LYS 57 19.870 -11.873 26.167 447 1HE LYS 57 HE2 LYS 57 21.214 -10.525 24.653 448 2HE LYS 57 HE1 LYS 57 20.975 -9.102 25.658 449 1HZ LYS 57 HZ1 LYS 57 22.447 -11.575 26.423 450 2HZ LYS 57 HZ2 LYS 57 22.145 -10.269 27.441 451 3HZ LYS 57 HZ3 LYS 57 23.118 -10.058 26.100 452 H LEU 58 HN LEU 58 18.109 -8.924 21.218 453 HA LEU 58 HA LEU 58 17.624 -11.083 19.291 454 1HB LEU 58 HB2 LEU 58 16.168 -8.986 19.216 455 2HB LEU 58 HB1 LEU 58 17.607 -8.079 18.838 456 HG LEU 58 HG LEU 58 16.175 -8.463 16.862 457 1HD1 LEU 58 HD11 LEU 58 18.535 -8.188 16.499 458 2HD1 LEU 58 HD12 LEU 58 17.836 -9.297 15.319 459 3HD1 LEU 58 HD13 LEU 58 18.791 -9.923 16.669 460 1HD2 LEU 58 HD21 LEU 58 15.921 -10.694 15.922 461 2HD2 LEU 58 HD22 LEU 58 15.209 -10.605 17.534 462 3HD2 LEU 58 HD23 LEU 58 16.772 -11.383 17.297 463 H ILE 59 HN ILE 59 19.454 -11.881 18.384 464 HA ILE 59 HA ILE 59 21.907 -10.207 18.293 465 HB ILE 59 HB ILE 59 21.731 -13.179 18.906 466 1HG1 ILE 59 HG12 ILE 59 22.477 -10.839 20.664 467 2HG1 ILE 59 HG11 ILE 59 21.050 -11.854 20.832 468 1HG2 ILE 59 HG21 ILE 59 24.163 -13.051 19.237 469 2HG2 ILE 59 HG22 ILE 59 24.133 -11.350 18.777 470 3HG2 ILE 59 HG23 ILE 59 23.721 -12.586 17.594 471 1HD1 ILE 59 HD11 ILE 59 23.912 -12.708 21.223 472 2HD1 ILE 59 HD12 ILE 59 22.521 -13.773 21.321 473 3HD1 ILE 59 HD13 ILE 59 22.710 -12.460 22.491 474 H SER 60 HN SER 60 22.897 -10.083 16.498 475 HA SER 60 HA SER 60 22.478 -12.059 14.414 476 1HB SER 60 HB2 SER 60 20.830 -10.168 14.044 477 2HB SER 60 HB1 SER 60 22.202 -9.077 13.940 478 HG SER 60 HG SER 60 21.542 -11.189 12.170 479 H ALA 61 HN ALA 61 24.371 -12.513 13.494 480 HA ALA 61 HA ALA 61 26.546 -12.510 12.921 481 1HB ALA 61 HB1 ALA 61 27.656 -10.399 12.377 482 2HB ALA 61 HB2 ALA 61 26.419 -9.503 13.254 483 3HB ALA 61 HB3 ALA 61 25.997 -10.377 11.782 484 H GLY 62 HN GLY 62 25.583 -12.469 15.725 485 1HA GLY 62 HA2 GLY 62 26.696 -13.077 17.673 486 2HA GLY 62 HA1 GLY 62 28.204 -12.539 16.949 487 H LYS 63 HN LYS 63 25.646 -10.168 16.736 488 HA LYS 63 HA LYS 63 26.815 -8.739 18.954 489 1HB LYS 63 HB2 LYS 63 25.869 -7.940 16.236 490 2HB LYS 63 HB1 LYS 63 25.883 -6.799 17.549 491 1HG LYS 63 HG2 LYS 63 27.861 -6.506 16.125 492 2HG LYS 63 HG1 LYS 63 28.358 -7.092 17.705 493 1HD LYS 63 HD2 LYS 63 28.615 -9.333 16.802 494 2HD LYS 63 HD1 LYS 63 28.013 -8.792 15.238 495 1HE LYS 63 HE2 LYS 63 30.491 -7.722 16.579 496 2HE LYS 63 HE1 LYS 63 30.503 -8.983 15.351 497 1HZ LYS 63 HZ1 LYS 63 30.976 -6.804 14.422 498 2HZ LYS 63 HZ2 LYS 63 29.511 -6.193 14.953 499 3HZ LYS 63 HZ3 LYS 63 29.550 -7.388 13.772 500 H VAL 64 HN VAL 64 25.358 -7.894 20.371 501 HA VAL 64 HA VAL 64 22.575 -8.665 20.100 502 HB VAL 64 HB VAL 64 23.915 -7.016 22.266 503 1HG1 VAL 64 HG11 VAL 64 21.979 -7.633 23.647 504 2HG1 VAL 64 HG12 VAL 64 21.273 -8.470 22.266 505 3HG1 VAL 64 HG13 VAL 64 21.502 -6.722 22.214 506 1HG2 VAL 64 HG21 VAL 64 23.982 -9.046 23.609 507 2HG2 VAL 64 HG22 VAL 64 24.937 -9.234 22.133 508 3HG2 VAL 64 HG23 VAL 64 23.344 -9.979 22.261 509 H LEU 65 HN LEU 65 21.125 -7.351 19.158 510 HA LEU 65 HA LEU 65 22.038 -4.812 18.307 511 1HB LEU 65 HB2 LEU 65 19.492 -6.313 17.786 512 2HB LEU 65 HB1 LEU 65 19.767 -4.678 17.238 513 HG LEU 65 HG LEU 65 21.742 -5.514 15.950 514 1HD1 LEU 65 HD11 LEU 65 22.200 -7.536 17.153 515 2HD1 LEU 65 HD12 LEU 65 21.947 -7.838 15.442 516 3HD1 LEU 65 HD13 LEU 65 20.675 -8.238 16.601 517 1HD2 LEU 65 HD21 LEU 65 20.417 -6.491 14.132 518 2HD2 LEU 65 HD22 LEU 65 19.663 -5.064 14.835 519 3HD2 LEU 65 HD23 LEU 65 19.047 -6.664 15.233 520 H GLU 66 HN GLU 66 21.822 -3.033 19.226 521 HA GLU 66 HA GLU 66 20.358 -2.567 21.628 522 1HB GLU 66 HB2 GLU 66 22.526 -1.543 21.035 523 2HB GLU 66 HB1 GLU 66 21.774 -0.722 19.691 524 1HG GLU 66 HG2 GLU 66 20.389 0.527 21.307 525 2HG GLU 66 HG1 GLU 66 21.270 -0.271 22.612 526 H ASN 67 HN ASN 67 18.331 -1.621 21.757 527 HA ASN 67 HA ASN 67 16.743 -1.699 19.391 528 1HB ASN 67 HB2 ASN 67 14.824 -1.095 20.728 529 2HB ASN 67 HB1 ASN 67 15.813 -2.201 21.657 530 1HD2 ASN 67 HD21 ASN 67 16.853 -1.446 23.503 531 2HD2 ASN 67 HD22 ASN 67 16.457 0.068 24.213 532 H SER 68 HN SER 68 18.585 0.812 20.783 533 HA SER 68 HA SER 68 17.035 2.956 19.706 534 1HB SER 68 HB2 SER 68 19.767 2.983 20.984 535 2HB SER 68 HB1 SER 68 18.775 4.405 20.647 536 HG SER 68 HG SER 68 17.191 3.552 22.021 537 H LYS 69 HN LYS 69 19.152 0.870 18.224 538 HA LYS 69 HA LYS 69 19.901 2.865 16.261 539 1HB LYS 69 HB2 LYS 69 21.463 1.187 15.458 540 2HB LYS 69 HB1 LYS 69 21.865 1.750 17.083 541 1HG LYS 69 HG2 LYS 69 20.918 -0.319 17.973 542 2HG LYS 69 HG1 LYS 69 20.461 -0.810 16.354 543 1HD LYS 69 HD2 LYS 69 22.503 -1.919 17.136 544 2HD LYS 69 HD1 LYS 69 22.776 -0.957 15.682 545 1HE LYS 69 HE2 LYS 69 23.740 0.819 17.075 546 2HE LYS 69 HE1 LYS 69 23.465 -0.162 18.514 547 1HZ LYS 69 HZ1 LYS 69 24.978 -1.824 17.644 548 2HZ LYS 69 HZ2 LYS 69 25.780 -0.325 17.610 549 3HZ LYS 69 HZ3 LYS 69 25.127 -0.969 16.206 550 H THR 70 HN THR 70 19.962 1.896 13.957 551 HA THR 70 HA THR 70 17.435 0.587 13.520 552 HB THR 70 HB THR 70 17.943 1.384 11.203 553 HG1 THR 70 HG1 THR 70 19.581 3.312 11.631 554 1HG2 THR 70 HG21 THR 70 17.379 3.740 11.689 555 2HG2 THR 70 HG22 THR 70 17.760 3.469 13.393 556 3HG2 THR 70 HG23 THR 70 16.405 2.628 12.645 557 H VAL 71 HN VAL 71 17.452 -0.812 11.527 558 HA VAL 71 HA VAL 71 19.262 -2.971 11.769 559 HB VAL 71 HB VAL 71 17.478 -2.245 9.405 560 1HG1 VAL 71 HG11 VAL 71 17.533 -4.636 8.861 561 2HG1 VAL 71 HG12 VAL 71 18.677 -4.907 10.175 562 3HG1 VAL 71 HG13 VAL 71 19.142 -3.912 8.798 563 1HG2 VAL 71 HG21 VAL 71 16.883 -4.000 11.790 564 2HG2 VAL 71 HG22 VAL 71 15.831 -3.785 10.391 565 3HG2 VAL 71 HG23 VAL 71 16.174 -2.420 11.456 566 H LYS 72 HN LYS 72 19.251 -0.035 10.054 567 HA LYS 72 HA LYS 72 20.975 -0.269 7.928 568 1HB LYS 72 HB2 LYS 72 19.588 1.679 8.676 569 2HB LYS 72 HB1 LYS 72 20.849 2.034 9.843 570 1HG LYS 72 HG2 LYS 72 21.035 3.418 7.892 571 2HG LYS 72 HG1 LYS 72 22.440 2.344 8.001 572 1HD LYS 72 HD2 LYS 72 21.527 0.900 6.333 573 2HD LYS 72 HD1 LYS 72 19.990 1.765 6.352 574 1HE LYS 72 HE2 LYS 72 21.118 3.740 5.466 575 2HE LYS 72 HE1 LYS 72 22.646 2.848 5.446 576 1HZ LYS 72 HZ1 LYS 72 21.774 1.349 3.854 577 2HZ LYS 72 HZ2 LYS 72 21.398 2.901 3.278 578 3HZ LYS 72 HZ3 LYS 72 20.221 1.951 4.050 579 H ASP 73 HN ASP 73 21.653 0.005 11.334 580 HA ASP 73 HA ASP 73 24.403 0.599 11.220 581 1HB ASP 73 HB2 ASP 73 23.045 0.925 13.201 582 2HB ASP 73 HB1 ASP 73 22.778 -0.789 13.376 583 H TYR 74 HN TYR 74 22.637 -2.415 10.955 584 HA TYR 74 HA TYR 74 25.144 -3.884 10.820 585 1HB TYR 74 HB2 TYR 74 22.329 -4.789 11.354 586 2HB TYR 74 HB1 TYR 74 23.693 -5.875 11.118 587 HD1 TYR 74 HD1 TYR 74 25.522 -5.931 12.773 588 HD2 TYR 74 HD2 TYR 74 22.031 -3.592 13.396 589 HE1 TYR 74 HE1 TYR 74 26.094 -5.715 15.150 590 HE2 TYR 74 HE2 TYR 74 22.595 -3.375 15.768 591 HH TYR 74 HH TYR 74 23.892 -4.529 17.439 592 H ARG 75 HN ARG 75 23.190 -2.310 8.742 593 HA ARG 75 HA ARG 75 22.764 -4.279 6.780 594 1HB ARG 75 HB2 ARG 75 21.341 -2.354 7.127 595 2HB ARG 75 HB1 ARG 75 22.698 -1.281 6.867 596 1HG ARG 75 HG2 ARG 75 21.280 -1.285 5.061 597 2HG ARG 75 HG1 ARG 75 22.827 -2.009 4.584 598 1HD ARG 75 HD2 ARG 75 21.846 -4.237 4.666 599 2HD ARG 75 HD1 ARG 75 20.322 -3.589 5.283 600 HE ARG 75 HE ARG 75 20.891 -2.339 2.881 601 1HH1 ARG 75 HH11 ARG 75 20.151 -5.636 3.925 602 2HH1 ARG 75 HH12 ARG 75 19.250 -6.059 2.543 603 1HH2 ARG 75 HH21 ARG 75 19.668 -2.903 0.948 604 2HH2 ARG 75 HH22 ARG 75 18.961 -4.432 0.776 605 H SER 76 HN SER 76 24.083 -4.655 5.036 606 HA SER 76 HA SER 76 26.665 -3.288 5.008 607 1HB SER 76 HB2 SER 76 26.733 -5.712 5.594 608 2HB SER 76 HB1 SER 76 25.927 -6.079 4.075 609 HG SER 76 HG SER 76 28.278 -4.583 3.897 610 HA PRO 77 HA PRO 77 25.324 -1.823 0.962 611 1HB PRO 77 HB2 PRO 77 28.138 -1.813 0.248 612 2HB PRO 77 HB1 PRO 77 27.014 -0.457 0.260 613 1HG PRO 77 HG2 PRO 77 28.956 -0.653 2.125 614 2HG PRO 77 HG1 PRO 77 27.358 -0.001 2.513 615 1HD PRO 77 HD2 PRO 77 28.502 -2.688 3.101 616 2HD PRO 77 HD1 PRO 77 27.427 -1.670 4.090 617 H VAL 78 HN VAL 78 24.552 -3.299 -0.261 618 HA VAL 78 HA VAL 78 26.079 -5.652 -1.037 619 HB VAL 78 HB VAL 78 23.201 -4.978 -1.509 620 1HG1 VAL 78 HG11 VAL 78 23.986 -6.642 -3.119 621 2HG1 VAL 78 HG12 VAL 78 22.879 -7.395 -1.972 622 3HG1 VAL 78 HG13 VAL 78 24.619 -7.630 -1.802 623 1HG2 VAL 78 HG21 VAL 78 22.691 -6.563 0.326 624 2HG2 VAL 78 HG22 VAL 78 23.628 -5.166 0.857 625 3HG2 VAL 78 HG23 VAL 78 24.421 -6.720 0.619 626 H SER 79 HN SER 79 25.005 -2.732 -2.179 627 HA SER 79 HA SER 79 25.220 -1.538 -4.112 628 1HB SER 79 HB2 SER 79 27.093 -3.772 -4.969 629 2HB SER 79 HB1 SER 79 26.978 -2.182 -5.731 630 HG SER 79 HG SER 79 27.976 -2.899 -3.206 631 H ASN 80 HN ASN 80 23.358 -3.649 -3.724 632 HA ASN 80 HA ASN 80 21.991 -3.709 -6.236 633 1HB ASN 80 HB2 ASN 80 23.783 -5.573 -6.418 634 2HB ASN 80 HB1 ASN 80 22.956 -6.370 -5.095 635 1HD2 ASN 80 HD21 ASN 80 23.461 -7.358 -7.715 636 2HD2 ASN 80 HD22 ASN 80 21.936 -7.699 -8.460 637 H LEU 81 HN LEU 81 19.778 -5.068 -5.713 638 HA LEU 81 HA LEU 81 18.847 -4.326 -3.252 639 1HB LEU 81 HB2 LEU 81 17.907 -6.325 -5.192 640 2HB LEU 81 HB1 LEU 81 17.026 -5.573 -3.933 641 HG LEU 81 HG LEU 81 18.070 -3.997 -6.289 642 1HD1 LEU 81 HD11 LEU 81 15.744 -3.898 -7.038 643 2HD1 LEU 81 HD12 LEU 81 15.267 -4.964 -5.717 644 3HD1 LEU 81 HD13 LEU 81 16.324 -5.562 -6.997 645 1HD2 LEU 81 HD21 LEU 81 16.620 -2.242 -5.431 646 2HD2 LEU 81 HD22 LEU 81 17.800 -2.722 -4.208 647 3HD2 LEU 81 HD23 LEU 81 16.134 -3.280 -4.094 648 H ALA 82 HN ALA 82 18.128 -5.781 -1.737 649 HA ALA 82 HA ALA 82 19.168 -8.411 -1.778 650 1HB ALA 82 HB1 ALA 82 20.320 -8.274 0.382 651 2HB ALA 82 HB2 ALA 82 19.964 -6.548 0.454 652 3HB ALA 82 HB3 ALA 82 21.029 -7.177 -0.804 653 H GLY 83 HN GLY 83 16.972 -8.826 -1.932 654 1HA GLY 83 HA2 GLY 83 15.433 -8.354 0.501 655 2HA GLY 83 HA1 GLY 83 14.783 -8.779 -1.086 656 H ALA 84 HN ALA 84 17.277 -10.043 0.965 657 HA ALA 84 HA ALA 84 16.235 -12.724 0.484 658 1HB ALA 84 HB1 ALA 84 18.591 -12.401 -0.111 659 2HB ALA 84 HB2 ALA 84 18.446 -13.494 1.268 660 3HB ALA 84 HB3 ALA 84 18.926 -11.815 1.519 661 H VAL 85 HN VAL 85 16.058 -14.107 2.325 662 HA VAL 85 HA VAL 85 15.110 -12.595 4.581 663 HB VAL 85 HB VAL 85 15.220 -15.572 4.196 664 1HG1 VAL 85 HG11 VAL 85 13.514 -15.656 5.987 665 2HG1 VAL 85 HG12 VAL 85 13.688 -13.908 6.192 666 3HG1 VAL 85 HG13 VAL 85 15.047 -14.972 6.531 667 1HG2 VAL 85 HG21 VAL 85 13.808 -14.546 2.483 668 2HG2 VAL 85 HG22 VAL 85 12.911 -13.679 3.729 669 3HG2 VAL 85 HG23 VAL 85 12.816 -15.430 3.640 670 H THR 86 HN THR 86 16.275 -12.128 6.113 671 HA THR 86 HA THR 86 18.862 -13.396 6.592 672 HB THR 86 HB THR 86 17.739 -10.864 7.857 673 HG1 THR 86 HG1 THR 86 17.875 -10.796 5.510 674 1HG2 THR 86 HG21 THR 86 19.704 -11.881 8.981 675 2HG2 THR 86 HG22 THR 86 20.120 -10.342 8.223 676 3HG2 THR 86 HG23 THR 86 20.576 -11.856 7.448 677 H THR 87 HN THR 87 19.230 -14.505 8.534 678 HA THR 87 HA THR 87 16.819 -14.909 10.127 679 HB THR 87 HB THR 87 19.315 -16.619 10.027 680 HG1 THR 87 HG1 THR 87 17.390 -16.323 8.230 681 1HG2 THR 87 HG21 THR 87 17.855 -18.300 11.093 682 2HG2 THR 87 HG22 THR 87 16.543 -17.126 11.140 683 3HG2 THR 87 HG23 THR 87 18.002 -16.855 12.091 684 H MET 88 HN MET 88 16.744 -13.844 11.967 685 HA MET 88 HA MET 88 19.215 -13.123 13.310 686 1HB MET 88 HB2 MET 88 16.421 -12.059 13.416 687 2HB MET 88 HB1 MET 88 17.469 -11.851 14.808 688 1HG MET 88 HG2 MET 88 17.431 -9.903 13.292 689 2HG MET 88 HG1 MET 88 19.033 -10.578 13.525 690 1HE MET 88 HE1 MET 88 19.183 -9.144 9.902 691 2HE MET 88 HE2 MET 88 19.941 -9.176 11.492 692 3HE MET 88 HE3 MET 88 18.340 -8.463 11.294 693 H HIS 89 HN HIS 89 19.645 -13.707 15.403 694 HA HIS 89 HA HIS 89 18.222 -16.119 16.173 695 1HB HIS 89 HB2 HIS 89 20.906 -15.041 17.082 696 2HB HIS 89 HB1 HIS 89 20.163 -16.518 17.689 697 HD1 HIS 89 HD1 HIS 89 20.330 -18.611 16.217 698 HD2 HIS 89 HD2 HIS 89 21.875 -15.198 14.409 699 HE1 HIS 89 HE1 HIS 89 21.547 -19.418 14.190 700 HE2 HIS 89 HE2 HIS 89 22.611 -17.359 13.199 701 H VAL 90 HN VAL 90 16.903 -16.120 17.759 702 HA VAL 90 HA VAL 90 16.735 -13.729 19.455 703 HB VAL 90 HB VAL 90 14.694 -15.877 18.875 704 1HG1 VAL 90 HG11 VAL 90 13.115 -14.390 20.011 705 2HG1 VAL 90 HG12 VAL 90 14.439 -13.279 20.372 706 3HG1 VAL 90 HG13 VAL 90 14.419 -14.891 21.089 707 1HG2 VAL 90 HG21 VAL 90 14.882 -13.050 17.874 708 2HG2 VAL 90 HG22 VAL 90 13.489 -14.106 17.695 709 3HG2 VAL 90 HG23 VAL 90 15.019 -14.530 16.910 710 H ILE 91 HN ILE 91 17.377 -13.770 21.274 711 HA ILE 91 HA ILE 91 17.891 -16.283 22.637 712 HB ILE 91 HB ILE 91 18.818 -13.494 22.941 713 1HG1 ILE 91 HG12 ILE 91 19.956 -14.590 21.172 714 2HG1 ILE 91 HG11 ILE 91 21.077 -14.456 22.521 715 1HG2 ILE 91 HG21 ILE 91 20.314 -14.295 24.811 716 2HG2 ILE 91 HG22 ILE 91 19.531 -15.871 24.715 717 3HG2 ILE 91 HG23 ILE 91 18.603 -14.455 25.217 718 1HD1 ILE 91 HD11 ILE 91 19.578 -16.948 21.712 719 2HD1 ILE 91 HD12 ILE 91 20.673 -16.801 23.083 720 3HD1 ILE 91 HD13 ILE 91 21.288 -16.608 21.441 721 H ILE 92 HN ILE 92 16.554 -16.910 23.972 722 HA ILE 92 HA ILE 92 14.464 -15.146 24.984 723 HB ILE 92 HB ILE 92 14.684 -18.143 24.790 724 1HG1 ILE 92 HG12 ILE 92 14.329 -17.092 22.625 725 2HG1 ILE 92 HG11 ILE 92 12.889 -17.969 23.120 726 1HG2 ILE 92 HG21 ILE 92 12.341 -18.233 25.497 727 2HG2 ILE 92 HG22 ILE 92 12.406 -16.496 25.830 728 3HG2 ILE 92 HG23 ILE 92 13.422 -17.607 26.746 729 1HD1 ILE 92 HD11 ILE 92 13.272 -14.980 23.301 730 2HD1 ILE 92 HD12 ILE 92 11.813 -15.884 23.734 731 3HD1 ILE 92 HD13 ILE 92 12.360 -15.842 22.066 732 H GLN 93 HN GLN 93 14.752 -14.416 27.009 733 HA GLN 93 HA GLN 93 15.943 -16.286 28.927 734 1HB GLN 93 HB2 GLN 93 15.845 -13.253 29.036 735 2HB GLN 93 HB1 GLN 93 16.513 -14.290 30.283 736 1HG GLN 93 HG2 GLN 93 18.253 -15.038 28.733 737 2HG GLN 93 HG1 GLN 93 17.574 -14.006 27.476 738 1HE2 GLN 93 HE21 GLN 93 20.215 -13.954 28.668 739 2HE2 GLN 93 HE22 GLN 93 20.426 -12.381 29.335 740 H ALA 94 HN ALA 94 14.312 -17.191 29.945 741 HA ALA 94 HA ALA 94 11.838 -15.672 30.286 742 1HB ALA 94 HB1 ALA 94 11.655 -17.807 29.107 743 2HB ALA 94 HB2 ALA 94 10.758 -17.836 30.624 744 3HB ALA 94 HB3 ALA 94 12.321 -18.643 30.507 745 HA PRO 95 HA PRO 95 12.489 -15.440 34.703 746 1HB PRO 95 HB2 PRO 95 9.861 -15.412 35.486 747 2HB PRO 95 HB1 PRO 95 10.697 -13.985 34.855 748 1HG PRO 95 HG2 PRO 95 8.859 -15.884 33.444 749 2HG PRO 95 HG1 PRO 95 8.928 -14.118 33.344 750 1HD PRO 95 HD2 PRO 95 9.997 -15.684 31.451 751 2HD PRO 95 HD1 PRO 95 10.750 -14.143 31.916 752 H VAL 96 HN VAL 96 11.981 -16.785 36.629 753 HA VAL 96 HA VAL 96 11.915 -19.544 35.912 754 HB VAL 96 HB VAL 96 11.759 -18.361 38.673 755 1HG1 VAL 96 HG11 VAL 96 11.110 -20.705 38.615 756 2HG1 VAL 96 HG12 VAL 96 12.670 -20.530 39.419 757 3HG1 VAL 96 HG13 VAL 96 12.596 -21.115 37.756 758 1HG2 VAL 96 HG21 VAL 96 14.199 -19.196 37.107 759 2HG2 VAL 96 HG22 VAL 96 14.194 -18.697 38.799 760 3HG2 VAL 96 HG23 VAL 96 13.746 -17.547 37.537 761 H THR 97 HN THR 97 10.007 -20.082 35.044 762 HA THR 97 HA THR 97 7.885 -20.725 36.764 763 HB THR 97 HB THR 97 7.465 -18.325 36.501 764 HG1 THR 97 HG1 THR 97 5.378 -19.020 34.974 765 1HG2 THR 97 HG21 THR 97 7.211 -18.904 33.540 766 2HG2 THR 97 HG22 THR 97 8.452 -17.922 34.311 767 3HG2 THR 97 HG23 THR 97 6.772 -17.376 34.309 768 H GLU 98 HN GLU 98 6.468 -22.160 35.697 769 HA GLU 98 HA GLU 98 6.959 -22.631 32.872 770 1HB GLU 98 HB2 GLU 98 8.305 -24.283 34.133 771 2HB GLU 98 HB1 GLU 98 6.845 -24.816 34.963 772 1HG GLU 98 HG2 GLU 98 5.887 -25.480 32.805 773 2HG GLU 98 HG1 GLU 98 7.380 -24.993 32.008 774 H LYS 99 HN LYS 99 5.106 -22.443 31.905 775 HA LYS 99 HA LYS 99 3.023 -22.517 31.378 776 1HB LYS 99 HB2 LYS 99 2.969 -24.891 31.852 777 2HB LYS 99 HB1 LYS 99 2.764 -24.594 33.566 778 1HG LYS 99 HG2 LYS 99 0.677 -25.313 32.587 779 2HG LYS 99 HG1 LYS 99 0.557 -23.645 33.135 780 1HD LYS 99 HD2 LYS 99 0.887 -22.863 30.837 781 2HD LYS 99 HD1 LYS 99 0.999 -24.538 30.285 782 1HE LYS 99 HE2 LYS 99 -1.389 -23.267 31.620 783 2HE LYS 99 HE1 LYS 99 -1.252 -23.626 29.906 784 1HZ LYS 99 HZ1 LYS 99 -1.058 -25.980 30.466 785 2HZ LYS 99 HZ2 LYS 99 -2.511 -25.321 31.049 786 3HZ LYS 99 HZ3 LYS 99 -1.252 -25.620 32.110 787 H GLU 100 HN GLU 100 3.144 -20.386 32.003 788 HA GLU 100 HA GLU 100 1.249 -19.840 34.138 789 1HB GLU 100 HB2 GLU 100 3.631 -18.908 34.420 790 2HB GLU 100 HB1 GLU 100 3.297 -17.870 33.053 791 1HG GLU 100 HG2 GLU 100 1.734 -17.841 35.633 792 2HG GLU 100 HG1 GLU 100 3.101 -16.796 35.303 793 H LYS 101 HN LYS 101 -0.295 -20.390 32.666 794 HA LYS 101 HA LYS 101 -1.160 -18.328 30.871 795 1HB LYS 101 HB2 LYS 101 0.259 -19.808 29.452 796 2HB LYS 101 HB1 LYS 101 -0.623 -21.210 30.002 797 1HG LYS 101 HG2 LYS 101 -1.889 -18.992 28.373 798 2HG LYS 101 HG1 LYS 101 -1.099 -20.380 27.644 799 1HD LYS 101 HD2 LYS 101 -2.701 -21.864 28.806 800 2HD LYS 101 HD1 LYS 101 -3.490 -20.451 29.495 801 1HE LYS 101 HE2 LYS 101 -4.055 -19.671 27.233 802 2HE LYS 101 HE1 LYS 101 -3.245 -21.080 26.549 803 1HZ LYS 101 HZ1 LYS 101 -5.660 -21.394 26.676 804 2HZ LYS 101 HZ2 LYS 101 -5.617 -21.184 28.346 805 3HZ LYS 101 HZ3 LYS 101 -4.853 -22.497 27.658 Start of MODEL 17 1 H GLU 1 HT1 GLU 1 0.910 -13.441 -5.290 2 HA GLU 1 HA GLU 1 1.817 -12.186 -3.529 3 1HB GLU 1 HB2 GLU 1 3.262 -14.745 -2.857 4 2HB GLU 1 HB1 GLU 1 3.627 -13.174 -2.169 5 1HG GLU 1 HG2 GLU 1 1.406 -13.113 -1.159 6 2HG GLU 1 HG1 GLU 1 1.058 -14.701 -1.847 7 H ALA 2 HN ALA 2 2.763 -10.959 -5.057 8 HA ALA 2 HA ALA 2 5.254 -11.972 -6.203 9 1HB ALA 2 HB1 ALA 2 3.188 -10.237 -7.570 10 2HB ALA 2 HB2 ALA 2 3.529 -11.930 -7.943 11 3HB ALA 2 HB3 ALA 2 4.752 -10.695 -8.243 12 H GLU 3 HN GLU 3 6.889 -10.801 -5.430 13 HA GLU 3 HA GLU 3 6.646 -8.002 -5.319 14 1HB GLU 3 HB2 GLU 3 5.819 -8.611 -3.111 15 2HB GLU 3 HB1 GLU 3 7.250 -9.587 -2.826 16 1HG GLU 3 HG2 GLU 3 8.640 -7.568 -2.951 17 2HG GLU 3 HG1 GLU 3 7.188 -6.604 -3.191 18 H VAL 4 HN VAL 4 8.340 -7.543 -6.478 19 HA VAL 4 HA VAL 4 10.819 -9.001 -6.059 20 HB VAL 4 HB VAL 4 10.164 -7.016 -8.242 21 1HG1 VAL 4 HG11 VAL 4 12.563 -7.177 -7.844 22 2HG1 VAL 4 HG12 VAL 4 12.146 -7.910 -9.392 23 3HG1 VAL 4 HG13 VAL 4 12.486 -8.933 -7.997 24 1HG2 VAL 4 HG21 VAL 4 8.757 -8.992 -8.389 25 2HG2 VAL 4 HG22 VAL 4 10.183 -10.031 -8.356 26 3HG2 VAL 4 HG23 VAL 4 9.907 -8.950 -9.718 27 H HIS 5 HN HIS 5 9.434 -6.079 -5.836 28 HA HIS 5 HA HIS 5 11.877 -4.902 -4.772 29 1HB HIS 5 HB2 HIS 5 10.688 -2.680 -4.437 30 2HB HIS 5 HB1 HIS 5 10.776 -3.217 -6.096 31 HD1 HIS 5 HD1 HIS 5 8.701 -2.785 -7.323 32 HD2 HIS 5 HD2 HIS 5 7.945 -3.359 -3.290 33 HE1 HIS 5 HE1 HIS 5 6.247 -2.410 -7.046 34 HE2 HIS 5 HE2 HIS 5 5.788 -2.993 -4.649 35 H ASN 6 HN ASN 6 12.291 -6.036 -3.174 36 HA ASN 6 HA ASN 6 10.427 -6.091 -0.934 37 1HB ASN 6 HB2 ASN 6 10.744 -8.259 -1.880 38 2HB ASN 6 HB1 ASN 6 12.482 -8.071 -1.913 39 1HD2 ASN 6 HD21 ASN 6 9.695 -8.640 0.055 40 2HD2 ASN 6 HD22 ASN 6 10.540 -9.322 1.408 41 H GLN 7 HN GLN 7 11.114 -5.617 1.062 42 HA GLN 7 HA GLN 7 13.510 -4.047 1.371 43 1HB GLN 7 HB2 GLN 7 11.259 -4.820 3.255 44 2HB GLN 7 HB1 GLN 7 12.626 -3.861 3.773 45 1HG GLN 7 HG2 GLN 7 10.721 -2.436 3.361 46 2HG GLN 7 HG1 GLN 7 11.978 -2.093 2.186 47 1HE2 GLN 7 HE21 GLN 7 8.815 -3.406 2.711 48 2HE2 GLN 7 HE22 GLN 7 8.337 -3.466 1.064 49 H LEU 8 HN LEU 8 13.860 -5.021 4.286 50 HA LEU 8 HA LEU 8 15.241 -7.476 3.544 51 1HB LEU 8 HB2 LEU 8 15.303 -5.921 6.086 52 2HB LEU 8 HB1 LEU 8 16.183 -7.375 5.794 53 HG LEU 8 HG LEU 8 17.486 -6.191 3.999 54 1HD1 LEU 8 HD11 LEU 8 15.948 -4.369 3.524 55 2HD1 LEU 8 HD12 LEU 8 17.532 -3.755 4.005 56 3HD1 LEU 8 HD13 LEU 8 16.191 -3.725 5.148 57 1HD2 LEU 8 HD21 LEU 8 18.371 -6.573 6.220 58 2HD2 LEU 8 HD22 LEU 8 17.667 -5.048 6.776 59 3HD2 LEU 8 HD23 LEU 8 18.931 -5.052 5.539 60 H GLU 9 HN GLU 9 14.336 -9.318 3.994 61 HA GLU 9 HA GLU 9 12.132 -9.346 5.883 62 1HB GLU 9 HB2 GLU 9 13.236 -11.601 4.255 63 2HB GLU 9 HB1 GLU 9 11.847 -11.667 5.284 64 1HG GLU 9 HG2 GLU 9 10.673 -10.028 3.874 65 2HG GLU 9 HG1 GLU 9 12.048 -10.024 2.767 66 H ILE 10 HN ILE 10 12.486 -9.773 7.786 67 HA ILE 10 HA ILE 10 14.961 -11.177 8.528 68 HB ILE 10 HB ILE 10 13.317 -9.340 10.311 69 1HG1 ILE 10 HG12 ILE 10 16.045 -8.916 9.038 70 2HG1 ILE 10 HG11 ILE 10 14.567 -8.116 8.531 71 1HG2 ILE 10 HG21 ILE 10 15.156 -9.547 11.893 72 2HG2 ILE 10 HG22 ILE 10 15.945 -10.722 10.833 73 3HG2 ILE 10 HG23 ILE 10 14.391 -11.107 11.582 74 1HD1 ILE 10 HD11 ILE 10 15.946 -6.640 9.870 75 2HD1 ILE 10 HD12 ILE 10 15.950 -7.809 11.192 76 3HD1 ILE 10 HD13 ILE 10 14.449 -7.010 10.727 77 H LYS 11 HN LYS 11 14.825 -12.979 9.412 78 HA LYS 11 HA LYS 11 12.247 -13.851 10.455 79 1HB LYS 11 HB2 LYS 11 12.834 -16.173 9.839 80 2HB LYS 11 HB1 LYS 11 12.665 -15.130 8.443 81 1HG LYS 11 HG2 LYS 11 15.154 -14.956 8.361 82 2HG LYS 11 HG1 LYS 11 15.226 -16.135 9.672 83 1HD LYS 11 HD2 LYS 11 13.957 -16.589 6.969 84 2HD LYS 11 HD1 LYS 11 15.535 -17.189 7.469 85 1HE LYS 11 HE2 LYS 11 14.492 -18.553 9.202 86 2HE LYS 11 HE1 LYS 11 12.908 -17.902 8.792 87 1HZ LYS 11 HZ1 LYS 11 13.100 -18.907 6.615 88 2HZ LYS 11 HZ2 LYS 11 13.224 -20.064 7.817 89 3HZ LYS 11 HZ3 LYS 11 14.615 -19.548 6.996 90 H PHE 12 HN PHE 12 12.228 -14.852 12.359 91 HA PHE 12 HA PHE 12 14.594 -14.322 13.953 92 1HB PHE 12 HB2 PHE 12 11.752 -14.918 14.771 93 2HB PHE 12 HB1 PHE 12 13.058 -14.531 15.873 94 HD1 PHE 12 HD1 PHE 12 14.048 -12.286 15.877 95 HD2 PHE 12 HD2 PHE 12 10.618 -13.175 13.527 96 HE1 PHE 12 HE1 PHE 12 13.586 -9.885 15.652 97 HE2 PHE 12 HE2 PHE 12 10.153 -10.765 13.294 98 HZ PHE 12 HZ PHE 12 11.672 -9.105 14.382 99 H ARG 13 HN ARG 13 15.921 -15.894 14.464 100 HA ARG 13 HA ARG 13 15.039 -18.675 14.289 101 1HB ARG 13 HB2 ARG 13 16.994 -18.162 12.983 102 2HB ARG 13 HB1 ARG 13 17.778 -17.401 14.356 103 1HG ARG 13 HG2 ARG 13 17.894 -19.582 15.484 104 2HG ARG 13 HG1 ARG 13 17.137 -20.334 14.082 105 1HD ARG 13 HD2 ARG 13 18.999 -19.743 12.682 106 2HD ARG 13 HD1 ARG 13 19.726 -18.791 13.976 107 HE ARG 13 HE ARG 13 19.377 -21.376 14.918 108 1HH1 ARG 13 HH11 ARG 13 21.318 -19.799 12.380 109 2HH1 ARG 13 HH12 ARG 13 22.621 -20.879 12.556 110 1HH2 ARG 13 HH21 ARG 13 21.154 -22.808 15.116 111 2HH2 ARG 13 HH22 ARG 13 22.546 -22.648 14.144 112 H LEU 14 HN LEU 14 14.422 -19.585 16.087 113 HA LEU 14 HA LEU 14 15.176 -18.555 18.688 114 1HB LEU 14 HB2 LEU 14 13.386 -20.844 17.867 115 2HB LEU 14 HB1 LEU 14 13.724 -20.450 19.533 116 HG LEU 14 HG LEU 14 12.593 -18.247 19.199 117 1HD1 LEU 14 HD11 LEU 14 12.891 -17.974 16.799 118 2HD1 LEU 14 HD12 LEU 14 11.191 -17.879 17.251 119 3HD1 LEU 14 HD13 LEU 14 11.822 -19.346 16.503 120 1HD2 LEU 14 HD21 LEU 14 10.941 -20.674 18.529 121 2HD2 LEU 14 HD22 LEU 14 10.322 -19.139 19.146 122 3HD2 LEU 14 HD23 LEU 14 11.390 -20.125 20.141 123 H THR 15 HN THR 15 15.740 -20.257 20.412 124 HA THR 15 HA THR 15 18.229 -21.343 19.777 125 HB THR 15 HB THR 15 17.971 -22.303 22.128 126 HG1 THR 15 HG1 THR 15 16.163 -21.891 23.190 127 1HG2 THR 15 HG21 THR 15 17.583 -19.324 21.704 128 2HG2 THR 15 HG22 THR 15 19.123 -20.178 21.673 129 3HG2 THR 15 HG23 THR 15 18.199 -20.081 23.171 130 H ASP 16 HN ASP 16 15.057 -22.636 19.694 131 HA ASP 16 HA ASP 16 15.846 -25.431 19.845 132 1HB ASP 16 HB2 ASP 16 13.192 -24.239 19.025 133 2HB ASP 16 HB1 ASP 16 13.498 -25.927 19.389 134 H GLY 17 HN GLY 17 16.148 -23.141 17.510 135 1HA GLY 17 HA2 GLY 17 16.705 -23.419 15.274 136 2HA GLY 17 HA1 GLY 17 16.225 -25.113 15.389 137 H SER 18 HN SER 18 13.972 -23.149 16.750 138 HA SER 18 HA SER 18 12.071 -23.540 14.622 139 1HB SER 18 HB2 SER 18 11.446 -23.852 17.019 140 2HB SER 18 HB1 SER 18 11.813 -22.164 17.320 141 HG SER 18 HG SER 18 9.621 -23.321 16.090 142 H ASP 19 HN ASP 19 10.896 -21.650 13.701 143 HA ASP 19 HA ASP 19 12.435 -19.204 13.859 144 1HB ASP 19 HB2 ASP 19 12.202 -18.920 11.521 145 2HB ASP 19 HB1 ASP 19 13.088 -20.419 11.819 146 H ILE 20 HN ILE 20 11.254 -17.416 13.294 147 HA ILE 20 HA ILE 20 8.326 -17.700 13.365 148 HB ILE 20 HB ILE 20 10.046 -15.219 13.809 149 1HG1 ILE 20 HG12 ILE 20 8.503 -16.870 15.830 150 2HG1 ILE 20 HG11 ILE 20 10.254 -16.815 15.670 151 1HG2 ILE 20 HG21 ILE 20 7.974 -14.113 14.533 152 2HG2 ILE 20 HG22 ILE 20 7.067 -15.572 14.151 153 3HG2 ILE 20 HG23 ILE 20 7.860 -14.669 12.859 154 1HD1 ILE 20 HD11 ILE 20 8.464 -14.523 16.466 155 2HD1 ILE 20 HD12 ILE 20 10.221 -14.452 16.326 156 3HD1 ILE 20 HD13 ILE 20 9.475 -15.482 17.547 157 H GLY 21 HN GLY 21 7.165 -16.899 11.615 158 1HA GLY 21 HA2 GLY 21 8.301 -17.089 9.114 159 2HA GLY 21 HA1 GLY 21 6.784 -16.258 9.446 160 HA PRO 22 HA PRO 22 10.727 -13.450 8.670 161 1HB PRO 22 HB2 PRO 22 10.634 -13.355 5.898 162 2HB PRO 22 HB1 PRO 22 11.821 -14.250 6.843 163 1HG PRO 22 HG2 PRO 22 9.342 -15.207 5.501 164 2HG PRO 22 HG1 PRO 22 10.896 -16.032 5.715 165 1HD PRO 22 HD2 PRO 22 8.728 -16.640 7.179 166 2HD PRO 22 HD1 PRO 22 10.371 -16.724 7.853 167 H LYS 23 HN LYS 23 10.340 -11.361 8.460 168 HA LYS 23 HA LYS 23 7.816 -10.521 7.203 169 1HB LYS 23 HB2 LYS 23 7.697 -10.599 9.719 170 2HB LYS 23 HB1 LYS 23 8.990 -9.415 9.763 171 1HG LYS 23 HG2 LYS 23 7.564 -7.811 8.586 172 2HG LYS 23 HG1 LYS 23 6.261 -8.994 8.554 173 1HD LYS 23 HD2 LYS 23 7.523 -7.778 11.004 174 2HD LYS 23 HD1 LYS 23 5.931 -7.401 10.351 175 1HE LYS 23 HE2 LYS 23 6.816 -10.065 11.493 176 2HE LYS 23 HE1 LYS 23 5.767 -8.894 12.270 177 1HZ LYS 23 HZ1 LYS 23 5.129 -10.410 9.790 178 2HZ LYS 23 HZ2 LYS 23 4.114 -9.278 10.510 179 3HZ LYS 23 HZ3 LYS 23 4.529 -10.698 11.333 180 H ALA 24 HN ALA 24 7.945 -8.318 6.392 181 HA ALA 24 HA ALA 24 10.648 -7.758 5.530 182 1HB ALA 24 HB1 ALA 24 9.614 -6.189 3.981 183 2HB ALA 24 HB2 ALA 24 8.044 -6.474 4.734 184 3HB ALA 24 HB3 ALA 24 8.860 -7.778 3.874 185 H PHE 25 HN PHE 25 11.885 -6.353 6.482 186 HA PHE 25 HA PHE 25 10.722 -4.111 7.981 187 1HB PHE 25 HB2 PHE 25 13.335 -5.546 8.503 188 2HB PHE 25 HB1 PHE 25 12.669 -4.223 9.436 189 HD1 PHE 25 HD1 PHE 25 11.083 -4.649 11.173 190 HD2 PHE 25 HD2 PHE 25 12.316 -7.752 8.571 191 HE1 PHE 25 HE1 PHE 25 10.074 -6.331 12.679 192 HE2 PHE 25 HE2 PHE 25 11.316 -9.417 10.050 193 HZ PHE 25 HZ PHE 25 10.236 -8.763 12.061 194 HA PRO 26 HA PRO 26 13.114 -1.868 4.818 195 1HB PRO 26 HB2 PRO 26 12.300 0.202 6.779 196 2HB PRO 26 HB1 PRO 26 12.254 0.317 5.033 197 1HG PRO 26 HG2 PRO 26 10.013 -0.089 6.344 198 2HG PRO 26 HG1 PRO 26 10.330 -1.089 4.910 199 1HD PRO 26 HD2 PRO 26 10.596 -1.793 7.809 200 2HD PRO 26 HD1 PRO 26 9.967 -2.770 6.462 201 H ASP 27 HN ASP 27 15.189 -0.933 4.910 202 HA ASP 27 HA ASP 27 17.044 -1.403 6.921 203 1HB ASP 27 HB2 ASP 27 17.032 0.939 4.988 204 2HB ASP 27 HB1 ASP 27 18.428 0.375 5.885 205 H ALA 28 HN ALA 28 14.824 1.254 6.522 206 HA ALA 28 HA ALA 28 16.040 2.936 8.515 207 1HB ALA 28 HB1 ALA 28 13.451 3.287 7.029 208 2HB ALA 28 HB2 ALA 28 15.026 3.885 6.508 209 3HB ALA 28 HB3 ALA 28 14.286 4.514 7.978 210 H THR 29 HN THR 29 14.198 0.235 8.909 211 HA THR 29 HA THR 29 12.384 1.239 10.885 212 HB THR 29 HB THR 29 13.223 -1.598 10.208 213 HG1 THR 29 HG1 THR 29 11.642 0.134 9.024 214 1HG2 THR 29 HG21 THR 29 10.949 -0.653 11.975 215 2HG2 THR 29 HG22 THR 29 12.410 -1.467 12.538 216 3HG2 THR 29 HG23 THR 29 11.263 -2.325 11.508 217 H THR 30 HN THR 30 12.642 1.337 13.071 218 HA THR 30 HA THR 30 15.297 1.215 14.024 219 HB THR 30 HB THR 30 14.169 2.009 16.131 220 HG1 THR 30 HG1 THR 30 12.062 2.084 16.180 221 1HG2 THR 30 HG21 THR 30 13.652 3.570 13.589 222 2HG2 THR 30 HG22 THR 30 15.154 3.578 14.518 223 3HG2 THR 30 HG23 THR 30 13.684 4.250 15.216 224 H VAL 31 HN VAL 31 15.952 -0.044 15.885 225 HA VAL 31 HA VAL 31 14.990 -2.698 15.864 226 HB VAL 31 HB VAL 31 16.834 -1.334 17.864 227 1HG1 VAL 31 HG11 VAL 31 15.792 -3.346 18.826 228 2HG1 VAL 31 HG12 VAL 31 17.511 -3.578 18.541 229 3HG1 VAL 31 HG13 VAL 31 16.335 -4.292 17.440 230 1HG2 VAL 31 HG21 VAL 31 17.711 -1.369 15.592 231 2HG2 VAL 31 HG22 VAL 31 17.426 -3.107 15.495 232 3HG2 VAL 31 HG23 VAL 31 18.618 -2.470 16.629 233 H SER 32 HN SER 32 14.161 0.112 17.697 234 HA SER 32 HA SER 32 12.839 -1.026 19.839 235 1HB SER 32 HB2 SER 32 11.497 1.119 19.742 236 2HB SER 32 HB1 SER 32 13.248 1.334 19.770 237 HG SER 32 HG SER 32 12.369 2.640 18.199 238 H ALA 33 HN ALA 33 11.637 -0.185 16.603 239 HA ALA 33 HA ALA 33 9.009 -1.221 16.981 240 1HB ALA 33 HB1 ALA 33 8.760 -0.908 14.573 241 2HB ALA 33 HB2 ALA 33 10.500 -0.680 14.410 242 3HB ALA 33 HB3 ALA 33 9.537 0.497 15.299 243 H LEU 34 HN LEU 34 12.064 -2.639 15.846 244 HA LEU 34 HA LEU 34 11.078 -4.977 14.775 245 1HB LEU 34 HB2 LEU 34 13.333 -4.102 14.413 246 2HB LEU 34 HB1 LEU 34 13.592 -4.146 16.141 247 HG LEU 34 HG LEU 34 13.633 -6.420 16.183 248 1HD1 LEU 34 HD11 LEU 34 13.654 -7.793 14.050 249 2HD1 LEU 34 HD12 LEU 34 13.276 -6.322 13.153 250 3HD1 LEU 34 HD13 LEU 34 12.111 -6.978 14.302 251 1HD2 LEU 34 HD21 LEU 34 15.447 -5.291 14.071 252 2HD2 LEU 34 HD22 LEU 34 15.760 -6.794 14.935 253 3HD2 LEU 34 HD23 LEU 34 15.693 -5.273 15.809 254 H LYS 35 HN LYS 35 12.284 -4.074 17.965 255 HA LYS 35 HA LYS 35 11.888 -6.472 19.334 256 1HB LYS 35 HB2 LYS 35 13.282 -4.649 20.140 257 2HB LYS 35 HB1 LYS 35 11.904 -3.611 20.274 258 1HG LYS 35 HG2 LYS 35 12.002 -6.119 21.907 259 2HG LYS 35 HG1 LYS 35 12.911 -4.709 22.421 260 1HD LYS 35 HD2 LYS 35 9.937 -4.745 21.873 261 2HD LYS 35 HD1 LYS 35 10.622 -4.878 23.482 262 1HE LYS 35 HE2 LYS 35 11.734 -2.653 23.077 263 2HE LYS 35 HE1 LYS 35 10.816 -2.541 21.585 264 1HZ LYS 35 HZ1 LYS 35 8.768 -2.671 22.870 265 2HZ LYS 35 HZ2 LYS 35 9.713 -1.367 23.339 266 3HZ LYS 35 HZ3 LYS 35 9.649 -2.743 24.309 267 H GLU 36 HN GLU 36 9.824 -3.666 19.052 268 HA GLU 36 HA GLU 36 7.618 -4.541 20.511 269 1HB GLU 36 HB2 GLU 36 7.825 -2.760 18.100 270 2HB GLU 36 HB1 GLU 36 6.320 -2.957 18.971 271 1HG GLU 36 HG2 GLU 36 8.876 -2.062 20.234 272 2HG GLU 36 HG1 GLU 36 7.702 -0.922 19.624 273 H THR 37 HN THR 37 8.478 -5.093 17.161 274 HA THR 37 HA THR 37 6.185 -6.562 16.475 275 HB THR 37 HB THR 37 8.952 -6.522 15.248 276 HG1 THR 37 HG1 THR 37 7.994 -4.545 15.060 277 1HG2 THR 37 HG21 THR 37 7.744 -8.565 14.592 278 2HG2 THR 37 HG22 THR 37 7.875 -7.449 13.232 279 3HG2 THR 37 HG23 THR 37 6.355 -7.592 14.115 280 H VAL 38 HN VAL 38 9.350 -7.506 17.790 281 HA VAL 38 HA VAL 38 9.127 -10.287 17.507 282 HB VAL 38 HB VAL 38 10.509 -8.755 19.735 283 1HG1 VAL 38 HG11 VAL 38 11.911 -10.744 19.972 284 2HG1 VAL 38 HG12 VAL 38 10.940 -11.578 18.756 285 3HG1 VAL 38 HG13 VAL 38 10.216 -11.105 20.295 286 1HG2 VAL 38 HG21 VAL 38 11.599 -9.772 17.123 287 2HG2 VAL 38 HG22 VAL 38 12.519 -8.959 18.396 288 3HG2 VAL 38 HG23 VAL 38 11.267 -8.089 17.516 289 H ILE 39 HN ILE 39 8.333 -8.194 20.199 290 HA ILE 39 HA ILE 39 7.264 -10.173 21.905 291 HB ILE 39 HB ILE 39 6.606 -7.201 21.809 292 1HG1 ILE 39 HG12 ILE 39 8.608 -8.738 23.484 293 2HG1 ILE 39 HG11 ILE 39 8.987 -7.658 22.150 294 1HG2 ILE 39 HG21 ILE 39 6.130 -9.189 24.035 295 2HG2 ILE 39 HG22 ILE 39 4.881 -8.390 23.072 296 3HG2 ILE 39 HG23 ILE 39 5.908 -7.448 24.158 297 1HD1 ILE 39 HD11 ILE 39 8.097 -5.777 23.417 298 2HD1 ILE 39 HD12 ILE 39 9.374 -6.602 24.311 299 3HD1 ILE 39 HD13 ILE 39 7.685 -6.862 24.742 300 H SER 40 HN SER 40 5.865 -8.340 19.318 301 HA SER 40 HA SER 40 3.202 -9.121 19.902 302 1HB SER 40 HB2 SER 40 4.333 -7.879 17.402 303 2HB SER 40 HB1 SER 40 2.615 -8.036 17.781 304 HG SER 40 HG SER 40 4.593 -6.506 19.095 305 H GLU 41 HN GLU 41 5.703 -10.359 17.609 306 HA GLU 41 HA GLU 41 3.919 -12.147 16.354 307 1HB GLU 41 HB2 GLU 41 6.928 -12.036 16.408 308 2HB GLU 41 HB1 GLU 41 5.934 -12.995 15.329 309 1HG GLU 41 HG2 GLU 41 6.073 -9.990 15.429 310 2HG GLU 41 HG1 GLU 41 6.784 -11.022 14.198 311 H TRP 42 HN TRP 42 6.051 -12.209 19.102 312 HA TRP 42 HA TRP 42 6.042 -15.048 19.462 313 1HB TRP 42 HB2 TRP 42 7.700 -13.244 20.379 314 2HB TRP 42 HB1 TRP 42 6.469 -12.928 21.583 315 HD1 TRP 42 HD1 TRP 42 6.112 -14.904 23.504 316 HE1 TRP 42 HE1 TRP 42 7.754 -16.732 24.319 317 HE3 TRP 42 HE3 TRP 42 9.434 -14.832 19.614 318 HZ2 TRP 42 HZ2 TRP 42 10.093 -17.998 23.404 319 HZ3 TRP 42 HZ3 TRP 42 11.339 -16.380 19.662 320 HH2 TRP 42 HH2 TRP 42 11.659 -17.930 21.522 321 HA PRO 43 HA PRO 43 1.831 -14.990 20.971 322 1HB PRO 43 HB2 PRO 43 2.498 -17.349 22.595 323 2HB PRO 43 HB1 PRO 43 1.300 -17.180 21.319 324 1HG PRO 43 HG2 PRO 43 3.574 -18.573 20.958 325 2HG PRO 43 HG1 PRO 43 2.806 -17.665 19.645 326 1HD PRO 43 HD2 PRO 43 5.202 -16.964 21.292 327 2HD PRO 43 HD1 PRO 43 4.890 -16.678 19.565 328 H ARG 44 HN ARG 44 1.534 -13.354 22.372 329 HA ARG 44 HA ARG 44 2.929 -13.084 24.843 330 1HB ARG 44 HB2 ARG 44 0.317 -11.790 24.018 331 2HB ARG 44 HB1 ARG 44 1.341 -11.282 25.348 332 1HG ARG 44 HG2 ARG 44 3.130 -10.756 23.716 333 2HG ARG 44 HG1 ARG 44 2.015 -11.170 22.413 334 1HD ARG 44 HD2 ARG 44 0.458 -9.443 23.255 335 2HD ARG 44 HD1 ARG 44 1.658 -9.005 24.467 336 HE ARG 44 HE ARG 44 2.292 -8.890 21.620 337 1HH1 ARG 44 HH11 ARG 44 1.990 -7.240 24.740 338 2HH1 ARG 44 HH12 ARG 44 2.551 -5.742 24.155 339 1HH2 ARG 44 HH21 ARG 44 3.079 -6.788 20.827 340 2HH2 ARG 44 HH22 ARG 44 3.209 -5.500 21.933 341 H GLU 45 HN GLU 45 0.168 -14.705 23.779 342 HA GLU 45 HA GLU 45 -1.148 -15.205 26.244 343 1HB GLU 45 HB2 GLU 45 -2.234 -15.367 24.040 344 2HB GLU 45 HB1 GLU 45 -1.197 -16.718 23.633 345 1HG GLU 45 HG2 GLU 45 -2.212 -18.021 25.451 346 2HG GLU 45 HG1 GLU 45 -3.278 -16.662 25.806 347 H LYS 46 HN LYS 46 1.813 -16.320 24.988 348 HA LYS 46 HA LYS 46 1.733 -19.013 25.908 349 1HB LYS 46 HB2 LYS 46 3.360 -18.077 24.127 350 2HB LYS 46 HB1 LYS 46 4.181 -17.297 25.443 351 1HG LYS 46 HG2 LYS 46 5.314 -19.346 24.742 352 2HG LYS 46 HG1 LYS 46 4.778 -19.429 26.421 353 1HD LYS 46 HD2 LYS 46 2.845 -20.753 25.768 354 2HD LYS 46 HD1 LYS 46 3.299 -20.615 24.067 355 1HE LYS 46 HE2 LYS 46 4.954 -21.930 26.212 356 2HE LYS 46 HE1 LYS 46 3.894 -22.794 25.105 357 1HZ LYS 46 HZ1 LYS 46 6.174 -22.857 24.366 358 2HZ LYS 46 HZ2 LYS 46 6.264 -21.165 24.283 359 3HZ LYS 46 HZ3 LYS 46 5.219 -22.010 23.276 360 H GLU 47 HN GLU 47 2.980 -19.838 27.693 361 HA GLU 47 HA GLU 47 2.601 -18.552 30.125 362 1HB GLU 47 HB2 GLU 47 4.291 -20.913 29.345 363 2HB GLU 47 HB1 GLU 47 4.074 -20.408 31.008 364 1HG GLU 47 HG2 GLU 47 2.649 -22.285 30.481 365 2HG GLU 47 HG1 GLU 47 1.673 -20.862 30.819 366 H ASN 48 HN ASN 48 4.750 -18.724 31.646 367 HA ASN 48 HA ASN 48 6.160 -16.528 30.767 368 1HB ASN 48 HB2 ASN 48 6.315 -17.927 33.396 369 2HB ASN 48 HB1 ASN 48 7.467 -16.654 32.990 370 1HD2 ASN 48 HD21 ASN 48 6.730 -15.266 34.573 371 2HD2 ASN 48 HD22 ASN 48 5.174 -14.544 34.491 372 H GLY 49 HN GLY 49 6.869 -17.549 29.097 373 1HA GLY 49 HA2 GLY 49 9.671 -18.547 29.298 374 2HA GLY 49 HA1 GLY 49 8.681 -18.507 27.851 375 HA PRO 50 HA PRO 50 10.804 -14.518 27.473 376 1HB PRO 50 HB2 PRO 50 10.330 -15.286 24.642 377 2HB PRO 50 HB1 PRO 50 11.791 -14.615 25.370 378 1HG PRO 50 HG2 PRO 50 11.741 -17.155 24.661 379 2HG PRO 50 HG1 PRO 50 12.473 -16.670 26.207 380 1HD PRO 50 HD2 PRO 50 9.751 -17.845 25.712 381 2HD PRO 50 HD1 PRO 50 10.953 -18.282 26.950 382 H LYS 51 HN LYS 51 9.468 -12.735 27.245 383 HA LYS 51 HA LYS 51 7.101 -12.958 25.582 384 1HB LYS 51 HB2 LYS 51 6.373 -13.783 27.805 385 2HB LYS 51 HB1 LYS 51 6.870 -12.252 28.511 386 1HG LYS 51 HG2 LYS 51 5.213 -11.061 27.235 387 2HG LYS 51 HG1 LYS 51 4.774 -12.531 26.370 388 1HD LYS 51 HD2 LYS 51 4.484 -12.093 29.332 389 2HD LYS 51 HD1 LYS 51 3.172 -11.968 28.142 390 1HE LYS 51 HE2 LYS 51 3.592 -14.360 27.542 391 2HE LYS 51 HE1 LYS 51 4.773 -14.444 28.844 392 1HZ LYS 51 HZ1 LYS 51 2.637 -15.340 29.483 393 2HZ LYS 51 HZ2 LYS 51 1.867 -13.900 29.167 394 3HZ LYS 51 HZ3 LYS 51 2.934 -13.995 30.451 395 H THR 52 HN THR 52 9.109 -11.033 27.739 396 HA THR 52 HA THR 52 8.472 -8.786 26.014 397 HB THR 52 HB THR 52 8.974 -7.310 27.892 398 HG1 THR 52 HG1 THR 52 9.606 -9.760 29.204 399 1HG2 THR 52 HG21 THR 52 6.884 -9.392 28.558 400 2HG2 THR 52 HG22 THR 52 6.650 -7.972 27.537 401 3HG2 THR 52 HG23 THR 52 6.970 -7.774 29.260 402 H VAL 53 HN VAL 53 10.269 -7.140 26.201 403 HA VAL 53 HA VAL 53 12.528 -8.056 24.900 404 HB VAL 53 HB VAL 53 11.674 -5.812 24.702 405 1HG1 VAL 53 HG11 VAL 53 12.675 -5.315 27.485 406 2HG1 VAL 53 HG12 VAL 53 10.996 -5.329 26.928 407 3HG1 VAL 53 HG13 VAL 53 12.101 -4.077 26.365 408 1HG2 VAL 53 HG21 VAL 53 13.959 -6.155 24.015 409 2HG2 VAL 53 HG22 VAL 53 14.549 -5.786 25.644 410 3HG2 VAL 53 HG23 VAL 53 13.747 -4.539 24.673 411 H LYS 54 HN LYS 54 11.989 -7.861 28.328 412 HA LYS 54 HA LYS 54 14.710 -7.800 29.091 413 1HB LYS 54 HB2 LYS 54 12.282 -8.737 30.621 414 2HB LYS 54 HB1 LYS 54 13.869 -8.442 31.311 415 1HG LYS 54 HG2 LYS 54 13.686 -6.080 30.719 416 2HG LYS 54 HG1 LYS 54 12.093 -6.380 30.020 417 1HD LYS 54 HD2 LYS 54 11.303 -7.156 32.221 418 2HD LYS 54 HD1 LYS 54 12.890 -6.802 32.897 419 1HE LYS 54 HE2 LYS 54 12.621 -4.450 32.316 420 2HE LYS 54 HE1 LYS 54 11.040 -4.795 31.619 421 1HZ LYS 54 HZ1 LYS 54 10.833 -3.923 33.866 422 2HZ LYS 54 HZ2 LYS 54 11.789 -5.182 34.461 423 3HZ LYS 54 HZ3 LYS 54 10.297 -5.521 33.828 424 H GLU 55 HN GLU 55 12.580 -10.248 27.937 425 HA GLU 55 HA GLU 55 14.486 -12.298 28.794 426 1HB GLU 55 HB2 GLU 55 11.787 -12.720 27.535 427 2HB GLU 55 HB1 GLU 55 12.837 -13.961 28.197 428 1HG GLU 55 HG2 GLU 55 11.154 -13.674 29.784 429 2HG GLU 55 HG1 GLU 55 12.523 -12.750 30.419 430 H VAL 56 HN VAL 56 12.726 -11.161 25.961 431 HA VAL 56 HA VAL 56 14.438 -12.851 24.329 432 HB VAL 56 HB VAL 56 12.059 -13.065 23.878 433 1HG1 VAL 56 HG11 VAL 56 10.712 -11.257 22.923 434 2HG1 VAL 56 HG12 VAL 56 12.049 -10.137 23.179 435 3HG1 VAL 56 HG13 VAL 56 11.254 -10.890 24.559 436 1HG2 VAL 56 HG21 VAL 56 13.544 -13.384 22.015 437 2HG2 VAL 56 HG22 VAL 56 13.480 -11.662 21.635 438 3HG2 VAL 56 HG23 VAL 56 12.036 -12.658 21.461 439 H LYS 57 HN LYS 57 16.241 -12.080 23.584 440 HA LYS 57 HA LYS 57 16.293 -9.356 22.659 441 1HB LYS 57 HB2 LYS 57 18.384 -10.850 24.163 442 2HB LYS 57 HB1 LYS 57 18.808 -9.499 23.119 443 1HG LYS 57 HG2 LYS 57 17.299 -8.039 24.371 444 2HG LYS 57 HG1 LYS 57 16.838 -9.393 25.398 445 1HD LYS 57 HD2 LYS 57 19.047 -9.522 26.310 446 2HD LYS 57 HD1 LYS 57 19.644 -8.327 25.151 447 1HE LYS 57 HE2 LYS 57 19.248 -7.344 27.372 448 2HE LYS 57 HE1 LYS 57 18.231 -6.622 26.128 449 1HZ LYS 57 HZ1 LYS 57 16.371 -8.008 26.933 450 2HZ LYS 57 HZ2 LYS 57 17.019 -7.020 28.131 451 3HZ LYS 57 HZ3 LYS 57 17.403 -8.649 28.125 452 H LEU 58 HN LEU 58 17.475 -8.804 20.852 453 HA LEU 58 HA LEU 58 17.576 -11.006 18.937 454 1HB LEU 58 HB2 LEU 58 17.426 -8.022 18.446 455 2HB LEU 58 HB1 LEU 58 17.357 -9.261 17.219 456 HG LEU 58 HG LEU 58 15.156 -8.497 17.448 457 1HD1 LEU 58 HD11 LEU 58 15.350 -11.002 19.087 458 2HD1 LEU 58 HD12 LEU 58 15.274 -10.895 17.332 459 3HD1 LEU 58 HD13 LEU 58 13.890 -10.405 18.305 460 1HD2 LEU 58 HD21 LEU 58 15.421 -8.751 20.451 461 2HD2 LEU 58 HD22 LEU 58 13.952 -8.273 19.604 462 3HD2 LEU 58 HD23 LEU 58 15.382 -7.247 19.538 463 H ILE 59 HN ILE 59 19.524 -11.668 18.201 464 HA ILE 59 HA ILE 59 21.804 -9.807 18.322 465 HB ILE 59 HB ILE 59 21.778 -12.697 19.232 466 1HG1 ILE 59 HG12 ILE 59 22.439 -10.114 20.618 467 2HG1 ILE 59 HG11 ILE 59 21.048 -11.143 20.941 468 1HG2 ILE 59 HG21 ILE 59 24.194 -12.498 19.599 469 2HG2 ILE 59 HG22 ILE 59 24.173 -10.908 18.839 470 3HG2 ILE 59 HG23 ILE 59 23.777 -12.341 17.892 471 1HD1 ILE 59 HD11 ILE 59 22.594 -12.885 21.765 472 2HD1 ILE 59 HD12 ILE 59 22.719 -11.382 22.680 473 3HD1 ILE 59 HD13 ILE 59 23.940 -11.787 21.471 474 H SER 60 HN SER 60 22.902 -9.595 16.565 475 HA SER 60 HA SER 60 22.782 -11.709 14.541 476 1HB SER 60 HB2 SER 60 22.837 -8.709 14.118 477 2HB SER 60 HB1 SER 60 22.968 -9.917 12.840 478 HG SER 60 HG SER 60 20.729 -9.224 14.414 479 H ALA 61 HN ALA 61 24.726 -12.591 14.259 480 HA ALA 61 HA ALA 61 26.933 -12.924 14.031 481 1HB ALA 61 HB1 ALA 61 27.169 -9.926 13.755 482 2HB ALA 61 HB2 ALA 61 26.805 -11.037 12.436 483 3HB ALA 61 HB3 ALA 61 28.367 -11.119 13.250 484 H GLY 62 HN GLY 62 25.741 -12.265 16.663 485 1HA GLY 62 HA2 GLY 62 26.672 -12.527 18.813 486 2HA GLY 62 HA1 GLY 62 28.258 -12.189 18.135 487 H LYS 63 HN LYS 63 25.680 -10.051 17.374 488 HA LYS 63 HA LYS 63 26.626 -8.111 19.341 489 1HB LYS 63 HB2 LYS 63 27.629 -7.684 17.127 490 2HB LYS 63 HB1 LYS 63 26.037 -7.711 16.403 491 1HG LYS 63 HG2 LYS 63 26.888 -5.459 16.593 492 2HG LYS 63 HG1 LYS 63 25.452 -5.678 17.596 493 1HD LYS 63 HD2 LYS 63 26.835 -5.832 19.579 494 2HD LYS 63 HD1 LYS 63 28.302 -5.754 18.595 495 1HE LYS 63 HE2 LYS 63 27.762 -3.519 17.871 496 2HE LYS 63 HE1 LYS 63 26.204 -3.592 18.688 497 1HZ LYS 63 HZ1 LYS 63 27.349 -3.698 20.796 498 2HZ LYS 63 HZ2 LYS 63 27.850 -2.331 19.956 499 3HZ LYS 63 HZ3 LYS 63 28.856 -3.671 20.043 500 H VAL 64 HN VAL 64 24.928 -7.343 20.497 501 HA VAL 64 HA VAL 64 22.286 -8.237 19.759 502 HB VAL 64 HB VAL 64 23.068 -8.482 22.107 503 1HG1 VAL 64 HG11 VAL 64 23.141 -6.577 23.623 504 2HG1 VAL 64 HG12 VAL 64 22.906 -5.491 22.256 505 3HG1 VAL 64 HG13 VAL 64 24.369 -6.463 22.361 506 1HG2 VAL 64 HG21 VAL 64 20.678 -8.472 21.681 507 2HG2 VAL 64 HG22 VAL 64 20.642 -6.716 21.802 508 3HG2 VAL 64 HG23 VAL 64 21.021 -7.691 23.226 509 H LEU 65 HN LEU 65 20.591 -7.070 19.150 510 HA LEU 65 HA LEU 65 21.086 -4.344 18.370 511 1HB LEU 65 HB2 LEU 65 18.832 -6.271 17.786 512 2HB LEU 65 HB1 LEU 65 18.867 -4.621 17.239 513 HG LEU 65 HG LEU 65 20.945 -5.203 15.923 514 1HD1 LEU 65 HD11 LEU 65 20.187 -8.027 16.599 515 2HD1 LEU 65 HD12 LEU 65 21.651 -7.180 17.103 516 3HD1 LEU 65 HD13 LEU 65 21.379 -7.531 15.396 517 1HD2 LEU 65 HD21 LEU 65 19.716 -6.307 14.121 518 2HD2 LEU 65 HD22 LEU 65 18.787 -5.000 14.856 519 3HD2 LEU 65 HD23 LEU 65 18.410 -6.680 15.247 520 H GLU 66 HN GLU 66 20.700 -2.924 19.962 521 HA GLU 66 HA GLU 66 18.506 -3.438 21.803 522 1HB GLU 66 HB2 GLU 66 20.642 -1.295 21.875 523 2HB GLU 66 HB1 GLU 66 19.464 -1.628 23.138 524 1HG GLU 66 HG2 GLU 66 20.415 -3.846 23.470 525 2HG GLU 66 HG1 GLU 66 21.584 -3.541 22.191 526 H ASN 67 HN ASN 67 17.077 -1.611 22.326 527 HA ASN 67 HA ASN 67 15.609 -0.884 20.084 528 1HB ASN 67 HB2 ASN 67 14.198 0.459 21.529 529 2HB ASN 67 HB1 ASN 67 14.642 -1.029 22.353 530 1HD2 ASN 67 HD21 ASN 67 15.999 -0.907 24.170 531 2HD2 ASN 67 HD22 ASN 67 16.339 0.578 24.959 532 H SER 68 HN SER 68 18.291 0.830 21.419 533 HA SER 68 HA SER 68 17.598 3.407 20.463 534 1HB SER 68 HB2 SER 68 20.266 2.285 21.261 535 2HB SER 68 HB1 SER 68 19.856 3.999 21.143 536 HG SER 68 HG SER 68 18.793 3.896 22.943 537 H LYS 69 HN LYS 69 18.769 0.670 18.937 538 HA LYS 69 HA LYS 69 20.186 2.128 16.885 539 1HB LYS 69 HB2 LYS 69 20.001 -0.759 17.596 540 2HB LYS 69 HB1 LYS 69 20.672 -0.226 16.071 541 1HG LYS 69 HG2 LYS 69 21.682 0.584 18.797 542 2HG LYS 69 HG1 LYS 69 22.405 -0.663 17.776 543 1HD LYS 69 HD2 LYS 69 22.758 1.053 16.011 544 2HD LYS 69 HD1 LYS 69 22.144 2.276 17.114 545 1HE LYS 69 HE2 LYS 69 23.970 1.840 18.654 546 2HE LYS 69 HE1 LYS 69 24.545 0.543 17.606 547 1HZ LYS 69 HZ1 LYS 69 25.807 2.559 17.242 548 2HZ LYS 69 HZ2 LYS 69 24.420 3.419 16.861 549 3HZ LYS 69 HZ3 LYS 69 24.932 2.160 15.858 550 H THR 70 HN THR 70 19.922 1.414 14.663 551 HA THR 70 HA THR 70 17.113 0.929 13.943 552 HB THR 70 HB THR 70 19.203 2.256 12.256 553 HG1 THR 70 HG1 THR 70 17.561 4.150 13.218 554 1HG2 THR 70 HG21 THR 70 16.190 2.462 12.260 555 2HG2 THR 70 HG22 THR 70 17.178 1.565 11.105 556 3HG2 THR 70 HG23 THR 70 17.260 3.324 11.153 557 H VAL 71 HN VAL 71 17.023 -0.257 11.717 558 HA VAL 71 HA VAL 71 18.679 -2.579 11.837 559 HB VAL 71 HB VAL 71 16.836 -1.651 9.587 560 1HG1 VAL 71 HG11 VAL 71 18.082 -4.371 10.029 561 2HG1 VAL 71 HG12 VAL 71 18.497 -3.243 8.738 562 3HG1 VAL 71 HG13 VAL 71 16.893 -3.977 8.788 563 1HG2 VAL 71 HG21 VAL 71 15.265 -3.312 10.488 564 2HG2 VAL 71 HG22 VAL 71 15.655 -2.071 11.680 565 3HG2 VAL 71 HG23 VAL 71 16.401 -3.667 11.790 566 H LYS 72 HN LYS 72 18.680 0.296 9.933 567 HA LYS 72 HA LYS 72 20.569 -0.169 8.001 568 1HB LYS 72 HB2 LYS 72 19.197 1.847 8.175 569 2HB LYS 72 HB1 LYS 72 20.127 2.361 9.571 570 1HG LYS 72 HG2 LYS 72 22.127 2.515 8.156 571 2HG LYS 72 HG1 LYS 72 21.152 2.045 6.761 572 1HD LYS 72 HD2 LYS 72 19.729 3.993 7.092 573 2HD LYS 72 HD1 LYS 72 20.684 4.448 8.501 574 1HE LYS 72 HE2 LYS 72 22.656 4.709 7.078 575 2HE LYS 72 HE1 LYS 72 21.698 4.249 5.671 576 1HZ LYS 72 HZ1 LYS 72 21.160 6.576 7.407 577 2HZ LYS 72 HZ2 LYS 72 20.341 6.187 5.966 578 3HZ LYS 72 HZ3 LYS 72 21.966 6.652 5.927 579 H ASP 73 HN ASP 73 21.112 0.499 11.421 580 HA ASP 73 HA ASP 73 23.873 1.129 11.340 581 1HB ASP 73 HB2 ASP 73 22.527 1.490 13.372 582 2HB ASP 73 HB1 ASP 73 22.306 -0.245 13.546 583 H TYR 74 HN TYR 74 22.156 -1.935 11.535 584 HA TYR 74 HA TYR 74 24.660 -3.384 11.650 585 1HB TYR 74 HB2 TYR 74 21.798 -4.230 11.997 586 2HB TYR 74 HB1 TYR 74 23.167 -5.330 12.065 587 HD1 TYR 74 HD1 TYR 74 21.056 -3.191 13.950 588 HD2 TYR 74 HD2 TYR 74 25.012 -4.726 13.772 589 HE1 TYR 74 HE1 TYR 74 21.367 -2.669 16.338 590 HE2 TYR 74 HE2 TYR 74 25.325 -4.215 16.140 591 HH TYR 74 HH TYR 74 22.883 -3.578 18.237 592 H ARG 75 HN ARG 75 22.962 -2.061 9.236 593 HA ARG 75 HA ARG 75 22.656 -4.256 7.503 594 1HB ARG 75 HB2 ARG 75 21.226 -2.335 7.624 595 2HB ARG 75 HB1 ARG 75 22.565 -1.277 7.218 596 1HG ARG 75 HG2 ARG 75 21.115 -1.565 5.429 597 2HG ARG 75 HG1 ARG 75 22.686 -2.315 5.057 598 1HD ARG 75 HD2 ARG 75 21.806 -4.504 5.359 599 2HD ARG 75 HD1 ARG 75 20.346 -3.873 6.127 600 HE ARG 75 HE ARG 75 19.891 -2.848 3.904 601 1HH1 ARG 75 HH11 ARG 75 21.591 -5.986 4.200 602 2HH1 ARG 75 HH12 ARG 75 21.103 -6.558 2.693 603 1HH2 ARG 75 HH21 ARG 75 19.139 -3.738 1.819 604 2HH2 ARG 75 HH22 ARG 75 19.642 -5.261 1.300 605 H SER 76 HN SER 76 24.576 -5.145 7.082 606 HA SER 76 HA SER 76 26.964 -3.677 6.668 607 1HB SER 76 HB2 SER 76 26.297 -6.584 6.255 608 2HB SER 76 HB1 SER 76 27.916 -5.887 6.302 609 HG SER 76 HG SER 76 27.114 -5.047 8.458 610 HA PRO 77 HA PRO 77 26.434 -3.262 2.248 611 1HB PRO 77 HB2 PRO 77 29.299 -3.112 1.951 612 2HB PRO 77 HB1 PRO 77 28.106 -1.835 1.697 613 1HG PRO 77 HG2 PRO 77 29.884 -1.821 3.778 614 2HG PRO 77 HG1 PRO 77 28.293 -1.042 3.853 615 1HD PRO 77 HD2 PRO 77 29.207 -3.639 4.997 616 2HD PRO 77 HD1 PRO 77 28.058 -2.443 5.645 617 H VAL 78 HN VAL 78 26.008 -5.004 1.114 618 HA VAL 78 HA VAL 78 27.894 -6.956 0.401 619 HB VAL 78 HB VAL 78 25.248 -7.583 1.689 620 1HG1 VAL 78 HG11 VAL 78 25.770 -9.134 -0.095 621 2HG1 VAL 78 HG12 VAL 78 25.902 -9.982 1.446 622 3HG1 VAL 78 HG13 VAL 78 27.358 -9.452 0.603 623 1HG2 VAL 78 HG21 VAL 78 26.804 -7.074 3.480 624 2HG2 VAL 78 HG22 VAL 78 27.984 -8.201 2.809 625 3HG2 VAL 78 HG23 VAL 78 26.468 -8.806 3.480 626 H SER 79 HN SER 79 27.179 -7.587 -1.509 627 HA SER 79 HA SER 79 25.877 -5.994 -3.286 628 1HB SER 79 HB2 SER 79 25.774 -9.015 -3.367 629 2HB SER 79 HB1 SER 79 25.534 -7.939 -4.745 630 HG SER 79 HG SER 79 27.677 -7.176 -4.414 631 H ASN 80 HN ASN 80 23.956 -5.120 -3.257 632 HA ASN 80 HA ASN 80 21.794 -6.356 -1.781 633 1HB ASN 80 HB2 ASN 80 22.028 -3.609 -3.032 634 2HB ASN 80 HB1 ASN 80 20.614 -4.191 -2.170 635 1HD2 ASN 80 HD21 ASN 80 23.938 -3.202 -1.857 636 2HD2 ASN 80 HD22 ASN 80 23.903 -2.964 -0.152 637 H LEU 81 HN LEU 81 20.644 -7.909 -2.917 638 HA LEU 81 HA LEU 81 19.998 -7.386 -5.610 639 1HB LEU 81 HB2 LEU 81 19.885 -9.591 -3.689 640 2HB LEU 81 HB1 LEU 81 18.908 -9.664 -5.109 641 HG LEU 81 HG LEU 81 20.891 -10.995 -5.499 642 1HD1 LEU 81 HD11 LEU 81 21.931 -9.938 -7.418 643 2HD1 LEU 81 HD12 LEU 81 21.224 -8.396 -6.957 644 3HD1 LEU 81 HD13 LEU 81 20.178 -9.739 -7.422 645 1HD2 LEU 81 HD21 LEU 81 22.339 -10.062 -3.771 646 2HD2 LEU 81 HD22 LEU 81 22.524 -8.582 -4.706 647 3HD2 LEU 81 HD23 LEU 81 23.173 -10.102 -5.326 648 H ALA 82 HN ALA 82 17.624 -8.363 -5.918 649 HA ALA 82 HA ALA 82 15.980 -6.554 -4.513 650 1HB ALA 82 HB1 ALA 82 15.317 -8.352 -6.840 651 2HB ALA 82 HB2 ALA 82 15.770 -6.653 -6.937 652 3HB ALA 82 HB3 ALA 82 14.250 -7.120 -6.167 653 H GLY 83 HN GLY 83 16.054 -7.587 -2.568 654 1HA GLY 83 HA2 GLY 83 14.261 -8.700 -1.229 655 2HA GLY 83 HA1 GLY 83 14.422 -10.045 -2.360 656 H ALA 84 HN ALA 84 15.591 -8.554 0.448 657 HA ALA 84 HA ALA 84 17.808 -10.475 0.586 658 1HB ALA 84 HB1 ALA 84 18.551 -8.147 0.647 659 2HB ALA 84 HB2 ALA 84 18.852 -8.945 2.192 660 3HB ALA 84 HB3 ALA 84 17.493 -7.837 2.022 661 H VAL 85 HN VAL 85 17.703 -11.989 2.112 662 HA VAL 85 HA VAL 85 15.695 -11.657 4.220 663 HB VAL 85 HB VAL 85 16.852 -14.234 3.135 664 1HG1 VAL 85 HG11 VAL 85 16.279 -14.424 5.499 665 2HG1 VAL 85 HG12 VAL 85 15.153 -15.363 4.519 666 3HG1 VAL 85 HG13 VAL 85 14.660 -13.802 5.173 667 1HG2 VAL 85 HG21 VAL 85 15.335 -13.198 1.544 668 2HG2 VAL 85 HG22 VAL 85 14.089 -13.078 2.789 669 3HG2 VAL 85 HG23 VAL 85 14.621 -14.660 2.219 670 H THR 86 HN THR 86 16.388 -11.622 6.180 671 HA THR 86 HA THR 86 19.200 -12.271 6.716 672 HB THR 86 HB THR 86 17.587 -10.009 7.935 673 HG1 THR 86 HG1 THR 86 18.276 -9.911 5.643 674 1HG2 THR 86 HG21 THR 86 19.766 -9.281 8.834 675 2HG2 THR 86 HG22 THR 86 20.542 -10.684 8.098 676 3HG2 THR 86 HG23 THR 86 19.375 -10.906 9.403 677 H THR 87 HN THR 87 19.372 -13.850 8.191 678 HA THR 87 HA THR 87 17.094 -14.480 9.880 679 HB THR 87 HB THR 87 19.694 -15.999 9.473 680 HG1 THR 87 HG1 THR 87 18.793 -16.235 7.549 681 1HG2 THR 87 HG21 THR 87 18.468 -16.578 11.533 682 2HG2 THR 87 HG22 THR 87 18.414 -17.903 10.371 683 3HG2 THR 87 HG23 THR 87 17.009 -16.862 10.583 684 H MET 88 HN MET 88 17.126 -13.867 11.969 685 HA MET 88 HA MET 88 19.703 -13.035 13.084 686 1HB MET 88 HB2 MET 88 18.288 -11.113 12.671 687 2HB MET 88 HB1 MET 88 16.964 -11.877 13.530 688 1HG MET 88 HG2 MET 88 18.099 -11.654 15.620 689 2HG MET 88 HG1 MET 88 19.570 -11.105 14.817 690 1HE MET 88 HE1 MET 88 15.641 -8.691 14.769 691 2HE MET 88 HE2 MET 88 15.794 -10.303 15.458 692 3HE MET 88 HE3 MET 88 15.970 -10.069 13.728 693 H HIS 89 HN HIS 89 20.188 -13.578 15.182 694 HA HIS 89 HA HIS 89 18.915 -16.011 16.063 695 1HB HIS 89 HB2 HIS 89 21.421 -15.641 15.958 696 2HB HIS 89 HB1 HIS 89 21.236 -14.521 17.288 697 HD1 HIS 89 HD1 HIS 89 21.781 -18.022 16.550 698 HD2 HIS 89 HD2 HIS 89 20.299 -15.838 19.743 699 HE1 HIS 89 HE1 HIS 89 21.836 -19.581 18.500 700 HE2 HIS 89 HE2 HIS 89 21.238 -18.132 20.452 701 H VAL 90 HN VAL 90 17.556 -16.138 17.670 702 HA VAL 90 HA VAL 90 17.004 -13.769 19.361 703 HB VAL 90 HB VAL 90 15.352 -16.272 18.891 704 1HG1 VAL 90 HG11 VAL 90 14.924 -15.200 21.034 705 2HG1 VAL 90 HG12 VAL 90 13.548 -15.018 19.946 706 3HG1 VAL 90 HG13 VAL 90 14.649 -13.666 20.210 707 1HG2 VAL 90 HG21 VAL 90 15.012 -13.532 17.700 708 2HG2 VAL 90 HG22 VAL 90 13.857 -14.856 17.598 709 3HG2 VAL 90 HG23 VAL 90 15.447 -15.016 16.836 710 H ILE 91 HN ILE 91 17.299 -13.766 21.336 711 HA ILE 91 HA ILE 91 18.584 -16.064 22.607 712 HB ILE 91 HB ILE 91 18.343 -13.169 23.173 713 1HG1 ILE 91 HG12 ILE 91 19.968 -13.631 21.486 714 2HG1 ILE 91 HG11 ILE 91 20.806 -13.117 22.944 715 1HG2 ILE 91 HG21 ILE 91 19.874 -13.530 25.169 716 2HG2 ILE 91 HG22 ILE 91 19.725 -15.270 24.902 717 3HG2 ILE 91 HG23 ILE 91 18.305 -14.323 25.349 718 1HD1 ILE 91 HD11 ILE 91 21.380 -15.447 23.430 719 2HD1 ILE 91 HD12 ILE 91 21.972 -14.952 21.848 720 3HD1 ILE 91 HD13 ILE 91 20.539 -15.964 21.970 721 H ILE 92 HN ILE 92 17.416 -17.317 23.675 722 HA ILE 92 HA ILE 92 14.921 -16.339 24.768 723 HB ILE 92 HB ILE 92 15.798 -19.148 24.069 724 1HG1 ILE 92 HG12 ILE 92 13.607 -19.140 22.764 725 2HG1 ILE 92 HG11 ILE 92 13.475 -17.439 23.145 726 1HG2 ILE 92 HG21 ILE 92 13.345 -18.419 25.623 727 2HG2 ILE 92 HG22 ILE 92 14.760 -19.291 26.208 728 3HG2 ILE 92 HG23 ILE 92 13.724 -20.024 24.977 729 1HD1 ILE 92 HD11 ILE 92 15.547 -17.027 21.926 730 2HD1 ILE 92 HD12 ILE 92 14.293 -17.753 20.924 731 3HD1 ILE 92 HD13 ILE 92 15.632 -18.742 21.515 732 H GLN 93 HN GLN 93 15.193 -15.587 26.721 733 HA GLN 93 HA GLN 93 16.766 -17.088 28.625 734 1HB GLN 93 HB2 GLN 93 15.426 -14.378 28.811 735 2HB GLN 93 HB1 GLN 93 16.383 -15.117 30.088 736 1HG GLN 93 HG2 GLN 93 18.362 -15.042 28.683 737 2HG GLN 93 HG1 GLN 93 17.408 -14.382 27.358 738 1HE2 GLN 93 HE21 GLN 93 16.741 -12.283 27.461 739 2HE2 GLN 93 HE22 GLN 93 17.424 -11.137 28.583 740 H ALA 94 HN ALA 94 15.702 -18.566 29.552 741 HA ALA 94 HA ALA 94 12.792 -18.466 29.711 742 1HB ALA 94 HB1 ALA 94 13.793 -20.421 28.644 743 2HB ALA 94 HB2 ALA 94 12.893 -20.868 30.091 744 3HB ALA 94 HB3 ALA 94 14.653 -20.797 30.137 745 HA PRO 95 HA PRO 95 13.339 -17.985 34.140 746 1HB PRO 95 HB2 PRO 95 11.059 -16.680 34.590 747 2HB PRO 95 HB1 PRO 95 12.420 -15.871 33.805 748 1HG PRO 95 HG2 PRO 95 9.890 -16.886 32.622 749 2HG PRO 95 HG1 PRO 95 10.876 -15.496 32.141 750 1HD PRO 95 HD2 PRO 95 10.878 -18.081 30.977 751 2HD PRO 95 HD1 PRO 95 12.017 -16.757 30.644 752 H VAL 96 HN VAL 96 11.657 -18.465 35.915 753 HA VAL 96 HA VAL 96 10.534 -21.073 35.417 754 HB VAL 96 HB VAL 96 10.333 -19.325 37.866 755 1HG1 VAL 96 HG11 VAL 96 9.763 -21.405 39.082 756 2HG1 VAL 96 HG12 VAL 96 9.795 -22.290 37.559 757 3HG1 VAL 96 HG13 VAL 96 8.577 -21.045 37.826 758 1HG2 VAL 96 HG21 VAL 96 12.237 -21.577 37.255 759 2HG2 VAL 96 HG22 VAL 96 12.112 -20.750 38.809 760 3HG2 VAL 96 HG23 VAL 96 12.642 -19.865 37.376 761 H THR 97 HN THR 97 8.356 -21.570 35.221 762 HA THR 97 HA THR 97 6.743 -19.490 34.217 763 HB THR 97 HB THR 97 5.939 -22.328 34.925 764 HG1 THR 97 HG1 THR 97 7.669 -21.549 33.191 765 1HG2 THR 97 HG21 THR 97 4.009 -20.822 34.620 766 2HG2 THR 97 HG22 THR 97 4.131 -21.963 33.278 767 3HG2 THR 97 HG23 THR 97 4.668 -20.295 33.073 768 H GLU 98 HN GLU 98 5.515 -18.090 35.370 769 HA GLU 98 HA GLU 98 4.354 -18.944 37.877 770 1HB GLU 98 HB2 GLU 98 6.547 -17.998 38.389 771 2HB GLU 98 HB1 GLU 98 6.113 -16.521 37.552 772 1HG GLU 98 HG2 GLU 98 4.357 -16.103 39.200 773 2HG GLU 98 HG1 GLU 98 4.796 -17.595 40.037 774 H LYS 99 HN LYS 99 2.311 -18.390 37.772 775 HA LYS 99 HA LYS 99 0.377 -17.346 37.417 776 1HB LYS 99 HB2 LYS 99 1.509 -15.323 38.343 777 2HB LYS 99 HB1 LYS 99 2.070 -14.903 36.740 778 1HG LYS 99 HG2 LYS 99 -0.262 -14.577 36.029 779 2HG LYS 99 HG1 LYS 99 -0.804 -14.984 37.656 780 1HD LYS 99 HD2 LYS 99 0.424 -13.066 38.539 781 2HD LYS 99 HD1 LYS 99 0.988 -12.680 36.912 782 1HE LYS 99 HE2 LYS 99 -1.337 -12.379 36.193 783 2HE LYS 99 HE1 LYS 99 -1.872 -12.740 37.831 784 1HZ LYS 99 HZ1 LYS 99 -1.805 -10.381 37.371 785 2HZ LYS 99 HZ2 LYS 99 -0.157 -10.451 37.054 786 3HZ LYS 99 HZ3 LYS 99 -0.740 -10.774 38.621 787 H GLU 100 HN GLU 100 -0.972 -16.270 35.626 788 HA GLU 100 HA GLU 100 -1.804 -16.246 33.582 789 1HB GLU 100 HB2 GLU 100 1.066 -16.412 32.620 790 2HB GLU 100 HB1 GLU 100 -0.320 -16.030 31.608 791 1HG GLU 100 HG2 GLU 100 -0.756 -14.032 32.986 792 2HG GLU 100 HG1 GLU 100 0.663 -14.406 33.951 793 H LYS 101 HN LYS 101 -0.760 -18.774 34.989 794 HA LYS 101 HA LYS 101 -2.296 -20.514 33.423 795 1HB LYS 101 HB2 LYS 101 -0.154 -20.713 32.151 796 2HB LYS 101 HB1 LYS 101 0.665 -21.183 33.635 797 1HG LYS 101 HG2 LYS 101 -0.746 -23.166 33.798 798 2HG LYS 101 HG1 LYS 101 -1.583 -22.706 32.322 799 1HD LYS 101 HD2 LYS 101 0.541 -22.891 31.090 800 2HD LYS 101 HD1 LYS 101 1.346 -23.391 32.581 801 1HE LYS 101 HE2 LYS 101 0.805 -25.329 31.220 802 2HE LYS 101 HE1 LYS 101 -0.135 -25.344 32.709 803 1HZ LYS 101 HZ1 LYS 101 -1.116 -24.517 30.021 804 2HZ LYS 101 HZ2 LYS 101 -2.031 -24.426 31.411 805 3HZ LYS 101 HZ3 LYS 101 -1.548 -25.923 30.833 Start of MODEL 18 1 H GLU 1 HT1 GLU 1 2.044 -14.656 1.762 2 HA GLU 1 HA GLU 1 0.123 -12.960 3.205 3 1HB GLU 1 HB2 GLU 1 3.108 -13.359 3.652 4 2HB GLU 1 HB1 GLU 1 2.164 -12.092 4.393 5 1HG GLU 1 HG2 GLU 1 2.533 -13.853 5.997 6 2HG GLU 1 HG1 GLU 1 0.828 -13.810 5.573 7 H ALA 2 HN ALA 2 0.682 -10.616 2.961 8 HA ALA 2 HA ALA 2 2.007 -10.144 0.400 9 1HB ALA 2 HB1 ALA 2 0.300 -8.492 -0.153 10 2HB ALA 2 HB2 ALA 2 -0.550 -8.859 1.344 11 3HB ALA 2 HB3 ALA 2 -0.416 -10.085 0.085 12 H GLU 3 HN GLU 3 3.600 -8.735 0.554 13 HA GLU 3 HA GLU 3 3.388 -6.403 2.026 14 1HB GLU 3 HB2 GLU 3 5.498 -6.719 3.372 15 2HB GLU 3 HB1 GLU 3 4.163 -7.711 3.911 16 1HG GLU 3 HG2 GLU 3 6.441 -8.698 2.193 17 2HG GLU 3 HG1 GLU 3 6.394 -8.824 3.948 18 H VAL 4 HN VAL 4 5.434 -5.051 1.622 19 HA VAL 4 HA VAL 4 5.928 -5.403 -1.206 20 HB VAL 4 HB VAL 4 5.301 -3.228 -0.278 21 1HG1 VAL 4 HG11 VAL 4 8.042 -3.226 0.940 22 2HG1 VAL 4 HG12 VAL 4 6.494 -3.167 1.790 23 3HG1 VAL 4 HG13 VAL 4 7.016 -1.803 0.801 24 1HG2 VAL 4 HG21 VAL 4 6.902 -1.842 -1.557 25 2HG2 VAL 4 HG22 VAL 4 6.309 -3.246 -2.435 26 3HG2 VAL 4 HG23 VAL 4 7.928 -3.267 -1.736 27 H HIS 5 HN HIS 5 7.973 -5.338 -2.151 28 HA HIS 5 HA HIS 5 9.962 -6.818 -0.551 29 1HB HIS 5 HB2 HIS 5 9.044 -7.898 -2.632 30 2HB HIS 5 HB1 HIS 5 9.782 -6.615 -3.576 31 HD1 HIS 5 HD1 HIS 5 11.918 -7.404 -4.635 32 HD2 HIS 5 HD2 HIS 5 11.231 -9.231 -0.971 33 HE1 HIS 5 HE1 HIS 5 13.825 -8.968 -4.295 34 HE2 HIS 5 HE2 HIS 5 13.169 -10.290 -2.292 35 H ASN 6 HN ASN 6 9.499 -3.756 -1.110 36 HA ASN 6 HA ASN 6 12.216 -3.059 -1.868 37 1HB ASN 6 HB2 ASN 6 9.919 -1.261 -1.039 38 2HB ASN 6 HB1 ASN 6 11.533 -0.660 -1.388 39 1HD2 ASN 6 HD21 ASN 6 8.575 -1.820 -2.707 40 2HD2 ASN 6 HD22 ASN 6 8.969 -1.572 -4.355 41 H GLN 7 HN GLN 7 10.592 -3.945 0.855 42 HA GLN 7 HA GLN 7 12.471 -2.704 2.670 43 1HB GLN 7 HB2 GLN 7 10.092 -4.517 3.111 44 2HB GLN 7 HB1 GLN 7 11.028 -3.758 4.395 45 1HG GLN 7 HG2 GLN 7 10.315 -1.568 3.632 46 2HG GLN 7 HG1 GLN 7 9.437 -2.295 2.292 47 1HE2 GLN 7 HE21 GLN 7 8.432 -0.583 4.379 48 2HE2 GLN 7 HE22 GLN 7 7.214 -1.481 5.198 49 H LEU 8 HN LEU 8 13.487 -4.414 4.258 50 HA LEU 8 HA LEU 8 14.253 -6.632 2.547 51 1HB LEU 8 HB2 LEU 8 15.736 -5.406 4.841 52 2HB LEU 8 HB1 LEU 8 16.235 -6.844 3.988 53 HG LEU 8 HG LEU 8 16.243 -5.378 1.881 54 1HD1 LEU 8 HD11 LEU 8 16.672 -3.007 2.216 55 2HD1 LEU 8 HD12 LEU 8 16.296 -3.184 3.928 56 3HD1 LEU 8 HD13 LEU 8 15.046 -3.473 2.717 57 1HD2 LEU 8 HD21 LEU 8 18.249 -6.241 2.901 58 2HD2 LEU 8 HD22 LEU 8 18.258 -4.895 4.045 59 3HD2 LEU 8 HD23 LEU 8 18.503 -4.593 2.326 60 H GLU 9 HN GLU 9 14.236 -8.734 3.203 61 HA GLU 9 HA GLU 9 12.415 -9.150 5.394 62 1HB GLU 9 HB2 GLU 9 13.512 -11.124 3.407 63 2HB GLU 9 HB1 GLU 9 12.431 -11.492 4.716 64 1HG GLU 9 HG2 GLU 9 11.145 -11.396 2.704 65 2HG GLU 9 HG1 GLU 9 10.727 -10.005 3.692 66 H ILE 10 HN ILE 10 12.822 -10.038 7.162 67 HA ILE 10 HA ILE 10 15.500 -11.124 7.730 68 HB ILE 10 HB ILE 10 13.727 -9.555 9.662 69 1HG1 ILE 10 HG12 ILE 10 16.268 -8.671 8.207 70 2HG1 ILE 10 HG11 ILE 10 14.655 -8.076 7.935 71 1HG2 ILE 10 HG21 ILE 10 15.056 -11.224 10.769 72 2HG2 ILE 10 HG22 ILE 10 15.656 -9.603 11.139 73 3HG2 ILE 10 HG23 ILE 10 16.516 -10.620 9.982 74 1HD1 ILE 10 HD11 ILE 10 15.999 -6.537 9.252 75 2HD1 ILE 10 HD12 ILE 10 16.175 -7.774 10.504 76 3HD1 ILE 10 HD13 ILE 10 14.583 -7.112 10.133 77 H LYS 11 HN LYS 11 15.478 -13.038 8.809 78 HA LYS 11 HA LYS 11 12.854 -13.983 9.642 79 1HB LYS 11 HB2 LYS 11 13.640 -16.338 9.376 80 2HB LYS 11 HB1 LYS 11 13.512 -15.441 7.875 81 1HG LYS 11 HG2 LYS 11 15.833 -15.318 7.626 82 2HG LYS 11 HG1 LYS 11 16.122 -15.738 9.310 83 1HD LYS 11 HD2 LYS 11 16.643 -17.588 7.694 84 2HD LYS 11 HD1 LYS 11 15.478 -18.028 8.930 85 1HE LYS 11 HE2 LYS 11 14.675 -17.144 6.160 86 2HE LYS 11 HE1 LYS 11 15.017 -18.827 6.538 87 1HZ LYS 11 HZ1 LYS 11 12.647 -18.339 6.635 88 2HZ LYS 11 HZ2 LYS 11 12.859 -17.192 7.844 89 3HZ LYS 11 HZ3 LYS 11 13.176 -18.799 8.149 90 H PHE 12 HN PHE 12 12.736 -15.086 11.613 91 HA PHE 12 HA PHE 12 14.958 -14.466 13.405 92 1HB PHE 12 HB2 PHE 12 12.074 -15.088 14.003 93 2HB PHE 12 HB1 PHE 12 13.293 -14.667 15.192 94 HD1 PHE 12 HD1 PHE 12 14.340 -12.367 15.063 95 HD2 PHE 12 HD2 PHE 12 10.858 -13.442 12.870 96 HE1 PHE 12 HE1 PHE 12 13.789 -9.998 14.791 97 HE2 PHE 12 HE2 PHE 12 10.297 -11.068 12.588 98 HZ PHE 12 HZ PHE 12 11.767 -9.338 13.552 99 H ARG 13 HN ARG 13 16.149 -16.084 14.146 100 HA ARG 13 HA ARG 13 15.188 -18.854 13.950 101 1HB ARG 13 HB2 ARG 13 17.899 -17.756 14.731 102 2HB ARG 13 HB1 ARG 13 17.498 -19.446 14.522 103 1HG ARG 13 HG2 ARG 13 17.560 -17.346 12.360 104 2HG ARG 13 HG1 ARG 13 18.773 -18.585 12.692 105 1HD ARG 13 HD2 ARG 13 15.928 -19.076 11.839 106 2HD ARG 13 HD1 ARG 13 17.340 -19.202 10.802 107 HE ARG 13 HE ARG 13 17.504 -20.874 13.129 108 1HH1 ARG 13 HH11 ARG 13 16.389 -20.761 9.764 109 2HH1 ARG 13 HH12 ARG 13 16.198 -22.443 9.617 110 1HH2 ARG 13 HH21 ARG 13 17.258 -23.205 12.908 111 2HH2 ARG 13 HH22 ARG 13 16.709 -23.849 11.452 112 H LEU 14 HN LEU 14 14.263 -19.672 15.759 113 HA LEU 14 HA LEU 14 14.542 -18.290 18.269 114 1HB LEU 14 HB2 LEU 14 13.051 -20.782 17.483 115 2HB LEU 14 HB1 LEU 14 12.997 -20.119 19.086 116 HG LEU 14 HG LEU 14 11.020 -19.515 18.101 117 1HD1 LEU 14 HD11 LEU 14 11.027 -17.077 17.836 118 2HD1 LEU 14 HD12 LEU 14 12.787 -17.106 17.834 119 3HD1 LEU 14 HD13 LEU 14 11.890 -17.649 19.255 120 1HD2 LEU 14 HD21 LEU 14 10.716 -18.470 15.944 121 2HD2 LEU 14 HD22 LEU 14 11.481 -20.054 15.799 122 3HD2 LEU 14 HD23 LEU 14 12.447 -18.580 15.624 123 H THR 15 HN THR 15 15.013 -19.610 20.282 124 HA THR 15 HA THR 15 17.561 -20.810 20.016 125 HB THR 15 HB THR 15 17.242 -21.300 22.478 126 HG1 THR 15 HG1 THR 15 15.415 -20.849 23.417 127 1HG2 THR 15 HG21 THR 15 16.787 -18.469 21.557 128 2HG2 THR 15 HG22 THR 15 18.361 -19.251 21.704 129 3HG2 THR 15 HG23 THR 15 17.395 -18.927 23.146 130 H ASP 16 HN ASP 16 14.459 -21.948 19.838 131 HA ASP 16 HA ASP 16 14.829 -24.680 20.652 132 1HB ASP 16 HB2 ASP 16 12.651 -23.606 20.778 133 2HB ASP 16 HB1 ASP 16 12.664 -23.303 19.052 134 H GLY 17 HN GLY 17 15.745 -22.933 17.940 135 1HA GLY 17 HA2 GLY 17 17.028 -23.751 16.178 136 2HA GLY 17 HA1 GLY 17 16.449 -25.374 16.527 137 H SER 18 HN SER 18 13.839 -23.380 16.542 138 HA SER 18 HA SER 18 13.182 -24.056 13.805 139 1HB SER 18 HB2 SER 18 10.841 -23.388 14.721 140 2HB SER 18 HB1 SER 18 11.542 -24.902 15.300 141 HG SER 18 HG SER 18 11.597 -24.125 17.224 142 H ASP 19 HN ASP 19 12.198 -22.251 12.439 143 HA ASP 19 HA ASP 19 12.995 -19.693 13.527 144 1HB ASP 19 HB2 ASP 19 13.772 -18.999 11.456 145 2HB ASP 19 HB1 ASP 19 14.553 -20.548 11.776 146 H ILE 20 HN ILE 20 12.023 -17.939 12.302 147 HA ILE 20 HA ILE 20 9.177 -18.479 11.808 148 HB ILE 20 HB ILE 20 10.547 -15.831 12.445 149 1HG1 ILE 20 HG12 ILE 20 8.860 -17.614 14.221 150 2HG1 ILE 20 HG11 ILE 20 10.592 -17.330 14.352 151 1HG2 ILE 20 HG21 ILE 20 7.605 -16.503 12.254 152 2HG2 ILE 20 HG22 ILE 20 8.528 -15.528 11.110 153 3HG2 ILE 20 HG23 ILE 20 8.270 -14.947 12.755 154 1HD1 ILE 20 HD11 ILE 20 10.174 -14.990 14.922 155 2HD1 ILE 20 HD12 ILE 20 9.330 -16.073 16.028 156 3HD1 ILE 20 HD13 ILE 20 8.441 -15.257 14.747 157 H GLY 21 HN GLY 21 8.297 -17.886 9.871 158 1HA GLY 21 HA2 GLY 21 9.840 -17.722 7.576 159 2HA GLY 21 HA1 GLY 21 8.159 -17.208 7.684 160 HA PRO 22 HA PRO 22 11.559 -13.722 7.626 161 1HB PRO 22 HB2 PRO 22 11.444 -13.064 4.998 162 2HB PRO 22 HB1 PRO 22 12.693 -14.100 5.698 163 1HG PRO 22 HG2 PRO 22 10.197 -14.868 4.220 164 2HG PRO 22 HG1 PRO 22 11.815 -15.584 4.110 165 1HD PRO 22 HD2 PRO 22 9.881 -16.773 5.521 166 2HD PRO 22 HD1 PRO 22 11.564 -16.759 6.094 167 H LYS 23 HN LYS 23 10.990 -11.699 7.811 168 HA LYS 23 HA LYS 23 8.240 -10.869 7.093 169 1HB LYS 23 HB2 LYS 23 8.794 -11.363 9.551 170 2HB LYS 23 HB1 LYS 23 9.932 -10.044 9.475 171 1HG LYS 23 HG2 LYS 23 8.005 -9.202 10.518 172 2HG LYS 23 HG1 LYS 23 7.965 -8.563 8.873 173 1HD LYS 23 HD2 LYS 23 6.417 -10.294 8.217 174 2HD LYS 23 HD1 LYS 23 6.493 -11.012 9.824 175 1HE LYS 23 HE2 LYS 23 5.596 -8.901 10.758 176 2HE LYS 23 HE1 LYS 23 5.418 -8.284 9.115 177 1HZ LYS 23 HZ1 LYS 23 3.915 -10.148 8.654 178 2HZ LYS 23 HZ2 LYS 23 3.332 -9.181 9.888 179 3HZ LYS 23 HZ3 LYS 23 4.037 -10.667 10.256 180 H ALA 24 HN ALA 24 8.203 -8.546 6.429 181 HA ALA 24 HA ALA 24 10.806 -7.745 5.387 182 1HB ALA 24 HB1 ALA 24 9.579 -6.247 3.923 183 2HB ALA 24 HB2 ALA 24 8.072 -6.621 4.756 184 3HB ALA 24 HB3 ALA 24 8.900 -7.871 3.827 185 H PHE 25 HN PHE 25 11.976 -6.153 6.232 186 HA PHE 25 HA PHE 25 10.683 -4.179 7.994 187 1HB PHE 25 HB2 PHE 25 13.429 -5.377 8.353 188 2HB PHE 25 HB1 PHE 25 12.655 -4.201 9.389 189 HD1 PHE 25 HD1 PHE 25 12.604 -7.656 8.245 190 HD2 PHE 25 HD2 PHE 25 11.182 -4.908 11.137 191 HE1 PHE 25 HE1 PHE 25 11.824 -9.514 9.600 192 HE2 PHE 25 HE2 PHE 25 10.384 -6.793 12.514 193 HZ PHE 25 HZ PHE 25 10.761 -9.144 11.676 194 HA PRO 26 HA PRO 26 12.859 -1.330 5.224 195 1HB PRO 26 HB2 PRO 26 12.102 0.468 7.457 196 2HB PRO 26 HB1 PRO 26 11.868 0.718 5.737 197 1HG PRO 26 HG2 PRO 26 9.820 0.061 7.289 198 2HG PRO 26 HG1 PRO 26 9.982 -0.677 5.686 199 1HD PRO 26 HD2 PRO 26 10.607 -1.840 8.370 200 2HD PRO 26 HD1 PRO 26 9.855 -2.598 6.944 201 H ASP 27 HN ASP 27 14.838 -0.260 5.368 202 HA ASP 27 HA ASP 27 16.888 -0.941 7.089 203 1HB ASP 27 HB2 ASP 27 16.480 1.590 5.517 204 2HB ASP 27 HB1 ASP 27 17.979 1.243 6.345 205 H ALA 28 HN ALA 28 14.591 1.688 7.437 206 HA ALA 28 HA ALA 28 16.016 2.925 9.615 207 1HB ALA 28 HB1 ALA 28 13.288 3.586 8.528 208 2HB ALA 28 HB2 ALA 28 14.812 4.275 7.967 209 3HB ALA 28 HB3 ALA 28 14.259 4.583 9.613 210 H THR 29 HN THR 29 13.936 0.296 9.503 211 HA THR 29 HA THR 29 12.384 0.718 11.797 212 HB THR 29 HB THR 29 13.376 -1.832 10.507 213 HG1 THR 29 HG1 THR 29 10.767 -1.019 10.201 214 1HG2 THR 29 HG21 THR 29 11.060 -1.381 12.403 215 2HG2 THR 29 HG22 THR 29 12.547 -2.249 12.787 216 3HG2 THR 29 HG23 THR 29 11.434 -2.892 11.579 217 H THR 30 HN THR 30 12.772 0.372 13.955 218 HA THR 30 HA THR 30 15.514 0.229 14.777 219 HB THR 30 HB THR 30 14.561 0.638 17.032 220 HG1 THR 30 HG1 THR 30 12.114 1.367 16.557 221 1HG2 THR 30 HG21 THR 30 13.577 2.507 14.863 222 2HG2 THR 30 HG22 THR 30 15.181 2.532 15.596 223 3HG2 THR 30 HG23 THR 30 13.762 2.927 16.565 224 H VAL 31 HN VAL 31 16.229 -1.172 16.453 225 HA VAL 31 HA VAL 31 15.638 -3.913 16.114 226 HB VAL 31 HB VAL 31 17.063 -2.516 18.390 227 1HG1 VAL 31 HG11 VAL 31 17.125 -5.421 17.552 228 2HG1 VAL 31 HG12 VAL 31 16.347 -4.787 18.999 229 3HG1 VAL 31 HG13 VAL 31 18.100 -4.702 18.836 230 1HG2 VAL 31 HG21 VAL 31 18.043 -2.087 16.196 231 2HG2 VAL 31 HG22 VAL 31 18.173 -3.825 15.908 232 3HG2 VAL 31 HG23 VAL 31 19.103 -3.061 17.204 233 H SER 32 HN SER 32 14.464 -1.491 18.309 234 HA SER 32 HA SER 32 13.084 -3.147 20.087 235 1HB SER 32 HB2 SER 32 13.444 -0.693 20.428 236 2HB SER 32 HB1 SER 32 12.316 -0.378 19.121 237 HG SER 32 HG SER 32 11.124 -0.231 20.868 238 H ALA 33 HN ALA 33 12.208 -1.752 16.936 239 HA ALA 33 HA ALA 33 9.572 -2.711 16.905 240 1HB ALA 33 HB1 ALA 33 11.327 -1.956 14.579 241 2HB ALA 33 HB2 ALA 33 10.338 -0.842 15.520 242 3HB ALA 33 HB3 ALA 33 9.570 -2.099 14.551 243 H LEU 34 HN LEU 34 12.650 -4.155 15.892 244 HA LEU 34 HA LEU 34 11.706 -6.456 14.615 245 1HB LEU 34 HB2 LEU 34 14.078 -5.951 16.385 246 2HB LEU 34 HB1 LEU 34 13.710 -7.581 15.911 247 HG LEU 34 HG LEU 34 15.496 -6.550 14.624 248 1HD1 LEU 34 HD11 LEU 34 13.017 -7.186 13.012 249 2HD1 LEU 34 HD12 LEU 34 14.211 -8.341 13.613 250 3HD1 LEU 34 HD13 LEU 34 14.661 -7.172 12.378 251 1HD2 LEU 34 HD21 LEU 34 14.707 -4.219 14.522 252 2HD2 LEU 34 HD22 LEU 34 13.356 -4.733 13.524 253 3HD2 LEU 34 HD23 LEU 34 14.999 -4.869 12.911 254 H LYS 35 HN LYS 35 12.258 -5.841 18.037 255 HA LYS 35 HA LYS 35 11.270 -8.324 18.889 256 1HB LYS 35 HB2 LYS 35 11.654 -5.749 20.394 257 2HB LYS 35 HB1 LYS 35 11.251 -7.287 21.146 258 1HG LYS 35 HG2 LYS 35 13.286 -8.271 20.313 259 2HG LYS 35 HG1 LYS 35 13.707 -6.766 19.492 260 1HD LYS 35 HD2 LYS 35 13.815 -5.645 21.666 261 2HD LYS 35 HD1 LYS 35 13.394 -7.163 22.464 262 1HE LYS 35 HE2 LYS 35 15.414 -8.195 21.551 263 2HE LYS 35 HE1 LYS 35 15.840 -6.665 20.782 264 1HZ LYS 35 HZ1 LYS 35 15.561 -7.117 23.702 265 2HZ LYS 35 HZ2 LYS 35 15.947 -5.649 22.945 266 3HZ LYS 35 HZ3 LYS 35 17.015 -6.934 22.860 267 H GLU 36 HN GLU 36 9.721 -5.134 18.597 268 HA GLU 36 HA GLU 36 7.219 -5.757 19.634 269 1HB GLU 36 HB2 GLU 36 7.871 -4.027 17.238 270 2HB GLU 36 HB1 GLU 36 6.348 -4.022 18.102 271 1HG GLU 36 HG2 GLU 36 9.015 -3.229 19.253 272 2HG GLU 36 HG1 GLU 36 7.774 -2.119 18.681 273 H THR 37 HN THR 37 8.573 -6.293 16.433 274 HA THR 37 HA THR 37 6.310 -7.437 15.235 275 HB THR 37 HB THR 37 9.245 -7.902 14.626 276 HG1 THR 37 HG1 THR 37 8.651 -5.728 14.393 277 1HG2 THR 37 HG21 THR 37 7.808 -9.644 13.638 278 2HG2 THR 37 HG22 THR 37 8.485 -8.583 12.403 279 3HG2 THR 37 HG23 THR 37 6.802 -8.391 12.904 280 H VAL 38 HN VAL 38 9.059 -8.913 16.963 281 HA VAL 38 HA VAL 38 8.350 -11.594 16.602 282 HB VAL 38 HB VAL 38 9.772 -10.358 18.991 283 1HG1 VAL 38 HG11 VAL 38 8.948 -12.590 19.522 284 2HG1 VAL 38 HG12 VAL 38 10.705 -12.598 19.369 285 3HG1 VAL 38 HG13 VAL 38 9.705 -13.233 18.063 286 1HG2 VAL 38 HG21 VAL 38 10.929 -9.902 16.897 287 2HG2 VAL 38 HG22 VAL 38 10.895 -11.616 16.487 288 3HG2 VAL 38 HG23 VAL 38 11.837 -11.059 17.868 289 H ILE 39 HN ILE 39 7.557 -9.337 19.168 290 HA ILE 39 HA ILE 39 6.053 -11.071 20.808 291 HB ILE 39 HB ILE 39 5.642 -8.064 20.485 292 1HG1 ILE 39 HG12 ILE 39 7.433 -9.517 22.436 293 2HG1 ILE 39 HG11 ILE 39 8.003 -8.716 20.975 294 1HG2 ILE 39 HG21 ILE 39 4.856 -8.162 22.833 295 2HG2 ILE 39 HG22 ILE 39 5.041 -9.903 22.820 296 3HG2 ILE 39 HG23 ILE 39 3.835 -9.145 21.774 297 1HD1 ILE 39 HD11 ILE 39 6.612 -7.395 23.287 298 2HD1 ILE 39 HD12 ILE 39 7.191 -6.584 21.832 299 3HD1 ILE 39 HD13 ILE 39 8.340 -7.335 22.945 300 H SER 40 HN SER 40 5.125 -9.102 18.022 301 HA SER 40 HA SER 40 2.316 -9.547 18.317 302 1HB SER 40 HB2 SER 40 3.858 -8.556 15.922 303 2HB SER 40 HB1 SER 40 2.121 -8.396 16.194 304 HG SER 40 HG SER 40 4.264 -7.066 17.369 305 H GLU 41 HN GLU 41 4.875 -11.062 16.240 306 HA GLU 41 HA GLU 41 2.987 -12.514 14.729 307 1HB GLU 41 HB2 GLU 41 5.970 -12.792 14.972 308 2HB GLU 41 HB1 GLU 41 4.946 -13.510 13.748 309 1HG GLU 41 HG2 GLU 41 5.487 -10.579 14.150 310 2HG GLU 41 HG1 GLU 41 6.063 -11.591 12.829 311 H TRP 42 HN TRP 42 4.857 -13.054 17.580 312 HA TRP 42 HA TRP 42 4.671 -15.889 17.625 313 1HB TRP 42 HB2 TRP 42 6.357 -14.348 18.791 314 2HB TRP 42 HB1 TRP 42 5.088 -13.952 19.926 315 HD1 TRP 42 HD1 TRP 42 4.741 -15.596 21.910 316 HE1 TRP 42 HE1 TRP 42 5.971 -17.700 22.702 317 HE3 TRP 42 HE3 TRP 42 7.563 -16.487 17.770 318 HZ2 TRP 42 HZ2 TRP 42 7.870 -19.550 21.684 319 HZ3 TRP 42 HZ3 TRP 42 9.082 -18.461 17.777 320 HH2 TRP 42 HH2 TRP 42 9.206 -19.937 19.683 321 HA PRO 43 HA PRO 43 0.457 -16.817 18.813 322 1HB PRO 43 HB2 PRO 43 1.747 -17.786 21.334 323 2HB PRO 43 HB1 PRO 43 0.422 -18.518 20.423 324 1HG PRO 43 HG2 PRO 43 2.890 -19.416 20.088 325 2HG PRO 43 HG1 PRO 43 1.825 -19.208 18.689 326 1HD PRO 43 HD2 PRO 43 4.185 -17.612 19.504 327 2HD PRO 43 HD1 PRO 43 3.479 -17.842 17.893 328 H ARG 44 HN ARG 44 -1.233 -15.797 19.802 329 HA ARG 44 HA ARG 44 -0.742 -13.465 21.388 330 1HB ARG 44 HB2 ARG 44 -3.352 -14.896 20.811 331 2HB ARG 44 HB1 ARG 44 -3.242 -13.447 21.760 332 1HG ARG 44 HG2 ARG 44 -4.051 -12.846 19.611 333 2HG ARG 44 HG1 ARG 44 -2.407 -12.259 19.717 334 1HD ARG 44 HD2 ARG 44 -3.098 -14.869 18.374 335 2HD ARG 44 HD1 ARG 44 -3.199 -13.341 17.523 336 HE ARG 44 HE ARG 44 -0.672 -13.631 18.719 337 1HH1 ARG 44 HH11 ARG 44 -2.595 -14.897 16.025 338 2HH1 ARG 44 HH12 ARG 44 -1.249 -15.195 15.019 339 1HH2 ARG 44 HH21 ARG 44 1.171 -14.061 17.322 340 2HH2 ARG 44 HH22 ARG 44 0.920 -14.703 15.763 341 H GLU 45 HN GLU 45 -1.609 -16.709 22.044 342 HA GLU 45 HA GLU 45 -2.342 -16.341 24.832 343 1HB GLU 45 HB2 GLU 45 -3.418 -17.998 23.301 344 2HB GLU 45 HB1 GLU 45 -1.895 -18.857 23.213 345 1HG GLU 45 HG2 GLU 45 -2.064 -19.242 25.673 346 2HG GLU 45 HG1 GLU 45 -3.671 -18.522 25.617 347 H LYS 46 HN LYS 46 0.631 -16.159 23.416 348 HA LYS 46 HA LYS 46 2.210 -18.132 23.941 349 1HB LYS 46 HB2 LYS 46 4.019 -16.750 23.717 350 2HB LYS 46 HB1 LYS 46 2.739 -16.082 22.775 351 1HG LYS 46 HG2 LYS 46 3.671 -14.964 25.432 352 2HG LYS 46 HG1 LYS 46 4.177 -14.386 23.862 353 1HD LYS 46 HD2 LYS 46 2.578 -12.827 24.417 354 2HD LYS 46 HD1 LYS 46 1.584 -13.995 23.555 355 1HE LYS 46 HE2 LYS 46 0.851 -14.954 25.652 356 2HE LYS 46 HE1 LYS 46 1.922 -13.878 26.549 357 1HZ LYS 46 HZ1 LYS 46 -0.311 -13.003 26.569 358 2HZ LYS 46 HZ2 LYS 46 -0.407 -13.116 24.902 359 3HZ LYS 46 HZ3 LYS 46 0.652 -11.992 25.597 360 H GLU 47 HN GLU 47 3.529 -18.991 25.279 361 HA GLU 47 HA GLU 47 2.876 -19.089 28.036 362 1HB GLU 47 HB2 GLU 47 4.466 -20.933 28.026 363 2HB GLU 47 HB1 GLU 47 3.341 -21.062 26.682 364 1HG GLU 47 HG2 GLU 47 5.095 -20.050 25.213 365 2HG GLU 47 HG1 GLU 47 6.190 -20.120 26.579 366 H ASN 48 HN ASN 48 5.220 -19.695 29.191 367 HA ASN 48 HA ASN 48 6.385 -17.323 29.984 368 1HB ASN 48 HB2 ASN 48 7.248 -20.171 30.414 369 2HB ASN 48 HB1 ASN 48 8.162 -18.831 31.081 370 1HD2 ASN 48 HD21 ASN 48 7.764 -19.561 33.164 371 2HD2 ASN 48 HD22 ASN 48 6.218 -19.383 33.912 372 H GLY 49 HN GLY 49 6.781 -18.199 27.116 373 1HA GLY 49 HA2 GLY 49 9.708 -18.020 26.819 374 2HA GLY 49 HA1 GLY 49 8.560 -18.423 25.554 375 HA PRO 50 HA PRO 50 9.426 -14.071 24.395 376 1HB PRO 50 HB2 PRO 50 7.729 -15.226 22.238 377 2HB PRO 50 HB1 PRO 50 9.106 -14.166 22.045 378 1HG PRO 50 HG2 PRO 50 9.417 -16.678 21.530 379 2HG PRO 50 HG1 PRO 50 10.611 -15.878 22.579 380 1HD PRO 50 HD2 PRO 50 8.334 -17.682 23.353 381 2HD PRO 50 HD1 PRO 50 10.010 -17.682 23.950 382 H LYS 51 HN LYS 51 8.024 -13.140 25.904 383 HA LYS 51 HA LYS 51 5.277 -13.065 24.990 384 1HB LYS 51 HB2 LYS 51 4.590 -12.630 27.401 385 2HB LYS 51 HB1 LYS 51 5.080 -14.254 26.975 386 1HG LYS 51 HG2 LYS 51 7.302 -13.794 27.980 387 2HG LYS 51 HG1 LYS 51 6.697 -12.214 28.494 388 1HD LYS 51 HD2 LYS 51 4.967 -13.251 29.809 389 2HD LYS 51 HD1 LYS 51 5.419 -14.840 29.199 390 1HE LYS 51 HE2 LYS 51 6.267 -14.515 31.477 391 2HE LYS 51 HE1 LYS 51 7.596 -14.661 30.331 392 1HZ LYS 51 HZ1 LYS 51 7.915 -12.878 31.984 393 2HZ LYS 51 HZ2 LYS 51 6.570 -12.075 31.383 394 3HZ LYS 51 HZ3 LYS 51 7.926 -12.287 30.423 395 H THR 52 HN THR 52 7.726 -11.109 26.662 396 HA THR 52 HA THR 52 6.646 -8.934 25.161 397 HB THR 52 HB THR 52 7.138 -7.394 27.039 398 HG1 THR 52 HG1 THR 52 8.047 -9.628 28.224 399 1HG2 THR 52 HG21 THR 52 5.064 -7.849 28.301 400 2HG2 THR 52 HG22 THR 52 4.988 -9.441 27.544 401 3HG2 THR 52 HG23 THR 52 4.849 -7.986 26.557 402 H VAL 53 HN VAL 53 8.296 -7.035 25.416 403 HA VAL 53 HA VAL 53 10.589 -7.779 24.005 404 HB VAL 53 HB VAL 53 9.591 -5.550 23.801 405 1HG1 VAL 53 HG11 VAL 53 10.645 -5.017 26.577 406 2HG1 VAL 53 HG12 VAL 53 8.953 -5.140 26.118 407 3HG1 VAL 53 HG13 VAL 53 9.936 -3.808 25.507 408 1HG2 VAL 53 HG21 VAL 53 12.455 -5.452 24.747 409 2HG2 VAL 53 HG22 VAL 53 11.652 -4.187 23.822 410 3HG2 VAL 53 HG23 VAL 53 11.893 -5.781 23.107 411 H LYS 54 HN LYS 54 9.965 -7.569 27.346 412 HA LYS 54 HA LYS 54 12.605 -7.110 28.259 413 1HB LYS 54 HB2 LYS 54 10.223 -8.183 29.758 414 2HB LYS 54 HB1 LYS 54 11.721 -7.613 30.479 415 1HG LYS 54 HG2 LYS 54 9.794 -5.933 28.878 416 2HG LYS 54 HG1 LYS 54 9.956 -5.934 30.634 417 1HD LYS 54 HD2 LYS 54 12.245 -5.115 30.440 418 2HD LYS 54 HD1 LYS 54 12.139 -5.174 28.681 419 1HE LYS 54 HE2 LYS 54 11.829 -2.899 29.472 420 2HE LYS 54 HE1 LYS 54 10.349 -3.501 28.732 421 1HZ LYS 54 HZ1 LYS 54 9.854 -2.319 30.758 422 2HZ LYS 54 HZ2 LYS 54 10.904 -3.280 31.646 423 3HZ LYS 54 HZ3 LYS 54 9.503 -3.943 30.997 424 H GLU 55 HN GLU 55 11.040 -9.962 27.152 425 HA GLU 55 HA GLU 55 13.436 -11.311 28.100 426 1HB GLU 55 HB2 GLU 55 12.218 -13.506 28.284 427 2HB GLU 55 HB1 GLU 55 11.918 -12.315 29.526 428 1HG GLU 55 HG2 GLU 55 10.097 -12.808 27.201 429 2HG GLU 55 HG1 GLU 55 10.022 -13.628 28.778 430 H VAL 56 HN VAL 56 12.732 -10.135 25.528 431 HA VAL 56 HA VAL 56 13.613 -12.460 23.987 432 HB VAL 56 HB VAL 56 11.379 -11.848 23.194 433 1HG1 VAL 56 HG11 VAL 56 12.472 -9.098 22.691 434 2HG1 VAL 56 HG12 VAL 56 11.300 -9.577 23.923 435 3HG1 VAL 56 HG13 VAL 56 10.870 -9.679 22.214 436 1HG2 VAL 56 HG21 VAL 56 12.907 -12.625 21.517 437 2HG2 VAL 56 HG22 VAL 56 13.510 -10.988 21.254 438 3HG2 VAL 56 HG23 VAL 56 11.849 -11.397 20.819 439 H LYS 57 HN LYS 57 15.613 -12.325 23.270 440 HA LYS 57 HA LYS 57 16.830 -9.649 23.024 441 1HB LYS 57 HB2 LYS 57 17.716 -10.987 24.891 442 2HB LYS 57 HB1 LYS 57 18.150 -12.279 23.797 443 1HG LYS 57 HG2 LYS 57 19.769 -10.773 22.696 444 2HG LYS 57 HG1 LYS 57 19.329 -9.502 23.838 445 1HD LYS 57 HD2 LYS 57 20.506 -12.189 24.575 446 2HD LYS 57 HD1 LYS 57 21.401 -10.671 24.504 447 1HE LYS 57 HE2 LYS 57 19.986 -9.761 26.305 448 2HE LYS 57 HE1 LYS 57 19.068 -11.262 26.352 449 1HZ LYS 57 HZ1 LYS 57 20.724 -11.192 28.108 450 2HZ LYS 57 HZ2 LYS 57 21.963 -10.999 26.995 451 3HZ LYS 57 HZ3 LYS 57 21.076 -12.426 27.027 452 H LEU 58 HN LEU 58 18.201 -9.253 21.146 453 HA LEU 58 HA LEU 58 17.688 -11.193 19.008 454 1HB LEU 58 HB2 LEU 58 16.256 -9.078 19.037 455 2HB LEU 58 HB1 LEU 58 17.717 -8.164 18.804 456 HG LEU 58 HG LEU 58 16.441 -8.339 16.699 457 1HD1 LEU 58 HD11 LEU 58 18.942 -9.961 16.552 458 2HD1 LEU 58 HD12 LEU 58 18.829 -8.209 16.560 459 3HD1 LEU 58 HD13 LEU 58 18.132 -9.127 15.218 460 1HD2 LEU 58 HD21 LEU 58 15.292 -10.440 17.167 461 2HD2 LEU 58 HD22 LEU 58 16.812 -11.318 16.990 462 3HD2 LEU 58 HD23 LEU 58 16.107 -10.482 15.608 463 H ILE 59 HN ILE 59 19.538 -11.948 18.131 464 HA ILE 59 HA ILE 59 21.967 -10.246 18.081 465 HB ILE 59 HB ILE 59 21.810 -13.241 18.569 466 1HG1 ILE 59 HG12 ILE 59 22.801 -10.970 20.288 467 2HG1 ILE 59 HG11 ILE 59 21.375 -11.954 20.582 468 1HG2 ILE 59 HG21 ILE 59 24.268 -13.215 18.674 469 2HG2 ILE 59 HG22 ILE 59 24.262 -11.518 18.192 470 3HG2 ILE 59 HG23 ILE 59 23.672 -12.750 17.078 471 1HD1 ILE 59 HD11 ILE 59 22.831 -13.909 20.913 472 2HD1 ILE 59 HD12 ILE 59 23.186 -12.607 22.048 473 3HD1 ILE 59 HD13 ILE 59 24.240 -12.880 20.658 474 H SER 60 HN SER 60 22.898 -9.984 16.206 475 HA SER 60 HA SER 60 22.210 -11.779 13.994 476 1HB SER 60 HB2 SER 60 20.822 -9.633 13.916 477 2HB SER 60 HB1 SER 60 22.340 -8.769 13.774 478 HG SER 60 HG SER 60 22.455 -9.262 11.750 479 H ALA 61 HN ALA 61 23.987 -12.389 12.910 480 HA ALA 61 HA ALA 61 26.118 -12.616 12.226 481 1HB ALA 61 HB1 ALA 61 26.290 -9.623 12.621 482 2HB ALA 61 HB2 ALA 61 25.711 -10.424 11.161 483 3HB ALA 61 HB3 ALA 61 27.395 -10.605 11.656 484 H GLY 62 HN GLY 62 25.414 -12.596 15.101 485 1HA GLY 62 HA2 GLY 62 26.648 -13.321 16.949 486 2HA GLY 62 HA1 GLY 62 28.120 -12.881 16.098 487 H LYS 63 HN LYS 63 25.599 -10.469 16.376 488 HA LYS 63 HA LYS 63 27.051 -9.246 18.605 489 1HB LYS 63 HB2 LYS 63 27.738 -8.199 16.442 490 2HB LYS 63 HB1 LYS 63 26.058 -7.818 16.115 491 1HG LYS 63 HG2 LYS 63 26.014 -6.335 18.069 492 2HG LYS 63 HG1 LYS 63 27.699 -6.737 18.405 493 1HD LYS 63 HD2 LYS 63 28.319 -5.818 16.182 494 2HD LYS 63 HD1 LYS 63 26.641 -5.357 15.938 495 1HE LYS 63 HE2 LYS 63 26.733 -3.888 17.889 496 2HE LYS 63 HE1 LYS 63 28.399 -4.372 18.189 497 1HZ LYS 63 HZ1 LYS 63 29.024 -3.380 16.059 498 2HZ LYS 63 HZ2 LYS 63 28.305 -2.246 17.057 499 3HZ LYS 63 HZ3 LYS 63 27.434 -2.902 15.782 500 H VAL 64 HN VAL 64 25.716 -8.215 20.083 501 HA VAL 64 HA VAL 64 22.911 -8.902 19.915 502 HB VAL 64 HB VAL 64 24.366 -7.348 22.074 503 1HG1 VAL 64 HG11 VAL 64 22.476 -7.992 23.518 504 2HG1 VAL 64 HG12 VAL 64 21.695 -8.747 22.126 505 3HG1 VAL 64 HG13 VAL 64 21.972 -7.005 22.145 506 1HG2 VAL 64 HG21 VAL 64 25.353 -9.572 21.829 507 2HG2 VAL 64 HG22 VAL 64 23.752 -10.304 21.973 508 3HG2 VAL 64 HG23 VAL 64 24.452 -9.447 23.339 509 H LEU 65 HN LEU 65 21.307 -7.527 19.294 510 HA LEU 65 HA LEU 65 22.145 -4.911 18.489 511 1HB LEU 65 HB2 LEU 65 19.686 -6.535 17.958 512 2HB LEU 65 HB1 LEU 65 19.815 -4.855 17.510 513 HG LEU 65 HG LEU 65 21.818 -5.491 16.136 514 1HD1 LEU 65 HD11 LEU 65 20.888 -8.290 16.612 515 2HD1 LEU 65 HD12 LEU 65 22.391 -7.554 17.157 516 3HD1 LEU 65 HD13 LEU 65 22.092 -7.766 15.435 517 1HD2 LEU 65 HD21 LEU 65 19.149 -6.671 15.362 518 2HD2 LEU 65 HD22 LEU 65 20.497 -6.400 14.267 519 3HD2 LEU 65 HD23 LEU 65 19.726 -5.031 15.063 520 H GLU 66 HN GLU 66 22.003 -3.331 19.806 521 HA GLU 66 HA GLU 66 20.302 -3.262 22.090 522 1HB GLU 66 HB2 GLU 66 22.579 -2.129 21.821 523 2HB GLU 66 HB1 GLU 66 21.811 -0.983 20.749 524 1HG GLU 66 HG2 GLU 66 21.014 -1.327 23.643 525 2HG GLU 66 HG1 GLU 66 22.273 -0.228 23.118 526 H ASN 67 HN ASN 67 18.322 -2.428 22.260 527 HA ASN 67 HA ASN 67 16.480 -2.538 20.238 528 1HB ASN 67 HB2 ASN 67 16.236 -0.886 22.739 529 2HB ASN 67 HB1 ASN 67 14.900 -1.328 21.697 530 1HD2 ASN 67 HD21 ASN 67 15.250 -1.857 24.465 531 2HD2 ASN 67 HD22 ASN 67 15.246 -3.560 24.688 532 H SER 68 HN SER 68 18.230 0.345 21.224 533 HA SER 68 HA SER 68 16.496 2.227 19.992 534 1HB SER 68 HB2 SER 68 19.395 2.608 20.664 535 2HB SER 68 HB1 SER 68 18.141 3.843 20.532 536 HG SER 68 HG SER 68 18.593 1.905 22.477 537 H LYS 69 HN LYS 69 18.957 0.295 18.745 538 HA LYS 69 HA LYS 69 19.726 2.040 16.607 539 1HB LYS 69 HB2 LYS 69 20.377 -0.785 17.283 540 2HB LYS 69 HB1 LYS 69 21.033 0.059 15.882 541 1HG LYS 69 HG2 LYS 69 21.411 0.900 18.758 542 2HG LYS 69 HG1 LYS 69 22.595 0.000 17.810 543 1HD LYS 69 HD2 LYS 69 22.690 1.848 16.200 544 2HD LYS 69 HD1 LYS 69 21.537 2.757 17.178 545 1HE LYS 69 HE2 LYS 69 23.123 2.771 19.031 546 2HE LYS 69 HE1 LYS 69 24.268 1.837 18.072 547 1HZ LYS 69 HZ1 LYS 69 23.268 4.544 17.407 548 2HZ LYS 69 HZ2 LYS 69 24.366 3.679 16.486 549 3HZ LYS 69 HZ3 LYS 69 24.786 4.208 18.029 550 H THR 70 HN THR 70 19.710 1.203 14.280 551 HA THR 70 HA THR 70 17.080 0.170 13.686 552 HB THR 70 HB THR 70 17.567 1.195 11.487 553 HG1 THR 70 HG1 THR 70 19.709 2.450 12.853 554 1HG2 THR 70 HG21 THR 70 16.205 2.377 13.144 555 2HG2 THR 70 HG22 THR 70 17.193 3.522 12.231 556 3HG2 THR 70 HG23 THR 70 17.663 3.055 13.865 557 H VAL 71 HN VAL 71 16.972 -1.064 11.620 558 HA VAL 71 HA VAL 71 18.497 -3.410 11.652 559 HB VAL 71 HB VAL 71 16.980 -2.217 9.306 560 1HG1 VAL 71 HG11 VAL 71 16.828 -4.518 8.461 561 2HG1 VAL 71 HG12 VAL 71 17.849 -5.067 9.793 562 3HG1 VAL 71 HG13 VAL 71 18.502 -3.972 8.576 563 1HG2 VAL 71 HG21 VAL 71 15.135 -3.662 10.011 564 2HG2 VAL 71 HG22 VAL 71 15.567 -2.512 11.281 565 3HG2 VAL 71 HG23 VAL 71 16.092 -4.195 11.388 566 H LYS 72 HN LYS 72 18.737 -0.567 9.600 567 HA LYS 72 HA LYS 72 20.717 -1.382 7.833 568 1HB LYS 72 HB2 LYS 72 19.384 0.597 7.493 569 2HB LYS 72 HB1 LYS 72 20.119 1.384 8.878 570 1HG LYS 72 HG2 LYS 72 22.282 1.384 7.723 571 2HG LYS 72 HG1 LYS 72 21.533 0.613 6.325 572 1HD LYS 72 HD2 LYS 72 20.056 2.544 6.052 573 2HD LYS 72 HD1 LYS 72 20.779 3.310 7.463 574 1HE LYS 72 HE2 LYS 72 22.239 2.589 4.913 575 2HE LYS 72 HE1 LYS 72 21.692 4.198 5.364 576 1HZ LYS 72 HZ1 LYS 72 23.707 2.585 6.857 577 2HZ LYS 72 HZ2 LYS 72 23.201 4.149 7.240 578 3HZ LYS 72 HZ3 LYS 72 24.033 3.866 5.816 579 H ASP 73 HN ASP 73 21.060 -0.176 11.098 580 HA ASP 73 HA ASP 73 23.766 0.593 10.942 581 1HB ASP 73 HB2 ASP 73 22.255 1.299 12.771 582 2HB ASP 73 HB1 ASP 73 22.252 -0.346 13.390 583 H TYR 74 HN TYR 74 22.245 -2.523 11.617 584 HA TYR 74 HA TYR 74 24.846 -3.675 12.199 585 1HB TYR 74 HB2 TYR 74 22.065 -4.774 12.451 586 2HB TYR 74 HB1 TYR 74 23.533 -5.655 12.841 587 HD1 TYR 74 HD1 TYR 74 24.712 -5.230 14.893 588 HD2 TYR 74 HD2 TYR 74 21.373 -2.859 13.784 589 HE1 TYR 74 HE1 TYR 74 24.633 -4.278 17.166 590 HE2 TYR 74 HE2 TYR 74 21.281 -1.918 16.015 591 HH TYR 74 HH TYR 74 21.950 -2.363 18.186 592 H ARG 75 HN ARG 75 22.557 -3.365 9.664 593 HA ARG 75 HA ARG 75 23.076 -5.818 8.423 594 1HB ARG 75 HB2 ARG 75 20.965 -4.486 8.260 595 2HB ARG 75 HB1 ARG 75 21.859 -3.287 7.332 596 1HG ARG 75 HG2 ARG 75 22.431 -4.940 5.736 597 2HG ARG 75 HG1 ARG 75 21.522 -6.136 6.677 598 1HD ARG 75 HD2 ARG 75 20.128 -5.446 4.834 599 2HD ARG 75 HD1 ARG 75 19.501 -4.777 6.344 600 HE ARG 75 HE ARG 75 19.992 -2.654 5.620 601 1HH1 ARG 75 HH11 ARG 75 21.490 -4.902 3.320 602 2HH1 ARG 75 HH12 ARG 75 21.461 -3.799 2.016 603 1HH2 ARG 75 HH21 ARG 75 19.910 -1.202 3.822 604 2HH2 ARG 75 HH22 ARG 75 20.534 -1.620 2.301 605 H SER 76 HN SER 76 24.149 -6.032 6.385 606 HA SER 76 HA SER 76 26.550 -4.650 5.992 607 1HB SER 76 HB2 SER 76 24.892 -6.227 4.014 608 2HB SER 76 HB1 SER 76 26.643 -5.989 4.000 609 HG SER 76 HG SER 76 26.647 -7.087 6.060 610 HA PRO 77 HA PRO 77 24.903 -1.076 3.887 611 1HB PRO 77 HB2 PRO 77 26.966 -0.507 2.180 612 2HB PRO 77 HB1 PRO 77 26.984 -0.112 3.903 613 1HG PRO 77 HG2 PRO 77 28.216 -2.430 2.474 614 2HG PRO 77 HG1 PRO 77 28.881 -1.428 3.781 615 1HD PRO 77 HD2 PRO 77 27.850 -3.873 4.239 616 2HD PRO 77 HD1 PRO 77 27.701 -2.549 5.412 617 H VAL 78 HN VAL 78 24.809 -0.206 1.453 618 HA VAL 78 HA VAL 78 23.495 -2.298 0.027 619 HB VAL 78 HB VAL 78 23.930 0.514 -0.786 620 1HG1 VAL 78 HG11 VAL 78 21.993 0.130 -2.348 621 2HG1 VAL 78 HG12 VAL 78 22.004 -1.564 -1.857 622 3HG1 VAL 78 HG13 VAL 78 23.391 -0.885 -2.713 623 1HG2 VAL 78 HG21 VAL 78 21.551 -0.724 0.589 624 2HG2 VAL 78 HG22 VAL 78 21.554 0.893 -0.101 625 3HG2 VAL 78 HG23 VAL 78 22.640 0.506 1.235 626 H SER 79 HN SER 79 25.117 -3.482 -0.290 627 HA SER 79 HA SER 79 26.956 -2.856 -2.512 628 1HB SER 79 HB2 SER 79 27.018 -5.210 -0.601 629 2HB SER 79 HB1 SER 79 28.274 -4.763 -1.758 630 HG SER 79 HG SER 79 28.065 -4.024 0.720 631 H ASN 80 HN ASN 80 27.279 -5.051 -3.896 632 HA ASN 80 HA ASN 80 24.571 -5.801 -4.616 633 1HB ASN 80 HB2 ASN 80 26.025 -5.102 -6.459 634 2HB ASN 80 HB1 ASN 80 27.168 -6.378 -6.059 635 1HD2 ASN 80 HD21 ASN 80 24.026 -5.668 -7.394 636 2HD2 ASN 80 HD22 ASN 80 23.791 -7.180 -8.172 637 H LEU 81 HN LEU 81 23.881 -7.272 -3.027 638 HA LEU 81 HA LEU 81 25.402 -9.618 -2.752 639 1HB LEU 81 HB2 LEU 81 23.842 -10.045 -1.106 640 2HB LEU 81 HB1 LEU 81 24.789 -8.645 -0.646 641 HG LEU 81 HG LEU 81 21.870 -8.875 -1.467 642 1HD1 LEU 81 HD11 LEU 81 23.166 -8.095 1.143 643 2HD1 LEU 81 HD12 LEU 81 22.323 -9.604 0.794 644 3HD1 LEU 81 HD13 LEU 81 21.432 -8.083 0.834 645 1HD2 LEU 81 HD21 LEU 81 23.399 -6.351 -0.767 646 2HD2 LEU 81 HD22 LEU 81 21.652 -6.477 -0.807 647 3HD2 LEU 81 HD23 LEU 81 22.558 -6.688 -2.293 648 H ALA 82 HN ALA 82 23.481 -11.402 -2.214 649 HA ALA 82 HA ALA 82 21.874 -11.393 -4.578 650 1HB ALA 82 HB1 ALA 82 23.830 -12.761 -5.035 651 2HB ALA 82 HB2 ALA 82 22.381 -13.769 -4.982 652 3HB ALA 82 HB3 ALA 82 23.492 -13.745 -3.612 653 H GLY 83 HN GLY 83 20.001 -11.029 -3.526 654 1HA GLY 83 HA2 GLY 83 18.019 -11.706 -2.507 655 2HA GLY 83 HA1 GLY 83 18.794 -13.236 -2.105 656 H ALA 84 HN ALA 84 18.037 -10.052 -1.019 657 HA ALA 84 HA ALA 84 19.813 -10.236 1.238 658 1HB ALA 84 HB1 ALA 84 19.376 -8.074 0.161 659 2HB ALA 84 HB2 ALA 84 18.927 -8.069 1.867 660 3HB ALA 84 HB3 ALA 84 17.679 -8.197 0.627 661 H VAL 85 HN VAL 85 19.242 -11.803 2.560 662 HA VAL 85 HA VAL 85 16.712 -11.479 3.980 663 HB VAL 85 HB VAL 85 18.216 -14.069 3.592 664 1HG1 VAL 85 HG11 VAL 85 15.532 -13.539 4.858 665 2HG1 VAL 85 HG12 VAL 85 17.022 -13.989 5.689 666 3HG1 VAL 85 HG13 VAL 85 16.237 -15.138 4.607 667 1HG2 VAL 85 HG21 VAL 85 17.186 -13.457 1.467 668 2HG2 VAL 85 HG22 VAL 85 15.631 -13.221 2.266 669 3HG2 VAL 85 HG23 VAL 85 16.337 -14.834 2.171 670 H THR 86 HN THR 86 17.124 -11.003 6.016 671 HA THR 86 HA THR 86 19.886 -11.392 6.933 672 HB THR 86 HB THR 86 17.737 -9.761 8.284 673 HG1 THR 86 HG1 THR 86 18.814 -9.317 6.001 674 1HG2 THR 86 HG21 THR 86 19.627 -10.379 9.721 675 2HG2 THR 86 HG22 THR 86 19.668 -8.652 9.375 676 3HG2 THR 86 HG23 THR 86 20.758 -9.748 8.526 677 H THR 87 HN THR 87 20.343 -12.774 8.574 678 HA THR 87 HA THR 87 18.082 -14.261 9.665 679 HB THR 87 HB THR 87 21.012 -15.029 9.498 680 HG1 THR 87 HG1 THR 87 20.014 -14.937 7.450 681 1HG2 THR 87 HG21 THR 87 18.550 -16.658 10.176 682 2HG2 THR 87 HG22 THR 87 19.762 -16.119 11.337 683 3HG2 THR 87 HG23 THR 87 20.200 -17.271 10.076 684 H MET 88 HN MET 88 17.575 -13.747 11.714 685 HA MET 88 HA MET 88 19.737 -12.794 13.440 686 1HB MET 88 HB2 MET 88 16.850 -11.896 13.389 687 2HB MET 88 HB1 MET 88 18.021 -11.431 14.617 688 1HG MET 88 HG2 MET 88 19.399 -10.369 12.866 689 2HG MET 88 HG1 MET 88 18.186 -10.815 11.682 690 1HE MET 88 HE1 MET 88 18.243 -8.200 10.969 691 2HE MET 88 HE2 MET 88 19.357 -7.835 12.285 692 3HE MET 88 HE3 MET 88 17.883 -6.887 12.090 693 H HIS 89 HN HIS 89 19.852 -13.631 15.448 694 HA HIS 89 HA HIS 89 18.165 -15.975 15.891 695 1HB HIS 89 HB2 HIS 89 20.624 -16.331 15.901 696 2HB HIS 89 HB1 HIS 89 20.762 -15.208 17.244 697 HD1 HIS 89 HD1 HIS 89 21.149 -16.479 19.333 698 HD2 HIS 89 HD2 HIS 89 18.596 -18.518 16.779 699 HE1 HIS 89 HE1 HIS 89 20.504 -18.574 20.554 700 HE2 HIS 89 HE2 HIS 89 19.408 -19.930 18.751 701 H VAL 90 HN VAL 90 16.670 -15.936 17.311 702 HA VAL 90 HA VAL 90 16.477 -13.717 19.220 703 HB VAL 90 HB VAL 90 14.427 -15.752 18.298 704 1HG1 VAL 90 HG11 VAL 90 14.025 -14.986 20.587 705 2HG1 VAL 90 HG12 VAL 90 12.804 -14.339 19.485 706 3HG1 VAL 90 HG13 VAL 90 14.131 -13.314 20.039 707 1HG2 VAL 90 HG21 VAL 90 13.355 -13.865 17.167 708 2HG2 VAL 90 HG22 VAL 90 14.973 -14.195 16.537 709 3HG2 VAL 90 HG23 VAL 90 14.710 -12.836 17.631 710 H ILE 91 HN ILE 91 16.976 -13.967 21.061 711 HA ILE 91 HA ILE 91 17.267 -16.628 22.176 712 HB ILE 91 HB ILE 91 18.311 -13.954 22.853 713 1HG1 ILE 91 HG12 ILE 91 19.673 -16.519 22.058 714 2HG1 ILE 91 HG11 ILE 91 19.522 -15.042 21.114 715 1HG2 ILE 91 HG21 ILE 91 19.521 -15.036 24.814 716 2HG2 ILE 91 HG22 ILE 91 18.636 -16.528 24.486 717 3HG2 ILE 91 HG23 ILE 91 17.767 -15.083 25.007 718 1HD1 ILE 91 HD11 ILE 91 20.979 -13.890 22.682 719 2HD1 ILE 91 HD12 ILE 91 21.761 -15.332 22.023 720 3HD1 ILE 91 HD13 ILE 91 21.093 -15.355 23.653 721 H ILE 92 HN ILE 92 15.819 -17.357 23.366 722 HA ILE 92 HA ILE 92 13.748 -15.686 24.455 723 HB ILE 92 HB ILE 92 14.168 -18.694 24.367 724 1HG1 ILE 92 HG12 ILE 92 12.046 -18.712 23.042 725 2HG1 ILE 92 HG11 ILE 92 12.019 -16.964 23.141 726 1HG2 ILE 92 HG21 ILE 92 11.909 -17.218 25.684 727 2HG2 ILE 92 HG22 ILE 92 13.157 -18.190 26.472 728 3HG2 ILE 92 HG23 ILE 92 11.973 -18.964 25.407 729 1HD1 ILE 92 HD11 ILE 92 12.731 -17.783 20.969 730 2HD1 ILE 92 HD12 ILE 92 14.111 -18.599 21.713 731 3HD1 ILE 92 HD13 ILE 92 13.990 -16.833 21.753 732 H GLN 93 HN GLN 93 13.868 -14.939 26.468 733 HA GLN 93 HA GLN 93 15.922 -16.027 28.194 734 1HB GLN 93 HB2 GLN 93 14.416 -13.405 28.273 735 2HB GLN 93 HB1 GLN 93 15.676 -13.882 29.397 736 1HG GLN 93 HG2 GLN 93 17.299 -13.931 27.588 737 2HG GLN 93 HG1 GLN 93 16.035 -13.507 26.438 738 1HE2 GLN 93 HE21 GLN 93 15.271 -11.413 26.388 739 2HE2 GLN 93 HE22 GLN 93 16.084 -10.111 27.193 740 H ALA 94 HN ALA 94 15.140 -17.483 29.449 741 HA ALA 94 HA ALA 94 12.399 -17.669 30.205 742 1HB ALA 94 HB1 ALA 94 13.779 -19.678 29.954 743 2HB ALA 94 HB2 ALA 94 13.122 -19.573 31.586 744 3HB ALA 94 HB3 ALA 94 14.806 -19.147 31.285 745 HA PRO 95 HA PRO 95 13.022 -14.761 33.578 746 1HB PRO 95 HB2 PRO 95 10.414 -14.548 34.253 747 2HB PRO 95 HB1 PRO 95 11.086 -13.730 32.839 748 1HG PRO 95 HG2 PRO 95 9.448 -16.214 33.011 749 2HG PRO 95 HG1 PRO 95 9.422 -14.927 31.796 750 1HD PRO 95 HD2 PRO 95 10.667 -17.357 31.461 751 2HD PRO 95 HD1 PRO 95 11.093 -15.879 30.578 752 H VAL 96 HN VAL 96 11.985 -14.680 35.853 753 HA VAL 96 HA VAL 96 12.757 -17.001 37.265 754 HB VAL 96 HB VAL 96 11.004 -14.733 38.190 755 1HG1 VAL 96 HG11 VAL 96 10.891 -16.647 39.710 756 2HG1 VAL 96 HG12 VAL 96 11.770 -15.315 40.465 757 3HG1 VAL 96 HG13 VAL 96 12.653 -16.689 39.801 758 1HG2 VAL 96 HG21 VAL 96 13.071 -13.747 39.112 759 2HG2 VAL 96 HG22 VAL 96 13.104 -13.880 37.356 760 3HG2 VAL 96 HG23 VAL 96 13.995 -15.037 38.347 761 H THR 97 HN THR 97 11.552 -18.739 37.987 762 HA THR 97 HA THR 97 9.096 -19.133 36.631 763 HB THR 97 HB THR 97 10.423 -20.946 38.668 764 HG1 THR 97 HG1 THR 97 10.810 -20.437 35.942 765 1HG2 THR 97 HG21 THR 97 9.093 -22.712 37.586 766 2HG2 THR 97 HG22 THR 97 8.356 -21.516 36.521 767 3HG2 THR 97 HG23 THR 97 8.035 -21.470 38.256 768 H GLU 98 HN GLU 98 7.857 -17.598 37.352 769 HA GLU 98 HA GLU 98 6.126 -18.280 39.541 770 1HB GLU 98 HB2 GLU 98 7.703 -16.672 40.593 771 2HB GLU 98 HB1 GLU 98 7.445 -15.552 39.263 772 1HG GLU 98 HG2 GLU 98 5.033 -15.435 39.946 773 2HG GLU 98 HG1 GLU 98 5.455 -16.387 41.367 774 H LYS 99 HN LYS 99 4.727 -18.764 37.836 775 HA LYS 99 HA LYS 99 4.575 -16.780 35.884 776 1HB LYS 99 HB2 LYS 99 3.235 -18.338 34.486 777 2HB LYS 99 HB1 LYS 99 4.850 -18.878 34.905 778 1HG LYS 99 HG2 LYS 99 3.881 -20.336 36.639 779 2HG LYS 99 HG1 LYS 99 2.272 -19.809 36.146 780 1HD LYS 99 HD2 LYS 99 2.682 -20.681 33.898 781 2HD LYS 99 HD1 LYS 99 4.289 -21.206 34.407 782 1HE LYS 99 HE2 LYS 99 3.252 -22.670 36.090 783 2HE LYS 99 HE1 LYS 99 1.664 -22.149 35.528 784 1HZ LYS 99 HZ1 LYS 99 2.264 -24.260 34.546 785 2HZ LYS 99 HZ2 LYS 99 3.686 -23.598 33.929 786 3HZ LYS 99 HZ3 LYS 99 2.197 -23.072 33.349 787 H GLU 100 HN GLU 100 3.582 -15.267 37.241 788 HA GLU 100 HA GLU 100 0.740 -15.628 37.524 789 1HB GLU 100 HB2 GLU 100 2.057 -14.326 39.250 790 2HB GLU 100 HB1 GLU 100 2.427 -13.141 38.020 791 1HG GLU 100 HG2 GLU 100 -0.368 -13.763 39.000 792 2HG GLU 100 HG1 GLU 100 0.636 -12.473 39.637 793 H LYS 101 HN LYS 101 0.103 -15.937 35.584 794 HA LYS 101 HA LYS 101 0.141 -13.822 33.657 795 1HB LYS 101 HB2 LYS 101 2.266 -15.071 33.265 796 2HB LYS 101 HB1 LYS 101 1.377 -16.567 33.166 797 1HG LYS 101 HG2 LYS 101 1.017 -14.309 31.196 798 2HG LYS 101 HG1 LYS 101 2.234 -15.563 30.997 799 1HD LYS 101 HD2 LYS 101 0.434 -17.255 31.009 800 2HD LYS 101 HD1 LYS 101 -0.755 -15.961 31.145 801 1HE LYS 101 HE2 LYS 101 -0.023 -15.057 29.012 802 2HE LYS 101 HE1 LYS 101 1.210 -16.312 28.891 803 1HZ LYS 101 HZ1 LYS 101 -0.740 -16.861 27.585 804 2HZ LYS 101 HZ2 LYS 101 -1.718 -16.741 28.947 805 3HZ LYS 101 HZ3 LYS 101 -0.578 -17.975 28.851 Start of MODEL 19 1 H GLU 1 HT1 GLU 1 4.441 -16.291 -7.305 2 HA GLU 1 HA GLU 1 3.256 -14.425 -6.367 3 1HB GLU 1 HB2 GLU 1 4.585 -14.112 -4.332 4 2HB GLU 1 HB1 GLU 1 4.674 -15.785 -4.834 5 1HG GLU 1 HG2 GLU 1 6.835 -13.712 -5.290 6 2HG GLU 1 HG1 GLU 1 6.821 -14.891 -3.986 7 H ALA 2 HN ALA 2 3.503 -12.238 -5.465 8 HA ALA 2 HA ALA 2 4.834 -10.527 -7.389 9 1HB ALA 2 HB1 ALA 2 2.505 -10.027 -6.800 10 2HB ALA 2 HB2 ALA 2 3.570 -8.714 -6.293 11 3HB ALA 2 HB3 ALA 2 2.965 -9.867 -5.106 12 H GLU 3 HN GLU 3 6.918 -10.097 -6.958 13 HA GLU 3 HA GLU 3 7.856 -10.321 -4.347 14 1HB GLU 3 HB2 GLU 3 9.289 -9.499 -6.857 15 2HB GLU 3 HB1 GLU 3 10.091 -9.669 -5.307 16 1HG GLU 3 HG2 GLU 3 9.298 -12.051 -5.270 17 2HG GLU 3 HG1 GLU 3 8.755 -11.817 -6.930 18 H VAL 4 HN VAL 4 7.246 -8.807 -2.994 19 HA VAL 4 HA VAL 4 7.443 -5.970 -3.723 20 HB VAL 4 HB VAL 4 6.019 -7.193 -1.327 21 1HG1 VAL 4 HG11 VAL 4 4.779 -5.088 -1.197 22 2HG1 VAL 4 HG12 VAL 4 5.719 -4.454 -2.543 23 3HG1 VAL 4 HG13 VAL 4 6.516 -4.834 -1.016 24 1HG2 VAL 4 HG21 VAL 4 4.829 -6.416 -3.982 25 2HG2 VAL 4 HG22 VAL 4 3.919 -6.907 -2.552 26 3HG2 VAL 4 HG23 VAL 4 4.998 -8.053 -3.348 27 H HIS 5 HN HIS 5 9.196 -8.186 -2.499 28 HA HIS 5 HA HIS 5 10.184 -6.846 -0.129 29 1HB HIS 5 HB2 HIS 5 11.785 -8.700 0.220 30 2HB HIS 5 HB1 HIS 5 10.156 -9.295 0.000 31 HD1 HIS 5 HD1 HIS 5 12.671 -11.085 -0.382 32 HD2 HIS 5 HD2 HIS 5 10.676 -9.153 -3.470 33 HE1 HIS 5 HE1 HIS 5 13.227 -12.373 -2.464 34 HE2 HIS 5 HE2 HIS 5 11.905 -11.292 -4.296 35 H ASN 6 HN ASN 6 10.905 -4.936 -0.826 36 HA ASN 6 HA ASN 6 13.311 -4.951 -2.510 37 1HB ASN 6 HB2 ASN 6 11.552 -3.352 -3.152 38 2HB ASN 6 HB1 ASN 6 11.602 -2.631 -1.550 39 1HD2 ASN 6 HD21 ASN 6 13.208 -2.943 -4.613 40 2HD2 ASN 6 HD22 ASN 6 14.307 -1.648 -4.397 41 H GLN 7 HN GLN 7 12.138 -4.433 0.670 42 HA GLN 7 HA GLN 7 14.548 -3.242 1.688 43 1HB GLN 7 HB2 GLN 7 12.133 -4.361 3.107 44 2HB GLN 7 HB1 GLN 7 13.400 -3.399 3.847 45 1HG GLN 7 HG2 GLN 7 11.579 -2.445 1.651 46 2HG GLN 7 HG1 GLN 7 11.341 -2.138 3.367 47 1HE2 GLN 7 HE21 GLN 7 11.408 0.044 3.019 48 2HE2 GLN 7 HE22 GLN 7 12.871 0.904 2.688 49 H LEU 8 HN LEU 8 15.127 -4.552 4.022 50 HA LEU 8 HA LEU 8 16.169 -7.026 2.893 51 1HB LEU 8 HB2 LEU 8 16.858 -5.603 5.450 52 2HB LEU 8 HB1 LEU 8 17.588 -7.079 4.916 53 HG LEU 8 HG LEU 8 18.523 -5.833 2.919 54 1HD1 LEU 8 HD11 LEU 8 18.678 -3.405 3.013 55 2HD1 LEU 8 HD12 LEU 8 17.614 -3.385 4.420 56 3HD1 LEU 8 HD13 LEU 8 17.001 -3.941 2.865 57 1HD2 LEU 8 HD21 LEU 8 20.331 -4.764 4.178 58 2HD2 LEU 8 HD22 LEU 8 19.904 -6.338 4.847 59 3HD2 LEU 8 HD23 LEU 8 19.358 -4.862 5.647 60 H GLU 9 HN GLU 9 15.536 -8.951 3.575 61 HA GLU 9 HA GLU 9 13.305 -8.992 5.436 62 1HB GLU 9 HB2 GLU 9 14.429 -11.242 3.775 63 2HB GLU 9 HB1 GLU 9 13.001 -11.285 4.756 64 1HG GLU 9 HG2 GLU 9 11.930 -9.608 3.354 65 2HG GLU 9 HG1 GLU 9 13.371 -9.550 2.336 66 H ILE 10 HN ILE 10 13.321 -9.911 7.325 67 HA ILE 10 HA ILE 10 15.740 -11.330 8.170 68 HB ILE 10 HB ILE 10 14.080 -9.457 9.925 69 1HG1 ILE 10 HG12 ILE 10 16.897 -9.072 8.827 70 2HG1 ILE 10 HG11 ILE 10 15.473 -8.193 8.295 71 1HG2 ILE 10 HG21 ILE 10 16.599 -10.981 10.525 72 2HG2 ILE 10 HG22 ILE 10 14.984 -11.314 11.166 73 3HG2 ILE 10 HG23 ILE 10 15.815 -9.811 11.592 74 1HD1 ILE 10 HD11 ILE 10 16.692 -8.102 11.045 75 2HD1 ILE 10 HD12 ILE 10 15.270 -7.197 10.516 76 3HD1 ILE 10 HD13 ILE 10 16.848 -6.866 9.795 77 H LYS 11 HN LYS 11 15.350 -13.174 9.107 78 HA LYS 11 HA LYS 11 12.597 -13.791 9.894 79 1HB LYS 11 HB2 LYS 11 12.973 -16.137 9.397 80 2HB LYS 11 HB1 LYS 11 13.230 -15.170 7.957 81 1HG LYS 11 HG2 LYS 11 15.650 -15.386 8.228 82 2HG LYS 11 HG1 LYS 11 15.408 -16.290 9.722 83 1HD LYS 11 HD2 LYS 11 14.461 -17.149 6.979 84 2HD LYS 11 HD1 LYS 11 15.873 -17.795 7.824 85 1HE LYS 11 HE2 LYS 11 14.406 -18.599 9.630 86 2HE LYS 11 HE1 LYS 11 13.005 -17.964 8.779 87 1HZ LYS 11 HZ1 LYS 11 13.463 -19.486 6.973 88 2HZ LYS 11 HZ2 LYS 11 13.211 -20.271 8.434 89 3HZ LYS 11 HZ3 LYS 11 14.782 -20.139 7.818 90 H PHE 12 HN PHE 12 12.511 -15.390 11.719 91 HA PHE 12 HA PHE 12 14.734 -14.733 13.513 92 1HB PHE 12 HB2 PHE 12 11.819 -15.084 14.193 93 2HB PHE 12 HB1 PHE 12 13.105 -14.769 15.355 94 HD1 PHE 12 HD1 PHE 12 10.808 -13.313 12.988 95 HD2 PHE 12 HD2 PHE 12 14.390 -12.625 15.187 96 HE1 PHE 12 HE1 PHE 12 10.570 -10.897 12.612 97 HE2 PHE 12 HE2 PHE 12 14.155 -10.214 14.817 98 HZ PHE 12 HZ PHE 12 12.256 -9.338 13.535 99 H ARG 13 HN ARG 13 15.906 -16.332 14.181 100 HA ARG 13 HA ARG 13 14.781 -19.031 14.274 101 1HB ARG 13 HB2 ARG 13 16.652 -18.996 12.807 102 2HB ARG 13 HB1 ARG 13 17.592 -18.007 13.900 103 1HG ARG 13 HG2 ARG 13 18.381 -20.336 13.793 104 2HG ARG 13 HG1 ARG 13 17.891 -19.856 15.412 105 1HD ARG 13 HD2 ARG 13 17.119 -22.099 14.966 106 2HD ARG 13 HD1 ARG 13 15.754 -21.012 15.074 107 HE ARG 13 HE ARG 13 15.826 -21.030 12.567 108 1HH1 ARG 13 HH11 ARG 13 17.176 -23.753 14.400 109 2HH1 ARG 13 HH12 ARG 13 16.620 -24.937 13.318 110 1HH2 ARG 13 HH21 ARG 13 15.015 -22.723 11.073 111 2HH2 ARG 13 HH22 ARG 13 15.375 -24.340 11.421 112 H LEU 14 HN LEU 14 14.192 -19.631 16.173 113 HA LEU 14 HA LEU 14 15.044 -18.304 18.589 114 1HB LEU 14 HB2 LEU 14 13.163 -20.593 18.076 115 2HB LEU 14 HB1 LEU 14 13.537 -19.995 19.667 116 HG LEU 14 HG LEU 14 12.457 -17.835 19.078 117 1HD1 LEU 14 HD11 LEU 14 11.060 -17.666 17.157 118 2HD1 LEU 14 HD12 LEU 14 11.653 -19.209 16.534 119 3HD1 LEU 14 HD13 LEU 14 12.748 -17.818 16.660 120 1HD2 LEU 14 HD21 LEU 14 10.196 -18.690 19.094 121 2HD2 LEU 14 HD22 LEU 14 11.239 -19.573 20.209 122 3HD2 LEU 14 HD23 LEU 14 10.790 -20.291 18.660 123 H THR 15 HN THR 15 15.909 -19.369 20.425 124 HA THR 15 HA THR 15 17.899 -21.312 20.082 125 HB THR 15 HB THR 15 17.683 -21.373 22.654 126 HG1 THR 15 HG1 THR 15 15.847 -20.559 23.243 127 1HG2 THR 15 HG21 THR 15 18.718 -19.137 22.885 128 2HG2 THR 15 HG22 THR 15 18.197 -18.752 21.242 129 3HG2 THR 15 HG23 THR 15 19.375 -20.032 21.516 130 H ASP 16 HN ASP 16 14.617 -21.511 20.304 131 HA ASP 16 HA ASP 16 14.237 -24.116 21.477 132 1HB ASP 16 HB2 ASP 16 12.464 -22.454 21.589 133 2HB ASP 16 HB1 ASP 16 12.456 -22.284 19.847 134 H GLY 17 HN GLY 17 15.415 -23.007 18.518 135 1HA GLY 17 HA2 GLY 17 16.230 -24.308 16.776 136 2HA GLY 17 HA1 GLY 17 15.335 -25.683 17.415 137 H SER 18 HN SER 18 13.502 -22.907 17.170 138 HA SER 18 HA SER 18 12.265 -23.891 14.705 139 1HB SER 18 HB2 SER 18 11.071 -22.377 17.021 140 2HB SER 18 HB1 SER 18 10.197 -22.870 15.569 141 HG SER 18 HG SER 18 10.861 -24.334 17.781 142 H ASP 19 HN ASP 19 11.563 -22.282 13.135 143 HA ASP 19 HA ASP 19 12.700 -19.664 13.593 144 1HB ASP 19 HB2 ASP 19 13.230 -19.571 11.245 145 2HB ASP 19 HB1 ASP 19 14.109 -20.887 12.026 146 H ILE 20 HN ILE 20 11.643 -17.989 12.697 147 HA ILE 20 HA ILE 20 8.797 -18.417 12.086 148 HB ILE 20 HB ILE 20 10.212 -15.916 13.101 149 1HG1 ILE 20 HG12 ILE 20 8.355 -17.825 14.549 150 2HG1 ILE 20 HG11 ILE 20 10.092 -17.705 14.794 151 1HG2 ILE 20 HG21 ILE 20 8.267 -15.346 11.735 152 2HG2 ILE 20 HG22 ILE 20 7.958 -14.987 13.434 153 3HG2 ILE 20 HG23 ILE 20 7.258 -16.428 12.698 154 1HD1 ILE 20 HD11 ILE 20 8.063 -15.550 15.380 155 2HD1 ILE 20 HD12 ILE 20 9.803 -15.423 15.641 156 3HD1 ILE 20 HD13 ILE 20 8.854 -16.587 16.565 157 H GLY 21 HN GLY 21 7.924 -17.523 10.247 158 1HA GLY 21 HA2 GLY 21 9.409 -17.337 7.936 159 2HA GLY 21 HA1 GLY 21 7.800 -16.670 8.132 160 HA PRO 22 HA PRO 22 11.424 -13.463 7.833 161 1HB PRO 22 HB2 PRO 22 11.549 -13.010 5.189 162 2HB PRO 22 HB1 PRO 22 12.516 -14.242 6.001 163 1HG PRO 22 HG2 PRO 22 9.954 -14.570 4.479 164 2HG PRO 22 HG1 PRO 22 11.426 -15.553 4.414 165 1HD PRO 22 HD2 PRO 22 9.268 -16.306 5.836 166 2HD PRO 22 HD1 PRO 22 10.927 -16.666 6.366 167 H LYS 23 HN LYS 23 11.140 -11.360 7.713 168 HA LYS 23 HA LYS 23 8.670 -10.263 6.570 169 1HB LYS 23 HB2 LYS 23 8.472 -10.611 9.063 170 2HB LYS 23 HB1 LYS 23 9.894 -9.632 9.291 171 1HG LYS 23 HG2 LYS 23 7.312 -8.584 8.124 172 2HG LYS 23 HG1 LYS 23 7.683 -8.552 9.836 173 1HD LYS 23 HD2 LYS 23 9.698 -7.190 9.299 174 2HD LYS 23 HD1 LYS 23 9.164 -7.151 7.621 175 1HE LYS 23 HE2 LYS 23 7.661 -6.067 10.005 176 2HE LYS 23 HE1 LYS 23 8.533 -5.117 8.806 177 1HZ LYS 23 HZ1 LYS 23 6.125 -6.786 8.301 178 2HZ LYS 23 HZ2 LYS 23 6.969 -5.966 7.121 179 3HZ LYS 23 HZ3 LYS 23 6.189 -5.105 8.333 180 H ALA 24 HN ALA 24 9.036 -8.143 5.690 181 HA ALA 24 HA ALA 24 11.860 -7.654 5.113 182 1HB ALA 24 HB1 ALA 24 11.080 -6.108 3.394 183 2HB ALA 24 HB2 ALA 24 9.428 -6.280 3.967 184 3HB ALA 24 HB3 ALA 24 10.256 -7.659 3.240 185 H PHE 25 HN PHE 25 13.040 -6.214 6.153 186 HA PHE 25 HA PHE 25 11.698 -4.029 7.595 187 1HB PHE 25 HB2 PHE 25 14.304 -5.413 8.268 188 2HB PHE 25 HB1 PHE 25 13.569 -4.101 9.164 189 HD1 PHE 25 HD1 PHE 25 11.933 -4.553 10.839 190 HD2 PHE 25 HD2 PHE 25 13.251 -7.627 8.229 191 HE1 PHE 25 HE1 PHE 25 10.855 -6.249 12.274 192 HE2 PHE 25 HE2 PHE 25 12.174 -9.307 9.647 193 HZ PHE 25 HZ PHE 25 11.024 -8.675 11.622 194 HA PRO 26 HA PRO 26 14.309 -1.498 4.886 195 1HB PRO 26 HB2 PRO 26 13.541 0.467 6.979 196 2HB PRO 26 HB1 PRO 26 13.451 0.658 5.234 197 1HG PRO 26 HG2 PRO 26 11.241 0.259 6.646 198 2HG PRO 26 HG1 PRO 26 11.454 -0.570 5.091 199 1HD PRO 26 HD2 PRO 26 11.752 -1.643 7.868 200 2HD PRO 26 HD1 PRO 26 11.059 -2.416 6.422 201 H ASP 27 HN ASP 27 16.410 -0.618 5.206 202 HA ASP 27 HA ASP 27 17.902 -1.706 7.312 203 1HB ASP 27 HB2 ASP 27 19.821 -0.453 6.444 204 2HB ASP 27 HB1 ASP 27 18.891 -1.162 5.134 205 H ALA 28 HN ALA 28 16.277 1.331 7.033 206 HA ALA 28 HA ALA 28 17.659 2.511 9.278 207 1HB ALA 28 HB1 ALA 28 15.252 3.511 7.779 208 2HB ALA 28 HB2 ALA 28 16.936 3.937 7.449 209 3HB ALA 28 HB3 ALA 28 16.185 4.412 8.970 210 H THR 29 HN THR 29 15.261 0.217 9.096 211 HA THR 29 HA THR 29 13.650 1.196 11.209 212 HB THR 29 HB THR 29 13.937 -1.587 10.044 213 HG1 THR 29 HG1 THR 29 12.908 0.589 9.121 214 1HG2 THR 29 HG21 THR 29 11.799 -2.095 11.169 215 2HG2 THR 29 HG22 THR 29 11.817 -0.502 11.922 216 3HG2 THR 29 HG23 THR 29 13.039 -1.696 12.360 217 H THR 30 HN THR 30 13.840 1.020 13.322 218 HA THR 30 HA THR 30 16.387 0.286 14.362 219 HB THR 30 HB THR 30 15.380 1.100 16.521 220 HG1 THR 30 HG1 THR 30 13.361 1.512 16.562 221 1HG2 THR 30 HG21 THR 30 16.763 2.547 15.110 222 2HG2 THR 30 HG22 THR 30 15.445 3.471 15.835 223 3HG2 THR 30 HG23 THR 30 15.349 2.971 14.148 224 H VAL 31 HN VAL 31 16.755 -1.000 16.128 225 HA VAL 31 HA VAL 31 15.653 -3.570 16.036 226 HB VAL 31 HB VAL 31 17.359 -2.229 18.143 227 1HG1 VAL 31 HG11 VAL 31 17.891 -4.476 18.976 228 2HG1 VAL 31 HG12 VAL 31 16.810 -5.191 17.788 229 3HG1 VAL 31 HG13 VAL 31 16.155 -4.197 19.086 230 1HG2 VAL 31 HG21 VAL 31 18.064 -4.116 15.900 231 2HG2 VAL 31 HG22 VAL 31 19.195 -3.447 17.078 232 3HG2 VAL 31 HG23 VAL 31 18.376 -2.384 15.940 233 H SER 32 HN SER 32 14.806 -0.762 17.942 234 HA SER 32 HA SER 32 13.163 -1.993 19.817 235 1HB SER 32 HB2 SER 32 12.014 0.247 19.894 236 2HB SER 32 HB1 SER 32 13.766 0.348 20.034 237 HG SER 32 HG SER 32 12.288 1.628 18.409 238 H ALA 33 HN ALA 33 12.495 -0.807 16.556 239 HA ALA 33 HA ALA 33 9.772 -1.629 16.523 240 1HB ALA 33 HB1 ALA 33 10.613 0.169 15.083 241 2HB ALA 33 HB2 ALA 33 9.857 -1.115 14.134 242 3HB ALA 33 HB3 ALA 33 11.618 -0.995 14.221 243 H LEU 34 HN LEU 34 12.854 -3.200 15.765 244 HA LEU 34 HA LEU 34 11.922 -5.355 14.339 245 1HB LEU 34 HB2 LEU 34 14.269 -4.669 14.490 246 2HB LEU 34 HB1 LEU 34 14.215 -4.909 16.225 247 HG LEU 34 HG LEU 34 13.937 -7.160 15.967 248 1HD1 LEU 34 HD11 LEU 34 14.309 -6.670 12.977 249 2HD1 LEU 34 HD12 LEU 34 12.853 -7.295 13.745 250 3HD1 LEU 34 HD13 LEU 34 14.319 -8.277 13.701 251 1HD2 LEU 34 HD21 LEU 34 16.338 -6.093 14.506 252 2HD2 LEU 34 HD22 LEU 34 16.221 -7.740 15.124 253 3HD2 LEU 34 HD23 LEU 34 16.164 -6.377 16.239 254 H LYS 35 HN LYS 35 12.553 -4.817 17.832 255 HA LYS 35 HA LYS 35 11.521 -7.270 18.661 256 1HB LYS 35 HB2 LYS 35 11.889 -4.683 20.142 257 2HB LYS 35 HB1 LYS 35 11.225 -6.119 20.903 258 1HG LYS 35 HG2 LYS 35 13.275 -7.331 20.327 259 2HG LYS 35 HG1 LYS 35 13.964 -5.830 19.684 260 1HD LYS 35 HD2 LYS 35 13.794 -4.804 21.872 261 2HD LYS 35 HD1 LYS 35 12.966 -6.231 22.500 262 1HE LYS 35 HE2 LYS 35 15.006 -7.552 22.033 263 2HE LYS 35 HE1 LYS 35 15.814 -6.064 21.537 264 1HZ LYS 35 HZ1 LYS 35 15.537 -5.194 23.782 265 2HZ LYS 35 HZ2 LYS 35 16.243 -6.715 23.907 266 3HZ LYS 35 HZ3 LYS 35 14.617 -6.525 24.211 267 H GLU 36 HN GLU 36 9.952 -4.110 18.306 268 HA GLU 36 HA GLU 36 7.468 -4.814 19.312 269 1HB GLU 36 HB2 GLU 36 8.121 -2.958 17.033 270 2HB GLU 36 HB1 GLU 36 6.555 -3.051 17.814 271 1HG GLU 36 HG2 GLU 36 9.146 -2.232 19.099 272 2HG GLU 36 HG1 GLU 36 7.816 -1.169 18.646 273 H THR 37 HN THR 37 8.831 -5.363 16.121 274 HA THR 37 HA THR 37 6.491 -6.423 14.969 275 HB THR 37 HB THR 37 9.390 -7.002 14.249 276 HG1 THR 37 HG1 THR 37 8.912 -4.790 14.126 277 1HG2 THR 37 HG21 THR 37 6.851 -7.279 12.615 278 2HG2 THR 37 HG22 THR 37 7.811 -8.612 13.250 279 3HG2 THR 37 HG23 THR 37 8.488 -7.547 12.016 280 H VAL 38 HN VAL 38 9.226 -7.891 16.705 281 HA VAL 38 HA VAL 38 8.428 -10.577 16.435 282 HB VAL 38 HB VAL 38 10.008 -9.333 18.713 283 1HG1 VAL 38 HG11 VAL 38 9.779 -12.204 17.826 284 2HG1 VAL 38 HG12 VAL 38 9.178 -11.522 19.343 285 3HG1 VAL 38 HG13 VAL 38 10.913 -11.597 19.024 286 1HG2 VAL 38 HG21 VAL 38 11.990 -10.100 17.514 287 2HG2 VAL 38 HG22 VAL 38 11.068 -8.939 16.554 288 3HG2 VAL 38 HG23 VAL 38 10.969 -10.666 16.195 289 H ILE 39 HN ILE 39 7.851 -8.210 18.983 290 HA ILE 39 HA ILE 39 6.346 -9.866 20.693 291 HB ILE 39 HB ILE 39 6.055 -6.840 20.401 292 1HG1 ILE 39 HG12 ILE 39 7.870 -8.421 22.230 293 2HG1 ILE 39 HG11 ILE 39 8.392 -7.555 20.789 294 1HG2 ILE 39 HG21 ILE 39 5.433 -8.689 22.719 295 2HG2 ILE 39 HG22 ILE 39 4.238 -7.791 21.777 296 3HG2 ILE 39 HG23 ILE 39 5.399 -6.942 22.809 297 1HD1 ILE 39 HD11 ILE 39 8.866 -6.293 22.786 298 2HD1 ILE 39 HD12 ILE 39 7.173 -6.362 23.252 299 3HD1 ILE 39 HD13 ILE 39 7.654 -5.453 21.812 300 H SER 40 HN SER 40 5.401 -8.035 17.867 301 HA SER 40 HA SER 40 2.601 -8.360 18.265 302 1HB SER 40 HB2 SER 40 4.115 -7.758 15.715 303 2HB SER 40 HB1 SER 40 2.380 -7.551 15.964 304 HG SER 40 HG SER 40 4.532 -6.089 16.960 305 H GLU 41 HN GLU 41 5.085 -10.243 16.448 306 HA GLU 41 HA GLU 41 3.169 -12.003 15.357 307 1HB GLU 41 HB2 GLU 41 6.170 -12.096 15.530 308 2HB GLU 41 HB1 GLU 41 5.163 -13.184 14.599 309 1HG GLU 41 HG2 GLU 41 5.433 -10.219 14.182 310 2HG GLU 41 HG1 GLU 41 6.126 -11.482 13.164 311 H TRP 42 HN TRP 42 5.084 -11.817 18.221 312 HA TRP 42 HA TRP 42 4.913 -14.600 18.857 313 1HB TRP 42 HB2 TRP 42 6.761 -12.953 19.549 314 2HB TRP 42 HB1 TRP 42 5.612 -12.331 20.722 315 HD1 TRP 42 HD1 TRP 42 5.554 -13.586 23.042 316 HE1 TRP 42 HE1 TRP 42 6.652 -15.704 23.943 317 HE3 TRP 42 HE3 TRP 42 7.405 -15.406 18.650 318 HZ2 TRP 42 HZ2 TRP 42 8.119 -17.972 22.851 319 HZ3 TRP 42 HZ3 TRP 42 8.600 -17.536 18.662 320 HH2 TRP 42 HH2 TRP 42 8.942 -18.784 20.742 321 HA PRO 43 HA PRO 43 0.754 -14.210 20.342 322 1HB PRO 43 HB2 PRO 43 1.386 -16.483 22.118 323 2HB PRO 43 HB1 PRO 43 0.145 -16.333 20.880 324 1HG PRO 43 HG2 PRO 43 2.337 -17.845 20.503 325 2HG PRO 43 HG1 PRO 43 1.539 -16.979 19.180 326 1HD PRO 43 HD2 PRO 43 4.055 -16.325 20.633 327 2HD PRO 43 HD1 PRO 43 3.621 -16.080 18.927 328 H ARG 44 HN ARG 44 0.106 -12.817 21.756 329 HA ARG 44 HA ARG 44 1.624 -11.911 23.972 330 1HB ARG 44 HB2 ARG 44 0.029 -10.481 22.785 331 2HB ARG 44 HB1 ARG 44 -1.284 -11.535 23.272 332 1HG ARG 44 HG2 ARG 44 -0.913 -10.911 25.607 333 2HG ARG 44 HG1 ARG 44 0.401 -9.842 25.106 334 1HD ARG 44 HD2 ARG 44 -1.694 -8.610 25.451 335 2HD ARG 44 HD1 ARG 44 -1.143 -8.524 23.778 336 HE ARG 44 HE ARG 44 -2.841 -10.643 23.779 337 1HH1 ARG 44 HH11 ARG 44 -3.229 -7.279 24.794 338 2HH1 ARG 44 HH12 ARG 44 -4.888 -7.230 24.414 339 1HH2 ARG 44 HH21 ARG 44 -5.080 -10.553 23.235 340 2HH2 ARG 44 HH22 ARG 44 -5.972 -9.136 23.506 341 H GLU 45 HN GLU 45 -0.858 -14.230 23.535 342 HA GLU 45 HA GLU 45 -1.135 -14.643 26.360 343 1HB GLU 45 HB2 GLU 45 -2.493 -15.992 24.046 344 2HB GLU 45 HB1 GLU 45 -2.804 -16.371 25.739 345 1HG GLU 45 HG2 GLU 45 -3.438 -14.002 26.105 346 2HG GLU 45 HG1 GLU 45 -3.244 -13.726 24.379 347 H LYS 46 HN LYS 46 1.233 -15.551 24.360 348 HA LYS 46 HA LYS 46 1.607 -18.300 24.941 349 1HB LYS 46 HB2 LYS 46 2.960 -16.974 23.195 350 2HB LYS 46 HB1 LYS 46 3.687 -16.142 24.521 351 1HG LYS 46 HG2 LYS 46 5.173 -17.838 23.636 352 2HG LYS 46 HG1 LYS 46 4.748 -18.169 25.312 353 1HD LYS 46 HD2 LYS 46 3.115 -19.825 24.586 354 2HD LYS 46 HD1 LYS 46 3.480 -19.460 22.897 355 1HE LYS 46 HE2 LYS 46 5.780 -20.215 23.236 356 2HE LYS 46 HE1 LYS 46 5.420 -20.552 24.928 357 1HZ LYS 46 HZ1 LYS 46 3.836 -22.209 24.241 358 2HZ LYS 46 HZ2 LYS 46 5.339 -22.535 23.557 359 3HZ LYS 46 HZ3 LYS 46 4.124 -21.880 22.608 360 H GLU 47 HN GLU 47 1.653 -19.041 27.021 361 HA GLU 47 HA GLU 47 2.249 -17.219 29.056 362 1HB GLU 47 HB2 GLU 47 1.842 -19.052 30.659 363 2HB GLU 47 HB1 GLU 47 0.516 -18.667 29.581 364 1HG GLU 47 HG2 GLU 47 1.039 -20.652 28.246 365 2HG GLU 47 HG1 GLU 47 2.432 -20.981 29.276 366 H ASN 48 HN ASN 48 3.821 -16.980 30.281 367 HA ASN 48 HA ASN 48 5.970 -16.750 30.873 368 1HB ASN 48 HB2 ASN 48 5.360 -18.719 32.238 369 2HB ASN 48 HB1 ASN 48 5.922 -19.778 30.946 370 1HD2 ASN 48 HD21 ASN 48 7.429 -20.725 32.341 371 2HD2 ASN 48 HD22 ASN 48 8.889 -19.919 32.803 372 H GLY 49 HN GLY 49 6.709 -15.784 28.984 373 1HA GLY 49 HA2 GLY 49 8.935 -17.112 27.871 374 2HA GLY 49 HA1 GLY 49 7.596 -17.065 26.735 375 HA PRO 50 HA PRO 50 10.082 -13.138 26.009 376 1HB PRO 50 HB2 PRO 50 9.237 -13.956 23.290 377 2HB PRO 50 HB1 PRO 50 10.829 -13.462 23.844 378 1HG PRO 50 HG2 PRO 50 10.373 -15.961 23.272 379 2HG PRO 50 HG1 PRO 50 11.300 -15.572 24.740 380 1HD PRO 50 HD2 PRO 50 8.414 -16.322 24.452 381 2HD PRO 50 HD1 PRO 50 9.622 -16.943 25.600 382 H LYS 51 HN LYS 51 7.586 -13.007 26.963 383 HA LYS 51 HA LYS 51 5.529 -12.194 25.221 384 1HB LYS 51 HB2 LYS 51 5.101 -12.993 27.477 385 2HB LYS 51 HB1 LYS 51 5.912 -11.595 28.151 386 1HG LYS 51 HG2 LYS 51 4.169 -10.154 27.133 387 2HG LYS 51 HG1 LYS 51 3.337 -11.606 26.585 388 1HD LYS 51 HD2 LYS 51 3.106 -12.359 28.900 389 2HD LYS 51 HD1 LYS 51 3.960 -10.918 29.457 390 1HE LYS 51 HE2 LYS 51 2.182 -9.523 28.470 391 2HE LYS 51 HE1 LYS 51 1.326 -10.987 27.990 392 1HZ LYS 51 HZ1 LYS 51 1.964 -10.173 30.766 393 2HZ LYS 51 HZ2 LYS 51 1.185 -11.595 30.332 394 3HZ LYS 51 HZ3 LYS 51 0.444 -10.106 30.041 395 H THR 52 HN THR 52 8.130 -10.300 26.738 396 HA THR 52 HA THR 52 7.055 -8.000 25.316 397 HB THR 52 HB THR 52 7.666 -6.519 27.094 398 HG1 THR 52 HG1 THR 52 7.855 -8.780 28.825 399 1HG2 THR 52 HG21 THR 52 5.831 -7.095 28.684 400 2HG2 THR 52 HG22 THR 52 5.753 -8.699 27.958 401 3HG2 THR 52 HG23 THR 52 5.358 -7.277 26.993 402 H VAL 53 HN VAL 53 8.661 -6.131 25.415 403 HA VAL 53 HA VAL 53 10.722 -6.659 23.671 404 HB VAL 53 HB VAL 53 9.656 -4.506 23.827 405 1HG1 VAL 53 HG11 VAL 53 9.314 -4.331 26.234 406 2HG1 VAL 53 HG12 VAL 53 10.138 -2.895 25.628 407 3HG1 VAL 53 HG13 VAL 53 11.049 -4.143 26.479 408 1HG2 VAL 53 HG21 VAL 53 11.837 -4.485 22.824 409 2HG2 VAL 53 HG22 VAL 53 12.607 -4.301 24.398 410 3HG2 VAL 53 HG23 VAL 53 11.616 -2.992 23.740 411 H LYS 54 HN LYS 54 10.980 -6.384 27.184 412 HA LYS 54 HA LYS 54 13.853 -6.321 27.112 413 1HB LYS 54 HB2 LYS 54 12.007 -6.853 29.426 414 2HB LYS 54 HB1 LYS 54 13.725 -6.520 29.536 415 1HG LYS 54 HG2 LYS 54 13.353 -4.278 28.653 416 2HG LYS 54 HG1 LYS 54 11.631 -4.613 28.510 417 1HD LYS 54 HD2 LYS 54 11.554 -5.055 30.939 418 2HD LYS 54 HD1 LYS 54 13.247 -4.587 31.056 419 1HE LYS 54 HE2 LYS 54 11.812 -2.738 31.697 420 2HE LYS 54 HE1 LYS 54 12.659 -2.355 30.199 421 1HZ LYS 54 HZ1 LYS 54 10.330 -1.733 30.118 422 2HZ LYS 54 HZ2 LYS 54 9.839 -3.325 30.355 423 3HZ LYS 54 HZ3 LYS 54 10.660 -2.888 28.959 424 H GLU 55 HN GLU 55 11.448 -8.785 27.182 425 HA GLU 55 HA GLU 55 13.234 -10.721 28.400 426 1HB GLU 55 HB2 GLU 55 10.474 -11.186 27.291 427 2HB GLU 55 HB1 GLU 55 11.370 -12.240 28.378 428 1HG GLU 55 HG2 GLU 55 10.204 -9.538 28.981 429 2HG GLU 55 HG1 GLU 55 9.719 -11.096 29.638 430 H VAL 56 HN VAL 56 12.185 -9.821 25.253 431 HA VAL 56 HA VAL 56 13.245 -12.291 24.168 432 HB VAL 56 HB VAL 56 11.089 -11.552 23.232 433 1HG1 VAL 56 HG11 VAL 56 10.866 -9.560 21.840 434 2HG1 VAL 56 HG12 VAL 56 12.501 -9.073 22.283 435 3HG1 VAL 56 HG13 VAL 56 11.248 -9.166 23.517 436 1HG2 VAL 56 HG21 VAL 56 13.321 -11.334 21.219 437 2HG2 VAL 56 HG22 VAL 56 11.621 -11.640 20.855 438 3HG2 VAL 56 HG23 VAL 56 12.549 -12.824 21.774 439 H LYS 57 HN LYS 57 15.291 -12.432 23.569 440 HA LYS 57 HA LYS 57 16.778 -9.956 23.164 441 1HB LYS 57 HB2 LYS 57 17.664 -12.684 24.062 442 2HB LYS 57 HB1 LYS 57 18.742 -11.316 23.799 443 1HG LYS 57 HG2 LYS 57 17.625 -10.079 25.565 444 2HG LYS 57 HG1 LYS 57 16.482 -11.402 25.787 445 1HD LYS 57 HD2 LYS 57 18.333 -12.869 26.449 446 2HD LYS 57 HD1 LYS 57 19.464 -11.530 26.223 447 1HE LYS 57 HE2 LYS 57 18.325 -10.255 27.958 448 2HE LYS 57 HE1 LYS 57 17.147 -11.546 28.144 449 1HZ LYS 57 HZ1 LYS 57 18.852 -11.639 29.854 450 2HZ LYS 57 HZ2 LYS 57 20.061 -11.829 28.690 451 3HZ LYS 57 HZ3 LYS 57 18.871 -13.010 28.888 452 H LEU 58 HN LEU 58 17.642 -9.560 21.248 453 HA LEU 58 HA LEU 58 17.596 -11.675 19.239 454 1HB LEU 58 HB2 LEU 58 17.677 -8.657 18.889 455 2HB LEU 58 HB1 LEU 58 17.843 -9.791 17.572 456 HG LEU 58 HG LEU 58 15.615 -8.886 17.523 457 1HD1 LEU 58 HD11 LEU 58 15.791 -11.198 16.920 458 2HD1 LEU 58 HD12 LEU 58 14.245 -10.854 17.687 459 3HD1 LEU 58 HD13 LEU 58 15.517 -11.676 18.596 460 1HD2 LEU 58 HD21 LEU 58 15.416 -8.141 19.829 461 2HD2 LEU 58 HD22 LEU 58 15.313 -9.815 20.377 462 3HD2 LEU 58 HD23 LEU 58 14.032 -9.137 19.369 463 H ILE 59 HN ILE 59 19.379 -12.333 18.278 464 HA ILE 59 HA ILE 59 21.977 -11.097 18.945 465 HB ILE 59 HB ILE 59 21.126 -13.983 18.895 466 1HG1 ILE 59 HG12 ILE 59 20.958 -12.586 20.988 467 2HG1 ILE 59 HG11 ILE 59 21.902 -14.083 21.153 468 1HG2 ILE 59 HG21 ILE 59 23.148 -13.872 17.593 469 2HG2 ILE 59 HG22 ILE 59 23.507 -14.613 19.153 470 3HG2 ILE 59 HG23 ILE 59 23.946 -12.935 18.849 471 1HD1 ILE 59 HD11 ILE 59 22.902 -11.257 20.872 472 2HD1 ILE 59 HD12 ILE 59 23.916 -12.694 20.906 473 3HD1 ILE 59 HD13 ILE 59 22.949 -12.276 22.318 474 H SER 60 HN SER 60 22.895 -10.367 17.191 475 HA SER 60 HA SER 60 22.653 -11.958 14.755 476 1HB SER 60 HB2 SER 60 22.990 -9.866 13.502 477 2HB SER 60 HB1 SER 60 21.596 -9.746 14.548 478 HG SER 60 HG SER 60 24.062 -8.915 15.553 479 H ALA 61 HN ALA 61 24.477 -13.067 14.483 480 HA ALA 61 HA ALA 61 26.640 -13.652 14.339 481 1HB ALA 61 HB1 ALA 61 28.341 -11.966 13.916 482 2HB ALA 61 HB2 ALA 61 27.267 -10.697 14.506 483 3HB ALA 61 HB3 ALA 61 26.874 -11.562 13.019 484 H GLY 62 HN GLY 62 25.296 -13.085 16.917 485 1HA GLY 62 HA2 GLY 62 26.038 -13.939 19.030 486 2HA GLY 62 HA1 GLY 62 27.675 -13.480 18.597 487 H LYS 63 HN LYS 63 25.791 -10.889 17.779 488 HA LYS 63 HA LYS 63 26.491 -9.630 20.313 489 1HB LYS 63 HB2 LYS 63 27.598 -8.851 18.148 490 2HB LYS 63 HB1 LYS 63 26.028 -8.281 17.629 491 1HG LYS 63 HG2 LYS 63 27.440 -7.280 20.107 492 2HG LYS 63 HG1 LYS 63 27.596 -6.526 18.529 493 1HD LYS 63 HD2 LYS 63 25.247 -5.993 18.514 494 2HD LYS 63 HD1 LYS 63 24.992 -6.913 19.993 495 1HE LYS 63 HE2 LYS 63 25.061 -4.530 20.476 496 2HE LYS 63 HE1 LYS 63 26.421 -5.358 21.219 497 1HZ LYS 63 HZ1 LYS 63 26.518 -3.725 18.726 498 2HZ LYS 63 HZ2 LYS 63 27.828 -4.537 19.383 499 3HZ LYS 63 HZ3 LYS 63 27.082 -3.296 20.246 500 H VAL 64 HN VAL 64 24.871 -8.976 21.616 501 HA VAL 64 HA VAL 64 22.112 -9.354 20.990 502 HB VAL 64 HB VAL 64 23.273 -7.640 23.206 503 1HG1 VAL 64 HG11 VAL 64 21.158 -8.085 24.386 504 2HG1 VAL 64 HG12 VAL 64 20.569 -8.951 22.966 505 3HG1 VAL 64 HG13 VAL 64 20.919 -7.226 22.865 506 1HG2 VAL 64 HG21 VAL 64 23.071 -9.584 24.684 507 2HG2 VAL 64 HG22 VAL 64 24.175 -9.928 23.349 508 3HG2 VAL 64 HG23 VAL 64 22.527 -10.558 23.324 509 H LEU 65 HN LEU 65 20.949 -8.008 19.718 510 HA LEU 65 HA LEU 65 21.866 -5.587 18.730 511 1HB LEU 65 HB2 LEU 65 19.117 -6.773 18.837 512 2HB LEU 65 HB1 LEU 65 19.479 -5.258 18.060 513 HG LEU 65 HG LEU 65 19.248 -6.984 16.477 514 1HD1 LEU 65 HD11 LEU 65 20.803 -5.251 15.921 515 2HD1 LEU 65 HD12 LEU 65 21.341 -6.787 15.245 516 3HD1 LEU 65 HD13 LEU 65 22.117 -6.144 16.689 517 1HD2 LEU 65 HD21 LEU 65 20.799 -8.862 16.286 518 2HD2 LEU 65 HD22 LEU 65 19.848 -8.924 17.772 519 3HD2 LEU 65 HD23 LEU 65 21.528 -8.395 17.818 520 H GLU 66 HN GLU 66 21.822 -3.649 19.432 521 HA GLU 66 HA GLU 66 20.619 -2.979 21.983 522 1HB GLU 66 HB2 GLU 66 22.915 -2.160 20.963 523 2HB GLU 66 HB1 GLU 66 21.923 -1.020 20.078 524 1HG GLU 66 HG2 GLU 66 22.221 -1.228 23.070 525 2HG GLU 66 HG1 GLU 66 22.864 0.033 22.034 526 H ASN 67 HN ASN 67 18.644 -2.002 22.124 527 HA ASN 67 HA ASN 67 16.877 -2.221 19.977 528 1HB ASN 67 HB2 ASN 67 15.140 -1.248 21.378 529 2HB ASN 67 HB1 ASN 67 16.085 -2.430 22.268 530 1HD2 ASN 67 HD21 ASN 67 17.285 -1.753 24.040 531 2HD2 ASN 67 HD22 ASN 67 17.181 -0.152 24.657 532 H SER 68 HN SER 68 18.737 0.613 20.917 533 HA SER 68 HA SER 68 16.900 2.262 19.420 534 1HB SER 68 HB2 SER 68 19.339 3.010 21.019 535 2HB SER 68 HB1 SER 68 18.207 4.151 20.285 536 HG SER 68 HG SER 68 17.120 2.156 21.912 537 H LYS 69 HN LYS 69 19.265 0.280 18.387 538 HA LYS 69 HA LYS 69 20.233 2.170 16.435 539 1HB LYS 69 HB2 LYS 69 21.153 -0.557 17.235 540 2HB LYS 69 HB1 LYS 69 21.703 0.247 15.782 541 1HG LYS 69 HG2 LYS 69 22.118 1.104 18.634 542 2HG LYS 69 HG1 LYS 69 23.351 0.608 17.467 543 1HD LYS 69 HD2 LYS 69 22.544 2.590 16.046 544 2HD LYS 69 HD1 LYS 69 21.721 3.138 17.504 545 1HE LYS 69 HE2 LYS 69 23.825 4.253 17.389 546 2HE LYS 69 HE1 LYS 69 23.926 3.049 18.667 547 1HZ LYS 69 HZ1 LYS 69 25.125 1.573 17.189 548 2HZ LYS 69 HZ2 LYS 69 25.879 3.087 17.181 549 3HZ LYS 69 HZ3 LYS 69 24.872 2.640 15.908 550 H THR 70 HN THR 70 20.470 1.268 14.147 551 HA THR 70 HA THR 70 17.901 0.177 13.377 552 HB THR 70 HB THR 70 18.515 1.047 11.216 553 HG1 THR 70 HG1 THR 70 20.918 1.942 12.499 554 1HG2 THR 70 HG21 THR 70 17.349 2.560 12.734 555 2HG2 THR 70 HG22 THR 70 18.488 3.457 11.728 556 3HG2 THR 70 HG23 THR 70 18.894 3.080 13.403 557 H VAL 71 HN VAL 71 18.057 -1.180 11.374 558 HA VAL 71 HA VAL 71 19.699 -3.447 11.726 559 HB VAL 71 HB VAL 71 18.368 -2.490 9.165 560 1HG1 VAL 71 HG11 VAL 71 20.012 -4.231 8.740 561 2HG1 VAL 71 HG12 VAL 71 18.381 -4.849 8.488 562 3HG1 VAL 71 HG13 VAL 71 19.262 -5.258 9.961 563 1HG2 VAL 71 HG21 VAL 71 17.281 -4.313 11.310 564 2HG2 VAL 71 HG22 VAL 71 16.488 -3.952 9.776 565 3HG2 VAL 71 HG23 VAL 71 16.736 -2.673 10.964 566 H LYS 72 HN LYS 72 19.939 -0.557 9.800 567 HA LYS 72 HA LYS 72 22.190 -1.073 8.257 568 1HB LYS 72 HB2 LYS 72 20.726 0.811 7.817 569 2HB LYS 72 HB1 LYS 72 21.110 1.515 9.376 570 1HG LYS 72 HG2 LYS 72 23.416 1.876 8.629 571 2HG LYS 72 HG1 LYS 72 22.994 1.205 7.051 572 1HD LYS 72 HD2 LYS 72 21.389 2.967 6.683 573 2HD LYS 72 HD1 LYS 72 21.661 3.596 8.311 574 1HE LYS 72 HE2 LYS 72 23.964 4.097 7.740 575 2HE LYS 72 HE1 LYS 72 23.721 3.451 6.116 576 1HZ LYS 72 HZ1 LYS 72 22.264 5.777 7.256 577 2HZ LYS 72 HZ2 LYS 72 22.157 5.203 5.667 578 3HZ LYS 72 HZ3 LYS 72 23.589 5.873 6.221 579 H ASP 73 HN ASP 73 21.988 -0.022 11.644 580 HA ASP 73 HA ASP 73 24.637 0.754 11.954 581 1HB ASP 73 HB2 ASP 73 22.552 -0.280 13.814 582 2HB ASP 73 HB1 ASP 73 24.179 -0.009 14.394 583 H TYR 74 HN TYR 74 23.259 -2.438 11.677 584 HA TYR 74 HA TYR 74 25.798 -3.604 12.531 585 1HB TYR 74 HB2 TYR 74 23.065 -4.853 12.264 586 2HB TYR 74 HB1 TYR 74 24.516 -5.614 12.907 587 HD1 TYR 74 HD1 TYR 74 21.901 -3.135 13.525 588 HD2 TYR 74 HD2 TYR 74 25.286 -5.100 15.179 589 HE1 TYR 74 HE1 TYR 74 21.309 -2.261 15.726 590 HE2 TYR 74 HE2 TYR 74 24.699 -4.221 17.405 591 HH TYR 74 HH TYR 74 21.657 -2.655 17.956 592 H ARG 75 HN ARG 75 23.931 -2.838 9.731 593 HA ARG 75 HA ARG 75 25.202 -4.910 8.181 594 1HB ARG 75 HB2 ARG 75 22.492 -3.709 8.187 595 2HB ARG 75 HB1 ARG 75 23.155 -4.507 6.783 596 1HG ARG 75 HG2 ARG 75 22.763 -5.750 9.510 597 2HG ARG 75 HG1 ARG 75 21.701 -5.981 8.114 598 1HD ARG 75 HD2 ARG 75 23.546 -6.902 6.854 599 2HD ARG 75 HD1 ARG 75 24.617 -6.663 8.224 600 HE ARG 75 HE ARG 75 22.732 -8.239 9.271 601 1HH1 ARG 75 HH11 ARG 75 24.625 -8.447 6.307 602 2HH1 ARG 75 HH12 ARG 75 24.653 -10.146 6.231 603 1HH2 ARG 75 HH21 ARG 75 22.812 -10.641 9.221 604 2HH2 ARG 75 HH22 ARG 75 23.607 -11.411 7.923 605 H SER 76 HN SER 76 25.119 -4.250 5.796 606 HA SER 76 HA SER 76 25.771 -1.453 5.522 607 1HB SER 76 HB2 SER 76 26.618 -3.901 3.975 608 2HB SER 76 HB1 SER 76 27.089 -2.238 3.612 609 HG SER 76 HG SER 76 27.571 -2.617 6.145 610 HA PRO 77 HA PRO 77 22.171 -1.154 2.849 611 1HB PRO 77 HB2 PRO 77 23.875 0.412 0.983 612 2HB PRO 77 HB1 PRO 77 22.367 0.881 1.775 613 1HG PRO 77 HG2 PRO 77 24.689 1.909 2.571 614 2HG PRO 77 HG1 PRO 77 23.432 1.484 3.746 615 1HD PRO 77 HD2 PRO 77 25.915 -0.004 3.007 616 2HD PRO 77 HD1 PRO 77 25.196 0.265 4.614 617 H VAL 78 HN VAL 78 21.434 -2.495 1.299 618 HA VAL 78 HA VAL 78 23.375 -4.114 -0.041 619 HB VAL 78 HB VAL 78 21.333 -5.194 0.845 620 1HG1 VAL 78 HG11 VAL 78 19.697 -3.493 0.487 621 2HG1 VAL 78 HG12 VAL 78 19.175 -4.983 -0.302 622 3HG1 VAL 78 HG13 VAL 78 19.840 -3.663 -1.261 623 1HG2 VAL 78 HG21 VAL 78 20.781 -6.597 -1.101 624 2HG2 VAL 78 HG22 VAL 78 22.516 -6.330 -0.930 625 3HG2 VAL 78 HG23 VAL 78 21.601 -5.433 -2.142 626 H SER 79 HN SER 79 21.207 -1.699 -0.869 627 HA SER 79 HA SER 79 20.907 -0.318 -2.684 628 1HB SER 79 HB2 SER 79 23.818 -0.953 -3.148 629 2HB SER 79 HB1 SER 79 22.951 0.458 -3.768 630 HG SER 79 HG SER 79 22.482 0.882 -1.432 631 H ASN 80 HN ASN 80 20.549 -3.123 -3.037 632 HA ASN 80 HA ASN 80 20.206 -3.218 -5.929 633 1HB ASN 80 HB2 ASN 80 21.740 -5.357 -4.396 634 2HB ASN 80 HB1 ASN 80 21.097 -5.604 -6.012 635 1HD2 ASN 80 HD21 ASN 80 23.577 -4.109 -4.098 636 2HD2 ASN 80 HD22 ASN 80 24.572 -3.616 -5.411 637 H LEU 81 HN LEU 81 19.236 -5.981 -6.042 638 HA LEU 81 HA LEU 81 16.782 -5.759 -4.870 639 1HB LEU 81 HB2 LEU 81 18.343 -8.037 -5.927 640 2HB LEU 81 HB1 LEU 81 16.640 -7.984 -5.643 641 HG LEU 81 HG LEU 81 18.044 -6.280 -7.705 642 1HD1 LEU 81 HD11 LEU 81 16.323 -8.729 -8.061 643 2HD1 LEU 81 HD12 LEU 81 18.064 -8.636 -8.333 644 3HD1 LEU 81 HD13 LEU 81 16.962 -7.716 -9.354 645 1HD2 LEU 81 HD21 LEU 81 16.029 -5.233 -6.810 646 2HD2 LEU 81 HD22 LEU 81 15.111 -6.704 -7.134 647 3HD2 LEU 81 HD23 LEU 81 15.777 -5.769 -8.471 648 H ALA 82 HN ALA 82 16.032 -7.606 -3.441 649 HA ALA 82 HA ALA 82 18.063 -8.386 -1.622 650 1HB ALA 82 HB1 ALA 82 16.844 -7.656 0.362 651 2HB ALA 82 HB2 ALA 82 15.578 -6.987 -0.663 652 3HB ALA 82 HB3 ALA 82 17.200 -6.299 -0.707 653 H GLY 83 HN GLY 83 17.784 -10.416 -2.393 654 1HA GLY 83 HA2 GLY 83 15.266 -11.740 -1.678 655 2HA GLY 83 HA1 GLY 83 16.466 -12.375 -2.809 656 H ALA 84 HN ALA 84 18.356 -11.186 -0.629 657 HA ALA 84 HA ALA 84 18.839 -13.720 0.637 658 1HB ALA 84 HB1 ALA 84 20.219 -11.056 1.000 659 2HB ALA 84 HB2 ALA 84 20.708 -12.321 -0.126 660 3HB ALA 84 HB3 ALA 84 20.791 -12.606 1.615 661 H VAL 85 HN VAL 85 17.894 -14.324 2.439 662 HA VAL 85 HA VAL 85 16.540 -12.336 4.058 663 HB VAL 85 HB VAL 85 16.467 -15.347 4.258 664 1HG1 VAL 85 HG11 VAL 85 15.874 -14.253 6.346 665 2HG1 VAL 85 HG12 VAL 85 14.466 -15.026 5.621 666 3HG1 VAL 85 HG13 VAL 85 14.666 -13.275 5.510 667 1HG2 VAL 85 HG21 VAL 85 14.263 -15.201 3.180 668 2HG2 VAL 85 HG22 VAL 85 15.555 -14.632 2.128 669 3HG2 VAL 85 HG23 VAL 85 14.503 -13.471 2.938 670 H THR 86 HN THR 86 17.172 -11.798 5.993 671 HA THR 86 HA THR 86 19.767 -12.626 6.938 672 HB THR 86 HB THR 86 17.783 -10.671 8.099 673 HG1 THR 86 HG1 THR 86 18.214 -9.832 6.166 674 1HG2 THR 86 HG21 THR 86 19.777 -9.652 9.136 675 2HG2 THR 86 HG22 THR 86 20.784 -10.904 8.415 676 3HG2 THR 86 HG23 THR 86 19.585 -11.333 9.636 677 H THR 87 HN THR 87 19.973 -14.170 8.519 678 HA THR 87 HA THR 87 17.537 -15.020 9.879 679 HB THR 87 HB THR 87 20.300 -16.284 9.905 680 HG1 THR 87 HG1 THR 87 18.813 -16.110 7.859 681 1HG2 THR 87 HG21 THR 87 17.578 -17.382 10.660 682 2HG2 THR 87 HG22 THR 87 18.840 -16.922 11.800 683 3HG2 THR 87 HG23 THR 87 19.096 -18.279 10.702 684 H MET 88 HN MET 88 17.145 -14.114 11.810 685 HA MET 88 HA MET 88 19.367 -12.987 13.361 686 1HB MET 88 HB2 MET 88 17.443 -11.510 12.744 687 2HB MET 88 HB1 MET 88 16.376 -12.592 13.611 688 1HG MET 88 HG2 MET 88 16.858 -10.649 14.948 689 2HG MET 88 HG1 MET 88 17.567 -12.084 15.701 690 1HE MET 88 HE1 MET 88 18.873 -10.003 12.594 691 2HE MET 88 HE2 MET 88 19.932 -8.851 13.410 692 3HE MET 88 HE3 MET 88 18.193 -8.796 13.684 693 H HIS 89 HN HIS 89 19.776 -13.831 15.417 694 HA HIS 89 HA HIS 89 18.324 -16.297 15.972 695 1HB HIS 89 HB2 HIS 89 20.825 -16.322 15.869 696 2HB HIS 89 HB1 HIS 89 20.859 -15.261 17.264 697 HD1 HIS 89 HD1 HIS 89 21.288 -16.547 19.391 698 HD2 HIS 89 HD2 HIS 89 19.220 -18.812 16.585 699 HE1 HIS 89 HE1 HIS 89 20.935 -18.749 20.446 700 HE2 HIS 89 HE2 HIS 89 19.990 -20.184 18.608 701 H VAL 90 HN VAL 90 16.941 -16.428 17.541 702 HA VAL 90 HA VAL 90 16.646 -14.167 19.452 703 HB VAL 90 HB VAL 90 14.599 -16.251 18.677 704 1HG1 VAL 90 HG11 VAL 90 12.986 -14.722 19.703 705 2HG1 VAL 90 HG12 VAL 90 14.308 -13.634 20.124 706 3HG1 VAL 90 HG13 VAL 90 14.231 -15.243 20.845 707 1HG2 VAL 90 HG21 VAL 90 15.074 -14.955 16.696 708 2HG2 VAL 90 HG22 VAL 90 14.869 -13.454 17.599 709 3HG2 VAL 90 HG23 VAL 90 13.488 -14.522 17.339 710 H ILE 91 HN ILE 91 17.000 -14.451 21.369 711 HA ILE 91 HA ILE 91 17.434 -17.153 22.366 712 HB ILE 91 HB ILE 91 18.219 -14.438 23.223 713 1HG1 ILE 91 HG12 ILE 91 19.843 -16.863 22.471 714 2HG1 ILE 91 HG11 ILE 91 19.681 -15.352 21.586 715 1HG2 ILE 91 HG21 ILE 91 18.579 -17.017 24.824 716 2HG2 ILE 91 HG22 ILE 91 17.603 -15.617 25.287 717 3HG2 ILE 91 HG23 ILE 91 19.359 -15.490 25.246 718 1HD1 ILE 91 HD11 ILE 91 21.848 -15.530 22.691 719 2HD1 ILE 91 HD12 ILE 91 21.044 -15.697 24.250 720 3HD1 ILE 91 HD13 ILE 91 20.909 -14.189 23.346 721 H ILE 92 HN ILE 92 15.921 -18.068 23.316 722 HA ILE 92 HA ILE 92 13.627 -16.569 24.232 723 HB ILE 92 HB ILE 92 14.098 -19.551 24.034 724 1HG1 ILE 92 HG12 ILE 92 14.092 -18.489 21.830 725 2HG1 ILE 92 HG11 ILE 92 12.645 -19.464 22.054 726 1HG2 ILE 92 HG21 ILE 92 11.680 -19.763 24.306 727 2HG2 ILE 92 HG22 ILE 92 11.565 -18.014 24.545 728 3HG2 ILE 92 HG23 ILE 92 12.440 -19.010 25.715 729 1HD1 ILE 92 HD11 ILE 92 11.365 -17.461 22.515 730 2HD1 ILE 92 HD12 ILE 92 12.138 -17.365 20.937 731 3HD1 ILE 92 HD13 ILE 92 12.801 -16.463 22.300 732 H GLN 93 HN GLN 93 14.069 -15.663 26.146 733 HA GLN 93 HA GLN 93 14.517 -17.593 28.278 734 1HB GLN 93 HB2 GLN 93 15.643 -14.803 28.106 735 2HB GLN 93 HB1 GLN 93 15.662 -15.767 29.581 736 1HG GLN 93 HG2 GLN 93 17.001 -17.465 28.434 737 2HG GLN 93 HG1 GLN 93 17.002 -16.482 26.976 738 1HE2 GLN 93 HE21 GLN 93 19.218 -17.434 28.515 739 2HE2 GLN 93 HE22 GLN 93 20.091 -16.042 29.058 740 H ALA 94 HN ALA 94 12.791 -17.827 29.306 741 HA ALA 94 HA ALA 94 10.705 -15.891 29.205 742 1HB ALA 94 HB1 ALA 94 10.844 -18.535 30.630 743 2HB ALA 94 HB2 ALA 94 10.277 -18.291 28.984 744 3HB ALA 94 HB3 ALA 94 9.391 -17.581 30.339 745 HA PRO 95 HA PRO 95 11.524 -13.906 33.167 746 1HB PRO 95 HB2 PRO 95 8.610 -13.719 33.489 747 2HB PRO 95 HB1 PRO 95 9.798 -12.429 33.342 748 1HG PRO 95 HG2 PRO 95 8.080 -12.944 31.363 749 2HG PRO 95 HG1 PRO 95 9.755 -12.436 31.066 750 1HD PRO 95 HD2 PRO 95 8.558 -15.167 30.896 751 2HD PRO 95 HD1 PRO 95 9.714 -14.355 29.822 752 H VAL 96 HN VAL 96 10.349 -13.919 35.384 753 HA VAL 96 HA VAL 96 10.723 -16.578 36.331 754 HB VAL 96 HB VAL 96 9.776 -14.173 37.848 755 1HG1 VAL 96 HG11 VAL 96 10.945 -16.783 38.826 756 2HG1 VAL 96 HG12 VAL 96 9.277 -16.248 39.034 757 3HG1 VAL 96 HG13 VAL 96 10.586 -15.393 39.852 758 1HG2 VAL 96 HG21 VAL 96 11.939 -13.751 36.852 759 2HG2 VAL 96 HG22 VAL 96 12.552 -15.276 37.480 760 3HG2 VAL 96 HG23 VAL 96 12.129 -13.974 38.592 761 H THR 97 HN THR 97 9.269 -18.047 36.118 762 HA THR 97 HA THR 97 6.732 -17.772 37.418 763 HB THR 97 HB THR 97 6.915 -18.753 34.527 764 HG1 THR 97 HG1 THR 97 6.648 -16.355 35.445 765 1HG2 THR 97 HG21 THR 97 4.522 -18.561 36.381 766 2HG2 THR 97 HG22 THR 97 5.305 -20.058 35.881 767 3HG2 THR 97 HG23 THR 97 4.473 -19.057 34.689 768 H GLU 98 HN GLU 98 7.034 -19.244 38.868 769 HA GLU 98 HA GLU 98 8.862 -21.436 38.264 770 1HB GLU 98 HB2 GLU 98 9.444 -19.913 40.030 771 2HB GLU 98 HB1 GLU 98 7.941 -20.262 40.854 772 1HG GLU 98 HG2 GLU 98 8.653 -22.532 41.245 773 2HG GLU 98 HG1 GLU 98 10.142 -22.234 40.335 774 H LYS 99 HN LYS 99 5.853 -21.041 40.251 775 HA LYS 99 HA LYS 99 4.918 -23.455 39.142 776 1HB LYS 99 HB2 LYS 99 6.362 -24.156 41.078 777 2HB LYS 99 HB1 LYS 99 5.314 -23.232 42.142 778 1HG LYS 99 HG2 LYS 99 3.442 -24.691 41.586 779 2HG LYS 99 HG1 LYS 99 4.475 -25.596 40.481 780 1HD LYS 99 HD2 LYS 99 5.932 -26.183 42.366 781 2HD LYS 99 HD1 LYS 99 4.844 -25.319 43.449 782 1HE LYS 99 HE2 LYS 99 4.407 -27.719 43.492 783 2HE LYS 99 HE1 LYS 99 3.027 -26.820 42.867 784 1HZ LYS 99 HZ1 LYS 99 5.023 -28.241 41.162 785 2HZ LYS 99 HZ2 LYS 99 3.627 -27.473 40.628 786 3HZ LYS 99 HZ3 LYS 99 3.510 -28.835 41.590 787 H GLU 100 HN GLU 100 4.294 -20.761 39.092 788 HA GLU 100 HA GLU 100 2.129 -20.200 40.827 789 1HB GLU 100 HB2 GLU 100 3.157 -18.741 38.393 790 2HB GLU 100 HB1 GLU 100 1.804 -18.172 39.350 791 1HG GLU 100 HG2 GLU 100 3.794 -16.970 39.998 792 2HG GLU 100 HG1 GLU 100 3.302 -18.010 41.322 793 H LYS 101 HN LYS 101 0.654 -21.634 40.655 794 HA LYS 101 HA LYS 101 -1.177 -21.585 38.446 795 1HB LYS 101 HB2 LYS 101 0.497 -23.423 37.896 796 2HB LYS 101 HB1 LYS 101 0.144 -24.157 39.435 797 1HG LYS 101 HG2 LYS 101 -1.914 -23.834 37.236 798 2HG LYS 101 HG1 LYS 101 -0.904 -25.261 37.421 799 1HD LYS 101 HD2 LYS 101 -1.867 -25.619 39.663 800 2HD LYS 101 HD1 LYS 101 -2.890 -24.200 39.440 801 1HE LYS 101 HE2 LYS 101 -3.958 -25.305 37.515 802 2HE LYS 101 HE1 LYS 101 -2.929 -26.714 37.771 803 1HZ LYS 101 HZ1 LYS 101 -5.121 -27.045 38.758 804 2HZ LYS 101 HZ2 LYS 101 -4.955 -25.673 39.682 805 3HZ LYS 101 HZ3 LYS 101 -3.957 -26.991 39.972 Start of MODEL 20 1 H GLU 1 HT1 GLU 1 1.016 -14.492 -0.991 2 HA GLU 1 HA GLU 1 0.350 -12.239 -1.473 3 1HB GLU 1 HB2 GLU 1 2.729 -12.292 0.366 4 2HB GLU 1 HB1 GLU 1 1.467 -11.077 0.344 5 1HG GLU 1 HG2 GLU 1 -0.139 -12.758 1.077 6 2HG GLU 1 HG1 GLU 1 1.146 -13.969 1.110 7 H ALA 2 HN ALA 2 1.052 -10.066 -1.896 8 HA ALA 2 HA ALA 2 3.482 -10.000 -3.523 9 1HB ALA 2 HB1 ALA 2 2.425 -8.178 -4.765 10 2HB ALA 2 HB2 ALA 2 1.009 -8.286 -3.721 11 3HB ALA 2 HB3 ALA 2 1.415 -9.626 -4.793 12 H GLU 3 HN GLU 3 5.009 -8.463 -3.075 13 HA GLU 3 HA GLU 3 4.544 -6.058 -1.805 14 1HB GLU 3 HB2 GLU 3 4.602 -8.036 0.082 15 2HB GLU 3 HB1 GLU 3 6.322 -7.730 -0.078 16 1HG GLU 3 HG2 GLU 3 4.239 -5.666 0.646 17 2HG GLU 3 HG1 GLU 3 5.280 -6.488 1.788 18 H VAL 4 HN VAL 4 6.490 -4.840 -1.979 19 HA VAL 4 HA VAL 4 8.207 -5.949 -4.065 20 HB VAL 4 HB VAL 4 8.104 -3.123 -2.977 21 1HG1 VAL 4 HG11 VAL 4 9.290 -4.168 -5.541 22 2HG1 VAL 4 HG12 VAL 4 10.181 -3.581 -4.138 23 3HG1 VAL 4 HG13 VAL 4 9.185 -2.468 -5.079 24 1HG2 VAL 4 HG21 VAL 4 5.934 -3.715 -3.893 25 2HG2 VAL 4 HG22 VAL 4 6.692 -4.269 -5.386 26 3HG2 VAL 4 HG23 VAL 4 6.746 -2.560 -4.952 27 H HIS 5 HN HIS 5 10.485 -5.970 -3.886 28 HA HIS 5 HA HIS 5 11.451 -6.016 -1.165 29 1HB HIS 5 HB2 HIS 5 12.260 -7.840 -2.577 30 2HB HIS 5 HB1 HIS 5 12.838 -6.699 -3.781 31 HD1 HIS 5 HD1 HIS 5 13.640 -7.646 -0.128 32 HD2 HIS 5 HD2 HIS 5 15.478 -6.132 -3.552 33 HE1 HIS 5 HE1 HIS 5 16.062 -7.471 0.415 34 HE2 HIS 5 HE2 HIS 5 17.166 -6.826 -1.754 35 H ASN 6 HN ASN 6 10.957 -3.843 -0.858 36 HA ASN 6 HA ASN 6 12.775 -1.900 -2.101 37 1HB ASN 6 HB2 ASN 6 10.353 -1.332 -1.991 38 2HB ASN 6 HB1 ASN 6 10.418 -1.476 -0.239 39 1HD2 ASN 6 HD21 ASN 6 9.780 0.635 0.102 40 2HD2 ASN 6 HD22 ASN 6 10.817 1.980 -0.234 41 H GLN 7 HN GLN 7 11.837 -3.384 0.915 42 HA GLN 7 HA GLN 7 14.049 -2.098 2.273 43 1HB GLN 7 HB2 GLN 7 11.638 -3.542 3.340 44 2HB GLN 7 HB1 GLN 7 12.864 -2.733 4.300 45 1HG GLN 7 HG2 GLN 7 10.926 -1.465 2.391 46 2HG GLN 7 HG1 GLN 7 10.909 -1.348 4.148 47 1HE2 GLN 7 HE21 GLN 7 11.028 0.733 2.185 48 2HE2 GLN 7 HE22 GLN 7 12.486 1.618 2.471 49 H LEU 8 HN LEU 8 14.385 -3.970 4.307 50 HA LEU 8 HA LEU 8 15.221 -6.279 2.752 51 1HB LEU 8 HB2 LEU 8 16.780 -6.789 4.583 52 2HB LEU 8 HB1 LEU 8 17.207 -5.344 3.703 53 HG LEU 8 HG LEU 8 15.905 -5.365 6.451 54 1HD1 LEU 8 HD11 LEU 8 18.167 -4.891 7.284 55 2HD1 LEU 8 HD12 LEU 8 18.806 -5.062 5.650 56 3HD1 LEU 8 HD13 LEU 8 18.111 -6.458 6.476 57 1HD2 LEU 8 HD21 LEU 8 17.365 -3.202 4.908 58 2HD2 LEU 8 HD22 LEU 8 16.745 -3.057 6.547 59 3HD2 LEU 8 HD23 LEU 8 15.625 -3.244 5.202 60 H GLU 9 HN GLU 9 14.683 -8.361 3.348 61 HA GLU 9 HA GLU 9 12.439 -8.438 5.161 62 1HB GLU 9 HB2 GLU 9 13.554 -10.731 3.523 63 2HB GLU 9 HB1 GLU 9 12.078 -10.675 4.415 64 1HG GLU 9 HG2 GLU 9 11.546 -10.511 2.084 65 2HG GLU 9 HG1 GLU 9 11.168 -8.982 2.864 66 H ILE 10 HN ILE 10 12.473 -9.308 7.044 67 HA ILE 10 HA ILE 10 14.919 -10.670 7.962 68 HB ILE 10 HB ILE 10 13.131 -8.833 9.610 69 1HG1 ILE 10 HG12 ILE 10 15.954 -8.354 8.547 70 2HG1 ILE 10 HG11 ILE 10 14.497 -7.563 7.969 71 1HG2 ILE 10 HG21 ILE 10 14.088 -10.612 10.942 72 2HG2 ILE 10 HG22 ILE 10 14.837 -9.069 11.354 73 3HG2 ILE 10 HG23 ILE 10 15.704 -10.226 10.349 74 1HD1 ILE 10 HD11 ILE 10 15.801 -6.130 9.367 75 2HD1 ILE 10 HD12 ILE 10 15.729 -7.295 10.699 76 3HD1 ILE 10 HD13 ILE 10 14.256 -6.483 10.146 77 H LYS 11 HN LYS 11 14.595 -12.490 8.961 78 HA LYS 11 HA LYS 11 11.866 -13.124 9.843 79 1HB LYS 11 HB2 LYS 11 12.151 -15.470 9.341 80 2HB LYS 11 HB1 LYS 11 12.432 -14.535 7.893 81 1HG LYS 11 HG2 LYS 11 14.820 -14.877 8.104 82 2HG LYS 11 HG1 LYS 11 14.580 -15.699 9.651 83 1HD LYS 11 HD2 LYS 11 13.170 -17.377 8.496 84 2HD LYS 11 HD1 LYS 11 13.544 -16.588 6.968 85 1HE LYS 11 HE2 LYS 11 15.888 -17.100 7.241 86 2HE LYS 11 HE1 LYS 11 15.576 -17.788 8.836 87 1HZ LYS 11 HZ1 LYS 11 15.728 -19.558 7.215 88 2HZ LYS 11 HZ2 LYS 11 14.554 -18.831 6.251 89 3HZ LYS 11 HZ3 LYS 11 14.125 -19.438 7.745 90 H PHE 12 HN PHE 12 11.746 -14.609 11.649 91 HA PHE 12 HA PHE 12 13.959 -14.058 13.496 92 1HB PHE 12 HB2 PHE 12 11.081 -14.751 14.116 93 2HB PHE 12 HB1 PHE 12 12.318 -14.310 15.285 94 HD1 PHE 12 HD1 PHE 12 13.284 -11.991 15.200 95 HD2 PHE 12 HD2 PHE 12 9.813 -13.117 13.010 96 HE1 PHE 12 HE1 PHE 12 12.675 -9.627 14.951 97 HE2 PHE 12 HE2 PHE 12 9.199 -10.753 12.753 98 HZ PHE 12 HZ PHE 12 10.631 -9.002 13.725 99 H ARG 13 HN ARG 13 15.193 -15.734 13.982 100 HA ARG 13 HA ARG 13 13.998 -18.385 13.725 101 1HB ARG 13 HB2 ARG 13 15.796 -18.050 12.112 102 2HB ARG 13 HB1 ARG 13 16.890 -17.591 13.403 103 1HG ARG 13 HG2 ARG 13 16.905 -19.819 14.281 104 2HG ARG 13 HG1 ARG 13 15.616 -20.312 13.181 105 1HD ARG 13 HD2 ARG 13 17.063 -19.948 11.274 106 2HD ARG 13 HD1 ARG 13 18.346 -19.356 12.322 107 HE ARG 13 HE ARG 13 18.280 -21.657 13.323 108 1HH1 ARG 13 HH11 ARG 13 17.362 -21.144 9.903 109 2HH1 ARG 13 HH12 ARG 13 17.906 -22.673 9.422 110 1HH2 ARG 13 HH21 ARG 13 19.019 -23.756 12.576 111 2HH2 ARG 13 HH22 ARG 13 18.869 -24.160 10.939 112 H LEU 14 HN LEU 14 13.663 -19.427 15.407 113 HA LEU 14 HA LEU 14 14.190 -18.442 17.958 114 1HB LEU 14 HB2 LEU 14 13.100 -21.062 16.959 115 2HB LEU 14 HB1 LEU 14 13.345 -20.780 18.661 116 HG LEU 14 HG LEU 14 11.013 -20.510 18.050 117 1HD1 LEU 14 HD11 LEU 14 12.312 -17.942 18.803 118 2HD1 LEU 14 HD12 LEU 14 11.801 -19.255 19.867 119 3HD1 LEU 14 HD13 LEU 14 10.601 -18.314 18.991 120 1HD2 LEU 14 HD21 LEU 14 11.233 -19.795 15.716 121 2HD2 LEU 14 HD22 LEU 14 11.911 -18.256 16.248 122 3HD2 LEU 14 HD23 LEU 14 10.237 -18.663 16.632 123 H THR 15 HN THR 15 15.102 -19.896 19.676 124 HA THR 15 HA THR 15 17.835 -20.252 19.308 125 HB THR 15 HB THR 15 16.781 -19.712 21.425 126 HG1 THR 15 HG1 THR 15 18.076 -20.997 22.727 127 1HG2 THR 15 HG21 THR 15 14.800 -21.106 21.361 128 2HG2 THR 15 HG22 THR 15 15.708 -21.467 22.829 129 3HG2 THR 15 HG23 THR 15 15.786 -22.563 21.452 130 H ASP 16 HN ASP 16 15.185 -22.468 19.110 131 HA ASP 16 HA ASP 16 16.842 -24.844 19.007 132 1HB ASP 16 HB2 ASP 16 14.774 -26.095 18.735 133 2HB ASP 16 HB1 ASP 16 14.608 -24.928 20.040 134 H GLY 17 HN GLY 17 16.149 -22.507 16.797 135 1HA GLY 17 HA2 GLY 17 17.094 -22.528 14.650 136 2HA GLY 17 HA1 GLY 17 17.002 -24.279 14.649 137 H SER 18 HN SER 18 14.047 -23.201 15.682 138 HA SER 18 HA SER 18 12.921 -23.560 13.048 139 1HB SER 18 HB2 SER 18 11.618 -22.948 15.708 140 2HB SER 18 HB1 SER 18 10.749 -23.378 14.232 141 HG SER 18 HG SER 18 12.308 -24.951 15.941 142 H ASP 19 HN ASP 19 12.008 -21.887 11.790 143 HA ASP 19 HA ASP 19 12.427 -19.246 12.890 144 1HB ASP 19 HB2 ASP 19 12.996 -18.535 10.607 145 2HB ASP 19 HB1 ASP 19 14.193 -19.605 11.331 146 H ILE 20 HN ILE 20 11.182 -17.594 12.111 147 HA ILE 20 HA ILE 20 8.459 -18.422 11.363 148 HB ILE 20 HB ILE 20 9.421 -15.843 12.678 149 1HG1 ILE 20 HG12 ILE 20 7.962 -18.203 13.902 150 2HG1 ILE 20 HG11 ILE 20 9.649 -17.794 14.171 151 1HG2 ILE 20 HG21 ILE 20 6.600 -16.837 12.211 152 2HG2 ILE 20 HG22 ILE 20 7.372 -15.508 11.364 153 3HG2 ILE 20 HG23 ILE 20 7.021 -15.364 13.076 154 1HD1 ILE 20 HD11 ILE 20 7.271 -16.125 14.968 155 2HD1 ILE 20 HD12 ILE 20 8.961 -15.700 15.243 156 3HD1 ILE 20 HD13 ILE 20 8.265 -17.106 16.045 157 H GLY 21 HN GLY 21 7.492 -17.466 9.625 158 1HA GLY 21 HA2 GLY 21 8.876 -16.904 7.361 159 2HA GLY 21 HA1 GLY 21 7.234 -16.363 7.641 160 HA PRO 22 HA PRO 22 10.671 -12.912 7.703 161 1HB PRO 22 HB2 PRO 22 11.233 -12.525 5.087 162 2HB PRO 22 HB1 PRO 22 12.169 -13.591 6.132 163 1HG PRO 22 HG2 PRO 22 10.043 -14.261 4.144 164 2HG PRO 22 HG1 PRO 22 11.560 -15.112 4.494 165 1HD PRO 22 HD2 PRO 22 9.147 -15.942 5.422 166 2HD PRO 22 HD1 PRO 22 10.671 -16.219 6.290 167 H LYS 23 HN LYS 23 10.226 -10.824 7.447 168 HA LYS 23 HA LYS 23 8.061 -9.977 5.650 169 1HB LYS 23 HB2 LYS 23 8.487 -8.922 8.463 170 2HB LYS 23 HB1 LYS 23 7.436 -8.184 7.280 171 1HG LYS 23 HG2 LYS 23 6.024 -9.295 8.657 172 2HG LYS 23 HG1 LYS 23 6.182 -10.402 7.308 173 1HD LYS 23 HD2 LYS 23 7.861 -11.696 8.555 174 2HD LYS 23 HD1 LYS 23 7.666 -10.604 9.928 175 1HE LYS 23 HE2 LYS 23 5.318 -11.226 10.086 176 2HE LYS 23 HE1 LYS 23 5.519 -12.340 8.730 177 1HZ LYS 23 HZ1 LYS 23 6.776 -12.482 11.399 178 2HZ LYS 23 HZ2 LYS 23 7.209 -13.499 10.099 179 3HZ LYS 23 HZ3 LYS 23 5.656 -13.550 10.755 180 H ALA 24 HN ALA 24 8.232 -7.627 5.242 181 HA ALA 24 HA ALA 24 11.061 -7.017 4.860 182 1HB ALA 24 HB1 ALA 24 8.633 -5.524 3.854 183 2HB ALA 24 HB2 ALA 24 9.556 -6.714 2.934 184 3HB ALA 24 HB3 ALA 24 10.306 -5.194 3.417 185 H PHE 25 HN PHE 25 12.132 -5.761 6.159 186 HA PHE 25 HA PHE 25 10.664 -3.877 7.866 187 1HB PHE 25 HB2 PHE 25 13.262 -5.309 8.439 188 2HB PHE 25 HB1 PHE 25 12.504 -4.121 9.477 189 HD1 PHE 25 HD1 PHE 25 11.985 -7.429 7.945 190 HD2 PHE 25 HD2 PHE 25 11.042 -4.834 11.163 191 HE1 PHE 25 HE1 PHE 25 10.889 -9.274 9.093 192 HE2 PHE 25 HE2 PHE 25 9.927 -6.701 12.323 193 HZ PHE 25 HZ PHE 25 9.896 -8.963 11.226 194 HA PRO 26 HA PRO 26 13.181 -1.057 5.487 195 1HB PRO 26 HB2 PRO 26 12.242 0.772 7.624 196 2HB PRO 26 HB1 PRO 26 12.172 1.001 5.881 197 1HG PRO 26 HG2 PRO 26 9.984 0.408 7.291 198 2HG PRO 26 HG1 PRO 26 10.228 -0.278 5.680 199 1HD PRO 26 HD2 PRO 26 10.556 -1.556 8.356 200 2HD PRO 26 HD1 PRO 26 9.963 -2.248 6.830 201 H ASP 27 HN ASP 27 15.165 -0.061 5.856 202 HA ASP 27 HA ASP 27 16.713 -0.967 8.020 203 1HB ASP 27 HB2 ASP 27 18.504 0.490 7.204 204 2HB ASP 27 HB1 ASP 27 17.710 -0.312 5.855 205 H ALA 28 HN ALA 28 14.653 1.730 7.637 206 HA ALA 28 HA ALA 28 15.700 3.259 9.834 207 1HB ALA 28 HB1 ALA 28 14.659 4.362 7.912 208 2HB ALA 28 HB2 ALA 28 13.849 4.770 9.425 209 3HB ALA 28 HB3 ALA 28 13.119 3.605 8.321 210 H THR 29 HN THR 29 13.930 0.460 9.763 211 HA THR 29 HA THR 29 12.161 1.057 11.940 212 HB THR 29 HB THR 29 12.966 -1.561 10.646 213 HG1 THR 29 HG1 THR 29 11.384 0.387 9.921 214 1HG2 THR 29 HG21 THR 29 10.752 -1.035 12.645 215 2HG2 THR 29 HG22 THR 29 12.226 -1.947 12.979 216 3HG2 THR 29 HG23 THR 29 11.047 -2.565 11.819 217 H THR 30 HN THR 30 12.460 0.604 14.111 218 HA THR 30 HA THR 30 15.213 0.330 14.907 219 HB THR 30 HB THR 30 14.365 0.851 17.142 220 HG1 THR 30 HG1 THR 30 11.899 1.619 16.684 221 1HG2 THR 30 HG21 THR 30 14.932 2.689 15.618 222 2HG2 THR 30 HG22 THR 30 13.578 3.124 16.662 223 3HG2 THR 30 HG23 THR 30 13.285 2.671 14.984 224 H VAL 31 HN VAL 31 15.786 -1.097 16.713 225 HA VAL 31 HA VAL 31 14.914 -3.795 16.428 226 HB VAL 31 HB VAL 31 16.447 -2.448 18.673 227 1HG1 VAL 31 HG11 VAL 31 16.242 -5.396 17.993 228 2HG1 VAL 31 HG12 VAL 31 15.505 -4.614 19.387 229 3HG1 VAL 31 HG13 VAL 31 17.260 -4.704 19.258 230 1HG2 VAL 31 HG21 VAL 31 17.441 -3.956 16.266 231 2HG2 VAL 31 HG22 VAL 31 18.449 -3.329 17.574 232 3HG2 VAL 31 HG23 VAL 31 17.557 -2.218 16.538 233 H SER 32 HN SER 32 13.878 -1.120 18.339 234 HA SER 32 HA SER 32 12.358 -2.477 20.264 235 1HB SER 32 HB2 SER 32 11.861 0.235 19.009 236 2HB SER 32 HB1 SER 32 11.204 -0.330 20.549 237 HG SER 32 HG SER 32 13.974 -0.461 20.270 238 H ALA 33 HN ALA 33 11.487 -1.113 17.069 239 HA ALA 33 HA ALA 33 8.807 -2.077 17.102 240 1HB ALA 33 HB1 ALA 33 8.737 -1.381 14.777 241 2HB ALA 33 HB2 ALA 33 10.496 -1.183 14.781 242 3HB ALA 33 HB3 ALA 33 9.486 -0.142 15.786 243 H LEU 34 HN LEU 34 11.863 -3.480 16.213 244 HA LEU 34 HA LEU 34 11.055 -5.500 14.552 245 1HB LEU 34 HB2 LEU 34 13.325 -4.695 14.866 246 2HB LEU 34 HB1 LEU 34 13.267 -5.136 16.555 247 HG LEU 34 HG LEU 34 13.123 -7.363 15.999 248 1HD1 LEU 34 HD11 LEU 34 13.669 -8.117 13.600 249 2HD1 LEU 34 HD12 LEU 34 13.564 -6.426 13.117 250 3HD1 LEU 34 HD13 LEU 34 12.133 -7.261 13.721 251 1HD2 LEU 34 HD21 LEU 34 15.264 -6.474 16.476 252 2HD2 LEU 34 HD22 LEU 34 15.486 -5.948 14.805 253 3HD2 LEU 34 HD23 LEU 34 15.469 -7.667 15.197 254 H LYS 35 HN LYS 35 11.334 -5.186 18.104 255 HA LYS 35 HA LYS 35 10.431 -7.819 18.655 256 1HB LYS 35 HB2 LYS 35 10.615 -5.375 20.379 257 2HB LYS 35 HB1 LYS 35 10.078 -6.941 20.961 258 1HG LYS 35 HG2 LYS 35 12.220 -7.898 20.356 259 2HG LYS 35 HG1 LYS 35 12.771 -6.318 19.788 260 1HD LYS 35 HD2 LYS 35 12.478 -5.408 22.015 261 2HD LYS 35 HD1 LYS 35 11.842 -6.950 22.580 262 1HE LYS 35 HE2 LYS 35 13.980 -8.007 22.055 263 2HE LYS 35 HE1 LYS 35 14.610 -6.446 21.525 264 1HZ LYS 35 HZ1 LYS 35 13.617 -7.045 24.252 265 2HZ LYS 35 HZ2 LYS 35 14.320 -5.586 23.708 266 3HZ LYS 35 HZ3 LYS 35 15.240 -7.006 23.773 267 H GLU 36 HN GLU 36 8.850 -4.687 18.351 268 HA GLU 36 HA GLU 36 6.342 -5.306 19.366 269 1HB GLU 36 HB2 GLU 36 6.981 -3.588 16.959 270 2HB GLU 36 HB1 GLU 36 5.487 -3.555 17.878 271 1HG GLU 36 HG2 GLU 36 8.203 -2.831 18.947 272 2HG GLU 36 HG1 GLU 36 6.977 -1.683 18.415 273 H THR 37 HN THR 37 7.777 -5.957 16.244 274 HA THR 37 HA THR 37 5.495 -6.991 14.951 275 HB THR 37 HB THR 37 8.425 -7.629 14.464 276 HG1 THR 37 HG1 THR 37 8.002 -5.383 14.286 277 1HG2 THR 37 HG21 THR 37 6.018 -7.866 12.634 278 2HG2 THR 37 HG22 THR 37 6.884 -9.216 13.360 279 3HG2 THR 37 HG23 THR 37 7.691 -8.190 12.172 280 H VAL 38 HN VAL 38 8.087 -8.507 16.850 281 HA VAL 38 HA VAL 38 7.369 -11.204 16.563 282 HB VAL 38 HB VAL 38 8.649 -9.866 18.967 283 1HG1 VAL 38 HG11 VAL 38 8.727 -12.751 18.092 284 2HG1 VAL 38 HG12 VAL 38 7.872 -12.097 19.495 285 3HG1 VAL 38 HG13 VAL 38 9.636 -12.050 19.435 286 1HG2 VAL 38 HG21 VAL 38 9.910 -9.383 16.945 287 2HG2 VAL 38 HG22 VAL 38 9.952 -11.102 16.548 288 3HG2 VAL 38 HG23 VAL 38 10.796 -10.506 17.974 289 H ILE 39 HN ILE 39 6.612 -8.866 19.067 290 HA ILE 39 HA ILE 39 5.018 -10.467 20.730 291 HB ILE 39 HB ILE 39 4.781 -7.469 20.306 292 1HG1 ILE 39 HG12 ILE 39 6.408 -9.043 22.293 293 2HG1 ILE 39 HG11 ILE 39 7.044 -8.197 20.884 294 1HG2 ILE 39 HG21 ILE 39 3.884 -7.423 22.603 295 2HG2 ILE 39 HG22 ILE 39 3.949 -9.170 22.669 296 3HG2 ILE 39 HG23 ILE 39 2.842 -8.374 21.536 297 1HD1 ILE 39 HD11 ILE 39 6.295 -6.090 21.807 298 2HD1 ILE 39 HD12 ILE 39 7.366 -6.958 22.917 299 3HD1 ILE 39 HD13 ILE 39 5.626 -6.942 23.201 300 H SER 40 HN SER 40 4.211 -8.748 17.827 301 HA SER 40 HA SER 40 1.412 -8.865 18.145 302 1HB SER 40 HB2 SER 40 3.062 -8.488 15.647 303 2HB SER 40 HB1 SER 40 1.329 -8.186 15.792 304 HG SER 40 HG SER 40 3.471 -6.837 17.062 305 H GLU 41 HN GLU 41 3.757 -11.109 16.516 306 HA GLU 41 HA GLU 41 1.513 -12.690 15.675 307 1HB GLU 41 HB2 GLU 41 3.182 -13.853 14.394 308 2HB GLU 41 HB1 GLU 41 3.005 -12.174 13.940 309 1HG GLU 41 HG2 GLU 41 5.074 -11.706 15.202 310 2HG GLU 41 HG1 GLU 41 5.259 -13.443 15.473 311 H TRP 42 HN TRP 42 4.074 -12.730 17.887 312 HA TRP 42 HA TRP 42 4.049 -15.570 18.383 313 1HB TRP 42 HB2 TRP 42 6.030 -14.096 18.843 314 2HB TRP 42 HB1 TRP 42 5.114 -13.333 20.131 315 HD1 TRP 42 HD1 TRP 42 4.768 -14.818 22.429 316 HE1 TRP 42 HE1 TRP 42 6.073 -16.738 23.364 317 HE3 TRP 42 HE3 TRP 42 7.265 -16.169 18.172 318 HZ2 TRP 42 HZ2 TRP 42 7.953 -18.696 22.410 319 HZ3 TRP 42 HZ3 TRP 42 8.794 -18.090 18.289 320 HH2 TRP 42 HH2 TRP 42 9.125 -19.314 20.355 321 HA PRO 43 HA PRO 43 0.384 -15.578 20.983 322 1HB PRO 43 HB2 PRO 43 1.775 -17.784 22.394 323 2HB PRO 43 HB1 PRO 43 0.162 -17.760 21.687 324 1HG PRO 43 HG2 PRO 43 2.145 -19.078 20.495 325 2HG PRO 43 HG1 PRO 43 0.952 -18.174 19.545 326 1HD PRO 43 HD2 PRO 43 3.765 -17.442 20.239 327 2HD PRO 43 HD1 PRO 43 2.858 -17.183 18.730 328 H ARG 44 HN ARG 44 0.359 -13.937 22.411 329 HA ARG 44 HA ARG 44 2.569 -13.326 24.093 330 1HB ARG 44 HB2 ARG 44 1.054 -11.615 23.149 331 2HB ARG 44 HB1 ARG 44 -0.238 -12.214 24.173 332 1HG ARG 44 HG2 ARG 44 1.062 -11.583 26.158 333 2HG ARG 44 HG1 ARG 44 2.338 -10.964 25.107 334 1HD ARG 44 HD2 ARG 44 -0.509 -9.983 25.232 335 2HD ARG 44 HD1 ARG 44 0.911 -9.153 25.871 336 HE ARG 44 HE ARG 44 1.492 -9.571 23.267 337 1HH1 ARG 44 HH11 ARG 44 -1.132 -7.945 24.990 338 2HH1 ARG 44 HH12 ARG 44 -1.490 -6.835 23.768 339 1HH2 ARG 44 HH21 ARG 44 0.994 -8.047 21.507 340 2HH2 ARG 44 HH22 ARG 44 -0.228 -6.909 21.712 341 H GLU 45 HN GLU 45 -0.230 -15.226 24.457 342 HA GLU 45 HA GLU 45 -0.362 -15.296 27.293 343 1HB GLU 45 HB2 GLU 45 -2.264 -15.894 25.905 344 2HB GLU 45 HB1 GLU 45 -1.367 -17.232 25.203 345 1HG GLU 45 HG2 GLU 45 -1.299 -18.313 27.398 346 2HG GLU 45 HG1 GLU 45 -2.231 -16.981 28.074 347 H LYS 46 HN LYS 46 1.754 -16.741 25.004 348 HA LYS 46 HA LYS 46 2.223 -19.258 26.115 349 1HB LYS 46 HB2 LYS 46 2.956 -18.455 23.787 350 2HB LYS 46 HB1 LYS 46 4.222 -17.614 24.615 351 1HG LYS 46 HG2 LYS 46 5.214 -19.603 25.443 352 2HG LYS 46 HG1 LYS 46 3.875 -20.578 24.843 353 1HD LYS 46 HD2 LYS 46 4.463 -19.949 22.542 354 2HD LYS 46 HD1 LYS 46 5.820 -19.002 23.159 355 1HE LYS 46 HE2 LYS 46 6.801 -21.015 24.121 356 2HE LYS 46 HE1 LYS 46 5.436 -21.965 23.550 357 1HZ LYS 46 HZ1 LYS 46 7.335 -22.192 22.106 358 2HZ LYS 46 HZ2 LYS 46 7.401 -20.545 21.817 359 3HZ LYS 46 HZ3 LYS 46 6.089 -21.437 21.266 360 H GLU 47 HN GLU 47 2.813 -19.594 28.140 361 HA GLU 47 HA GLU 47 4.662 -17.857 29.368 362 1HB GLU 47 HB2 GLU 47 4.434 -19.342 31.370 363 2HB GLU 47 HB1 GLU 47 2.949 -18.586 30.838 364 1HG GLU 47 HG2 GLU 47 3.732 -21.433 30.198 365 2HG GLU 47 HG1 GLU 47 2.759 -20.957 31.588 366 H ASN 48 HN ASN 48 6.643 -18.725 30.481 367 HA ASN 48 HA ASN 48 8.628 -19.664 30.403 368 1HB ASN 48 HB2 ASN 48 7.180 -22.000 29.113 369 2HB ASN 48 HB1 ASN 48 8.892 -22.042 29.494 370 1HD2 ASN 48 HD21 ASN 48 6.642 -20.417 31.605 371 2HD2 ASN 48 HD22 ASN 48 6.666 -21.561 32.880 372 H GLY 49 HN GLY 49 7.309 -18.272 28.060 373 1HA GLY 49 HA2 GLY 49 9.696 -18.304 26.468 374 2HA GLY 49 HA1 GLY 49 8.168 -18.658 25.653 375 HA PRO 50 HA PRO 50 8.936 -13.997 25.763 376 1HB PRO 50 HB2 PRO 50 8.095 -14.469 22.962 377 2HB PRO 50 HB1 PRO 50 9.348 -13.403 23.609 378 1HG PRO 50 HG2 PRO 50 10.049 -15.643 22.410 379 2HG PRO 50 HG1 PRO 50 10.853 -15.163 23.920 380 1HD PRO 50 HD2 PRO 50 8.649 -17.145 23.510 381 2HD PRO 50 HD1 PRO 50 10.126 -17.312 24.484 382 H LYS 51 HN LYS 51 7.388 -12.413 25.652 383 HA LYS 51 HA LYS 51 4.665 -12.986 24.770 384 1HB LYS 51 HB2 LYS 51 5.231 -11.797 27.498 385 2HB LYS 51 HB1 LYS 51 3.677 -12.273 26.845 386 1HG LYS 51 HG2 LYS 51 4.254 -14.595 27.051 387 2HG LYS 51 HG1 LYS 51 5.894 -14.171 27.543 388 1HD LYS 51 HD2 LYS 51 4.838 -12.913 29.465 389 2HD LYS 51 HD1 LYS 51 3.332 -13.731 29.038 390 1HE LYS 51 HE2 LYS 51 4.548 -14.914 30.800 391 2HE LYS 51 HE1 LYS 51 4.384 -15.880 29.330 392 1HZ LYS 51 HZ1 LYS 51 6.690 -15.826 30.434 393 2HZ LYS 51 HZ2 LYS 51 6.821 -14.252 29.828 394 3HZ LYS 51 HZ3 LYS 51 6.646 -15.524 28.773 395 H THR 52 HN THR 52 6.779 -10.819 26.581 396 HA THR 52 HA THR 52 6.008 -8.580 24.866 397 HB THR 52 HB THR 52 6.449 -7.114 26.755 398 HG1 THR 52 HG1 THR 52 6.971 -9.614 28.110 399 1HG2 THR 52 HG21 THR 52 4.167 -7.905 26.431 400 2HG2 THR 52 HG22 THR 52 4.498 -7.741 28.157 401 3HG2 THR 52 HG23 THR 52 4.502 -9.334 27.407 402 H VAL 53 HN VAL 53 7.893 -6.691 25.050 403 HA VAL 53 HA VAL 53 9.981 -7.499 23.591 404 HB VAL 53 HB VAL 53 10.902 -5.342 24.124 405 1HG1 VAL 53 HG11 VAL 53 9.112 -3.949 23.231 406 2HG1 VAL 53 HG12 VAL 53 7.954 -5.205 23.618 407 3HG1 VAL 53 HG13 VAL 53 9.199 -5.500 22.393 408 1HG2 VAL 53 HG21 VAL 53 8.642 -5.064 26.084 409 2HG2 VAL 53 HG22 VAL 53 9.690 -3.740 25.569 410 3HG2 VAL 53 HG23 VAL 53 10.365 -5.105 26.459 411 H LYS 54 HN LYS 54 9.677 -7.492 27.034 412 HA LYS 54 HA LYS 54 12.416 -7.306 27.791 413 1HB LYS 54 HB2 LYS 54 10.153 -8.644 29.267 414 2HB LYS 54 HB1 LYS 54 11.648 -8.037 29.951 415 1HG LYS 54 HG2 LYS 54 10.976 -5.761 29.477 416 2HG LYS 54 HG1 LYS 54 9.509 -6.343 28.682 417 1HD LYS 54 HD2 LYS 54 8.825 -7.405 30.821 418 2HD LYS 54 HD1 LYS 54 10.241 -6.691 31.589 419 1HE LYS 54 HE2 LYS 54 9.427 -4.463 31.056 420 2HE LYS 54 HE1 LYS 54 8.028 -5.156 30.240 421 1HZ LYS 54 HZ1 LYS 54 7.483 -4.427 32.463 422 2HZ LYS 54 HZ2 LYS 54 8.662 -5.410 33.130 423 3HZ LYS 54 HZ3 LYS 54 7.321 -6.098 32.359 424 H GLU 55 HN GLU 55 10.370 -9.800 26.647 425 HA GLU 55 HA GLU 55 12.020 -11.930 27.794 426 1HB GLU 55 HB2 GLU 55 9.296 -11.970 26.521 427 2HB GLU 55 HB1 GLU 55 10.079 -13.308 27.373 428 1HG GLU 55 HG2 GLU 55 9.971 -12.220 29.437 429 2HG GLU 55 HG1 GLU 55 9.612 -10.665 28.698 430 H VAL 56 HN VAL 56 12.168 -10.194 25.125 431 HA VAL 56 HA VAL 56 12.774 -12.480 23.354 432 HB VAL 56 HB VAL 56 11.876 -9.697 22.514 433 1HG1 VAL 56 HG11 VAL 56 13.320 -10.762 20.885 434 2HG1 VAL 56 HG12 VAL 56 11.670 -10.648 20.277 435 3HG1 VAL 56 HG13 VAL 56 12.285 -12.189 20.879 436 1HG2 VAL 56 HG21 VAL 56 10.025 -10.938 23.558 437 2HG2 VAL 56 HG22 VAL 56 10.308 -12.262 22.405 438 3HG2 VAL 56 HG23 VAL 56 9.770 -10.692 21.827 439 H LYS 57 HN LYS 57 14.963 -12.614 23.021 440 HA LYS 57 HA LYS 57 16.473 -10.113 22.931 441 1HB LYS 57 HB2 LYS 57 17.268 -12.886 23.799 442 2HB LYS 57 HB1 LYS 57 18.467 -11.723 23.286 443 1HG LYS 57 HG2 LYS 57 18.375 -11.789 25.700 444 2HG LYS 57 HG1 LYS 57 17.767 -10.241 25.147 445 1HD LYS 57 HD2 LYS 57 15.474 -10.983 25.560 446 2HD LYS 57 HD1 LYS 57 16.061 -12.582 26.029 447 1HE LYS 57 HE2 LYS 57 17.337 -11.566 27.877 448 2HE LYS 57 HE1 LYS 57 16.747 -9.979 27.404 449 1HZ LYS 57 HZ1 LYS 57 14.508 -10.659 27.997 450 2HZ LYS 57 HZ2 LYS 57 15.534 -10.900 29.284 451 3HZ LYS 57 HZ3 LYS 57 15.009 -12.213 28.399 452 H LEU 58 HN LEU 58 17.214 -9.563 20.961 453 HA LEU 58 HA LEU 58 17.238 -11.643 18.888 454 1HB LEU 58 HB2 LEU 58 17.233 -8.629 18.558 455 2HB LEU 58 HB1 LEU 58 17.345 -9.764 17.238 456 HG LEU 58 HG LEU 58 15.131 -8.943 17.249 457 1HD1 LEU 58 HD11 LEU 58 13.753 -10.894 17.634 458 2HD1 LEU 58 HD12 LEU 58 15.083 -11.663 18.496 459 3HD1 LEU 58 HD13 LEU 58 15.246 -11.280 16.781 460 1HD2 LEU 58 HD21 LEU 58 14.996 -9.622 20.179 461 2HD2 LEU 58 HD22 LEU 58 13.645 -9.063 19.195 462 3HD2 LEU 58 HD23 LEU 58 15.032 -8.004 19.474 463 H ILE 59 HN ILE 59 19.096 -12.438 18.241 464 HA ILE 59 HA ILE 59 21.560 -10.867 18.564 465 HB ILE 59 HB ILE 59 21.112 -13.871 18.699 466 1HG1 ILE 59 HG12 ILE 59 22.174 -13.739 20.902 467 2HG1 ILE 59 HG11 ILE 59 22.239 -11.982 20.792 468 1HG2 ILE 59 HG21 ILE 59 23.724 -12.389 18.706 469 2HG2 ILE 59 HG22 ILE 59 23.124 -13.459 17.446 470 3HG2 ILE 59 HG23 ILE 59 23.533 -14.109 19.037 471 1HD1 ILE 59 HD11 ILE 59 19.785 -13.732 20.960 472 2HD1 ILE 59 HD12 ILE 59 19.769 -11.975 20.825 473 3HD1 ILE 59 HD13 ILE 59 20.458 -12.744 22.255 474 H SER 60 HN SER 60 22.724 -10.501 16.800 475 HA SER 60 HA SER 60 22.091 -12.016 14.378 476 1HB SER 60 HB2 SER 60 22.652 -9.971 13.108 477 2HB SER 60 HB1 SER 60 21.286 -9.729 14.193 478 HG SER 60 HG SER 60 23.816 -9.164 15.191 479 H ALA 61 HN ALA 61 23.752 -13.311 13.965 480 HA ALA 61 HA ALA 61 25.823 -14.133 13.588 481 1HB ALA 61 HB1 ALA 61 25.978 -12.183 12.084 482 2HB ALA 61 HB2 ALA 61 27.546 -12.623 12.760 483 3HB ALA 61 HB3 ALA 61 26.668 -11.237 13.405 484 H GLY 62 HN GLY 62 25.020 -13.382 16.337 485 1HA GLY 62 HA2 GLY 62 26.128 -14.122 18.333 486 2HA GLY 62 HA1 GLY 62 27.665 -13.792 17.546 487 H LYS 63 HN LYS 63 25.325 -11.218 17.266 488 HA LYS 63 HA LYS 63 26.459 -9.865 19.544 489 1HB LYS 63 HB2 LYS 63 25.881 -9.005 16.744 490 2HB LYS 63 HB1 LYS 63 25.991 -7.872 18.064 491 1HG LYS 63 HG2 LYS 63 28.266 -9.750 17.428 492 2HG LYS 63 HG1 LYS 63 28.051 -8.273 16.500 493 1HD LYS 63 HD2 LYS 63 29.697 -7.871 18.228 494 2HD LYS 63 HD1 LYS 63 28.248 -6.973 18.613 495 1HE LYS 63 HE2 LYS 63 29.248 -7.957 20.588 496 2HE LYS 63 HE1 LYS 63 27.661 -8.647 20.315 497 1HZ LYS 63 HZ1 LYS 63 29.304 -10.300 20.937 498 2HZ LYS 63 HZ2 LYS 63 30.259 -9.948 19.603 499 3HZ LYS 63 HZ3 LYS 63 28.727 -10.630 19.409 500 H VAL 64 HN VAL 64 24.874 -8.976 20.840 501 HA VAL 64 HA VAL 64 22.124 -9.568 20.219 502 HB VAL 64 HB VAL 64 23.246 -7.983 22.550 503 1HG1 VAL 64 HG11 VAL 64 20.867 -7.643 22.238 504 2HG1 VAL 64 HG12 VAL 64 21.156 -8.596 23.695 505 3HG1 VAL 64 HG13 VAL 64 20.593 -9.383 22.222 506 1HG2 VAL 64 HG21 VAL 64 24.244 -10.221 22.501 507 2HG2 VAL 64 HG22 VAL 64 22.628 -10.938 22.443 508 3HG2 VAL 64 HG23 VAL 64 23.139 -10.034 23.858 509 H LEU 65 HN LEU 65 20.597 -8.126 19.506 510 HA LEU 65 HA LEU 65 21.524 -5.625 18.558 511 1HB LEU 65 HB2 LEU 65 18.839 -6.964 18.480 512 2HB LEU 65 HB1 LEU 65 19.081 -5.335 17.914 513 HG LEU 65 HG LEU 65 20.740 -6.251 16.257 514 1HD1 LEU 65 HD11 LEU 65 20.654 -8.595 15.705 515 2HD1 LEU 65 HD12 LEU 65 19.639 -8.897 17.115 516 3HD1 LEU 65 HD13 LEU 65 21.296 -8.320 17.321 517 1HD2 LEU 65 HD21 LEU 65 17.912 -7.257 16.069 518 2HD2 LEU 65 HD22 LEU 65 19.048 -7.126 14.726 519 3HD2 LEU 65 HD23 LEU 65 18.506 -5.674 15.561 520 H GLU 66 HN GLU 66 21.554 -3.868 19.561 521 HA GLU 66 HA GLU 66 20.413 -3.465 22.151 522 1HB GLU 66 HB2 GLU 66 22.614 -2.589 21.482 523 2HB GLU 66 HB1 GLU 66 21.859 -1.645 20.218 524 1HG GLU 66 HG2 GLU 66 20.781 -0.250 21.859 525 2HG GLU 66 HG1 GLU 66 21.414 -1.259 23.164 526 H ASN 67 HN ASN 67 18.497 -2.560 22.545 527 HA ASN 67 HA ASN 67 16.540 -2.536 20.585 528 1HB ASN 67 HB2 ASN 67 16.411 -1.388 23.355 529 2HB ASN 67 HB1 ASN 67 15.022 -1.554 22.289 530 1HD2 ASN 67 HD21 ASN 67 17.303 -3.212 24.288 531 2HD2 ASN 67 HD22 ASN 67 16.544 -4.743 24.239 532 H SER 68 HN SER 68 18.326 0.185 21.827 533 HA SER 68 HA SER 68 16.558 2.146 20.737 534 1HB SER 68 HB2 SER 68 19.393 2.459 21.724 535 2HB SER 68 HB1 SER 68 18.230 3.760 21.465 536 HG SER 68 HG SER 68 17.199 3.244 23.191 537 H LYS 69 HN LYS 69 18.849 0.200 19.312 538 HA LYS 69 HA LYS 69 19.596 2.162 17.369 539 1HB LYS 69 HB2 LYS 69 20.563 -0.629 17.878 540 2HB LYS 69 HB1 LYS 69 21.129 0.400 16.568 541 1HG LYS 69 HG2 LYS 69 21.303 1.110 19.494 542 2HG LYS 69 HG1 LYS 69 22.620 0.427 18.540 543 1HD LYS 69 HD2 LYS 69 22.733 2.370 17.152 544 2HD LYS 69 HD1 LYS 69 21.238 3.020 17.806 545 1HE LYS 69 HE2 LYS 69 23.240 4.163 18.687 546 2HE LYS 69 HE1 LYS 69 22.274 3.404 19.943 547 1HZ LYS 69 HZ1 LYS 69 24.663 3.106 20.218 548 2HZ LYS 69 HZ2 LYS 69 24.746 2.157 18.812 549 3HZ LYS 69 HZ3 LYS 69 23.802 1.684 20.147 550 H THR 70 HN THR 70 19.764 1.294 15.044 551 HA THR 70 HA THR 70 16.999 0.513 14.468 552 HB THR 70 HB THR 70 18.799 2.173 12.759 553 HG1 THR 70 HG1 THR 70 18.086 2.741 15.203 554 1HG2 THR 70 HG21 THR 70 16.667 3.162 12.044 555 2HG2 THR 70 HG22 THR 70 15.822 2.116 13.188 556 3HG2 THR 70 HG23 THR 70 16.684 1.413 11.818 557 H VAL 71 HN VAL 71 16.853 -0.490 12.225 558 HA VAL 71 HA VAL 71 18.567 -2.728 11.983 559 HB VAL 71 HB VAL 71 16.690 -1.545 9.896 560 1HG1 VAL 71 HG11 VAL 71 18.354 -2.994 8.821 561 2HG1 VAL 71 HG12 VAL 71 16.761 -3.751 8.801 562 3HG1 VAL 71 HG13 VAL 71 17.975 -4.284 9.962 563 1HG2 VAL 71 HG21 VAL 71 16.311 -3.844 11.813 564 2HG2 VAL 71 HG22 VAL 71 15.157 -3.335 10.586 565 3HG2 VAL 71 HG23 VAL 71 15.554 -2.255 11.925 566 H LYS 72 HN LYS 72 18.620 0.390 10.537 567 HA LYS 72 HA LYS 72 20.586 0.277 8.622 568 1HB LYS 72 HB2 LYS 72 19.308 2.250 9.008 569 2HB LYS 72 HB1 LYS 72 19.887 2.389 10.649 570 1HG LYS 72 HG2 LYS 72 21.764 2.598 8.324 571 2HG LYS 72 HG1 LYS 72 20.775 3.968 8.803 572 1HD LYS 72 HD2 LYS 72 22.742 2.505 10.609 573 2HD LYS 72 HD1 LYS 72 23.087 4.025 9.789 574 1HE LYS 72 HE2 LYS 72 21.268 5.104 11.026 575 2HE LYS 72 HE1 LYS 72 20.901 3.589 11.838 576 1HZ LYS 72 HZ1 LYS 72 23.475 5.073 12.097 577 2HZ LYS 72 HZ2 LYS 72 23.029 3.678 12.969 578 3HZ LYS 72 HZ3 LYS 72 22.208 5.095 13.189 579 H ASP 73 HN ASP 73 20.976 0.156 12.135 580 HA ASP 73 HA ASP 73 23.754 0.623 12.113 581 1HB ASP 73 HB2 ASP 73 21.808 -0.335 14.177 582 2HB ASP 73 HB1 ASP 73 23.483 -0.012 14.541 583 H TYR 74 HN TYR 74 21.805 -2.214 11.603 584 HA TYR 74 HA TYR 74 24.027 -3.911 12.419 585 1HB TYR 74 HB2 TYR 74 21.110 -4.547 12.038 586 2HB TYR 74 HB1 TYR 74 22.356 -5.692 12.531 587 HD1 TYR 74 HD1 TYR 74 23.383 -5.532 14.754 588 HD2 TYR 74 HD2 TYR 74 20.325 -2.858 13.535 589 HE1 TYR 74 HE1 TYR 74 23.137 -4.754 17.068 590 HE2 TYR 74 HE2 TYR 74 20.065 -2.083 15.833 591 HH TYR 74 HH TYR 74 20.521 -2.777 18.054 592 H ARG 75 HN ARG 75 22.264 -2.857 9.601 593 HA ARG 75 HA ARG 75 22.653 -5.060 8.007 594 1HB ARG 75 HB2 ARG 75 22.157 -3.534 6.227 595 2HB ARG 75 HB1 ARG 75 21.027 -3.319 7.548 596 1HG ARG 75 HG2 ARG 75 22.277 -1.326 8.262 597 2HG ARG 75 HG1 ARG 75 23.387 -1.561 6.916 598 1HD ARG 75 HD2 ARG 75 21.522 -1.270 5.344 599 2HD ARG 75 HD1 ARG 75 20.430 -1.020 6.705 600 HE ARG 75 HE ARG 75 22.420 0.790 7.076 601 1HH1 ARG 75 HH11 ARG 75 20.180 0.145 4.404 602 2HH1 ARG 75 HH12 ARG 75 20.116 1.760 3.881 603 1HH2 ARG 75 HH21 ARG 75 22.324 3.041 6.338 604 2HH2 ARG 75 HH22 ARG 75 21.354 3.425 5.008 605 H SER 76 HN SER 76 24.338 -5.723 6.843 606 HA SER 76 HA SER 76 26.924 -4.618 7.180 607 1HB SER 76 HB2 SER 76 25.827 -6.794 5.387 608 2HB SER 76 HB1 SER 76 27.536 -6.534 5.715 609 HG SER 76 HG SER 76 27.230 -7.065 7.807 610 HA PRO 77 HA PRO 77 27.537 -1.934 3.588 611 1HB PRO 77 HB2 PRO 77 29.345 -3.534 2.094 612 2HB PRO 77 HB1 PRO 77 29.759 -2.237 3.218 613 1HG PRO 77 HG2 PRO 77 29.673 -5.180 3.665 614 2HG PRO 77 HG1 PRO 77 30.749 -3.962 4.371 615 1HD PRO 77 HD2 PRO 77 28.803 -5.019 5.825 616 2HD PRO 77 HD1 PRO 77 29.159 -3.285 5.930 617 H VAL 78 HN VAL 78 27.008 -1.717 1.342 618 HA VAL 78 HA VAL 78 24.917 -3.507 0.608 619 HB VAL 78 HB VAL 78 25.961 -1.170 -0.869 620 1HG1 VAL 78 HG11 VAL 78 23.323 -2.631 -1.099 621 2HG1 VAL 78 HG12 VAL 78 24.616 -2.608 -2.299 622 3HG1 VAL 78 HG13 VAL 78 23.699 -1.137 -1.958 623 1HG2 VAL 78 HG21 VAL 78 24.082 0.123 0.097 624 2HG2 VAL 78 HG22 VAL 78 25.213 -0.467 1.320 625 3HG2 VAL 78 HG23 VAL 78 23.670 -1.284 1.074 626 H SER 79 HN SER 79 26.118 -5.190 0.323 627 HA SER 79 HA SER 79 27.613 -5.426 -2.188 628 1HB SER 79 HB2 SER 79 28.617 -6.397 -0.104 629 2HB SER 79 HB1 SER 79 27.243 -7.492 0.012 630 HG SER 79 HG SER 79 29.389 -7.453 -1.761 631 H ASN 80 HN ASN 80 26.797 -6.642 -3.876 632 HA ASN 80 HA ASN 80 23.980 -7.139 -3.803 633 1HB ASN 80 HB2 ASN 80 24.189 -7.834 -6.179 634 2HB ASN 80 HB1 ASN 80 24.878 -6.246 -5.881 635 1HD2 ASN 80 HD21 ASN 80 25.332 -8.271 -7.982 636 2HD2 ASN 80 HD22 ASN 80 27.026 -8.584 -7.991 637 H LEU 81 HN LEU 81 23.344 -8.849 -2.529 638 HA LEU 81 HA LEU 81 24.725 -11.277 -2.650 639 1HB LEU 81 HB2 LEU 81 22.337 -10.185 -1.316 640 2HB LEU 81 HB1 LEU 81 23.005 -11.758 -0.998 641 HG LEU 81 HG LEU 81 24.303 -9.088 -0.403 642 1HD1 LEU 81 HD11 LEU 81 23.265 -11.215 1.455 643 2HD1 LEU 81 HD12 LEU 81 22.529 -9.642 1.148 644 3HD1 LEU 81 HD13 LEU 81 24.103 -9.740 1.937 645 1HD2 LEU 81 HD21 LEU 81 26.100 -10.370 0.671 646 2HD2 LEU 81 HD22 LEU 81 26.003 -10.711 -1.054 647 3HD2 LEU 81 HD23 LEU 81 25.358 -11.869 0.112 648 H ALA 82 HN ALA 82 22.894 -13.136 -2.640 649 HA ALA 82 HA ALA 82 21.610 -12.915 -5.171 650 1HB ALA 82 HB1 ALA 82 22.028 -15.265 -3.336 651 2HB ALA 82 HB2 ALA 82 23.021 -14.836 -4.723 652 3HB ALA 82 HB3 ALA 82 21.347 -15.349 -4.959 653 H GLY 83 HN GLY 83 20.533 -11.499 -2.862 654 1HA GLY 83 HA2 GLY 83 18.423 -11.021 -2.054 655 2HA GLY 83 HA1 GLY 83 17.821 -12.459 -2.885 656 H ALA 84 HN ALA 84 19.602 -11.360 -0.070 657 HA ALA 84 HA ALA 84 19.177 -13.987 1.145 658 1HB ALA 84 HB1 ALA 84 21.018 -11.768 2.015 659 2HB ALA 84 HB2 ALA 84 21.489 -13.185 1.078 660 3HB ALA 84 HB3 ALA 84 20.907 -13.378 2.731 661 H VAL 85 HN VAL 85 17.897 -14.272 2.795 662 HA VAL 85 HA VAL 85 16.349 -12.044 3.778 663 HB VAL 85 HB VAL 85 16.232 -14.991 4.512 664 1HG1 VAL 85 HG11 VAL 85 14.026 -14.488 5.434 665 2HG1 VAL 85 HG12 VAL 85 14.258 -12.779 5.064 666 3HG1 VAL 85 HG13 VAL 85 15.290 -13.571 6.257 667 1HG2 VAL 85 HG21 VAL 85 15.693 -14.645 2.162 668 2HG2 VAL 85 HG22 VAL 85 14.508 -13.415 2.599 669 3HG2 VAL 85 HG23 VAL 85 14.246 -15.094 3.065 670 H THR 86 HN THR 86 16.551 -11.213 5.807 671 HA THR 86 HA THR 86 19.102 -11.673 7.033 672 HB THR 86 HB THR 86 16.884 -9.763 7.740 673 HG1 THR 86 HG1 THR 86 17.335 -8.979 5.860 674 1HG2 THR 86 HG21 THR 86 19.870 -9.659 8.236 675 2HG2 THR 86 HG22 THR 86 18.623 -10.002 9.439 676 3HG2 THR 86 HG23 THR 86 18.709 -8.406 8.689 677 H THR 87 HN THR 87 19.285 -12.902 8.875 678 HA THR 87 HA THR 87 16.748 -13.781 10.057 679 HB THR 87 HB THR 87 19.376 -15.250 10.037 680 HG1 THR 87 HG1 THR 87 18.115 -14.875 7.969 681 1HG2 THR 87 HG21 THR 87 16.567 -16.128 10.721 682 2HG2 THR 87 HG22 THR 87 17.874 -15.850 11.874 683 3HG2 THR 87 HG23 THR 87 17.993 -17.168 10.706 684 H MET 88 HN MET 88 16.415 -12.922 11.977 685 HA MET 88 HA MET 88 18.673 -12.275 13.727 686 1HB MET 88 HB2 MET 88 15.788 -11.476 13.652 687 2HB MET 88 HB1 MET 88 16.583 -11.544 15.204 688 1HG MET 88 HG2 MET 88 16.469 -9.267 14.273 689 2HG MET 88 HG1 MET 88 18.108 -9.791 14.563 690 1HE MET 88 HE1 MET 88 19.313 -11.160 12.161 691 2HE MET 88 HE2 MET 88 19.944 -9.651 12.821 692 3HE MET 88 HE3 MET 88 19.720 -9.815 11.090 693 H HIS 89 HN HIS 89 19.261 -13.623 15.216 694 HA HIS 89 HA HIS 89 17.696 -16.014 15.632 695 1HB HIS 89 HB2 HIS 89 20.118 -16.141 15.255 696 2HB HIS 89 HB1 HIS 89 20.399 -15.177 16.698 697 HD1 HIS 89 HD1 HIS 89 21.110 -16.599 18.586 698 HD2 HIS 89 HD2 HIS 89 18.511 -18.602 16.054 699 HE1 HIS 89 HE1 HIS 89 20.895 -18.870 19.537 700 HE2 HIS 89 HE2 HIS 89 19.755 -20.119 17.681 701 H VAL 90 HN VAL 90 16.402 -16.225 17.286 702 HA VAL 90 HA VAL 90 16.522 -14.149 19.361 703 HB VAL 90 HB VAL 90 14.380 -14.336 17.999 704 1HG1 VAL 90 HG11 VAL 90 14.091 -16.933 19.302 705 2HG1 VAL 90 HG12 VAL 90 14.272 -16.553 17.571 706 3HG1 VAL 90 HG13 VAL 90 12.830 -16.034 18.450 707 1HG2 VAL 90 HG21 VAL 90 14.347 -13.273 20.201 708 2HG2 VAL 90 HG22 VAL 90 14.111 -14.849 20.955 709 3HG2 VAL 90 HG23 VAL 90 12.860 -14.179 19.911 710 H ILE 91 HN ILE 91 16.901 -14.460 21.217 711 HA ILE 91 HA ILE 91 17.154 -17.175 22.282 712 HB ILE 91 HB ILE 91 18.443 -14.565 22.907 713 1HG1 ILE 91 HG12 ILE 91 19.528 -15.815 21.151 714 2HG1 ILE 91 HG11 ILE 91 20.581 -15.774 22.561 715 1HG2 ILE 91 HG21 ILE 91 18.613 -17.084 24.607 716 2HG2 ILE 91 HG22 ILE 91 17.879 -15.549 25.071 717 3HG2 ILE 91 HG23 ILE 91 19.625 -15.655 24.844 718 1HD1 ILE 91 HD11 ILE 91 18.877 -18.092 21.652 719 2HD1 ILE 91 HD12 ILE 91 19.858 -18.062 23.113 720 3HD1 ILE 91 HD13 ILE 91 20.633 -17.952 21.536 721 H ILE 92 HN ILE 92 15.824 -17.791 23.699 722 HA ILE 92 HA ILE 92 13.769 -15.945 24.503 723 HB ILE 92 HB ILE 92 13.940 -18.961 24.558 724 1HG1 ILE 92 HG12 ILE 92 11.893 -18.845 23.149 725 2HG1 ILE 92 HG11 ILE 92 11.956 -17.096 23.214 726 1HG2 ILE 92 HG21 ILE 92 11.687 -19.023 25.540 727 2HG2 ILE 92 HG22 ILE 92 11.789 -17.274 25.800 728 3HG2 ILE 92 HG23 ILE 92 12.914 -18.358 26.623 729 1HD1 ILE 92 HD11 ILE 92 12.730 -17.933 21.100 730 2HD1 ILE 92 HD12 ILE 92 13.975 -18.905 21.900 731 3HD1 ILE 92 HD13 ILE 92 14.038 -17.135 21.968 732 H GLN 93 HN GLN 93 14.196 -14.820 26.203 733 HA GLN 93 HA GLN 93 14.835 -16.280 28.644 734 1HB GLN 93 HB2 GLN 93 16.128 -13.674 27.808 735 2HB GLN 93 HB1 GLN 93 16.184 -14.320 29.431 736 1HG GLN 93 HG2 GLN 93 17.435 -16.238 28.647 737 2HG GLN 93 HG1 GLN 93 17.340 -15.637 26.992 738 1HE2 GLN 93 HE21 GLN 93 19.669 -16.155 28.709 739 2HE2 GLN 93 HE22 GLN 93 20.541 -14.662 28.755 740 H ALA 94 HN ALA 94 13.081 -16.100 29.704 741 HA ALA 94 HA ALA 94 11.572 -13.611 29.756 742 1HB ALA 94 HB1 ALA 94 9.855 -15.014 30.920 743 2HB ALA 94 HB2 ALA 94 10.941 -16.395 30.807 744 3HB ALA 94 HB3 ALA 94 10.289 -15.668 29.343 745 HA PRO 95 HA PRO 95 12.940 -12.097 33.749 746 1HB PRO 95 HB2 PRO 95 10.323 -13.104 34.764 747 2HB PRO 95 HB1 PRO 95 11.140 -11.585 35.126 748 1HG PRO 95 HG2 PRO 95 9.158 -11.651 33.324 749 2HG PRO 95 HG1 PRO 95 10.568 -10.606 33.110 750 1HD PRO 95 HD2 PRO 95 9.800 -13.028 31.624 751 2HD PRO 95 HD1 PRO 95 10.918 -11.721 31.172 752 H VAL 96 HN VAL 96 13.872 -12.840 35.579 753 HA VAL 96 HA VAL 96 14.831 -15.449 35.559 754 HB VAL 96 HB VAL 96 14.835 -13.560 37.895 755 1HG1 VAL 96 HG11 VAL 96 15.374 -15.827 38.604 756 2HG1 VAL 96 HG12 VAL 96 16.825 -14.827 38.658 757 3HG1 VAL 96 HG13 VAL 96 16.586 -15.962 37.329 758 1HG2 VAL 96 HG21 VAL 96 16.875 -13.968 35.709 759 2HG2 VAL 96 HG22 VAL 96 17.097 -12.940 37.121 760 3HG2 VAL 96 HG23 VAL 96 15.852 -12.548 35.931 761 H THR 97 HN THR 97 12.462 -14.065 37.813 762 HA THR 97 HA THR 97 11.825 -16.802 38.554 763 HB THR 97 HB THR 97 10.965 -14.222 39.909 764 HG1 THR 97 HG1 THR 97 12.772 -14.353 40.947 765 1HG2 THR 97 HG21 THR 97 10.775 -17.115 40.804 766 2HG2 THR 97 HG22 THR 97 9.418 -16.109 40.296 767 3HG2 THR 97 HG23 THR 97 10.308 -15.711 41.765 768 H GLU 98 HN GLU 98 10.542 -17.465 36.869 769 HA GLU 98 HA GLU 98 8.011 -16.022 36.627 770 1HB GLU 98 HB2 GLU 98 9.172 -15.977 34.467 771 2HB GLU 98 HB1 GLU 98 9.349 -17.730 34.517 772 1HG GLU 98 HG2 GLU 98 6.908 -17.974 34.491 773 2HG GLU 98 HG1 GLU 98 6.732 -16.234 34.389 774 H LYS 99 HN LYS 99 6.593 -17.032 37.781 775 HA LYS 99 HA LYS 99 6.189 -19.759 37.274 776 1HB LYS 99 HB2 LYS 99 7.662 -19.804 39.264 777 2HB LYS 99 HB1 LYS 99 6.536 -18.770 40.120 778 1HG LYS 99 HG2 LYS 99 4.878 -20.541 40.144 779 2HG LYS 99 HG1 LYS 99 5.929 -21.572 39.170 780 1HD LYS 99 HD2 LYS 99 7.619 -21.513 40.949 781 2HD LYS 99 HD1 LYS 99 6.553 -20.518 41.931 782 1HE LYS 99 HE2 LYS 99 5.951 -23.318 40.970 783 2HE LYS 99 HE1 LYS 99 6.517 -22.902 42.583 784 1HZ LYS 99 HZ1 LYS 99 4.462 -21.620 42.900 785 2HZ LYS 99 HZ2 LYS 99 4.160 -23.225 42.586 786 3HZ LYS 99 HZ3 LYS 99 3.900 -22.098 41.382 787 H GLU 100 HN GLU 100 4.502 -18.893 36.155 788 HA GLU 100 HA GLU 100 2.313 -17.874 37.772 789 1HB GLU 100 HB2 GLU 100 1.762 -16.311 35.903 790 2HB GLU 100 HB1 GLU 100 3.242 -15.935 36.762 791 1HG GLU 100 HG2 GLU 100 4.503 -17.076 34.932 792 2HG GLU 100 HG1 GLU 100 2.983 -17.221 34.051 793 H LYS 101 HN LYS 101 3.252 -20.358 35.953 794 HA LYS 101 HA LYS 101 0.963 -20.635 34.312 795 1HB LYS 101 HB2 LYS 101 3.032 -21.725 33.625 796 2HB LYS 101 HB1 LYS 101 3.105 -22.607 35.128 797 1HG LYS 101 HG2 LYS 101 2.481 -24.146 33.405 798 2HG LYS 101 HG1 LYS 101 1.085 -23.892 34.434 799 1HD LYS 101 HD2 LYS 101 1.467 -22.470 31.778 800 2HD LYS 101 HD1 LYS 101 0.676 -24.024 31.915 801 1HE LYS 101 HE2 LYS 101 -1.066 -23.020 33.313 802 2HE LYS 101 HE1 LYS 101 -0.267 -21.458 33.247 803 1HZ LYS 101 HZ1 LYS 101 -0.560 -21.444 30.862 804 2HZ LYS 101 HZ2 LYS 101 -2.063 -21.585 31.613 805 3HZ LYS 101 HZ3 LYS 101 -1.347 -22.925 30.900
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